Detailed results of SPR104_R3_em_bcr3 by PSVS
Output from PDBStat
Constraints analysis
table of NOE constraints
# -------------- SUMMARY OF RESTRAINTS ---------------
# TOTAL NUMBER OF NOE RESTRAINTS : 1844
# INTRA-RESIDUE RESTRAINTS (I=J) : 468
# SEQUENTIAL RESTRAINTS (I-J)=1 : 556
# BACKBONE-BACKBONE : 242
# BACKBONE-SIDE CHAIN : 10
# SIDE CHAIN-SIDE CHAIN : 304
# MEDIUM RANGE RESTRAINTS 1<(I-J)<5 : 140
# BACKBONE-BACKBONE : 38
# BACKBONE-SIDE CHAIN : 33
# SIDE CHAIN-SIDE CHAIN : 69
# LONG RANGE RESTRAINTS (I-J)>=5 : 680
# TOTAL HYDROGEN BOND RESTRAINTS : 0
# LONG RANGE H-BOND RESTR. (I-J)>=5 : 0
# DISULFIDE RESTRAINTS : 0
# INTRA-CHAIN RESTRAINTS : 1596
# INTER-CHAIN RESTRAINTS : 248
# AMBIGUOUS RESTRAINTS : 0
# -----------------------------------------------------
# -----------------------------------------------------
# -----------------------------------------------------
# RES # INTRA INTER seq med lng InterChain
MET 1 0 1.5 1.5 0.0 0.0 0.0
LYS 2 5 3.0 3.0 0.0 0.0 0.0
LYS 3 3 3.0 3.0 0.0 0.0 0.0
MET 4 2 3.0 3.0 0.0 0.0 0.0
ALA 5 1 2.5 2.5 0.0 0.0 0.0
GLU 6 2 3.0 3.0 0.0 0.0 0.0
PHE 7 5 5.0 3.5 0.0 1.5 0.0
THR 8 3 5.5 3.0 0.0 2.5 0.0
PHE 9 2 8.5 4.0 0.0 4.5 0.0
GLU 10 2 8.0 5.0 0.0 3.0 0.0
ILE 11 11 13.5 4.5 1.0 8.0 0.0
GLU 12 4 9.5 4.5 0.0 5.0 0.0
GLU 13 4 11.5 5.0 1.5 5.0 0.0
HIS 14 2 4.5 3.5 0.0 1.0 0.0
LEU 15 7 18.5 3.0 0.5 15.0 2.5
LEU 16 0 19.5 4.0 0.0 15.5 9.5
THR 17 3 6.0 3.5 0.0 2.5 0.0
LEU 18 10 21.0 3.0 0.0 18.0 11.5
SER 19 0 4.0 3.0 0.0 1.0 0.0
GLU 20 3 8.0 4.0 0.5 3.5 0.0
ASN 21 0 6.0 4.5 0.5 1.0 0.0
GLU 22 3 3.5 3.5 0.0 0.0 0.0
LYS 23 2 2.5 2.5 0.0 0.0 0.0
GLY 24 0 3.0 1.5 0.5 1.0 0.0
TRP 25 1 12.0 2.5 0.5 9.0 0.0
THR 26 2 9.0 3.5 0.0 5.5 0.0
LYS 27 7 17.0 3.0 0.0 14.0 5.0
GLU 28 0 6.5 2.5 0.0 4.0 0.0
ILE 29 5 26.5 2.5 0.0 24.0 4.5
ASN 30 1 12.0 3.0 0.5 8.5 0.0
ARG 31 7 16.0 3.5 0.0 12.5 0.0
VAL 32 5 20.0 4.5 2.5 13.0 0.0
SER 33 0 9.5 3.5 0.0 6.0 0.0
PHE 34 2 7.5 2.5 2.0 3.0 0.0
ASN 35 1 7.5 3.0 0.0 4.5 0.0
GLY 36 0 2.5 2.5 0.0 0.0 0.0
ALA 37 1 2.5 2.5 0.0 0.0 0.0
PRO 38 0 3.5 3.5 0.0 0.0 0.0
ALA 39 1 12.5 4.0 0.0 8.5 0.0
LYS 40 5 8.0 4.5 0.0 3.5 0.0
PHE 41 4 14.5 5.0 0.0 9.5 0.5
ASP 42 0 10.0 3.0 0.0 7.0 0.0
ILE 43 8 16.5 1.5 0.0 15.0 0.5
ARG 44 0 5.0 2.5 0.0 2.5 0.5
ALA 45 1 10.0 2.5 0.0 7.5 1.0
TRP 46 1 5.0 2.5 0.0 2.5 0.0
SER 47 0 2.0 1.5 0.0 0.5 0.0
PRO 48 0 3.5 0.0 0.0 3.5 0.0
ASP 49 0 1.5 1.5 0.0 0.0 0.0
HIS 50 1 2.5 2.5 0.0 0.0 0.0
THR 51 2 3.0 3.0 0.0 0.0 0.0
LYS 52 12 8.5 4.5 0.0 4.0 0.0
MET 53 3 5.5 5.0 0.0 0.5 0.0
GLY 54 0 4.5 4.0 0.0 0.5 0.0
LYS 55 9 4.5 3.5 0.5 0.5 0.5
GLY 56 0 7.5 7.5 0.0 0.0 4.5
ILE 57 9 19.0 8.5 0.5 10.0 11.0
THR 58 3 8.5 5.0 0.0 3.5 0.0
LEU 59 7 11.5 3.5 0.0 8.0 2.0
SER 60 0 4.0 2.5 0.0 1.5 0.0
ASN 61 2 6.0 3.0 1.0 2.0 0.5
GLU 62 5 6.0 4.5 1.5 0.0 0.0
GLU 63 1 9.0 5.0 2.0 2.0 2.0
PHE 64 5 19.0 4.5 4.0 10.5 3.0
GLN 65 10 12.5 4.5 6.0 2.0 2.0
THR 66 3 12.5 4.5 3.5 4.5 4.5
MET 67 3 22.5 5.5 6.5 10.5 11.5
VAL 68 5 25.0 6.0 14.0 5.0 12.5
ASP 69 1 7.5 4.5 2.5 0.5 0.5
ALA 70 1 9.5 3.5 2.5 3.5 3.5
PHE 71 2 23.0 4.0 10.0 9.0 16.5
LYS 72 12 9.0 5.5 3.5 0.0 4.0
GLY 73 0 5.5 4.0 1.0 0.5 0.5
ASN 74 0 3.0 2.5 0.0 0.5 0.5
LEU 75 6 10.0 2.0 1.0 7.0 7.0
GLU 76 2 3.5 2.0 0.0 1.5 1.5
HIS 77 2 3.0 2.5 0.0 0.5 0.5
HIS 78 1 2.0 2.0 0.0 0.0 0.0
HIS 79 1 2.0 2.0 0.0 0.0 0.0
HIS 80 1 1.5 1.5 0.0 0.0 0.0
HIS 81 1 1.5 1.5 0.0 0.0 0.0
HIS 82 1 1.0 1.0 0.0 0.0 0.0
MET 1 0 1.5 1.5 0.0 0.0 0.0
LYS 2 5 3.0 3.0 0.0 0.0 0.0
LYS 3 3 3.0 3.0 0.0 0.0 0.0
MET 4 2 3.0 3.0 0.0 0.0 0.0
ALA 5 1 2.5 2.5 0.0 0.0 0.0
GLU 6 2 3.0 3.0 0.0 0.0 0.0
PHE 7 5 5.0 3.5 0.0 1.5 0.0
THR 8 3 5.5 3.0 0.0 2.5 0.0
PHE 9 2 8.5 4.0 0.0 4.5 0.0
GLU 10 2 8.0 5.0 0.0 3.0 0.0
ILE 11 11 13.5 4.5 1.0 8.0 0.0
GLU 12 4 9.5 4.5 0.0 5.0 0.0
GLU 13 4 11.5 5.0 1.5 5.0 0.0
HIS 14 2 4.5 3.5 0.0 1.0 0.0
LEU 15 7 18.5 3.0 0.5 15.0 2.5
LEU 16 0 19.5 4.0 0.0 15.5 9.5
THR 17 3 6.0 3.5 0.0 2.5 0.0
LEU 18 10 21.0 3.0 0.0 18.0 11.5
SER 19 0 4.0 3.0 0.0 1.0 0.0
GLU 20 3 8.0 4.0 0.5 3.5 0.0
ASN 21 0 6.0 4.5 0.5 1.0 0.0
GLU 22 3 3.5 3.5 0.0 0.0 0.0
LYS 23 2 2.5 2.5 0.0 0.0 0.0
GLY 24 0 3.0 1.5 0.5 1.0 0.0
TRP 25 1 12.0 2.5 0.5 9.0 0.0
THR 26 2 9.0 3.5 0.0 5.5 0.0
LYS 27 7 17.0 3.0 0.0 14.0 5.0
GLU 28 0 6.5 2.5 0.0 4.0 0.0
ILE 29 5 26.5 2.5 0.0 24.0 4.5
ASN 30 1 12.0 3.0 0.5 8.5 0.0
ARG 31 7 16.0 3.5 0.0 12.5 0.0
VAL 32 5 20.0 4.5 2.5 13.0 0.0
SER 33 0 9.5 3.5 0.0 6.0 0.0
PHE 34 2 7.5 2.5 2.0 3.0 0.0
ASN 35 1 7.5 3.0 0.0 4.5 0.0
GLY 36 0 2.5 2.5 0.0 0.0 0.0
ALA 37 1 2.5 2.5 0.0 0.0 0.0
PRO 38 0 3.5 3.5 0.0 0.0 0.0
ALA 39 1 12.5 4.0 0.0 8.5 0.0
LYS 40 5 8.0 4.5 0.0 3.5 0.0
PHE 41 4 14.5 5.0 0.0 9.5 0.5
ASP 42 0 10.0 3.0 0.0 7.0 0.0
ILE 43 8 16.5 1.5 0.0 15.0 0.5
ARG 44 0 5.0 2.5 0.0 2.5 0.5
ALA 45 1 10.0 2.5 0.0 7.5 1.0
TRP 46 1 5.0 2.5 0.0 2.5 0.0
SER 47 0 2.0 1.5 0.0 0.5 0.0
PRO 48 0 3.5 0.0 0.0 3.5 0.0
ASP 49 0 1.5 1.5 0.0 0.0 0.0
HIS 50 1 2.5 2.5 0.0 0.0 0.0
THR 51 2 3.0 3.0 0.0 0.0 0.0
LYS 52 12 8.5 4.5 0.0 4.0 0.0
MET 53 3 5.5 5.0 0.0 0.5 0.0
GLY 54 0 4.5 4.0 0.0 0.5 0.0
LYS 55 9 4.5 3.5 0.5 0.5 0.5
GLY 56 0 7.5 7.5 0.0 0.0 4.5
ILE 57 7 19.0 8.5 0.5 10.0 11.0
THR 58 3 8.5 5.0 0.0 3.5 0.0
LEU 59 7 11.5 3.5 0.0 8.0 2.0
SER 60 0 4.0 2.5 0.0 1.5 0.0
ASN 61 2 6.0 3.0 1.0 2.0 0.5
GLU 62 5 6.0 4.5 1.5 0.0 0.0
GLU 63 1 9.0 5.0 2.0 2.0 2.0
PHE 64 5 19.0 4.5 4.0 10.5 3.0
GLN 65 10 12.5 4.5 6.0 2.0 2.0
THR 66 3 12.5 4.5 3.5 4.5 4.5
MET 67 3 22.5 5.5 6.5 10.5 11.5
VAL 68 5 25.0 6.0 14.0 5.0 12.5
ASP 69 1 7.5 4.5 2.5 0.5 0.5
ALA 70 1 9.5 3.5 2.5 3.5 3.5
PHE 71 2 23.0 4.0 10.0 9.0 16.5
LYS 72 8 9.0 5.5 3.5 0.0 4.0
GLY 73 0 5.5 4.0 1.0 0.5 0.5
ASN 74 0 3.0 2.5 0.0 0.5 0.5
LEU 75 6 10.0 2.0 1.0 7.0 7.0
GLU 76 2 3.5 2.0 0.0 1.5 1.5
HIS 77 2 3.0 2.5 0.0 0.5 0.5
HIS 78 1 2.0 2.0 0.0 0.0 0.0
HIS 79 1 2.0 2.0 0.0 0.0 0.0
HIS 80 1 1.5 1.5 0.0 0.0 0.0
HIS 81 1 1.5 1.5 0.0 0.0 0.0
HIS 82 1 1.0 1.0 0.0 0.0 0.0
# TOTAL 468 1376.0 556.0 140.0 680.0 248.0
# TOTAL NUMBER OF RESTRAINTS (CHECKING): 1844.0
List of conformationally-resticting NOE constraints
assign ((segid A and resid 1 and name HA )) ((segid A and resid 2 and name HN )) 1.80 0.00 1.80
assign ((segid A and resid 1 and name HB* )) ((segid A and resid 2 and name HN )) 1.80 0.00 2.10
assign ((segid A and resid 1 and name HG* )) ((segid A and resid 2 and name HN )) 1.80 0.00 2.93
assign ((segid A and resid 2 and name HA )) ((segid A and resid 2 and name HG* )) 1.80 0.00 1.96
assign ((segid A and resid 2 and name HA )) ((segid A and resid 3 and name HN )) 1.80 0.00 1.57
assign ((segid A and resid 2 and name HB* )) ((segid A and resid 3 and name HN )) 1.80 0.00 2.20
assign ((segid A and resid 2 and name HB1 )) ((segid A and resid 2 and name HD* )) 1.80 0.00 1.50
assign ((segid A and resid 2 and name HB2 )) ((segid A and resid 2 and name HD* )) 1.80 0.00 1.50
assign ((segid A and resid 2 and name HG* )) ((segid A and resid 3 and name HN )) 1.80 0.00 2.91
assign ((segid A and resid 2 and name HN )) ((segid A and resid 2 and name HB* )) 1.80 0.00 1.58
assign ((segid A and resid 2 and name HN )) ((segid A and resid 2 and name HG* )) 1.80 0.00 2.50
assign ((segid A and resid 3 and name HA )) ((segid A and resid 4 and name HN )) 1.80 0.00 1.80
assign ((segid A and resid 3 and name HB* )) ((segid A and resid 3 and name HD* )) 1.80 0.00 1.33
assign ((segid A and resid 3 and name HB* )) ((segid A and resid 4 and name HN )) 1.80 0.00 2.10
assign ((segid A and resid 3 and name HG* )) ((segid A and resid 4 and name HN )) 1.80 0.00 2.80
assign ((segid A and resid 3 and name HN )) ((segid A and resid 3 and name HB* )) 1.80 0.00 1.50
assign ((segid A and resid 3 and name HN )) ((segid A and resid 3 and name HG* )) 1.80 0.00 3.00
assign ((segid A and resid 4 and name HA )) ((segid A and resid 5 and name HN )) 1.80 0.00 1.80
assign ((segid A and resid 4 and name HB* )) ((segid A and resid 5 and name HN )) 1.80 0.00 2.20
assign ((segid A and resid 4 and name HG* )) ((segid A and resid 5 and name HN )) 1.80 0.00 2.74
assign ((segid A and resid 4 and name HN )) ((segid A and resid 4 and name HB* )) 1.80 0.00 1.38
assign ((segid A and resid 4 and name HN )) ((segid A and resid 4 and name HG* )) 1.80 0.00 2.30
assign ((segid A and resid 5 and name HA )) ((segid A and resid 6 and name HN )) 1.80 0.00 1.80
assign ((segid A and resid 5 and name HB* )) ((segid A and resid 6 and name HN )) 1.80 0.00 1.80
assign ((segid A and resid 5 and name HN )) ((segid A and resid 5 and name HB* )) 1.80 0.00 1.36
assign ((segid A and resid 6 and name HA )) ((segid A and resid 7 and name HN )) 1.80 0.00 1.80
assign ((segid A and resid 6 and name HB* )) ((segid A and resid 7 and name HN )) 1.80 0.00 2.10
assign ((segid A and resid 6 and name HG1 )) ((segid A and resid 7 and name HN )) 1.80 0.00 3.80
assign ((segid A and resid 6 and name HG2 )) ((segid A and resid 7 and name HN )) 1.80 0.00 3.80
assign ((segid A and resid 6 and name HN )) ((segid A and resid 6 and name HB* )) 1.80 0.00 1.50
assign ((segid A and resid 6 and name HN )) ((segid A and resid 6 and name HG* )) 1.80 0.00 2.50
assign ((segid A and resid 7 and name HA )) ((segid A and resid 7 and name HD* )) 1.80 0.00 2.36
assign ((segid A and resid 7 and name HA )) ((segid A and resid 8 and name HN )) 1.80 0.00 2.00
assign ((segid A and resid 7 and name HA )) ((segid A and resid 35 and name HD2* )) 1.80 0.00 2.67
assign ((segid A and resid 7 and name HB* )) ((segid A and resid 8 and name HN )) 1.80 0.00 1.80
assign ((segid A and resid 7 and name HB* )) ((segid A and resid 35 and name HD2* )) 1.80 0.00 2.39
assign ((segid A and resid 7 and name HB* )) ((segid A and resid 35 and name HN )) 1.80 0.00 3.20
assign ((segid A and resid 7 and name HD* )) ((segid A and resid 7 and name HZ )) 1.80 0.00 2.40
assign ((segid A and resid 7 and name HD* )) ((segid A and resid 8 and name HN )) 1.80 0.00 3.00
assign ((segid A and resid 7 and name HE* )) ((segid A and resid 7 and name HZ )) 1.80 0.00 1.50
assign ((segid A and resid 7 and name HN )) ((segid A and resid 7 and name HB* )) 1.80 0.00 1.45
assign ((segid A and resid 7 and name HN )) ((segid A and resid 7 and name HD* )) 1.80 0.00 2.60
assign ((segid A and resid 8 and name HA )) ((segid A and resid 8 and name HG2* )) 1.80 0.00 1.50
assign ((segid A and resid 8 and name HA )) ((segid A and resid 9 and name HN )) 1.80 0.00 1.50
assign ((segid A and resid 8 and name HB )) ((segid A and resid 9 and name HN )) 1.80 0.00 2.50
assign ((segid A and resid 8 and name HG2* )) ((segid A and resid 35 and name HA )) 1.80 0.00 3.00
assign ((segid A and resid 8 and name HG2* )) ((segid A and resid 35 and name HN )) 1.80 0.00 3.00
assign ((segid A and resid 8 and name HN )) ((segid A and resid 8 and name HB )) 1.80 0.00 2.43
assign ((segid A and resid 8 and name HN )) ((segid A and resid 8 and name HG2* )) 1.80 0.00 2.30
assign ((segid A and resid 8 and name HN )) ((segid A and resid 9 and name HN )) 1.80 0.00 3.29
assign ((segid A and resid 8 and name HN )) ((segid A and resid 35 and name HA )) 1.80 0.00 2.48
assign ((segid A and resid 8 and name HN )) ((segid A and resid 35 and name HD2* )) 1.80 0.00 3.16
assign ((segid A and resid 8 and name HN )) ((segid A and resid 35 and name HN )) 1.80 0.00 2.30
assign ((segid A and resid 9 and name HA )) ((segid A and resid 9 and name HD* )) 1.80 0.00 3.14
assign ((segid A and resid 9 and name HA )) ((segid A and resid 10 and name HN )) 1.80 0.00 1.81
assign ((segid A and resid 9 and name HA )) ((segid A and resid 32 and name HG1* )) 1.80 0.00 2.63
assign ((segid A and resid 9 and name HA )) ((segid A and resid 34 and name HA )) 1.80 0.00 2.67
assign ((segid A and resid 9 and name HA )) ((segid A and resid 34 and name HD* )) 1.80 0.00 2.96
assign ((segid A and resid 9 and name HA )) ((segid A and resid 35 and name HN )) 1.80 0.00 2.62
assign ((segid A and resid 9 and name HB* )) ((segid A and resid 34 and name HA )) 1.80 0.00 3.17
assign ((segid A and resid 9 and name HB1 )) ((segid A and resid 10 and name HN )) 1.80 0.00 3.08
assign ((segid A and resid 9 and name HB1 )) ((segid A and resid 32 and name HG1* )) 1.80 0.00 2.48
assign ((segid A and resid 9 and name HB2 )) ((segid A and resid 10 and name HN )) 1.80 0.00 3.08
assign ((segid A and resid 9 and name HB2 )) ((segid A and resid 32 and name HG1* )) 1.80 0.00 2.48
assign ((segid A and resid 9 and name HD* )) ((segid A and resid 10 and name HN )) 1.80 0.00 3.23
assign ((segid A and resid 9 and name HD* )) ((segid A and resid 32 and name HG1* )) 1.80 0.00 2.52
assign ((segid A and resid 9 and name HD* )) ((segid A and resid 34 and name HE* )) 1.80 0.00 2.53
assign ((segid A and resid 9 and name HN )) ((segid A and resid 9 and name HD* )) 1.80 0.00 2.30
assign ((segid A and resid 9 and name HN )) ((segid A and resid 10 and name HN )) 1.80 0.00 3.21
assign ((segid A and resid 10 and name HA )) ((segid A and resid 10 and name HG* )) 1.80 0.00 1.73
assign ((segid A and resid 10 and name HA )) ((segid A and resid 11 and name HN )) 1.80 0.00 1.68
assign ((segid A and resid 10 and name HA )) ((segid A and resid 32 and name HG1* )) 1.80 0.00 3.07
assign ((segid A and resid 10 and name HB* )) ((segid A and resid 33 and name HN )) 1.80 0.00 3.21
assign ((segid A and resid 10 and name HB1 )) ((segid A and resid 11 and name HN )) 1.80 0.00 3.03
assign ((segid A and resid 10 and name HB2 )) ((segid A and resid 11 and name HN )) 1.80 0.00 3.03
assign ((segid A and resid 10 and name HG* )) ((segid A and resid 11 and name HN )) 1.80 0.00 2.80
assign ((segid A and resid 10 and name HN )) ((segid A and resid 10 and name HG* )) 1.80 0.00 2.62
assign ((segid A and resid 10 and name HN )) ((segid A and resid 11 and name HN )) 1.80 0.00 3.18
assign ((segid A and resid 10 and name HN )) ((segid A and resid 32 and name HG1* )) 1.80 0.00 2.08
assign ((segid A and resid 10 and name HN )) ((segid A and resid 33 and name HB* )) 1.80 0.00 3.09
assign ((segid A and resid 10 and name HN )) ((segid A and resid 33 and name HN )) 1.80 0.00 2.02
assign ((segid A and resid 10 and name HN )) ((segid A and resid 34 and name HA )) 1.80 0.00 2.74
assign ((segid A and resid 11 and name HA )) ((segid A and resid 11 and name HD1* )) 1.80 0.00 3.00
assign ((segid A and resid 11 and name HA )) ((segid A and resid 11 and name HG2* )) 1.80 0.00 1.94
assign ((segid A and resid 11 and name HA )) ((segid A and resid 12 and name HN )) 1.80 0.00 1.90
assign ((segid A and resid 11 and name HA )) ((segid A and resid 32 and name HA )) 1.80 0.00 2.72
assign ((segid A and resid 11 and name HA )) ((segid A and resid 32 and name HG1* )) 1.80 0.00 2.41
assign ((segid A and resid 11 and name HA )) ((segid A and resid 32 and name HG2* )) 1.80 0.00 2.16
assign ((segid A and resid 11 and name HA )) ((segid A and resid 33 and name HN )) 1.80 0.00 2.72
assign ((segid A and resid 11 and name HB )) ((segid A and resid 11 and name HD1* )) 1.80 0.00 1.94
assign ((segid A and resid 11 and name HD1* )) ((segid A and resid 32 and name HG1* )) 1.80 0.00 3.21
assign ((segid A and resid 11 and name HD1* )) ((segid A and resid 32 and name HG2* )) 1.80 0.00 2.77
assign ((segid A and resid 11 and name HG1* )) ((segid A and resid 12 and name HN )) 1.80 0.00 3.16
assign ((segid A and resid 11 and name HG1* )) ((segid A and resid 32 and name HG2* )) 1.80 0.00 3.21
assign ((segid A and resid 11 and name HG2* )) ((segid A and resid 11 and name HD1* )) 1.80 0.00 1.47
assign ((segid A and resid 11 and name HG2* )) ((segid A and resid 11 and name HG11 )) 1.80 0.00 2.85
assign ((segid A and resid 11 and name HG2* )) ((segid A and resid 11 and name HG12 )) 1.80 0.00 2.85
assign ((segid A and resid 11 and name HG2* )) ((segid A and resid 12 and name HN )) 1.80 0.00 2.16
assign ((segid A and resid 11 and name HG2* )) ((segid A and resid 13 and name HB* )) 1.80 0.00 3.80
assign ((segid A and resid 11 and name HG2* )) ((segid A and resid 13 and name HN )) 1.80 0.00 1.91
assign ((segid A and resid 11 and name HG2* )) ((segid A and resid 30 and name HA )) 1.80 0.00 3.16
assign ((segid A and resid 11 and name HG2* )) ((segid A and resid 30 and name HB1 )) 1.80 0.00 2.18
assign ((segid A and resid 11 and name HG2* )) ((segid A and resid 30 and name HB2 )) 1.80 0.00 2.18
assign ((segid A and resid 11 and name HG2* )) ((segid A and resid 31 and name HN )) 1.80 0.00 2.59
assign ((segid A and resid 11 and name HG2* )) ((segid A and resid 32 and name HA )) 1.80 0.00 2.99
assign ((segid A and resid 11 and name HG2* )) ((segid A and resid 32 and name HG1* )) 1.80 0.00 3.20
assign ((segid A and resid 11 and name HG2* )) ((segid A and resid 32 and name HG2* )) 1.80 0.00 1.85
assign ((segid A and resid 11 and name HN )) ((segid A and resid 11 and name HB )) 1.80 0.00 2.08
assign ((segid A and resid 11 and name HN )) ((segid A and resid 11 and name HD1* )) 1.80 0.00 2.66
assign ((segid A and resid 11 and name HN )) ((segid A and resid 11 and name HG11 )) 1.80 0.00 2.89
assign ((segid A and resid 11 and name HN )) ((segid A and resid 11 and name HG12 )) 1.80 0.00 2.89
assign ((segid A and resid 11 and name HN )) ((segid A and resid 11 and name HG2* )) 1.80 0.00 2.49
assign ((segid A and resid 11 and name HN )) ((segid A and resid 12 and name HN )) 1.80 0.00 3.36
assign ((segid A and resid 11 and name HN )) ((segid A and resid 32 and name HG1* )) 1.80 0.00 3.27
assign ((segid A and resid 11 and name HN )) ((segid A and resid 32 and name HG2* )) 1.80 0.00 3.45
assign ((segid A and resid 12 and name HA )) ((segid A and resid 12 and name HG1 )) 1.80 0.00 2.62
assign ((segid A and resid 12 and name HA )) ((segid A and resid 12 and name HG2 )) 1.80 0.00 2.62
assign ((segid A and resid 12 and name HA )) ((segid A and resid 13 and name HN )) 1.80 0.00 1.80
assign ((segid A and resid 12 and name HB* )) ((segid A and resid 13 and name HN )) 1.80 0.00 2.36
assign ((segid A and resid 12 and name HB* )) ((segid A and resid 39 and name HB* )) 1.80 0.00 2.52
assign ((segid A and resid 12 and name HG* )) ((segid A and resid 33 and name HB* )) 1.80 0.00 3.23
assign ((segid A and resid 12 and name HG1 )) ((segid A and resid 13 and name HN )) 1.80 0.00 3.29
assign ((segid A and resid 12 and name HG1 )) ((segid A and resid 39 and name HB* )) 1.80 0.00 1.94
assign ((segid A and resid 12 and name HG2 )) ((segid A and resid 13 and name HN )) 1.80 0.00 3.29
assign ((segid A and resid 12 and name HG2 )) ((segid A and resid 32 and name HA )) 1.80 0.00 3.39
assign ((segid A and resid 12 and name HG2 )) ((segid A and resid 39 and name HB* )) 1.80 0.00 2.35
assign ((segid A and resid 12 and name HN )) ((segid A and resid 12 and name HG1 )) 1.80 0.00 2.42
assign ((segid A and resid 12 and name HN )) ((segid A and resid 12 and name HG2 )) 1.80 0.00 2.42
assign ((segid A and resid 12 and name HN )) ((segid A and resid 13 and name HN )) 1.80 0.00 1.91
assign ((segid A and resid 12 and name HN )) ((segid A and resid 32 and name HA )) 1.80 0.00 2.69
assign ((segid A and resid 12 and name HN )) ((segid A and resid 32 and name HG1* )) 1.80 0.00 3.59
assign ((segid A and resid 12 and name HN )) ((segid A and resid 32 and name HG2* )) 1.80 0.00 3.30
assign ((segid A and resid 12 and name HN )) ((segid A and resid 33 and name HN )) 1.80 0.00 3.27
assign ((segid A and resid 12 and name HN )) ((segid A and resid 39 and name HB* )) 1.80 0.00 3.16
assign ((segid A and resid 13 and name HA )) ((segid A and resid 13 and name HG* )) 1.80 0.00 1.90
assign ((segid A and resid 13 and name HA )) ((segid A and resid 14 and name HN )) 1.80 0.00 1.65
assign ((segid A and resid 13 and name HB* )) ((segid A and resid 31 and name HB1 )) 1.80 0.00 4.25
assign ((segid A and resid 13 and name HB* )) ((segid A and resid 31 and name HB2 )) 1.80 0.00 3.20
assign ((segid A and resid 13 and name HB* )) ((segid A and resid 31 and name HD* )) 1.80 0.00 3.80
assign ((segid A and resid 13 and name HB* )) ((segid A and resid 31 and name HN )) 1.80 0.00 3.19
assign ((segid A and resid 13 and name HB* )) ((segid A and resid 39 and name HB* )) 1.80 0.00 3.60
assign ((segid A and resid 13 and name HB1 )) ((segid A and resid 14 and name HN )) 1.80 0.00 2.94
assign ((segid A and resid 13 and name HB2 )) ((segid A and resid 14 and name HN )) 1.80 0.00 2.94
assign ((segid A and resid 13 and name HG* )) ((segid A and resid 14 and name HN )) 1.80 0.00 2.57
assign ((segid A and resid 13 and name HG* )) ((segid A and resid 15 and name HD2* )) 1.80 0.00 3.15
assign ((segid A and resid 13 and name HG* )) ((segid A and resid 31 and name HD* )) 1.80 0.00 3.80
assign ((segid A and resid 13 and name HN )) ((segid A and resid 13 and name HB1 )) 1.80 0.00 2.49
assign ((segid A and resid 13 and name HN )) ((segid A and resid 13 and name HB2 )) 1.80 0.00 2.49
assign ((segid A and resid 13 and name HN )) ((segid A and resid 13 and name HG* )) 1.80 0.00 3.03
assign ((segid A and resid 13 and name HN )) ((segid A and resid 14 and name HN )) 1.80 0.00 3.21
assign ((segid A and resid 13 and name HN )) ((segid A and resid 30 and name HB* )) 1.80 0.00 3.14
assign ((segid A and resid 13 and name HN )) ((segid A and resid 31 and name HB* )) 1.80 0.00 3.01
assign ((segid A and resid 13 and name HN )) ((segid A and resid 31 and name HN )) 1.80 0.00 2.80
assign ((segid A and resid 13 and name HN )) ((segid A and resid 39 and name HB* )) 1.80 0.00 3.20
assign ((segid A and resid 14 and name HA )) ((segid A and resid 15 and name HN )) 1.80 0.00 2.00
assign ((segid A and resid 14 and name HA )) ((segid A and resid 30 and name HA )) 1.80 0.00 2.82
assign ((segid A and resid 14 and name HA )) ((segid A and resid 30 and name HB* )) 1.80 0.00 2.70
assign ((segid A and resid 14 and name HN )) ((segid A and resid 14 and name HB1 )) 1.80 0.00 2.29
assign ((segid A and resid 14 and name HN )) ((segid A and resid 14 and name HB2 )) 1.80 0.00 2.29
assign ((segid A and resid 14 and name HN )) ((segid A and resid 15 and name HN )) 1.80 0.00 3.68
assign ((segid A and resid 15 and name HA )) ((segid A and resid 15 and name HD2* )) 1.80 0.00 1.33
assign ((segid A and resid 15 and name HA )) ((segid A and resid 15 and name HG )) 1.80 0.00 1.91
assign ((segid A and resid 15 and name HA )) ((segid A and resid 16 and name HN )) 1.80 0.00 2.00
assign ((segid A and resid 15 and name HB* )) ((segid A and resid 15 and name HD2* )) 1.80 0.00 1.50
assign ((segid A and resid 15 and name HB* )) ((segid A and resid 29 and name HB )) 1.80 0.00 3.03
assign ((segid A and resid 15 and name HB* )) ((segid A and resid 30 and name HA )) 1.80 0.00 3.27
assign ((segid A and resid 15 and name HB1 )) ((segid A and resid 15 and name HD1* )) 1.80 0.00 1.47
assign ((segid A and resid 15 and name HB1 )) ((segid A and resid 16 and name HN )) 1.80 0.00 2.03
assign ((segid A and resid 15 and name HB2 )) ((segid A and resid 15 and name HD1* )) 1.80 0.00 1.47
assign ((segid A and resid 15 and name HB2 )) ((segid A and resid 16 and name HN )) 1.80 0.00 2.03
assign ((segid A and resid 15 and name HD1* )) ((segid A and resid 29 and name HB )) 1.80 0.00 3.80
assign ((segid A and resid 15 and name HD1* )) ((segid A and resid 29 and name HG2* )) 1.80 0.00 3.80
assign ((segid A and resid 15 and name HD1* )) ((segid A and resid 30 and name HA )) 1.80 0.00 2.80
assign ((segid A and resid 15 and name HD1* )) ((segid A and resid 30 and name HB* )) 1.80 0.00 3.30
assign ((segid A and resid 15 and name HD1* )) ((segid A and resid 31 and name HA )) 1.80 0.00 3.80
assign ((segid A and resid 15 and name HD1* )) ((segid A and resid 31 and name HG* )) 1.80 0.00 2.50
assign ((segid A and resid 15 and name HD1* )) ((segid A and resid 31 and name HN )) 1.80 0.00 3.00
assign ((segid A and resid 15 and name HD1* )) ((segid A and resid 41 and name HA )) 1.80 0.00 3.00
assign ((segid A and resid 15 and name HD1* )) ((segid A and resid 41 and name HD* )) 1.80 0.00 1.81
assign ((segid A and resid 15 and name HD1* )) ((segid A and resid 64 and name HE* )) 1.80 0.00 3.35
assign ((segid A and resid 15 and name HD1* )) ((segid A and resid 64 and name HZ )) 1.80 0.00 3.00
assign ((segid A and resid 15 and name HD2* )) ((segid A and resid 30 and name HA )) 1.80 0.00 3.10
assign ((segid A and resid 15 and name HD2* )) ((segid A and resid 31 and name HD* )) 1.80 0.00 2.24
assign ((segid A and resid 15 and name HD2* )) ((segid A and resid 31 and name HG* )) 1.80 0.00 2.01
assign ((segid A and resid 15 and name HD2* )) ((segid A and resid 41 and name HD* )) 1.80 0.00 3.00
assign ((segid A and resid 15 and name HD2* )) ((segid A and resid 64 and name HD* )) 1.80 0.00 3.80
assign ((segid A and resid 15 and name HD2* )) ((segid A and resid 64 and name HE* )) 1.80 0.00 3.00
assign ((segid A and resid 15 and name HD2* )) ((segid A and resid 64 and name HZ )) 1.80 0.00 3.00
assign ((segid A and resid 15 and name HG )) ((segid A and resid 30 and name HA )) 1.80 0.00 2.79
assign ((segid A and resid 15 and name HN )) ((segid A and resid 15 and name HD2* )) 1.80 0.00 2.82
assign ((segid A and resid 15 and name HN )) ((segid A and resid 15 and name HG )) 1.80 0.00 2.42
assign ((segid A and resid 15 and name HN )) ((segid A and resid 16 and name HN )) 1.80 0.00 1.95
assign ((segid A and resid 15 and name HN )) ((segid A and resid 29 and name HG2* )) 1.80 0.00 3.22
assign ((segid A and resid 15 and name HN )) ((segid A and resid 29 and name HN )) 1.80 0.00 3.53
assign ((segid A and resid 15 and name HN )) ((segid A and resid 30 and name HA )) 1.80 0.00 2.39
assign ((segid A and resid 15 and name HN )) ((segid A and resid 31 and name HN )) 1.80 0.00 3.11
assign ((segid A and resid 16 and name HA )) ((segid A and resid 17 and name HN )) 1.80 0.00 1.60
assign ((segid A and resid 16 and name HB* )) ((segid A and resid 17 and name HN )) 1.80 0.00 1.99
assign ((segid A and resid 16 and name HB* )) ((segid A and resid 29 and name HD1* )) 1.80 0.00 3.80
assign ((segid A and resid 16 and name HD1* )) ((segid A and resid 17 and name HN )) 1.80 0.00 3.00
assign ((segid A and resid 16 and name HD1* )) ((segid A and resid 29 and name HB )) 1.80 0.00 3.24
assign ((segid A and resid 16 and name HD1* )) ((segid A and resid 29 and name HD1* )) 1.80 0.00 2.50
assign ((segid A and resid 16 and name HD1* )) ((segid A and resid 29 and name HN )) 1.80 0.00 3.80
assign ((segid A and resid 16 and name HD2* )) ((segid A and resid 29 and name HB )) 1.80 0.00 3.10
assign ((segid A and resid 16 and name HD2* )) ((segid A and resid 29 and name HD1* )) 1.80 0.00 2.50
assign ((segid A and resid 16 and name HD2* )) ((segid A and resid 29 and name HG2* )) 1.80 0.00 3.80
assign ((segid A and resid 16 and name HD2* )) ((segid A and resid 29 and name HN )) 1.80 0.00 4.25
assign ((segid A and resid 16 and name HN )) ((segid A and resid 17 and name HN )) 1.80 0.00 3.00
assign ((segid A and resid 16 and name HN )) ((segid A and resid 29 and name HB )) 1.80 0.00 3.00
assign ((segid A and resid 16 and name HN )) ((segid A and resid 29 and name HD1* )) 1.80 0.00 3.19
assign ((segid A and resid 16 and name HN )) ((segid A and resid 29 and name HN )) 1.80 0.00 2.80
assign ((segid A and resid 16 and name HN )) ((segid A and resid 30 and name HA )) 1.80 0.00 2.77
assign ((segid A and resid 17 and name HA )) ((segid A and resid 17 and name HG2* )) 1.80 0.00 1.50
assign ((segid A and resid 17 and name HA )) ((segid A and resid 18 and name HN )) 1.80 0.00 2.00
assign ((segid A and resid 17 and name HA )) ((segid A and resid 28 and name HA )) 1.80 0.00 2.72
assign ((segid A and resid 17 and name HG2* )) ((segid A and resid 18 and name HN )) 1.80 0.00 2.22
assign ((segid A and resid 17 and name HG2* )) ((segid A and resid 26 and name HB )) 1.80 0.00 3.60
assign ((segid A and resid 17 and name HG2* )) ((segid A and resid 27 and name HN )) 1.80 0.00 3.11
assign ((segid A and resid 17 and name HG2* )) ((segid A and resid 28 and name HA )) 1.80 0.00 2.49
assign ((segid A and resid 17 and name HG2* )) ((segid A and resid 29 and name HN )) 1.80 0.00 3.38
assign ((segid A and resid 17 and name HN )) ((segid A and resid 17 and name HB )) 1.80 0.00 2.07
assign ((segid A and resid 17 and name HN )) ((segid A and resid 17 and name HG2* )) 1.80 0.00 2.57
assign ((segid A and resid 17 and name HN )) ((segid A and resid 18 and name HN )) 1.80 0.00 3.44
assign ((segid A and resid 18 and name HA )) ((segid A and resid 18 and name HD1* )) 1.80 0.00 2.62
assign ((segid A and resid 18 and name HA )) ((segid A and resid 18 and name HD2* )) 1.80 0.00 1.51
assign ((segid A and resid 18 and name HA )) ((segid A and resid 18 and name HG )) 1.80 0.00 2.27
assign ((segid A and resid 18 and name HA )) ((segid A and resid 19 and name HN )) 1.80 0.00 2.00
assign ((segid A and resid 18 and name HB* )) ((segid A and resid 19 and name HN )) 1.80 0.00 2.71
assign ((segid A and resid 18 and name HB* )) ((segid A and resid 27 and name HN )) 1.80 0.00 3.23
assign ((segid A and resid 18 and name HB1 )) ((segid A and resid 18 and name HD1* )) 1.80 0.00 1.78
assign ((segid A and resid 18 and name HB1 )) ((segid A and resid 18 and name HD2* )) 1.80 0.00 1.84
assign ((segid A and resid 18 and name HB2 )) ((segid A and resid 18 and name HD1* )) 1.80 0.00 1.78
assign ((segid A and resid 18 and name HB2 )) ((segid A and resid 18 and name HD2* )) 1.80 0.00 1.84
assign ((segid A and resid 18 and name HD1* )) ((segid A and resid 27 and name HB1 )) 1.80 0.00 3.00
assign ((segid A and resid 18 and name HD1* )) ((segid A and resid 27 and name HB2 )) 1.80 0.00 3.20
assign ((segid A and resid 18 and name HD1* )) ((segid A and resid 27 and name HE* )) 1.80 0.00 3.59
assign ((segid A and resid 18 and name HD1* )) ((segid A and resid 27 and name HG* )) 1.80 0.00 2.77
assign ((segid A and resid 18 and name HD1* )) ((segid A and resid 29 and name HD1* )) 1.80 0.00 2.31
assign ((segid A and resid 18 and name HD1* )) ((segid A and resid 43 and name HG2* )) 1.80 0.00 2.15
assign ((segid A and resid 18 and name HD2* )) ((segid A and resid 29 and name HD1* )) 1.80 0.00 1.98
assign ((segid A and resid 18 and name HD2* )) ((segid A and resid 29 and name HG1* )) 1.80 0.00 3.38
assign ((segid A and resid 18 and name HD2* )) ((segid A and resid 29 and name HG2* )) 1.80 0.00 3.52
assign ((segid A and resid 18 and name HG )) ((segid A and resid 27 and name HG* )) 1.80 0.00 3.21
assign ((segid A and resid 18 and name HG )) ((segid A and resid 29 and name HG1* )) 1.80 0.00 3.44
assign ((segid A and resid 18 and name HN )) ((segid A and resid 18 and name HD1* )) 1.80 0.00 2.89
assign ((segid A and resid 18 and name HN )) ((segid A and resid 18 and name HD2* )) 1.80 0.00 2.71
assign ((segid A and resid 18 and name HN )) ((segid A and resid 18 and name HG )) 1.80 0.00 2.69
assign ((segid A and resid 18 and name HN )) ((segid A and resid 19 and name HN )) 1.80 0.00 2.50
assign ((segid A and resid 18 and name HN )) ((segid A and resid 28 and name HA )) 1.80 0.00 3.37
assign ((segid A and resid 19 and name HA )) ((segid A and resid 20 and name HN )) 1.80 0.00 1.80
assign ((segid A and resid 19 and name HB* )) ((segid A and resid 20 and name HN )) 1.80 0.00 2.50
assign ((segid A and resid 19 and name HN )) ((segid A and resid 20 and name HN )) 1.80 0.00 3.12
assign ((segid A and resid 19 and name HN )) ((segid A and resid 27 and name HB* )) 1.80 0.00 3.20
assign ((segid A and resid 19 and name HN )) ((segid A and resid 27 and name HN )) 1.80 0.00 3.00
assign ((segid A and resid 20 and name HA )) ((segid A and resid 21 and name HN )) 1.80 0.00 1.68
assign ((segid A and resid 20 and name HA )) ((segid A and resid 26 and name HA )) 1.80 0.00 2.38
assign ((segid A and resid 20 and name HA )) ((segid A and resid 26 and name HG2* )) 1.80 0.00 1.99
assign ((segid A and resid 20 and name HA )) ((segid A and resid 27 and name HN )) 1.80 0.00 2.74
assign ((segid A and resid 20 and name HB1 )) ((segid A and resid 21 and name HN )) 1.80 0.00 2.95
assign ((segid A and resid 20 and name HB1 )) ((segid A and resid 26 and name HG2* )) 1.80 0.00 2.70
assign ((segid A and resid 20 and name HB2 )) ((segid A and resid 21 and name HN )) 1.80 0.00 2.95
assign ((segid A and resid 20 and name HB2 )) ((segid A and resid 26 and name HG2* )) 1.80 0.00 3.00
assign ((segid A and resid 20 and name HG* )) ((segid A and resid 21 and name HN )) 1.80 0.00 2.02
assign ((segid A and resid 20 and name HG* )) ((segid A and resid 24 and name HN )) 1.80 0.00 3.00
assign ((segid A and resid 20 and name HG* )) ((segid A and resid 25 and name HN )) 1.80 0.00 3.30
assign ((segid A and resid 20 and name HG* )) ((segid A and resid 26 and name HG2* )) 1.80 0.00 3.00
assign ((segid A and resid 20 and name HN )) ((segid A and resid 20 and name HB1 )) 1.80 0.00 2.07
assign ((segid A and resid 20 and name HN )) ((segid A and resid 20 and name HB2 )) 1.80 0.00 2.07
assign ((segid A and resid 20 and name HN )) ((segid A and resid 20 and name HG* )) 1.80 0.00 2.79
assign ((segid A and resid 20 and name HN )) ((segid A and resid 21 and name HN )) 1.80 0.00 3.18
assign ((segid A and resid 21 and name HA )) ((segid A and resid 22 and name HN )) 1.80 0.00 1.56
assign ((segid A and resid 21 and name HB1 )) ((segid A and resid 22 and name HN )) 1.80 0.00 2.61
assign ((segid A and resid 21 and name HB2 )) ((segid A and resid 22 and name HN )) 1.80 0.00 2.61
assign ((segid A and resid 21 and name HN )) ((segid A and resid 22 and name HN )) 1.80 0.00 3.27
assign ((segid A and resid 21 and name HN )) ((segid A and resid 25 and name HN )) 1.80 0.00 2.55
assign ((segid A and resid 21 and name HN )) ((segid A and resid 26 and name HA )) 1.80 0.00 2.72
assign ((segid A and resid 21 and name HN )) ((segid A and resid 26 and name HG2* )) 1.80 0.00 3.00
assign ((segid A and resid 22 and name HA )) ((segid A and resid 22 and name HG* )) 1.80 0.00 2.03
assign ((segid A and resid 22 and name HB* )) ((segid A and resid 23 and name HN )) 1.80 0.00 2.47
assign ((segid A and resid 22 and name HG* )) ((segid A and resid 23 and name HN )) 1.80 0.00 3.20
assign ((segid A and resid 22 and name HN )) ((segid A and resid 22 and name HB* )) 1.80 0.00 1.80
assign ((segid A and resid 22 and name HN )) ((segid A and resid 22 and name HG* )) 1.80 0.00 2.50
assign ((segid A and resid 22 and name HN )) ((segid A and resid 23 and name HN )) 1.80 0.00 3.00
assign ((segid A and resid 23 and name HB* )) ((segid A and resid 24 and name HN )) 1.80 0.00 2.23
assign ((segid A and resid 23 and name HN )) ((segid A and resid 23 and name HB1 )) 1.80 0.00 2.46
assign ((segid A and resid 23 and name HN )) ((segid A and resid 23 and name HB2 )) 1.80 0.00 2.46
assign ((segid A and resid 23 and name HN )) ((segid A and resid 24 and name HN )) 1.80 0.00 2.50
assign ((segid A and resid 24 and name HA1 )) ((segid A and resid 48 and name HG* )) 1.80 0.00 3.48
assign ((segid A and resid 24 and name HA2 )) ((segid A and resid 48 and name HG* )) 1.80 0.00 4.25
assign ((segid A and resid 24 and name HN )) ((segid A and resid 25 and name HN )) 1.80 0.00 1.59
assign ((segid A and resid 25 and name HA )) ((segid A and resid 26 and name HN )) 1.80 0.00 1.51
assign ((segid A and resid 25 and name HA )) ((segid A and resid 48 and name HD* )) 1.80 0.00 4.13
assign ((segid A and resid 25 and name HB* )) ((segid A and resid 45 and name HB* )) 1.80 0.00 2.59
assign ((segid A and resid 25 and name HB1 )) ((segid A and resid 26 and name HN )) 1.80 0.00 2.90
assign ((segid A and resid 25 and name HB2 )) ((segid A and resid 26 and name HN )) 1.80 0.00 2.90
assign ((segid A and resid 25 and name HE1 )) ((segid A and resid 47 and name HB* )) 1.80 0.00 4.25
assign ((segid A and resid 25 and name HE1 )) ((segid A and resid 48 and name HD1 )) 1.80 0.00 2.72
assign ((segid A and resid 25 and name HE1 )) ((segid A and resid 48 and name HD2 )) 1.80 0.00 2.72
assign ((segid A and resid 25 and name HE1 )) ((segid A and resid 48 and name HG2 )) 1.80 0.00 3.49
assign ((segid A and resid 25 and name HE1 )) ((segid A and resid 52 and name HE* )) 1.80 0.00 3.67
assign ((segid A and resid 25 and name HH2 )) ((segid A and resid 52 and name HB1 )) 1.80 0.00 3.77
assign ((segid A and resid 25 and name HH2 )) ((segid A and resid 52 and name HB2 )) 1.80 0.00 3.77
assign ((segid A and resid 25 and name HH2 )) ((segid A and resid 52 and name HD* )) 1.80 0.00 2.78
assign ((segid A and resid 25 and name HH2 )) ((segid A and resid 52 and name HG* )) 1.80 0.00 3.80
assign ((segid A and resid 25 and name HH2 )) ((segid A and resid 53 and name HN )) 1.80 0.00 3.41
assign ((segid A and resid 25 and name HN )) ((segid A and resid 25 and name HD1 )) 1.80 0.00 1.86
assign ((segid A and resid 25 and name HN )) ((segid A and resid 26 and name HN )) 1.80 0.00 3.41
assign ((segid A and resid 25 and name HN )) ((segid A and resid 48 and name HD* )) 1.80 0.00 3.29
assign ((segid A and resid 25 and name HZ2 )) ((segid A and resid 52 and name HD1 )) 1.80 0.00 2.63
assign ((segid A and resid 25 and name HZ2 )) ((segid A and resid 52 and name HD2 )) 1.80 0.00 2.63
assign ((segid A and resid 25 and name HZ2 )) ((segid A and resid 52 and name HG* )) 1.80 0.00 2.96
assign ((segid A and resid 25 and name HZ3 )) ((segid A and resid 45 and name HB* )) 1.80 0.00 2.90
assign ((segid A and resid 26 and name HA )) ((segid A and resid 26 and name HG2* )) 1.80 0.00 1.68
assign ((segid A and resid 26 and name HA )) ((segid A and resid 27 and name HN )) 1.80 0.00 1.81
assign ((segid A and resid 26 and name HB )) ((segid A and resid 27 and name HN )) 1.80 0.00 2.51
assign ((segid A and resid 26 and name HG2* )) ((segid A and resid 27 and name HN )) 1.80 0.00 3.03
assign ((segid A and resid 26 and name HN )) ((segid A and resid 26 and name HG2* )) 1.80 0.00 2.10
assign ((segid A and resid 26 and name HN )) ((segid A and resid 45 and name HB* )) 1.80 0.00 3.05
assign ((segid A and resid 26 and name HN )) ((segid A and resid 46 and name HB* )) 1.80 0.00 3.80
assign ((segid A and resid 26 and name HN )) ((segid A and resid 46 and name HN )) 1.80 0.00 2.47
assign ((segid A and resid 27 and name HA )) ((segid A and resid 27 and name HE* )) 1.80 0.00 3.42
assign ((segid A and resid 27 and name HA )) ((segid A and resid 28 and name HN )) 1.80 0.00 2.12
assign ((segid A and resid 27 and name HA )) ((segid A and resid 45 and name HA )) 1.80 0.00 2.61
assign ((segid A and resid 27 and name HA )) ((segid A and resid 45 and name HB* )) 1.80 0.00 2.26
assign ((segid A and resid 27 and name HA )) ((segid A and resid 46 and name HN )) 1.80 0.00 2.95
assign ((segid A and resid 27 and name HB* )) ((segid A and resid 27 and name HD* )) 1.80 0.00 1.71
assign ((segid A and resid 27 and name HB* )) ((segid A and resid 27 and name HE* )) 1.80 0.00 1.57
assign ((segid A and resid 27 and name HB* )) ((segid A and resid 28 and name HN )) 1.80 0.00 2.72
assign ((segid A and resid 27 and name HE* )) ((segid A and resid 45 and name HB* )) 1.80 0.00 3.20
assign ((segid A and resid 27 and name HG* )) ((segid A and resid 27 and name HE* )) 1.80 0.00 1.50
assign ((segid A and resid 27 and name HG* )) ((segid A and resid 28 and name HN )) 1.80 0.00 2.57
assign ((segid A and resid 27 and name HG* )) ((segid A and resid 44 and name HA )) 1.80 0.00 3.33
assign ((segid A and resid 27 and name HG* )) ((segid A and resid 45 and name HB* )) 1.80 0.00 3.20
assign ((segid A and resid 27 and name HG1 )) ((segid A and resid 45 and name HA )) 1.80 0.00 3.80
assign ((segid A and resid 27 and name HG2 )) ((segid A and resid 45 and name HA )) 1.80 0.00 3.80
assign ((segid A and resid 27 and name HN )) ((segid A and resid 27 and name HB* )) 1.80 0.00 1.86
assign ((segid A and resid 27 and name HN )) ((segid A and resid 27 and name HE* )) 1.80 0.00 4.25
assign ((segid A and resid 27 and name HN )) ((segid A and resid 27 and name HG* )) 1.80 0.00 2.95
assign ((segid A and resid 28 and name HA )) ((segid A and resid 29 and name HN )) 1.80 0.00 2.12
assign ((segid A and resid 28 and name HB* )) ((segid A and resid 46 and name HD1 )) 1.80 0.00 4.25
assign ((segid A and resid 28 and name HN )) ((segid A and resid 29 and name HN )) 1.80 0.00 3.41
assign ((segid A and resid 28 and name HN )) ((segid A and resid 44 and name HN )) 1.80 0.00 2.88
assign ((segid A and resid 28 and name HN )) ((segid A and resid 45 and name HA )) 1.80 0.00 2.74
assign ((segid A and resid 28 and name HN )) ((segid A and resid 45 and name HB* )) 1.80 0.00 3.21
assign ((segid A and resid 28 and name HN )) ((segid A and resid 46 and name HD1 )) 1.80 0.00 3.25
assign ((segid A and resid 29 and name HA )) ((segid A and resid 29 and name HD1* )) 1.80 0.00 2.72
assign ((segid A and resid 29 and name HA )) ((segid A and resid 29 and name HG2* )) 1.80 0.00 1.78
assign ((segid A and resid 29 and name HA )) ((segid A and resid 30 and name HN )) 1.80 0.00 1.80
assign ((segid A and resid 29 and name HA )) ((segid A and resid 43 and name HA )) 1.80 0.00 3.40
assign ((segid A and resid 29 and name HA )) ((segid A and resid 43 and name HG2* )) 1.80 0.00 2.48
assign ((segid A and resid 29 and name HA )) ((segid A and resid 44 and name HN )) 1.80 0.00 2.93
assign ((segid A and resid 29 and name HB )) ((segid A and resid 29 and name HD1* )) 1.80 0.00 1.38
assign ((segid A and resid 29 and name HD1* )) ((segid A and resid 64 and name HE* )) 1.80 0.00 3.01
assign ((segid A and resid 29 and name HD1* )) ((segid A and resid 64 and name HZ )) 1.80 0.00 3.19
assign ((segid A and resid 29 and name HD1* )) ((segid A and resid 67 and name HE* )) 1.80 0.00 2.89
assign ((segid A and resid 29 and name HG1* )) ((segid A and resid 30 and name HN )) 1.80 0.00 3.29
assign ((segid A and resid 29 and name HG1* )) ((segid A and resid 43 and name HA )) 1.80 0.00 3.73
assign ((segid A and resid 29 and name HG1* )) ((segid A and resid 43 and name HG2* )) 1.80 0.00 2.50
assign ((segid A and resid 29 and name HG2* )) ((segid A and resid 29 and name HD1* )) 1.80 0.00 1.50
assign ((segid A and resid 29 and name HG2* )) ((segid A and resid 30 and name HN )) 1.80 0.00 2.03
assign ((segid A and resid 29 and name HG2* )) ((segid A and resid 41 and name HA )) 1.80 0.00 3.08
assign ((segid A and resid 29 and name HG2* )) ((segid A and resid 41 and name HB* )) 1.80 0.00 2.74
assign ((segid A and resid 29 and name HG2* )) ((segid A and resid 42 and name HN )) 1.80 0.00 2.29
assign ((segid A and resid 29 and name HG2* )) ((segid A and resid 43 and name HA )) 1.80 0.00 2.43
assign ((segid A and resid 29 and name HG2* )) ((segid A and resid 43 and name HG1* )) 1.80 0.00 2.50
assign ((segid A and resid 29 and name HG2* )) ((segid A and resid 44 and name HN )) 1.80 0.00 3.27
assign ((segid A and resid 29 and name HG2* )) ((segid A and resid 64 and name HD* )) 1.80 0.00 3.63
assign ((segid A and resid 29 and name HG2* )) ((segid A and resid 64 and name HE* )) 1.80 0.00 2.71
assign ((segid A and resid 29 and name HG2* )) ((segid A and resid 64 and name HZ )) 1.80 0.00 1.63
assign ((segid A and resid 29 and name HN )) ((segid A and resid 29 and name HD1* )) 1.80 0.00 2.91
assign ((segid A and resid 30 and name HA )) ((segid A and resid 31 and name HN )) 1.80 0.00 1.80
assign ((segid A and resid 30 and name HB* )) ((segid A and resid 30 and name HD2* )) 1.80 0.00 1.53
assign ((segid A and resid 30 and name HB* )) ((segid A and resid 31 and name HN )) 1.80 0.00 2.04
assign ((segid A and resid 30 and name HB* )) ((segid A and resid 32 and name HG2* )) 1.80 0.00 3.26
assign ((segid A and resid 30 and name HN )) ((segid A and resid 31 and name HN )) 1.80 0.00 3.20
assign ((segid A and resid 30 and name HN )) ((segid A and resid 41 and name HA )) 1.80 0.00 4.03
assign ((segid A and resid 30 and name HN )) ((segid A and resid 42 and name HN )) 1.80 0.00 2.82
assign ((segid A and resid 30 and name HN )) ((segid A and resid 43 and name HA )) 1.80 0.00 3.48
assign ((segid A and resid 30 and name HN )) ((segid A and resid 43 and name HG2* )) 1.80 0.00 3.68
assign ((segid A and resid 31 and name HA )) ((segid A and resid 32 and name HN )) 1.80 0.00 1.85
assign ((segid A and resid 31 and name HA )) ((segid A and resid 41 and name HA )) 1.80 0.00 2.71
assign ((segid A and resid 31 and name HA )) ((segid A and resid 42 and name HN )) 1.80 0.00 2.71
assign ((segid A and resid 31 and name HB* )) ((segid A and resid 31 and name HD* )) 1.80 0.00 1.59
assign ((segid A and resid 31 and name HB* )) ((segid A and resid 39 and name HB* )) 1.80 0.00 2.27
assign ((segid A and resid 31 and name HB1 )) ((segid A and resid 31 and name HD1 )) 1.80 0.00 2.59
assign ((segid A and resid 31 and name HB1 )) ((segid A and resid 31 and name HD2 )) 1.80 0.00 2.59
assign ((segid A and resid 31 and name HB1 )) ((segid A and resid 32 and name HN )) 1.80 0.00 2.96
assign ((segid A and resid 31 and name HB2 )) ((segid A and resid 31 and name HD1 )) 1.80 0.00 2.59
assign ((segid A and resid 31 and name HB2 )) ((segid A and resid 31 and name HD2 )) 1.80 0.00 2.59
assign ((segid A and resid 31 and name HB2 )) ((segid A and resid 32 and name HN )) 1.80 0.00 2.96
assign ((segid A and resid 31 and name HD* )) ((segid A and resid 31 and name HH2* )) 1.80 0.00 3.20
assign ((segid A and resid 31 and name HD* )) ((segid A and resid 39 and name HB* )) 1.80 0.00 2.92
assign ((segid A and resid 31 and name HD* )) ((segid A and resid 41 and name HA )) 1.80 0.00 3.62
assign ((segid A and resid 31 and name HD* )) ((segid A and resid 41 and name HD* )) 1.80 0.00 3.20
assign ((segid A and resid 31 and name HE )) ((segid A and resid 39 and name HB* )) 1.80 0.00 2.94
assign ((segid A and resid 31 and name HG* )) ((segid A and resid 32 and name HN )) 1.80 0.00 3.26
assign ((segid A and resid 31 and name HG* )) ((segid A and resid 41 and name HA )) 1.80 0.00 2.47
assign ((segid A and resid 31 and name HG* )) ((segid A and resid 41 and name HD* )) 1.80 0.00 3.38
assign ((segid A and resid 31 and name HG* )) ((segid A and resid 42 and name HN )) 1.80 0.00 3.37
assign ((segid A and resid 31 and name HH2* )) ((segid A and resid 39 and name HB* )) 1.80 0.00 2.42
assign ((segid A and resid 31 and name HN )) ((segid A and resid 31 and name HG* )) 1.80 0.00 2.24
assign ((segid A and resid 32 and name HA )) ((segid A and resid 32 and name HG1* )) 1.80 0.00 1.81
assign ((segid A and resid 32 and name HA )) ((segid A and resid 32 and name HG2* )) 1.80 0.00 2.03
assign ((segid A and resid 32 and name HA )) ((segid A and resid 33 and name HN )) 1.80 0.00 2.09
assign ((segid A and resid 32 and name HB )) ((segid A and resid 33 and name HN )) 1.80 0.00 3.29
assign ((segid A and resid 32 and name HB )) ((segid A and resid 34 and name HZ )) 1.80 0.00 3.00
assign ((segid A and resid 32 and name HG1* )) ((segid A and resid 33 and name HN )) 1.80 0.00 2.07
assign ((segid A and resid 32 and name HG1* )) ((segid A and resid 34 and name HD* )) 1.80 0.00 2.59
assign ((segid A and resid 32 and name HG1* )) ((segid A and resid 34 and name HZ )) 1.80 0.00 2.26
assign ((segid A and resid 32 and name HG2* )) ((segid A and resid 33 and name HN )) 1.80 0.00 3.05
assign ((segid A and resid 32 and name HG2* )) ((segid A and resid 34 and name HZ )) 1.80 0.00 2.80
assign ((segid A and resid 32 and name HG2* )) ((segid A and resid 42 and name HB* )) 1.80 0.00 2.15
assign ((segid A and resid 32 and name HN )) ((segid A and resid 32 and name HB )) 1.80 0.00 2.38
assign ((segid A and resid 32 and name HN )) ((segid A and resid 32 and name HG1* )) 1.80 0.00 2.67
assign ((segid A and resid 32 and name HN )) ((segid A and resid 32 and name HG2* )) 1.80 0.00 2.01
assign ((segid A and resid 32 and name HN )) ((segid A and resid 33 and name HN )) 1.80 0.00 3.33
assign ((segid A and resid 32 and name HN )) ((segid A and resid 39 and name HA )) 1.80 0.00 3.42
assign ((segid A and resid 32 and name HN )) ((segid A and resid 39 and name HB* )) 1.80 0.00 2.41
assign ((segid A and resid 32 and name HN )) ((segid A and resid 40 and name HN )) 1.80 0.00 2.42
assign ((segid A and resid 32 and name HN )) ((segid A and resid 42 and name HB* )) 1.80 0.00 2.86
assign ((segid A and resid 33 and name HA )) ((segid A and resid 34 and name HN )) 1.80 0.00 1.80
assign ((segid A and resid 33 and name HA )) ((segid A and resid 39 and name HA )) 1.80 0.00 2.61
assign ((segid A and resid 33 and name HA )) ((segid A and resid 39 and name HB* )) 1.80 0.00 2.50
assign ((segid A and resid 33 and name HA )) ((segid A and resid 39 and name HN )) 1.80 0.00 3.11
assign ((segid A and resid 33 and name HA )) ((segid A and resid 40 and name HN )) 1.80 0.00 2.80
assign ((segid A and resid 33 and name HB* )) ((segid A and resid 39 and name HB* )) 1.80 0.00 2.02
assign ((segid A and resid 33 and name HN )) ((segid A and resid 34 and name HN )) 1.80 0.00 3.39
assign ((segid A and resid 33 and name HN )) ((segid A and resid 39 and name HB* )) 1.80 0.00 3.49
assign ((segid A and resid 34 and name HA )) ((segid A and resid 34 and name HD* )) 1.80 0.00 2.55
assign ((segid A and resid 34 and name HA )) ((segid A and resid 35 and name HN )) 1.80 0.00 1.79
assign ((segid A and resid 34 and name HB* )) ((segid A and resid 35 and name HN )) 1.80 0.00 2.50
assign ((segid A and resid 34 and name HD* )) ((segid A and resid 35 and name HN )) 1.80 0.00 3.27
assign ((segid A and resid 34 and name HN )) ((segid A and resid 34 and name HD* )) 1.80 0.00 2.83
assign ((segid A and resid 34 and name HZ )) ((segid A and resid 58 and name HG2* )) 1.80 0.00 3.00
assign ((segid A and resid 35 and name HA )) ((segid A and resid 36 and name HN )) 1.80 0.00 1.80
assign ((segid A and resid 35 and name HB* )) ((segid A and resid 35 and name HD2* )) 1.80 0.00 1.53
assign ((segid A and resid 35 and name HB* )) ((segid A and resid 36 and name HN )) 1.80 0.00 2.20
assign ((segid A and resid 35 and name HN )) ((segid A and resid 36 and name HN )) 1.80 0.00 2.80
assign ((segid A and resid 36 and name HA* )) ((segid A and resid 37 and name HN )) 1.80 0.00 1.60
assign ((segid A and resid 36 and name HN )) ((segid A and resid 37 and name HN )) 1.80 0.00 3.00
assign ((segid A and resid 37 and name HA )) ((segid A and resid 38 and name HD* )) 1.80 0.00 1.54
assign ((segid A and resid 37 and name HB* )) ((segid A and resid 38 and name HD* )) 1.80 0.00 3.20
assign ((segid A and resid 37 and name HB* )) ((segid A and resid 38 and name HG* )) 1.80 0.00 3.20
assign ((segid A and resid 37 and name HN )) ((segid A and resid 37 and name HB* )) 1.80 0.00 1.50
assign ((segid A and resid 38 and name HA )) ((segid A and resid 39 and name HB* )) 1.80 0.00 2.71
assign ((segid A and resid 38 and name HA )) ((segid A and resid 39 and name HN )) 1.80 0.00 2.00
assign ((segid A and resid 38 and name HB* )) ((segid A and resid 39 and name HN )) 1.80 0.00 2.18
assign ((segid A and resid 38 and name HG* )) ((segid A and resid 39 and name HN )) 1.80 0.00 3.58
assign ((segid A and resid 39 and name HA )) ((segid A and resid 40 and name HB* )) 1.80 0.00 3.27
assign ((segid A and resid 39 and name HA )) ((segid A and resid 40 and name HN )) 1.80 0.00 1.87
assign ((segid A and resid 39 and name HB* )) ((segid A and resid 40 and name HN )) 1.80 0.00 1.91
assign ((segid A and resid 39 and name HN )) ((segid A and resid 39 and name HB* )) 1.80 0.00 1.43
assign ((segid A and resid 39 and name HN )) ((segid A and resid 40 and name HN )) 1.80 0.00 3.22
assign ((segid A and resid 40 and name HA )) ((segid A and resid 40 and name HD* )) 1.80 0.00 2.80
assign ((segid A and resid 40 and name HA )) ((segid A and resid 41 and name HN )) 1.80 0.00 1.67
assign ((segid A and resid 40 and name HB* )) ((segid A and resid 40 and name HE* )) 1.80 0.00 2.39
assign ((segid A and resid 40 and name HB* )) ((segid A and resid 41 and name HN )) 1.80 0.00 2.08
assign ((segid A and resid 40 and name HD* )) ((segid A and resid 41 and name HN )) 1.80 0.00 3.30
assign ((segid A and resid 40 and name HD* )) ((segid A and resid 60 and name HA )) 1.80 0.00 3.49
assign ((segid A and resid 40 and name HD* )) ((segid A and resid 61 and name HN )) 1.80 0.00 3.47
assign ((segid A and resid 40 and name HE* )) ((segid A and resid 60 and name HA )) 1.80 0.00 3.00
assign ((segid A and resid 40 and name HE* )) ((segid A and resid 61 and name HN )) 1.80 0.00 3.00
assign ((segid A and resid 40 and name HG* )) ((segid A and resid 40 and name HE* )) 1.80 0.00 1.57
assign ((segid A and resid 40 and name HG* )) ((segid A and resid 60 and name HA )) 1.80 0.00 2.97
assign ((segid A and resid 40 and name HG1 )) ((segid A and resid 41 and name HN )) 1.80 0.00 3.48
assign ((segid A and resid 40 and name HG2 )) ((segid A and resid 41 and name HN )) 1.80 0.00 3.48
assign ((segid A and resid 40 and name HN )) ((segid A and resid 40 and name HB* )) 1.80 0.00 2.12
assign ((segid A and resid 40 and name HN )) ((segid A and resid 40 and name HD* )) 1.80 0.00 3.15
assign ((segid A and resid 41 and name HA )) ((segid A and resid 41 and name HD* )) 1.80 0.00 2.89
assign ((segid A and resid 41 and name HA )) ((segid A and resid 42 and name HN )) 1.80 0.00 1.92
assign ((segid A and resid 41 and name HB* )) ((segid A and resid 59 and name HN )) 1.80 0.00 3.78
assign ((segid A and resid 41 and name HB* )) ((segid A and resid 64 and name HZ )) 1.80 0.00 3.60
assign ((segid A and resid 41 and name HB1 )) ((segid A and resid 42 and name HN )) 1.80 0.00 3.13
assign ((segid A and resid 41 and name HB1 )) ((segid A and resid 59 and name HD1* )) 1.80 0.00 3.20
assign ((segid A and resid 41 and name HB2 )) ((segid A and resid 42 and name HN )) 1.80 0.00 3.13
assign ((segid A and resid 41 and name HB2 )) ((segid A and resid 59 and name HD1* )) 1.80 0.00 3.90
assign ((segid A and resid 41 and name HD* )) ((segid A and resid 42 and name HN )) 1.80 0.00 3.07
assign ((segid A and resid 41 and name HD* )) ((segid A and resid 61 and name HA )) 1.80 0.00 2.60
assign ((segid A and resid 41 and name HD* )) ((segid A and resid 64 and name HA )) 1.80 0.00 3.76
assign ((segid A and resid 41 and name HN )) ((segid A and resid 41 and name HB1 )) 1.80 0.00 2.41
assign ((segid A and resid 41 and name HN )) ((segid A and resid 41 and name HB2 )) 1.80 0.00 2.41
assign ((segid A and resid 41 and name HN )) ((segid A and resid 41 and name HD* )) 1.80 0.00 2.22
assign ((segid A and resid 41 and name HN )) ((segid A and resid 42 and name HN )) 1.80 0.00 3.27
assign ((segid A and resid 41 and name HN )) ((segid A and resid 59 and name HN )) 1.80 0.00 3.84
assign ((segid A and resid 42 and name HA )) ((segid A and resid 43 and name HN )) 1.80 0.00 1.95
assign ((segid A and resid 42 and name HA )) ((segid A and resid 57 and name HG2* )) 1.80 0.00 3.46
assign ((segid A and resid 42 and name HA )) ((segid A and resid 58 and name HA )) 1.80 0.00 2.63
assign ((segid A and resid 42 and name HA )) ((segid A and resid 58 and name HG2* )) 1.80 0.00 2.35
assign ((segid A and resid 42 and name HA )) ((segid A and resid 59 and name HD1* )) 1.80 0.00 3.56
assign ((segid A and resid 42 and name HA )) ((segid A and resid 59 and name HG )) 1.80 0.00 3.71
assign ((segid A and resid 42 and name HA )) ((segid A and resid 59 and name HN )) 1.80 0.00 3.13
assign ((segid A and resid 42 and name HB* )) ((segid A and resid 59 and name HN )) 1.80 0.00 4.07
assign ((segid A and resid 42 and name HN )) ((segid A and resid 58 and name HA )) 1.80 0.00 4.25
assign ((segid A and resid 43 and name HA )) ((segid A and resid 43 and name HD1* )) 1.80 0.00 2.51
assign ((segid A and resid 43 and name HA )) ((segid A and resid 43 and name HG2* )) 1.80 0.00 1.83
assign ((segid A and resid 43 and name HA )) ((segid A and resid 44 and name HN )) 1.80 0.00 1.80
assign ((segid A and resid 43 and name HA )) ((segid A and resid 57 and name HG2* )) 1.80 0.00 3.71
assign ((segid A and resid 43 and name HB )) ((segid A and resid 43 and name HD1* )) 1.80 0.00 1.67
assign ((segid A and resid 43 and name HB )) ((segid A and resid 57 and name HG2* )) 1.80 0.00 1.83
assign ((segid A and resid 43 and name HB )) ((segid A and resid 57 and name HN )) 1.80 0.00 2.88
assign ((segid A and resid 43 and name HD1* )) ((segid A and resid 57 and name HG2* )) 1.80 0.00 2.50
assign ((segid A and resid 43 and name HD1* )) ((segid A and resid 58 and name HA )) 1.80 0.00 4.25
assign ((segid A and resid 43 and name HD1* )) ((segid A and resid 59 and name HD2* )) 1.80 0.00 3.03
assign ((segid A and resid 43 and name HD1* )) ((segid A and resid 64 and name HD* )) 1.80 0.00 3.80
assign ((segid A and resid 43 and name HD1* )) ((segid A and resid 64 and name HE* )) 1.80 0.00 2.69
assign ((segid A and resid 43 and name HD1* )) ((segid A and resid 67 and name HE* )) 1.80 0.00 2.45
assign ((segid A and resid 43 and name HG1* )) ((segid A and resid 57 and name HG2* )) 1.80 0.00 2.01
assign ((segid A and resid 43 and name HG1* )) ((segid A and resid 57 and name HN )) 1.80 0.00 3.79
assign ((segid A and resid 43 and name HG2* )) ((segid A and resid 43 and name HG1* )) 1.80 0.00 1.59
assign ((segid A and resid 43 and name HG2* )) ((segid A and resid 44 and name HN )) 1.80 0.00 2.25
assign ((segid A and resid 43 and name HG2* )) ((segid A and resid 57 and name HN )) 1.80 0.00 4.25
assign ((segid A and resid 43 and name HG2* )) ((segid A and resid 64 and name HE* )) 1.80 0.00 4.25
assign ((segid A and resid 43 and name HN )) ((segid A and resid 43 and name HD1* )) 1.80 0.00 2.60
assign ((segid A and resid 43 and name HN )) ((segid A and resid 43 and name HG11 )) 1.80 0.00 2.92
assign ((segid A and resid 43 and name HN )) ((segid A and resid 43 and name HG12 )) 1.80 0.00 2.92
assign ((segid A and resid 43 and name HN )) ((segid A and resid 43 and name HG2* )) 1.80 0.00 2.57
assign ((segid A and resid 43 and name HN )) ((segid A and resid 57 and name HG2* )) 1.80 0.00 2.02
assign ((segid A and resid 43 and name HN )) ((segid A and resid 57 and name HN )) 1.80 0.00 2.53
assign ((segid A and resid 43 and name HN )) ((segid A and resid 58 and name HA )) 1.80 0.00 2.82
assign ((segid A and resid 43 and name HN )) ((segid A and resid 58 and name HG2* )) 1.80 0.00 3.49
assign ((segid A and resid 43 and name HN )) ((segid A and resid 59 and name HD1* )) 1.80 0.00 3.55
assign ((segid A and resid 43 and name HN )) ((segid A and resid 59 and name HG )) 1.80 0.00 3.81
assign ((segid A and resid 43 and name HN )) ((segid A and resid 59 and name HN )) 1.80 0.00 3.79
assign ((segid A and resid 44 and name HA )) ((segid A and resid 45 and name HN )) 1.80 0.00 2.00
assign ((segid A and resid 44 and name HB* )) ((segid A and resid 45 and name HN )) 1.80 0.00 2.00
assign ((segid A and resid 44 and name HN )) ((segid A and resid 45 and name HN )) 1.80 0.00 3.60
assign ((segid A and resid 45 and name HA )) ((segid A and resid 46 and name HN )) 1.80 0.00 2.10
assign ((segid A and resid 45 and name HB* )) ((segid A and resid 46 and name HN )) 1.80 0.00 1.89
assign ((segid A and resid 45 and name HB* )) ((segid A and resid 54 and name HA* )) 1.80 0.00 2.50
assign ((segid A and resid 45 and name HB* )) ((segid A and resid 55 and name HN )) 1.80 0.00 4.25
assign ((segid A and resid 45 and name HN )) ((segid A and resid 45 and name HB* )) 1.80 0.00 1.62
assign ((segid A and resid 46 and name HA )) ((segid A and resid 47 and name HN )) 1.80 0.00 2.01
assign ((segid A and resid 46 and name HB* )) ((segid A and resid 47 and name HN )) 1.80 0.00 2.30
assign ((segid A and resid 46 and name HN )) ((segid A and resid 46 and name HD1 )) 1.80 0.00 3.25
assign ((segid A and resid 46 and name HN )) ((segid A and resid 47 and name HN )) 1.80 0.00 3.67
assign ((segid A and resid 49 and name HA )) ((segid A and resid 50 and name HN )) 1.80 0.00 2.00
assign ((segid A and resid 49 and name HB* )) ((segid A and resid 50 and name HN )) 1.80 0.00 2.20
assign ((segid A and resid 49 and name HN )) ((segid A and resid 50 and name HN )) 1.80 0.00 3.00
assign ((segid A and resid 50 and name HA )) ((segid A and resid 50 and name HD* )) 1.80 0.00 3.29
assign ((segid A and resid 50 and name HA )) ((segid A and resid 51 and name HN )) 1.80 0.00 2.00
assign ((segid A and resid 50 and name HN )) ((segid A and resid 51 and name HN )) 1.80 0.00 2.66
assign ((segid A and resid 51 and name HA )) ((segid A and resid 51 and name HG2* )) 1.80 0.00 1.81
assign ((segid A and resid 51 and name HA )) ((segid A and resid 52 and name HN )) 1.80 0.00 2.10
assign ((segid A and resid 51 and name HB )) ((segid A and resid 52 and name HN )) 1.80 0.00 3.28
assign ((segid A and resid 51 and name HG2* )) ((segid A and resid 52 and name HN )) 1.80 0.00 2.50
assign ((segid A and resid 51 and name HN )) ((segid A and resid 51 and name HG2* )) 1.80 0.00 2.20
assign ((segid A and resid 51 and name HN )) ((segid A and resid 52 and name HN )) 1.80 0.00 3.20
assign ((segid A and resid 52 and name HA )) ((segid A and resid 52 and name HD* )) 1.80 0.00 2.67
assign ((segid A and resid 52 and name HA )) ((segid A and resid 52 and name HG* )) 1.80 0.00 1.98
assign ((segid A and resid 52 and name HA )) ((segid A and resid 53 and name HN )) 1.80 0.00 1.80
assign ((segid A and resid 52 and name HB* )) ((segid A and resid 52 and name HD1 )) 1.80 0.00 1.65
assign ((segid A and resid 52 and name HB* )) ((segid A and resid 52 and name HD2 )) 1.80 0.00 1.65
assign ((segid A and resid 52 and name HB1 )) ((segid A and resid 52 and name HD* )) 1.80 0.00 1.72
assign ((segid A and resid 52 and name HB1 )) ((segid A and resid 52 and name HE* )) 1.80 0.00 3.67
assign ((segid A and resid 52 and name HB1 )) ((segid A and resid 53 and name HN )) 1.80 0.00 2.54
assign ((segid A and resid 52 and name HB2 )) ((segid A and resid 52 and name HD* )) 1.80 0.00 1.72
assign ((segid A and resid 52 and name HB2 )) ((segid A and resid 52 and name HE* )) 1.80 0.00 3.67
assign ((segid A and resid 52 and name HB2 )) ((segid A and resid 53 and name HN )) 1.80 0.00 2.24
assign ((segid A and resid 52 and name HD1 )) ((segid A and resid 52 and name HE* )) 1.80 0.00 1.51
assign ((segid A and resid 52 and name HD2 )) ((segid A and resid 52 and name HE* )) 1.80 0.00 1.51
assign ((segid A and resid 52 and name HG* )) ((segid A and resid 52 and name HE* )) 1.80 0.00 1.31
assign ((segid A and resid 52 and name HG* )) ((segid A and resid 53 and name HN )) 1.80 0.00 3.00
assign ((segid A and resid 52 and name HN )) ((segid A and resid 52 and name HG* )) 1.80 0.00 2.41
assign ((segid A and resid 52 and name HN )) ((segid A and resid 53 and name HN )) 1.80 0.00 3.80
assign ((segid A and resid 53 and name HA )) ((segid A and resid 54 and name HN )) 1.80 0.00 1.80
assign ((segid A and resid 53 and name HB* )) ((segid A and resid 53 and name HE* )) 1.80 0.00 1.92
assign ((segid A and resid 53 and name HB1 )) ((segid A and resid 54 and name HN )) 1.80 0.00 3.02
assign ((segid A and resid 53 and name HB2 )) ((segid A and resid 54 and name HN )) 1.80 0.00 3.02
assign ((segid A and resid 53 and name HG* )) ((segid A and resid 53 and name HE* )) 1.80 0.00 2.05
assign ((segid A and resid 53 and name HG* )) ((segid A and resid 54 and name HN )) 1.80 0.00 2.90
assign ((segid A and resid 53 and name HN )) ((segid A and resid 53 and name HG* )) 1.80 0.00 2.30
assign ((segid A and resid 53 and name HN )) ((segid A and resid 54 and name HN )) 1.80 0.00 3.48
assign ((segid A and resid 54 and name HA1 )) ((segid A and resid 55 and name HN )) 1.80 0.00 1.95
assign ((segid A and resid 54 and name HA2 )) ((segid A and resid 55 and name HN )) 1.80 0.00 1.95
assign ((segid A and resid 54 and name HN )) ((segid A and resid 55 and name HN )) 1.80 0.00 3.44
assign ((segid A and resid 55 and name HA )) ((segid A and resid 55 and name HD* )) 1.80 0.00 2.67
assign ((segid A and resid 55 and name HA )) ((segid A and resid 55 and name HG* )) 1.80 0.00 1.67
assign ((segid A and resid 55 and name HA )) ((segid A and resid 56 and name HN )) 1.80 0.00 1.83
assign ((segid A and resid 55 and name HB* )) ((segid A and resid 55 and name HD* )) 1.80 0.00 1.50
assign ((segid A and resid 55 and name HB* )) ((segid A and resid 55 and name HE* )) 1.80 0.00 3.51
assign ((segid A and resid 55 and name HB* )) ((segid A and resid 56 and name HN )) 1.80 0.00 2.05
assign ((segid A and resid 55 and name HG* )) ((segid A and resid 56 and name HN )) 1.80 0.00 2.69
assign ((segid A and resid 55 and name HG1 )) ((segid A and resid 55 and name HE* )) 1.80 0.00 1.49
assign ((segid A and resid 55 and name HG2 )) ((segid A and resid 55 and name HE* )) 1.80 0.00 1.49
assign ((segid A and resid 55 and name HN )) ((segid A and resid 55 and name HB* )) 1.80 0.00 1.63
assign ((segid A and resid 55 and name HN )) ((segid A and resid 55 and name HD* )) 1.80 0.00 2.78
assign ((segid A and resid 55 and name HN )) ((segid A and resid 55 and name HG* )) 1.80 0.00 2.07
assign ((segid A and resid 55 and name HN )) ((segid A and resid 56 and name HN )) 1.80 0.00 3.34
assign ((segid A and resid 56 and name HA* )) ((segid A and resid 57 and name HN )) 1.80 0.00 1.70
assign ((segid A and resid 56 and name HN )) ((segid A and resid 57 and name HN )) 1.80 0.00 3.17
assign ((segid A and resid 57 and name HA )) ((segid A and resid 57 and name HG1* )) 1.80 0.00 2.12
assign ((segid A and resid 57 and name HA )) ((segid A and resid 58 and name HN )) 1.80 0.00 1.80
assign ((segid A and resid 57 and name HB )) ((segid A and resid 57 and name HD1* )) 1.80 0.00 1.41
assign ((segid A and resid 57 and name HB )) ((segid A and resid 58 and name HN )) 1.80 0.00 2.67
assign ((segid A and resid 57 and name HD1* )) ((segid A and resid 58 and name HN )) 1.80 0.00 2.53
assign ((segid A and resid 57 and name HG1* )) ((segid A and resid 58 and name HN )) 1.80 0.00 1.82
assign ((segid A and resid 57 and name HG2* )) ((segid A and resid 57 and name HD1* )) 1.80 0.00 2.22
assign ((segid A and resid 57 and name HG2* )) ((segid A and resid 57 and name HG1* )) 1.80 0.00 1.65
assign ((segid A and resid 57 and name HG2* )) ((segid A and resid 58 and name HN )) 1.80 0.00 2.37
assign ((segid A and resid 57 and name HN )) ((segid A and resid 57 and name HB )) 1.80 0.00 2.36
assign ((segid A and resid 57 and name HN )) ((segid A and resid 57 and name HG1* )) 1.80 0.00 3.32
assign ((segid A and resid 57 and name HN )) ((segid A and resid 57 and name HG2* )) 1.80 0.00 1.58
assign ((segid A and resid 57 and name HN )) ((segid A and resid 58 and name HN )) 1.80 0.00 3.30
assign ((segid A and resid 58 and name HA )) ((segid A and resid 58 and name HG2* )) 1.80 0.00 1.92
assign ((segid A and resid 58 and name HA )) ((segid A and resid 59 and name HN )) 1.80 0.00 2.01
assign ((segid A and resid 58 and name HB )) ((segid A and resid 59 and name HN )) 1.80 0.00 2.80
assign ((segid A and resid 58 and name HG2* )) ((segid A and resid 59 and name HN )) 1.80 0.00 3.00
assign ((segid A and resid 58 and name HN )) ((segid A and resid 58 and name HB )) 1.80 0.00 2.28
assign ((segid A and resid 58 and name HN )) ((segid A and resid 58 and name HG2* )) 1.80 0.00 2.45
assign ((segid A and resid 58 and name HN )) ((segid A and resid 59 and name HN )) 1.80 0.00 3.28
assign ((segid A and resid 59 and name HA )) ((segid A and resid 59 and name HD1* )) 1.80 0.00 2.50
assign ((segid A and resid 59 and name HA )) ((segid A and resid 59 and name HD2* )) 1.80 0.00 1.80
assign ((segid A and resid 59 and name HA )) ((segid A and resid 60 and name HN )) 1.80 0.00 1.68
assign ((segid A and resid 59 and name HB* )) ((segid A and resid 59 and name HD1* )) 1.80 0.00 1.41
assign ((segid A and resid 59 and name HB* )) ((segid A and resid 59 and name HD2* )) 1.80 0.00 1.39
assign ((segid A and resid 59 and name HD1* )) ((segid A and resid 60 and name HN )) 1.80 0.00 3.79
assign ((segid A and resid 59 and name HD2* )) ((segid A and resid 60 and name HN )) 1.80 0.00 2.54
assign ((segid A and resid 59 and name HN )) ((segid A and resid 59 and name HD1* )) 1.80 0.00 2.93
assign ((segid A and resid 59 and name HN )) ((segid A and resid 59 and name HD2* )) 1.80 0.00 3.05
assign ((segid A and resid 59 and name HN )) ((segid A and resid 59 and name HG )) 1.80 0.00 2.42
assign ((segid A and resid 60 and name HA )) ((segid A and resid 61 and name HN )) 1.80 0.00 1.81
assign ((segid A and resid 60 and name HB* )) ((segid A and resid 61 and name HN )) 1.80 0.00 1.83
assign ((segid A and resid 61 and name HA )) ((segid A and resid 62 and name HN )) 1.80 0.00 2.00
assign ((segid A and resid 61 and name HA )) ((segid A and resid 64 and name HB* )) 1.80 0.00 3.09
assign ((segid A and resid 61 and name HA )) ((segid A and resid 65 and name HN )) 1.80 0.00 3.44
assign ((segid A and resid 61 and name HB* )) ((segid A and resid 61 and name HD2* )) 1.80 0.00 1.39
assign ((segid A and resid 61 and name HB* )) ((segid A and resid 62 and name HN )) 1.80 0.00 1.72
assign ((segid A and resid 61 and name HD2* )) ((segid A and resid 62 and name HN )) 1.80 0.00 3.32
assign ((segid A and resid 61 and name HN )) ((segid A and resid 61 and name HB* )) 1.80 0.00 1.86
assign ((segid A and resid 61 and name HN )) ((segid A and resid 62 and name HN )) 1.80 0.00 2.07
assign ((segid A and resid 62 and name HA )) ((segid A and resid 62 and name HG1 )) 1.80 0.00 2.55
assign ((segid A and resid 62 and name HA )) ((segid A and resid 62 and name HG2 )) 1.80 0.00 2.55
assign ((segid A and resid 62 and name HA )) ((segid A and resid 63 and name HN )) 1.80 0.00 2.00
assign ((segid A and resid 62 and name HA )) ((segid A and resid 65 and name HB* )) 1.80 0.00 2.45
assign ((segid A and resid 62 and name HA )) ((segid A and resid 65 and name HN )) 1.80 0.00 3.05
assign ((segid A and resid 62 and name HA )) ((segid A and resid 66 and name HN )) 1.80 0.00 2.90
assign ((segid A and resid 62 and name HB* )) ((segid A and resid 63 and name HN )) 1.80 0.00 2.43
assign ((segid A and resid 62 and name HG1 )) ((segid A and resid 63 and name HN )) 1.80 0.00 3.34
assign ((segid A and resid 62 and name HG2 )) ((segid A and resid 63 and name HN )) 1.80 0.00 3.34
assign ((segid A and resid 62 and name HN )) ((segid A and resid 62 and name HB* )) 1.80 0.00 1.51
assign ((segid A and resid 62 and name HN )) ((segid A and resid 62 and name HG1 )) 1.80 0.00 2.86
assign ((segid A and resid 62 and name HN )) ((segid A and resid 62 and name HG2 )) 1.80 0.00 3.20
assign ((segid A and resid 62 and name HN )) ((segid A and resid 63 and name HN )) 1.80 0.00 2.19
assign ((segid A and resid 63 and name HA )) ((segid A and resid 63 and name HG* )) 1.80 0.00 2.20
assign ((segid A and resid 63 and name HA )) ((segid A and resid 64 and name HN )) 1.80 0.00 2.00
assign ((segid A and resid 63 and name HA )) ((segid A and resid 66 and name HB )) 1.80 0.00 2.75
assign ((segid A and resid 63 and name HA )) ((segid A and resid 66 and name HG2* )) 1.80 0.00 3.02
assign ((segid A and resid 63 and name HA )) ((segid A and resid 66 and name HN )) 1.80 0.00 2.69
assign ((segid A and resid 63 and name HA )) ((segid A and resid 67 and name HN )) 1.80 0.00 3.58
assign ((segid A and resid 63 and name HB* )) ((segid A and resid 64 and name HN )) 1.80 0.00 2.02
assign ((segid A and resid 63 and name HG* )) ((segid A and resid 64 and name HN )) 1.80 0.00 3.24
assign ((segid A and resid 63 and name HN )) ((segid A and resid 64 and name HB* )) 1.80 0.00 2.96
assign ((segid A and resid 63 and name HN )) ((segid A and resid 64 and name HN )) 1.80 0.00 2.47
assign ((segid A and resid 64 and name HA )) ((segid A and resid 64 and name HD* )) 1.80 0.00 2.35
assign ((segid A and resid 64 and name HA )) ((segid A and resid 64 and name HE* )) 1.80 0.00 3.36
assign ((segid A and resid 64 and name HA )) ((segid A and resid 65 and name HN )) 1.80 0.00 2.00
assign ((segid A and resid 64 and name HA )) ((segid A and resid 67 and name HE* )) 1.80 0.00 2.00
assign ((segid A and resid 64 and name HA )) ((segid A and resid 67 and name HB* )) 1.80 0.00 2.50
assign ((segid A and resid 64 and name HA )) ((segid A and resid 67 and name HN )) 1.80 0.00 3.05
assign ((segid A and resid 64 and name HA )) ((segid A and resid 68 and name HN )) 1.80 0.00 3.42
assign ((segid A and resid 64 and name HB* )) ((segid A and resid 65 and name HN )) 1.80 0.00 2.18
assign ((segid A and resid 64 and name HD* )) ((segid A and resid 64 and name HZ )) 1.80 0.00 2.60
assign ((segid A and resid 64 and name HD* )) ((segid A and resid 65 and name HN )) 1.80 0.00 3.44
assign ((segid A and resid 64 and name HD* )) ((segid A and resid 67 and name HE* )) 1.80 0.00 1.33
assign ((segid A and resid 64 and name HD* )) ((segid A and resid 68 and name HG2* )) 1.80 0.00 2.90
assign ((segid A and resid 64 and name HE* )) ((segid A and resid 67 and name HE* )) 1.80 0.00 1.37
assign ((segid A and resid 64 and name HN )) ((segid A and resid 64 and name HB* )) 1.80 0.00 1.96
assign ((segid A and resid 64 and name HN )) ((segid A and resid 64 and name HD* )) 1.80 0.00 3.22
assign ((segid A and resid 64 and name HN )) ((segid A and resid 65 and name HN )) 1.80 0.00 2.20
assign ((segid A and resid 65 and name HA )) ((segid A and resid 65 and name HE21 )) 1.80 0.00 3.02
assign ((segid A and resid 65 and name HA )) ((segid A and resid 65 and name HE22 )) 1.80 0.00 3.06
assign ((segid A and resid 65 and name HA )) ((segid A and resid 65 and name HG1 )) 1.80 0.00 2.38
assign ((segid A and resid 65 and name HA )) ((segid A and resid 65 and name HG2 )) 1.80 0.00 2.38
assign ((segid A and resid 65 and name HA )) ((segid A and resid 66 and name HN )) 1.80 0.00 1.80
assign ((segid A and resid 65 and name HA )) ((segid A and resid 68 and name HB )) 1.80 0.00 2.26
assign ((segid A and resid 65 and name HA )) ((segid A and resid 68 and name HG1* )) 1.80 0.00 2.43
assign ((segid A and resid 65 and name HA )) ((segid A and resid 68 and name HG2* )) 1.80 0.00 1.93
assign ((segid A and resid 65 and name HA )) ((segid A and resid 68 and name HN )) 1.80 0.00 2.50
assign ((segid A and resid 65 and name HA )) ((segid A and resid 69 and name HN )) 1.80 0.00 2.97
assign ((segid A and resid 65 and name HB* )) ((segid A and resid 65 and name HE21 )) 1.80 0.00 2.99
assign ((segid A and resid 65 and name HB* )) ((segid A and resid 66 and name HN )) 1.80 0.00 1.96
assign ((segid A and resid 65 and name HE21 )) ((segid A and resid 68 and name HB )) 1.80 0.00 2.95
assign ((segid A and resid 65 and name HE21 )) ((segid A and resid 68 and name HG1* )) 1.80 0.00 3.33
assign ((segid A and resid 65 and name HE22 )) ((segid A and resid 68 and name HB )) 1.80 0.00 3.14
assign ((segid A and resid 65 and name HE22 )) ((segid A and resid 68 and name HG1* )) 1.80 0.00 2.47
assign ((segid A and resid 65 and name HG1 )) ((segid A and resid 65 and name HE21 )) 1.80 0.00 1.75
assign ((segid A and resid 65 and name HG1 )) ((segid A and resid 66 and name HN )) 1.80 0.00 3.62
assign ((segid A and resid 65 and name HG2 )) ((segid A and resid 65 and name HE21 )) 1.80 0.00 1.75
assign ((segid A and resid 65 and name HG2 )) ((segid A and resid 66 and name HN )) 1.80 0.00 3.62
assign ((segid A and resid 65 and name HN )) ((segid A and resid 65 and name HB1 )) 1.80 0.00 1.83
assign ((segid A and resid 65 and name HN )) ((segid A and resid 65 and name HB2 )) 1.80 0.00 1.83
assign ((segid A and resid 65 and name HN )) ((segid A and resid 65 and name HG* )) 1.80 0.00 3.08
assign ((segid A and resid 65 and name HN )) ((segid A and resid 66 and name HN )) 1.80 0.00 1.92
assign ((segid A and resid 66 and name HA )) ((segid A and resid 66 and name HG2* )) 1.80 0.00 1.51
assign ((segid A and resid 66 and name HA )) ((segid A and resid 67 and name HN )) 1.80 0.00 1.80
assign ((segid A and resid 66 and name HA )) ((segid A and resid 69 and name HB* )) 1.80 0.00 2.80
assign ((segid A and resid 66 and name HA )) ((segid A and resid 69 and name HN )) 1.80 0.00 2.72
assign ((segid A and resid 66 and name HA )) ((segid A and resid 70 and name HN )) 1.80 0.00 3.00
assign ((segid A and resid 66 and name HB )) ((segid A and resid 67 and name HN )) 1.80 0.00 2.53
assign ((segid A and resid 66 and name HG2* )) ((segid A and resid 67 and name HN )) 1.80 0.00 2.14
assign ((segid A and resid 66 and name HN )) ((segid A and resid 66 and name HB )) 1.80 0.00 1.93
assign ((segid A and resid 66 and name HN )) ((segid A and resid 66 and name HG2* )) 1.80 0.00 2.35
assign ((segid A and resid 66 and name HN )) ((segid A and resid 67 and name HN )) 1.80 0.00 1.96
assign ((segid A and resid 67 and name HA )) ((segid A and resid 68 and name HN )) 1.80 0.00 1.80
assign ((segid A and resid 67 and name HA )) ((segid A and resid 70 and name HB* )) 1.80 0.00 1.97
assign ((segid A and resid 67 and name HA )) ((segid A and resid 70 and name HN )) 1.80 0.00 2.46
assign ((segid A and resid 67 and name HA )) ((segid A and resid 71 and name HN )) 1.80 0.00 2.48
assign ((segid A and resid 67 and name HB* )) ((segid A and resid 68 and name HN )) 1.80 0.00 2.69
assign ((segid A and resid 67 and name HE* )) ((segid A and resid 68 and name HG2* )) 1.80 0.00 1.60
assign ((segid A and resid 67 and name HE* )) ((segid A and resid 68 and name HN )) 1.80 0.00 2.38
assign ((segid A and resid 67 and name HG1 )) ((segid A and resid 68 and name HN )) 1.80 0.00 3.35
assign ((segid A and resid 67 and name HG2 )) ((segid A and resid 68 and name HN )) 1.80 0.00 3.35
assign ((segid A and resid 67 and name HN )) ((segid A and resid 67 and name HB* )) 1.80 0.00 1.98
assign ((segid A and resid 67 and name HN )) ((segid A and resid 67 and name HG1 )) 1.80 0.00 3.03
assign ((segid A and resid 67 and name HN )) ((segid A and resid 67 and name HG2 )) 1.80 0.00 3.03
assign ((segid A and resid 67 and name HN )) ((segid A and resid 68 and name HN )) 1.80 0.00 2.05
assign ((segid A and resid 68 and name HA )) ((segid A and resid 68 and name HG1* )) 1.80 0.00 1.48
assign ((segid A and resid 68 and name HA )) ((segid A and resid 68 and name HG2* )) 1.80 0.00 1.50
assign ((segid A and resid 68 and name HA )) ((segid A and resid 69 and name HN )) 1.80 0.00 1.80
assign ((segid A and resid 68 and name HA )) ((segid A and resid 71 and name HB* )) 1.80 0.00 2.94
assign ((segid A and resid 68 and name HA )) ((segid A and resid 71 and name HN )) 1.80 0.00 2.71
assign ((segid A and resid 68 and name HA )) ((segid A and resid 72 and name HN )) 1.80 0.00 3.37
assign ((segid A and resid 68 and name HB )) ((segid A and resid 69 and name HN )) 1.80 0.00 1.84
assign ((segid A and resid 68 and name HG1* )) ((segid A and resid 69 and name HN )) 1.80 0.00 1.98
assign ((segid A and resid 68 and name HG2* )) ((segid A and resid 69 and name HN )) 1.80 0.00 2.45
assign ((segid A and resid 68 and name HN )) ((segid A and resid 68 and name HB )) 1.80 0.00 1.89
assign ((segid A and resid 68 and name HN )) ((segid A and resid 68 and name HG1* )) 1.80 0.00 2.50
assign ((segid A and resid 68 and name HN )) ((segid A and resid 68 and name HG2* )) 1.80 0.00 1.41
assign ((segid A and resid 68 and name HN )) ((segid A and resid 69 and name HN )) 1.80 0.00 1.81
assign ((segid A and resid 69 and name HA )) ((segid A and resid 70 and name HN )) 1.80 0.00 2.00
assign ((segid A and resid 69 and name HA )) ((segid A and resid 72 and name HB* )) 1.80 0.00 2.40
assign ((segid A and resid 69 and name HA )) ((segid A and resid 72 and name HN )) 1.80 0.00 2.91
assign ((segid A and resid 69 and name HB1 )) ((segid A and resid 70 and name HN )) 1.80 0.00 2.50
assign ((segid A and resid 69 and name HB2 )) ((segid A and resid 70 and name HN )) 1.80 0.00 2.15
assign ((segid A and resid 69 and name HN )) ((segid A and resid 69 and name HB* )) 1.80 0.00 1.33
assign ((segid A and resid 69 and name HN )) ((segid A and resid 70 and name HN )) 1.80 0.00 1.64
assign ((segid A and resid 70 and name HA )) ((segid A and resid 71 and name HN )) 1.80 0.00 2.00
assign ((segid A and resid 70 and name HA )) ((segid A and resid 73 and name HN )) 1.80 0.00 2.60
assign ((segid A and resid 70 and name HB* )) ((segid A and resid 71 and name HN )) 1.80 0.00 1.48
assign ((segid A and resid 70 and name HB* )) ((segid A and resid 73 and name HN )) 1.80 0.00 3.27
assign ((segid A and resid 70 and name HN )) ((segid A and resid 70 and name HB* )) 1.80 0.00 1.50
assign ((segid A and resid 70 and name HN )) ((segid A and resid 71 and name HN )) 1.80 0.00 1.46
assign ((segid A and resid 71 and name HA )) ((segid A and resid 71 and name HD* )) 1.80 0.00 1.70
assign ((segid A and resid 71 and name HA )) ((segid A and resid 72 and name HN )) 1.80 0.00 1.80
assign ((segid A and resid 71 and name HA )) ((segid A and resid 75 and name HB* )) 1.80 0.00 3.19
assign ((segid A and resid 71 and name HB1 )) ((segid A and resid 72 and name HN )) 1.80 0.00 2.57
assign ((segid A and resid 71 and name HB2 )) ((segid A and resid 72 and name HN )) 1.80 0.00 2.57
assign ((segid A and resid 71 and name HD* )) ((segid A and resid 72 and name HN )) 1.80 0.00 3.05
assign ((segid A and resid 71 and name HD* )) ((segid A and resid 75 and name HB* )) 1.80 0.00 3.08
assign ((segid A and resid 71 and name HN )) ((segid A and resid 71 and name HD* )) 1.80 0.00 1.96
assign ((segid A and resid 71 and name HN )) ((segid A and resid 72 and name HN )) 1.80 0.00 1.67
assign ((segid A and resid 72 and name HA )) ((segid A and resid 72 and name HG1 )) 1.80 0.00 2.68
assign ((segid A and resid 72 and name HA )) ((segid A and resid 72 and name HG2 )) 1.80 0.00 2.68
assign ((segid A and resid 72 and name HA )) ((segid A and resid 73 and name HN )) 1.80 0.00 2.06
assign ((segid A and resid 72 and name HB* )) ((segid A and resid 72 and name HD* )) 1.80 0.00 1.47
assign ((segid A and resid 72 and name HB* )) ((segid A and resid 72 and name HE* )) 1.80 0.00 3.27
assign ((segid A and resid 72 and name HB* )) ((segid A and resid 73 and name HN )) 1.80 0.00 2.59
assign ((segid A and resid 72 and name HD* )) ((segid A and resid 73 and name HN )) 1.80 0.00 3.26
assign ((segid A and resid 72 and name HG1 )) ((segid A and resid 72 and name HE* )) 1.80 0.00 1.97
assign ((segid A and resid 72 and name HG1 )) ((segid A and resid 73 and name HN )) 1.80 0.00 3.20
assign ((segid A and resid 72 and name HG2 )) ((segid A and resid 72 and name HE* )) 1.80 0.00 1.97
assign ((segid A and resid 72 and name HG2 )) ((segid A and resid 73 and name HN )) 1.80 0.00 2.43
assign ((segid A and resid 72 and name HN )) ((segid A and resid 72 and name HB* )) 1.80 0.00 1.58
assign ((segid A and resid 72 and name HN )) ((segid A and resid 72 and name HD* )) 1.80 0.00 3.26
assign ((segid A and resid 72 and name HN )) ((segid A and resid 73 and name HN )) 1.80 0.00 1.35
assign ((segid A and resid 73 and name HA* )) ((segid A and resid 74 and name HN )) 1.80 0.00 1.50
assign ((segid A and resid 73 and name HN )) ((segid A and resid 74 and name HN )) 1.80 0.00 1.80
assign ((segid A and resid 74 and name HA )) ((segid A and resid 75 and name HN )) 1.80 0.00 1.80
assign ((segid A and resid 74 and name HB1 )) ((segid A and resid 75 and name HN )) 1.80 0.00 2.68
assign ((segid A and resid 74 and name HB2 )) ((segid A and resid 75 and name HN )) 1.80 0.00 2.68
assign ((segid A and resid 75 and name HA )) ((segid A and resid 75 and name HD1* )) 1.80 0.00 1.93
assign ((segid A and resid 75 and name HA )) ((segid A and resid 75 and name HD2* )) 1.80 0.00 2.10
assign ((segid A and resid 75 and name HB* )) ((segid A and resid 75 and name HD1* )) 1.80 0.00 1.50
assign ((segid A and resid 75 and name HB* )) ((segid A and resid 75 and name HD2* )) 1.80 0.00 1.50
assign ((segid A and resid 75 and name HD2* )) ((segid A and resid 76 and name HN )) 1.80 0.00 3.80
assign ((segid A and resid 75 and name HN )) ((segid A and resid 75 and name HB* )) 1.80 0.00 1.50
assign ((segid A and resid 75 and name HN )) ((segid A and resid 75 and name HD1* )) 1.80 0.00 2.65
assign ((segid A and resid 76 and name HA )) ((segid A and resid 77 and name HN )) 1.80 0.00 1.80
assign ((segid A and resid 76 and name HB* )) ((segid A and resid 77 and name HN )) 1.80 0.00 2.50
assign ((segid A and resid 76 and name HG* )) ((segid A and resid 77 and name HN )) 1.80 0.00 3.00
assign ((segid A and resid 76 and name HN )) ((segid A and resid 76 and name HB* )) 1.80 0.00 2.00
assign ((segid A and resid 76 and name HN )) ((segid A and resid 76 and name HG* )) 1.80 0.00 2.80
assign ((segid A and resid 77 and name HA )) ((segid A and resid 78 and name HN )) 1.80 0.00 1.74
assign ((segid A and resid 77 and name HB* )) ((segid A and resid 77 and name HD* )) 1.80 0.00 1.80
assign ((segid A and resid 77 and name HB* )) ((segid A and resid 78 and name HN )) 1.80 0.00 2.48
assign ((segid A and resid 77 and name HN )) ((segid A and resid 77 and name HB* )) 1.80 0.00 1.43
assign ((segid A and resid 78 and name HA )) ((segid A and resid 79 and name HN )) 1.80 0.00 1.80
assign ((segid A and resid 78 and name HB* )) ((segid A and resid 79 and name HN )) 1.80 0.00 2.45
assign ((segid A and resid 78 and name HN )) ((segid A and resid 78 and name HB* )) 1.80 0.00 1.50
assign ((segid A and resid 79 and name HA )) ((segid A and resid 80 and name HN )) 1.80 0.00 1.80
assign ((segid A and resid 79 and name HB* )) ((segid A and resid 80 and name HN )) 1.80 0.00 2.46
assign ((segid A and resid 79 and name HN )) ((segid A and resid 79 and name HB* )) 1.80 0.00 2.04
assign ((segid A and resid 80 and name HA )) ((segid A and resid 81 and name HN )) 1.80 0.00 1.80
assign ((segid A and resid 80 and name HN )) ((segid A and resid 80 and name HB* )) 1.80 0.00 2.07
assign ((segid A and resid 81 and name HA )) ((segid A and resid 82 and name HN )) 1.80 0.00 1.80
assign ((segid A and resid 81 and name HB* )) ((segid A and resid 82 and name HN )) 1.80 0.00 2.30
assign ((segid A and resid 81 and name HN )) ((segid A and resid 81 and name HB* )) 1.80 0.00 1.49
assign ((segid A and resid 82 and name HN )) ((segid A and resid 82 and name HB* )) 1.80 0.00 1.60
assign ((segid B and resid 1 and name HA )) ((segid B and resid 2 and name HN )) 1.80 0.00 1.80
assign ((segid B and resid 1 and name HB* )) ((segid B and resid 2 and name HN )) 1.80 0.00 2.10
assign ((segid B and resid 1 and name HG* )) ((segid B and resid 2 and name HN )) 1.80 0.00 2.93
assign ((segid B and resid 2 and name HA )) ((segid B and resid 2 and name HG* )) 1.80 0.00 1.96
assign ((segid B and resid 2 and name HA )) ((segid B and resid 3 and name HN )) 1.80 0.00 1.57
assign ((segid B and resid 2 and name HB* )) ((segid B and resid 3 and name HN )) 1.80 0.00 2.20
assign ((segid B and resid 2 and name HB1 )) ((segid B and resid 2 and name HD* )) 1.80 0.00 1.50
assign ((segid B and resid 2 and name HB2 )) ((segid B and resid 2 and name HD* )) 1.80 0.00 1.50
assign ((segid B and resid 2 and name HG* )) ((segid B and resid 3 and name HN )) 1.80 0.00 2.91
assign ((segid B and resid 2 and name HN )) ((segid B and resid 2 and name HB* )) 1.80 0.00 1.58
assign ((segid B and resid 2 and name HN )) ((segid B and resid 2 and name HG* )) 1.80 0.00 2.50
assign ((segid B and resid 3 and name HA )) ((segid B and resid 4 and name HN )) 1.80 0.00 1.80
assign ((segid B and resid 3 and name HB* )) ((segid B and resid 3 and name HD* )) 1.80 0.00 1.33
assign ((segid B and resid 3 and name HB* )) ((segid B and resid 4 and name HN )) 1.80 0.00 2.10
assign ((segid B and resid 3 and name HG* )) ((segid B and resid 4 and name HN )) 1.80 0.00 2.80
assign ((segid B and resid 3 and name HN )) ((segid B and resid 3 and name HB* )) 1.80 0.00 1.50
assign ((segid B and resid 3 and name HN )) ((segid B and resid 3 and name HG* )) 1.80 0.00 3.00
assign ((segid B and resid 4 and name HA )) ((segid B and resid 5 and name HN )) 1.80 0.00 1.80
assign ((segid B and resid 4 and name HB* )) ((segid B and resid 5 and name HN )) 1.80 0.00 2.20
assign ((segid B and resid 4 and name HG* )) ((segid B and resid 5 and name HN )) 1.80 0.00 2.74
assign ((segid B and resid 4 and name HN )) ((segid B and resid 4 and name HB* )) 1.80 0.00 1.38
assign ((segid B and resid 4 and name HN )) ((segid B and resid 4 and name HG* )) 1.80 0.00 2.30
assign ((segid B and resid 5 and name HA )) ((segid B and resid 6 and name HN )) 1.80 0.00 1.80
assign ((segid B and resid 5 and name HB* )) ((segid B and resid 6 and name HN )) 1.80 0.00 1.80
assign ((segid B and resid 5 and name HN )) ((segid B and resid 5 and name HB* )) 1.80 0.00 1.36
assign ((segid B and resid 6 and name HA )) ((segid B and resid 7 and name HN )) 1.80 0.00 1.80
assign ((segid B and resid 6 and name HB* )) ((segid B and resid 7 and name HN )) 1.80 0.00 2.10
assign ((segid B and resid 6 and name HG1 )) ((segid B and resid 7 and name HN )) 1.80 0.00 3.80
assign ((segid B and resid 6 and name HG2 )) ((segid B and resid 7 and name HN )) 1.80 0.00 3.80
assign ((segid B and resid 6 and name HN )) ((segid B and resid 6 and name HB* )) 1.80 0.00 1.50
assign ((segid B and resid 6 and name HN )) ((segid B and resid 6 and name HG* )) 1.80 0.00 2.50
assign ((segid B and resid 7 and name HA )) ((segid B and resid 7 and name HD* )) 1.80 0.00 2.36
assign ((segid B and resid 7 and name HA )) ((segid B and resid 8 and name HN )) 1.80 0.00 2.00
assign ((segid B and resid 7 and name HA )) ((segid B and resid 35 and name HD2* )) 1.80 0.00 2.67
assign ((segid B and resid 7 and name HB* )) ((segid B and resid 8 and name HN )) 1.80 0.00 1.80
assign ((segid B and resid 7 and name HB* )) ((segid B and resid 35 and name HD2* )) 1.80 0.00 2.39
assign ((segid B and resid 7 and name HB* )) ((segid B and resid 35 and name HN )) 1.80 0.00 3.20
assign ((segid B and resid 7 and name HD* )) ((segid B and resid 7 and name HZ )) 1.80 0.00 2.40
assign ((segid B and resid 7 and name HD* )) ((segid B and resid 8 and name HN )) 1.80 0.00 3.00
assign ((segid B and resid 7 and name HE* )) ((segid B and resid 7 and name HZ )) 1.80 0.00 1.50
assign ((segid B and resid 7 and name HN )) ((segid B and resid 7 and name HB* )) 1.80 0.00 1.45
assign ((segid B and resid 7 and name HN )) ((segid B and resid 7 and name HD* )) 1.80 0.00 2.30
assign ((segid B and resid 8 and name HA )) ((segid B and resid 8 and name HG2* )) 1.80 0.00 1.50
assign ((segid B and resid 8 and name HA )) ((segid B and resid 9 and name HN )) 1.80 0.00 1.50
assign ((segid B and resid 8 and name HB )) ((segid B and resid 9 and name HN )) 1.80 0.00 2.50
assign ((segid B and resid 8 and name HG2* )) ((segid B and resid 35 and name HA )) 1.80 0.00 3.00
assign ((segid B and resid 8 and name HG2* )) ((segid B and resid 35 and name HN )) 1.80 0.00 3.00
assign ((segid B and resid 8 and name HN )) ((segid B and resid 8 and name HB )) 1.80 0.00 2.43
assign ((segid B and resid 8 and name HN )) ((segid B and resid 8 and name HG2* )) 1.80 0.00 2.30
assign ((segid B and resid 8 and name HN )) ((segid B and resid 9 and name HN )) 1.80 0.00 3.29
assign ((segid B and resid 8 and name HN )) ((segid B and resid 35 and name HA )) 1.80 0.00 2.48
assign ((segid B and resid 8 and name HN )) ((segid B and resid 35 and name HD2* )) 1.80 0.00 3.16
assign ((segid B and resid 8 and name HN )) ((segid B and resid 35 and name HN )) 1.80 0.00 2.30
assign ((segid B and resid 9 and name HA )) ((segid B and resid 9 and name HD* )) 1.80 0.00 3.14
assign ((segid B and resid 9 and name HA )) ((segid B and resid 10 and name HN )) 1.80 0.00 1.81
assign ((segid B and resid 9 and name HA )) ((segid B and resid 32 and name HG1* )) 1.80 0.00 2.63
assign ((segid B and resid 9 and name HA )) ((segid B and resid 34 and name HA )) 1.80 0.00 2.67
assign ((segid B and resid 9 and name HA )) ((segid B and resid 34 and name HD* )) 1.80 0.00 2.96
assign ((segid B and resid 9 and name HA )) ((segid B and resid 35 and name HN )) 1.80 0.00 2.62
assign ((segid B and resid 9 and name HB* )) ((segid B and resid 34 and name HA )) 1.80 0.00 3.17
assign ((segid B and resid 9 and name HB1 )) ((segid B and resid 10 and name HN )) 1.80 0.00 3.08
assign ((segid B and resid 9 and name HB1 )) ((segid B and resid 32 and name HG1* )) 1.80 0.00 2.48
assign ((segid B and resid 9 and name HB2 )) ((segid B and resid 10 and name HN )) 1.80 0.00 3.08
assign ((segid B and resid 9 and name HB2 )) ((segid B and resid 32 and name HG1* )) 1.80 0.00 2.48
assign ((segid B and resid 9 and name HD* )) ((segid B and resid 10 and name HN )) 1.80 0.00 3.23
assign ((segid B and resid 9 and name HD* )) ((segid B and resid 32 and name HG1* )) 1.80 0.00 2.52
assign ((segid B and resid 9 and name HD* )) ((segid B and resid 34 and name HE* )) 1.80 0.00 2.53
assign ((segid B and resid 9 and name HN )) ((segid B and resid 9 and name HD* )) 1.80 0.00 2.30
assign ((segid B and resid 9 and name HN )) ((segid B and resid 10 and name HN )) 1.80 0.00 3.21
assign ((segid B and resid 10 and name HA )) ((segid B and resid 10 and name HG* )) 1.80 0.00 1.73
assign ((segid B and resid 10 and name HA )) ((segid B and resid 11 and name HN )) 1.80 0.00 1.68
assign ((segid B and resid 10 and name HA )) ((segid B and resid 32 and name HG1* )) 1.80 0.00 3.07
assign ((segid B and resid 10 and name HB* )) ((segid B and resid 33 and name HN )) 1.80 0.00 3.21
assign ((segid B and resid 10 and name HB1 )) ((segid B and resid 11 and name HN )) 1.80 0.00 3.03
assign ((segid B and resid 10 and name HB2 )) ((segid B and resid 11 and name HN )) 1.80 0.00 3.03
assign ((segid B and resid 10 and name HG* )) ((segid B and resid 11 and name HN )) 1.80 0.00 2.80
assign ((segid B and resid 10 and name HN )) ((segid B and resid 10 and name HG* )) 1.80 0.00 2.62
assign ((segid B and resid 10 and name HN )) ((segid B and resid 11 and name HN )) 1.80 0.00 3.18
assign ((segid B and resid 10 and name HN )) ((segid B and resid 32 and name HG1* )) 1.80 0.00 2.08
assign ((segid B and resid 10 and name HN )) ((segid B and resid 33 and name HB* )) 1.80 0.00 3.09
assign ((segid B and resid 10 and name HN )) ((segid B and resid 33 and name HN )) 1.80 0.00 2.02
assign ((segid B and resid 10 and name HN )) ((segid B and resid 34 and name HA )) 1.80 0.00 2.74
assign ((segid B and resid 11 and name HA )) ((segid B and resid 11 and name HD1* )) 1.80 0.00 3.00
assign ((segid B and resid 11 and name HA )) ((segid B and resid 11 and name HG2* )) 1.80 0.00 1.94
assign ((segid B and resid 11 and name HA )) ((segid B and resid 12 and name HN )) 1.80 0.00 2.15
assign ((segid B and resid 11 and name HA )) ((segid B and resid 32 and name HA )) 1.80 0.00 2.72
assign ((segid B and resid 11 and name HA )) ((segid B and resid 32 and name HG1* )) 1.80 0.00 2.41
assign ((segid B and resid 11 and name HA )) ((segid B and resid 32 and name HG2* )) 1.80 0.00 2.16
assign ((segid B and resid 11 and name HA )) ((segid B and resid 33 and name HN )) 1.80 0.00 2.72
assign ((segid B and resid 11 and name HB )) ((segid B and resid 11 and name HD1* )) 1.80 0.00 1.94
assign ((segid B and resid 11 and name HD1* )) ((segid B and resid 32 and name HG1* )) 1.80 0.00 3.21
assign ((segid B and resid 11 and name HD1* )) ((segid B and resid 32 and name HG2* )) 1.80 0.00 2.77
assign ((segid B and resid 11 and name HG1* )) ((segid B and resid 12 and name HN )) 1.80 0.00 3.16
assign ((segid B and resid 11 and name HG1* )) ((segid B and resid 32 and name HG2* )) 1.80 0.00 3.21
assign ((segid B and resid 11 and name HG2* )) ((segid B and resid 11 and name HD1* )) 1.80 0.00 1.47
assign ((segid B and resid 11 and name HG2* )) ((segid B and resid 11 and name HG11 )) 1.80 0.00 2.85
assign ((segid B and resid 11 and name HG2* )) ((segid B and resid 11 and name HG12 )) 1.80 0.00 2.85
assign ((segid B and resid 11 and name HG2* )) ((segid B and resid 12 and name HN )) 1.80 0.00 2.16
assign ((segid B and resid 11 and name HG2* )) ((segid B and resid 13 and name HB* )) 1.80 0.00 3.80
assign ((segid B and resid 11 and name HG2* )) ((segid B and resid 13 and name HN )) 1.80 0.00 1.91
assign ((segid B and resid 11 and name HG2* )) ((segid B and resid 30 and name HA )) 1.80 0.00 3.16
assign ((segid B and resid 11 and name HG2* )) ((segid B and resid 30 and name HB1 )) 1.80 0.00 2.18
assign ((segid B and resid 11 and name HG2* )) ((segid B and resid 30 and name HB2 )) 1.80 0.00 2.18
assign ((segid B and resid 11 and name HG2* )) ((segid B and resid 31 and name HN )) 1.80 0.00 2.59
assign ((segid B and resid 11 and name HG2* )) ((segid B and resid 32 and name HA )) 1.80 0.00 2.99
assign ((segid B and resid 11 and name HG2* )) ((segid B and resid 32 and name HG1* )) 1.80 0.00 3.20
assign ((segid B and resid 11 and name HG2* )) ((segid B and resid 32 and name HG2* )) 1.80 0.00 1.85
assign ((segid B and resid 11 and name HN )) ((segid B and resid 11 and name HB )) 1.80 0.00 2.08
assign ((segid B and resid 11 and name HN )) ((segid B and resid 11 and name HD1* )) 1.80 0.00 2.66
assign ((segid B and resid 11 and name HN )) ((segid B and resid 11 and name HG11 )) 1.80 0.00 2.89
assign ((segid B and resid 11 and name HN )) ((segid B and resid 11 and name HG12 )) 1.80 0.00 2.89
assign ((segid B and resid 11 and name HN )) ((segid B and resid 11 and name HG2* )) 1.80 0.00 2.49
assign ((segid B and resid 11 and name HN )) ((segid B and resid 12 and name HN )) 1.80 0.00 3.36
assign ((segid B and resid 11 and name HN )) ((segid B and resid 32 and name HG1* )) 1.80 0.00 3.27
assign ((segid B and resid 11 and name HN )) ((segid B and resid 32 and name HG2* )) 1.80 0.00 3.45
assign ((segid B and resid 12 and name HA )) ((segid B and resid 12 and name HG1 )) 1.80 0.00 2.62
assign ((segid B and resid 12 and name HA )) ((segid B and resid 12 and name HG2 )) 1.80 0.00 2.62
assign ((segid B and resid 12 and name HA )) ((segid B and resid 13 and name HN )) 1.80 0.00 1.80
assign ((segid B and resid 12 and name HB* )) ((segid B and resid 13 and name HN )) 1.80 0.00 2.36
assign ((segid B and resid 12 and name HB* )) ((segid B and resid 39 and name HB* )) 1.80 0.00 2.52
assign ((segid B and resid 12 and name HG* )) ((segid B and resid 33 and name HB* )) 1.80 0.00 3.23
assign ((segid B and resid 12 and name HG1 )) ((segid B and resid 13 and name HN )) 1.80 0.00 3.29
assign ((segid B and resid 12 and name HG1 )) ((segid B and resid 39 and name HB* )) 1.80 0.00 1.94
assign ((segid B and resid 12 and name HG2 )) ((segid B and resid 13 and name HN )) 1.80 0.00 3.29
assign ((segid B and resid 12 and name HG2 )) ((segid B and resid 32 and name HA )) 1.80 0.00 3.39
assign ((segid B and resid 12 and name HG2 )) ((segid B and resid 39 and name HB* )) 1.80 0.00 2.70
assign ((segid B and resid 12 and name HN )) ((segid B and resid 12 and name HG1 )) 1.80 0.00 2.42
assign ((segid B and resid 12 and name HN )) ((segid B and resid 12 and name HG2 )) 1.80 0.00 2.80
assign ((segid B and resid 12 and name HN )) ((segid B and resid 13 and name HN )) 1.80 0.00 1.91
assign ((segid B and resid 12 and name HN )) ((segid B and resid 32 and name HA )) 1.80 0.00 2.69
assign ((segid B and resid 12 and name HN )) ((segid B and resid 32 and name HG1* )) 1.80 0.00 3.59
assign ((segid B and resid 12 and name HN )) ((segid B and resid 32 and name HG2* )) 1.80 0.00 3.30
assign ((segid B and resid 12 and name HN )) ((segid B and resid 33 and name HN )) 1.80 0.00 3.27
assign ((segid B and resid 12 and name HN )) ((segid B and resid 39 and name HB* )) 1.80 0.00 3.16
assign ((segid B and resid 13 and name HA )) ((segid B and resid 13 and name HG* )) 1.80 0.00 1.90
assign ((segid B and resid 13 and name HA )) ((segid B and resid 14 and name HN )) 1.80 0.00 1.65
assign ((segid B and resid 13 and name HB* )) ((segid B and resid 31 and name HB1 )) 1.80 0.00 4.25
assign ((segid B and resid 13 and name HB* )) ((segid B and resid 31 and name HB2 )) 1.80 0.00 3.20
assign ((segid B and resid 13 and name HB* )) ((segid B and resid 31 and name HD* )) 1.80 0.00 3.80
assign ((segid B and resid 13 and name HB* )) ((segid B and resid 31 and name HN )) 1.80 0.00 3.19
assign ((segid B and resid 13 and name HB* )) ((segid B and resid 39 and name HB* )) 1.80 0.00 4.25
assign ((segid B and resid 13 and name HB1 )) ((segid B and resid 14 and name HN )) 1.80 0.00 2.94
assign ((segid B and resid 13 and name HB2 )) ((segid B and resid 14 and name HN )) 1.80 0.00 2.94
assign ((segid B and resid 13 and name HG* )) ((segid B and resid 14 and name HN )) 1.80 0.00 2.57
assign ((segid B and resid 13 and name HG* )) ((segid B and resid 15 and name HD2* )) 1.80 0.00 2.90
assign ((segid B and resid 13 and name HG* )) ((segid B and resid 31 and name HD* )) 1.80 0.00 3.80
assign ((segid B and resid 13 and name HN )) ((segid B and resid 13 and name HB1 )) 1.80 0.00 2.49
assign ((segid B and resid 13 and name HN )) ((segid B and resid 13 and name HB2 )) 1.80 0.00 2.49
assign ((segid B and resid 13 and name HN )) ((segid B and resid 13 and name HG* )) 1.80 0.00 3.03
assign ((segid B and resid 13 and name HN )) ((segid B and resid 14 and name HN )) 1.80 0.00 3.21
assign ((segid B and resid 13 and name HN )) ((segid B and resid 30 and name HB* )) 1.80 0.00 3.14
assign ((segid B and resid 13 and name HN )) ((segid B and resid 31 and name HB* )) 1.80 0.00 3.01
assign ((segid B and resid 13 and name HN )) ((segid B and resid 31 and name HN )) 1.80 0.00 2.80
assign ((segid B and resid 13 and name HN )) ((segid B and resid 39 and name HB* )) 1.80 0.00 3.20
assign ((segid B and resid 14 and name HA )) ((segid B and resid 15 and name HN )) 1.80 0.00 2.00
assign ((segid B and resid 14 and name HA )) ((segid B and resid 30 and name HA )) 1.80 0.00 2.82
assign ((segid B and resid 14 and name HA )) ((segid B and resid 30 and name HB* )) 1.80 0.00 2.70
assign ((segid B and resid 14 and name HN )) ((segid B and resid 14 and name HB1 )) 1.80 0.00 2.29
assign ((segid B and resid 14 and name HN )) ((segid B and resid 14 and name HB2 )) 1.80 0.00 2.29
assign ((segid B and resid 14 and name HN )) ((segid B and resid 15 and name HN )) 1.80 0.00 3.68
assign ((segid B and resid 15 and name HA )) ((segid B and resid 15 and name HD2* )) 1.80 0.00 1.33
assign ((segid B and resid 15 and name HA )) ((segid B and resid 15 and name HG )) 1.80 0.00 1.91
assign ((segid B and resid 15 and name HA )) ((segid B and resid 16 and name HN )) 1.80 0.00 2.00
assign ((segid B and resid 15 and name HB* )) ((segid B and resid 15 and name HD2* )) 1.80 0.00 1.50
assign ((segid B and resid 15 and name HB* )) ((segid B and resid 29 and name HB )) 1.80 0.00 3.03
assign ((segid B and resid 15 and name HB* )) ((segid B and resid 30 and name HA )) 1.80 0.00 3.27
assign ((segid B and resid 15 and name HB1 )) ((segid B and resid 15 and name HD1* )) 1.80 0.00 1.47
assign ((segid B and resid 15 and name HB1 )) ((segid B and resid 16 and name HN )) 1.80 0.00 2.03
assign ((segid B and resid 15 and name HB2 )) ((segid B and resid 15 and name HD1* )) 1.80 0.00 1.47
assign ((segid B and resid 15 and name HB2 )) ((segid B and resid 16 and name HN )) 1.80 0.00 2.03
assign ((segid B and resid 15 and name HD1* )) ((segid B and resid 29 and name HB )) 1.80 0.00 3.80
assign ((segid B and resid 15 and name HD1* )) ((segid B and resid 29 and name HG2* )) 1.80 0.00 3.80
assign ((segid B and resid 15 and name HD1* )) ((segid B and resid 30 and name HA )) 1.80 0.00 2.80
assign ((segid B and resid 15 and name HD1* )) ((segid B and resid 30 and name HB* )) 1.80 0.00 3.30
assign ((segid B and resid 15 and name HD1* )) ((segid B and resid 31 and name HA )) 1.80 0.00 3.27
assign ((segid B and resid 15 and name HD1* )) ((segid B and resid 31 and name HG* )) 1.80 0.00 2.50
assign ((segid B and resid 15 and name HD1* )) ((segid B and resid 31 and name HN )) 1.80 0.00 3.00
assign ((segid B and resid 15 and name HD1* )) ((segid B and resid 41 and name HA )) 1.80 0.00 3.00
assign ((segid B and resid 15 and name HD1* )) ((segid B and resid 41 and name HD* )) 1.80 0.00 2.00
assign ((segid B and resid 15 and name HD1* )) ((segid B and resid 64 and name HE* )) 1.80 0.00 3.35
assign ((segid B and resid 15 and name HD1* )) ((segid B and resid 64 and name HZ )) 1.80 0.00 3.00
assign ((segid B and resid 15 and name HD2* )) ((segid B and resid 30 and name HA )) 1.80 0.00 3.10
assign ((segid B and resid 15 and name HD2* )) ((segid B and resid 31 and name HD* )) 1.80 0.00 2.24
assign ((segid B and resid 15 and name HD2* )) ((segid B and resid 31 and name HG* )) 1.80 0.00 2.01
assign ((segid B and resid 15 and name HD2* )) ((segid B and resid 41 and name HD* )) 1.80 0.00 3.00
assign ((segid B and resid 15 and name HD2* )) ((segid B and resid 64 and name HD* )) 1.80 0.00 3.80
assign ((segid B and resid 15 and name HD2* )) ((segid B and resid 64 and name HE* )) 1.80 0.00 3.00
assign ((segid B and resid 15 and name HD2* )) ((segid B and resid 64 and name HZ )) 1.80 0.00 3.00
assign ((segid B and resid 15 and name HG )) ((segid B and resid 30 and name HA )) 1.80 0.00 2.79
assign ((segid B and resid 15 and name HN )) ((segid B and resid 15 and name HD2* )) 1.80 0.00 2.82
assign ((segid B and resid 15 and name HN )) ((segid B and resid 15 and name HG )) 1.80 0.00 2.42
assign ((segid B and resid 15 and name HN )) ((segid B and resid 16 and name HN )) 1.80 0.00 1.95
assign ((segid B and resid 15 and name HN )) ((segid B and resid 29 and name HG2* )) 1.80 0.00 3.22
assign ((segid B and resid 15 and name HN )) ((segid B and resid 29 and name HN )) 1.80 0.00 3.53
assign ((segid B and resid 15 and name HN )) ((segid B and resid 30 and name HA )) 1.80 0.00 2.39
assign ((segid B and resid 15 and name HN )) ((segid B and resid 31 and name HN )) 1.80 0.00 3.11
assign ((segid B and resid 16 and name HA )) ((segid B and resid 17 and name HN )) 1.80 0.00 1.60
assign ((segid B and resid 16 and name HB* )) ((segid B and resid 17 and name HN )) 1.80 0.00 1.99
assign ((segid B and resid 16 and name HB* )) ((segid B and resid 29 and name HD1* )) 1.80 0.00 3.80
assign ((segid B and resid 16 and name HD1* )) ((segid B and resid 17 and name HN )) 1.80 0.00 3.00
assign ((segid B and resid 16 and name HD1* )) ((segid B and resid 29 and name HB )) 1.80 0.00 3.24
assign ((segid B and resid 16 and name HD1* )) ((segid B and resid 29 and name HD1* )) 1.80 0.00 2.50
assign ((segid B and resid 16 and name HD1* )) ((segid B and resid 29 and name HN )) 1.80 0.00 3.80
assign ((segid B and resid 16 and name HD2* )) ((segid B and resid 29 and name HB )) 1.80 0.00 2.69
assign ((segid B and resid 16 and name HD2* )) ((segid B and resid 29 and name HD1* )) 1.80 0.00 2.50
assign ((segid B and resid 16 and name HD2* )) ((segid B and resid 29 and name HG2* )) 1.80 0.00 3.80
assign ((segid B and resid 16 and name HD2* )) ((segid B and resid 29 and name HN )) 1.80 0.00 4.25
assign ((segid B and resid 16 and name HN )) ((segid B and resid 17 and name HN )) 1.80 0.00 3.00
assign ((segid B and resid 16 and name HN )) ((segid B and resid 29 and name HB )) 1.80 0.00 3.00
assign ((segid B and resid 16 and name HN )) ((segid B and resid 29 and name HD1* )) 1.80 0.00 3.19
assign ((segid B and resid 16 and name HN )) ((segid B and resid 29 and name HN )) 1.80 0.00 2.80
assign ((segid B and resid 16 and name HN )) ((segid B and resid 30 and name HA )) 1.80 0.00 2.77
assign ((segid B and resid 17 and name HA )) ((segid B and resid 17 and name HG2* )) 1.80 0.00 1.50
assign ((segid B and resid 17 and name HA )) ((segid B and resid 18 and name HN )) 1.80 0.00 2.00
assign ((segid B and resid 17 and name HA )) ((segid B and resid 28 and name HA )) 1.80 0.00 2.72
assign ((segid B and resid 17 and name HG2* )) ((segid B and resid 18 and name HN )) 1.80 0.00 2.22
assign ((segid B and resid 17 and name HG2* )) ((segid B and resid 26 and name HB )) 1.80 0.00 3.60
assign ((segid B and resid 17 and name HG2* )) ((segid B and resid 27 and name HN )) 1.80 0.00 3.11
assign ((segid B and resid 17 and name HG2* )) ((segid B and resid 28 and name HA )) 1.80 0.00 2.49
assign ((segid B and resid 17 and name HG2* )) ((segid B and resid 29 and name HN )) 1.80 0.00 3.38
assign ((segid B and resid 17 and name HN )) ((segid B and resid 17 and name HB )) 1.80 0.00 2.07
assign ((segid B and resid 17 and name HN )) ((segid B and resid 17 and name HG2* )) 1.80 0.00 2.57
assign ((segid B and resid 17 and name HN )) ((segid B and resid 18 and name HN )) 1.80 0.00 3.44
assign ((segid B and resid 18 and name HA )) ((segid B and resid 18 and name HD1* )) 1.80 0.00 2.62
assign ((segid B and resid 18 and name HA )) ((segid B and resid 18 and name HD2* )) 1.80 0.00 1.51
assign ((segid B and resid 18 and name HA )) ((segid B and resid 18 and name HG )) 1.80 0.00 2.27
assign ((segid B and resid 18 and name HA )) ((segid B and resid 19 and name HN )) 1.80 0.00 2.00
assign ((segid B and resid 18 and name HB* )) ((segid B and resid 19 and name HN )) 1.80 0.00 2.71
assign ((segid B and resid 18 and name HB* )) ((segid B and resid 27 and name HN )) 1.80 0.00 3.23
assign ((segid B and resid 18 and name HB1 )) ((segid B and resid 18 and name HD1* )) 1.80 0.00 1.78
assign ((segid B and resid 18 and name HB1 )) ((segid B and resid 18 and name HD2* )) 1.80 0.00 1.84
assign ((segid B and resid 18 and name HB2 )) ((segid B and resid 18 and name HD1* )) 1.80 0.00 1.78
assign ((segid B and resid 18 and name HB2 )) ((segid B and resid 18 and name HD2* )) 1.80 0.00 1.84
assign ((segid B and resid 18 and name HD1* )) ((segid B and resid 27 and name HB1 )) 1.80 0.00 3.00
assign ((segid B and resid 18 and name HD1* )) ((segid B and resid 27 and name HB2 )) 1.80 0.00 3.00
assign ((segid B and resid 18 and name HD1* )) ((segid B and resid 27 and name HE* )) 1.80 0.00 3.59
assign ((segid B and resid 18 and name HD1* )) ((segid B and resid 27 and name HG* )) 1.80 0.00 2.77
assign ((segid B and resid 18 and name HD1* )) ((segid B and resid 29 and name HD1* )) 1.80 0.00 2.31
assign ((segid B and resid 18 and name HD1* )) ((segid B and resid 43 and name HG2* )) 1.80 0.00 2.15
assign ((segid B and resid 18 and name HD2* )) ((segid B and resid 29 and name HD1* )) 1.80 0.00 1.98
assign ((segid B and resid 18 and name HD2* )) ((segid B and resid 29 and name HG1* )) 1.80 0.00 3.38
assign ((segid B and resid 18 and name HD2* )) ((segid B and resid 29 and name HG2* )) 1.80 0.00 3.52
assign ((segid B and resid 18 and name HG )) ((segid B and resid 27 and name HG* )) 1.80 0.00 3.21
assign ((segid B and resid 18 and name HG )) ((segid B and resid 29 and name HG1* )) 1.80 0.00 3.44
assign ((segid B and resid 18 and name HN )) ((segid B and resid 18 and name HD1* )) 1.80 0.00 2.89
assign ((segid B and resid 18 and name HN )) ((segid B and resid 18 and name HD2* )) 1.80 0.00 2.71
assign ((segid B and resid 18 and name HN )) ((segid B and resid 18 and name HG )) 1.80 0.00 2.69
assign ((segid B and resid 18 and name HN )) ((segid B and resid 19 and name HN )) 1.80 0.00 2.50
assign ((segid B and resid 18 and name HN )) ((segid B and resid 28 and name HA )) 1.80 0.00 3.37
assign ((segid B and resid 19 and name HA )) ((segid B and resid 20 and name HN )) 1.80 0.00 1.80
assign ((segid B and resid 19 and name HB* )) ((segid B and resid 20 and name HN )) 1.80 0.00 2.50
assign ((segid B and resid 19 and name HN )) ((segid B and resid 20 and name HN )) 1.80 0.00 3.12
assign ((segid B and resid 19 and name HN )) ((segid B and resid 27 and name HB* )) 1.80 0.00 3.20
assign ((segid B and resid 19 and name HN )) ((segid B and resid 27 and name HN )) 1.80 0.00 3.00
assign ((segid B and resid 20 and name HA )) ((segid B and resid 21 and name HN )) 1.80 0.00 1.68
assign ((segid B and resid 20 and name HA )) ((segid B and resid 26 and name HA )) 1.80 0.00 2.38
assign ((segid B and resid 20 and name HA )) ((segid B and resid 26 and name HG2* )) 1.80 0.00 1.99
assign ((segid B and resid 20 and name HA )) ((segid B and resid 27 and name HN )) 1.80 0.00 2.74
assign ((segid B and resid 20 and name HB1 )) ((segid B and resid 21 and name HN )) 1.80 0.00 2.95
assign ((segid B and resid 20 and name HB1 )) ((segid B and resid 26 and name HG2* )) 1.80 0.00 2.70
assign ((segid B and resid 20 and name HB2 )) ((segid B and resid 21 and name HN )) 1.80 0.00 2.95
assign ((segid B and resid 20 and name HB2 )) ((segid B and resid 26 and name HG2* )) 1.80 0.00 3.00
assign ((segid B and resid 20 and name HG* )) ((segid B and resid 21 and name HN )) 1.80 0.00 2.02
assign ((segid B and resid 20 and name HG* )) ((segid B and resid 24 and name HN )) 1.80 0.00 3.00
assign ((segid B and resid 20 and name HG* )) ((segid B and resid 25 and name HN )) 1.80 0.00 3.30
assign ((segid B and resid 20 and name HG* )) ((segid B and resid 26 and name HG2* )) 1.80 0.00 3.00
assign ((segid B and resid 20 and name HN )) ((segid B and resid 20 and name HB1 )) 1.80 0.00 2.07
assign ((segid B and resid 20 and name HN )) ((segid B and resid 20 and name HB2 )) 1.80 0.00 2.07
assign ((segid B and resid 20 and name HN )) ((segid B and resid 20 and name HG* )) 1.80 0.00 2.79
assign ((segid B and resid 20 and name HN )) ((segid B and resid 21 and name HN )) 1.80 0.00 3.18
assign ((segid B and resid 21 and name HA )) ((segid B and resid 22 and name HN )) 1.80 0.00 1.56
assign ((segid B and resid 21 and name HB1 )) ((segid B and resid 22 and name HN )) 1.80 0.00 2.61
assign ((segid B and resid 21 and name HB2 )) ((segid B and resid 22 and name HN )) 1.80 0.00 2.61
assign ((segid B and resid 21 and name HN )) ((segid B and resid 22 and name HN )) 1.80 0.00 3.27
assign ((segid B and resid 21 and name HN )) ((segid B and resid 25 and name HN )) 1.80 0.00 2.55
assign ((segid B and resid 21 and name HN )) ((segid B and resid 26 and name HA )) 1.80 0.00 2.72
assign ((segid B and resid 21 and name HN )) ((segid B and resid 26 and name HG2* )) 1.80 0.00 3.00
assign ((segid B and resid 22 and name HA )) ((segid B and resid 22 and name HG* )) 1.80 0.00 2.03
assign ((segid B and resid 22 and name HB* )) ((segid B and resid 23 and name HN )) 1.80 0.00 2.47
assign ((segid B and resid 22 and name HG* )) ((segid B and resid 23 and name HN )) 1.80 0.00 3.20
assign ((segid B and resid 22 and name HN )) ((segid B and resid 22 and name HB* )) 1.80 0.00 1.80
assign ((segid B and resid 22 and name HN )) ((segid B and resid 22 and name HG* )) 1.80 0.00 2.50
assign ((segid B and resid 22 and name HN )) ((segid B and resid 23 and name HN )) 1.80 0.00 3.00
assign ((segid B and resid 23 and name HB* )) ((segid B and resid 24 and name HN )) 1.80 0.00 2.23
assign ((segid B and resid 23 and name HN )) ((segid B and resid 23 and name HB1 )) 1.80 0.00 2.46
assign ((segid B and resid 23 and name HN )) ((segid B and resid 23 and name HB2 )) 1.80 0.00 2.46
assign ((segid B and resid 23 and name HN )) ((segid B and resid 24 and name HN )) 1.80 0.00 2.50
assign ((segid B and resid 24 and name HA1 )) ((segid B and resid 48 and name HG* )) 1.80 0.00 3.48
assign ((segid B and resid 24 and name HA2 )) ((segid B and resid 48 and name HG* )) 1.80 0.00 4.25
assign ((segid B and resid 24 and name HN )) ((segid B and resid 25 and name HN )) 1.80 0.00 1.59
assign ((segid B and resid 25 and name HA )) ((segid B and resid 26 and name HN )) 1.80 0.00 1.51
assign ((segid B and resid 25 and name HA )) ((segid B and resid 48 and name HD* )) 1.80 0.00 4.13
assign ((segid B and resid 25 and name HB* )) ((segid B and resid 45 and name HB* )) 1.80 0.00 2.59
assign ((segid B and resid 25 and name HB1 )) ((segid B and resid 26 and name HN )) 1.80 0.00 2.90
assign ((segid B and resid 25 and name HB2 )) ((segid B and resid 26 and name HN )) 1.80 0.00 2.90
assign ((segid B and resid 25 and name HE1 )) ((segid B and resid 47 and name HB* )) 1.80 0.00 4.25
assign ((segid B and resid 25 and name HE1 )) ((segid B and resid 48 and name HD1 )) 1.80 0.00 3.20
assign ((segid B and resid 25 and name HE1 )) ((segid B and resid 48 and name HD2 )) 1.80 0.00 3.20
assign ((segid B and resid 25 and name HE1 )) ((segid B and resid 48 and name HG2 )) 1.80 0.00 3.49
assign ((segid B and resid 25 and name HE1 )) ((segid B and resid 52 and name HE* )) 1.80 0.00 3.67
assign ((segid B and resid 25 and name HH2 )) ((segid B and resid 52 and name HB1 )) 1.80 0.00 3.77
assign ((segid B and resid 25 and name HH2 )) ((segid B and resid 52 and name HB2 )) 1.80 0.00 3.77
assign ((segid B and resid 25 and name HH2 )) ((segid B and resid 52 and name HD* )) 1.80 0.00 2.78
assign ((segid B and resid 25 and name HH2 )) ((segid B and resid 52 and name HG* )) 1.80 0.00 3.80
assign ((segid B and resid 25 and name HH2 )) ((segid B and resid 53 and name HN )) 1.80 0.00 3.41
assign ((segid B and resid 25 and name HN )) ((segid B and resid 25 and name HD1 )) 1.80 0.00 1.86
assign ((segid B and resid 25 and name HN )) ((segid B and resid 26 and name HN )) 1.80 0.00 3.41
assign ((segid B and resid 25 and name HN )) ((segid B and resid 48 and name HD* )) 1.80 0.00 3.29
assign ((segid B and resid 25 and name HZ2 )) ((segid B and resid 52 and name HD1 )) 1.80 0.00 2.63
assign ((segid B and resid 25 and name HZ2 )) ((segid B and resid 52 and name HD2 )) 1.80 0.00 2.63
assign ((segid B and resid 25 and name HZ2 )) ((segid B and resid 52 and name HG* )) 1.80 0.00 2.96
assign ((segid B and resid 25 and name HZ3 )) ((segid B and resid 45 and name HB* )) 1.80 0.00 2.90
assign ((segid B and resid 26 and name HA )) ((segid B and resid 26 and name HG2* )) 1.80 0.00 1.68
assign ((segid B and resid 26 and name HA )) ((segid B and resid 27 and name HN )) 1.80 0.00 1.81
assign ((segid B and resid 26 and name HB )) ((segid B and resid 27 and name HN )) 1.80 0.00 2.51
assign ((segid B and resid 26 and name HG2* )) ((segid B and resid 27 and name HN )) 1.80 0.00 3.03
assign ((segid B and resid 26 and name HN )) ((segid B and resid 26 and name HG2* )) 1.80 0.00 2.10
assign ((segid B and resid 26 and name HN )) ((segid B and resid 45 and name HB* )) 1.80 0.00 3.05
assign ((segid B and resid 26 and name HN )) ((segid B and resid 46 and name HB* )) 1.80 0.00 3.80
assign ((segid B and resid 26 and name HN )) ((segid B and resid 46 and name HN )) 1.80 0.00 2.47
assign ((segid B and resid 27 and name HA )) ((segid B and resid 27 and name HE* )) 1.80 0.00 3.42
assign ((segid B and resid 27 and name HA )) ((segid B and resid 28 and name HN )) 1.80 0.00 2.12
assign ((segid B and resid 27 and name HA )) ((segid B and resid 45 and name HA )) 1.80 0.00 2.61
assign ((segid B and resid 27 and name HA )) ((segid B and resid 45 and name HB* )) 1.80 0.00 2.26
assign ((segid B and resid 27 and name HA )) ((segid B and resid 46 and name HN )) 1.80 0.00 2.95
assign ((segid B and resid 27 and name HB* )) ((segid B and resid 27 and name HD* )) 1.80 0.00 1.71
assign ((segid B and resid 27 and name HB* )) ((segid B and resid 27 and name HE* )) 1.80 0.00 1.57
assign ((segid B and resid 27 and name HB* )) ((segid B and resid 28 and name HN )) 1.80 0.00 2.72
assign ((segid B and resid 27 and name HE* )) ((segid B and resid 45 and name HB* )) 1.80 0.00 3.20
assign ((segid B and resid 27 and name HG* )) ((segid B and resid 27 and name HE* )) 1.80 0.00 1.50
assign ((segid B and resid 27 and name HG* )) ((segid B and resid 28 and name HN )) 1.80 0.00 2.57
assign ((segid B and resid 27 and name HG* )) ((segid B and resid 44 and name HA )) 1.80 0.00 3.33
assign ((segid B and resid 27 and name HG* )) ((segid B and resid 45 and name HB* )) 1.80 0.00 3.20
assign ((segid B and resid 27 and name HG1 )) ((segid B and resid 45 and name HA )) 1.80 0.00 3.80
assign ((segid B and resid 27 and name HG2 )) ((segid B and resid 45 and name HA )) 1.80 0.00 3.80
assign ((segid B and resid 27 and name HN )) ((segid B and resid 27 and name HB* )) 1.80 0.00 1.86
assign ((segid B and resid 27 and name HN )) ((segid B and resid 27 and name HE* )) 1.80 0.00 3.50
assign ((segid B and resid 27 and name HN )) ((segid B and resid 27 and name HG* )) 1.80 0.00 2.95
assign ((segid B and resid 28 and name HA )) ((segid B and resid 29 and name HN )) 1.80 0.00 2.12
assign ((segid B and resid 28 and name HB* )) ((segid B and resid 46 and name HD1 )) 1.80 0.00 4.25
assign ((segid B and resid 28 and name HN )) ((segid B and resid 29 and name HN )) 1.80 0.00 3.41
assign ((segid B and resid 28 and name HN )) ((segid B and resid 44 and name HN )) 1.80 0.00 2.88
assign ((segid B and resid 28 and name HN )) ((segid B and resid 45 and name HA )) 1.80 0.00 2.74
assign ((segid B and resid 28 and name HN )) ((segid B and resid 45 and name HB* )) 1.80 0.00 3.21
assign ((segid B and resid 28 and name HN )) ((segid B and resid 46 and name HD1 )) 1.80 0.00 3.25
assign ((segid B and resid 29 and name HA )) ((segid B and resid 29 and name HD1* )) 1.80 0.00 2.72
assign ((segid B and resid 29 and name HA )) ((segid B and resid 29 and name HG2* )) 1.80 0.00 1.78
assign ((segid B and resid 29 and name HA )) ((segid B and resid 30 and name HN )) 1.80 0.00 1.80
assign ((segid B and resid 29 and name HA )) ((segid B and resid 43 and name HA )) 1.80 0.00 3.40
assign ((segid B and resid 29 and name HA )) ((segid B and resid 43 and name HG2* )) 1.80 0.00 2.48
assign ((segid B and resid 29 and name HA )) ((segid B and resid 44 and name HN )) 1.80 0.00 2.93
assign ((segid B and resid 29 and name HB )) ((segid B and resid 29 and name HD1* )) 1.80 0.00 1.38
assign ((segid B and resid 29 and name HD1* )) ((segid B and resid 64 and name HE* )) 1.80 0.00 3.01
assign ((segid B and resid 29 and name HD1* )) ((segid B and resid 64 and name HZ )) 1.80 0.00 3.19
assign ((segid B and resid 29 and name HD1* )) ((segid B and resid 67 and name HE* )) 1.80 0.00 2.89
assign ((segid B and resid 29 and name HG1* )) ((segid B and resid 30 and name HN )) 1.80 0.00 3.29
assign ((segid B and resid 29 and name HG1* )) ((segid B and resid 43 and name HA )) 1.80 0.00 3.73
assign ((segid B and resid 29 and name HG1* )) ((segid B and resid 43 and name HG2* )) 1.80 0.00 2.50
assign ((segid B and resid 29 and name HG2* )) ((segid B and resid 29 and name HD1* )) 1.80 0.00 1.50
assign ((segid B and resid 29 and name HG2* )) ((segid B and resid 30 and name HN )) 1.80 0.00 2.03
assign ((segid B and resid 29 and name HG2* )) ((segid B and resid 41 and name HA )) 1.80 0.00 3.08
assign ((segid B and resid 29 and name HG2* )) ((segid B and resid 41 and name HB* )) 1.80 0.00 3.10
assign ((segid B and resid 29 and name HG2* )) ((segid B and resid 42 and name HN )) 1.80 0.00 2.29
assign ((segid B and resid 29 and name HG2* )) ((segid B and resid 43 and name HA )) 1.80 0.00 2.43
assign ((segid B and resid 29 and name HG2* )) ((segid B and resid 43 and name HG1* )) 1.80 0.00 2.50
assign ((segid B and resid 29 and name HG2* )) ((segid B and resid 44 and name HN )) 1.80 0.00 3.27
assign ((segid B and resid 29 and name HG2* )) ((segid B and resid 64 and name HD* )) 1.80 0.00 3.63
assign ((segid B and resid 29 and name HG2* )) ((segid B and resid 64 and name HE* )) 1.80 0.00 2.71
assign ((segid B and resid 29 and name HG2* )) ((segid B and resid 64 and name HZ )) 1.80 0.00 1.63
assign ((segid B and resid 29 and name HN )) ((segid B and resid 29 and name HD1* )) 1.80 0.00 2.91
assign ((segid B and resid 30 and name HA )) ((segid B and resid 31 and name HN )) 1.80 0.00 1.80
assign ((segid B and resid 30 and name HB* )) ((segid B and resid 30 and name HD2* )) 1.80 0.00 1.53
assign ((segid B and resid 30 and name HB* )) ((segid B and resid 31 and name HN )) 1.80 0.00 2.04
assign ((segid B and resid 30 and name HB* )) ((segid B and resid 32 and name HG2* )) 1.80 0.00 3.26
assign ((segid B and resid 30 and name HN )) ((segid B and resid 31 and name HN )) 1.80 0.00 3.20
assign ((segid B and resid 30 and name HN )) ((segid B and resid 41 and name HA )) 1.80 0.00 4.03
assign ((segid B and resid 30 and name HN )) ((segid B and resid 42 and name HN )) 1.80 0.00 2.82
assign ((segid B and resid 30 and name HN )) ((segid B and resid 43 and name HA )) 1.80 0.00 3.48
assign ((segid B and resid 30 and name HN )) ((segid B and resid 43 and name HG2* )) 1.80 0.00 3.68
assign ((segid B and resid 31 and name HA )) ((segid B and resid 32 and name HN )) 1.80 0.00 1.85
assign ((segid B and resid 31 and name HA )) ((segid B and resid 41 and name HA )) 1.80 0.00 2.71
assign ((segid B and resid 31 and name HA )) ((segid B and resid 42 and name HN )) 1.80 0.00 2.71
assign ((segid B and resid 31 and name HB* )) ((segid B and resid 31 and name HD* )) 1.80 0.00 1.59
assign ((segid B and resid 31 and name HB* )) ((segid B and resid 39 and name HB* )) 1.80 0.00 2.27
assign ((segid B and resid 31 and name HB1 )) ((segid B and resid 31 and name HD1 )) 1.80 0.00 2.59
assign ((segid B and resid 31 and name HB1 )) ((segid B and resid 31 and name HD2 )) 1.80 0.00 2.59
assign ((segid B and resid 31 and name HB1 )) ((segid B and resid 32 and name HN )) 1.80 0.00 2.96
assign ((segid B and resid 31 and name HB2 )) ((segid B and resid 31 and name HD1 )) 1.80 0.00 2.59
assign ((segid B and resid 31 and name HB2 )) ((segid B and resid 31 and name HD2 )) 1.80 0.00 2.59
assign ((segid B and resid 31 and name HB2 )) ((segid B and resid 32 and name HN )) 1.80 0.00 2.96
assign ((segid B and resid 31 and name HD* )) ((segid B and resid 31 and name HH2* )) 1.80 0.00 3.20
assign ((segid B and resid 31 and name HD* )) ((segid B and resid 39 and name HB* )) 1.80 0.00 2.92
assign ((segid B and resid 31 and name HD* )) ((segid B and resid 41 and name HA )) 1.80 0.00 3.62
assign ((segid B and resid 31 and name HD* )) ((segid B and resid 41 and name HD* )) 1.80 0.00 3.20
assign ((segid B and resid 31 and name HE )) ((segid B and resid 39 and name HB* )) 1.80 0.00 2.94
assign ((segid B and resid 31 and name HG* )) ((segid B and resid 32 and name HN )) 1.80 0.00 3.26
assign ((segid B and resid 31 and name HG* )) ((segid B and resid 41 and name HA )) 1.80 0.00 2.47
assign ((segid B and resid 31 and name HG* )) ((segid B and resid 41 and name HD* )) 1.80 0.00 3.38
assign ((segid B and resid 31 and name HG* )) ((segid B and resid 42 and name HN )) 1.80 0.00 3.37
assign ((segid B and resid 31 and name HH2* )) ((segid B and resid 39 and name HB* )) 1.80 0.00 2.42
assign ((segid B and resid 31 and name HN )) ((segid B and resid 31 and name HG* )) 1.80 0.00 2.24
assign ((segid B and resid 32 and name HA )) ((segid B and resid 32 and name HG1* )) 1.80 0.00 1.81
assign ((segid B and resid 32 and name HA )) ((segid B and resid 32 and name HG2* )) 1.80 0.00 2.03
assign ((segid B and resid 32 and name HA )) ((segid B and resid 33 and name HN )) 1.80 0.00 2.09
assign ((segid B and resid 32 and name HB )) ((segid B and resid 33 and name HN )) 1.80 0.00 3.29
assign ((segid B and resid 32 and name HB )) ((segid B and resid 34 and name HZ )) 1.80 0.00 3.00
assign ((segid B and resid 32 and name HG1* )) ((segid B and resid 33 and name HN )) 1.80 0.00 2.07
assign ((segid B and resid 32 and name HG1* )) ((segid B and resid 34 and name HD* )) 1.80 0.00 2.59
assign ((segid B and resid 32 and name HG1* )) ((segid B and resid 34 and name HZ )) 1.80 0.00 2.26
assign ((segid B and resid 32 and name HG2* )) ((segid B and resid 33 and name HN )) 1.80 0.00 3.05
assign ((segid B and resid 32 and name HG2* )) ((segid B and resid 34 and name HZ )) 1.80 0.00 2.80
assign ((segid B and resid 32 and name HG2* )) ((segid B and resid 42 and name HB* )) 1.80 0.00 2.15
assign ((segid B and resid 32 and name HN )) ((segid B and resid 32 and name HB )) 1.80 0.00 2.38
assign ((segid B and resid 32 and name HN )) ((segid B and resid 32 and name HG1* )) 1.80 0.00 2.67
assign ((segid B and resid 32 and name HN )) ((segid B and resid 32 and name HG2* )) 1.80 0.00 2.01
assign ((segid B and resid 32 and name HN )) ((segid B and resid 33 and name HN )) 1.80 0.00 3.33
assign ((segid B and resid 32 and name HN )) ((segid B and resid 39 and name HA )) 1.80 0.00 3.42
assign ((segid B and resid 32 and name HN )) ((segid B and resid 39 and name HB* )) 1.80 0.00 2.41
assign ((segid B and resid 32 and name HN )) ((segid B and resid 40 and name HN )) 1.80 0.00 2.42
assign ((segid B and resid 32 and name HN )) ((segid B and resid 42 and name HB* )) 1.80 0.00 2.86
assign ((segid B and resid 33 and name HA )) ((segid B and resid 34 and name HN )) 1.80 0.00 1.80
assign ((segid B and resid 33 and name HA )) ((segid B and resid 39 and name HA )) 1.80 0.00 2.61
assign ((segid B and resid 33 and name HA )) ((segid B and resid 39 and name HB* )) 1.80 0.00 2.50
assign ((segid B and resid 33 and name HA )) ((segid B and resid 39 and name HN )) 1.80 0.00 3.11
assign ((segid B and resid 33 and name HA )) ((segid B and resid 40 and name HN )) 1.80 0.00 2.80
assign ((segid B and resid 33 and name HB* )) ((segid B and resid 39 and name HB* )) 1.80 0.00 2.02
assign ((segid B and resid 33 and name HN )) ((segid B and resid 34 and name HN )) 1.80 0.00 3.39
assign ((segid B and resid 33 and name HN )) ((segid B and resid 39 and name HB* )) 1.80 0.00 3.49
assign ((segid B and resid 34 and name HA )) ((segid B and resid 34 and name HD* )) 1.80 0.00 2.55
assign ((segid B and resid 34 and name HA )) ((segid B and resid 35 and name HN )) 1.80 0.00 1.79
assign ((segid B and resid 34 and name HB* )) ((segid B and resid 35 and name HN )) 1.80 0.00 2.50
assign ((segid B and resid 34 and name HD* )) ((segid B and resid 35 and name HN )) 1.80 0.00 3.27
assign ((segid B and resid 34 and name HN )) ((segid B and resid 34 and name HD* )) 1.80 0.00 2.83
assign ((segid B and resid 34 and name HZ )) ((segid B and resid 58 and name HG2* )) 1.80 0.00 3.00
assign ((segid B and resid 35 and name HA )) ((segid B and resid 36 and name HN )) 1.80 0.00 1.80
assign ((segid B and resid 35 and name HB* )) ((segid B and resid 35 and name HD2* )) 1.80 0.00 1.53
assign ((segid B and resid 35 and name HB* )) ((segid B and resid 36 and name HN )) 1.80 0.00 2.20
assign ((segid B and resid 35 and name HN )) ((segid B and resid 36 and name HN )) 1.80 0.00 2.80
assign ((segid B and resid 36 and name HA* )) ((segid B and resid 37 and name HN )) 1.80 0.00 1.60
assign ((segid B and resid 36 and name HN )) ((segid B and resid 37 and name HN )) 1.80 0.00 3.00
assign ((segid B and resid 37 and name HA )) ((segid B and resid 38 and name HD* )) 1.80 0.00 1.54
assign ((segid B and resid 37 and name HB* )) ((segid B and resid 38 and name HD* )) 1.80 0.00 3.20
assign ((segid B and resid 37 and name HB* )) ((segid B and resid 38 and name HG* )) 1.80 0.00 3.20
assign ((segid B and resid 37 and name HN )) ((segid B and resid 37 and name HB* )) 1.80 0.00 1.50
assign ((segid B and resid 38 and name HA )) ((segid B and resid 39 and name HB* )) 1.80 0.00 2.71
assign ((segid B and resid 38 and name HA )) ((segid B and resid 39 and name HN )) 1.80 0.00 2.00
assign ((segid B and resid 38 and name HB* )) ((segid B and resid 39 and name HN )) 1.80 0.00 2.18
assign ((segid B and resid 38 and name HG* )) ((segid B and resid 39 and name HN )) 1.80 0.00 3.58
assign ((segid B and resid 39 and name HA )) ((segid B and resid 40 and name HB* )) 1.80 0.00 3.27
assign ((segid B and resid 39 and name HA )) ((segid B and resid 40 and name HN )) 1.80 0.00 1.87
assign ((segid B and resid 39 and name HB* )) ((segid B and resid 40 and name HN )) 1.80 0.00 1.91
assign ((segid B and resid 39 and name HN )) ((segid B and resid 39 and name HB* )) 1.80 0.00 1.43
assign ((segid B and resid 39 and name HN )) ((segid B and resid 40 and name HN )) 1.80 0.00 3.22
assign ((segid B and resid 40 and name HA )) ((segid B and resid 40 and name HD* )) 1.80 0.00 2.80
assign ((segid B and resid 40 and name HA )) ((segid B and resid 41 and name HN )) 1.80 0.00 1.67
assign ((segid B and resid 40 and name HB* )) ((segid B and resid 40 and name HE* )) 1.80 0.00 2.39
assign ((segid B and resid 40 and name HB* )) ((segid B and resid 41 and name HN )) 1.80 0.00 2.08
assign ((segid B and resid 40 and name HD* )) ((segid B and resid 41 and name HN )) 1.80 0.00 3.30
assign ((segid B and resid 40 and name HD* )) ((segid B and resid 60 and name HA )) 1.80 0.00 3.49
assign ((segid B and resid 40 and name HD* )) ((segid B and resid 61 and name HN )) 1.80 0.00 3.47
assign ((segid B and resid 40 and name HE* )) ((segid B and resid 60 and name HA )) 1.80 0.00 3.00
assign ((segid B and resid 40 and name HE* )) ((segid B and resid 61 and name HN )) 1.80 0.00 3.00
assign ((segid B and resid 40 and name HG* )) ((segid B and resid 40 and name HE* )) 1.80 0.00 1.57
assign ((segid B and resid 40 and name HG* )) ((segid B and resid 60 and name HA )) 1.80 0.00 2.97
assign ((segid B and resid 40 and name HG1 )) ((segid B and resid 41 and name HN )) 1.80 0.00 3.48
assign ((segid B and resid 40 and name HG2 )) ((segid B and resid 41 and name HN )) 1.80 0.00 3.48
assign ((segid B and resid 40 and name HN )) ((segid B and resid 40 and name HB* )) 1.80 0.00 2.12
assign ((segid B and resid 40 and name HN )) ((segid B and resid 40 and name HD* )) 1.80 0.00 3.15
assign ((segid B and resid 41 and name HA )) ((segid B and resid 41 and name HD* )) 1.80 0.00 2.89
assign ((segid B and resid 41 and name HA )) ((segid B and resid 42 and name HN )) 1.80 0.00 1.92
assign ((segid B and resid 41 and name HB* )) ((segid B and resid 59 and name HN )) 1.80 0.00 3.78
assign ((segid B and resid 41 and name HB* )) ((segid B and resid 64 and name HZ )) 1.80 0.00 3.60
assign ((segid B and resid 41 and name HB1 )) ((segid B and resid 42 and name HN )) 1.80 0.00 3.13
assign ((segid B and resid 41 and name HB1 )) ((segid B and resid 59 and name HD1* )) 1.80 0.00 3.20
assign ((segid B and resid 41 and name HB2 )) ((segid B and resid 42 and name HN )) 1.80 0.00 3.13
assign ((segid B and resid 41 and name HB2 )) ((segid B and resid 59 and name HD1* )) 1.80 0.00 3.90
assign ((segid B and resid 41 and name HD* )) ((segid B and resid 42 and name HN )) 1.80 0.00 3.07
assign ((segid B and resid 41 and name HD* )) ((segid B and resid 61 and name HA )) 1.80 0.00 2.60
assign ((segid B and resid 41 and name HD* )) ((segid B and resid 64 and name HA )) 1.80 0.00 3.76
assign ((segid B and resid 41 and name HN )) ((segid B and resid 41 and name HB1 )) 1.80 0.00 2.41
assign ((segid B and resid 41 and name HN )) ((segid B and resid 41 and name HB2 )) 1.80 0.00 2.41
assign ((segid B and resid 41 and name HN )) ((segid B and resid 41 and name HD* )) 1.80 0.00 2.22
assign ((segid B and resid 41 and name HN )) ((segid B and resid 42 and name HN )) 1.80 0.00 3.27
assign ((segid B and resid 41 and name HN )) ((segid B and resid 59 and name HN )) 1.80 0.00 3.84
assign ((segid B and resid 42 and name HA )) ((segid B and resid 43 and name HN )) 1.80 0.00 1.95
assign ((segid B and resid 42 and name HA )) ((segid B and resid 57 and name HG2* )) 1.80 0.00 3.46
assign ((segid B and resid 42 and name HA )) ((segid B and resid 58 and name HA )) 1.80 0.00 2.63
assign ((segid B and resid 42 and name HA )) ((segid B and resid 58 and name HG2* )) 1.80 0.00 2.35
assign ((segid B and resid 42 and name HA )) ((segid B and resid 59 and name HD1* )) 1.80 0.00 3.56
assign ((segid B and resid 42 and name HA )) ((segid B and resid 59 and name HG )) 1.80 0.00 3.71
assign ((segid B and resid 42 and name HA )) ((segid B and resid 59 and name HN )) 1.80 0.00 3.13
assign ((segid B and resid 42 and name HB* )) ((segid B and resid 59 and name HN )) 1.80 0.00 4.07
assign ((segid B and resid 42 and name HN )) ((segid B and resid 58 and name HA )) 1.80 0.00 4.25
assign ((segid B and resid 43 and name HA )) ((segid B and resid 43 and name HD1* )) 1.80 0.00 2.51
assign ((segid B and resid 43 and name HA )) ((segid B and resid 43 and name HG2* )) 1.80 0.00 1.83
assign ((segid B and resid 43 and name HA )) ((segid B and resid 44 and name HN )) 1.80 0.00 1.80
assign ((segid B and resid 43 and name HA )) ((segid B and resid 57 and name HG2* )) 1.80 0.00 3.71
assign ((segid B and resid 43 and name HB )) ((segid B and resid 43 and name HD1* )) 1.80 0.00 1.67
assign ((segid B and resid 43 and name HB )) ((segid B and resid 57 and name HG2* )) 1.80 0.00 1.83
assign ((segid B and resid 43 and name HB )) ((segid B and resid 57 and name HN )) 1.80 0.00 2.88
assign ((segid B and resid 43 and name HD1* )) ((segid B and resid 57 and name HG2* )) 1.80 0.00 2.50
assign ((segid B and resid 43 and name HD1* )) ((segid B and resid 58 and name HA )) 1.80 0.00 4.25
assign ((segid B and resid 43 and name HD1* )) ((segid B and resid 59 and name HD2* )) 1.80 0.00 3.03
assign ((segid B and resid 43 and name HD1* )) ((segid B and resid 64 and name HD* )) 1.80 0.00 3.80
assign ((segid B and resid 43 and name HD1* )) ((segid B and resid 64 and name HE* )) 1.80 0.00 2.69
assign ((segid B and resid 43 and name HD1* )) ((segid B and resid 67 and name HE* )) 1.80 0.00 2.45
assign ((segid B and resid 43 and name HG1* )) ((segid B and resid 57 and name HG2* )) 1.80 0.00 2.01
assign ((segid B and resid 43 and name HG1* )) ((segid B and resid 57 and name HN )) 1.80 0.00 3.79
assign ((segid B and resid 43 and name HG2* )) ((segid B and resid 43 and name HG1* )) 1.80 0.00 1.59
assign ((segid B and resid 43 and name HG2* )) ((segid B and resid 44 and name HN )) 1.80 0.00 2.25
assign ((segid B and resid 43 and name HG2* )) ((segid B and resid 57 and name HN )) 1.80 0.00 4.25
assign ((segid B and resid 43 and name HG2* )) ((segid B and resid 64 and name HE* )) 1.80 0.00 4.25
assign ((segid B and resid 43 and name HN )) ((segid B and resid 43 and name HD1* )) 1.80 0.00 2.60
assign ((segid B and resid 43 and name HN )) ((segid B and resid 43 and name HG11 )) 1.80 0.00 2.92
assign ((segid B and resid 43 and name HN )) ((segid B and resid 43 and name HG12 )) 1.80 0.00 2.92
assign ((segid B and resid 43 and name HN )) ((segid B and resid 43 and name HG2* )) 1.80 0.00 2.57
assign ((segid B and resid 43 and name HN )) ((segid B and resid 57 and name HG2* )) 1.80 0.00 2.02
assign ((segid B and resid 43 and name HN )) ((segid B and resid 57 and name HN )) 1.80 0.00 2.53
assign ((segid B and resid 43 and name HN )) ((segid B and resid 58 and name HA )) 1.80 0.00 2.82
assign ((segid B and resid 43 and name HN )) ((segid B and resid 58 and name HG2* )) 1.80 0.00 3.49
assign ((segid B and resid 43 and name HN )) ((segid B and resid 59 and name HD1* )) 1.80 0.00 3.55
assign ((segid B and resid 43 and name HN )) ((segid B and resid 59 and name HG )) 1.80 0.00 3.81
assign ((segid B and resid 43 and name HN )) ((segid B and resid 59 and name HN )) 1.80 0.00 3.79
assign ((segid B and resid 44 and name HA )) ((segid B and resid 45 and name HN )) 1.80 0.00 2.00
assign ((segid B and resid 44 and name HB* )) ((segid B and resid 45 and name HN )) 1.80 0.00 2.00
assign ((segid B and resid 44 and name HN )) ((segid B and resid 45 and name HN )) 1.80 0.00 3.60
assign ((segid B and resid 45 and name HA )) ((segid B and resid 46 and name HN )) 1.80 0.00 2.10
assign ((segid B and resid 45 and name HB* )) ((segid B and resid 46 and name HN )) 1.80 0.00 1.89
assign ((segid B and resid 45 and name HB* )) ((segid B and resid 54 and name HA* )) 1.80 0.00 2.50
assign ((segid B and resid 45 and name HB* )) ((segid B and resid 55 and name HN )) 1.80 0.00 4.25
assign ((segid B and resid 45 and name HN )) ((segid B and resid 45 and name HB* )) 1.80 0.00 1.62
assign ((segid B and resid 46 and name HA )) ((segid B and resid 47 and name HN )) 1.80 0.00 2.01
assign ((segid B and resid 46 and name HB* )) ((segid B and resid 47 and name HN )) 1.80 0.00 2.30
assign ((segid B and resid 46 and name HN )) ((segid B and resid 46 and name HD1 )) 1.80 0.00 3.25
assign ((segid B and resid 46 and name HN )) ((segid B and resid 47 and name HN )) 1.80 0.00 3.67
assign ((segid B and resid 49 and name HA )) ((segid B and resid 50 and name HN )) 1.80 0.00 2.00
assign ((segid B and resid 49 and name HB* )) ((segid B and resid 50 and name HN )) 1.80 0.00 2.20
assign ((segid B and resid 49 and name HN )) ((segid B and resid 50 and name HN )) 1.80 0.00 3.00
assign ((segid B and resid 50 and name HA )) ((segid B and resid 50 and name HD* )) 1.80 0.00 3.29
assign ((segid B and resid 50 and name HA )) ((segid B and resid 51 and name HN )) 1.80 0.00 2.00
assign ((segid B and resid 50 and name HN )) ((segid B and resid 51 and name HN )) 1.80 0.00 2.66
assign ((segid B and resid 51 and name HA )) ((segid B and resid 51 and name HG2* )) 1.80 0.00 1.81
assign ((segid B and resid 51 and name HA )) ((segid B and resid 52 and name HN )) 1.80 0.00 2.10
assign ((segid B and resid 51 and name HB )) ((segid B and resid 52 and name HN )) 1.80 0.00 3.28
assign ((segid B and resid 51 and name HG2* )) ((segid B and resid 52 and name HN )) 1.80 0.00 2.50
assign ((segid B and resid 51 and name HN )) ((segid B and resid 51 and name HG2* )) 1.80 0.00 2.20
assign ((segid B and resid 51 and name HN )) ((segid B and resid 52 and name HN )) 1.80 0.00 3.20
assign ((segid B and resid 52 and name HA )) ((segid B and resid 52 and name HD* )) 1.80 0.00 2.67
assign ((segid B and resid 52 and name HA )) ((segid B and resid 52 and name HG* )) 1.80 0.00 1.98
assign ((segid B and resid 52 and name HA )) ((segid B and resid 53 and name HN )) 1.80 0.00 1.80
assign ((segid B and resid 52 and name HB* )) ((segid B and resid 52 and name HD1 )) 1.80 0.00 1.65
assign ((segid B and resid 52 and name HB* )) ((segid B and resid 52 and name HD2 )) 1.80 0.00 1.65
assign ((segid B and resid 52 and name HB1 )) ((segid B and resid 52 and name HD* )) 1.80 0.00 1.72
assign ((segid B and resid 52 and name HB1 )) ((segid B and resid 52 and name HE* )) 1.80 0.00 3.67
assign ((segid B and resid 52 and name HB1 )) ((segid B and resid 53 and name HN )) 1.80 0.00 2.54
assign ((segid B and resid 52 and name HB2 )) ((segid B and resid 52 and name HD* )) 1.80 0.00 1.72
assign ((segid B and resid 52 and name HB2 )) ((segid B and resid 52 and name HE* )) 1.80 0.00 3.67
assign ((segid B and resid 52 and name HB2 )) ((segid B and resid 53 and name HN )) 1.80 0.00 2.24
assign ((segid B and resid 52 and name HD1 )) ((segid B and resid 52 and name HE* )) 1.80 0.00 1.51
assign ((segid B and resid 52 and name HD2 )) ((segid B and resid 52 and name HE* )) 1.80 0.00 1.51
assign ((segid B and resid 52 and name HG* )) ((segid B and resid 52 and name HE* )) 1.80 0.00 1.31
assign ((segid B and resid 52 and name HG* )) ((segid B and resid 53 and name HN )) 1.80 0.00 3.00
assign ((segid B and resid 52 and name HN )) ((segid B and resid 52 and name HG* )) 1.80 0.00 2.41
assign ((segid B and resid 52 and name HN )) ((segid B and resid 53 and name HN )) 1.80 0.00 3.80
assign ((segid B and resid 53 and name HA )) ((segid B and resid 54 and name HN )) 1.80 0.00 1.80
assign ((segid B and resid 53 and name HB* )) ((segid B and resid 53 and name HE* )) 1.80 0.00 1.92
assign ((segid B and resid 53 and name HB1 )) ((segid B and resid 54 and name HN )) 1.80 0.00 3.02
assign ((segid B and resid 53 and name HB2 )) ((segid B and resid 54 and name HN )) 1.80 0.00 3.02
assign ((segid B and resid 53 and name HG* )) ((segid B and resid 53 and name HE* )) 1.80 0.00 2.05
assign ((segid B and resid 53 and name HG* )) ((segid B and resid 54 and name HN )) 1.80 0.00 2.90
assign ((segid B and resid 53 and name HN )) ((segid B and resid 53 and name HG* )) 1.80 0.00 2.30
assign ((segid B and resid 53 and name HN )) ((segid B and resid 54 and name HN )) 1.80 0.00 3.48
assign ((segid B and resid 54 and name HA1 )) ((segid B and resid 55 and name HN )) 1.80 0.00 1.95
assign ((segid B and resid 54 and name HA2 )) ((segid B and resid 55 and name HN )) 1.80 0.00 1.95
assign ((segid B and resid 54 and name HN )) ((segid B and resid 55 and name HN )) 1.80 0.00 3.44
assign ((segid B and resid 55 and name HA )) ((segid B and resid 55 and name HD* )) 1.80 0.00 2.67
assign ((segid B and resid 55 and name HA )) ((segid B and resid 55 and name HG* )) 1.80 0.00 1.67
assign ((segid B and resid 55 and name HA )) ((segid B and resid 56 and name HN )) 1.80 0.00 1.83
assign ((segid B and resid 55 and name HB* )) ((segid B and resid 55 and name HD* )) 1.80 0.00 1.50
assign ((segid B and resid 55 and name HB* )) ((segid B and resid 55 and name HE* )) 1.80 0.00 3.51
assign ((segid B and resid 55 and name HB* )) ((segid B and resid 56 and name HN )) 1.80 0.00 2.05
assign ((segid B and resid 55 and name HG* )) ((segid B and resid 56 and name HN )) 1.80 0.00 2.69
assign ((segid B and resid 55 and name HG1 )) ((segid B and resid 55 and name HE* )) 1.80 0.00 1.49
assign ((segid B and resid 55 and name HG2 )) ((segid B and resid 55 and name HE* )) 1.80 0.00 1.49
assign ((segid B and resid 55 and name HN )) ((segid B and resid 55 and name HB* )) 1.80 0.00 1.63
assign ((segid B and resid 55 and name HN )) ((segid B and resid 55 and name HD* )) 1.80 0.00 2.78
assign ((segid B and resid 55 and name HN )) ((segid B and resid 55 and name HG* )) 1.80 0.00 2.07
assign ((segid B and resid 55 and name HN )) ((segid B and resid 56 and name HN )) 1.80 0.00 3.34
assign ((segid B and resid 56 and name HA* )) ((segid B and resid 57 and name HN )) 1.80 0.00 1.70
assign ((segid B and resid 56 and name HN )) ((segid B and resid 57 and name HN )) 1.80 0.00 3.17
assign ((segid B and resid 57 and name HA )) ((segid B and resid 57 and name HG1* )) 1.80 0.00 2.12
assign ((segid B and resid 57 and name HA )) ((segid B and resid 58 and name HN )) 1.80 0.00 1.80
assign ((segid B and resid 57 and name HB )) ((segid B and resid 57 and name HD1* )) 1.80 0.00 1.41
assign ((segid B and resid 57 and name HB )) ((segid B and resid 58 and name HN )) 1.80 0.00 2.67
assign ((segid B and resid 57 and name HD1* )) ((segid B and resid 58 and name HN )) 1.80 0.00 2.53
assign ((segid B and resid 57 and name HG1* )) ((segid B and resid 58 and name HN )) 1.80 0.00 1.82
assign ((segid B and resid 57 and name HG2* )) ((segid B and resid 57 and name HD1* )) 1.80 0.00 2.22
assign ((segid B and resid 57 and name HG2* )) ((segid B and resid 57 and name HG1* )) 1.80 0.00 1.65
assign ((segid B and resid 57 and name HG2* )) ((segid B and resid 58 and name HN )) 1.80 0.00 2.37
assign ((segid B and resid 57 and name HN )) ((segid B and resid 57 and name HB )) 1.80 0.00 2.36
assign ((segid B and resid 57 and name HN )) ((segid B and resid 57 and name HG1* )) 1.80 0.00 3.32
assign ((segid B and resid 57 and name HN )) ((segid B and resid 57 and name HG2* )) 1.80 0.00 1.58
assign ((segid B and resid 57 and name HN )) ((segid B and resid 58 and name HN )) 1.80 0.00 3.30
assign ((segid B and resid 58 and name HA )) ((segid B and resid 58 and name HG2* )) 1.80 0.00 1.92
assign ((segid B and resid 58 and name HA )) ((segid B and resid 59 and name HN )) 1.80 0.00 2.01
assign ((segid B and resid 58 and name HB )) ((segid B and resid 59 and name HN )) 1.80 0.00 2.80
assign ((segid B and resid 58 and name HG2* )) ((segid B and resid 59 and name HN )) 1.80 0.00 3.00
assign ((segid B and resid 58 and name HN )) ((segid B and resid 58 and name HB )) 1.80 0.00 2.28
assign ((segid B and resid 58 and name HN )) ((segid B and resid 58 and name HG2* )) 1.80 0.00 2.45
assign ((segid B and resid 58 and name HN )) ((segid B and resid 59 and name HN )) 1.80 0.00 3.28
assign ((segid B and resid 59 and name HA )) ((segid B and resid 59 and name HD1* )) 1.80 0.00 2.50
assign ((segid B and resid 59 and name HA )) ((segid B and resid 59 and name HD2* )) 1.80 0.00 1.80
assign ((segid B and resid 59 and name HA )) ((segid B and resid 60 and name HN )) 1.80 0.00 1.68
assign ((segid B and resid 59 and name HB* )) ((segid B and resid 59 and name HD1* )) 1.80 0.00 1.41
assign ((segid B and resid 59 and name HB* )) ((segid B and resid 59 and name HD2* )) 1.80 0.00 1.39
assign ((segid B and resid 59 and name HD1* )) ((segid B and resid 60 and name HN )) 1.80 0.00 3.79
assign ((segid B and resid 59 and name HD2* )) ((segid B and resid 60 and name HN )) 1.80 0.00 2.90
assign ((segid B and resid 59 and name HN )) ((segid B and resid 59 and name HD1* )) 1.80 0.00 2.93
assign ((segid B and resid 59 and name HN )) ((segid B and resid 59 and name HD2* )) 1.80 0.00 3.05
assign ((segid B and resid 59 and name HN )) ((segid B and resid 59 and name HG )) 1.80 0.00 2.42
assign ((segid B and resid 60 and name HA )) ((segid B and resid 61 and name HN )) 1.80 0.00 1.81
assign ((segid B and resid 60 and name HB* )) ((segid B and resid 61 and name HN )) 1.80 0.00 1.83
assign ((segid B and resid 61 and name HA )) ((segid B and resid 62 and name HN )) 1.80 0.00 2.00
assign ((segid B and resid 61 and name HA )) ((segid B and resid 64 and name HB* )) 1.80 0.00 3.09
assign ((segid B and resid 61 and name HA )) ((segid B and resid 65 and name HN )) 1.80 0.00 3.44
assign ((segid B and resid 61 and name HB* )) ((segid B and resid 61 and name HD2* )) 1.80 0.00 1.39
assign ((segid B and resid 61 and name HB* )) ((segid B and resid 62 and name HN )) 1.80 0.00 1.72
assign ((segid B and resid 61 and name HD2* )) ((segid B and resid 62 and name HN )) 1.80 0.00 3.32
assign ((segid B and resid 61 and name HN )) ((segid B and resid 61 and name HB* )) 1.80 0.00 1.86
assign ((segid B and resid 61 and name HN )) ((segid B and resid 62 and name HN )) 1.80 0.00 2.07
assign ((segid B and resid 62 and name HA )) ((segid B and resid 62 and name HG1 )) 1.80 0.00 2.55
assign ((segid B and resid 62 and name HA )) ((segid B and resid 62 and name HG2 )) 1.80 0.00 2.55
assign ((segid B and resid 62 and name HA )) ((segid B and resid 63 and name HN )) 1.80 0.00 2.00
assign ((segid B and resid 62 and name HA )) ((segid B and resid 65 and name HB* )) 1.80 0.00 2.45
assign ((segid B and resid 62 and name HA )) ((segid B and resid 65 and name HN )) 1.80 0.00 3.05
assign ((segid B and resid 62 and name HA )) ((segid B and resid 66 and name HN )) 1.80 0.00 2.90
assign ((segid B and resid 62 and name HB* )) ((segid B and resid 63 and name HN )) 1.80 0.00 2.43
assign ((segid B and resid 62 and name HG1 )) ((segid B and resid 63 and name HN )) 1.80 0.00 3.34
assign ((segid B and resid 62 and name HG2 )) ((segid B and resid 63 and name HN )) 1.80 0.00 3.34
assign ((segid B and resid 62 and name HN )) ((segid B and resid 62 and name HB* )) 1.80 0.00 1.51
assign ((segid B and resid 62 and name HN )) ((segid B and resid 62 and name HG1 )) 1.80 0.00 2.86
assign ((segid B and resid 62 and name HN )) ((segid B and resid 62 and name HG2 )) 1.80 0.00 3.20
assign ((segid B and resid 62 and name HN )) ((segid B and resid 63 and name HN )) 1.80 0.00 2.19
assign ((segid B and resid 63 and name HA )) ((segid B and resid 63 and name HG* )) 1.80 0.00 2.20
assign ((segid B and resid 63 and name HA )) ((segid B and resid 64 and name HN )) 1.80 0.00 2.00
assign ((segid B and resid 63 and name HA )) ((segid B and resid 66 and name HB )) 1.80 0.00 2.75
assign ((segid B and resid 63 and name HA )) ((segid B and resid 66 and name HG2* )) 1.80 0.00 3.02
assign ((segid B and resid 63 and name HA )) ((segid B and resid 66 and name HN )) 1.80 0.00 2.69
assign ((segid B and resid 63 and name HA )) ((segid B and resid 67 and name HN )) 1.80 0.00 3.58
assign ((segid B and resid 63 and name HB* )) ((segid B and resid 64 and name HN )) 1.80 0.00 2.02
assign ((segid B and resid 63 and name HG* )) ((segid B and resid 64 and name HN )) 1.80 0.00 3.24
assign ((segid B and resid 63 and name HN )) ((segid B and resid 64 and name HB* )) 1.80 0.00 2.96
assign ((segid B and resid 63 and name HN )) ((segid B and resid 64 and name HN )) 1.80 0.00 2.47
assign ((segid B and resid 64 and name HA )) ((segid B and resid 64 and name HD* )) 1.80 0.00 2.35
assign ((segid B and resid 64 and name HA )) ((segid B and resid 64 and name HE* )) 1.80 0.00 3.36
assign ((segid B and resid 64 and name HA )) ((segid B and resid 65 and name HN )) 1.80 0.00 2.00
assign ((segid B and resid 64 and name HA )) ((segid B and resid 67 and name HE* )) 1.80 0.00 2.00
assign ((segid B and resid 64 and name HA )) ((segid B and resid 67 and name HB* )) 1.80 0.00 2.50
assign ((segid B and resid 64 and name HA )) ((segid B and resid 67 and name HN )) 1.80 0.00 3.05
assign ((segid B and resid 64 and name HA )) ((segid B and resid 68 and name HN )) 1.80 0.00 3.42
assign ((segid B and resid 64 and name HB* )) ((segid B and resid 65 and name HN )) 1.80 0.00 2.18
assign ((segid B and resid 64 and name HD* )) ((segid B and resid 64 and name HZ )) 1.80 0.00 2.60
assign ((segid B and resid 64 and name HD* )) ((segid B and resid 65 and name HN )) 1.80 0.00 3.44
assign ((segid B and resid 64 and name HD* )) ((segid B and resid 67 and name HE* )) 1.80 0.00 1.33
assign ((segid B and resid 64 and name HD* )) ((segid B and resid 68 and name HG2* )) 1.80 0.00 2.90
assign ((segid B and resid 64 and name HE* )) ((segid B and resid 67 and name HE* )) 1.80 0.00 1.37
assign ((segid B and resid 64 and name HN )) ((segid B and resid 64 and name HB* )) 1.80 0.00 1.96
assign ((segid B and resid 64 and name HN )) ((segid B and resid 64 and name HD* )) 1.80 0.00 3.22
assign ((segid B and resid 64 and name HN )) ((segid B and resid 65 and name HN )) 1.80 0.00 2.20
assign ((segid B and resid 65 and name HA )) ((segid B and resid 65 and name HE21 )) 1.80 0.00 3.02
assign ((segid B and resid 65 and name HA )) ((segid B and resid 65 and name HE22 )) 1.80 0.00 3.06
assign ((segid B and resid 65 and name HA )) ((segid B and resid 65 and name HG1 )) 1.80 0.00 2.38
assign ((segid B and resid 65 and name HA )) ((segid B and resid 65 and name HG2 )) 1.80 0.00 2.38
assign ((segid B and resid 65 and name HA )) ((segid B and resid 66 and name HN )) 1.80 0.00 1.80
assign ((segid B and resid 65 and name HA )) ((segid B and resid 68 and name HB )) 1.80 0.00 2.26
assign ((segid B and resid 65 and name HA )) ((segid B and resid 68 and name HG1* )) 1.80 0.00 2.43
assign ((segid B and resid 65 and name HA )) ((segid B and resid 68 and name HG2* )) 1.80 0.00 1.93
assign ((segid B and resid 65 and name HA )) ((segid B and resid 68 and name HN )) 1.80 0.00 2.50
assign ((segid B and resid 65 and name HA )) ((segid B and resid 69 and name HN )) 1.80 0.00 2.97
assign ((segid B and resid 65 and name HB* )) ((segid B and resid 65 and name HE21 )) 1.80 0.00 2.99
assign ((segid B and resid 65 and name HB* )) ((segid B and resid 66 and name HN )) 1.80 0.00 1.96
assign ((segid B and resid 65 and name HE21 )) ((segid B and resid 68 and name HB )) 1.80 0.00 2.95
assign ((segid B and resid 65 and name HE21 )) ((segid B and resid 68 and name HG1* )) 1.80 0.00 3.33
assign ((segid B and resid 65 and name HE22 )) ((segid B and resid 68 and name HB )) 1.80 0.00 3.14
assign ((segid B and resid 65 and name HE22 )) ((segid B and resid 68 and name HG1* )) 1.80 0.00 2.47
assign ((segid B and resid 65 and name HG1 )) ((segid B and resid 65 and name HE21 )) 1.80 0.00 1.75
assign ((segid B and resid 65 and name HG1 )) ((segid B and resid 66 and name HN )) 1.80 0.00 3.62
assign ((segid B and resid 65 and name HG2 )) ((segid B and resid 65 and name HE21 )) 1.80 0.00 1.75
assign ((segid B and resid 65 and name HG2 )) ((segid B and resid 66 and name HN )) 1.80 0.00 3.62
assign ((segid B and resid 65 and name HN )) ((segid B and resid 65 and name HB1 )) 1.80 0.00 1.83
assign ((segid B and resid 65 and name HN )) ((segid B and resid 65 and name HB2 )) 1.80 0.00 1.83
assign ((segid B and resid 65 and name HN )) ((segid B and resid 65 and name HG* )) 1.80 0.00 3.08
assign ((segid B and resid 65 and name HN )) ((segid B and resid 66 and name HN )) 1.80 0.00 1.92
assign ((segid B and resid 66 and name HA )) ((segid B and resid 66 and name HG2* )) 1.80 0.00 1.51
assign ((segid B and resid 66 and name HA )) ((segid B and resid 67 and name HN )) 1.80 0.00 1.80
assign ((segid B and resid 66 and name HA )) ((segid B and resid 69 and name HB* )) 1.80 0.00 2.80
assign ((segid B and resid 66 and name HA )) ((segid B and resid 69 and name HN )) 1.80 0.00 2.72
assign ((segid B and resid 66 and name HA )) ((segid B and resid 70 and name HN )) 1.80 0.00 3.00
assign ((segid B and resid 66 and name HB )) ((segid B and resid 67 and name HN )) 1.80 0.00 2.53
assign ((segid B and resid 66 and name HG2* )) ((segid B and resid 67 and name HN )) 1.80 0.00 2.14
assign ((segid B and resid 66 and name HN )) ((segid B and resid 66 and name HB )) 1.80 0.00 1.93
assign ((segid B and resid 66 and name HN )) ((segid B and resid 66 and name HG2* )) 1.80 0.00 2.35
assign ((segid B and resid 66 and name HN )) ((segid B and resid 67 and name HN )) 1.80 0.00 1.96
assign ((segid B and resid 67 and name HA )) ((segid B and resid 68 and name HN )) 1.80 0.00 1.80
assign ((segid B and resid 67 and name HA )) ((segid B and resid 70 and name HB* )) 1.80 0.00 1.97
assign ((segid B and resid 67 and name HA )) ((segid B and resid 70 and name HN )) 1.80 0.00 2.46
assign ((segid B and resid 67 and name HA )) ((segid B and resid 71 and name HN )) 1.80 0.00 2.48
assign ((segid B and resid 67 and name HB* )) ((segid B and resid 68 and name HN )) 1.80 0.00 2.69
assign ((segid B and resid 67 and name HE* )) ((segid B and resid 68 and name HG2* )) 1.80 0.00 1.60
assign ((segid B and resid 67 and name HE* )) ((segid B and resid 68 and name HN )) 1.80 0.00 2.38
assign ((segid B and resid 67 and name HG1 )) ((segid B and resid 68 and name HN )) 1.80 0.00 3.35
assign ((segid B and resid 67 and name HG2 )) ((segid B and resid 68 and name HN )) 1.80 0.00 3.35
assign ((segid B and resid 67 and name HN )) ((segid B and resid 67 and name HB* )) 1.80 0.00 1.98
assign ((segid B and resid 67 and name HN )) ((segid B and resid 67 and name HG1 )) 1.80 0.00 3.03
assign ((segid B and resid 67 and name HN )) ((segid B and resid 67 and name HG2 )) 1.80 0.00 3.03
assign ((segid B and resid 67 and name HN )) ((segid B and resid 68 and name HN )) 1.80 0.00 2.05
assign ((segid B and resid 68 and name HA )) ((segid B and resid 68 and name HG1* )) 1.80 0.00 1.48
assign ((segid B and resid 68 and name HA )) ((segid B and resid 68 and name HG2* )) 1.80 0.00 1.50
assign ((segid B and resid 68 and name HA )) ((segid B and resid 69 and name HN )) 1.80 0.00 1.80
assign ((segid B and resid 68 and name HA )) ((segid B and resid 71 and name HB* )) 1.80 0.00 2.94
assign ((segid B and resid 68 and name HA )) ((segid B and resid 71 and name HN )) 1.80 0.00 2.71
assign ((segid B and resid 68 and name HA )) ((segid B and resid 72 and name HN )) 1.80 0.00 3.37
assign ((segid B and resid 68 and name HB )) ((segid B and resid 69 and name HN )) 1.80 0.00 1.84
assign ((segid B and resid 68 and name HG1* )) ((segid B and resid 69 and name HN )) 1.80 0.00 1.98
assign ((segid B and resid 68 and name HG2* )) ((segid B and resid 69 and name HN )) 1.80 0.00 2.45
assign ((segid B and resid 68 and name HN )) ((segid B and resid 68 and name HB )) 1.80 0.00 1.89
assign ((segid B and resid 68 and name HN )) ((segid B and resid 68 and name HG1* )) 1.80 0.00 2.50
assign ((segid B and resid 68 and name HN )) ((segid B and resid 68 and name HG2* )) 1.80 0.00 1.41
assign ((segid B and resid 68 and name HN )) ((segid B and resid 69 and name HN )) 1.80 0.00 1.81
assign ((segid B and resid 69 and name HA )) ((segid B and resid 70 and name HN )) 1.80 0.00 2.00
assign ((segid B and resid 69 and name HA )) ((segid B and resid 72 and name HB* )) 1.80 0.00 2.40
assign ((segid B and resid 69 and name HA )) ((segid B and resid 72 and name HN )) 1.80 0.00 2.91
assign ((segid B and resid 69 and name HB1 )) ((segid B and resid 70 and name HN )) 1.80 0.00 2.50
assign ((segid B and resid 69 and name HB2 )) ((segid B and resid 70 and name HN )) 1.80 0.00 2.15
assign ((segid B and resid 69 and name HN )) ((segid B and resid 69 and name HB* )) 1.80 0.00 1.33
assign ((segid B and resid 69 and name HN )) ((segid B and resid 70 and name HN )) 1.80 0.00 1.64
assign ((segid B and resid 70 and name HA )) ((segid B and resid 71 and name HN )) 1.80 0.00 2.00
assign ((segid B and resid 70 and name HA )) ((segid B and resid 73 and name HN )) 1.80 0.00 2.60
assign ((segid B and resid 70 and name HB* )) ((segid B and resid 71 and name HN )) 1.80 0.00 1.48
assign ((segid B and resid 70 and name HB* )) ((segid B and resid 73 and name HN )) 1.80 0.00 3.27
assign ((segid B and resid 70 and name HN )) ((segid B and resid 70 and name HB* )) 1.80 0.00 1.50
assign ((segid B and resid 70 and name HN )) ((segid B and resid 71 and name HN )) 1.80 0.00 1.46
assign ((segid B and resid 71 and name HA )) ((segid B and resid 71 and name HD* )) 1.80 0.00 1.70
assign ((segid B and resid 71 and name HA )) ((segid B and resid 72 and name HN )) 1.80 0.00 1.80
assign ((segid B and resid 71 and name HA )) ((segid B and resid 75 and name HB* )) 1.80 0.00 3.19
assign ((segid B and resid 71 and name HB1 )) ((segid B and resid 72 and name HN )) 1.80 0.00 2.57
assign ((segid B and resid 71 and name HB2 )) ((segid B and resid 72 and name HN )) 1.80 0.00 2.57
assign ((segid B and resid 71 and name HD* )) ((segid B and resid 72 and name HN )) 1.80 0.00 3.05
assign ((segid B and resid 71 and name HD* )) ((segid B and resid 75 and name HB* )) 1.80 0.00 3.08
assign ((segid B and resid 71 and name HN )) ((segid B and resid 71 and name HD* )) 1.80 0.00 1.96
assign ((segid B and resid 71 and name HN )) ((segid B and resid 72 and name HN )) 1.80 0.00 1.67
assign ((segid B and resid 72 and name HA )) ((segid B and resid 72 and name HG1 )) 1.80 0.00 2.68
assign ((segid B and resid 72 and name HA )) ((segid B and resid 72 and name HG2 )) 1.80 0.00 2.68
assign ((segid B and resid 72 and name HA )) ((segid B and resid 73 and name HN )) 1.80 0.00 2.06
assign ((segid B and resid 72 and name HB* )) ((segid B and resid 72 and name HD* )) 1.80 0.00 1.47
assign ((segid B and resid 72 and name HB* )) ((segid B and resid 72 and name HE* )) 1.80 0.00 3.27
assign ((segid B and resid 72 and name HB* )) ((segid B and resid 73 and name HN )) 1.80 0.00 2.59
assign ((segid B and resid 72 and name HD* )) ((segid B and resid 73 and name HN )) 1.80 0.00 3.26
assign ((segid B and resid 72 and name HG1 )) ((segid B and resid 72 and name HE* )) 1.80 0.00 1.97
assign ((segid B and resid 72 and name HG1 )) ((segid B and resid 73 and name HN )) 1.80 0.00 3.20
assign ((segid B and resid 72 and name HG2 )) ((segid B and resid 72 and name HE* )) 1.80 0.00 1.97
assign ((segid B and resid 72 and name HG2 )) ((segid B and resid 73 and name HN )) 1.80 0.00 2.43
assign ((segid B and resid 72 and name HN )) ((segid B and resid 72 and name HB* )) 1.80 0.00 1.58
assign ((segid B and resid 72 and name HN )) ((segid B and resid 72 and name HD* )) 1.80 0.00 3.26
assign ((segid B and resid 72 and name HN )) ((segid B and resid 73 and name HN )) 1.80 0.00 1.35
assign ((segid B and resid 73 and name HA* )) ((segid B and resid 74 and name HN )) 1.80 0.00 1.50
assign ((segid B and resid 73 and name HN )) ((segid B and resid 74 and name HN )) 1.80 0.00 1.80
assign ((segid B and resid 74 and name HA )) ((segid B and resid 75 and name HN )) 1.80 0.00 1.80
assign ((segid B and resid 74 and name HB1 )) ((segid B and resid 75 and name HN )) 1.80 0.00 2.68
assign ((segid B and resid 74 and name HB2 )) ((segid B and resid 75 and name HN )) 1.80 0.00 2.68
assign ((segid B and resid 75 and name HA )) ((segid B and resid 75 and name HD1* )) 1.80 0.00 1.93
assign ((segid B and resid 75 and name HA )) ((segid B and resid 75 and name HD2* )) 1.80 0.00 2.10
assign ((segid B and resid 75 and name HB* )) ((segid B and resid 75 and name HD1* )) 1.80 0.00 1.50
assign ((segid B and resid 75 and name HB* )) ((segid B and resid 75 and name HD2* )) 1.80 0.00 1.50
assign ((segid B and resid 75 and name HD2* )) ((segid B and resid 76 and name HN )) 1.80 0.00 3.80
assign ((segid B and resid 75 and name HN )) ((segid B and resid 75 and name HB* )) 1.80 0.00 1.50
assign ((segid B and resid 75 and name HN )) ((segid B and resid 75 and name HD1* )) 1.80 0.00 2.65
assign ((segid B and resid 76 and name HA )) ((segid B and resid 77 and name HN )) 1.80 0.00 1.80
assign ((segid B and resid 76 and name HB* )) ((segid B and resid 77 and name HN )) 1.80 0.00 2.50
assign ((segid B and resid 76 and name HG* )) ((segid B and resid 77 and name HN )) 1.80 0.00 3.00
assign ((segid B and resid 76 and name HN )) ((segid B and resid 76 and name HB* )) 1.80 0.00 2.00
assign ((segid B and resid 76 and name HN )) ((segid B and resid 76 and name HG* )) 1.80 0.00 2.80
assign ((segid B and resid 77 and name HA )) ((segid B and resid 78 and name HN )) 1.80 0.00 1.74
assign ((segid B and resid 77 and name HB* )) ((segid B and resid 77 and name HD* )) 1.80 0.00 1.80
assign ((segid B and resid 77 and name HB* )) ((segid B and resid 78 and name HN )) 1.80 0.00 2.48
assign ((segid B and resid 77 and name HN )) ((segid B and resid 77 and name HB* )) 1.80 0.00 1.43
assign ((segid B and resid 78 and name HA )) ((segid B and resid 79 and name HN )) 1.80 0.00 1.80
assign ((segid B and resid 78 and name HB* )) ((segid B and resid 79 and name HN )) 1.80 0.00 2.45
assign ((segid B and resid 78 and name HN )) ((segid B and resid 78 and name HB* )) 1.80 0.00 1.50
assign ((segid B and resid 79 and name HA )) ((segid B and resid 80 and name HN )) 1.80 0.00 1.80
assign ((segid B and resid 79 and name HB* )) ((segid B and resid 80 and name HN )) 1.80 0.00 2.46
assign ((segid B and resid 79 and name HN )) ((segid B and resid 79 and name HB* )) 1.80 0.00 2.04
assign ((segid B and resid 80 and name HA )) ((segid B and resid 81 and name HN )) 1.80 0.00 1.80
assign ((segid B and resid 80 and name HN )) ((segid B and resid 80 and name HB* )) 1.80 0.00 2.07
assign ((segid B and resid 81 and name HA )) ((segid B and resid 82 and name HN )) 1.80 0.00 1.80
assign ((segid B and resid 81 and name HB* )) ((segid B and resid 82 and name HN )) 1.80 0.00 2.30
assign ((segid B and resid 81 and name HN )) ((segid B and resid 81 and name HB* )) 1.80 0.00 1.49
assign ((segid B and resid 82 and name HN )) ((segid B and resid 82 and name HB* )) 1.80 0.00 1.60
assign ((segid A and resid 15 and name HB* )) ((segid B and resid 71 and name HD* )) 1.80 0.00 3.18
assign ((segid A and resid 15 and name HD1* )) ((segid B and resid 71 and name HE* )) 1.80 0.00 1.57
assign ((segid A and resid 15 and name HD1* )) ((segid B and resid 71 and name HZ )) 1.80 0.00 2.97
assign ((segid A and resid 15 and name HD2* )) ((segid B and resid 71 and name HD* )) 1.80 0.00 3.80
assign ((segid A and resid 15 and name HD2* )) ((segid B and resid 71 and name HE* )) 1.80 0.00 2.14
assign ((segid A and resid 16 and name HB* )) ((segid B and resid 70 and name HB* )) 1.80 0.00 2.59
assign ((segid A and resid 16 and name HD1* )) ((segid B and resid 66 and name HG2* )) 1.80 0.00 1.69
assign ((segid A and resid 16 and name HD1* )) ((segid B and resid 67 and name HA )) 1.80 0.00 2.46
assign ((segid A and resid 16 and name HD1* )) ((segid B and resid 67 and name HN )) 1.80 0.00 2.83
assign ((segid A and resid 16 and name HD1* )) ((segid B and resid 70 and name HA )) 1.80 0.00 3.26
assign ((segid A and resid 16 and name HD1* )) ((segid B and resid 70 and name HB* )) 1.80 0.00 1.27
assign ((segid A and resid 16 and name HD1* )) ((segid B and resid 70 and name HN )) 1.80 0.00 2.92
assign ((segid A and resid 16 and name HD1* )) ((segid B and resid 71 and name HE* )) 1.80 0.00 3.18
assign ((segid A and resid 16 and name HD1* )) ((segid B and resid 71 and name HN )) 1.80 0.00 2.88
assign ((segid A and resid 16 and name HD1* )) ((segid B and resid 71 and name HZ )) 1.80 0.00 3.68
assign ((segid A and resid 16 and name HD2* )) ((segid B and resid 66 and name HG2* )) 1.80 0.00 3.09
assign ((segid A and resid 16 and name HD2* )) ((segid B and resid 67 and name HA )) 1.80 0.00 2.10
assign ((segid A and resid 16 and name HD2* )) ((segid B and resid 67 and name HN )) 1.80 0.00 4.00
assign ((segid A and resid 16 and name HD2* )) ((segid B and resid 70 and name HA )) 1.80 0.00 3.53
assign ((segid A and resid 16 and name HD2* )) ((segid B and resid 70 and name HB* )) 1.80 0.00 1.33
assign ((segid A and resid 16 and name HD2* )) ((segid B and resid 70 and name HN )) 1.80 0.00 2.90
assign ((segid A and resid 16 and name HD2* )) ((segid B and resid 71 and name HE* )) 1.80 0.00 3.23
assign ((segid A and resid 16 and name HD2* )) ((segid B and resid 71 and name HN )) 1.80 0.00 3.36
assign ((segid A and resid 16 and name HG )) ((segid B and resid 71 and name HE* )) 1.80 0.00 3.06
assign ((segid A and resid 18 and name HA )) ((segid B and resid 66 and name HG2* )) 1.80 0.00 1.69
assign ((segid A and resid 18 and name HB* )) ((segid B and resid 63 and name HA )) 1.80 0.00 3.13
assign ((segid A and resid 18 and name HD1* )) ((segid B and resid 63 and name HA )) 1.80 0.00 2.90
assign ((segid A and resid 18 and name HD1* )) ((segid B and resid 63 and name HB* )) 1.80 0.00 2.08
assign ((segid A and resid 18 and name HD1* )) ((segid B and resid 64 and name HA )) 1.80 0.00 3.61
assign ((segid A and resid 18 and name HD1* )) ((segid B and resid 66 and name HG2* )) 1.80 0.00 2.95
assign ((segid A and resid 18 and name HD1* )) ((segid B and resid 67 and name HE* )) 1.80 0.00 3.30
assign ((segid A and resid 18 and name HD1* )) ((segid B and resid 67 and name HG1 )) 1.80 0.00 3.73
assign ((segid A and resid 18 and name HD1* )) ((segid B and resid 67 and name HG2 )) 1.80 0.00 3.73
assign ((segid A and resid 18 and name HD1* )) ((segid B and resid 67 and name HN )) 1.80 0.00 3.51
assign ((segid A and resid 18 and name HD2* )) ((segid B and resid 63 and name HA )) 1.80 0.00 3.02
assign ((segid A and resid 18 and name HD2* )) ((segid B and resid 64 and name HA )) 1.80 0.00 4.25
assign ((segid A and resid 18 and name HD2* )) ((segid B and resid 66 and name HA )) 1.80 0.00 3.93
assign ((segid A and resid 18 and name HD2* )) ((segid B and resid 66 and name HB )) 1.80 0.00 1.93
assign ((segid A and resid 18 and name HD2* )) ((segid B and resid 66 and name HG2* )) 1.80 0.00 1.32
assign ((segid A and resid 18 and name HD2* )) ((segid B and resid 66 and name HN )) 1.80 0.00 3.68
assign ((segid A and resid 18 and name HD2* )) ((segid B and resid 67 and name HA )) 1.80 0.00 2.01
assign ((segid A and resid 18 and name HD2* )) ((segid B and resid 67 and name HB* )) 1.80 0.00 2.67
assign ((segid A and resid 18 and name HD2* )) ((segid B and resid 67 and name HG1 )) 1.80 0.00 3.37
assign ((segid A and resid 18 and name HD2* )) ((segid B and resid 67 and name HG2 )) 1.80 0.00 3.37
assign ((segid A and resid 18 and name HD2* )) ((segid B and resid 67 and name HN )) 1.80 0.00 1.87
assign ((segid A and resid 18 and name HD2* )) ((segid B and resid 68 and name HN )) 1.80 0.00 3.72
assign ((segid A and resid 18 and name HG )) ((segid B and resid 66 and name HG2* )) 1.80 0.00 3.56
assign ((segid A and resid 27 and name HA )) ((segid B and resid 57 and name HD1* )) 1.80 0.00 3.83
assign ((segid A and resid 27 and name HD* )) ((segid B and resid 57 and name HD1* )) 1.80 0.00 1.43
assign ((segid A and resid 27 and name HD* )) ((segid B and resid 57 and name HG1* )) 1.80 0.00 2.01
assign ((segid A and resid 27 and name HE* )) ((segid B and resid 57 and name HD1* )) 1.80 0.00 2.04
assign ((segid A and resid 27 and name HE* )) ((segid B and resid 59 and name HA )) 1.80 0.00 3.45
assign ((segid A and resid 27 and name HE* )) ((segid B and resid 59 and name HD2* )) 1.80 0.00 2.01
assign ((segid A and resid 27 and name HG* )) ((segid B and resid 57 and name HD1* )) 1.80 0.00 2.45
assign ((segid A and resid 27 and name HG* )) ((segid B and resid 57 and name HG2* )) 1.80 0.00 4.07
assign ((segid A and resid 27 and name HG* )) ((segid B and resid 59 and name HD1* )) 1.80 0.00 4.07
assign ((segid A and resid 27 and name HG* )) ((segid B and resid 59 and name HD2* )) 1.80 0.00 4.05
assign ((segid A and resid 29 and name HD1* )) ((segid B and resid 67 and name HA )) 1.80 0.00 2.61
assign ((segid A and resid 29 and name HD1* )) ((segid B and resid 67 and name HB* )) 1.80 0.00 3.23
assign ((segid A and resid 29 and name HD1* )) ((segid B and resid 67 and name HG1 )) 1.80 0.00 3.70
assign ((segid A and resid 29 and name HD1* )) ((segid B and resid 67 and name HG2 )) 1.80 0.00 3.70
assign ((segid A and resid 29 and name HD1* )) ((segid B and resid 71 and name HD* )) 1.80 0.00 3.15
assign ((segid A and resid 29 and name HD1* )) ((segid B and resid 71 and name HE* )) 1.80 0.00 2.08
assign ((segid A and resid 29 and name HD1* )) ((segid B and resid 71 and name HZ )) 1.80 0.00 2.13
assign ((segid A and resid 29 and name HG2* )) ((segid B and resid 71 and name HE* )) 1.80 0.00 2.31
assign ((segid A and resid 29 and name HG2* )) ((segid B and resid 71 and name HZ )) 1.80 0.00 2.90
assign ((segid A and resid 41 and name HD* )) ((segid B and resid 75 and name HD2* )) 1.80 0.00 3.20
assign ((segid A and resid 43 and name HB )) ((segid B and resid 57 and name HD1* )) 1.80 0.00 2.89
assign ((segid A and resid 44 and name HA )) ((segid B and resid 57 and name HD1* )) 1.80 0.00 1.79
assign ((segid A and resid 45 and name HB* )) ((segid B and resid 57 and name HD1* )) 1.80 0.00 2.59
assign ((segid A and resid 45 and name HN )) ((segid B and resid 57 and name HD1* )) 1.80 0.00 3.08
assign ((segid A and resid 55 and name HB* )) ((segid B and resid 57 and name HD1* )) 1.80 0.00 2.96
assign ((segid A and resid 56 and name HA* )) ((segid B and resid 57 and name HG11 )) 1.80 0.00 4.25
assign ((segid A and resid 56 and name HA* )) ((segid B and resid 57 and name HG12 )) 1.80 0.00 4.25
assign ((segid A and resid 56 and name HA* )) ((segid B and resid 57 and name HG2* )) 1.80 0.00 3.30
assign ((segid A and resid 56 and name HA1 )) ((segid B and resid 57 and name HB )) 1.80 0.00 4.25
assign ((segid A and resid 56 and name HA1 )) ((segid B and resid 57 and name HD1* )) 1.80 0.00 2.85
assign ((segid A and resid 56 and name HA2 )) ((segid B and resid 57 and name HB )) 1.80 0.00 4.25
assign ((segid A and resid 56 and name HA2 )) ((segid B and resid 57 and name HD1* )) 1.80 0.00 2.85
assign ((segid A and resid 56 and name HN )) ((segid B and resid 57 and name HB )) 1.80 0.00 4.25
assign ((segid A and resid 56 and name HN )) ((segid B and resid 57 and name HD1* )) 1.80 0.00 3.06
assign ((segid A and resid 57 and name HB )) ((segid B and resid 56 and name HA1 )) 1.80 0.00 4.25
assign ((segid A and resid 57 and name HB )) ((segid B and resid 56 and name HA2 )) 1.80 0.00 4.25
assign ((segid A and resid 57 and name HB )) ((segid B and resid 56 and name HN )) 1.80 0.00 4.25
assign ((segid A and resid 57 and name HD1* )) ((segid B and resid 27 and name HA )) 1.80 0.00 3.83
assign ((segid A and resid 57 and name HD1* )) ((segid B and resid 27 and name HD* )) 1.80 0.00 1.43
assign ((segid A and resid 57 and name HD1* )) ((segid B and resid 27 and name HE* )) 1.80 0.00 2.04
assign ((segid A and resid 57 and name HD1* )) ((segid B and resid 27 and name HG* )) 1.80 0.00 2.45
assign ((segid A and resid 57 and name HD1* )) ((segid B and resid 43 and name HB )) 1.80 0.00 2.89
assign ((segid A and resid 57 and name HD1* )) ((segid B and resid 44 and name HA )) 1.80 0.00 1.79
assign ((segid A and resid 57 and name HD1* )) ((segid B and resid 45 and name HB* )) 1.80 0.00 2.59
assign ((segid A and resid 57 and name HD1* )) ((segid B and resid 45 and name HN )) 1.80 0.00 3.08
assign ((segid A and resid 57 and name HD1* )) ((segid B and resid 55 and name HB* )) 1.80 0.00 2.96
assign ((segid A and resid 57 and name HD1* )) ((segid B and resid 56 and name HA1 )) 1.80 0.00 2.85
assign ((segid A and resid 57 and name HD1* )) ((segid B and resid 56 and name HA2 )) 1.80 0.00 2.85
assign ((segid A and resid 57 and name HD1* )) ((segid B and resid 56 and name HN )) 1.80 0.00 3.06
assign ((segid A and resid 57 and name HD1* )) ((segid B and resid 57 and name HN )) 1.80 0.00 4.25
assign ((segid A and resid 57 and name HG1* )) ((segid B and resid 27 and name HD* )) 1.80 0.00 2.01
assign ((segid A and resid 57 and name HG11 )) ((segid B and resid 56 and name HA* )) 1.80 0.00 4.25
assign ((segid A and resid 57 and name HG12 )) ((segid B and resid 56 and name HA* )) 1.80 0.00 4.25
assign ((segid A and resid 57 and name HG2* )) ((segid B and resid 27 and name HG* )) 1.80 0.00 4.07
assign ((segid A and resid 57 and name HG2* )) ((segid B and resid 56 and name HA* )) 1.80 0.00 3.30
assign ((segid A and resid 57 and name HN )) ((segid B and resid 57 and name HD1* )) 1.80 0.00 4.25
assign ((segid A and resid 59 and name HA )) ((segid B and resid 27 and name HE* )) 1.80 0.00 3.45
assign ((segid A and resid 59 and name HD1* )) ((segid B and resid 27 and name HG* )) 1.80 0.00 4.07
assign ((segid A and resid 59 and name HD2* )) ((segid B and resid 27 and name HE* )) 1.80 0.00 2.01
assign ((segid A and resid 59 and name HD2* )) ((segid B and resid 27 and name HG* )) 1.80 0.00 4.05
assign ((segid A and resid 61 and name HA )) ((segid B and resid 75 and name HD2* )) 1.80 0.00 3.77
assign ((segid A and resid 63 and name HA )) ((segid B and resid 18 and name HB* )) 1.80 0.00 3.13
assign ((segid A and resid 63 and name HA )) ((segid B and resid 18 and name HD1* )) 1.80 0.00 2.90
assign ((segid A and resid 63 and name HA )) ((segid B and resid 18 and name HD2* )) 1.80 0.00 3.02
assign ((segid A and resid 63 and name HB* )) ((segid B and resid 18 and name HD1* )) 1.80 0.00 2.08
assign ((segid A and resid 64 and name HA )) ((segid B and resid 18 and name HD1* )) 1.80 0.00 3.61
assign ((segid A and resid 64 and name HA )) ((segid B and resid 18 and name HD2* )) 1.80 0.00 4.25
assign ((segid A and resid 64 and name HA )) ((segid B and resid 75 and name HD2* )) 1.80 0.00 3.24
assign ((segid A and resid 64 and name HE* )) ((segid B and resid 71 and name HZ )) 1.80 0.00 2.42
assign ((segid A and resid 64 and name HN )) ((segid B and resid 75 and name HD2* )) 1.80 0.00 4.03
assign ((segid A and resid 64 and name HZ )) ((segid B and resid 71 and name HE* )) 1.80 0.00 2.09
assign ((segid A and resid 65 and name HA )) ((segid B and resid 75 and name HD1* )) 1.80 0.00 2.77
assign ((segid A and resid 65 and name HE22 )) ((segid B and resid 76 and name HB* )) 1.80 0.00 3.78
assign ((segid A and resid 65 and name HE22 )) ((segid B and resid 77 and name HN )) 1.80 0.00 3.77
assign ((segid A and resid 65 and name HN )) ((segid B and resid 75 and name HD2* )) 1.80 0.00 2.04
assign ((segid A and resid 66 and name HA )) ((segid B and resid 18 and name HD2* )) 1.80 0.00 3.93
assign ((segid A and resid 66 and name HB )) ((segid B and resid 18 and name HD2* )) 1.80 0.00 1.93
assign ((segid A and resid 66 and name HG2* )) ((segid B and resid 16 and name HD1* )) 1.80 0.00 1.69
assign ((segid A and resid 66 and name HG2* )) ((segid B and resid 16 and name HD2* )) 1.80 0.00 3.09
assign ((segid A and resid 66 and name HG2* )) ((segid B and resid 18 and name HA )) 1.80 0.00 1.69
assign ((segid A and resid 66 and name HG2* )) ((segid B and resid 18 and name HD1* )) 1.80 0.00 2.95
assign ((segid A and resid 66 and name HG2* )) ((segid B and resid 18 and name HD2* )) 1.80 0.00 1.32
assign ((segid A and resid 66 and name HG2* )) ((segid B and resid 18 and name HG )) 1.80 0.00 3.56
assign ((segid A and resid 66 and name HN )) ((segid B and resid 18 and name HD2* )) 1.80 0.00 3.68
assign ((segid A and resid 67 and name HA )) ((segid B and resid 16 and name HD1* )) 1.80 0.00 2.46
assign ((segid A and resid 67 and name HA )) ((segid B and resid 16 and name HD2* )) 1.80 0.00 2.10
assign ((segid A and resid 67 and name HA )) ((segid B and resid 18 and name HD2* )) 1.80 0.00 2.01
assign ((segid A and resid 67 and name HA )) ((segid B and resid 29 and name HD1* )) 1.80 0.00 2.61
assign ((segid A and resid 67 and name HB* )) ((segid B and resid 18 and name HD2* )) 1.80 0.00 2.67
assign ((segid A and resid 67 and name HB* )) ((segid B and resid 29 and name HD1* )) 1.80 0.00 3.23
assign ((segid A and resid 67 and name HE* )) ((segid B and resid 18 and name HD1* )) 1.80 0.00 3.30
assign ((segid A and resid 67 and name HE* )) ((segid B and resid 71 and name HB* )) 1.80 0.00 1.97
assign ((segid A and resid 67 and name HE* )) ((segid B and resid 71 and name HD* )) 1.80 0.00 3.01
assign ((segid A and resid 67 and name HE* )) ((segid B and resid 71 and name HE* )) 1.80 0.00 2.59
assign ((segid A and resid 67 and name HE* )) ((segid B and resid 71 and name HZ )) 1.80 0.00 2.14
assign ((segid A and resid 67 and name HE* )) ((segid B and resid 75 and name HD2* )) 1.80 0.00 2.40
assign ((segid A and resid 67 and name HG* )) ((segid B and resid 75 and name HD2* )) 1.80 0.00 3.92
assign ((segid A and resid 67 and name HG1 )) ((segid B and resid 18 and name HD1* )) 1.80 0.00 3.73
assign ((segid A and resid 67 and name HG1 )) ((segid B and resid 18 and name HD2* )) 1.80 0.00 3.37
assign ((segid A and resid 67 and name HG1 )) ((segid B and resid 29 and name HD1* )) 1.80 0.00 3.70
assign ((segid A and resid 67 and name HG2 )) ((segid B and resid 18 and name HD1* )) 1.80 0.00 3.73
assign ((segid A and resid 67 and name HG2 )) ((segid B and resid 18 and name HD2* )) 1.80 0.00 3.37
assign ((segid A and resid 67 and name HG2 )) ((segid B and resid 29 and name HD1* )) 1.80 0.00 3.70
assign ((segid A and resid 67 and name HN )) ((segid B and resid 16 and name HD1* )) 1.80 0.00 2.83
assign ((segid A and resid 67 and name HN )) ((segid B and resid 16 and name HD2* )) 1.80 0.00 4.00
assign ((segid A and resid 67 and name HN )) ((segid B and resid 18 and name HD1* )) 1.80 0.00 3.51
assign ((segid A and resid 67 and name HN )) ((segid B and resid 18 and name HD2* )) 1.80 0.00 1.87
assign ((segid A and resid 68 and name HA )) ((segid B and resid 71 and name HA )) 1.80 0.00 4.25
assign ((segid A and resid 68 and name HA )) ((segid B and resid 71 and name HB* )) 1.80 0.00 2.55
assign ((segid A and resid 68 and name HG1* )) ((segid B and resid 71 and name HA )) 1.80 0.00 3.01
assign ((segid A and resid 68 and name HG1* )) ((segid B and resid 71 and name HB1 )) 1.80 0.00 3.26
assign ((segid A and resid 68 and name HG1* )) ((segid B and resid 71 and name HB2 )) 1.80 0.00 3.26
assign ((segid A and resid 68 and name HG1* )) ((segid B and resid 71 and name HD* )) 1.80 0.00 3.26
assign ((segid A and resid 68 and name HG1* )) ((segid B and resid 72 and name HA )) 1.80 0.00 3.45
assign ((segid A and resid 68 and name HG1* )) ((segid B and resid 72 and name HB* )) 1.80 0.00 3.47
assign ((segid A and resid 68 and name HG1* )) ((segid B and resid 72 and name HG* )) 1.80 0.00 4.25
assign ((segid A and resid 68 and name HG1* )) ((segid B and resid 72 and name HN )) 1.80 0.00 3.71
assign ((segid A and resid 68 and name HG1* )) ((segid B and resid 73 and name HN )) 1.80 0.00 3.40
assign ((segid A and resid 68 and name HG1* )) ((segid B and resid 74 and name HN )) 1.80 0.00 3.71
assign ((segid A and resid 68 and name HG1* )) ((segid B and resid 75 and name HD1* )) 1.80 0.00 2.57
assign ((segid A and resid 68 and name HG1* )) ((segid B and resid 75 and name HD2* )) 1.80 0.00 2.67
assign ((segid A and resid 68 and name HG1* )) ((segid B and resid 76 and name HB* )) 1.80 0.00 2.49
assign ((segid A and resid 68 and name HG2* )) ((segid B and resid 71 and name HB1 )) 1.80 0.00 2.94
assign ((segid A and resid 68 and name HG2* )) ((segid B and resid 71 and name HB2 )) 1.80 0.00 2.94
assign ((segid A and resid 68 and name HG2* )) ((segid B and resid 71 and name HD* )) 1.80 0.00 2.29
assign ((segid A and resid 68 and name HG2* )) ((segid B and resid 71 and name HE* )) 1.80 0.00 3.15
assign ((segid A and resid 68 and name HG2* )) ((segid B and resid 71 and name HN )) 1.80 0.00 3.59
assign ((segid A and resid 68 and name HG2* )) ((segid B and resid 75 and name HB* )) 1.80 0.00 3.01
assign ((segid A and resid 68 and name HG2* )) ((segid B and resid 75 and name HD1* )) 1.80 0.00 2.50
assign ((segid A and resid 68 and name HG2* )) ((segid B and resid 75 and name HD2* )) 1.80 0.00 2.72
assign ((segid A and resid 68 and name HN )) ((segid B and resid 18 and name HD2* )) 1.80 0.00 3.72
assign ((segid A and resid 68 and name HN )) ((segid B and resid 75 and name HD2* )) 1.80 0.00 4.25
assign ((segid A and resid 69 and name HN )) ((segid B and resid 76 and name HB* )) 1.80 0.00 4.25
assign ((segid A and resid 70 and name HA )) ((segid B and resid 16 and name HD1* )) 1.80 0.00 3.26
assign ((segid A and resid 70 and name HA )) ((segid B and resid 16 and name HD2* )) 1.80 0.00 3.53
assign ((segid A and resid 70 and name HB* )) ((segid B and resid 16 and name HB* )) 1.80 0.00 2.59
assign ((segid A and resid 70 and name HB* )) ((segid B and resid 16 and name HD1* )) 1.80 0.00 1.27
assign ((segid A and resid 70 and name HB* )) ((segid B and resid 16 and name HD2* )) 1.80 0.00 1.33
assign ((segid A and resid 70 and name HN )) ((segid B and resid 16 and name HD1* )) 1.80 0.00 2.92
assign ((segid A and resid 70 and name HN )) ((segid B and resid 16 and name HD2* )) 1.80 0.00 2.90
assign ((segid A and resid 71 and name HA )) ((segid B and resid 68 and name HA )) 1.80 0.00 4.25
assign ((segid A and resid 71 and name HA )) ((segid B and resid 68 and name HG1* )) 1.80 0.00 3.01
assign ((segid A and resid 71 and name HB* )) ((segid B and resid 67 and name HE* )) 1.80 0.00 1.97
assign ((segid A and resid 71 and name HB* )) ((segid B and resid 68 and name HA )) 1.80 0.00 2.55
assign ((segid A and resid 71 and name HB1 )) ((segid B and resid 68 and name HG1* )) 1.80 0.00 3.26
assign ((segid A and resid 71 and name HB1 )) ((segid B and resid 68 and name HG2* )) 1.80 0.00 2.94
assign ((segid A and resid 71 and name HB2 )) ((segid B and resid 68 and name HG1* )) 1.80 0.00 3.26
assign ((segid A and resid 71 and name HB2 )) ((segid B and resid 68 and name HG2* )) 1.80 0.00 2.94
assign ((segid A and resid 71 and name HD* )) ((segid B and resid 15 and name HB* )) 1.80 0.00 3.18
assign ((segid A and resid 71 and name HD* )) ((segid B and resid 15 and name HD2* )) 1.80 0.00 3.12
assign ((segid A and resid 71 and name HD* )) ((segid B and resid 29 and name HD1* )) 1.80 0.00 3.15
assign ((segid A and resid 71 and name HD* )) ((segid B and resid 67 and name HE* )) 1.80 0.00 3.01
assign ((segid A and resid 71 and name HD* )) ((segid B and resid 68 and name HG1* )) 1.80 0.00 3.26
assign ((segid A and resid 71 and name HD* )) ((segid B and resid 68 and name HG2* )) 1.80 0.00 2.29
assign ((segid A and resid 71 and name HE* )) ((segid B and resid 15 and name HD1* )) 1.80 0.00 1.57
assign ((segid A and resid 71 and name HE* )) ((segid B and resid 15 and name HD2* )) 1.80 0.00 2.14
assign ((segid A and resid 71 and name HE* )) ((segid B and resid 16 and name HD1* )) 1.80 0.00 3.18
assign ((segid A and resid 71 and name HE* )) ((segid B and resid 16 and name HD2* )) 1.80 0.00 3.23
assign ((segid A and resid 71 and name HE* )) ((segid B and resid 16 and name HG )) 1.80 0.00 3.06
assign ((segid A and resid 71 and name HE* )) ((segid B and resid 29 and name HD1* )) 1.80 0.00 2.08
assign ((segid A and resid 71 and name HE* )) ((segid B and resid 29 and name HG2* )) 1.80 0.00 2.31
assign ((segid A and resid 71 and name HE* )) ((segid B and resid 64 and name HZ )) 1.80 0.00 2.09
assign ((segid A and resid 71 and name HE* )) ((segid B and resid 67 and name HE* )) 1.80 0.00 2.59
assign ((segid A and resid 71 and name HE* )) ((segid B and resid 68 and name HG2* )) 1.80 0.00 3.15
assign ((segid A and resid 71 and name HN )) ((segid B and resid 16 and name HD1* )) 1.80 0.00 2.88
assign ((segid A and resid 71 and name HN )) ((segid B and resid 16 and name HD2* )) 1.80 0.00 3.36
assign ((segid A and resid 71 and name HN )) ((segid B and resid 68 and name HG2* )) 1.80 0.00 3.59
assign ((segid A and resid 71 and name HZ )) ((segid B and resid 15 and name HD1* )) 1.80 0.00 2.97
assign ((segid A and resid 71 and name HZ )) ((segid B and resid 16 and name HD1* )) 1.80 0.00 3.68
assign ((segid A and resid 71 and name HZ )) ((segid B and resid 29 and name HD1* )) 1.80 0.00 2.13
assign ((segid A and resid 71 and name HZ )) ((segid B and resid 29 and name HG2* )) 1.80 0.00 2.90
assign ((segid A and resid 71 and name HZ )) ((segid B and resid 64 and name HE* )) 1.80 0.00 2.42
assign ((segid A and resid 71 and name HZ )) ((segid B and resid 67 and name HE* )) 1.80 0.00 2.14
assign ((segid A and resid 72 and name HA )) ((segid B and resid 68 and name HG1* )) 1.80 0.00 3.45
assign ((segid A and resid 72 and name HA )) ((segid B and resid 72 and name HE* )) 1.80 0.00 2.84
assign ((segid A and resid 72 and name HB* )) ((segid B and resid 68 and name HG1* )) 1.80 0.00 3.47
assign ((segid A and resid 72 and name HB* )) ((segid B and resid 72 and name HE* )) 1.80 0.00 3.13
assign ((segid A and resid 72 and name HE* )) ((segid B and resid 72 and name HA )) 1.80 0.00 2.84
assign ((segid A and resid 72 and name HE* )) ((segid B and resid 72 and name HB* )) 1.80 0.00 3.13
assign ((segid A and resid 72 and name HG* )) ((segid B and resid 68 and name HG1* )) 1.80 0.00 4.25
assign ((segid A and resid 72 and name HN )) ((segid B and resid 68 and name HG1* )) 1.80 0.00 3.71
assign ((segid A and resid 73 and name HN )) ((segid B and resid 68 and name HG1* )) 1.80 0.00 3.40
assign ((segid A and resid 74 and name HN )) ((segid B and resid 68 and name HG1* )) 1.80 0.00 3.71
assign ((segid A and resid 75 and name HB* )) ((segid B and resid 68 and name HG2* )) 1.80 0.00 3.01
assign ((segid A and resid 75 and name HD1* )) ((segid B and resid 65 and name HA )) 1.80 0.00 2.77
assign ((segid A and resid 75 and name HD1* )) ((segid B and resid 68 and name HG1* )) 1.80 0.00 2.70
assign ((segid A and resid 75 and name HD1* )) ((segid B and resid 68 and name HG2* )) 1.80 0.00 2.50
assign ((segid A and resid 75 and name HD2* )) ((segid B and resid 41 and name HD* )) 1.80 0.00 3.20
assign ((segid A and resid 75 and name HD2* )) ((segid B and resid 61 and name HA )) 1.80 0.00 3.77
assign ((segid A and resid 75 and name HD2* )) ((segid B and resid 64 and name HA )) 1.80 0.00 3.24
assign ((segid A and resid 75 and name HD2* )) ((segid B and resid 64 and name HN )) 1.80 0.00 4.03
assign ((segid A and resid 75 and name HD2* )) ((segid B and resid 65 and name HN )) 1.80 0.00 2.04
assign ((segid A and resid 75 and name HD2* )) ((segid B and resid 67 and name HE* )) 1.80 0.00 2.40
assign ((segid A and resid 75 and name HD2* )) ((segid B and resid 67 and name HG* )) 1.80 0.00 3.92
assign ((segid A and resid 75 and name HD2* )) ((segid B and resid 68 and name HG1* )) 1.80 0.00 2.67
assign ((segid A and resid 75 and name HD2* )) ((segid B and resid 68 and name HG2* )) 1.80 0.00 2.72
assign ((segid A and resid 75 and name HD2* )) ((segid B and resid 68 and name HN )) 1.80 0.00 4.25
assign ((segid A and resid 76 and name HB* )) ((segid B and resid 65 and name HE22 )) 1.80 0.00 3.78
assign ((segid A and resid 76 and name HB* )) ((segid B and resid 68 and name HG1* )) 1.80 0.00 2.49
assign ((segid A and resid 76 and name HB* )) ((segid B and resid 69 and name HN )) 1.80 0.00 4.25
assign ((segid A and resid 77 and name HN )) ((segid B and resid 65 and name HE22 )) 1.80 0.00 3.77
list of removed NOE constraints
1845-> LEU B 15 HB* - PHE A 71 HD* 1.80 4.98 # Duplicated (1792)
1846-> LEU B 15 HD1* - PHE A 71 HE* 1.80 3.37 # Duplicated (1798)
1847-> LEU B 15 HD1* - PHE A 71 HZ 1.80 4.77 # Duplicated (1811)
1848-> LEU B 15 HD2* - PHE A 71 HD* 1.80 4.92 # Duplicated (1793)
1849-> LEU B 15 HD2* - PHE A 71 HE* 1.80 3.94 # Duplicated (1799)
1850-> LEU B 16 HB* - ALA A 70 HB* 1.80 4.39 # Duplicated (1779)
1851-> LEU B 16 HD1* - THR A 66 HG2* 1.80 3.49 # Duplicated (1721)
1852-> LEU B 16 HD1* - MET A 67 HA 1.80 4.26 # Duplicated (1728)
1853-> LEU B 16 HD1* - MET A 67 HN 1.80 4.63 # Duplicated (1747)
1854-> LEU B 16 HD1* - ALA A 70 HA 1.80 5.06 # Duplicated (1777)
1855-> LEU B 16 HD1* - ALA A 70 HB* 1.80 3.07 # Duplicated (1780)
1856-> LEU B 16 HD1* - ALA A 70 HN 1.80 4.72 # Duplicated (1782)
1857-> LEU B 16 HD1* - PHE A 71 HE* 1.80 4.98 # Duplicated (1800)
1858-> LEU B 16 HD1* - PHE A 71 HN 1.80 4.68 # Duplicated (1808)
1859-> LEU B 16 HD1* - PHE A 71 HZ 1.80 5.48 # Duplicated (1812)
1860-> LEU B 16 HD2* - THR A 66 HG2* 1.80 4.89 # Duplicated (1722)
1861-> LEU B 16 HD2* - MET A 67 HA 1.80 3.90 # Duplicated (1729)
1862-> LEU B 16 HD2* - MET A 67 HN 1.80 5.80 # Duplicated (1748)
1863-> LEU B 16 HD2* - ALA A 70 HA 1.80 5.33 # Duplicated (1778)
1864-> LEU B 16 HD2* - ALA A 70 HB* 1.80 3.13 # Duplicated (1781)
1865-> LEU B 16 HD2* - ALA A 70 HN 1.80 4.70 # Duplicated (1783)
1866-> LEU B 16 HD2* - PHE A 71 HE* 1.80 5.03 # Duplicated (1801)
1867-> LEU B 16 HD2* - PHE A 71 HN 1.80 5.16 # Duplicated (1809)
1868-> LEU B 16 HG - PHE A 71 HE* 1.80 4.86 # Duplicated (1802)
1869-> LEU B 18 HA - THR A 66 HG2* 1.80 3.49 # Duplicated (1723)
1870-> LEU B 18 HB* - GLU A 63 HA 1.80 5.04 # Same atoms-diff bounds (1705)
1871-> LEU B 18 HD1* - GLU A 63 HA 1.80 4.70 # Duplicated (1706)
1872-> LEU B 18 HD1* - GLU A 63 HB* 1.80 3.88 # Duplicated (1708)
1873-> LEU B 18 HD1* - PHE A 64 HA 1.80 5.41 # Duplicated (1709)
1874-> LEU B 18 HD1* - THR A 66 HG2* 1.80 4.75 # Duplicated (1724)
1875-> LEU B 18 HD1* - MET A 67 HE* 1.80 5.10 # Duplicated (1734)
1876-> LEU B 18 HD1* - MET A 67 HG1 1.80 5.53 # Duplicated (1741)
1877-> LEU B 18 HD1* - MET A 67 HG2 1.80 5.53 # Duplicated (1744)
1878-> LEU B 18 HD1* - MET A 67 HN 1.80 5.31 # Duplicated (1749)
1879-> LEU B 18 HD2* - GLU A 63 HA 1.80 4.82 # Duplicated (1707)
1880-> LEU B 18 HD2* - PHE A 64 HA 1.80 6.05 # Duplicated (1710)
1881-> LEU B 18 HD2* - THR A 66 HA 1.80 5.73 # Duplicated (1719)
1882-> LEU B 18 HD2* - THR A 66 HB 1.80 3.73 # Duplicated (1720)
1883-> LEU B 18 HD2* - THR A 66 HG2* 1.80 3.12 # Duplicated (1725)
1884-> LEU B 18 HD2* - THR A 66 HN 1.80 5.48 # Duplicated (1727)
1885-> LEU B 18 HD2* - MET A 67 HA 1.80 3.81 # Duplicated (1730)
1886-> LEU B 18 HD2* - MET A 67 HB* 1.80 4.47 # Duplicated (1732)
1887-> LEU B 18 HD2* - MET A 67 HG1 1.80 5.17 # Duplicated (1742)
1888-> LEU B 18 HD2* - MET A 67 HG2 1.80 5.17 # Duplicated (1745)
1889-> LEU B 18 HD2* - MET A 67 HN 1.80 3.67 # Duplicated (1750)
1890-> LEU B 18 HD2* - VAL A 68 HN 1.80 5.52 # Duplicated (1774)
1891-> LEU B 18 HG - THR A 66 HG2* 1.80 5.36 # Duplicated (1726)
1892-> LYS B 27 HA - ILE A 57 HD1* 1.80 5.63 # Duplicated (1681)
1893-> LYS B 27 HD* - ILE A 57 HD1* 1.80 3.23 # Duplicated (1682)
1894-> LYS B 27 HD* - ILE A 57 HG1* 1.80 3.81 # Duplicated (1694)
1895-> LYS B 27 HE* - ILE A 57 HD1* 1.80 3.84 # Duplicated (1683)
1896-> LYS B 27 HE* - LEU A 59 HA 1.80 5.25 # Duplicated (1700)
1897-> LYS B 27 HE* - LEU A 59 HD2* 1.80 3.81 # Duplicated (1702)
1898-> LYS B 27 HG* - ILE A 57 HD1* 1.80 4.25 # Duplicated (1684)
1899-> LYS B 27 HG* - ILE A 57 HG2* 1.80 5.87 # Duplicated (1697)
1900-> LYS B 27 HG* - LEU A 59 HD1* 1.80 5.87 # Duplicated (1701)
1901-> LYS B 27 HG* - LEU A 59 HD2* 1.80 5.85 # Duplicated (1703)
1902-> ILE B 29 HD1* - MET A 67 HA 1.80 4.41 # Duplicated (1731)
1903-> ILE B 29 HD1* - MET A 67 HB* 1.80 5.03 # Duplicated (1733)
1904-> ILE B 29 HD1* - MET A 67 HG1 1.80 5.50 # Duplicated (1743)
1905-> ILE B 29 HD1* - MET A 67 HG2 1.80 5.50 # Duplicated (1746)
1906-> ILE B 29 HD1* - PHE A 71 HD* 1.80 4.95 # Duplicated (1794)
1907-> ILE B 29 HD1* - PHE A 71 HE* 1.80 3.88 # Duplicated (1803)
1908-> ILE B 29 HD1* - PHE A 71 HZ 1.80 3.93 # Duplicated (1813)
1909-> ILE B 29 HG2* - PHE A 71 HE* 1.80 4.11 # Duplicated (1804)
1910-> ILE B 29 HG2* - PHE A 71 HZ 1.80 4.70 # Duplicated (1814)
1911-> PHE B 41 HD* - LEU A 75 HD2* 1.80 5.00 # Duplicated (1831)
1912-> ILE B 43 HB - ILE A 57 HD1* 1.80 4.69 # Duplicated (1685)
1913-> ARG B 44 HA - ILE A 57 HD1* 1.80 3.59 # Duplicated (1686)
1914-> ALA B 45 HB* - ILE A 57 HD1* 1.80 4.39 # Duplicated (1687)
1915-> ALA B 45 HN - ILE A 57 HD1* 1.80 4.88 # Duplicated (1688)
1916-> LYS B 55 HB* - ILE A 57 HD1* 1.80 4.76 # Duplicated (1689)
1917-> GLY B 56 HA* - ILE A 57 HG11 1.80 6.05 # Duplicated (1695)
1918-> GLY B 56 HA* - ILE A 57 HG12 1.80 6.05 # Duplicated (1696)
1919-> GLY B 56 HA* - ILE A 57 HG2* 1.80 5.10 # Duplicated (1698)
1920-> GLY B 56 HA1 - ILE A 57 HB 1.80 6.05 # Duplicated (1678)
1921-> GLY B 56 HA1 - ILE A 57 HD1* 1.80 4.65 # Duplicated (1690)
1922-> GLY B 56 HA2 - ILE A 57 HB 1.80 6.05 # Duplicated (1679)
1923-> GLY B 56 HA2 - ILE A 57 HD1* 1.80 4.65 # Duplicated (1691)
1924-> GLY B 56 HN - ILE A 57 HB 1.80 6.05 # Duplicated (1680)
1925-> GLY B 56 HN - ILE A 57 HD1* 1.80 4.86 # Duplicated (1692)
1926-> ILE B 57 HB - GLY A 56 HA1 1.80 6.05 # Duplicated (1672)
1927-> ILE B 57 HB - GLY A 56 HA2 1.80 6.05 # Duplicated (1674)
1928-> ILE B 57 HB - GLY A 56 HN 1.80 6.05 # Duplicated (1676)
1929-> ILE B 57 HD1* - LYS A 27 HA 1.80 5.63 # Duplicated (1644)
1930-> ILE B 57 HD1* - LYS A 27 HD* 1.80 3.23 # Duplicated (1645)
1931-> ILE B 57 HD1* - LYS A 27 HE* 1.80 3.84 # Duplicated (1647)
1932-> ILE B 57 HD1* - LYS A 27 HG* 1.80 4.25 # Duplicated (1650)
1933-> ILE B 57 HD1* - ILE A 43 HB 1.80 4.69 # Duplicated (1664)
1934-> ILE B 57 HD1* - ARG A 44 HA 1.80 3.59 # Duplicated (1665)
1935-> ILE B 57 HD1* - ALA A 45 HB* 1.80 4.39 # Duplicated (1666)
1936-> ILE B 57 HD1* - ALA A 45 HN 1.80 4.88 # Duplicated (1667)
1937-> ILE B 57 HD1* - LYS A 55 HB* 1.80 4.76 # Duplicated (1668)
1938-> ILE B 57 HD1* - GLY A 56 HA1 1.80 4.65 # Duplicated (1673)
1939-> ILE B 57 HD1* - GLY A 56 HA2 1.80 4.65 # Duplicated (1675)
1940-> ILE B 57 HD1* - GLY A 56 HN 1.80 4.86 # Duplicated (1677)
1941-> ILE B 57 HD1* - ILE A 57 HN 1.80 6.05 # Duplicated (1699)
1942-> ILE B 57 HG1* - LYS A 27 HD* 1.80 3.81 # Duplicated (1646)
1943-> ILE B 57 HG11 - GLY A 56 HA* 1.80 6.05 # Duplicated (1669)
1944-> ILE B 57 HG12 - GLY A 56 HA* 1.80 6.05 # Duplicated (1670)
1945-> ILE B 57 HG2* - LYS A 27 HG* 1.80 5.87 # Duplicated (1651)
1946-> ILE B 57 HG2* - GLY A 56 HA* 1.80 5.10 # Duplicated (1671)
1947-> ILE B 57 HN - ILE A 57 HD1* 1.80 6.05 # Duplicated (1693)
1948-> LEU B 59 HA - LYS A 27 HE* 1.80 5.25 # Duplicated (1648)
1949-> LEU B 59 HD1* - LYS A 27 HG* 1.80 5.87 # Duplicated (1652)
1950-> LEU B 59 HD2* - LYS A 27 HE* 1.80 3.81 # Duplicated (1649)
1951-> LEU B 59 HD2* - LYS A 27 HG* 1.80 5.85 # Duplicated (1653)
1952-> ASN B 61 HA - LEU A 75 HD2* 1.80 5.57 # Duplicated (1832)
1953-> GLU B 63 HA - LEU A 18 HB* 1.80 4.93 # Duplicated (1622)
1954-> GLU B 63 HA - LEU A 18 HD1* 1.80 4.70 # Duplicated (1623)
1955-> GLU B 63 HA - LEU A 18 HD2* 1.80 4.82 # Duplicated (1631)
1956-> GLU B 63 HB* - LEU A 18 HD1* 1.80 3.88 # Duplicated (1624)
1957-> PHE B 64 HA - LEU A 18 HD1* 1.80 5.41 # Duplicated (1625)
1958-> PHE B 64 HA - LEU A 18 HD2* 1.80 6.05 # Duplicated (1632)
1959-> PHE B 64 HA - LEU A 75 HD2* 1.80 5.04 # Duplicated (1833)
1960-> PHE B 64 HE* - PHE A 71 HZ 1.80 4.22 # Duplicated (1815)
1961-> PHE B 64 HN - LEU A 75 HD2* 1.80 5.83 # Duplicated (1834)
1962-> PHE B 64 HZ - PHE A 71 HE* 1.80 3.89 # Duplicated (1805)
1963-> GLN B 65 HA - LEU A 75 HD1* 1.80 4.57 # Duplicated (1828)
1964-> GLN B 65 HE22 - GLU A 76 HB* 1.80 5.58 # Duplicated (1841)
1965-> GLN B 65 HE22 - HIS A 77 HN 1.80 5.57 # Duplicated (1844)
1966-> GLN B 65 HN - LEU A 75 HD2* 1.80 3.84 # Duplicated (1835)
1967-> THR B 66 HA - LEU A 18 HD2* 1.80 5.73 # Duplicated (1633)
1968-> THR B 66 HB - LEU A 18 HD2* 1.80 3.73 # Duplicated (1634)
1969-> THR B 66 HG2* - LEU A 16 HD1* 1.80 3.49 # Duplicated (1603)
1970-> THR B 66 HG2* - LEU A 16 HD2* 1.80 4.89 # Duplicated (1612)
1971-> THR B 66 HG2* - LEU A 18 HA 1.80 3.49 # Duplicated (1621)
1972-> THR B 66 HG2* - LEU A 18 HD1* 1.80 4.75 # Duplicated (1626)
1973-> THR B 66 HG2* - LEU A 18 HD2* 1.80 3.12 # Duplicated (1635)
1974-> THR B 66 HG2* - LEU A 18 HG 1.80 5.36 # Duplicated (1643)
1975-> THR B 66 HN - LEU A 18 HD2* 1.80 5.48 # Duplicated (1636)
1976-> MET B 67 HA - LEU A 16 HD1* 1.80 4.26 # Duplicated (1604)
1977-> MET B 67 HA - LEU A 16 HD2* 1.80 3.90 # Duplicated (1613)
1978-> MET B 67 HA - LEU A 18 HD2* 1.80 3.81 # Duplicated (1637)
1979-> MET B 67 HA - ILE A 29 HD1* 1.80 4.41 # Duplicated (1654)
1980-> MET B 67 HB* - LEU A 18 HD2* 1.80 4.47 # Duplicated (1638)
1981-> MET B 67 HB* - ILE A 29 HD1* 1.80 5.03 # Duplicated (1655)
1982-> MET B 67 HE* - LEU A 18 HD1* 1.80 5.10 # Duplicated (1627)
1983-> MET B 67 HE* - PHE A 71 HB* 1.80 3.77 # Duplicated (1786)
1984-> MET B 67 HE* - PHE A 71 HD* 1.80 4.81 # Duplicated (1795)
1985-> MET B 67 HE* - PHE A 71 HE* 1.80 4.39 # Duplicated (1806)
1986-> MET B 67 HE* - PHE A 71 HZ 1.80 3.94 # Duplicated (1816)
1987-> MET B 67 HE* - LEU A 75 HD2* 1.80 4.20 # Duplicated (1836)
1988-> MET B 67 HG* - LEU A 75 HD2* 1.80 5.72 # Duplicated (1837)
1989-> MET B 67 HG1 - LEU A 18 HD1* 1.80 5.53 # Duplicated (1628)
1990-> MET B 67 HG1 - LEU A 18 HD2* 1.80 5.17 # Duplicated (1639)
1991-> MET B 67 HG1 - ILE A 29 HD1* 1.80 5.50 # Duplicated (1656)
1992-> MET B 67 HG2 - LEU A 18 HD1* 1.80 5.53 # Duplicated (1629)
1993-> MET B 67 HG2 - LEU A 18 HD2* 1.80 5.17 # Duplicated (1640)
1994-> MET B 67 HG2 - ILE A 29 HD1* 1.80 5.50 # Duplicated (1657)
1995-> MET B 67 HN - LEU A 16 HD1* 1.80 4.63 # Duplicated (1605)
1996-> MET B 67 HN - LEU A 16 HD2* 1.80 5.80 # Duplicated (1614)
1997-> MET B 67 HN - LEU A 18 HD1* 1.80 5.31 # Duplicated (1630)
1998-> MET B 67 HN - LEU A 18 HD2* 1.80 3.67 # Duplicated (1641)
1999-> VAL B 68 HA - PHE A 71 HA 1.80 6.05 # Duplicated (1784)
2000-> VAL B 68 HA - PHE A 71 HB* 1.80 4.35 # Duplicated (1787)
2001-> VAL B 68 HG1* - PHE A 71 HA 1.80 4.81 # Duplicated (1785)
2002-> VAL B 68 HG1* - PHE A 71 HB1 1.80 5.06 # Duplicated (1788)
2003-> VAL B 68 HG1* - PHE A 71 HB2 1.80 5.06 # Duplicated (1790)
2004-> VAL B 68 HG1* - PHE A 71 HD* 1.80 5.06 # Duplicated (1796)
2005-> VAL B 68 HG1* - LYS A 72 HA 1.80 5.25 # Duplicated (1817)
2006-> VAL B 68 HG1* - LYS A 72 HB* 1.80 5.27 # Duplicated (1819)
2007-> VAL B 68 HG1* - LYS A 72 HG* 1.80 6.05 # Duplicated (1823)
2008-> VAL B 68 HG1* - LYS A 72 HN 1.80 5.51 # Duplicated (1824)
2009-> VAL B 68 HG1* - GLY A 73 HN 1.80 5.20 # Duplicated (1825)
2010-> VAL B 68 HG1* - ASN A 74 HN 1.80 5.51 # Duplicated (1826)
2011-> VAL B 68 HG1* - LEU A 75 HD1* 1.80 4.50 # Duplicated (1829)
2012-> VAL B 68 HG1* - LEU A 75 HD2* 1.80 4.47 # Duplicated (1838)
2013-> VAL B 68 HG1* - GLU A 76 HB* 1.80 4.29 # Duplicated (1842)
2014-> VAL B 68 HG2* - PHE A 71 HB1 1.80 4.74 # Duplicated (1789)
2015-> VAL B 68 HG2* - PHE A 71 HB2 1.80 4.74 # Duplicated (1791)
2016-> VAL B 68 HG2* - PHE A 71 HD* 1.80 4.09 # Duplicated (1797)
2017-> VAL B 68 HG2* - PHE A 71 HE* 1.80 4.95 # Duplicated (1807)
2018-> VAL B 68 HG2* - PHE A 71 HN 1.80 5.39 # Duplicated (1810)
2019-> VAL B 68 HG2* - LEU A 75 HB* 1.80 4.81 # Duplicated (1827)
2020-> VAL B 68 HG2* - LEU A 75 HD1* 1.80 4.30 # Duplicated (1830)
2021-> VAL B 68 HG2* - LEU A 75 HD2* 1.80 4.52 # Duplicated (1839)
2022-> VAL B 68 HN - LEU A 18 HD2* 1.80 5.52 # Duplicated (1642)
2023-> VAL B 68 HN - LEU A 75 HD2* 1.80 6.05 # Duplicated (1840)
2024-> ASP B 69 HN - GLU A 76 HB* 1.80 6.05 # Duplicated (1843)
2025-> ALA B 70 HA - LEU A 16 HD1* 1.80 5.06 # Duplicated (1606)
2026-> ALA B 70 HA - LEU A 16 HD2* 1.80 5.33 # Duplicated (1615)
2027-> ALA B 70 HB* - LEU A 16 HB* 1.80 4.39 # Duplicated (1602)
2028-> ALA B 70 HB* - LEU A 16 HD1* 1.80 3.07 # Duplicated (1607)
2029-> ALA B 70 HB* - LEU A 16 HD2* 1.80 3.13 # Duplicated (1616)
2030-> ALA B 70 HN - LEU A 16 HD1* 1.80 4.72 # Duplicated (1608)
2031-> ALA B 70 HN - LEU A 16 HD2* 1.80 4.70 # Duplicated (1617)
2032-> PHE B 71 HA - VAL A 68 HA 1.80 6.05 # Duplicated (1751)
2033-> PHE B 71 HA - VAL A 68 HG1* 1.80 4.81 # Duplicated (1753)
2034-> PHE B 71 HB* - MET A 67 HE* 1.80 3.77 # Duplicated (1735)
2035-> PHE B 71 HB* - VAL A 68 HA 1.80 4.35 # Duplicated (1752)
2036-> PHE B 71 HB1 - VAL A 68 HG1* 1.80 5.06 # Duplicated (1754)
2037-> PHE B 71 HB1 - VAL A 68 HG2* 1.80 4.74 # Duplicated (1766)
2038-> PHE B 71 HB2 - VAL A 68 HG1* 1.80 5.06 # Duplicated (1755)
2039-> PHE B 71 HB2 - VAL A 68 HG2* 1.80 4.74 # Duplicated (1767)
2040-> PHE B 71 HD* - LEU A 15 HB* 1.80 4.98 # Duplicated (1597)
2041-> PHE B 71 HD* - LEU A 15 HD2* 1.80 5.60 # Duplicated (1600)
2042-> PHE B 71 HD* - ILE A 29 HD1* 1.80 4.95 # Duplicated (1658)
2043-> PHE B 71 HD* - MET A 67 HE* 1.80 4.81 # Duplicated (1736)
2044-> PHE B 71 HD* - VAL A 68 HG1* 1.80 5.06 # Duplicated (1756)
2045-> PHE B 71 HD* - VAL A 68 HG2* 1.80 4.09 # Duplicated (1768)
2046-> PHE B 71 HE* - LEU A 15 HD1* 1.80 3.37 # Duplicated (1598)
2047-> PHE B 71 HE* - LEU A 15 HD2* 1.80 3.94 # Duplicated (1601)
2048-> PHE B 71 HE* - LEU A 16 HD1* 1.80 4.98 # Duplicated (1609)
2049-> PHE B 71 HE* - LEU A 16 HD2* 1.80 5.03 # Duplicated (1618)
2050-> PHE B 71 HE* - LEU A 16 HG 1.80 4.86 # Duplicated (1620)
2051-> PHE B 71 HE* - ILE A 29 HD1* 1.80 3.88 # Duplicated (1659)
2052-> PHE B 71 HE* - ILE A 29 HG2* 1.80 4.11 # Duplicated (1661)
2053-> PHE B 71 HE* - PHE A 64 HZ 1.80 3.89 # Duplicated (1714)
2054-> PHE B 71 HE* - MET A 67 HE* 1.80 4.39 # Duplicated (1737)
2055-> PHE B 71 HE* - VAL A 68 HG2* 1.80 4.95 # Duplicated (1769)
2056-> PHE B 71 HN - LEU A 16 HD1* 1.80 4.68 # Duplicated (1610)
2057-> PHE B 71 HN - LEU A 16 HD2* 1.80 5.16 # Duplicated (1619)
2058-> PHE B 71 HN - VAL A 68 HG2* 1.80 5.39 # Duplicated (1770)
2059-> PHE B 71 HZ - LEU A 15 HD1* 1.80 4.77 # Duplicated (1599)
2060-> PHE B 71 HZ - LEU A 16 HD1* 1.80 5.48 # Duplicated (1611)
2061-> PHE B 71 HZ - ILE A 29 HD1* 1.80 3.93 # Duplicated (1660)
2062-> PHE B 71 HZ - ILE A 29 HG2* 1.80 4.70 # Duplicated (1662)
2063-> PHE B 71 HZ - PHE A 64 HE* 1.80 4.22 # Duplicated (1712)
2064-> PHE B 71 HZ - MET A 67 HE* 1.80 3.94 # Duplicated (1738)
2065-> LYS B 72 HA - VAL A 68 HG1* 1.80 5.25 # Duplicated (1757)
2066-> LYS B 72 HA - LYS A 72 HE* 1.80 4.64 # Duplicated (1821)
2067-> LYS B 72 HB* - VAL A 68 HG1* 1.80 5.27 # Duplicated (1758)
2068-> LYS B 72 HB* - LYS A 72 HE* 1.80 4.93 # Duplicated (1822)
2069-> LYS B 72 HE* - LYS A 72 HA 1.80 4.64 # Duplicated (1818)
2070-> LYS B 72 HE* - LYS A 72 HB* 1.80 4.93 # Duplicated (1820)
2071-> LYS B 72 HG* - VAL A 68 HG1* 1.80 6.05 # Duplicated (1759)
2072-> LYS B 72 HN - VAL A 68 HG1* 1.80 5.51 # Duplicated (1760)
2073-> GLY B 73 HN - VAL A 68 HG1* 1.80 5.20 # Duplicated (1761)
2074-> ASN B 74 HN - VAL A 68 HG1* 1.80 5.51 # Duplicated (1762)
2075-> LEU B 75 HB* - VAL A 68 HG2* 1.80 4.81 # Duplicated (1771)
2076-> LEU B 75 HD1* - GLN A 65 HA 1.80 4.57 # Duplicated (1715)
2077-> LEU B 75 HD1* - VAL A 68 HG1* 1.80 4.37 # Duplicated (1763)
2078-> LEU B 75 HD1* - VAL A 68 HG2* 1.80 4.30 # Duplicated (1772)
2079-> LEU B 75 HD2* - PHE A 41 HD* 1.80 5.00 # Duplicated (1663)
2080-> LEU B 75 HD2* - ASN A 61 HA 1.80 5.57 # Duplicated (1704)
2081-> LEU B 75 HD2* - PHE A 64 HA 1.80 5.04 # Duplicated (1711)
2082-> LEU B 75 HD2* - PHE A 64 HN 1.80 5.83 # Duplicated (1713)
2083-> LEU B 75 HD2* - GLN A 65 HN 1.80 3.84 # Duplicated (1718)
2084-> LEU B 75 HD2* - MET A 67 HE* 1.80 4.20 # Duplicated (1739)
2085-> LEU B 75 HD2* - MET A 67 HG* 1.80 5.72 # Duplicated (1740)
2086-> LEU B 75 HD2* - VAL A 68 HG1* 1.80 4.47 # Duplicated (1764)
2087-> LEU B 75 HD2* - VAL A 68 HG2* 1.80 4.52 # Duplicated (1773)
2088-> LEU B 75 HD2* - VAL A 68 HN 1.80 6.05 # Duplicated (1775)
2089-> GLU B 76 HB* - GLN A 65 HE22 1.80 5.58 # Duplicated (1716)
2090-> GLU B 76 HB* - VAL A 68 HG1* 1.80 4.29 # Duplicated (1765)
2091-> GLU B 76 HB* - ASP A 69 HN 1.80 6.05 # Duplicated (1776)
2092-> HIS B 77 HN - GLN A 65 HE22 1.80 5.57 # Duplicated (1717)
====== TOTAL ======: 248
table of distance constraints violations
Residual Violations greater than 0.10
3-> MET A 1 HG* - LYS A 2 HN [ 1.80 4.73] 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.09 .. 0.12]
5-> LYS A 2 HA - LYS A 3 HN [ 1.80 3.37] 0.00 0.00 0.00 0.00 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.18 .. 0.18]
20-> MET A 4 HG* - ALA A 5 HN [ 1.80 4.54] 0.00 0.00 0.00 0.23 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.12 0.00 - 4 [ 0.00 .. 0.23]
21-> MET A 4 HN - MET A 4 HB* [ 1.80 3.18] 0.00 0.00 0.00 0.00 0.09 0.00 0.00 0.00 0.12 0.00 0.02 0.05 0.00 0.00 0.00 0.00 0.00 0.07 0.17 0.04 - 7 [ 0.02 .. 0.17]
24-> ALA A 5 HB* - GLU A 6 HN [ 1.80 3.60] 0.07 0.10 0.00 0.00 0.00 0.12 0.11 0.00 0.00 0.00 0.00 0.08 0.00 0.00 0.11 0.10 0.00 0.10 0.00 0.00 - 8 [ 0.07 .. 0.12]
27-> GLU A 6 HB* - PHE A 7 HN [ 1.80 3.90] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.12 0.00 - 2 [ 0.03 .. 0.12]
28-> GLU A 6 HG3 - PHE A 7 HN [ 1.80 5.60] 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.25 0.00 0.00 - 2 [ 0.22 .. 0.25]
34-> PHE A 7 HA - ASN A 35 HD2* [ 1.80 4.47] 3.10 1.24 1.83 2.35 0.00 1.50 2.54 0.80 1.11 0.00 1.36 0.00 0.35 0.00 1.35 0.00 0.00 1.65 0.00 2.47 - 13 [ 0.35 .. 3.10]
35-> PHE A 7 HB* - THR A 8 HN [ 1.80 3.60] 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.08 0.00 0.31 0.00 0.00 0.28 0.00 0.00 0.00 - 4 [ 0.08 .. 0.31]
36-> PHE A 7 HB* - ASN A 35 HD2* [ 1.80 4.19] 1.76 0.00 3.50 0.24 0.00 0.00 1.71 0.31 0.00 0.13 0.00 0.27 0.43 0.46 0.29 0.00 0.28 1.00 0.00 0.53 - 13 [ 0.13 .. 3.50]
37-> PHE A 7 HB* - ASN A 35 HN [ 1.80 5.00] 0.00 0.00 1.90 0.00 0.05 0.00 1.37 0.00 0.51 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 1.01 - 6 [ 0.05 .. 1.90]
41-> PHE A 7 HN - PHE A 7 HB* [ 1.80 3.25] 0.00 0.03 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.03 .. 0.15]
45-> THR A 8 HB - PHE A 9 HN [ 1.80 4.30] 0.01 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.13 0.00 0.00 0.11 0.00 0.00 0.00 - 4 [ 0.01 .. 0.13]
46-> THR A 8 HG2* - ASN A 35 HA [ 1.80 4.80] 0.00 0.40 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.11 .. 0.54]
47-> THR A 8 HG2* - ASN A 35 HN [ 1.80 4.80] 0.00 0.97 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.51 .. 0.97]
51-> THR A 8 HN - ASN A 35 HA [ 1.80 4.28] 0.84 0.00 0.65 0.00 0.00 0.00 1.95 0.00 1.31 0.00 0.23 0.12 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.44 - 8 [ 0.12 .. 1.95]
52-> THR A 8 HN - ASN A 35 HD2* [ 1.80 4.96] 1.20 0.55 0.31 0.82 0.00 0.13 0.47 0.00 0.00 0.00 0.21 0.00 0.00 0.00 1.12 0.00 0.00 0.40 0.00 0.00 - 9 [ 0.13 .. 1.20]
53-> THR A 8 HN - ASN A 35 HN [ 1.80 4.10] 0.56 0.38 0.48 0.00 0.00 0.00 2.08 0.00 1.28 0.00 0.29 0.00 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.35 - 8 [ 0.14 .. 2.08]
56-> PHE A 9 HA - VAL A 32 HG1* [ 1.80 4.43] 0.00 0.00 0.00 0.00 0.00 0.92 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.92 .. 1.24]
58-> PHE A 9 HA - PHE A 34 HD* [ 1.80 4.76] 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.97 .. 0.97]
59-> PHE A 9 HA - ASN A 35 HN [ 1.80 4.42] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 1.13 .. 1.13]
60-> PHE A 9 HB* - PHE A 34 HA [ 1.80 4.97] 0.00 0.00 0.00 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.04 0.00 0.00 0.00 0.00 - 3 [ 0.04 .. 0.86]
62-> PHE A 9 HB3 - VAL A 32 HG1* [ 1.80 4.28] 0.00 0.00 0.00 0.00 0.00 0.67 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.61 .. 0.67]
64-> PHE A 9 HB2 - VAL A 32 HG1* [ 1.80 4.28] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.23 0.00 0.00 0.00 - 1 [ 0.23 .. 0.23]
67-> PHE A 9 HD* - PHE A 34 HE* [ 1.80 4.33] 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.08 .. 2.01]
72-> GLU A 10 HA - VAL A 32 HG1* [ 1.80 4.87] 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 1.26 .. 1.26]
79-> GLU A 10 HN - VAL A 32 HG1* [ 1.80 3.88] 0.00 0.00 0.00 0.00 0.00 0.11 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.11 .. 0.97]
82-> GLU A 10 HN - PHE A 34 HA [ 1.80 4.54] 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.81 .. 0.81]
87-> ILE A 11 HA - VAL A 32 HG1* [ 1.80 4.21] 0.00 0.00 0.00 0.00 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.13 .. 0.13]
88-> ILE A 11 HA - VAL A 32 HG2* [ 1.80 3.96] 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.62 .. 0.62]
92-> ILE A 11 HD1* - VAL A 32 HG2* [ 1.80 4.57] 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.78 .. 0.78]
100-> ILE A 11 HG2* - GLU A 13 HN [ 1.80 3.71] 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.48 .. 0.48]
101-> ILE A 11 HG2* - ASN A 30 HA [ 1.80 4.96] 0.00 2.40 0.00 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.32 0.00 - 4 [ 0.08 .. 2.40]
102-> ILE A 11 HG2* - ASN A 30 HB3 [ 1.80 3.98] 0.00 2.58 0.00 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.09 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.46 0.00 - 5 [ 0.08 .. 2.58]
103-> ILE A 11 HG2* - ASN A 30 HB2 [ 1.80 3.98] 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 1.35 .. 1.35]
104-> ILE A 11 HG2* - ARG A 31 HN [ 1.80 4.39] 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 1.54 .. 1.54]
107-> ILE A 11 HG2* - VAL A 32 HG2* [ 1.80 3.65] 0.00 0.28 0.00 0.00 0.00 1.70 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.28 .. 1.70]
114-> ILE A 11 HN - VAL A 32 HG1* [ 1.80 5.07] 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.74 .. 0.74]
115-> ILE A 11 HN - VAL A 32 HG2* [ 1.80 5.25] 0.00 0.00 0.00 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.34 .. 0.34]
121-> GLU A 12 HG* - SER A 33 HB* [ 1.80 5.03] 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.38 0.00 - 3 [ 0.02 .. 0.89]
123-> GLU A 12 HG3 - ALA A 39 HB* [ 1.80 3.74] 0.61 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.10 0.00 0.36 0.92 0.00 1.26 0.39 0.00 2.16 0.00 0.12 0.00 - 9 [ 0.10 .. 2.16]
125-> GLU A 12 HG2 - VAL A 32 HA [ 1.80 5.19] 1.54 0.00 1.86 0.48 0.61 0.25 0.11 0.49 1.57 0.55 1.19 1.45 0.00 1.39 0.54 0.00 1.38 0.00 0.83 0.20 - 16 [ 0.11 .. 1.86]
126-> GLU A 12 HG2 - ALA A 39 HB* [ 1.80 4.15] 0.00 0.00 0.00 0.26 0.33 0.04 0.55 0.00 0.00 0.00 0.00 0.24 0.00 0.51 0.00 0.00 1.43 0.00 0.00 0.36 - 8 [ 0.04 .. 1.43]
127-> GLU A 12 HN - GLU A 12 HG3 [ 1.80 4.22] 0.32 0.00 0.34 0.00 0.00 0.00 0.00 0.23 0.01 0.14 0.01 0.28 0.00 0.28 0.15 0.00 0.34 0.00 0.01 0.00 - 11 [ 0.01 .. 0.34]
128-> GLU A 12 HN - GLU A 12 HG2 [ 1.80 4.22] 0.32 0.00 0.30 0.00 0.00 0.00 0.00 0.51 0.46 0.57 0.44 0.22 0.00 0.25 0.60 0.00 0.28 0.00 0.47 0.00 - 11 [ 0.22 .. 0.60]
132-> GLU A 12 HN - VAL A 32 HG2* [ 1.80 5.10] 0.00 0.00 0.00 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.37 .. 0.37]
134-> GLU A 12 HN - ALA A 39 HB* [ 1.80 4.96] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.21 0.00 0.00 0.19 0.00 0.00 0.20 - 3 [ 0.19 .. 0.21]
141-> GLU A 13 HB* - ALA A 39 HB* [ 1.80 5.40] 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 - 2 [ 0.30 .. 0.99]
145-> GLU A 13 HG* - LEU A 15 HD2* [ 1.80 4.95] 3.08 0.85 0.69 0.00 0.44 3.02 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.43 0.00 0.00 0.00 - 7 [ 0.43 .. 3.08]
154-> GLU A 13 HN - ALA A 39 HB* [ 1.80 5.00] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.55 0.03 0.00 0.69 - 4 [ 0.03 .. 0.69]
161-> LEU A 15 HA - LEU A 15 HD2* [ 1.80 3.13] 0.78 0.77 0.00 0.00 0.77 0.79 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 - 6 [ 0.74 .. 0.79]
173-> LEU A 15 HD1* - ASN A 30 HA [ 1.80 4.60] 0.58 0.37 0.00 0.00 0.38 0.75 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 - 6 [ 0.37 .. 0.84]
174-> LEU A 15 HD1* - ASN A 30 HB* [ 1.80 5.10] 1.07 0.88 0.34 0.00 0.64 1.12 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 - 7 [ 0.34 .. 1.47]
175-> LEU A 15 HD1* - ARG A 31 HA [ 1.80 5.60] 1.30 1.00 0.05 0.00 1.69 1.92 0.00 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 - 7 [ 0.05 .. 1.96]
176-> LEU A 15 HD1* - ARG A 31 HG* [ 1.80 4.30] 0.19 0.00 0.00 0.00 0.67 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 2.88 0.46 0.00 0.00 - 6 [ 0.14 .. 2.88]
177-> LEU A 15 HD1* - ARG A 31 HN [ 1.80 4.80] 1.33 1.14 0.92 0.00 1.32 1.98 0.00 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 - 7 [ 0.43 .. 1.98]
178-> LEU A 15 HD1* - PHE A 41 HA [ 1.80 4.80] 1.53 1.65 0.00 0.00 2.19 2.27 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 3.03 0.00 0.00 0.00 - 6 [ 1.12 .. 3.03]
179-> LEU A 15 HD1* - PHE A 41 HD* [ 1.80 3.61] 0.48 0.52 0.00 0.00 1.14 1.21 0.00 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 - 6 [ 0.07 .. 1.79]
183-> LEU A 15 HD2* - ARG A 31 HD* [ 1.80 4.04] 1.08 0.23 0.00 0.00 1.12 1.04 0.00 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.10 2.32 0.52 0.00 0.00 - 8 [ 0.10 .. 2.32]
184-> LEU A 15 HD2* - ARG A 31 HG* [ 1.80 3.81] 0.65 0.09 0.14 0.00 0.75 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 3.09 1.56 0.00 0.00 - 8 [ 0.09 .. 3.09]
186-> LEU A 15 HD2* - PHE A 64 HD* [ 1.80 5.60] 0.00 0.00 0.27 0.78 0.00 0.00 0.83 1.30 0.00 0.00 1.07 1.03 1.18 0.51 1.06 0.02 0.00 0.12 1.09 0.74 - 13 [ 0.02 .. 1.30]
187-> LEU A 15 HD2* - PHE A 64 HE* [ 1.80 4.80] 0.00 0.00 0.00 0.39 0.00 0.00 0.46 0.99 0.00 0.00 0.68 0.66 1.16 0.04 0.73 0.00 0.00 0.00 0.65 0.36 - 10 [ 0.04 .. 1.16]
188-> LEU A 15 HD2* - PHE A 64 HZ [ 1.80 4.80] 0.00 0.00 0.00 0.31 0.00 0.00 0.31 1.09 0.00 0.00 1.00 0.69 1.73 0.00 1.36 0.00 0.00 0.00 0.53 0.21 - 9 [ 0.21 .. 1.73]
189-> LEU A 15 HG - ASN A 30 HA [ 1.80 4.59] 1.25 0.91 0.00 0.00 0.93 1.20 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 - 6 [ 0.91 .. 1.40]
191-> LEU A 15 HN - LEU A 15 HG [ 1.80 4.22] 0.16 0.16 0.00 0.00 0.16 0.17 0.00 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.18 0.00 0.00 0.00 - 6 [ 0.16 .. 0.18]
200-> LEU A 16 HD1* - THR A 17 HN [ 1.80 4.80] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.04 0.00 - 2 [ 0.04 .. 0.10]
201-> LEU A 16 HD1* - ILE A 29 HB [ 1.80 5.04] 0.00 0.00 1.35 0.03 0.00 0.00 0.28 0.75 0.00 0.00 0.01 0.05 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 - 7 [ 0.01 .. 1.35]
202-> LEU A 16 HD1* - ILE A 29 HD1* [ 1.80 4.30] 0.00 0.00 1.99 0.18 0.00 0.19 0.73 1.04 0.00 0.00 0.09 0.23 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 - 8 [ 0.09 .. 1.99]
203-> LEU A 16 HD1* - ILE A 29 HN [ 1.80 5.60] 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.33 0.00 0.00 0.00 - 3 [ 0.03 .. 0.33]
204-> LEU A 16 HD2* - ILE A 29 HB [ 1.80 4.90] 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 - 2 [ 0.61 .. 0.65]
205-> LEU A 16 HD2* - ILE A 29 HD1* [ 1.80 4.30] 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 0.00 - 2 [ 0.44 .. 0.46]
206-> LEU A 16 HD2* - ILE A 29 HG2* [ 1.80 5.60] 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.00 0.00 0.00 - 2 [ 0.48 .. 0.57]
210-> LEU A 16 HN - ILE A 29 HD1* [ 1.80 4.99] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.13 0.00 0.00 0.23 0.00 0.00 - 3 [ 0.13 .. 0.24]
217-> THR A 17 HG2* - THR A 26 HB [ 1.80 5.40] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 0.00 0.59 0.00 0.14 0.00 0.00 0.00 1.20 0.00 - 4 [ 0.14 .. 1.20]
218-> THR A 17 HG2* - LYS A 27 HN [ 1.80 4.91] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.52 .. 0.52]
219-> THR A 17 HG2* - GLU A 28 HA [ 1.80 4.29] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.42 .. 0.42]
220-> THR A 17 HG2* - ILE A 29 HN [ 1.80 5.18] 0.00 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.04 .. 0.12]
236-> LEU A 18 HD1* - LYS A 27 HE* [ 1.80 5.39] 0.00 0.00 0.00 0.00 0.00 0.00 0.15 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.17 0.00 0.00 0.00 0.00 - 4 [ 0.00 .. 0.53]
237-> LEU A 18 HD1* - LYS A 27 HG* [ 1.80 4.57] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.17 0.00 0.00 - 2 [ 0.17 .. 0.23]
243-> LEU A 18 HG - LYS A 27 HG* [ 1.80 5.01] 1.05 1.18 1.01 0.00 1.18 0.99 1.20 0.00 1.93 1.06 1.26 1.13 0.87 0.83 0.00 1.38 0.95 1.44 1.14 0.00 - 16 [ 0.83 .. 1.93]
257-> GLU A 20 HA - THR A 26 HG2* [ 1.80 3.79] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 0.00 0.00 0.00 0.88 0.00 0.03 0.00 0.91 0.22 - 5 [ 0.03 .. 0.91]
260-> GLU A 20 HB3 - THR A 26 HG2* [ 1.80 4.50] 0.39 0.00 0.00 0.76 0.00 0.00 0.14 1.54 0.00 0.00 1.04 0.00 0.02 0.00 1.17 0.01 0.91 0.00 0.86 0.36 - 11 [ 0.01 .. 1.54]
262-> GLU A 20 HB2 - THR A 26 HG2* [ 1.80 4.80] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 1.47 0.00 0.00 0.09 1.17 0.00 - 4 [ 0.09 .. 1.47]
263-> GLU A 20 HG* - ASN A 21 HN [ 1.80 3.82] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.46 0.00 0.00 0.14 0.15 0.00 - 4 [ 0.14 .. 0.61]
264-> GLU A 20 HG* - GLY A 24 HN [ 1.80 4.80] 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.82 0.09 0.00 0.90 1.62 0.00 - 6 [ 0.09 .. 1.62]
265-> GLU A 20 HG* - TRP A 25 HN [ 1.80 5.10] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.59 0.00 0.00 0.54 0.43 0.00 - 4 [ 0.43 .. 0.92]
275-> ASN A 21 HN - TRP A 25 HN [ 1.80 4.35] 0.13 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.41 0.00 0.00 0.00 0.00 - 4 [ 0.13 .. 0.41]
277-> ASN A 21 HN - THR A 26 HG2* [ 1.80 4.80] 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 0.56 0.00 0.00 0.41 0.59 1.10 0.00 0.47 0.44 1.19 0.79 - 9 [ 0.41 .. 1.19]
288-> GLY A 24 HA3 - PRO A 48 HG* [ 1.80 5.28] 2.54 0.00 0.00 0.00 0.00 0.00 0.00 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.78 - 4 [ 0.73 .. 4.52]
289-> GLY A 24 HA2 - PRO A 48 HG* [ 1.80 6.05] 2.99 0.00 0.00 0.00 0.00 0.00 0.00 4.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 - 3 [ 0.10 .. 4.77]
293-> TRP A 25 HB* - ALA A 45 HB* [ 1.80 4.39] 0.00 0.91 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.00 0.44 0.95 0.22 0.65 0.00 0.97 0.00 0.10 0.00 - 9 [ 0.10 .. 0.97]
296-> TRP A 25 HE1 - SER A 47 HB* [ 1.80 6.05] 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.83 0.28 1.93 0.00 0.90 0.00 0.00 0.00 - 6 [ 0.28 .. 1.93]
297-> TRP A 25 HE1 - PRO A 48 HD3 [ 1.80 4.52] 0.00 2.43 1.53 0.00 0.60 0.00 0.00 0.05 3.48 0.00 1.73 2.48 3.17 0.00 2.55 0.00 3.17 0.00 0.00 1.46 - 11 [ 0.05 .. 3.48]
298-> TRP A 25 HE1 - PRO A 48 HD2 [ 1.80 4.52] 0.00 3.89 1.31 0.00 0.34 0.00 0.00 0.74 3.06 0.00 1.71 3.94 4.09 0.00 4.29 0.00 4.25 0.00 0.00 0.00 - 11 [ 0.00 .. 4.29]
299-> TRP A 25 HE1 - PRO A 48 HG2 [ 1.80 5.29] 0.63 4.05 2.91 0.00 0.84 0.00 0.00 1.87 4.15 0.00 2.66 3.75 5.37 0.00 3.74 0.48 4.55 0.59 0.00 1.20 - 14 [ 0.48 .. 5.37]
300-> TRP A 25 HE1 - LYS A 52 HE* [ 1.80 5.47] 2.33 5.76 3.77 2.38 2.28 3.38 0.00 0.00 0.00 0.06 3.56 6.54 4.19 0.27 5.90 0.73 6.61 2.57 0.00 0.17 - 17 [ 0.00 .. 6.61]
301-> TRP A 25 HH2 - LYS A 52 HB3 [ 1.80 5.57] 4.65 0.37 3.02 0.00 0.00 0.00 0.00 3.29 0.00 0.00 0.00 1.00 0.00 0.00 0.81 0.00 0.91 3.42 0.00 0.00 - 8 [ 0.37 .. 4.65]
302-> TRP A 25 HH2 - LYS A 52 HB2 [ 1.80 5.57] 5.77 0.08 2.82 0.00 0.00 0.00 0.00 2.90 0.00 0.00 0.00 2.75 0.00 0.00 2.57 0.00 0.00 2.87 0.00 1.00 - 8 [ 0.08 .. 5.77]
303-> TRP A 25 HH2 - LYS A 52 HD* [ 1.80 4.58] 4.34 1.13 5.16 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.00 2.52 0.93 0.00 1.91 0.00 2.23 2.28 0.58 1.45 - 11 [ 0.58 .. 5.16]
304-> TRP A 25 HH2 - LYS A 52 HG* [ 1.80 5.60] 5.02 1.52 3.37 0.00 0.00 0.00 0.00 0.43 0.00 0.00 0.00 1.14 0.00 0.00 0.61 0.00 1.31 3.30 0.00 0.00 - 8 [ 0.43 .. 5.02]
305-> TRP A 25 HH2 - MET A 53 HN [ 1.80 5.21] 5.50 1.92 3.73 0.00 0.00 0.00 0.00 1.07 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.69 0.00 0.00 - 6 [ 0.27 .. 5.69]
306-> TRP A 25 HN - TRP A 25 HD1 [ 1.80 3.66] 0.01 1.15 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.24 0.00 1.24 0.00 1.25 1.65 0.00 0.00 - 8 [ 0.01 .. 1.65]
308-> TRP A 25 HN - PRO A 48 HD* [ 1.80 5.09] 1.49 0.00 0.00 0.00 0.00 0.00 0.00 2.45 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.09 0.00 0.00 1.00 - 5 [ 0.09 .. 2.45]
309-> TRP A 25 HZ2 - LYS A 52 HD3 [ 1.80 4.43] 2.78 4.57 5.98 0.20 0.75 0.51 0.00 1.12 0.00 0.47 0.96 5.43 4.81 0.08 4.81 0.00 6.33 1.78 0.98 0.00 - 16 [ 0.08 .. 6.33]
310-> TRP A 25 HZ2 - LYS A 52 HD2 [ 1.80 4.43] 3.83 4.05 5.20 0.20 0.00 0.87 0.00 0.83 0.89 0.00 0.95 7.03 3.48 0.00 6.49 0.00 5.18 1.59 0.07 0.98 - 15 [ 0.07 .. 7.03]
311-> TRP A 25 HZ2 - LYS A 52 HG* [ 1.80 4.76] 3.86 4.43 3.13 0.00 0.38 0.68 0.00 1.37 0.00 0.00 1.69 4.30 2.37 0.00 3.69 0.08 4.38 2.68 0.00 0.00 - 13 [ 0.08 .. 4.43]
312-> TRP A 25 HZ3 - ALA A 45 HB* [ 1.80 4.70] 1.02 0.58 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.74 0.00 0.89 2.60 0.00 0.29 - 8 [ 0.29 .. 2.60]
315-> THR A 26 HB - LYS A 27 HN [ 1.80 4.31] 0.00 0.00 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.02 0.00 0.00 0.01 0.02 0.13 - 5 [ 0.01 .. 0.13]
318-> THR A 26 HN - ALA A 45 HB* [ 1.80 4.85] 0.00 0.00 0.00 0.00 0.00 0.00 0.33 0.00 0.00 0.23 0.00 0.00 0.39 0.36 0.00 0.00 0.03 0.00 0.38 0.00 - 6 [ 0.03 .. 0.39]
327-> LYS A 27 HB* - LYS A 27 HE* [ 1.80 3.37] 0.15 0.18 0.14 0.00 0.18 0.14 0.14 0.00 0.18 0.11 0.18 0.12 0.14 0.15 0.00 0.18 0.17 0.00 0.18 0.00 - 15 [ 0.11 .. 0.18]
332-> LYS A 27 HG* - ARG A 44 HA [ 1.80 5.13] 0.67 0.90 0.58 0.00 0.00 0.13 0.72 0.00 0.00 0.85 0.04 0.02 1.21 1.11 0.00 0.00 0.90 0.78 1.08 0.00 - 13 [ 0.02 .. 1.21]
340-> GLU A 28 HB* - TRP A 46 HD1 [ 1.80 6.05] 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 2.29 0.00 0.00 0.00 0.00 0.84 0.57 0.00 - 5 [ 0.10 .. 2.54]
345-> GLU A 28 HN - TRP A 46 HD1 [ 1.80 5.05] 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 3.51 0.00 0.00 0.00 0.00 2.76 0.54 0.00 - 5 [ 0.54 .. 3.51]
354-> ILE A 29 HD1* - PHE A 64 HZ [ 1.80 4.99] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 - 3 [ 0.34 .. 0.99]
355-> ILE A 29 HD1* - MET A 67 HE* [ 1.80 4.69] 0.00 0.00 0.00 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 - 2 [ 0.01 .. 0.28]
363-> ILE A 29 HG2* - ASP A 42 HN [ 1.80 4.09] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.29 .. 0.29]
366-> ILE A 29 HG2* - ARG A 44 HN [ 1.80 5.07] 0.00 0.00 0.00 0.00 0.15 0.00 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.04 - 3 [ 0.04 .. 0.19]
369-> ILE A 29 HG2* - PHE A 64 HZ [ 1.80 3.43] 0.29 0.39 0.63 0.29 0.38 0.00 0.46 1.85 0.67 1.08 0.00 0.16 0.00 0.32 0.00 0.00 0.00 0.00 1.55 0.61 - 13 [ 0.16 .. 1.85]
374-> ASN A 30 HB* - VAL A 32 HG2* [ 1.80 5.06] 0.00 0.00 0.00 0.00 0.00 0.69 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.69 .. 0.69]
384-> ARG A 31 HB* - ALA A 39 HB* [ 1.80 4.07] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 0.00 0.00 0.00 - 1 [ 0.14 .. 0.14]
400-> ARG A 31 HH2* - ALA A 39 HB* [ 1.80 4.22] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.23 0.00 0.00 0.00 - 1 [ 0.23 .. 0.23]
406-> VAL A 32 HB - PHE A 34 HZ [ 1.80 4.80] 0.00 0.00 0.00 0.00 0.00 5.73 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.39 .. 5.73]
408-> VAL A 32 HG1* - PHE A 34 HD* [ 1.80 4.39] 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 1.98 .. 1.98]
409-> VAL A 32 HG1* - PHE A 34 HZ [ 1.80 4.06] 0.00 0.00 0.00 0.00 0.00 5.89 0.00 0.00 0.00 0.11 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.06 .. 5.89]
411-> VAL A 32 HG2* - PHE A 34 HZ [ 1.80 4.60] 0.00 0.00 0.00 0.00 0.00 2.79 0.00 0.00 0.00 0.18 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.08 .. 2.79]
412-> VAL A 32 HG2* - ASP A 42 HB* [ 1.80 3.95] 0.00 0.00 0.00 0.00 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.10 .. 0.10]
418-> VAL A 32 HN - ALA A 39 HB* [ 1.80 4.21] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.11 0.00 0.00 0.00 0.00 0.28 - 3 [ 0.11 .. 0.44]
426-> SER A 33 HB* - ALA A 39 HB* [ 1.80 3.82] 0.00 0.64 0.00 0.00 0.14 0.50 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.28 - 6 [ 0.03 .. 0.64]
437-> ASN A 35 HB* - GLY A 36 HN [ 1.80 4.00] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.10 .. 0.10]
441-> ALA A 37 HA - PRO A 38 HD* [ 1.80 3.34] 0.20 0.00 0.21 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.20 0.00 0.20 0.00 0.00 0.00 - 6 [ 0.20 .. 0.24]
443-> ALA A 37 HB* - PRO A 38 HG* [ 1.80 5.00] 0.00 0.00 0.00 0.12 0.00 0.00 0.00 0.07 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.08 - 4 [ 0.07 .. 0.12]
460-> LYS A 40 HD* - ASN A 61 HN [ 1.80 5.27] 0.00 0.12 0.00 0.00 0.00 0.00 0.01 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.21 0.00 - 5 [ 0.01 .. 1.29]
461-> LYS A 40 HE* - SER A 60 HA [ 1.80 4.80] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.56 .. 1.45]
462-> LYS A 40 HE* - ASN A 61 HN [ 1.80 4.80] 0.00 0.01 0.00 0.00 0.00 0.00 0.81 0.00 2.42 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.16 0.00 - 5 [ 0.01 .. 2.42]
464-> LYS A 40 HG* - SER A 60 HA [ 1.80 4.77] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.74 .. 0.74]
472-> PHE A 41 HB* - PHE A 64 HZ [ 1.80 5.40] 0.00 0.00 0.00 0.00 0.02 0.00 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.02 .. 0.75]
474-> PHE A 41 HB3 - LEU A 59 HD1* [ 1.80 5.00] 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 1.09 .. 1.09]
479-> PHE A 41 HD* - PHE A 64 HA [ 1.80 5.56] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.83 .. 0.83]
486-> ASP A 42 HA - ILE A 57 HG2* [ 1.80 5.26] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.94 .. 0.94]
489-> ASP A 42 HA - LEU A 59 HD1* [ 1.80 5.36] 0.00 0.44 0.28 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.02 0.00 0.93 0.51 0.00 0.00 0.00 0.00 0.78 0.00 - 7 [ 0.02 .. 0.93]
490-> ASP A 42 HA - LEU A 59 HG [ 1.80 5.51] 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.13 0.00 - 3 [ 0.07 .. 0.84]
497-> ILE A 43 HA - ILE A 57 HG2* [ 1.80 5.51] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.56 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.56 .. 1.04]
499-> ILE A 43 HB - ILE A 57 HG2* [ 1.80 3.63] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.05 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.05 .. 0.68]
501-> ILE A 43 HD1* - ILE A 57 HG2* [ 1.80 4.30] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.37 .. 0.37]
502-> ILE A 43 HD1* - THR A 58 HA [ 1.80 6.05] 0.09 0.00 0.00 0.18 0.04 0.00 0.00 0.14 0.15 0.00 0.00 0.00 0.00 0.00 0.24 0.03 0.00 0.00 0.00 0.00 - 7 [ 0.03 .. 0.24]
503-> ILE A 43 HD1* - LEU A 59 HD2* [ 1.80 4.83] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.09 0.00 0.00 0.37 0.00 - 2 [ 0.09 .. 0.37]
505-> ILE A 43 HD1* - PHE A 64 HE* [ 1.80 4.49] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.38 .. 0.38]
507-> ILE A 43 HG1* - ILE A 57 HG2* [ 1.80 3.81] 0.00 0.00 0.00 0.50 0.00 0.00 0.00 0.20 0.00 0.00 0.00 0.00 1.79 0.53 0.00 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.20 .. 1.79]
512-> ILE A 43 HG2* - PHE A 64 HE* [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.47 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.04 - 5 [ 0.04 .. 0.71]
517-> ILE A 43 HN - ILE A 57 HG2* [ 1.80 3.82] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.36 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.36 .. 1.34]
520-> ILE A 43 HN - THR A 58 HG2* [ 1.80 5.29] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.01 0.04 0.00 0.00 0.00 0.00 - 3 [ 0.01 .. 0.19]
521-> ILE A 43 HN - LEU A 59 HD1* [ 1.80 5.35] 0.00 0.00 0.00 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.17 0.00 - 3 [ 0.17 .. 0.24]
522-> ILE A 43 HN - LEU A 59 HG [ 1.80 5.61] 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.57 .. 0.57]
529-> ALA A 45 HB* - GLY A 54 HA* [ 1.80 4.30] 0.00 0.09 0.00 0.89 2.02 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.76 0.00 0.00 0.00 0.00 - 7 [ 0.00 .. 2.02]
534-> TRP A 46 HN - TRP A 46 HD1 [ 1.80 5.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.21 .. 0.21]
558-> LYS A 52 HB2 - MET A 53 HN [ 1.80 4.04] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 - 2 [ 0.00 .. 0.42]
563-> LYS A 52 HN - LYS A 52 HG* [ 1.80 4.21] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.00 .. 0.17]
571-> MET A 53 HN - MET A 53 HG* [ 1.80 4.10] 0.19 0.00 0.00 0.00 0.12 0.21 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.12 .. 0.21]
581-> LYS A 55 HB* - GLY A 56 HN [ 1.80 3.85] 0.00 0.00 0.00 0.00 0.13 0.00 0.00 0.01 0.00 0.09 0.00 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.01 .. 0.13]
586-> LYS A 55 HN - LYS A 55 HD* [ 1.80 4.58] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.18 0.15 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.12 .. 0.18]
587-> LYS A 55 HN - LYS A 55 HG* [ 1.80 3.87] 0.00 0.00 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.13 .. 0.13]
595-> ILE A 57 HD1* - THR A 58 HN [ 1.80 4.33] 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.03 .. 0.91]
596-> ILE A 57 HG1* - THR A 58 HN [ 1.80 3.62] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.49 .. 0.49]
602-> ILE A 57 HN - ILE A 57 HG2* [ 1.80 3.38] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.42 .. 0.42]
617-> LEU A 59 HD2* - SER A 60 HN [ 1.80 4.34] 0.00 0.00 0.00 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.43 .. 0.43]
620-> LEU A 59 HN - LEU A 59 HG [ 1.80 4.22] 0.00 0.00 0.00 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.16 .. 0.16]
627-> ASN A 61 HB* - GLU A 62 HN [ 1.80 3.52] 0.00 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.30 0.00 - 4 [ 0.03 .. 0.37]
628-> ASN A 61 HD2* - GLU A 62 HN [ 1.80 5.12] 0.00 0.00 0.12 0.09 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.21 0.15 0.02 0.00 0.00 - 6 [ 0.02 .. 0.21]
636-> GLU A 62 HA - THR A 66 HN [ 1.80 4.70] 0.16 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.12 .. 0.16]
649-> GLU A 63 HA - MET A 67 HN [ 1.80 5.38] 0.18 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.18 .. 0.40]
657-> PHE A 64 HA - MET A 67 HE* [ 1.80 3.80] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.58 0.00 0.00 0.00 - 2 [ 0.58 .. 0.82]
658-> PHE A 64 HA - MET A 67 HB* [ 1.80 4.30] 0.67 0.00 0.00 0.00 0.26 0.00 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 0.00 0.00 0.00 - 4 [ 0.14 .. 0.67]
664-> PHE A 64 HD* - MET A 67 HE* [ 1.80 3.13] 0.17 0.00 0.00 0.00 0.14 0.00 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.64 0.00 0.00 0.00 - 5 [ 0.14 .. 0.85]
666-> PHE A 64 HE* - MET A 67 HE* [ 1.80 3.17] 1.12 0.00 0.00 0.00 1.37 0.59 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 0.00 0.00 - 5 [ 0.55 .. 1.70]
670-> GLN A 65 HA - GLN A 65 HE21 [ 1.80 4.82] 0.28 0.14 0.00 0.12 0.00 0.00 0.22 0.06 0.00 0.00 0.12 0.00 0.21 0.07 0.00 0.33 0.00 0.14 0.31 0.09 - 12 [ 0.06 .. 0.33]
671-> GLN A 65 HA - GLN A 65 HE22 [ 1.80 4.86] 1.16 1.13 0.00 1.12 0.00 0.00 1.17 1.05 0.00 0.00 1.14 0.00 1.16 1.10 0.00 1.23 0.00 1.13 1.21 1.12 - 12 [ 1.05 .. 1.23]
675-> GLN A 65 HA - VAL A 68 HB [ 1.80 4.06] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.85 .. 0.85]
676-> GLN A 65 HA - VAL A 68 HG1* [ 1.80 4.23] 0.00 0.00 0.00 0.60 0.00 0.00 0.64 0.00 0.00 0.00 0.07 0.05 0.00 0.00 0.29 0.17 0.00 0.00 0.10 0.00 - 8 [ 0.00 .. 0.64]
677-> GLN A 65 HA - VAL A 68 HG2* [ 1.80 3.73] 0.00 0.00 0.00 0.39 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.39 .. 0.57]
679-> GLN A 65 HA - ASP A 69 HN [ 1.80 4.77] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.00 0.00 0.00 0.40 0.15 - 3 [ 0.07 .. 0.40]
682-> GLN A 65 HE21 - VAL A 68 HB [ 1.80 4.75] 2.22 1.79 0.00 3.28 0.00 0.00 2.86 3.18 0.00 0.00 2.58 0.00 2.26 0.96 0.00 3.04 0.00 2.51 1.56 2.59 - 12 [ 0.96 .. 3.28]
683-> GLN A 65 HE21 - VAL A 68 HG1* [ 1.80 5.13] 1.43 1.02 0.00 3.02 0.00 0.00 2.39 2.04 0.00 0.00 2.14 0.00 1.80 0.25 0.00 2.76 0.00 2.13 1.27 1.79 - 12 [ 0.25 .. 3.02]
684-> GLN A 65 HE22 - VAL A 68 HB [ 1.80 4.94] 2.63 2.45 0.00 4.28 0.00 0.00 4.07 4.56 0.00 0.00 3.58 0.00 3.14 2.26 0.00 3.51 0.00 3.42 2.85 3.42 - 12 [ 2.26 .. 4.56]
685-> GLN A 65 HE22 - VAL A 68 HG1* [ 1.80 4.27] 2.71 2.62 0.00 4.92 0.00 0.00 4.56 4.00 0.00 0.00 4.06 0.00 3.54 2.53 0.21 4.06 0.00 3.97 3.43 3.66 - 13 [ 0.21 .. 4.92]
698-> THR A 66 HA - ALA A 70 HN [ 1.80 4.80] 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.00 0.79 0.00 - 3 [ 0.20 .. 0.79]
705-> MET A 67 HA - ALA A 70 HB* [ 1.80 3.77] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 - 1 [ 0.88 .. 0.88]
706-> MET A 67 HA - ALA A 70 HN [ 1.80 4.26] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.17 0.00 - 1 [ 0.17 .. 0.17]
707-> MET A 67 HA - PHE A 71 HN [ 1.80 4.28] 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.53 0.00 0.00 0.68 0.00 0.96 0.08 0.00 0.00 0.00 0.00 0.74 0.00 - 6 [ 0.08 .. 0.96]
709-> MET A 67 HE* - VAL A 68 HG2* [ 1.80 3.40] 1.12 0.62 0.00 0.00 1.23 0.99 0.00 0.92 1.33 0.56 0.00 0.00 0.00 0.00 1.06 1.38 0.80 0.00 0.36 1.02 - 12 [ 0.36 .. 1.38]
710-> MET A 67 HE* - VAL A 68 HN [ 1.80 4.18] 0.65 0.17 0.00 0.00 0.65 0.50 0.00 0.00 0.63 0.04 0.00 0.00 0.00 0.00 0.39 0.85 0.37 0.00 0.18 0.37 - 11 [ 0.04 .. 0.85]
715-> MET A 67 HN - MET A 67 HG2 [ 1.80 4.83] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 0.00 0.00 0.00 - 1 [ 0.14 .. 0.14]
722-> VAL A 68 HA - LYS A 72 HN [ 1.80 5.17] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 - 2 [ 0.10 .. 0.32]
723-> VAL A 68 HB - ASP A 69 HN [ 1.80 3.64] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.44 .. 0.44]
724-> VAL A 68 HG1* - ASP A 69 HN [ 1.80 3.78] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.19 .. 0.19]
731-> ASP A 69 HA - LYS A 72 HB* [ 1.80 4.20] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 - 1 [ 0.85 .. 0.85]
738-> ALA A 70 HA - GLY A 73 HN [ 1.80 4.40] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.45 0.08 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.08 .. 0.95]
740-> ALA A 70 HB* - GLY A 73 HN [ 1.80 5.07] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.20 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.20 .. 1.06]
745-> PHE A 71 HA - LEU A 75 HB* [ 1.80 4.99] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.00 - 1 [ 0.39 .. 0.39]
749-> PHE A 71 HD* - LEU A 75 HB* [ 1.80 4.88] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.67 - 4 [ 0.35 .. 1.63]
760-> LYS A 72 HG3 - GLY A 73 HN [ 1.80 5.00] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.18 .. 0.18]
762-> LYS A 72 HG2 - GLY A 73 HN [ 1.80 4.23] 0.00 0.00 0.83 0.00 0.03 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 - 4 [ 0.03 .. 0.86]
769-> ASN A 74 HB3 - LEU A 75 HN [ 1.80 4.48] 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.00 .. 0.13]
770-> ASN A 74 HB2 - LEU A 75 HN [ 1.80 4.48] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.22 .. 0.22]
771-> LEU A 75 HA - LEU A 75 HD1* [ 1.80 3.73] 0.16 0.12 0.00 0.13 0.12 0.16 0.15 0.00 0.20 0.17 0.13 0.13 0.00 0.15 0.16 0.13 0.14 0.00 0.12 0.00 - 15 [ 0.12 .. 0.20]
797-> HIS A 81 HN - HIS A 81 HB* [ 1.80 3.29] 0.00 0.00 0.00 0.00 0.00 0.00 0.11 0.00 0.00 0.09 0.00 0.00 0.09 0.00 0.11 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.09 .. 0.11]
801-> MET B 1 HG* - LYS B 2 HN [ 1.80 4.73] 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.09 .. 0.12]
803-> LYS B 2 HA - LYS B 3 HN [ 1.80 3.37] 0.00 0.00 0.00 0.00 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.18 .. 0.18]
818-> MET B 4 HG* - ALA B 5 HN [ 1.80 4.54] 0.00 0.00 0.00 0.23 0.00 0.05 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.12 0.00 - 4 [ 0.01 .. 0.23]
819-> MET B 4 HN - MET B 4 HB* [ 1.80 3.18] 0.00 0.00 0.00 0.00 0.09 0.00 0.00 0.00 0.12 0.00 0.02 0.06 0.00 0.00 0.00 0.00 0.00 0.07 0.17 0.04 - 7 [ 0.02 .. 0.17]
822-> ALA B 5 HB* - GLU B 6 HN [ 1.80 3.60] 0.07 0.10 0.00 0.00 0.00 0.12 0.11 0.00 0.00 0.00 0.00 0.08 0.00 0.00 0.11 0.10 0.00 0.10 0.00 0.00 - 8 [ 0.07 .. 0.12]
825-> GLU B 6 HB* - PHE B 7 HN [ 1.80 3.90] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.12 0.00 - 2 [ 0.03 .. 0.12]
826-> GLU B 6 HG3 - PHE B 7 HN [ 1.80 5.60] 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.25 0.00 0.00 - 2 [ 0.22 .. 0.25]
832-> PHE B 7 HA - ASN B 35 HD2* [ 1.80 4.47] 3.10 1.24 1.83 2.35 0.00 1.50 2.54 0.80 1.11 0.00 1.36 0.00 0.35 0.00 1.35 0.00 0.00 1.65 0.00 2.47 - 13 [ 0.35 .. 3.10]
833-> PHE B 7 HB* - THR B 8 HN [ 1.80 3.60] 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.08 0.00 0.31 0.00 0.00 0.28 0.00 0.00 0.00 - 4 [ 0.08 .. 0.31]
834-> PHE B 7 HB* - ASN B 35 HD2* [ 1.80 4.19] 1.76 0.00 3.50 0.24 0.00 0.00 1.71 0.31 0.00 0.13 0.00 0.27 0.43 0.46 0.29 0.00 0.28 1.00 0.00 0.53 - 13 [ 0.13 .. 3.50]
835-> PHE B 7 HB* - ASN B 35 HN [ 1.80 5.00] 0.00 0.00 1.91 0.00 0.05 0.00 1.37 0.00 0.51 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 1.01 - 6 [ 0.05 .. 1.91]
839-> PHE B 7 HN - PHE B 7 HB* [ 1.80 3.25] 0.00 0.03 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.03 .. 0.15]
843-> THR B 8 HB - PHE B 9 HN [ 1.80 4.30] 0.01 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.13 0.00 0.00 0.11 0.00 0.00 0.00 - 4 [ 0.01 .. 0.13]
844-> THR B 8 HG2* - ASN B 35 HA [ 1.80 4.80] 0.00 0.40 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.11 .. 0.54]
845-> THR B 8 HG2* - ASN B 35 HN [ 1.80 4.80] 0.00 0.97 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.51 .. 0.97]
849-> THR B 8 HN - ASN B 35 HA [ 1.80 4.28] 0.84 0.00 0.65 0.00 0.00 0.00 1.95 0.00 1.32 0.00 0.23 0.12 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.44 - 8 [ 0.12 .. 1.95]
850-> THR B 8 HN - ASN B 35 HD2* [ 1.80 4.96] 1.20 0.54 0.31 0.82 0.00 0.13 0.47 0.00 0.00 0.00 0.21 0.00 0.00 0.00 1.12 0.00 0.00 0.40 0.00 0.00 - 9 [ 0.13 .. 1.20]
851-> THR B 8 HN - ASN B 35 HN [ 1.80 4.10] 0.56 0.38 0.48 0.00 0.00 0.00 2.08 0.00 1.28 0.00 0.29 0.00 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.35 - 8 [ 0.14 .. 2.08]
854-> PHE B 9 HA - VAL B 32 HG1* [ 1.80 4.43] 0.00 0.00 0.00 0.00 0.00 0.93 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.93 .. 1.24]
856-> PHE B 9 HA - PHE B 34 HD* [ 1.80 4.76] 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.97 .. 0.97]
857-> PHE B 9 HA - ASN B 35 HN [ 1.80 4.42] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 1.13 .. 1.13]
858-> PHE B 9 HB* - PHE B 34 HA [ 1.80 4.97] 0.00 0.00 0.00 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.04 0.00 0.00 0.00 0.00 - 3 [ 0.04 .. 0.86]
860-> PHE B 9 HB3 - VAL B 32 HG1* [ 1.80 4.28] 0.00 0.00 0.00 0.00 0.00 0.67 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.60 .. 0.67]
862-> PHE B 9 HB2 - VAL B 32 HG1* [ 1.80 4.28] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.23 0.00 0.00 0.00 - 1 [ 0.23 .. 0.23]
865-> PHE B 9 HD* - PHE B 34 HE* [ 1.80 4.33] 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.08 .. 2.01]
870-> GLU B 10 HA - VAL B 32 HG1* [ 1.80 4.87] 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 1.26 .. 1.26]
877-> GLU B 10 HN - VAL B 32 HG1* [ 1.80 3.88] 0.00 0.00 0.00 0.00 0.00 0.11 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.11 .. 0.97]
880-> GLU B 10 HN - PHE B 34 HA [ 1.80 4.54] 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.81 .. 0.81]
885-> ILE B 11 HA - VAL B 32 HG1* [ 1.80 4.21] 0.00 0.00 0.00 0.00 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.13 .. 0.13]
886-> ILE B 11 HA - VAL B 32 HG2* [ 1.80 3.96] 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.62 .. 0.62]
890-> ILE B 11 HD1* - VAL B 32 HG2* [ 1.80 4.57] 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.78 .. 0.78]
898-> ILE B 11 HG2* - GLU B 13 HN [ 1.80 3.71] 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.48 .. 0.48]
899-> ILE B 11 HG2* - ASN B 30 HA [ 1.80 4.96] 0.00 2.40 0.00 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.32 0.00 - 4 [ 0.08 .. 2.40]
900-> ILE B 11 HG2* - ASN B 30 HB3 [ 1.80 3.98] 0.00 2.58 0.00 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.09 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.45 0.00 - 5 [ 0.08 .. 2.58]
901-> ILE B 11 HG2* - ASN B 30 HB2 [ 1.80 3.98] 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 1.35 .. 1.35]
902-> ILE B 11 HG2* - ARG B 31 HN [ 1.80 4.39] 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 1.54 .. 1.54]
905-> ILE B 11 HG2* - VAL B 32 HG2* [ 1.80 3.65] 0.00 0.28 0.00 0.00 0.00 1.71 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.28 .. 1.71]
912-> ILE B 11 HN - VAL B 32 HG1* [ 1.80 5.07] 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.74 .. 0.74]
913-> ILE B 11 HN - VAL B 32 HG2* [ 1.80 5.25] 0.00 0.00 0.00 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.34 .. 0.34]
919-> GLU B 12 HG* - SER B 33 HB* [ 1.80 5.03] 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.38 0.00 - 3 [ 0.02 .. 0.90]
921-> GLU B 12 HG3 - ALA B 39 HB* [ 1.80 3.74] 0.61 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.10 0.00 0.36 0.92 0.00 1.26 0.39 0.00 2.16 0.00 0.12 0.00 - 9 [ 0.10 .. 2.16]
923-> GLU B 12 HG2 - VAL B 32 HA [ 1.80 5.19] 1.54 0.00 1.86 0.48 0.61 0.25 0.11 0.49 1.57 0.55 1.19 1.45 0.00 1.39 0.54 0.00 1.38 0.00 0.83 0.20 - 16 [ 0.11 .. 1.86]
924-> GLU B 12 HG2 - ALA B 39 HB* [ 1.80 4.50] 0.00 0.00 0.00 0.00 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.17 0.00 0.00 1.08 0.00 0.00 0.01 - 4 [ 0.01 .. 1.08]
925-> GLU B 12 HN - GLU B 12 HG3 [ 1.80 4.22] 0.32 0.00 0.34 0.00 0.00 0.00 0.00 0.23 0.01 0.14 0.01 0.28 0.00 0.28 0.15 0.00 0.34 0.00 0.01 0.00 - 11 [ 0.01 .. 0.34]
926-> GLU B 12 HN - GLU B 12 HG2 [ 1.80 4.60] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.13 0.08 0.19 0.06 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.09 0.00 - 6 [ 0.06 .. 0.22]
930-> GLU B 12 HN - VAL B 32 HG2* [ 1.80 5.10] 0.00 0.00 0.00 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.37 .. 0.37]
932-> GLU B 12 HN - ALA B 39 HB* [ 1.80 4.96] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.20 0.00 0.00 0.19 0.00 0.00 0.20 - 3 [ 0.19 .. 0.20]
939-> GLU B 13 HB* - ALA B 39 HB* [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.34 - 1 [ 0.34 .. 0.34]
943-> GLU B 13 HG* - LEU B 15 HD2* [ 1.80 4.70] 3.33 1.10 0.94 0.00 0.69 3.27 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.13 0.00 0.00 - 8 [ 0.13 .. 3.33]
952-> GLU B 13 HN - ALA B 39 HB* [ 1.80 5.00] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.55 0.03 0.00 0.69 - 4 [ 0.03 .. 0.69]
959-> LEU B 15 HA - LEU B 15 HD2* [ 1.80 3.13] 0.78 0.77 0.00 0.00 0.77 0.79 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 - 6 [ 0.74 .. 0.79]
971-> LEU B 15 HD1* - ASN B 30 HA [ 1.80 4.60] 0.58 0.37 0.00 0.00 0.38 0.75 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 - 6 [ 0.37 .. 0.84]
972-> LEU B 15 HD1* - ASN B 30 HB* [ 1.80 5.10] 1.07 0.88 0.34 0.00 0.64 1.12 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 - 7 [ 0.34 .. 1.47]
973-> LEU B 15 HD1* - ARG B 31 HA [ 1.80 5.07] 1.83 1.53 0.58 0.00 2.22 2.45 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 2.49 0.00 0.00 0.00 - 7 [ 0.58 .. 2.49]
974-> LEU B 15 HD1* - ARG B 31 HG* [ 1.80 4.30] 0.19 0.00 0.00 0.00 0.67 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 2.88 0.46 0.00 0.00 - 6 [ 0.14 .. 2.88]
975-> LEU B 15 HD1* - ARG B 31 HN [ 1.80 4.80] 1.33 1.14 0.92 0.00 1.32 1.98 0.00 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 - 7 [ 0.43 .. 1.98]
976-> LEU B 15 HD1* - PHE B 41 HA [ 1.80 4.80] 1.53 1.65 0.00 0.00 2.19 2.27 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 3.03 0.00 0.00 0.00 - 6 [ 1.12 .. 3.03]
977-> LEU B 15 HD1* - PHE B 41 HD* [ 1.80 3.80] 0.29 0.33 0.00 0.00 0.95 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 - 5 [ 0.29 .. 1.60]
981-> LEU B 15 HD2* - ARG B 31 HD* [ 1.80 4.04] 1.08 0.23 0.00 0.00 1.12 1.05 0.00 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.10 2.32 0.51 0.00 0.00 - 8 [ 0.10 .. 2.32]
982-> LEU B 15 HD2* - ARG B 31 HG* [ 1.80 3.81] 0.65 0.09 0.14 0.00 0.75 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 3.09 1.56 0.00 0.00 - 8 [ 0.09 .. 3.09]
984-> LEU B 15 HD2* - PHE B 64 HD* [ 1.80 5.60] 0.00 0.00 0.27 0.78 0.00 0.00 0.83 1.30 0.00 0.00 1.07 1.03 1.18 0.51 1.06 0.03 0.00 0.12 1.09 0.74 - 13 [ 0.03 .. 1.30]
985-> LEU B 15 HD2* - PHE B 64 HE* [ 1.80 4.80] 0.00 0.00 0.00 0.39 0.00 0.00 0.46 0.99 0.00 0.00 0.68 0.66 1.16 0.04 0.73 0.00 0.00 0.00 0.65 0.36 - 10 [ 0.04 .. 1.16]
986-> LEU B 15 HD2* - PHE B 64 HZ [ 1.80 4.80] 0.00 0.00 0.00 0.30 0.00 0.00 0.31 1.09 0.00 0.00 1.00 0.69 1.73 0.00 1.36 0.00 0.00 0.00 0.53 0.21 - 9 [ 0.21 .. 1.73]
987-> LEU B 15 HG - ASN B 30 HA [ 1.80 4.59] 1.25 0.91 0.00 0.00 0.93 1.20 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 - 6 [ 0.91 .. 1.40]
989-> LEU B 15 HN - LEU B 15 HG [ 1.80 4.22] 0.16 0.16 0.00 0.00 0.16 0.17 0.00 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.18 0.00 0.00 0.00 - 6 [ 0.16 .. 0.18]
998-> LEU B 16 HD1* - THR B 17 HN [ 1.80 4.80] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.04 0.00 - 2 [ 0.04 .. 0.10]
999-> LEU B 16 HD1* - ILE B 29 HB [ 1.80 5.04] 0.00 0.00 1.35 0.03 0.00 0.00 0.28 0.75 0.00 0.00 0.02 0.05 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 - 7 [ 0.02 .. 1.35]
1000-> LEU B 16 HD1* - ILE B 29 HD1* [ 1.80 4.30] 0.00 0.00 1.99 0.18 0.00 0.19 0.73 1.04 0.00 0.00 0.09 0.23 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 - 8 [ 0.09 .. 1.99]
1001-> LEU B 16 HD1* - ILE B 29 HN [ 1.80 5.60] 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.33 0.00 0.00 0.00 - 3 [ 0.03 .. 0.33]
1002-> LEU B 16 HD2* - ILE B 29 HB [ 1.80 4.49] 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.25 0.00 - 4 [ 0.18 .. 1.05]
1003-> LEU B 16 HD2* - ILE B 29 HD1* [ 1.80 4.30] 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 0.00 - 2 [ 0.44 .. 0.46]
1004-> LEU B 16 HD2* - ILE B 29 HG2* [ 1.80 5.60] 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.00 0.00 0.00 - 2 [ 0.48 .. 0.57]
1008-> LEU B 16 HN - ILE B 29 HD1* [ 1.80 4.99] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.13 0.00 0.00 0.23 0.00 0.00 - 3 [ 0.13 .. 0.24]
1015-> THR B 17 HG2* - THR B 26 HB [ 1.80 5.40] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 0.00 0.59 0.00 0.14 0.00 0.00 0.00 1.20 0.00 - 4 [ 0.14 .. 1.20]
1016-> THR B 17 HG2* - LYS B 27 HN [ 1.80 4.91] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.52 .. 0.52]
1017-> THR B 17 HG2* - GLU B 28 HA [ 1.80 4.29] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.42 .. 0.42]
1018-> THR B 17 HG2* - ILE B 29 HN [ 1.80 5.18] 0.00 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.03 .. 0.12]
1033-> LEU B 18 HD1* - LYS B 27 HB2 [ 1.80 4.80] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.27 - 2 [ 0.15 .. 0.27]
1034-> LEU B 18 HD1* - LYS B 27 HE* [ 1.80 5.39] 0.00 0.00 0.00 0.00 0.00 0.00 0.15 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.17 0.00 0.00 0.00 0.00 - 4 [ 0.00 .. 0.53]
1035-> LEU B 18 HD1* - LYS B 27 HG* [ 1.80 4.57] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.17 0.00 0.00 - 2 [ 0.17 .. 0.23]
1041-> LEU B 18 HG - LYS B 27 HG* [ 1.80 5.01] 1.05 1.18 1.01 0.00 1.18 0.99 1.20 0.00 1.93 1.05 1.26 1.13 0.87 0.83 0.00 1.37 0.95 1.44 1.14 0.00 - 16 [ 0.83 .. 1.93]
1055-> GLU B 20 HA - THR B 26 HG2* [ 1.80 3.79] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 0.00 0.00 0.00 0.88 0.00 0.03 0.00 0.91 0.22 - 5 [ 0.03 .. 0.91]
1058-> GLU B 20 HB3 - THR B 26 HG2* [ 1.80 4.50] 0.39 0.00 0.00 0.76 0.00 0.00 0.14 1.54 0.00 0.00 1.04 0.00 0.02 0.00 1.17 0.01 0.91 0.00 0.86 0.36 - 11 [ 0.01 .. 1.54]
1060-> GLU B 20 HB2 - THR B 26 HG2* [ 1.80 4.80] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 1.47 0.00 0.00 0.09 1.17 0.00 - 4 [ 0.09 .. 1.47]
1061-> GLU B 20 HG* - ASN B 21 HN [ 1.80 3.82] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.46 0.00 0.00 0.14 0.15 0.00 - 4 [ 0.14 .. 0.61]
1062-> GLU B 20 HG* - GLY B 24 HN [ 1.80 4.80] 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.82 0.09 0.00 0.90 1.63 0.00 - 6 [ 0.09 .. 1.63]
1063-> GLU B 20 HG* - TRP B 25 HN [ 1.80 5.10] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.59 0.00 0.00 0.54 0.43 0.00 - 4 [ 0.43 .. 0.92]
1073-> ASN B 21 HN - TRP B 25 HN [ 1.80 4.35] 0.13 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.41 0.00 0.00 0.00 0.00 - 4 [ 0.13 .. 0.41]
1075-> ASN B 21 HN - THR B 26 HG2* [ 1.80 4.80] 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 0.56 0.00 0.00 0.41 0.59 1.10 0.00 0.47 0.44 1.19 0.79 - 9 [ 0.41 .. 1.19]
1086-> GLY B 24 HA3 - PRO B 48 HG* [ 1.80 5.28] 2.54 0.00 0.00 0.00 0.00 0.00 0.00 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.78 - 4 [ 0.73 .. 4.52]
1087-> GLY B 24 HA2 - PRO B 48 HG* [ 1.80 6.05] 2.99 0.00 0.00 0.00 0.00 0.00 0.00 4.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 - 3 [ 0.10 .. 4.77]
1091-> TRP B 25 HB* - ALA B 45 HB* [ 1.80 4.39] 0.00 0.91 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.00 0.44 0.95 0.22 0.66 0.00 0.97 0.00 0.10 0.00 - 9 [ 0.10 .. 0.97]
1094-> TRP B 25 HE1 - SER B 47 HB* [ 1.80 6.05] 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.83 0.28 1.93 0.00 0.90 0.00 0.00 0.00 - 6 [ 0.28 .. 1.93]
1095-> TRP B 25 HE1 - PRO B 48 HD3 [ 1.80 5.00] 0.00 1.95 1.05 0.00 0.12 0.00 0.00 0.00 3.00 0.00 1.25 2.00 2.69 0.00 2.07 0.00 2.69 0.00 0.00 0.98 - 10 [ 0.12 .. 3.00]
1096-> TRP B 25 HE1 - PRO B 48 HD2 [ 1.80 5.00] 0.00 3.41 0.83 0.00 0.00 0.00 0.00 0.26 2.58 0.00 1.23 3.46 3.61 0.00 3.81 0.00 3.77 0.00 0.00 0.00 - 9 [ 0.26 .. 3.81]
1097-> TRP B 25 HE1 - PRO B 48 HG2 [ 1.80 5.29] 0.63 4.05 2.91 0.00 0.84 0.00 0.00 1.87 4.15 0.00 2.66 3.75 5.37 0.00 3.74 0.48 4.55 0.59 0.00 1.20 - 14 [ 0.48 .. 5.37]
1098-> TRP B 25 HE1 - LYS B 52 HE* [ 1.80 5.47] 2.33 5.76 3.77 2.38 2.28 3.38 0.00 0.00 0.00 0.06 3.56 6.54 4.19 0.27 5.90 0.73 6.61 2.57 0.00 0.17 - 17 [ 0.00 .. 6.61]
1099-> TRP B 25 HH2 - LYS B 52 HB3 [ 1.80 5.57] 4.65 0.37 3.02 0.00 0.00 0.00 0.00 3.29 0.00 0.00 0.00 0.99 0.00 0.00 0.80 0.00 0.91 3.42 0.00 0.00 - 8 [ 0.37 .. 4.65]
1100-> TRP B 25 HH2 - LYS B 52 HB2 [ 1.80 5.57] 5.77 0.08 2.82 0.00 0.00 0.00 0.00 2.90 0.00 0.00 0.00 2.75 0.00 0.00 2.57 0.00 0.00 2.87 0.00 1.00 - 8 [ 0.08 .. 5.77]
1101-> TRP B 25 HH2 - LYS B 52 HD* [ 1.80 4.58] 4.34 1.13 5.16 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.00 2.52 0.93 0.00 1.91 0.00 2.23 2.28 0.58 1.45 - 11 [ 0.58 .. 5.16]
1102-> TRP B 25 HH2 - LYS B 52 HG* [ 1.80 5.60] 5.02 1.52 3.37 0.00 0.00 0.00 0.00 0.43 0.00 0.00 0.00 1.14 0.00 0.00 0.61 0.00 1.31 3.30 0.00 0.00 - 8 [ 0.43 .. 5.02]
1103-> TRP B 25 HH2 - MET B 53 HN [ 1.80 5.21] 5.50 1.92 3.73 0.00 0.00 0.00 0.00 1.07 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.69 0.00 0.00 - 6 [ 0.27 .. 5.69]
1104-> TRP B 25 HN - TRP B 25 HD1 [ 1.80 3.66] 0.00 1.15 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.24 0.00 1.24 0.00 1.25 1.65 0.00 0.00 - 8 [ 0.00 .. 1.65]
1106-> TRP B 25 HN - PRO B 48 HD* [ 1.80 5.09] 1.49 0.00 0.00 0.00 0.00 0.00 0.00 2.45 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.09 0.00 0.00 1.00 - 5 [ 0.09 .. 2.45]
1107-> TRP B 25 HZ2 - LYS B 52 HD3 [ 1.80 4.43] 2.78 4.57 5.98 0.20 0.75 0.51 0.00 1.11 0.00 0.47 0.96 5.43 4.81 0.08 4.82 0.00 6.33 1.79 0.98 0.00 - 16 [ 0.08 .. 6.33]
1108-> TRP B 25 HZ2 - LYS B 52 HD2 [ 1.80 4.43] 3.83 4.05 5.20 0.20 0.00 0.86 0.00 0.83 0.89 0.00 0.95 7.03 3.48 0.00 6.49 0.00 5.18 1.59 0.07 0.98 - 15 [ 0.07 .. 7.03]
1109-> TRP B 25 HZ2 - LYS B 52 HG* [ 1.80 4.76] 3.86 4.43 3.13 0.00 0.38 0.68 0.00 1.37 0.00 0.00 1.69 4.30 2.37 0.00 3.69 0.08 4.38 2.68 0.00 0.00 - 13 [ 0.08 .. 4.43]
1110-> TRP B 25 HZ3 - ALA B 45 HB* [ 1.80 4.70] 1.02 0.58 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.74 0.00 0.89 2.60 0.00 0.29 - 8 [ 0.29 .. 2.60]
1113-> THR B 26 HB - LYS B 27 HN [ 1.80 4.31] 0.00 0.00 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.02 0.00 0.00 0.01 0.02 0.13 - 5 [ 0.01 .. 0.13]
1116-> THR B 26 HN - ALA B 45 HB* [ 1.80 4.85] 0.00 0.00 0.00 0.00 0.00 0.00 0.33 0.00 0.00 0.23 0.00 0.00 0.39 0.36 0.00 0.00 0.03 0.00 0.38 0.00 - 6 [ 0.03 .. 0.39]
1125-> LYS B 27 HB* - LYS B 27 HE* [ 1.80 3.37] 0.15 0.18 0.14 0.00 0.18 0.14 0.14 0.00 0.18 0.11 0.18 0.12 0.14 0.15 0.00 0.18 0.17 0.00 0.18 0.00 - 15 [ 0.11 .. 0.18]
1130-> LYS B 27 HG* - ARG B 44 HA [ 1.80 5.13] 0.67 0.90 0.58 0.00 0.00 0.13 0.72 0.00 0.00 0.85 0.04 0.02 1.21 1.11 0.00 0.00 0.90 0.78 1.08 0.00 - 13 [ 0.02 .. 1.21]
1138-> GLU B 28 HB* - TRP B 46 HD1 [ 1.80 6.05] 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 2.29 0.00 0.00 0.00 0.00 0.84 0.57 0.00 - 5 [ 0.10 .. 2.54]
1143-> GLU B 28 HN - TRP B 46 HD1 [ 1.80 5.05] 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 3.50 0.00 0.00 0.00 0.00 2.76 0.54 0.00 - 5 [ 0.54 .. 3.50]
1152-> ILE B 29 HD1* - PHE B 64 HZ [ 1.80 4.99] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 - 3 [ 0.34 .. 0.99]
1153-> ILE B 29 HD1* - MET B 67 HE* [ 1.80 4.69] 0.00 0.00 0.00 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 - 2 [ 0.01 .. 0.28]
1161-> ILE B 29 HG2* - ASP B 42 HN [ 1.80 4.09] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.29 .. 0.29]
1164-> ILE B 29 HG2* - ARG B 44 HN [ 1.80 5.07] 0.00 0.00 0.00 0.00 0.15 0.00 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 - 3 [ 0.03 .. 0.19]
1167-> ILE B 29 HG2* - PHE B 64 HZ [ 1.80 3.43] 0.29 0.39 0.64 0.29 0.38 0.00 0.46 1.85 0.67 1.08 0.00 0.16 0.00 0.32 0.00 0.00 0.00 0.00 1.55 0.61 - 13 [ 0.16 .. 1.85]
1172-> ASN B 30 HB* - VAL B 32 HG2* [ 1.80 5.06] 0.00 0.00 0.00 0.00 0.00 0.69 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.69 .. 0.69]
1182-> ARG B 31 HB* - ALA B 39 HB* [ 1.80 4.07] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 0.00 0.00 0.00 - 1 [ 0.14 .. 0.14]
1198-> ARG B 31 HH2* - ALA B 39 HB* [ 1.80 4.22] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.23 0.00 0.00 0.00 - 1 [ 0.23 .. 0.23]
1204-> VAL B 32 HB - PHE B 34 HZ [ 1.80 4.80] 0.00 0.00 0.00 0.00 0.00 5.73 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.39 .. 5.73]
1206-> VAL B 32 HG1* - PHE B 34 HD* [ 1.80 4.39] 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 1.98 .. 1.98]
1207-> VAL B 32 HG1* - PHE B 34 HZ [ 1.80 4.06] 0.00 0.00 0.00 0.00 0.00 5.89 0.00 0.00 0.00 0.11 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.06 .. 5.89]
1209-> VAL B 32 HG2* - PHE B 34 HZ [ 1.80 4.60] 0.00 0.00 0.00 0.00 0.00 2.79 0.00 0.00 0.00 0.19 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.08 .. 2.79]
1210-> VAL B 32 HG2* - ASP B 42 HB* [ 1.80 3.95] 0.00 0.00 0.00 0.00 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.10 .. 0.10]
1216-> VAL B 32 HN - ALA B 39 HB* [ 1.80 4.21] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.11 0.00 0.00 0.00 0.00 0.28 - 3 [ 0.11 .. 0.44]
1224-> SER B 33 HB* - ALA B 39 HB* [ 1.80 3.82] 0.00 0.64 0.00 0.00 0.14 0.50 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.28 - 6 [ 0.03 .. 0.64]
1235-> ASN B 35 HB* - GLY B 36 HN [ 1.80 4.00] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.10 .. 0.10]
1239-> ALA B 37 HA - PRO B 38 HD* [ 1.80 3.34] 0.20 0.00 0.21 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.20 0.00 0.21 0.00 0.00 0.00 - 6 [ 0.20 .. 0.24]
1241-> ALA B 37 HB* - PRO B 38 HG* [ 1.80 5.00] 0.00 0.00 0.00 0.12 0.00 0.00 0.00 0.07 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.08 - 4 [ 0.07 .. 0.12]
1258-> LYS B 40 HD* - ASN B 61 HN [ 1.80 5.27] 0.00 0.12 0.00 0.00 0.00 0.00 0.01 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.21 0.00 - 5 [ 0.01 .. 1.29]
1259-> LYS B 40 HE* - SER B 60 HA [ 1.80 4.80] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.56 .. 1.45]
1260-> LYS B 40 HE* - ASN B 61 HN [ 1.80 4.80] 0.00 0.01 0.00 0.00 0.00 0.00 0.81 0.00 2.42 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.16 0.00 - 5 [ 0.01 .. 2.42]
1262-> LYS B 40 HG* - SER B 60 HA [ 1.80 4.77] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.74 .. 0.74]
1270-> PHE B 41 HB* - PHE B 64 HZ [ 1.80 5.40] 0.00 0.00 0.00 0.00 0.02 0.00 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.02 .. 0.75]
1272-> PHE B 41 HB3 - LEU B 59 HD1* [ 1.80 5.00] 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 1.09 .. 1.09]
1277-> PHE B 41 HD* - PHE B 64 HA [ 1.80 5.56] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.83 .. 0.83]
1284-> ASP B 42 HA - ILE B 57 HG2* [ 1.80 5.26] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.94 .. 0.94]
1287-> ASP B 42 HA - LEU B 59 HD1* [ 1.80 5.36] 0.00 0.44 0.28 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.02 0.00 0.93 0.51 0.00 0.00 0.00 0.00 0.78 0.00 - 7 [ 0.02 .. 0.93]
1288-> ASP B 42 HA - LEU B 59 HG [ 1.80 5.51] 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.13 0.00 - 3 [ 0.07 .. 0.84]
1295-> ILE B 43 HA - ILE B 57 HG2* [ 1.80 5.51] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.56 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.56 .. 1.04]
1297-> ILE B 43 HB - ILE B 57 HG2* [ 1.80 3.63] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.05 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.05 .. 0.68]
1299-> ILE B 43 HD1* - ILE B 57 HG2* [ 1.80 4.30] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.37 .. 0.37]
1300-> ILE B 43 HD1* - THR B 58 HA [ 1.80 6.05] 0.09 0.00 0.00 0.18 0.04 0.00 0.00 0.14 0.15 0.00 0.00 0.00 0.00 0.00 0.24 0.03 0.00 0.00 0.00 0.00 - 7 [ 0.03 .. 0.24]
1301-> ILE B 43 HD1* - LEU B 59 HD2* [ 1.80 4.83] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.09 0.00 0.00 0.37 0.00 - 2 [ 0.09 .. 0.37]
1303-> ILE B 43 HD1* - PHE B 64 HE* [ 1.80 4.49] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.39 .. 0.39]
1305-> ILE B 43 HG1* - ILE B 57 HG2* [ 1.80 3.81] 0.00 0.00 0.00 0.50 0.00 0.00 0.00 0.20 0.00 0.00 0.00 0.00 1.79 0.53 0.00 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.20 .. 1.79]
1310-> ILE B 43 HG2* - PHE B 64 HE* [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.47 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.04 - 5 [ 0.04 .. 0.71]
1315-> ILE B 43 HN - ILE B 57 HG2* [ 1.80 3.82] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.36 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.36 .. 1.34]
1318-> ILE B 43 HN - THR B 58 HG2* [ 1.80 5.29] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.02 0.04 0.00 0.00 0.00 0.00 - 3 [ 0.02 .. 0.19]
1319-> ILE B 43 HN - LEU B 59 HD1* [ 1.80 5.35] 0.00 0.00 0.00 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.17 0.00 - 3 [ 0.17 .. 0.24]
1320-> ILE B 43 HN - LEU B 59 HG [ 1.80 5.61] 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.57 .. 0.57]
1327-> ALA B 45 HB* - GLY B 54 HA* [ 1.80 4.30] 0.00 0.08 0.00 0.89 2.02 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.76 0.00 0.00 0.00 0.00 - 7 [ 0.00 .. 2.02]
1332-> TRP B 46 HN - TRP B 46 HD1 [ 1.80 5.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.21 .. 0.21]
1356-> LYS B 52 HB2 - MET B 53 HN [ 1.80 4.04] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 - 2 [ 0.00 .. 0.42]
1361-> LYS B 52 HN - LYS B 52 HG* [ 1.80 4.21] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.00 .. 0.17]
1369-> MET B 53 HN - MET B 53 HG* [ 1.80 4.10] 0.19 0.00 0.00 0.00 0.12 0.21 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.12 .. 0.21]
1379-> LYS B 55 HB* - GLY B 56 HN [ 1.80 3.85] 0.00 0.00 0.00 0.00 0.13 0.00 0.00 0.01 0.00 0.09 0.00 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.01 .. 0.13]
1384-> LYS B 55 HN - LYS B 55 HD* [ 1.80 4.58] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.18 0.15 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.12 .. 0.18]
1385-> LYS B 55 HN - LYS B 55 HG* [ 1.80 3.87] 0.00 0.00 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.13 .. 0.13]
1393-> ILE B 57 HD1* - THR B 58 HN [ 1.80 4.33] 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.03 .. 0.91]
1394-> ILE B 57 HG1* - THR B 58 HN [ 1.80 3.62] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.49 .. 0.49]
1400-> ILE B 57 HN - ILE B 57 HG2* [ 1.80 3.38] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.42 .. 0.42]
1418-> LEU B 59 HN - LEU B 59 HG [ 1.80 4.22] 0.00 0.00 0.00 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.16 .. 0.16]
1425-> ASN B 61 HB* - GLU B 62 HN [ 1.80 3.52] 0.00 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.30 0.00 - 4 [ 0.03 .. 0.37]
1426-> ASN B 61 HD2* - GLU B 62 HN [ 1.80 5.12] 0.00 0.00 0.13 0.09 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.21 0.15 0.02 0.00 0.00 - 6 [ 0.02 .. 0.21]
1434-> GLU B 62 HA - THR B 66 HN [ 1.80 4.70] 0.16 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.12 .. 0.16]
1447-> GLU B 63 HA - MET B 67 HN [ 1.80 5.38] 0.18 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.18 .. 0.40]
1455-> PHE B 64 HA - MET B 67 HE* [ 1.80 3.80] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.58 0.00 0.00 0.00 - 2 [ 0.58 .. 0.82]
1456-> PHE B 64 HA - MET B 67 HB* [ 1.80 4.30] 0.67 0.00 0.00 0.00 0.26 0.00 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 0.00 0.00 0.00 - 4 [ 0.14 .. 0.67]
1462-> PHE B 64 HD* - MET B 67 HE* [ 1.80 3.13] 0.17 0.00 0.00 0.00 0.13 0.00 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.64 0.00 0.00 0.00 - 5 [ 0.13 .. 0.85]
1464-> PHE B 64 HE* - MET B 67 HE* [ 1.80 3.17] 1.12 0.00 0.00 0.00 1.37 0.59 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 0.00 0.00 - 5 [ 0.55 .. 1.70]
1468-> GLN B 65 HA - GLN B 65 HE21 [ 1.80 4.82] 0.28 0.14 0.00 0.12 0.00 0.00 0.22 0.06 0.00 0.00 0.12 0.00 0.21 0.07 0.00 0.33 0.00 0.14 0.31 0.09 - 12 [ 0.06 .. 0.33]
1469-> GLN B 65 HA - GLN B 65 HE22 [ 1.80 4.86] 1.16 1.13 0.00 1.12 0.00 0.00 1.17 1.05 0.00 0.00 1.14 0.00 1.16 1.10 0.00 1.23 0.00 1.13 1.21 1.12 - 12 [ 1.05 .. 1.23]
1473-> GLN B 65 HA - VAL B 68 HB [ 1.80 4.06] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.85 .. 0.85]
1474-> GLN B 65 HA - VAL B 68 HG1* [ 1.80 4.23] 0.00 0.00 0.00 0.60 0.00 0.00 0.64 0.00 0.00 0.00 0.06 0.05 0.00 0.00 0.29 0.17 0.00 0.00 0.10 0.00 - 8 [ 0.00 .. 0.64]
1475-> GLN B 65 HA - VAL B 68 HG2* [ 1.80 3.73] 0.00 0.00 0.00 0.39 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.39 .. 0.56]
1477-> GLN B 65 HA - ASP B 69 HN [ 1.80 4.77] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.00 0.00 0.00 0.40 0.15 - 3 [ 0.07 .. 0.40]
1480-> GLN B 65 HE21 - VAL B 68 HB [ 1.80 4.75] 2.22 1.79 0.00 3.27 0.00 0.00 2.86 3.18 0.00 0.00 2.58 0.00 2.26 0.96 0.00 3.04 0.00 2.51 1.56 2.58 - 12 [ 0.96 .. 3.27]
1481-> GLN B 65 HE21 - VAL B 68 HG1* [ 1.80 5.13] 1.43 1.02 0.00 3.02 0.00 0.00 2.39 2.04 0.00 0.00 2.14 0.00 1.80 0.25 0.00 2.76 0.00 2.13 1.27 1.79 - 12 [ 0.25 .. 3.02]
1482-> GLN B 65 HE22 - VAL B 68 HB [ 1.80 4.94] 2.63 2.45 0.00 4.28 0.00 0.00 4.07 4.56 0.00 0.00 3.58 0.00 3.14 2.25 0.00 3.51 0.00 3.42 2.85 3.42 - 12 [ 2.25 .. 4.56]
1483-> GLN B 65 HE22 - VAL B 68 HG1* [ 1.80 4.27] 2.71 2.62 0.00 4.92 0.00 0.00 4.56 4.00 0.00 0.00 4.06 0.00 3.54 2.53 0.21 4.06 0.00 3.97 3.43 3.66 - 13 [ 0.21 .. 4.92]
1496-> THR B 66 HA - ALA B 70 HN [ 1.80 4.80] 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.00 0.79 0.00 - 3 [ 0.20 .. 0.79]
1503-> MET B 67 HA - ALA B 70 HB* [ 1.80 3.77] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 - 1 [ 0.88 .. 0.88]
1504-> MET B 67 HA - ALA B 70 HN [ 1.80 4.26] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.17 0.00 - 1 [ 0.17 .. 0.17]
1505-> MET B 67 HA - PHE B 71 HN [ 1.80 4.28] 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.53 0.00 0.00 0.68 0.00 0.96 0.08 0.00 0.00 0.00 0.00 0.74 0.00 - 6 [ 0.08 .. 0.96]
1507-> MET B 67 HE* - VAL B 68 HG2* [ 1.80 3.40] 1.12 0.62 0.00 0.00 1.23 0.99 0.00 0.92 1.33 0.56 0.00 0.00 0.00 0.00 1.06 1.38 0.79 0.00 0.36 1.02 - 12 [ 0.36 .. 1.38]
1508-> MET B 67 HE* - VAL B 68 HN [ 1.80 4.18] 0.65 0.17 0.00 0.00 0.64 0.50 0.00 0.00 0.63 0.04 0.00 0.00 0.00 0.00 0.39 0.86 0.37 0.00 0.18 0.37 - 11 [ 0.04 .. 0.86]
1513-> MET B 67 HN - MET B 67 HG2 [ 1.80 4.83] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 0.00 0.00 0.00 - 1 [ 0.14 .. 0.14]
1520-> VAL B 68 HA - LYS B 72 HN [ 1.80 5.17] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 - 2 [ 0.10 .. 0.32]
1521-> VAL B 68 HB - ASP B 69 HN [ 1.80 3.64] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.44 .. 0.44]
1522-> VAL B 68 HG1* - ASP B 69 HN [ 1.80 3.78] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.19 .. 0.19]
1529-> ASP B 69 HA - LYS B 72 HB* [ 1.80 4.20] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 - 1 [ 0.85 .. 0.85]
1536-> ALA B 70 HA - GLY B 73 HN [ 1.80 4.40] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.45 0.08 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.08 .. 0.95]
1538-> ALA B 70 HB* - GLY B 73 HN [ 1.80 5.07] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.20 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.20 .. 1.06]
1543-> PHE B 71 HA - LEU B 75 HB* [ 1.80 4.99] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.00 - 1 [ 0.39 .. 0.39]
1547-> PHE B 71 HD* - LEU B 75 HB* [ 1.80 4.88] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.67 - 4 [ 0.35 .. 1.63]
1558-> LYS B 72 HG3 - GLY B 73 HN [ 1.80 5.00] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.18 .. 0.18]
1560-> LYS B 72 HG2 - GLY B 73 HN [ 1.80 4.23] 0.00 0.00 0.83 0.00 0.03 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 - 4 [ 0.03 .. 0.86]
1567-> ASN B 74 HB3 - LEU B 75 HN [ 1.80 4.48] 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.01 .. 0.13]
1568-> ASN B 74 HB2 - LEU B 75 HN [ 1.80 4.48] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.22 .. 0.22]
1569-> LEU B 75 HA - LEU B 75 HD1* [ 1.80 3.73] 0.16 0.12 0.00 0.13 0.12 0.16 0.15 0.00 0.20 0.18 0.13 0.13 0.00 0.15 0.16 0.13 0.14 0.00 0.12 0.00 - 15 [ 0.12 .. 0.20]
1595-> HIS B 81 HN - HIS B 81 HB* [ 1.80 3.29] 0.00 0.00 0.00 0.00 0.00 0.00 0.11 0.00 0.00 0.09 0.00 0.00 0.09 0.00 0.11 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.09 .. 0.11]
1597-> LEU A 15 HB* - PHE B 71 HD* [ 1.80 4.98] 1.64 1.81 0.00 0.00 1.32 1.04 0.00 0.18 0.85 2.06 0.00 0.00 0.21 0.17 2.46 0.24 0.55 0.00 0.00 0.05 - 13 [ 0.05 .. 2.46]
1598-> LEU A 15 HD1* - PHE B 71 HE* [ 1.80 3.37] 0.46 0.80 0.00 0.64 0.37 0.76 0.52 0.00 1.34 0.50 0.00 0.28 0.00 0.15 2.63 1.01 0.95 0.00 0.00 1.00 - 14 [ 0.15 .. 2.63]
1599-> LEU A 15 HD1* - PHE B 71 HZ [ 1.80 4.77] 0.50 0.71 0.00 0.00 0.66 1.03 0.00 0.00 0.45 0.46 0.00 0.00 0.00 0.00 1.43 0.14 1.36 0.00 0.00 0.76 - 10 [ 0.14 .. 1.43]
1600-> LEU A 15 HD2* - PHE B 71 HD* [ 1.80 5.60] 0.00 0.00 0.00 0.04 0.00 0.00 0.00 0.31 1.30 0.00 0.00 0.00 0.00 0.25 2.65 0.56 0.00 0.00 0.00 0.41 - 7 [ 0.04 .. 2.65]
1601-> LEU A 15 HD2* - PHE B 71 HE* [ 1.80 3.94] 0.00 0.00 0.24 0.78 0.00 0.00 0.47 1.32 1.84 0.00 0.00 0.23 0.00 0.86 3.75 1.71 0.00 0.25 1.23 2.30 - 12 [ 0.23 .. 3.75]
1603-> LEU A 16 HD1* - THR B 66 HG2* [ 1.80 3.49] 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.12 0.00 0.00 0.00 0.56 0.00 0.00 - 4 [ 0.12 .. 0.58]
1604-> LEU A 16 HD1* - MET B 67 HA [ 1.80 4.26] 0.00 0.00 1.85 0.00 0.00 0.00 0.17 1.59 0.00 0.00 0.16 0.05 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.19 - 7 [ 0.05 .. 1.85]
1605-> LEU A 16 HD1* - MET B 67 HN [ 1.80 4.63] 0.00 0.00 2.57 0.67 0.00 0.74 1.00 2.19 0.06 0.00 1.02 0.93 0.00 0.23 0.17 0.84 2.32 0.30 0.00 0.36 - 14 [ 0.06 .. 2.57]
1606-> LEU A 16 HD1* - ALA B 70 HA [ 1.80 5.06] 1.31 1.60 0.00 0.00 1.32 0.00 0.00 0.00 0.00 1.26 0.12 0.00 0.00 1.63 1.70 0.00 0.00 1.26 0.00 1.49 - 9 [ 0.12 .. 1.70]
1607-> LEU A 16 HD1* - ALA B 70 HB* [ 1.80 3.07] 0.65 0.89 0.58 0.00 0.66 0.00 0.00 0.55 0.00 0.66 0.00 0.00 0.00 0.85 1.03 0.00 0.76 0.48 0.00 0.85 - 11 [ 0.48 .. 1.03]
1608-> LEU A 16 HD1* - ALA B 70 HN [ 1.80 4.72] 0.72 1.19 0.70 0.34 0.77 0.29 0.10 0.39 0.00 0.97 0.79 0.01 0.00 1.10 1.04 0.00 0.97 1.09 0.00 1.65 - 16 [ 0.01 .. 1.65]
1609-> LEU A 16 HD1* - PHE B 71 HE* [ 1.80 4.98] 0.00 0.00 2.38 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 0.00 0.00 0.00 - 3 [ 2.24 .. 2.46]
1610-> LEU A 16 HD1* - PHE B 71 HN [ 1.80 4.68] 1.43 1.82 2.24 0.73 1.52 0.99 0.39 2.35 0.00 1.98 1.99 0.79 0.50 1.61 2.04 0.71 2.55 0.98 0.00 1.95 - 18 [ 0.39 .. 2.55]
1611-> LEU A 16 HD1* - PHE B 71 HZ [ 1.80 5.48] 0.00 0.00 3.59 0.00 0.00 0.73 0.00 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.80 1.14 4.01 0.00 0.00 0.00 - 6 [ 0.73 .. 4.01]
1615-> LEU A 16 HD2* - ALA B 70 HA [ 1.80 5.33] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.18 .. 0.18]
1617-> LEU A 16 HD2* - ALA B 70 HN [ 1.80 4.70] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.37 .. 0.37]
1618-> LEU A 16 HD2* - PHE B 71 HE* [ 1.80 5.03] 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.13 0.00 - 4 [ 0.13 .. 0.84]
1619-> LEU A 16 HD2* - PHE B 71 HN [ 1.80 5.16] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.01 .. 0.42]
1620-> LEU A 16 HG - PHE B 71 HE* [ 1.80 4.86] 0.00 0.00 2.91 0.00 0.00 0.57 0.00 2.49 0.58 0.00 0.16 0.09 0.00 0.00 1.14 0.58 2.73 0.00 0.00 0.00 - 9 [ 0.09 .. 2.91]
1621-> LEU A 18 HA - THR B 66 HG2* [ 1.80 3.49] 0.00 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.16 0.00 0.42 - 4 [ 0.16 .. 0.56]
1623-> LEU A 18 HD1* - GLU B 63 HA [ 1.80 4.70] 0.35 0.54 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.60 0.59 0.00 0.00 - 6 [ 0.10 .. 0.72]
1625-> LEU A 18 HD1* - PHE B 64 HA [ 1.80 5.41] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.36 .. 0.36]
1626-> LEU A 18 HD1* - THR B 66 HG2* [ 1.80 4.75] 0.00 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.45 0.08 0.00 0.00 0.00 0.35 0.00 0.79 0.00 0.00 - 5 [ 0.08 .. 0.79]
1628-> LEU A 18 HD1* - MET B 67 HG3 [ 1.80 5.53] 0.14 0.00 0.00 0.00 0.37 0.02 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.02 .. 0.37]
1629-> LEU A 18 HD1* - MET B 67 HG2 [ 1.80 5.53] 0.00 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.07 .. 0.23]
1630-> LEU A 18 HD1* - MET B 67 HN [ 1.80 5.31] 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.04 .. 0.46]
1635-> LEU A 18 HD2* - THR B 66 HG2* [ 1.80 3.12] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 - 1 [ 0.24 .. 0.24]
1637-> LEU A 18 HD2* - MET B 67 HA [ 1.80 3.81] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 - 1 [ 0.73 .. 0.73]
1641-> LEU A 18 HD2* - MET B 67 HN [ 1.80 3.67] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.23 - 1 [ 0.23 .. 0.23]
1642-> LEU A 18 HD2* - VAL B 68 HN [ 1.80 5.52] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 - 1 [ 0.50 .. 0.50]
1643-> LEU A 18 HG - THR B 66 HG2* [ 1.80 5.36] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.28 0.00 0.00 - 2 [ 0.09 .. 0.28]
1644-> LYS A 27 HA - ILE B 57 HD1* [ 1.80 5.63] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.34 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.34 .. 0.54]
1645-> LYS A 27 HD* - ILE B 57 HD1* [ 1.80 3.23] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.78 0.00 0.00 0.00 0.73 0.37 0.00 - 4 [ 0.37 .. 1.78]
1646-> LYS A 27 HD* - ILE B 57 HG1* [ 1.80 3.81] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.71 0.00 0.00 0.00 1.03 0.75 0.00 - 4 [ 0.75 .. 2.04]
1647-> LYS A 27 HE* - ILE B 57 HD1* [ 1.80 3.84] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 2.00 0.00 0.00 0.00 0.00 0.59 0.00 - 3 [ 0.59 .. 2.00]
1648-> LYS A 27 HE* - LEU B 59 HA [ 1.80 5.25] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.45 0.00 - 1 [ 0.45 .. 0.45]
1649-> LYS A 27 HE* - LEU B 59 HD2* [ 1.80 3.81] 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.20 0.00 - 3 [ 0.07 .. 1.39]
1650-> LYS A 27 HG* - ILE B 57 HD1* [ 1.80 4.25] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 1.02 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.91 .. 1.02]
1651-> LYS A 27 HG* - ILE B 57 HG2* [ 1.80 5.87] 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 - 2 [ 0.11 .. 0.87]
1652-> LYS A 27 HG* - LEU B 59 HD1* [ 1.80 5.87] 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.00 0.00 0.00 0.02 0.14 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.00 - 4 [ 0.02 .. 0.35]
1658-> ILE A 29 HD1* - PHE B 71 HD* [ 1.80 4.95] 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.05 .. 0.26]
1661-> ILE A 29 HG2* - PHE B 71 HE* [ 1.80 4.11] 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.07 .. 0.52]
1663-> PHE A 41 HD* - LEU B 75 HD2* [ 1.80 5.00] 0.47 0.44 0.12 0.00 1.53 0.77 0.19 0.44 0.80 0.43 0.00 0.00 0.00 0.00 0.00 0.91 0.28 0.00 1.21 0.00 - 12 [ 0.12 .. 1.53]
1664-> ILE A 43 HB - ILE B 57 HD1* [ 1.80 4.69] 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 - 3 [ 0.01 .. 0.78]
1665-> ARG A 44 HA - ILE B 57 HD1* [ 1.80 3.59] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.13 0.00 - 2 [ 0.13 .. 1.60]
1667-> ALA A 45 HN - ILE B 57 HD1* [ 1.80 4.88] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.36 .. 0.36]
1668-> LYS A 55 HB* - ILE B 57 HD1* [ 1.80 4.76] 0.61 0.37 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.94 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.02 0.00 0.00 - 6 [ 0.02 .. 0.94]
1669-> GLY A 56 HA* - ILE B 57 HG13 [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.61 .. 0.61]
1671-> GLY A 56 HA* - ILE B 57 HG2* [ 1.80 5.10] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.24 .. 0.24]
1672-> GLY A 56 HA3 - ILE B 57 HB [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.84 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 1.25 .. 1.84]
1673-> GLY A 56 HA3 - ILE B 57 HD1* [ 1.80 4.65] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 1.03 .. 1.03]
1674-> GLY A 56 HA2 - ILE B 57 HB [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.52 .. 0.52]
1676-> GLY A 56 HN - ILE B 57 HB [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.93 .. 0.93]
1677-> GLY A 56 HN - ILE B 57 HD1* [ 1.80 4.86] 0.63 0.27 0.00 0.00 0.80 0.00 0.00 0.00 0.64 0.59 0.52 0.24 1.35 0.00 0.02 0.00 0.00 0.49 0.00 0.00 - 10 [ 0.02 .. 1.35]
1678-> ILE A 57 HB - GLY B 56 HA3 [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.84 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 1.25 .. 1.84]
1679-> ILE A 57 HB - GLY B 56 HA2 [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.52 .. 0.52]
1680-> ILE A 57 HB - GLY B 56 HN [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.93 .. 0.93]
1681-> ILE A 57 HD1* - LYS B 27 HA [ 1.80 5.63] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.33 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.33 .. 0.54]
1682-> ILE A 57 HD1* - LYS B 27 HD* [ 1.80 3.23] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.78 0.00 0.00 0.00 0.73 0.37 0.00 - 4 [ 0.37 .. 1.78]
1683-> ILE A 57 HD1* - LYS B 27 HE* [ 1.80 3.84] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 2.00 0.00 0.00 0.00 0.00 0.59 0.00 - 3 [ 0.59 .. 2.00]
1684-> ILE A 57 HD1* - LYS B 27 HG* [ 1.80 4.25] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 1.01 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.91 .. 1.01]
1685-> ILE A 57 HD1* - ILE B 43 HB [ 1.80 4.69] 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 - 3 [ 0.01 .. 0.78]
1686-> ILE A 57 HD1* - ARG B 44 HA [ 1.80 3.59] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.13 0.00 - 2 [ 0.13 .. 1.60]
1688-> ILE A 57 HD1* - ALA B 45 HN [ 1.80 4.88] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.35 .. 0.35]
1689-> ILE A 57 HD1* - LYS B 55 HB* [ 1.80 4.76] 0.61 0.37 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.94 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.02 0.00 0.00 - 6 [ 0.02 .. 0.94]
1690-> ILE A 57 HD1* - GLY B 56 HA3 [ 1.80 4.65] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 1.03 .. 1.03]
1692-> ILE A 57 HD1* - GLY B 56 HN [ 1.80 4.86] 0.63 0.27 0.00 0.00 0.80 0.00 0.00 0.00 0.64 0.59 0.52 0.24 1.35 0.00 0.02 0.00 0.00 0.49 0.00 0.00 - 10 [ 0.02 .. 1.35]
1694-> ILE A 57 HG1* - LYS B 27 HD* [ 1.80 3.81] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.71 0.00 0.00 0.00 1.03 0.75 0.00 - 4 [ 0.75 .. 2.04]
1695-> ILE A 57 HG13 - GLY B 56 HA* [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.61 .. 0.61]
1697-> ILE A 57 HG2* - LYS B 27 HG* [ 1.80 5.87] 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 - 2 [ 0.11 .. 0.87]
1698-> ILE A 57 HG2* - GLY B 56 HA* [ 1.80 5.10] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.24 .. 0.24]
1700-> LEU A 59 HA - LYS B 27 HE* [ 1.80 5.25] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.45 0.00 - 1 [ 0.45 .. 0.45]
1701-> LEU A 59 HD1* - LYS B 27 HG* [ 1.80 5.87] 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.00 0.00 0.00 0.02 0.14 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.00 - 4 [ 0.02 .. 0.35]
1702-> LEU A 59 HD2* - LYS B 27 HE* [ 1.80 3.81] 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.20 0.00 - 3 [ 0.07 .. 1.39]
1704-> ASN A 61 HA - LEU B 75 HD2* [ 1.80 5.57] 2.13 2.04 1.76 2.70 2.44 1.69 2.30 0.00 2.78 2.02 0.00 2.03 0.00 2.08 0.37 3.12 1.86 1.00 0.00 0.00 - 15 [ 0.37 .. 3.12]
1706-> GLU A 63 HA - LEU B 18 HD1* [ 1.80 4.70] 0.35 0.54 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.60 0.59 0.00 0.00 - 6 [ 0.10 .. 0.72]
1709-> PHE A 64 HA - LEU B 18 HD1* [ 1.80 5.41] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.36 .. 0.36]
1711-> PHE A 64 HA - LEU B 75 HD2* [ 1.80 5.04] 3.12 2.94 1.40 3.33 3.40 3.73 3.36 0.04 2.62 3.08 1.19 3.59 0.00 3.23 0.72 3.51 2.98 1.92 2.62 0.00 - 18 [ 0.04 .. 3.73]
1712-> PHE A 64 HE* - PHE B 71 HZ [ 1.80 4.22] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.37 .. 0.44]
1713-> PHE A 64 HN - LEU B 75 HD2* [ 1.80 5.83] 2.97 2.80 1.80 3.31 3.34 3.07 3.35 0.00 3.29 2.99 0.63 3.30 0.00 3.06 0.93 3.51 2.94 1.80 1.42 0.00 - 17 [ 0.63 .. 3.51]
1714-> PHE A 64 HZ - PHE B 71 HE* [ 1.80 3.89] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.77 .. 0.77]
1715-> GLN A 65 HA - LEU B 75 HD1* [ 1.80 4.57] 0.53 0.36 0.91 2.04 0.33 0.00 2.43 0.00 1.24 0.60 0.00 1.19 0.00 1.71 2.09 0.95 0.59 0.00 0.00 0.67 - 14 [ 0.33 .. 2.43]
1716-> GLN A 65 HE22 - GLU B 76 HB* [ 1.80 5.58] 2.87 1.87 1.68 4.78 1.08 0.02 4.18 2.49 0.00 0.00 0.00 0.00 1.05 0.32 0.00 6.56 2.08 4.48 0.00 0.56 - 14 [ 0.02 .. 6.56]
1717-> GLN A 65 HE22 - HIS B 77 HN [ 1.80 5.57] 1.59 2.87 3.05 2.49 0.80 0.00 1.62 1.16 1.03 0.00 1.59 0.00 0.99 0.00 2.32 4.25 4.46 8.09 0.28 1.43 - 16 [ 0.28 .. 8.09]
1718-> GLN A 65 HN - LEU B 75 HD2* [ 1.80 3.84] 3.90 3.73 2.36 4.29 3.76 3.53 4.45 0.00 4.21 3.78 1.02 4.07 0.00 3.79 3.01 4.37 3.99 2.48 1.70 0.00 - 17 [ 1.02 .. 4.45]
1721-> THR A 66 HG2* - LEU B 16 HD1* [ 1.80 3.49] 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.12 0.00 0.00 0.00 0.56 0.00 0.00 - 4 [ 0.12 .. 0.58]
1723-> THR A 66 HG2* - LEU B 18 HA [ 1.80 3.49] 0.00 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.16 0.00 0.42 - 4 [ 0.16 .. 0.56]
1724-> THR A 66 HG2* - LEU B 18 HD1* [ 1.80 4.75] 0.00 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.45 0.08 0.00 0.00 0.00 0.35 0.00 0.79 0.00 0.00 - 5 [ 0.08 .. 0.79]
1725-> THR A 66 HG2* - LEU B 18 HD2* [ 1.80 3.12] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 - 1 [ 0.24 .. 0.24]
1726-> THR A 66 HG2* - LEU B 18 HG [ 1.80 5.36] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.28 0.00 0.00 - 2 [ 0.09 .. 0.28]
1728-> MET A 67 HA - LEU B 16 HD1* [ 1.80 4.26] 0.00 0.00 1.85 0.00 0.00 0.00 0.17 1.59 0.00 0.00 0.17 0.05 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.18 - 7 [ 0.05 .. 1.85]
1730-> MET A 67 HA - LEU B 18 HD2* [ 1.80 3.81] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 - 1 [ 0.73 .. 0.73]
1735-> MET A 67 HE* - PHE B 71 HB* [ 1.80 3.77] 2.74 1.70 1.63 0.42 2.99 2.99 0.56 0.70 2.73 2.08 0.96 0.64 1.01 0.60 1.82 1.82 1.77 0.41 0.55 0.96 - 20 [ 0.41 .. 2.99]
1736-> MET A 67 HE* - PHE B 71 HD* [ 1.80 4.81] 0.31 0.00 0.00 0.00 0.60 0.68 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.31 .. 0.74]
1737-> MET A 67 HE* - PHE B 71 HE* [ 1.80 4.39] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.46 .. 0.68]
1738-> MET A 67 HE* - PHE B 71 HZ [ 1.80 3.94] 0.86 0.00 0.00 1.18 0.89 1.36 0.99 0.00 0.00 0.00 2.72 1.99 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 8 [ 0.86 .. 2.72]
1739-> MET A 67 HE* - LEU B 75 HD2* [ 1.80 4.20] 3.89 2.32 0.42 2.43 4.37 4.65 2.69 0.89 3.41 2.75 1.58 2.67 0.31 2.56 1.26 3.65 2.83 1.27 3.36 1.08 - 20 [ 0.31 .. 4.65]
1740-> MET A 67 HG* - LEU B 75 HD2* [ 1.80 5.72] 1.43 2.75 0.28 3.20 1.62 2.27 3.50 0.47 0.99 3.23 1.90 3.33 0.13 3.09 1.90 3.25 1.22 2.07 3.34 0.90 - 20 [ 0.13 .. 3.50]
1741-> MET A 67 HG3 - LEU B 18 HD1* [ 1.80 5.53] 0.14 0.00 0.00 0.00 0.37 0.02 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.02 .. 0.37]
1744-> MET A 67 HG2 - LEU B 18 HD1* [ 1.80 5.53] 0.00 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.07 .. 0.23]
1747-> MET A 67 HN - LEU B 16 HD1* [ 1.80 4.63] 0.00 0.00 2.56 0.67 0.00 0.74 1.00 2.19 0.06 0.00 1.02 0.93 0.00 0.23 0.17 0.84 2.32 0.30 0.00 0.36 - 14 [ 0.06 .. 2.56]
1749-> MET A 67 HN - LEU B 18 HD1* [ 1.80 5.31] 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.04 .. 0.46]
1750-> MET A 67 HN - LEU B 18 HD2* [ 1.80 3.67] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.23 - 1 [ 0.23 .. 0.23]
1751-> VAL A 68 HA - PHE B 71 HA [ 1.80 6.05] 0.00 0.00 1.01 0.80 0.00 0.00 0.90 0.43 0.00 0.00 1.83 1.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 7 [ 0.43 .. 1.83]
1752-> VAL A 68 HA - PHE B 71 HB* [ 1.80 4.35] 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.07 .. 0.55]
1753-> VAL A 68 HG1* - PHE B 71 HA [ 1.80 4.81] 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.16 .. 0.16]
1757-> VAL A 68 HG1* - LYS B 72 HA [ 1.80 5.25] 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.00 - 3 [ 0.54 .. 0.91]
1758-> VAL A 68 HG1* - LYS B 72 HB* [ 1.80 5.27] 0.47 0.64 1.62 0.00 0.07 0.60 0.00 1.29 0.55 0.47 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.16 0.00 0.00 - 10 [ 0.07 .. 1.62]
1759-> VAL A 68 HG1* - LYS B 72 HG* [ 1.80 6.05] 0.12 0.21 0.00 0.00 0.36 0.25 0.00 1.18 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 - 7 [ 0.12 .. 1.18]
1760-> VAL A 68 HG1* - LYS B 72 HN [ 1.80 5.51] 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.19 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 - 4 [ 0.02 .. 0.83]
1761-> VAL A 68 HG1* - GLY B 73 HN [ 1.80 5.20] 0.77 0.97 2.59 0.00 0.66 0.41 0.00 1.43 1.32 0.70 0.00 0.22 0.12 0.24 0.57 0.25 2.20 0.49 0.00 0.00 - 15 [ 0.12 .. 2.59]
1762-> VAL A 68 HG1* - ASN B 74 HN [ 1.80 5.51] 0.00 0.00 1.94 0.00 0.21 0.00 0.00 0.00 0.85 0.14 0.00 0.00 0.00 0.00 0.68 0.00 1.79 0.00 0.00 0.00 - 6 [ 0.14 .. 1.94]
1763-> VAL A 68 HG1* - LEU B 75 HD1* [ 1.80 4.37] 0.00 0.00 0.41 0.14 0.00 0.00 0.52 0.87 0.00 0.00 0.00 0.00 0.30 0.00 0.54 0.00 0.00 0.00 1.24 1.42 - 8 [ 0.14 .. 1.42]
1764-> VAL A 68 HG1* - LEU B 75 HD2* [ 1.80 4.47] 0.00 0.00 0.00 0.65 0.00 0.00 1.06 0.00 0.30 0.00 0.11 0.60 0.00 0.55 1.26 0.14 0.00 0.00 1.40 0.54 - 10 [ 0.11 .. 1.40]
1765-> VAL A 68 HG1* - GLU B 76 HB* [ 1.80 4.29] 0.00 0.00 1.18 0.00 0.36 0.00 0.00 1.47 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.71 1.95 0.00 1.05 - 8 [ 0.00 .. 1.95]
1767-> VAL A 68 HG2* - PHE B 71 HB2 [ 1.80 4.74] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.35 .. 0.65]
1768-> VAL A 68 HG2* - PHE B 71 HD* [ 1.80 4.09] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.77 .. 0.77]
1769-> VAL A 68 HG2* - PHE B 71 HE* [ 1.80 4.95] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 - 2 [ 0.03 .. 0.88]
1770-> VAL A 68 HG2* - PHE B 71 HN [ 1.80 5.39] 0.00 0.06 0.16 0.00 0.00 0.10 0.00 1.67 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.23 0.00 0.00 - 7 [ 0.06 .. 1.67]
1772-> VAL A 68 HG2* - LEU B 75 HD1* [ 1.80 4.30] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.30 - 2 [ 0.12 .. 0.30]
1773-> VAL A 68 HG2* - LEU B 75 HD2* [ 1.80 4.52] 0.00 0.00 0.00 0.34 0.00 0.10 0.75 0.00 0.00 0.00 0.00 0.39 0.00 0.02 0.00 0.00 0.00 0.00 0.48 0.00 - 6 [ 0.02 .. 0.75]
1774-> VAL A 68 HN - LEU B 18 HD2* [ 1.80 5.52] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 - 1 [ 0.50 .. 0.50]
1775-> VAL A 68 HN - LEU B 75 HD2* [ 1.80 6.05] 1.45 0.71 0.00 1.95 1.28 1.88 2.38 0.00 1.42 1.03 0.17 2.05 0.00 1.93 0.75 1.26 1.20 0.49 1.59 0.00 - 16 [ 0.17 .. 2.38]
1776-> ASP A 69 HN - GLU B 76 HB* [ 1.80 6.05] 0.00 0.00 4.26 0.40 1.72 1.41 0.57 1.18 0.11 1.00 0.99 0.00 0.00 0.00 0.00 1.80 3.04 4.71 0.00 3.06 - 13 [ 0.11 .. 4.71]
1777-> ALA A 70 HA - LEU B 16 HD1* [ 1.80 5.06] 1.31 1.60 0.00 0.00 1.32 0.00 0.00 0.00 0.00 1.26 0.12 0.00 0.00 1.63 1.70 0.00 0.00 1.25 0.00 1.49 - 9 [ 0.12 .. 1.70]
1778-> ALA A 70 HA - LEU B 16 HD2* [ 1.80 5.33] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.18 .. 0.18]
1780-> ALA A 70 HB* - LEU B 16 HD1* [ 1.80 3.07] 0.65 0.89 0.58 0.00 0.66 0.00 0.00 0.55 0.00 0.66 0.00 0.00 0.00 0.85 1.03 0.00 0.76 0.48 0.00 0.85 - 11 [ 0.48 .. 1.03]
1782-> ALA A 70 HN - LEU B 16 HD1* [ 1.80 4.72] 0.72 1.19 0.70 0.35 0.77 0.29 0.10 0.39 0.00 0.97 0.79 0.01 0.00 1.10 1.04 0.00 0.97 1.08 0.00 1.65 - 16 [ 0.01 .. 1.65]
1783-> ALA A 70 HN - LEU B 16 HD2* [ 1.80 4.70] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.37 .. 0.37]
1784-> PHE A 71 HA - VAL B 68 HA [ 1.80 6.05] 0.00 0.00 1.01 0.80 0.00 0.00 0.90 0.43 0.00 0.00 1.83 1.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 7 [ 0.43 .. 1.83]
1785-> PHE A 71 HA - VAL B 68 HG1* [ 1.80 4.81] 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.16 .. 0.16]
1786-> PHE A 71 HB* - MET B 67 HE* [ 1.80 3.77] 2.74 1.70 1.63 0.42 2.99 2.99 0.56 0.70 2.73 2.08 0.96 0.64 1.01 0.60 1.82 1.82 1.77 0.41 0.55 0.96 - 20 [ 0.41 .. 2.99]
1787-> PHE A 71 HB* - VAL B 68 HA [ 1.80 4.35] 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.07 .. 0.55]
1791-> PHE A 71 HB2 - VAL B 68 HG2* [ 1.80 4.74] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.35 .. 0.65]
1792-> PHE A 71 HD* - LEU B 15 HB* [ 1.80 4.98] 1.64 1.81 0.00 0.00 1.32 1.04 0.00 0.18 0.85 2.06 0.00 0.00 0.21 0.17 2.46 0.24 0.55 0.00 0.00 0.05 - 13 [ 0.05 .. 2.46]
1793-> PHE A 71 HD* - LEU B 15 HD2* [ 1.80 4.92] 0.00 0.00 0.00 0.72 0.00 0.00 0.67 0.99 1.98 0.00 0.00 0.39 0.02 0.93 3.33 1.24 0.00 0.52 0.33 1.09 - 12 [ 0.02 .. 3.33]
1794-> PHE A 71 HD* - ILE B 29 HD1* [ 1.80 4.95] 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.05 .. 0.26]
1795-> PHE A 71 HD* - MET B 67 HE* [ 1.80 4.81] 0.31 0.00 0.00 0.00 0.60 0.68 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.31 .. 0.74]
1797-> PHE A 71 HD* - VAL B 68 HG2* [ 1.80 4.09] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.77 .. 0.77]
1798-> PHE A 71 HE* - LEU B 15 HD1* [ 1.80 3.37] 0.46 0.80 0.00 0.64 0.37 0.76 0.52 0.00 1.34 0.50 0.00 0.28 0.00 0.15 2.63 1.01 0.95 0.00 0.00 1.00 - 14 [ 0.15 .. 2.63]
1799-> PHE A 71 HE* - LEU B 15 HD2* [ 1.80 3.94] 0.00 0.00 0.24 0.78 0.00 0.00 0.47 1.32 1.84 0.00 0.00 0.23 0.00 0.86 3.75 1.71 0.00 0.25 1.23 2.30 - 12 [ 0.23 .. 3.75]
1800-> PHE A 71 HE* - LEU B 16 HD1* [ 1.80 4.98] 0.00 0.00 2.38 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 0.00 0.00 0.00 - 3 [ 2.24 .. 2.46]
1801-> PHE A 71 HE* - LEU B 16 HD2* [ 1.80 5.03] 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.13 0.00 - 4 [ 0.13 .. 0.84]
1802-> PHE A 71 HE* - LEU B 16 HG [ 1.80 4.86] 0.00 0.00 2.91 0.00 0.00 0.57 0.00 2.49 0.58 0.00 0.16 0.09 0.00 0.00 1.14 0.58 2.73 0.00 0.00 0.00 - 9 [ 0.09 .. 2.91]
1804-> PHE A 71 HE* - ILE B 29 HG2* [ 1.80 4.11] 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.07 .. 0.52]
1805-> PHE A 71 HE* - PHE B 64 HZ [ 1.80 3.89] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.77 .. 0.77]
1806-> PHE A 71 HE* - MET B 67 HE* [ 1.80 4.39] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.46 .. 0.68]
1807-> PHE A 71 HE* - VAL B 68 HG2* [ 1.80 4.95] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 - 2 [ 0.03 .. 0.88]
1808-> PHE A 71 HN - LEU B 16 HD1* [ 1.80 4.68] 1.43 1.82 2.23 0.73 1.52 0.99 0.39 2.35 0.00 1.98 1.99 0.79 0.50 1.61 2.04 0.71 2.55 0.98 0.00 1.95 - 18 [ 0.39 .. 2.55]
1809-> PHE A 71 HN - LEU B 16 HD2* [ 1.80 5.16] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.01 .. 0.42]
1810-> PHE A 71 HN - VAL B 68 HG2* [ 1.80 5.39] 0.00 0.06 0.16 0.00 0.00 0.10 0.00 1.67 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.23 0.00 0.00 - 7 [ 0.06 .. 1.67]
1811-> PHE A 71 HZ - LEU B 15 HD1* [ 1.80 4.77] 0.50 0.71 0.00 0.00 0.66 1.03 0.00 0.00 0.45 0.47 0.00 0.00 0.00 0.00 1.43 0.14 1.36 0.00 0.00 0.76 - 10 [ 0.14 .. 1.43]
1812-> PHE A 71 HZ - LEU B 16 HD1* [ 1.80 5.48] 0.00 0.00 3.59 0.00 0.00 0.73 0.00 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.80 1.14 4.01 0.00 0.00 0.00 - 6 [ 0.73 .. 4.01]
1815-> PHE A 71 HZ - PHE B 64 HE* [ 1.80 4.22] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.37 .. 0.44]
1816-> PHE A 71 HZ - MET B 67 HE* [ 1.80 3.94] 0.86 0.00 0.00 1.18 0.89 1.36 0.99 0.00 0.00 0.00 2.72 1.99 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 8 [ 0.86 .. 2.72]
1817-> LYS A 72 HA - VAL B 68 HG1* [ 1.80 5.25] 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.00 - 3 [ 0.54 .. 0.91]
1818-> LYS A 72 HA - LYS B 72 HE* [ 1.80 4.64] 0.00 0.00 1.03 0.77 1.30 0.00 0.00 2.09 0.00 2.04 0.55 0.00 0.00 0.00 0.00 1.04 1.53 0.00 0.29 0.00 - 9 [ 0.29 .. 2.09]
1819-> LYS A 72 HB* - VAL B 68 HG1* [ 1.80 5.27] 0.47 0.64 1.62 0.00 0.07 0.60 0.00 1.29 0.55 0.47 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.16 0.00 0.00 - 10 [ 0.07 .. 1.62]
1820-> LYS A 72 HB* - LYS B 72 HE* [ 1.80 4.93] 0.19 0.54 1.51 0.41 1.12 0.39 0.00 2.73 0.00 2.32 0.00 0.00 0.00 0.26 0.00 0.73 2.10 0.25 0.00 0.00 - 13 [ 0.00 .. 2.73]
1821-> LYS A 72 HE* - LYS B 72 HA [ 1.80 4.64] 0.00 0.00 1.03 0.77 1.30 0.00 0.00 2.09 0.00 2.04 0.55 0.00 0.00 0.00 0.00 1.04 1.52 0.00 0.29 0.00 - 9 [ 0.29 .. 2.09]
1822-> LYS A 72 HE* - LYS B 72 HB* [ 1.80 4.93] 0.19 0.54 1.51 0.41 1.12 0.39 0.00 2.73 0.00 2.32 0.00 0.00 0.00 0.26 0.00 0.73 2.10 0.24 0.00 0.00 - 13 [ 0.00 .. 2.73]
1823-> LYS A 72 HG* - VAL B 68 HG1* [ 1.80 6.05] 0.12 0.21 0.00 0.00 0.36 0.25 0.00 1.18 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 - 7 [ 0.12 .. 1.18]
1824-> LYS A 72 HN - VAL B 68 HG1* [ 1.80 5.51] 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.19 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 - 4 [ 0.02 .. 0.83]
1825-> GLY A 73 HN - VAL B 68 HG1* [ 1.80 5.20] 0.77 0.97 2.59 0.00 0.66 0.41 0.00 1.43 1.32 0.70 0.00 0.22 0.12 0.24 0.57 0.25 2.20 0.49 0.00 0.00 - 15 [ 0.12 .. 2.59]
1826-> ASN A 74 HN - VAL B 68 HG1* [ 1.80 5.51] 0.00 0.00 1.94 0.00 0.21 0.00 0.00 0.00 0.85 0.14 0.00 0.00 0.00 0.00 0.68 0.00 1.79 0.00 0.00 0.00 - 6 [ 0.14 .. 1.94]
1828-> LEU A 75 HD1* - GLN B 65 HA [ 1.80 4.57] 0.53 0.36 0.91 2.04 0.32 0.00 2.43 0.00 1.24 0.60 0.00 1.19 0.00 1.71 2.09 0.95 0.59 0.00 0.00 0.67 - 14 [ 0.32 .. 2.43]
1829-> LEU A 75 HD1* - VAL B 68 HG1* [ 1.80 4.50] 0.00 0.00 0.28 0.01 0.00 0.00 0.39 0.74 0.00 0.00 0.00 0.00 0.17 0.00 0.41 0.00 0.00 0.00 1.11 1.29 - 8 [ 0.01 .. 1.29]
1830-> LEU A 75 HD1* - VAL B 68 HG2* [ 1.80 4.30] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.30 - 2 [ 0.12 .. 0.30]
1831-> LEU A 75 HD2* - PHE B 41 HD* [ 1.80 5.00] 0.47 0.44 0.12 0.00 1.53 0.77 0.19 0.45 0.80 0.43 0.00 0.00 0.00 0.00 0.00 0.91 0.28 0.00 1.21 0.00 - 12 [ 0.12 .. 1.53]
1832-> LEU A 75 HD2* - ASN B 61 HA [ 1.80 5.57] 2.13 2.04 1.76 2.70 2.44 1.69 2.30 0.00 2.78 2.02 0.00 2.03 0.00 2.08 0.37 3.12 1.86 1.00 0.00 0.00 - 15 [ 0.37 .. 3.12]
1833-> LEU A 75 HD2* - PHE B 64 HA [ 1.80 5.04] 3.12 2.94 1.40 3.33 3.40 3.73 3.36 0.04 2.62 3.08 1.19 3.59 0.00 3.23 0.72 3.51 2.98 1.92 2.62 0.00 - 18 [ 0.04 .. 3.73]
1834-> LEU A 75 HD2* - PHE B 64 HN [ 1.80 5.83] 2.97 2.80 1.80 3.31 3.34 3.07 3.35 0.00 3.29 2.99 0.62 3.30 0.00 3.06 0.93 3.51 2.94 1.80 1.42 0.00 - 17 [ 0.62 .. 3.51]
1835-> LEU A 75 HD2* - GLN B 65 HN [ 1.80 3.84] 3.90 3.73 2.36 4.29 3.76 3.53 4.45 0.00 4.21 3.78 1.02 4.07 0.00 3.80 3.01 4.37 3.99 2.48 1.70 0.00 - 17 [ 1.02 .. 4.45]
1836-> LEU A 75 HD2* - MET B 67 HE* [ 1.80 4.20] 3.89 2.32 0.42 2.43 4.37 4.65 2.69 0.89 3.41 2.75 1.58 2.67 0.31 2.56 1.26 3.65 2.83 1.27 3.36 1.08 - 20 [ 0.31 .. 4.65]
1837-> LEU A 75 HD2* - MET B 67 HG* [ 1.80 5.72] 1.43 2.75 0.28 3.20 1.62 2.27 3.50 0.47 0.99 3.23 1.90 3.33 0.13 3.09 1.90 3.25 1.22 2.07 3.34 0.90 - 20 [ 0.13 .. 3.50]
1838-> LEU A 75 HD2* - VAL B 68 HG1* [ 1.80 4.47] 0.00 0.00 0.00 0.65 0.00 0.00 1.06 0.00 0.30 0.00 0.11 0.60 0.00 0.55 1.26 0.14 0.00 0.00 1.40 0.54 - 10 [ 0.11 .. 1.40]
1839-> LEU A 75 HD2* - VAL B 68 HG2* [ 1.80 4.52] 0.00 0.00 0.00 0.34 0.00 0.10 0.75 0.00 0.00 0.00 0.00 0.39 0.00 0.02 0.00 0.00 0.00 0.00 0.48 0.00 - 6 [ 0.02 .. 0.75]
1840-> LEU A 75 HD2* - VAL B 68 HN [ 1.80 6.05] 1.45 0.71 0.00 1.95 1.28 1.88 2.38 0.00 1.43 1.03 0.17 2.06 0.00 1.93 0.75 1.26 1.20 0.49 1.59 0.00 - 16 [ 0.17 .. 2.38]
1841-> GLU A 76 HB* - GLN B 65 HE22 [ 1.80 5.58] 2.87 1.87 1.68 4.78 1.08 0.02 4.18 2.49 0.00 0.00 0.00 0.00 1.05 0.32 0.00 6.56 2.07 4.48 0.00 0.56 - 14 [ 0.02 .. 6.56]
1842-> GLU A 76 HB* - VAL B 68 HG1* [ 1.80 4.29] 0.00 0.00 1.18 0.00 0.36 0.00 0.00 1.47 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.71 1.94 0.00 1.05 - 8 [ 0.00 .. 1.94]
1843-> GLU A 76 HB* - ASP B 69 HN [ 1.80 6.05] 0.00 0.00 4.26 0.40 1.72 1.41 0.56 1.18 0.11 1.00 0.99 0.00 0.00 0.00 0.00 1.80 3.04 4.71 0.00 3.06 - 13 [ 0.11 .. 4.71]
1844-> HIS A 77 HN - GLN B 65 HE22 [ 1.80 5.57] 1.59 2.86 3.05 2.49 0.80 0.00 1.63 1.15 1.03 0.00 1.59 0.00 0.99 0.00 2.31 4.25 4.45 8.09 0.28 1.43 - 16 [ 0.28 .. 8.09]
1845-> LEU B 15 HB* - PHE A 71 HD* [ 1.80 4.98] 1.64 1.81 0.00 0.00 1.32 1.04 0.00 0.18 0.85 2.06 0.00 0.00 0.21 0.17 2.46 0.24 0.55 0.00 0.00 0.05 - 13 [ 0.05 .. 2.46]
1846-> LEU B 15 HD1* - PHE A 71 HE* [ 1.80 3.37] 0.46 0.80 0.00 0.64 0.37 0.76 0.52 0.00 1.34 0.50 0.00 0.28 0.00 0.15 2.63 1.01 0.95 0.00 0.00 1.00 - 14 [ 0.15 .. 2.63]
1847-> LEU B 15 HD1* - PHE A 71 HZ [ 1.80 4.77] 0.50 0.71 0.00 0.00 0.66 1.03 0.00 0.00 0.45 0.47 0.00 0.00 0.00 0.00 1.43 0.14 1.36 0.00 0.00 0.76 - 10 [ 0.14 .. 1.43]
1848-> LEU B 15 HD2* - PHE A 71 HD* [ 1.80 4.92] 0.00 0.00 0.00 0.72 0.00 0.00 0.67 0.99 1.98 0.00 0.00 0.39 0.02 0.93 3.33 1.24 0.00 0.52 0.33 1.09 - 12 [ 0.02 .. 3.33]
1849-> LEU B 15 HD2* - PHE A 71 HE* [ 1.80 3.94] 0.00 0.00 0.24 0.78 0.00 0.00 0.47 1.32 1.84 0.00 0.00 0.23 0.00 0.86 3.75 1.71 0.00 0.25 1.23 2.30 - 12 [ 0.23 .. 3.75]
1851-> LEU B 16 HD1* - THR A 66 HG2* [ 1.80 3.49] 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.12 0.00 0.00 0.00 0.56 0.00 0.00 - 4 [ 0.12 .. 0.58]
1852-> LEU B 16 HD1* - MET A 67 HA [ 1.80 4.26] 0.00 0.00 1.85 0.00 0.00 0.00 0.17 1.59 0.00 0.00 0.17 0.05 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.18 - 7 [ 0.05 .. 1.85]
1853-> LEU B 16 HD1* - MET A 67 HN [ 1.80 4.63] 0.00 0.00 2.56 0.67 0.00 0.74 1.00 2.19 0.06 0.00 1.02 0.93 0.00 0.23 0.17 0.84 2.32 0.30 0.00 0.36 - 14 [ 0.06 .. 2.56]
1854-> LEU B 16 HD1* - ALA A 70 HA [ 1.80 5.06] 1.31 1.60 0.00 0.00 1.32 0.00 0.00 0.00 0.00 1.26 0.12 0.00 0.00 1.63 1.70 0.00 0.00 1.25 0.00 1.49 - 9 [ 0.12 .. 1.70]
1855-> LEU B 16 HD1* - ALA A 70 HB* [ 1.80 3.07] 0.65 0.89 0.58 0.00 0.66 0.00 0.00 0.55 0.00 0.66 0.00 0.00 0.00 0.85 1.03 0.00 0.76 0.48 0.00 0.85 - 11 [ 0.48 .. 1.03]
1856-> LEU B 16 HD1* - ALA A 70 HN [ 1.80 4.72] 0.72 1.19 0.70 0.35 0.77 0.29 0.10 0.39 0.00 0.97 0.79 0.01 0.00 1.10 1.04 0.00 0.97 1.08 0.00 1.65 - 16 [ 0.01 .. 1.65]
1857-> LEU B 16 HD1* - PHE A 71 HE* [ 1.80 4.98] 0.00 0.00 2.38 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 0.00 0.00 0.00 - 3 [ 2.24 .. 2.46]
1858-> LEU B 16 HD1* - PHE A 71 HN [ 1.80 4.68] 1.43 1.82 2.23 0.73 1.52 0.99 0.39 2.35 0.00 1.98 1.99 0.79 0.50 1.61 2.04 0.71 2.55 0.98 0.00 1.95 - 18 [ 0.39 .. 2.55]
1859-> LEU B 16 HD1* - PHE A 71 HZ [ 1.80 5.48] 0.00 0.00 3.59 0.00 0.00 0.73 0.00 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.80 1.14 4.01 0.00 0.00 0.00 - 6 [ 0.73 .. 4.01]
1863-> LEU B 16 HD2* - ALA A 70 HA [ 1.80 5.33] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.18 .. 0.18]
1865-> LEU B 16 HD2* - ALA A 70 HN [ 1.80 4.70] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.37 .. 0.37]
1866-> LEU B 16 HD2* - PHE A 71 HE* [ 1.80 5.03] 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.13 0.00 - 4 [ 0.13 .. 0.84]
1867-> LEU B 16 HD2* - PHE A 71 HN [ 1.80 5.16] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.01 .. 0.42]
1868-> LEU B 16 HG - PHE A 71 HE* [ 1.80 4.86] 0.00 0.00 2.91 0.00 0.00 0.57 0.00 2.49 0.58 0.00 0.16 0.09 0.00 0.00 1.14 0.58 2.73 0.00 0.00 0.00 - 9 [ 0.09 .. 2.91]
1869-> LEU B 18 HA - THR A 66 HG2* [ 1.80 3.49] 0.00 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.16 0.00 0.42 - 4 [ 0.16 .. 0.56]
1871-> LEU B 18 HD1* - GLU A 63 HA [ 1.80 4.70] 0.35 0.54 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.60 0.59 0.00 0.00 - 6 [ 0.10 .. 0.72]
1873-> LEU B 18 HD1* - PHE A 64 HA [ 1.80 5.41] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.36 .. 0.36]
1874-> LEU B 18 HD1* - THR A 66 HG2* [ 1.80 4.75] 0.00 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.45 0.08 0.00 0.00 0.00 0.35 0.00 0.79 0.00 0.00 - 5 [ 0.08 .. 0.79]
1876-> LEU B 18 HD1* - MET A 67 HG3 [ 1.80 5.53] 0.14 0.00 0.00 0.00 0.37 0.02 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.02 .. 0.37]
1877-> LEU B 18 HD1* - MET A 67 HG2 [ 1.80 5.53] 0.00 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.07 .. 0.23]
1878-> LEU B 18 HD1* - MET A 67 HN [ 1.80 5.31] 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.04 .. 0.46]
1883-> LEU B 18 HD2* - THR A 66 HG2* [ 1.80 3.12] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 - 1 [ 0.24 .. 0.24]
1885-> LEU B 18 HD2* - MET A 67 HA [ 1.80 3.81] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 - 1 [ 0.73 .. 0.73]
1889-> LEU B 18 HD2* - MET A 67 HN [ 1.80 3.67] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.23 - 1 [ 0.23 .. 0.23]
1890-> LEU B 18 HD2* - VAL A 68 HN [ 1.80 5.52] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 - 1 [ 0.50 .. 0.50]
1891-> LEU B 18 HG - THR A 66 HG2* [ 1.80 5.36] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.28 0.00 0.00 - 2 [ 0.09 .. 0.28]
1892-> LYS B 27 HA - ILE A 57 HD1* [ 1.80 5.63] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.33 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.33 .. 0.54]
1893-> LYS B 27 HD* - ILE A 57 HD1* [ 1.80 3.23] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.78 0.00 0.00 0.00 0.73 0.37 0.00 - 4 [ 0.37 .. 1.78]
1894-> LYS B 27 HD* - ILE A 57 HG1* [ 1.80 3.81] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.71 0.00 0.00 0.00 1.03 0.75 0.00 - 4 [ 0.75 .. 2.04]
1895-> LYS B 27 HE* - ILE A 57 HD1* [ 1.80 3.84] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 2.00 0.00 0.00 0.00 0.00 0.59 0.00 - 3 [ 0.59 .. 2.00]
1896-> LYS B 27 HE* - LEU A 59 HA [ 1.80 5.25] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.45 0.00 - 1 [ 0.45 .. 0.45]
1897-> LYS B 27 HE* - LEU A 59 HD2* [ 1.80 3.81] 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.20 0.00 - 3 [ 0.07 .. 1.39]
1898-> LYS B 27 HG* - ILE A 57 HD1* [ 1.80 4.25] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 1.01 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.91 .. 1.01]
1899-> LYS B 27 HG* - ILE A 57 HG2* [ 1.80 5.87] 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 - 2 [ 0.11 .. 0.87]
1900-> LYS B 27 HG* - LEU A 59 HD1* [ 1.80 5.87] 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.00 0.00 0.00 0.02 0.14 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.00 - 4 [ 0.02 .. 0.35]
1906-> ILE B 29 HD1* - PHE A 71 HD* [ 1.80 4.95] 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.05 .. 0.26]
1909-> ILE B 29 HG2* - PHE A 71 HE* [ 1.80 4.11] 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.07 .. 0.52]
1911-> PHE B 41 HD* - LEU A 75 HD2* [ 1.80 5.00] 0.47 0.44 0.12 0.00 1.53 0.77 0.19 0.45 0.80 0.43 0.00 0.00 0.00 0.00 0.00 0.91 0.28 0.00 1.21 0.00 - 12 [ 0.12 .. 1.53]
1912-> ILE B 43 HB - ILE A 57 HD1* [ 1.80 4.69] 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 - 3 [ 0.01 .. 0.78]
1913-> ARG B 44 HA - ILE A 57 HD1* [ 1.80 3.59] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.13 0.00 - 2 [ 0.13 .. 1.60]
1915-> ALA B 45 HN - ILE A 57 HD1* [ 1.80 4.88] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.35 .. 0.35]
1916-> LYS B 55 HB* - ILE A 57 HD1* [ 1.80 4.76] 0.61 0.37 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.94 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.02 0.00 0.00 - 6 [ 0.02 .. 0.94]
1917-> GLY B 56 HA* - ILE A 57 HG13 [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.61 .. 0.61]
1919-> GLY B 56 HA* - ILE A 57 HG2* [ 1.80 5.10] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.24 .. 0.24]
1920-> GLY B 56 HA3 - ILE A 57 HB [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.84 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 1.25 .. 1.84]
1921-> GLY B 56 HA3 - ILE A 57 HD1* [ 1.80 4.65] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 1.03 .. 1.03]
1922-> GLY B 56 HA2 - ILE A 57 HB [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.52 .. 0.52]
1924-> GLY B 56 HN - ILE A 57 HB [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.93 .. 0.93]
1925-> GLY B 56 HN - ILE A 57 HD1* [ 1.80 4.86] 0.63 0.27 0.00 0.00 0.80 0.00 0.00 0.00 0.64 0.59 0.52 0.24 1.35 0.00 0.02 0.00 0.00 0.49 0.00 0.00 - 10 [ 0.02 .. 1.35]
1926-> ILE B 57 HB - GLY A 56 HA3 [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.84 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 1.25 .. 1.84]
1927-> ILE B 57 HB - GLY A 56 HA2 [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.52 .. 0.52]
1928-> ILE B 57 HB - GLY A 56 HN [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.93 .. 0.93]
1929-> ILE B 57 HD1* - LYS A 27 HA [ 1.80 5.63] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.34 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.34 .. 0.54]
1930-> ILE B 57 HD1* - LYS A 27 HD* [ 1.80 3.23] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.78 0.00 0.00 0.00 0.73 0.37 0.00 - 4 [ 0.37 .. 1.78]
1931-> ILE B 57 HD1* - LYS A 27 HE* [ 1.80 3.84] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 2.00 0.00 0.00 0.00 0.00 0.59 0.00 - 3 [ 0.59 .. 2.00]
1932-> ILE B 57 HD1* - LYS A 27 HG* [ 1.80 4.25] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 1.02 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.91 .. 1.02]
1933-> ILE B 57 HD1* - ILE A 43 HB [ 1.80 4.69] 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 - 3 [ 0.01 .. 0.78]
1934-> ILE B 57 HD1* - ARG A 44 HA [ 1.80 3.59] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.13 0.00 - 2 [ 0.13 .. 1.60]
1936-> ILE B 57 HD1* - ALA A 45 HN [ 1.80 4.88] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.36 .. 0.36]
1937-> ILE B 57 HD1* - LYS A 55 HB* [ 1.80 4.76] 0.61 0.37 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.94 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.02 0.00 0.00 - 6 [ 0.02 .. 0.94]
1938-> ILE B 57 HD1* - GLY A 56 HA3 [ 1.80 4.65] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 1.03 .. 1.03]
1940-> ILE B 57 HD1* - GLY A 56 HN [ 1.80 4.86] 0.63 0.27 0.00 0.00 0.80 0.00 0.00 0.00 0.64 0.59 0.52 0.24 1.35 0.00 0.02 0.00 0.00 0.49 0.00 0.00 - 10 [ 0.02 .. 1.35]
1942-> ILE B 57 HG1* - LYS A 27 HD* [ 1.80 3.81] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.71 0.00 0.00 0.00 1.03 0.75 0.00 - 4 [ 0.75 .. 2.04]
1943-> ILE B 57 HG13 - GLY A 56 HA* [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.61 .. 0.61]
1945-> ILE B 57 HG2* - LYS A 27 HG* [ 1.80 5.87] 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 - 2 [ 0.11 .. 0.87]
1946-> ILE B 57 HG2* - GLY A 56 HA* [ 1.80 5.10] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.24 .. 0.24]
1948-> LEU B 59 HA - LYS A 27 HE* [ 1.80 5.25] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.45 0.00 - 1 [ 0.45 .. 0.45]
1949-> LEU B 59 HD1* - LYS A 27 HG* [ 1.80 5.87] 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.00 0.00 0.00 0.02 0.14 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.00 - 4 [ 0.02 .. 0.35]
1950-> LEU B 59 HD2* - LYS A 27 HE* [ 1.80 3.81] 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.20 0.00 - 3 [ 0.07 .. 1.39]
1952-> ASN B 61 HA - LEU A 75 HD2* [ 1.80 5.57] 2.13 2.04 1.76 2.70 2.44 1.69 2.30 0.00 2.78 2.02 0.00 2.03 0.00 2.08 0.37 3.12 1.86 1.00 0.00 0.00 - 15 [ 0.37 .. 3.12]
1954-> GLU B 63 HA - LEU A 18 HD1* [ 1.80 4.70] 0.35 0.54 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.60 0.59 0.00 0.00 - 6 [ 0.10 .. 0.72]
1957-> PHE B 64 HA - LEU A 18 HD1* [ 1.80 5.41] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.36 .. 0.36]
1959-> PHE B 64 HA - LEU A 75 HD2* [ 1.80 5.04] 3.12 2.94 1.40 3.33 3.40 3.73 3.36 0.04 2.62 3.08 1.19 3.59 0.00 3.23 0.72 3.51 2.98 1.92 2.62 0.00 - 18 [ 0.04 .. 3.73]
1960-> PHE B 64 HE* - PHE A 71 HZ [ 1.80 4.22] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.37 .. 0.44]
1961-> PHE B 64 HN - LEU A 75 HD2* [ 1.80 5.83] 2.97 2.80 1.80 3.31 3.34 3.07 3.35 0.00 3.29 2.99 0.62 3.30 0.00 3.06 0.93 3.51 2.94 1.80 1.42 0.00 - 17 [ 0.62 .. 3.51]
1962-> PHE B 64 HZ - PHE A 71 HE* [ 1.80 3.89] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.77 .. 0.77]
1963-> GLN B 65 HA - LEU A 75 HD1* [ 1.80 4.57] 0.53 0.36 0.91 2.04 0.32 0.00 2.43 0.00 1.24 0.60 0.00 1.19 0.00 1.71 2.09 0.95 0.59 0.00 0.00 0.67 - 14 [ 0.32 .. 2.43]
1964-> GLN B 65 HE22 - GLU A 76 HB* [ 1.80 5.58] 2.87 1.87 1.68 4.78 1.08 0.02 4.18 2.49 0.00 0.00 0.00 0.00 1.05 0.32 0.00 6.56 2.07 4.48 0.00 0.56 - 14 [ 0.02 .. 6.56]
1965-> GLN B 65 HE22 - HIS A 77 HN [ 1.80 5.57] 1.59 2.86 3.05 2.49 0.80 0.00 1.63 1.15 1.03 0.00 1.59 0.00 0.99 0.00 2.31 4.25 4.45 8.09 0.28 1.43 - 16 [ 0.28 .. 8.09]
1966-> GLN B 65 HN - LEU A 75 HD2* [ 1.80 3.84] 3.90 3.73 2.36 4.29 3.76 3.53 4.45 0.00 4.21 3.78 1.02 4.07 0.00 3.80 3.01 4.37 3.99 2.48 1.70 0.00 - 17 [ 1.02 .. 4.45]
1969-> THR B 66 HG2* - LEU A 16 HD1* [ 1.80 3.49] 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.12 0.00 0.00 0.00 0.56 0.00 0.00 - 4 [ 0.12 .. 0.58]
1971-> THR B 66 HG2* - LEU A 18 HA [ 1.80 3.49] 0.00 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.16 0.00 0.42 - 4 [ 0.16 .. 0.56]
1972-> THR B 66 HG2* - LEU A 18 HD1* [ 1.80 4.75] 0.00 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.45 0.08 0.00 0.00 0.00 0.35 0.00 0.79 0.00 0.00 - 5 [ 0.08 .. 0.79]
1973-> THR B 66 HG2* - LEU A 18 HD2* [ 1.80 3.12] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 - 1 [ 0.24 .. 0.24]
1974-> THR B 66 HG2* - LEU A 18 HG [ 1.80 5.36] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.28 0.00 0.00 - 2 [ 0.09 .. 0.28]
1976-> MET B 67 HA - LEU A 16 HD1* [ 1.80 4.26] 0.00 0.00 1.85 0.00 0.00 0.00 0.17 1.59 0.00 0.00 0.16 0.05 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.19 - 7 [ 0.05 .. 1.85]
1978-> MET B 67 HA - LEU A 18 HD2* [ 1.80 3.81] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 - 1 [ 0.73 .. 0.73]
1983-> MET B 67 HE* - PHE A 71 HB* [ 1.80 3.77] 2.74 1.70 1.63 0.42 2.99 2.99 0.56 0.70 2.73 2.08 0.96 0.64 1.01 0.60 1.82 1.82 1.77 0.41 0.55 0.96 - 20 [ 0.41 .. 2.99]
1984-> MET B 67 HE* - PHE A 71 HD* [ 1.80 4.81] 0.31 0.00 0.00 0.00 0.60 0.68 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.31 .. 0.74]
1985-> MET B 67 HE* - PHE A 71 HE* [ 1.80 4.39] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.46 .. 0.68]
1986-> MET B 67 HE* - PHE A 71 HZ [ 1.80 3.94] 0.86 0.00 0.00 1.18 0.89 1.36 0.99 0.00 0.00 0.00 2.72 1.99 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 8 [ 0.86 .. 2.72]
1987-> MET B 67 HE* - LEU A 75 HD2* [ 1.80 4.20] 3.89 2.32 0.42 2.43 4.37 4.65 2.69 0.89 3.41 2.75 1.58 2.67 0.31 2.56 1.26 3.65 2.83 1.27 3.36 1.08 - 20 [ 0.31 .. 4.65]
1988-> MET B 67 HG* - LEU A 75 HD2* [ 1.80 5.72] 1.43 2.75 0.28 3.20 1.62 2.27 3.50 0.47 0.99 3.23 1.90 3.33 0.13 3.09 1.90 3.25 1.22 2.07 3.34 0.90 - 20 [ 0.13 .. 3.50]
1989-> MET B 67 HG3 - LEU A 18 HD1* [ 1.80 5.53] 0.14 0.00 0.00 0.00 0.37 0.02 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.02 .. 0.37]
1992-> MET B 67 HG2 - LEU A 18 HD1* [ 1.80 5.53] 0.00 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.07 .. 0.23]
1995-> MET B 67 HN - LEU A 16 HD1* [ 1.80 4.63] 0.00 0.00 2.57 0.67 0.00 0.74 1.00 2.19 0.06 0.00 1.02 0.93 0.00 0.23 0.17 0.84 2.32 0.30 0.00 0.36 - 14 [ 0.06 .. 2.57]
1997-> MET B 67 HN - LEU A 18 HD1* [ 1.80 5.31] 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.04 .. 0.46]
1998-> MET B 67 HN - LEU A 18 HD2* [ 1.80 3.67] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.23 - 1 [ 0.23 .. 0.23]
1999-> VAL B 68 HA - PHE A 71 HA [ 1.80 6.05] 0.00 0.00 1.01 0.80 0.00 0.00 0.90 0.43 0.00 0.00 1.83 1.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 7 [ 0.43 .. 1.83]
2000-> VAL B 68 HA - PHE A 71 HB* [ 1.80 4.35] 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.07 .. 0.55]
2001-> VAL B 68 HG1* - PHE A 71 HA [ 1.80 4.81] 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.16 .. 0.16]
2005-> VAL B 68 HG1* - LYS A 72 HA [ 1.80 5.25] 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.00 - 3 [ 0.54 .. 0.91]
2006-> VAL B 68 HG1* - LYS A 72 HB* [ 1.80 5.27] 0.47 0.64 1.62 0.00 0.07 0.60 0.00 1.29 0.55 0.47 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.16 0.00 0.00 - 10 [ 0.07 .. 1.62]
2007-> VAL B 68 HG1* - LYS A 72 HG* [ 1.80 6.05] 0.12 0.21 0.00 0.00 0.36 0.25 0.00 1.18 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 - 7 [ 0.12 .. 1.18]
2008-> VAL B 68 HG1* - LYS A 72 HN [ 1.80 5.51] 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.19 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 - 4 [ 0.02 .. 0.83]
2009-> VAL B 68 HG1* - GLY A 73 HN [ 1.80 5.20] 0.77 0.97 2.59 0.00 0.66 0.41 0.00 1.43 1.32 0.70 0.00 0.22 0.12 0.24 0.57 0.25 2.20 0.49 0.00 0.00 - 15 [ 0.12 .. 2.59]
2010-> VAL B 68 HG1* - ASN A 74 HN [ 1.80 5.51] 0.00 0.00 1.94 0.00 0.21 0.00 0.00 0.00 0.85 0.14 0.00 0.00 0.00 0.00 0.68 0.00 1.79 0.00 0.00 0.00 - 6 [ 0.14 .. 1.94]
2011-> VAL B 68 HG1* - LEU A 75 HD1* [ 1.80 4.50] 0.00 0.00 0.28 0.01 0.00 0.00 0.39 0.74 0.00 0.00 0.00 0.00 0.17 0.00 0.41 0.00 0.00 0.00 1.11 1.29 - 8 [ 0.01 .. 1.29]
2012-> VAL B 68 HG1* - LEU A 75 HD2* [ 1.80 4.47] 0.00 0.00 0.00 0.65 0.00 0.00 1.06 0.00 0.30 0.00 0.11 0.60 0.00 0.55 1.26 0.14 0.00 0.00 1.40 0.54 - 10 [ 0.11 .. 1.40]
2013-> VAL B 68 HG1* - GLU A 76 HB* [ 1.80 4.29] 0.00 0.00 1.18 0.00 0.36 0.00 0.00 1.47 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.71 1.94 0.00 1.05 - 8 [ 0.00 .. 1.94]
2015-> VAL B 68 HG2* - PHE A 71 HB2 [ 1.80 4.74] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.35 .. 0.65]
2016-> VAL B 68 HG2* - PHE A 71 HD* [ 1.80 4.09] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.77 .. 0.77]
2017-> VAL B 68 HG2* - PHE A 71 HE* [ 1.80 4.95] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 - 2 [ 0.03 .. 0.88]
2018-> VAL B 68 HG2* - PHE A 71 HN [ 1.80 5.39] 0.00 0.06 0.16 0.00 0.00 0.10 0.00 1.67 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.23 0.00 0.00 - 7 [ 0.06 .. 1.67]
2020-> VAL B 68 HG2* - LEU A 75 HD1* [ 1.80 4.30] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.30 - 2 [ 0.12 .. 0.30]
2021-> VAL B 68 HG2* - LEU A 75 HD2* [ 1.80 4.52] 0.00 0.00 0.00 0.34 0.00 0.10 0.75 0.00 0.00 0.00 0.00 0.39 0.00 0.02 0.00 0.00 0.00 0.00 0.48 0.00 - 6 [ 0.02 .. 0.75]
2022-> VAL B 68 HN - LEU A 18 HD2* [ 1.80 5.52] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 - 1 [ 0.50 .. 0.50]
2023-> VAL B 68 HN - LEU A 75 HD2* [ 1.80 6.05] 1.45 0.71 0.00 1.95 1.28 1.88 2.38 0.00 1.43 1.03 0.17 2.06 0.00 1.93 0.75 1.26 1.20 0.49 1.59 0.00 - 16 [ 0.17 .. 2.38]
2024-> ASP B 69 HN - GLU A 76 HB* [ 1.80 6.05] 0.00 0.00 4.26 0.40 1.72 1.41 0.56 1.18 0.11 1.00 0.99 0.00 0.00 0.00 0.00 1.80 3.04 4.71 0.00 3.06 - 13 [ 0.11 .. 4.71]
2025-> ALA B 70 HA - LEU A 16 HD1* [ 1.80 5.06] 1.31 1.60 0.00 0.00 1.32 0.00 0.00 0.00 0.00 1.26 0.12 0.00 0.00 1.63 1.70 0.00 0.00 1.26 0.00 1.49 - 9 [ 0.12 .. 1.70]
2026-> ALA B 70 HA - LEU A 16 HD2* [ 1.80 5.33] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.18 .. 0.18]
2028-> ALA B 70 HB* - LEU A 16 HD1* [ 1.80 3.07] 0.65 0.89 0.58 0.00 0.66 0.00 0.00 0.55 0.00 0.66 0.00 0.00 0.00 0.85 1.03 0.00 0.76 0.48 0.00 0.85 - 11 [ 0.48 .. 1.03]
2030-> ALA B 70 HN - LEU A 16 HD1* [ 1.80 4.72] 0.72 1.19 0.70 0.34 0.77 0.29 0.10 0.39 0.00 0.97 0.79 0.01 0.00 1.10 1.04 0.00 0.97 1.09 0.00 1.65 - 16 [ 0.01 .. 1.65]
2031-> ALA B 70 HN - LEU A 16 HD2* [ 1.80 4.70] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.37 .. 0.37]
2032-> PHE B 71 HA - VAL A 68 HA [ 1.80 6.05] 0.00 0.00 1.01 0.80 0.00 0.00 0.90 0.43 0.00 0.00 1.83 1.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 7 [ 0.43 .. 1.83]
2033-> PHE B 71 HA - VAL A 68 HG1* [ 1.80 4.81] 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.16 .. 0.16]
2034-> PHE B 71 HB* - MET A 67 HE* [ 1.80 3.77] 2.74 1.70 1.63 0.42 2.99 2.99 0.56 0.70 2.73 2.08 0.96 0.64 1.01 0.60 1.82 1.82 1.77 0.41 0.55 0.96 - 20 [ 0.41 .. 2.99]
2035-> PHE B 71 HB* - VAL A 68 HA [ 1.80 4.35] 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.07 .. 0.55]
2039-> PHE B 71 HB2 - VAL A 68 HG2* [ 1.80 4.74] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.35 .. 0.65]
2040-> PHE B 71 HD* - LEU A 15 HB* [ 1.80 4.98] 1.64 1.81 0.00 0.00 1.32 1.04 0.00 0.18 0.85 2.06 0.00 0.00 0.21 0.17 2.46 0.24 0.55 0.00 0.00 0.05 - 13 [ 0.05 .. 2.46]
2041-> PHE B 71 HD* - LEU A 15 HD2* [ 1.80 5.60] 0.00 0.00 0.00 0.04 0.00 0.00 0.00 0.31 1.30 0.00 0.00 0.00 0.00 0.25 2.65 0.56 0.00 0.00 0.00 0.41 - 7 [ 0.04 .. 2.65]
2042-> PHE B 71 HD* - ILE A 29 HD1* [ 1.80 4.95] 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.05 .. 0.26]
2043-> PHE B 71 HD* - MET A 67 HE* [ 1.80 4.81] 0.31 0.00 0.00 0.00 0.60 0.68 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.31 .. 0.74]
2045-> PHE B 71 HD* - VAL A 68 HG2* [ 1.80 4.09] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.77 .. 0.77]
2046-> PHE B 71 HE* - LEU A 15 HD1* [ 1.80 3.37] 0.46 0.80 0.00 0.64 0.37 0.76 0.52 0.00 1.34 0.50 0.00 0.28 0.00 0.15 2.63 1.01 0.95 0.00 0.00 1.00 - 14 [ 0.15 .. 2.63]
2047-> PHE B 71 HE* - LEU A 15 HD2* [ 1.80 3.94] 0.00 0.00 0.24 0.78 0.00 0.00 0.47 1.32 1.84 0.00 0.00 0.23 0.00 0.86 3.75 1.71 0.00 0.25 1.23 2.30 - 12 [ 0.23 .. 3.75]
2048-> PHE B 71 HE* - LEU A 16 HD1* [ 1.80 4.98] 0.00 0.00 2.38 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 0.00 0.00 0.00 - 3 [ 2.24 .. 2.46]
2049-> PHE B 71 HE* - LEU A 16 HD2* [ 1.80 5.03] 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.13 0.00 - 4 [ 0.13 .. 0.84]
2050-> PHE B 71 HE* - LEU A 16 HG [ 1.80 4.86] 0.00 0.00 2.91 0.00 0.00 0.57 0.00 2.49 0.58 0.00 0.16 0.09 0.00 0.00 1.14 0.58 2.73 0.00 0.00 0.00 - 9 [ 0.09 .. 2.91]
2052-> PHE B 71 HE* - ILE A 29 HG2* [ 1.80 4.11] 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.07 .. 0.52]
2053-> PHE B 71 HE* - PHE A 64 HZ [ 1.80 3.89] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.77 .. 0.77]
2054-> PHE B 71 HE* - MET A 67 HE* [ 1.80 4.39] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.46 .. 0.68]
2055-> PHE B 71 HE* - VAL A 68 HG2* [ 1.80 4.95] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 - 2 [ 0.03 .. 0.88]
2056-> PHE B 71 HN - LEU A 16 HD1* [ 1.80 4.68] 1.43 1.82 2.24 0.73 1.52 0.99 0.39 2.35 0.00 1.98 1.99 0.79 0.50 1.61 2.04 0.71 2.55 0.98 0.00 1.95 - 18 [ 0.39 .. 2.55]
2057-> PHE B 71 HN - LEU A 16 HD2* [ 1.80 5.16] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.01 .. 0.42]
2058-> PHE B 71 HN - VAL A 68 HG2* [ 1.80 5.39] 0.00 0.06 0.16 0.00 0.00 0.10 0.00 1.67 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.23 0.00 0.00 - 7 [ 0.06 .. 1.67]
2059-> PHE B 71 HZ - LEU A 15 HD1* [ 1.80 4.77] 0.50 0.71 0.00 0.00 0.66 1.03 0.00 0.00 0.45 0.46 0.00 0.00 0.00 0.00 1.43 0.14 1.36 0.00 0.00 0.76 - 10 [ 0.14 .. 1.43]
2060-> PHE B 71 HZ - LEU A 16 HD1* [ 1.80 5.48] 0.00 0.00 3.59 0.00 0.00 0.73 0.00 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.80 1.14 4.01 0.00 0.00 0.00 - 6 [ 0.73 .. 4.01]
2063-> PHE B 71 HZ - PHE A 64 HE* [ 1.80 4.22] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.37 .. 0.44]
2064-> PHE B 71 HZ - MET A 67 HE* [ 1.80 3.94] 0.86 0.00 0.00 1.18 0.89 1.36 0.99 0.00 0.00 0.00 2.72 1.99 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 8 [ 0.86 .. 2.72]
2065-> LYS B 72 HA - VAL A 68 HG1* [ 1.80 5.25] 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.00 - 3 [ 0.54 .. 0.91]
2066-> LYS B 72 HA - LYS A 72 HE* [ 1.80 4.64] 0.00 0.00 1.03 0.77 1.30 0.00 0.00 2.09 0.00 2.04 0.55 0.00 0.00 0.00 0.00 1.04 1.52 0.00 0.29 0.00 - 9 [ 0.29 .. 2.09]
2067-> LYS B 72 HB* - VAL A 68 HG1* [ 1.80 5.27] 0.47 0.64 1.62 0.00 0.07 0.60 0.00 1.29 0.55 0.47 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.16 0.00 0.00 - 10 [ 0.07 .. 1.62]
2068-> LYS B 72 HB* - LYS A 72 HE* [ 1.80 4.93] 0.19 0.54 1.51 0.41 1.12 0.39 0.00 2.73 0.00 2.32 0.00 0.00 0.00 0.26 0.00 0.73 2.10 0.24 0.00 0.00 - 13 [ 0.00 .. 2.73]
2069-> LYS B 72 HE* - LYS A 72 HA [ 1.80 4.64] 0.00 0.00 1.03 0.77 1.30 0.00 0.00 2.09 0.00 2.04 0.55 0.00 0.00 0.00 0.00 1.04 1.53 0.00 0.29 0.00 - 9 [ 0.29 .. 2.09]
2070-> LYS B 72 HE* - LYS A 72 HB* [ 1.80 4.93] 0.19 0.54 1.51 0.41 1.12 0.39 0.00 2.73 0.00 2.32 0.00 0.00 0.00 0.26 0.00 0.73 2.10 0.25 0.00 0.00 - 13 [ 0.00 .. 2.73]
2071-> LYS B 72 HG* - VAL A 68 HG1* [ 1.80 6.05] 0.12 0.21 0.00 0.00 0.36 0.25 0.00 1.18 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 - 7 [ 0.12 .. 1.18]
2072-> LYS B 72 HN - VAL A 68 HG1* [ 1.80 5.51] 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.19 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 - 4 [ 0.02 .. 0.83]
2073-> GLY B 73 HN - VAL A 68 HG1* [ 1.80 5.20] 0.77 0.97 2.59 0.00 0.66 0.41 0.00 1.43 1.32 0.70 0.00 0.22 0.12 0.24 0.57 0.25 2.20 0.49 0.00 0.00 - 15 [ 0.12 .. 2.59]
2074-> ASN B 74 HN - VAL A 68 HG1* [ 1.80 5.51] 0.00 0.00 1.94 0.00 0.21 0.00 0.00 0.00 0.85 0.14 0.00 0.00 0.00 0.00 0.68 0.00 1.79 0.00 0.00 0.00 - 6 [ 0.14 .. 1.94]
2076-> LEU B 75 HD1* - GLN A 65 HA [ 1.80 4.57] 0.53 0.36 0.91 2.04 0.33 0.00 2.43 0.00 1.24 0.60 0.00 1.19 0.00 1.71 2.09 0.95 0.59 0.00 0.00 0.67 - 14 [ 0.33 .. 2.43]
2077-> LEU B 75 HD1* - VAL A 68 HG1* [ 1.80 4.37] 0.00 0.00 0.41 0.14 0.00 0.00 0.52 0.87 0.00 0.00 0.00 0.00 0.30 0.00 0.54 0.00 0.00 0.00 1.24 1.42 - 8 [ 0.14 .. 1.42]
2078-> LEU B 75 HD1* - VAL A 68 HG2* [ 1.80 4.30] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.30 - 2 [ 0.12 .. 0.30]
2079-> LEU B 75 HD2* - PHE A 41 HD* [ 1.80 5.00] 0.47 0.44 0.12 0.00 1.53 0.77 0.19 0.44 0.80 0.43 0.00 0.00 0.00 0.00 0.00 0.91 0.28 0.00 1.21 0.00 - 12 [ 0.12 .. 1.53]
2080-> LEU B 75 HD2* - ASN A 61 HA [ 1.80 5.57] 2.13 2.04 1.76 2.70 2.44 1.69 2.30 0.00 2.78 2.02 0.00 2.03 0.00 2.08 0.37 3.12 1.86 1.00 0.00 0.00 - 15 [ 0.37 .. 3.12]
2081-> LEU B 75 HD2* - PHE A 64 HA [ 1.80 5.04] 3.12 2.94 1.40 3.33 3.40 3.73 3.36 0.04 2.62 3.08 1.19 3.59 0.00 3.23 0.72 3.51 2.98 1.92 2.62 0.00 - 18 [ 0.04 .. 3.73]
2082-> LEU B 75 HD2* - PHE A 64 HN [ 1.80 5.83] 2.97 2.80 1.80 3.31 3.34 3.07 3.35 0.00 3.29 2.99 0.63 3.30 0.00 3.06 0.93 3.51 2.94 1.80 1.42 0.00 - 17 [ 0.63 .. 3.51]
2083-> LEU B 75 HD2* - GLN A 65 HN [ 1.80 3.84] 3.90 3.73 2.36 4.29 3.76 3.53 4.45 0.00 4.21 3.78 1.02 4.07 0.00 3.79 3.01 4.37 3.99 2.48 1.70 0.00 - 17 [ 1.02 .. 4.45]
2084-> LEU B 75 HD2* - MET A 67 HE* [ 1.80 4.20] 3.89 2.32 0.42 2.43 4.37 4.65 2.69 0.89 3.41 2.75 1.58 2.67 0.31 2.56 1.26 3.65 2.83 1.27 3.36 1.08 - 20 [ 0.31 .. 4.65]
2085-> LEU B 75 HD2* - MET A 67 HG* [ 1.80 5.72] 1.43 2.75 0.28 3.20 1.62 2.27 3.50 0.47 0.99 3.23 1.90 3.33 0.13 3.09 1.90 3.25 1.22 2.07 3.34 0.90 - 20 [ 0.13 .. 3.50]
2086-> LEU B 75 HD2* - VAL A 68 HG1* [ 1.80 4.47] 0.00 0.00 0.00 0.65 0.00 0.00 1.06 0.00 0.30 0.00 0.11 0.60 0.00 0.55 1.26 0.14 0.00 0.00 1.40 0.54 - 10 [ 0.11 .. 1.40]
2087-> LEU B 75 HD2* - VAL A 68 HG2* [ 1.80 4.52] 0.00 0.00 0.00 0.34 0.00 0.10 0.75 0.00 0.00 0.00 0.00 0.39 0.00 0.02 0.00 0.00 0.00 0.00 0.48 0.00 - 6 [ 0.02 .. 0.75]
2088-> LEU B 75 HD2* - VAL A 68 HN [ 1.80 6.05] 1.45 0.71 0.00 1.95 1.28 1.88 2.38 0.00 1.42 1.03 0.17 2.05 0.00 1.93 0.75 1.26 1.20 0.49 1.59 0.00 - 16 [ 0.17 .. 2.38]
2089-> GLU B 76 HB* - GLN A 65 HE22 [ 1.80 5.58] 2.87 1.87 1.68 4.78 1.08 0.02 4.18 2.49 0.00 0.00 0.00 0.00 1.05 0.32 0.00 6.56 2.08 4.48 0.00 0.56 - 14 [ 0.02 .. 6.56]
2090-> GLU B 76 HB* - VAL A 68 HG1* [ 1.80 4.29] 0.00 0.00 1.18 0.00 0.36 0.00 0.00 1.47 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.71 1.95 0.00 1.05 - 8 [ 0.00 .. 1.95]
2091-> GLU B 76 HB* - ASP A 69 HN [ 1.80 6.05] 0.00 0.00 4.26 0.40 1.72 1.41 0.57 1.18 0.11 1.00 0.99 0.00 0.00 0.00 0.00 1.80 3.04 4.71 0.00 3.06 - 13 [ 0.11 .. 4.71]
2092-> HIS B 77 HN - GLN A 65 HE22 [ 1.80 5.57] 1.59 2.87 3.05 2.49 0.80 0.00 1.62 1.16 1.03 0.00 1.59 0.00 0.99 0.00 2.32 4.25 4.46 8.09 0.28 1.43 - 16 [ 0.28 .. 8.09]
2093-> GLU A 10 HN - SER A 33 O [ 1.70 2.30] 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.87 .. 0.87]
2094-> GLU A 10 N - SER A 33 O [ 2.70 3.30] 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.63 .. 0.63]
2095-> SER A 19 HN - LYS A 27 O [ 1.70 2.30] 0.00 0.00 0.00 0.00 0.00 0.09 0.42 0.00 0.00 0.00 0.18 0.20 0.13 0.58 0.00 0.00 0.00 0.00 0.00 0.00 - 6 [ 0.09 .. 0.58]
2096-> SER A 19 N - LYS A 27 O [ 2.70 3.30] 0.00 0.00 0.00 0.00 0.00 0.04 0.31 0.00 0.00 0.00 0.13 0.15 0.08 0.45 0.00 0.00 0.00 0.00 0.00 0.00 - 6 [ 0.04 .. 0.45]
2097-> ASN A 21 HN - TRP A 25 O [ 1.70 2.30] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.43 0.00 0.57 0.00 0.00 0.00 0.00 0.18 0.00 0.00 0.16 0.00 - 4 [ 0.16 .. 0.57]
2098-> ASN A 21 N - TRP A 25 O [ 2.70 3.30] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.17 0.00 0.44 0.03 0.00 0.00 0.00 0.00 0.02 0.00 0.09 0.00 - 5 [ 0.02 .. 0.44]
2099-> TRP A 25 HN - ASN A 21 O [ 1.70 2.30] 0.88 0.52 0.00 0.00 0.00 0.00 0.22 0.72 0.62 0.38 0.37 0.00 0.33 0.48 0.00 0.49 0.00 0.00 0.80 0.00 - 11 [ 0.22 .. 0.88]
2100-> TRP A 25 N - ASN A 21 O [ 2.70 3.30] 0.47 0.01 0.01 0.00 0.00 0.00 0.07 0.27 0.19 0.27 0.00 0.17 0.00 0.32 0.00 0.25 0.00 0.00 0.55 0.00 - 12 [ 0.00 .. 0.55]
2101-> THR A 26 HN - TRP A 46 O [ 1.70 2.30] 0.00 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.32 .. 1.67]
2102-> THR A 26 N - TRP A 46 O [ 2.70 3.30] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.19 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.19 .. 1.07]
2115-> ASN A 35 HN - THR A 8 O [ 1.70 2.30] 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.64 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.00 .. 1.21]
2116-> ASN A 35 N - THR A 8 O [ 2.70 3.30] 0.00 0.00 0.00 0.00 0.00 0.00 0.16 0.00 0.48 0.00 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.01 - 4 [ 0.01 .. 0.66]
2117-> LYS A 40 HN - VAL A 32 O [ 1.70 2.30] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.00 0.00 - 1 [ 0.46 .. 0.46]
2123-> ARG A 44 HN - GLU A 28 O [ 1.70 2.30] 0.00 0.00 0.00 0.00 0.17 0.00 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.21 0.00 0.03 - 4 [ 0.03 .. 0.21]
2124-> ARG A 44 N - GLU A 28 O [ 2.70 3.30] 0.00 0.00 0.00 0.00 0.14 0.00 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 0.00 0.00 - 3 [ 0.10 .. 0.14]
2126-> TRP A 46 N - THR A 26 O [ 2.70 3.30] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.02 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.02 .. 0.16]
2129-> PHE A 64 HN - SER A 60 O [ 1.70 2.30] 0.00 0.00 0.00 0.35 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 0.00 0.00 0.21 0.00 0.00 - 5 [ 0.00 .. 0.35]
2130-> PHE A 64 N - SER A 60 O [ 2.70 3.30] 0.00 0.00 0.00 0.31 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.09 0.00 0.00 0.07 0.00 0.00 - 4 [ 0.07 .. 0.31]
2131-> GLN A 65 HN - ASN A 61 O [ 1.70 2.30] 1.57 1.29 0.58 1.47 0.00 0.56 0.00 0.00 0.00 0.07 0.00 0.90 1.12 0.99 0.00 1.11 0.36 1.37 0.58 0.00 - 13 [ 0.07 .. 1.57]
2132-> GLN A 65 N - ASN A 61 O [ 2.70 3.30] 1.33 1.04 0.42 1.31 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.69 0.97 0.88 0.00 0.92 0.09 1.24 0.42 0.00 - 12 [ 0.09 .. 1.33]
2133-> THR A 66 HN - GLU A 62 O [ 1.70 2.30] 0.60 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.03 0.00 0.00 0.00 - 4 [ 0.03 .. 0.60]
2134-> THR A 66 N - GLU A 62 O [ 2.70 3.30] 0.29 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.12 0.00 0.00 0.00 0.00 - 3 [ 0.12 .. 0.32]
2135-> MET A 67 HN - GLU A 63 O [ 1.70 2.30] 1.12 1.26 0.00 0.00 0.75 0.64 0.00 0.00 0.34 0.79 0.00 0.01 0.05 0.00 0.00 0.76 0.69 0.00 0.00 0.31 - 11 [ 0.01 .. 1.26]
2136-> MET A 67 N - GLU A 63 O [ 2.70 3.30] 0.96 1.10 0.00 0.00 0.59 0.52 0.00 0.00 0.19 0.67 0.00 0.00 0.00 0.00 0.00 0.59 0.62 0.00 0.00 0.16 - 9 [ 0.16 .. 1.10]
2137-> VAL A 68 HN - PHE A 64 O [ 1.70 2.30] 0.46 0.44 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.29 0.00 0.00 0.00 0.00 - 5 [ 0.02 .. 0.46]
2138-> VAL A 68 N - PHE A 64 O [ 2.70 3.30] 0.33 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.20 0.00 0.00 0.00 0.00 - 4 [ 0.05 .. 0.34]
2139-> ASP A 69 HN - GLN A 65 O [ 1.70 2.30] 0.02 0.00 0.00 0.00 0.00 0.02 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.69 0.54 - 6 [ 0.02 .. 0.87]
2140-> ASP A 69 N - GLN A 65 O [ 2.70 3.30] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.34 0.46 - 4 [ 0.03 .. 0.79]
2141-> ALA A 70 HN - THR A 66 O [ 1.70 2.30] 0.49 0.11 0.00 0.00 0.20 0.00 0.00 0.37 0.00 0.00 0.03 0.00 0.48 0.05 0.65 0.00 0.00 0.00 1.15 0.00 - 9 [ 0.03 .. 1.15]
2142-> ALA A 70 N - THR A 66 O [ 2.70 3.30] 0.42 0.02 0.00 0.00 0.08 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.35 0.01 0.55 0.00 0.00 0.00 1.00 0.00 - 8 [ 0.01 .. 1.00]
2143-> PHE A 71 HN - MET A 67 O [ 1.70 2.30] 0.00 0.06 0.22 0.00 0.00 0.00 0.00 0.08 0.00 0.00 0.34 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.45 0.00 - 6 [ 0.06 .. 0.51]
2144-> PHE A 71 N - MET A 67 O [ 2.70 3.30] 0.00 0.08 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.39 0.00 - 4 [ 0.02 .. 0.39]
2145-> LYS A 72 HN - VAL A 68 O [ 1.70 2.30] 0.00 0.00 0.51 0.00 0.00 0.76 0.06 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 1.20 - 6 [ 0.06 .. 1.22]
2146-> LYS A 72 N - VAL A 68 O [ 2.70 3.30] 0.00 0.00 0.18 0.00 0.00 0.44 0.00 0.01 0.99 0.00 0.00 0.00 0.02 0.00 0.00 0.00 0.02 0.00 0.00 0.93 - 7 [ 0.01 .. 0.99]
2147-> GLY A 73 HN - ASP A 69 O [ 1.70 2.30] 0.00 0.00 0.00 1.17 0.00 0.81 1.08 0.66 0.00 0.47 1.30 0.94 1.32 0.00 0.00 0.00 0.00 0.00 0.97 0.76 - 10 [ 0.47 .. 1.32]
2148-> GLY A 73 N - ASP A 69 O [ 2.70 3.30] 0.00 0.00 0.00 0.98 0.05 0.67 0.88 0.49 0.00 0.26 1.16 0.84 1.20 0.00 0.00 0.00 0.00 0.00 0.62 0.57 - 11 [ 0.05 .. 1.20]
2149-> GLU B 10 HN - SER B 33 O [ 1.70 2.30] 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.87 .. 0.87]
2150-> GLU B 10 N - SER B 33 O [ 2.70 3.30] 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.63 .. 0.63]
2151-> SER B 19 HN - LYS B 27 O [ 1.70 2.30] 0.00 0.00 0.00 0.00 0.00 0.09 0.42 0.00 0.00 0.00 0.18 0.21 0.13 0.58 0.00 0.00 0.00 0.00 0.00 0.00 - 6 [ 0.09 .. 0.58]
2152-> SER B 19 N - LYS B 27 O [ 2.70 3.30] 0.00 0.00 0.00 0.00 0.00 0.04 0.31 0.00 0.00 0.00 0.13 0.15 0.08 0.45 0.00 0.00 0.00 0.00 0.00 0.00 - 6 [ 0.04 .. 0.45]
2153-> ASN B 21 HN - TRP B 25 O [ 1.70 2.30] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.57 0.00 0.00 0.00 0.00 0.18 0.00 0.00 0.16 0.00 - 4 [ 0.16 .. 0.57]
2154-> ASN B 21 N - TRP B 25 O [ 2.70 3.30] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.17 0.00 0.44 0.03 0.00 0.00 0.00 0.00 0.02 0.00 0.09 0.00 - 5 [ 0.02 .. 0.44]
2155-> TRP B 25 HN - ASN B 21 O [ 1.70 2.30] 0.88 0.52 0.00 0.00 0.00 0.00 0.22 0.72 0.62 0.38 0.37 0.00 0.33 0.48 0.00 0.49 0.00 0.00 0.80 0.00 - 11 [ 0.22 .. 0.88]
2156-> TRP B 25 N - ASN B 21 O [ 2.70 3.30] 0.47 0.01 0.01 0.00 0.00 0.00 0.07 0.27 0.19 0.27 0.00 0.17 0.00 0.32 0.00 0.25 0.00 0.00 0.55 0.00 - 12 [ 0.00 .. 0.55]
2157-> THR B 26 HN - TRP B 46 O [ 1.70 2.30] 0.00 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.33 .. 1.67]
2158-> THR B 26 N - TRP B 46 O [ 2.70 3.30] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.19 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.19 .. 1.07]
2171-> ASN B 35 HN - THR B 8 O [ 1.70 2.30] 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.63 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.00 .. 1.21]
2172-> ASN B 35 N - THR B 8 O [ 2.70 3.30] 0.00 0.00 0.00 0.00 0.00 0.00 0.16 0.00 0.48 0.00 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.01 - 4 [ 0.01 .. 0.66]
2173-> LYS B 40 HN - VAL B 32 O [ 1.70 2.30] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.00 0.00 - 1 [ 0.46 .. 0.46]
2179-> ARG B 44 HN - GLU B 28 O [ 1.70 2.30] 0.00 0.00 0.00 0.00 0.17 0.00 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.03 - 4 [ 0.03 .. 0.22]
2180-> ARG B 44 N - GLU B 28 O [ 2.70 3.30] 0.00 0.00 0.00 0.00 0.14 0.00 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 0.00 0.00 - 3 [ 0.10 .. 0.14]
2182-> TRP B 46 N - THR B 26 O [ 2.70 3.30] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.02 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.02 .. 0.16]
2185-> PHE B 64 HN - SER B 60 O [ 1.70 2.30] 0.00 0.00 0.00 0.35 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 0.00 0.00 0.21 0.00 0.00 - 5 [ 0.00 .. 0.35]
2186-> PHE B 64 N - SER B 60 O [ 2.70 3.30] 0.00 0.00 0.00 0.31 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.09 0.00 0.00 0.07 0.00 0.00 - 4 [ 0.07 .. 0.31]
2187-> GLN B 65 HN - ASN B 61 O [ 1.70 2.30] 1.57 1.29 0.58 1.47 0.00 0.56 0.00 0.00 0.00 0.07 0.00 0.90 1.12 0.99 0.00 1.11 0.36 1.37 0.58 0.00 - 13 [ 0.07 .. 1.57]
2188-> GLN B 65 N - ASN B 61 O [ 2.70 3.30] 1.33 1.04 0.42 1.31 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.69 0.97 0.88 0.00 0.92 0.09 1.24 0.42 0.00 - 12 [ 0.09 .. 1.33]
2189-> THR B 66 HN - GLU B 62 O [ 1.70 2.30] 0.60 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.02 0.00 0.00 0.00 - 4 [ 0.02 .. 0.60]
2190-> THR B 66 N - GLU B 62 O [ 2.70 3.30] 0.29 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.12 0.00 0.00 0.00 0.00 - 3 [ 0.12 .. 0.32]
2191-> MET B 67 HN - GLU B 63 O [ 1.70 2.30] 1.12 1.26 0.00 0.00 0.75 0.64 0.00 0.00 0.34 0.79 0.00 0.01 0.06 0.00 0.00 0.77 0.69 0.00 0.00 0.31 - 11 [ 0.01 .. 1.26]
2192-> MET B 67 N - GLU B 63 O [ 2.70 3.30] 0.96 1.10 0.00 0.00 0.59 0.52 0.00 0.00 0.19 0.67 0.00 0.00 0.00 0.00 0.00 0.59 0.62 0.00 0.00 0.16 - 9 [ 0.16 .. 1.10]
2193-> VAL B 68 HN - PHE B 64 O [ 1.70 2.30] 0.46 0.44 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.29 0.00 0.00 0.00 0.00 - 5 [ 0.02 .. 0.46]
2194-> VAL B 68 N - PHE B 64 O [ 2.70 3.30] 0.33 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.20 0.00 0.00 0.00 0.00 - 4 [ 0.05 .. 0.34]
2195-> ASP B 69 HN - GLN B 65 O [ 1.70 2.30] 0.02 0.00 0.00 0.00 0.00 0.02 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.69 0.54 - 6 [ 0.02 .. 0.87]
2196-> ASP B 69 N - GLN B 65 O [ 2.70 3.30] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.35 0.46 - 4 [ 0.03 .. 0.79]
2197-> ALA B 70 HN - THR B 66 O [ 1.70 2.30] 0.49 0.11 0.00 0.00 0.20 0.00 0.00 0.37 0.00 0.00 0.03 0.00 0.48 0.06 0.65 0.00 0.00 0.00 1.15 0.00 - 9 [ 0.03 .. 1.15]
2198-> ALA B 70 N - THR B 66 O [ 2.70 3.30] 0.42 0.02 0.00 0.00 0.08 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.35 0.01 0.55 0.00 0.00 0.00 1.00 0.00 - 8 [ 0.01 .. 1.00]
2199-> PHE B 71 HN - MET B 67 O [ 1.70 2.30] 0.00 0.06 0.23 0.00 0.00 0.00 0.00 0.09 0.00 0.00 0.34 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.45 0.00 - 6 [ 0.06 .. 0.51]
2200-> PHE B 71 N - MET B 67 O [ 2.70 3.30] 0.00 0.08 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.39 0.00 - 4 [ 0.02 .. 0.39]
2201-> LYS B 72 HN - VAL B 68 O [ 1.70 2.30] 0.00 0.00 0.51 0.00 0.00 0.76 0.06 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 1.20 - 6 [ 0.06 .. 1.22]
2202-> LYS B 72 N - VAL B 68 O [ 2.70 3.30] 0.00 0.00 0.18 0.00 0.00 0.44 0.00 0.02 0.99 0.00 0.00 0.00 0.02 0.00 0.00 0.00 0.02 0.00 0.00 0.92 - 7 [ 0.02 .. 0.99]
2203-> GLY B 73 HN - ASP B 69 O [ 1.70 2.30] 0.00 0.00 0.00 1.17 0.00 0.81 1.08 0.66 0.00 0.47 1.30 0.94 1.32 0.00 0.00 0.00 0.00 0.00 0.97 0.76 - 10 [ 0.47 .. 1.32]
2204-> GLY B 73 N - ASP B 69 O [ 2.70 3.30] 0.00 0.00 0.00 0.98 0.05 0.67 0.88 0.49 0.00 0.26 1.16 0.85 1.20 0.00 0.00 0.00 0.00 0.00 0.62 0.57 - 11 [ 0.05 .. 1.20]
-------------------------------------------
Number of Violations greater than 0.10 259 245 246 185 206 237 200 238 225 182 197 172 234 213 236 182 273 211 228 198
-------------------------------------------
---- Summary Of Residual Distance Constraint Violations ----
Mod 1 Mod 2 Mod 3 Mod 4 Mod 5 Mod 6 Mod 7 Mod 8 Mod 9 Mod 10 Mod 11 Mod 12 Mod 13 Mod 14 Mod 15 Mod 16 Mod 17 Mod 18 Mod 19 Mod 20 Averages
~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~~~~~~
0.1 - 0.2 ang: 34 26 24 20 25 22 32 23 40 25 38 24 26 19 24 24 18 17 40 15 25.80
0.2 - 0.5 ang: 49 48 45 53 41 41 39 45 39 43 35 42 52 65 35 30 36 62 56 50 45.30
> 0.5 ang: 176 171 177 112 140 174 129 170 146 114 124 106 156 129 177 128 219 132 132 133 147.25
Total : 287 295 265 205 245 277 228 275 254 207 234 226 274 238 258 212 297 247 253 245 251.10
Minimum Violation : 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000
Maximum Violation : 5.772 5.756 5.981 4.922 4.368 5.891 4.561 4.774 4.213 3.782 4.062 7.026 5.373 3.795 6.490 6.562 6.609 8.088 3.431 3.664 8.088
Max Intra Viol : 1.157 1.153 0.936 1.121 0.766 0.786 1.172 1.055 0.456 0.775 1.137 1.126 1.243 1.103 1.238 1.226 1.249 1.646 1.209 1.119 1.646
Max Inter Viol : 3.897 3.728 4.263 4.780 4.368 4.648 4.451 3.118 4.213 3.782 2.724 4.066 2.309 3.795 3.746 6.562 4.456 8.088 3.357 3.065 8.088
Max Seque Viol : 1.118 0.621 0.833 0.367 1.230 0.987 0.224 0.920 1.328 0.563 0.111 0.103 0.609 0.912 1.058 1.378 0.795 0.246 0.360 1.020 1.378
Max Medium Viol : 3.329 2.624 0.945 4.922 1.371 5.891 4.561 4.561 1.697 1.237 4.062 0.937 3.544 2.529 0.868 4.064 0.695 3.971 3.431 3.664 5.891
Max Long Viol : 5.772 5.756 5.981 2.383 2.277 3.381 2.539 4.774 4.152 1.472 3.562 7.026 5.373 1.672 6.490 1.375 6.609 5.693 1.546 2.472 7.026
Average Violation : 0.159 0.141 0.162 0.107 0.103 0.128 0.112 0.132 0.108 0.089 0.085 0.109 0.117 0.100 0.137 0.119 0.193 0.132 0.089 0.083 0.12022
Avge Intra Viol : 0.015 0.016 0.007 0.006 0.007 0.007 0.008 0.009 0.005 0.008 0.009 0.009 0.013 0.010 0.009 0.008 0.014 0.013 0.010 0.006 0.00948
Avge Inter Viol : 0.309 0.300 0.412 0.329 0.343 0.302 0.313 0.332 0.304 0.317 0.201 0.247 0.189 0.324 0.332 0.399 0.508 0.336 0.197 0.203 0.30976
Avge Seque Viol : 0.089 0.064 0.012 0.082 0.015 0.095 0.070 0.069 0.024 0.017 0.070 0.015 0.080 0.033 0.019 0.080 0.015 0.059 0.093 0.065 0.05325
Avge Mediu Viol : 0.029 0.016 0.020 0.012 0.030 0.031 0.008 0.035 0.030 0.011 0.001 0.004 0.010 0.030 0.031 0.035 0.026 0.008 0.018 0.040 0.02136
Avge Long Viol : 0.245 0.209 0.250 0.044 0.075 0.132 0.089 0.141 0.119 0.042 0.083 0.188 0.205 0.059 0.211 0.021 0.277 0.153 0.073 0.068 0.13415
RMS Violation : 0.633 0.562 0.637 0.523 0.452 0.546 0.520 0.517 0.463 0.410 0.376 0.572 0.483 0.429 0.568 0.585 0.715 0.632 0.369 0.351 0.52632
RMS Inter : 0.837 0.791 0.950 0.933 0.878 0.855 0.921 0.764 0.817 0.829 0.533 0.784 0.487 0.831 0.814 1.131 1.111 1.062 0.609 0.543 0.84204
RMS Intra : 0.100 0.119 0.068 0.075 0.056 0.057 0.080 0.077 0.033 0.062 0.080 0.079 0.113 0.082 0.088 0.085 0.101 0.132 0.087 0.074 0.08542
RMS Sequential : 0.395 0.305 0.081 0.508 0.110 0.588 0.451 0.448 0.153 0.104 0.411 0.105 0.392 0.233 0.110 0.436 0.089 0.398 0.378 0.383 0.34312
RMS Medium range : 0.153 0.079 0.107 0.054 0.163 0.137 0.037 0.137 0.172 0.067 0.013 0.018 0.072 0.130 0.144 0.191 0.112 0.036 0.064 0.169 0.11602
RMS Long range : 0.890 0.766 0.886 0.234 0.317 0.430 0.335 0.577 0.471 0.197 0.372 0.852 0.740 0.227 0.811 0.137 0.948 0.636 0.253 0.266 0.58270
Final --global-- Summary for 20 models, 2204 NOEs/model, 44080 NOEs total
~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
Summ of viol : 5299.161
Summ sq. viol : 12210.556
Maximum viol : 8.088
Average viol : 0.12022
RMSD viol : 0.52632
Std. Dev. viol : 0.51240
RMS Inter : 0.84204
RMS Intra : 0.08542
RMS Seque : 0.34312
RMS Medi : 0.11602
RMS Long : 0.58270
table of dihedral angle constraints violations
1-> [THR A 8] PHI -132.1 -73.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 18.5 0.0 0.0 0.0 1.4 28.9 0.0 0.0 0.0 10.4 23.8 0.0 0.0 - 5 [ 0.0 .. 28.9]
2-> [THR A 8] PSI 119.2 160.8 4.1 0.0 0.0 5.5 0.0 0.2 0.0 26.0 0.0 0.0 0.0 0.0 0.0 19.0 4.2 0.0 11.4 25.5 0.0 0.0 - 8 [ 0.0 .. 26.0]
3-> [PHE A 9] PHI -172.7 -104.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 17.4 0.0 10.2 0.0 0.0 0.0 26.1 0.0 7.6 0.0 0.0 - 4 [ 0.0 .. 26.1]
4-> [PHE A 9] PSI 120.2 -169.2 0.0 0.0 0.0 0.0 31.0 0.0 0.0 0.0 0.0 7.3 0.0 9.4 31.6 0.0 0.0 0.0 15.2 10.5 31.3 0.0 - 7 [ 0.0 .. 31.6]
5-> [GLU A 10] PHI -160.5 -92.7 0.0 0.0 0.0 0.0 4.5 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 4.5]
6-> [GLU A 10] PSI 113.1 153.1 0.0 0.0 0.0 0.0 11.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 22.3 0.0 0.0 4.3 0.0 0.0 8.2 0.0 - 4 [ 0.0 .. 22.3]
8-> [ILE A 11] PSI 91.8 142.4 0.0 5.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 5.3]
10-> [GLU A 13] PSI 115.4 155.4 0.0 11.0 15.9 7.2 8.7 7.2 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 4.1 0.0 0.0 9.0 0.0 4.6 - 8 [ 0.0 .. 15.9]
11-> [HIS A 14] PHI -117.9 -72.5 0.0 0.0 31.8 0.3 0.0 17.6 0.0 0.0 0.0 8.0 0.0 0.0 8.4 4.2 8.4 0.0 0.0 1.1 0.0 0.0 - 8 [ 0.0 .. 31.8]
12-> [HIS A 14] PSI 77.1 143.5 0.0 3.5 0.0 0.0 0.0 0.0 0.0 0.0 0.4 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 3.0 - 3 [ 0.0 .. 3.5]
15-> [THR A 17] PHI -105.7 -65.7 7.5 0.0 0.0 0.0 8.8 0.0 0.0 0.0 0.0 4.9 0.0 0.0 2.1 4.5 0.0 0.0 0.0 6.9 7.2 14.1 - 8 [ 0.0 .. 14.1]
18-> [SER A 19] PSI 144.6 -175.4 0.0 0.0 10.6 3.7 0.0 0.0 1.6 0.0 1.1 0.0 0.0 7.2 0.0 1.2 0.0 2.1 0.0 2.1 0.0 0.0 - 8 [ 0.0 .. 10.6]
19-> [GLU A 20] PHI -154.6 -75.4 10.2 0.0 0.0 0.0 0.0 1.5 0.0 0.0 2.9 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 3 [ 0.0 .. 10.2]
20-> [GLU A 20] PSI 104.3 147.9 0.0 0.0 3.2 4.2 0.0 5.3 0.0 0.0 0.0 0.0 0.0 4.5 14.3 0.0 0.0 4.2 3.2 2.2 2.2 0.0 - 9 [ 0.0 .. 14.3]
21-> [ASN A 21] PHI -114.8 -74.8 0.0 0.0 0.0 0.0 0.0 40.0 0.0 6.3 0.0 0.0 15.2 0.0 3.3 0.0 0.0 0.0 0.0 44.5 0.0 0.0 - 5 [ 0.0 .. 44.5]
22-> [ASN A 21] PSI 125.8 -143.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 7.9 0.0 0.0 7.5 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 7.9]
25-> [THR A 26] PHI -152.6 -87.4 0.0 0.0 0.0 32.5 0.0 0.0 0.0 0.0 26.1 0.0 13.4 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 - 4 [ 0.0 .. 32.5]
26-> [THR A 26] PSI 139.9 -178.3 7.9 2.3 18.5 20.3 24.2 14.9 16.3 20.5 10.9 12.6 4.2 1.6 9.8 7.7 23.4 19.0 14.9 24.3 21.6 40.4 - 20 [ 1.6 .. 40.4]
28-> [LYS A 27] PSI 116.3 166.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 3.6 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 10.5 0.6 - 3 [ 0.0 .. 10.5]
29-> [GLU A 28] PHI -169.2 -87.8 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 3.7 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 3.7]
34-> [ASN A 30] PSI 138.4 -174.6 0.0 0.0 0.0 0.0 0.0 4.4 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 4.4]
39-> [SER A 33] PHI -140.7 -74.3 0.0 0.0 0.0 0.0 0.0 22.8 0.0 0.0 0.0 0.0 0.0 1.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 22.8]
40-> [SER A 33] PSI 102.5 146.7 0.0 0.0 0.0 0.0 0.0 5.1 13.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 13.3]
42-> [PHE A 34] PSI 83.9 154.1 0.0 0.0 0.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 0.0 3.9 9.5 0.0 0.0 5.8 0.0 0.0 0.0 0.0 - 4 [ 0.0 .. 25.0]
46-> [PHE A 41] PSI 115.4 168.6 0.0 5.6 6.3 0.0 0.0 0.0 0.0 8.7 0.0 0.0 16.1 0.0 12.2 9.0 0.0 0.0 0.0 0.0 1.7 2.2 - 8 [ 0.0 .. 16.1]
49-> [ILE A 43] PHI -147.1 -91.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.7 1.3 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 1.3]
50-> [ILE A 43] PSI 104.9 147.3 5.7 2.9 0.0 0.0 0.0 10.7 0.0 0.0 0.0 0.0 0.0 2.3 0.0 0.0 0.0 0.0 0.0 6.4 0.0 0.0 - 5 [ 0.0 .. 10.7]
51-> [ARG A 44] PHI -163.1 -112.7 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.7 0.0 0.0 0.0 12.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 12.3]
53-> [ALA A 45] PHI -155.9 -91.3 0.0 0.0 0.0 1.4 3.7 7.2 2.4 0.0 0.0 0.0 8.1 9.5 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.7 - 7 [ 0.0 .. 9.5]
54-> [ALA A 45] PSI 101.6 164.0 0.0 0.0 13.6 0.0 0.0 7.8 0.0 0.0 0.0 0.0 0.0 6.7 0.0 0.0 0.0 0.0 0.0 0.0 24.8 0.0 - 4 [ 0.0 .. 24.8]
55-> [TRP A 46] PHI -156.7 -108.7 0.0 0.0 23.7 11.3 23.7 30.2 3.8 0.0 0.0 0.0 0.0 0.0 0.0 3.7 0.0 2.4 1.3 44.4 0.0 28.7 - 10 [ 0.0 .. 44.4]
56-> [TRP A 46] PSI 125.7 -172.7 0.0 0.0 4.0 0.0 0.0 0.0 18.9 0.0 0.0 10.8 0.0 0.0 0.0 1.3 0.0 0.0 0.0 3.2 0.0 0.0 - 5 [ 0.0 .. 18.9]
57-> [ILE A 57] PHI -161.5 -121.5 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 14.6 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 14.6]
58-> [ILE A 57] PSI 127.8 169.6 2.8 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 10.8 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 10.8]
61-> [LEU A 59] PHI -151.0 -100.4 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.8 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 1.8]
63-> [ASN A 61] PHI -80.6 -40.6 0.0 0.0 0.0 8.8 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.4 0.5 0.0 - 3 [ 0.0 .. 8.8]
64-> [ASN A 61] PSI -58.7 -18.7 22.0 12.0 0.0 31.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 8.7 6.3 7.3 0.0 2.7 0.0 23.3 21.1 0.0 - 9 [ 0.0 .. 31.3]
65-> [GLU A 62] PHI -84.8 -44.8 30.2 28.5 20.6 34.0 0.0 15.1 0.0 0.0 0.0 0.6 0.0 23.2 21.4 23.4 0.0 25.5 13.9 28.3 19.6 0.0 - 13 [ 0.0 .. 34.0]
72-> [GLN A 65] PSI -62.1 -21.9 1.2 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 1.2]
75-> [MET A 67] PHI -82.9 -42.9 1.0 0.0 0.0 0.0 1.9 0.0 0.0 0.0 1.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 3 [ 0.0 .. 1.9]
76-> [MET A 67] PSI -66.0 -26.0 6.0 0.0 0.0 0.0 6.1 1.8 0.0 0.0 4.8 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 4 [ 0.0 .. 6.1]
79-> [ASP A 69] PHI -87.1 -47.1 0.0 0.0 0.0 0.0 0.0 7.8 0.0 0.0 7.9 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 7.9]
83-> [PHE A 71] PHI -107.8 -37.6 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 14.1 0.0 6.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 14.1]
86-> [LYS A 72] PSI -59.2 7.8 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 8.4 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 8.4]
87-> [THR B 8] PHI -132.1 -73.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 18.5 0.0 0.0 0.0 1.4 28.9 0.0 0.0 0.0 10.4 23.8 0.0 0.0 - 5 [ 0.0 .. 28.9]
88-> [THR B 8] PSI 119.2 160.8 4.2 0.0 0.0 5.5 0.0 0.3 0.0 26.1 0.0 0.0 0.0 0.0 0.0 19.2 4.2 0.0 11.4 25.4 0.0 0.0 - 8 [ 0.0 .. 26.1]
89-> [PHE B 9] PHI -172.7 -104.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 17.4 0.0 10.1 0.0 0.0 0.0 26.1 0.0 7.6 0.0 0.0 - 4 [ 0.0 .. 26.1]
90-> [PHE B 9] PSI 120.2 -169.2 0.0 0.0 0.0 0.0 30.9 0.0 0.0 0.0 0.0 7.2 0.0 9.4 31.5 0.0 0.0 0.0 15.2 10.5 31.2 0.0 - 7 [ 0.0 .. 31.5]
91-> [GLU B 10] PHI -160.5 -92.7 0.0 0.0 0.0 0.0 4.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 4.3]
92-> [GLU B 10] PSI 113.1 153.1 0.0 0.0 0.0 0.0 11.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 22.2 0.0 0.0 4.3 0.0 0.0 8.1 0.0 - 4 [ 0.0 .. 22.2]
94-> [ILE B 11] PSI 91.8 142.4 0.0 5.2 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 5.2]
96-> [GLU B 13] PSI 115.4 155.4 0.0 10.9 15.9 7.2 8.6 7.2 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 4.1 0.0 0.0 9.1 0.0 4.5 - 8 [ 0.0 .. 15.9]
97-> [HIS B 14] PHI -117.9 -72.5 0.0 0.0 31.9 0.3 0.0 17.6 0.0 0.0 0.0 7.9 0.0 0.0 8.4 4.1 8.2 0.0 0.0 1.1 0.0 0.0 - 8 [ 0.0 .. 31.9]
98-> [HIS B 14] PSI 77.1 143.5 0.0 3.6 0.0 0.0 0.0 0.0 0.0 0.0 0.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 3.0 - 3 [ 0.0 .. 3.6]
101-> [THR B 17] PHI -105.7 -65.7 7.5 0.0 0.0 0.0 8.8 0.0 0.0 0.0 0.0 5.0 0.0 0.0 2.2 4.4 0.0 0.0 0.0 6.8 7.3 14.1 - 8 [ 0.0 .. 14.1]
104-> [SER B 19] PSI 144.6 -175.4 0.0 0.0 10.6 3.7 0.0 0.0 1.7 0.0 1.1 0.0 0.0 7.3 0.0 1.2 0.0 2.1 0.0 2.2 0.0 0.0 - 8 [ 0.0 .. 10.6]
105-> [GLU B 20] PHI -154.6 -75.4 10.2 0.0 0.0 0.0 0.0 1.5 0.0 0.0 2.9 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 3 [ 0.0 .. 10.2]
106-> [GLU B 20] PSI 104.3 147.9 0.0 0.0 3.3 4.2 0.0 5.3 0.0 0.0 0.0 0.0 0.0 4.5 14.4 0.0 0.0 4.3 3.3 2.2 2.1 0.0 - 9 [ 0.0 .. 14.4]
107-> [ASN B 21] PHI -114.8 -74.8 0.0 0.0 0.0 0.0 0.0 40.0 0.0 6.3 0.0 0.0 15.2 0.0 3.2 0.0 0.0 0.0 0.0 44.5 0.0 0.0 - 5 [ 0.0 .. 44.5]
108-> [ASN B 21] PSI 125.8 -143.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 7.8 0.0 0.0 7.5 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 7.8]
111-> [THR B 26] PHI -152.6 -87.4 0.0 0.0 0.0 32.3 0.0 0.0 0.0 0.0 26.0 0.0 13.4 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.9 - 4 [ 0.0 .. 32.3]
112-> [THR B 26] PSI 139.9 -178.3 7.8 2.3 18.5 20.2 24.2 14.9 16.2 20.4 10.8 12.7 4.2 1.6 9.9 7.7 23.3 18.9 15.0 24.4 21.6 40.4 - 20 [ 1.6 .. 40.4]
114-> [LYS B 27] PSI 116.3 166.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 3.6 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 10.5 0.6 - 3 [ 0.0 .. 10.5]
115-> [GLU B 28] PHI -169.2 -87.8 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 3.8 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 3.8]
120-> [ASN B 30] PSI 138.4 -174.6 0.0 0.0 0.0 0.0 0.0 4.4 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 4.4]
125-> [SER B 33] PHI -140.7 -74.3 0.0 0.0 0.0 0.0 0.0 22.6 0.0 0.0 0.0 0.0 0.0 1.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 22.6]
126-> [SER B 33] PSI 102.5 146.7 0.0 0.0 0.0 0.0 0.0 5.1 13.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 13.3]
128-> [PHE B 34] PSI 83.9 154.1 0.0 0.0 0.0 0.0 0.0 0.0 24.8 0.0 0.0 0.0 0.0 3.9 9.6 0.0 0.0 5.9 0.0 0.0 0.0 0.0 - 4 [ 0.0 .. 24.8]
132-> [PHE B 41] PSI 115.4 168.6 0.0 5.6 6.3 0.0 0.0 0.0 0.0 8.7 0.0 0.0 16.1 0.0 12.1 8.9 0.0 0.0 0.0 0.0 1.7 2.1 - 8 [ 0.0 .. 16.1]
135-> [ILE B 43] PHI -147.1 -91.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.8 1.4 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 1.4]
136-> [ILE B 43] PSI 104.9 147.3 5.7 2.8 0.0 0.0 0.0 10.8 0.0 0.0 0.0 0.0 0.0 2.3 0.0 0.0 0.0 0.0 0.0 6.4 0.0 0.0 - 5 [ 0.0 .. 10.8]
137-> [ARG B 44] PHI -163.1 -112.7 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.6 0.0 0.0 0.0 12.2 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 12.2]
139-> [ALA B 45] PHI -155.9 -91.3 0.0 0.0 0.0 1.5 3.8 7.3 2.3 0.0 0.0 0.0 8.0 9.4 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.8 - 7 [ 0.0 .. 9.4]
140-> [ALA B 45] PSI 101.6 164.0 0.0 0.0 13.6 0.0 0.0 7.8 0.0 0.0 0.0 0.0 0.0 6.6 0.0 0.0 0.0 0.0 0.0 0.0 24.8 0.0 - 4 [ 0.0 .. 24.8]
141-> [TRP B 46] PHI -156.7 -108.7 0.0 0.0 23.7 11.4 23.7 30.2 3.9 0.0 0.0 0.0 0.0 0.0 0.0 3.7 0.0 2.5 1.3 44.4 0.0 28.7 - 10 [ 0.0 .. 44.4]
142-> [TRP B 46] PSI 125.7 -172.7 0.0 0.0 4.0 0.0 0.0 0.0 18.9 0.0 0.0 10.8 0.0 0.0 0.0 1.3 0.0 0.0 0.0 3.2 0.0 0.0 - 5 [ 0.0 .. 18.9]
143-> [ILE B 57] PHI -161.5 -121.5 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 14.6 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 14.6]
144-> [ILE B 57] PSI 127.8 169.6 2.8 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 10.7 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 10.7]
147-> [LEU B 59] PHI -151.0 -100.4 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.7 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 1.7]
149-> [ASN B 61] PHI -80.6 -40.6 0.0 0.0 0.0 8.8 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.4 0.6 0.0 - 3 [ 0.0 .. 8.8]
150-> [ASN B 61] PSI -58.7 -18.7 22.0 12.0 0.0 31.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 8.7 6.4 7.3 0.0 2.8 0.0 23.5 21.0 0.0 - 9 [ 0.0 .. 31.3]
151-> [GLU B 62] PHI -84.8 -44.8 30.2 28.5 20.5 34.0 0.0 15.1 0.0 0.0 0.0 0.6 0.0 23.2 21.5 23.3 0.0 25.6 14.0 28.3 19.5 0.0 - 13 [ 0.0 .. 34.0]
158-> [GLN B 65] PSI -62.1 -21.9 1.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 1.1]
161-> [MET B 67] PHI -82.9 -42.9 1.0 0.0 0.0 0.0 1.9 0.0 0.0 0.0 1.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 3 [ 0.0 .. 1.9]
162-> [MET B 67] PSI -66.0 -26.0 6.0 0.0 0.0 0.0 6.0 2.0 0.0 0.0 4.9 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 4 [ 0.0 .. 6.0]
165-> [ASP B 69] PHI -87.1 -47.1 0.0 0.0 0.0 0.0 0.0 7.9 0.0 0.0 7.9 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 7.9]
169-> [PHE B 71] PHI -107.8 -37.6 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 14.2 0.0 6.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 14.2]
172-> [LYS B 72] PSI -59.2 7.8 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 8.4 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 8.4]
---- ACOSummary Of Residual ACO Constraint Violations ----
Mod 1 Mod 2 Mod 3 Mod 4 Mod 5 Mod 6 Mod 7 Mod 8 Mod 9 Mod 10 Mod 11 Mod 12 Mod 13 Mod 14 Mod 15 Mod 16 Mod 17 Mod 18 Mod 19 Mod 20 Averages
~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~~~~~~
1 - 10. degrees : 14 10 6 12 12 18 6 6 14 8 4 22 18 20 6 12 4 18 8 6 11.20
> 10. degrees : 6 6 14 10 8 14 8 6 4 6 8 4 14 8 2 6 10 16 12 6 8.40
Total : 22 16 20 24 20 34 14 12 20 18 12 26 34 30 10 18 14 34 24 18 21.00
Minimum Violation : 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.00
Maximum Violation : 30.2 28.5 31.9 34.0 31.0 40.0 25.0 26.1 26.1 17.4 16.1 23.2 31.6 23.4 23.4 26.1 15.2 44.5 31.3 40.4 44.53
Max PHI Viol : 30.2 28.5 31.9 34.0 23.7 40.0 3.9 18.5 26.1 17.4 15.2 23.2 28.9 23.4 8.4 26.1 14.0 44.5 19.6 28.7 44.53
Max PSI Viol : 22.0 12.0 18.5 31.3 31.0 14.9 25.0 26.1 10.9 12.7 16.1 9.4 31.6 19.2 23.4 19.0 15.2 25.5 31.3 40.4 40.39
Average Violation : 1.1 0.8 1.7 1.9 1.4 2.3 0.9 1.0 0.7 0.8 0.8 1.0 2.4 1.3 0.5 1.1 0.8 3.1 1.7 1.1 1.328
Avge PHI Viol : 1.066 0.814 1.330 1.434 0.995 1.819 0.380 0.760 1.003 0.850 1.087 1.029 1.392 1.114 0.462 1.122 0.771 1.917 0.801 1.017 1.123
Avge PSI Viol : 1.074 0.995 1.295 1.294 1.372 1.158 1.321 1.170 0.632 0.947 0.686 1.015 1.684 1.144 0.858 0.943 1.021 1.575 1.679 1.085 1.182
RMS Violation : 4.465 3.675 5.861 6.748 5.341 6.998 4.095 4.271 3.252 3.016 3.326 3.480 6.621 4.165 2.748 4.554 3.231 9.319 6.025 5.594 5.114
RMS PHI Viol : 4.998 4.346 6.813 7.495 3.969 9.254 0.689 2.983 4.222 3.014 3.964 4.140 6.048 4.355 1.277 5.583 2.657 11.235 3.182 4.885 5.351
RMS PSI Viol : 3.858 2.851 4.719 5.908 6.426 3.507 5.750 5.253 1.823 3.017 2.531 2.662 7.149 3.964 3.670 3.211 3.718 6.889 7.904 6.223 4.865
Final --global-- Summary for 20 models, 172 ACOs/model, 3440 ACOs total
~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
Summ. Viol. : 4569.06
Summ. Sq. Viol. : 89961.11
Max. Viol. : 44.529
Avg. Viol. : 1.32822
RMS Viol. : 5.11385
Std. Dev. Viol. : 4.93835
JPEG image for inter-residue distance constraints per residue plot
S(phi)|S(psi) V/S Residue number
Text output from PDBStat of phi psi order
# CHAIN .GT. SUM.GT.
# RES ID DIH S(phi) S(psi) S(chi1) S(chi2) S(chi3) S(chi4) S(chi5) 0.90 1.6
# -----------------------------------------------------------------------------------
MET M 1 0.308 0.688 0.478 0.253
LYS M 2 0.624 0.567 0.656 0.793 0.930 0.998
LYS M 3 0.766 0.386 0.745 0.927 0.999 0.999
MET M 4 0.559 0.091 0.467 0.479 0.207
ALA M 5 0.249 0.326
GLU M 6 0.594 0.424 0.747 0.862 0.986
PHE M 7 0.761 0.527 0.777 0.789
THR M 8 0.907 0.917 0.635 8 8
PHE M 9 0.893 0.871 0.465 0.744 9
GLU M 10 0.937 0.966 0.700 0.999 0.999 10 10
ILE M 11 0.994 0.996 0.939 1.000 11 11
GLU M 12 0.983 0.992 0.540 0.298 0.836 12 12
GLU M 13 0.979 0.939 0.443 0.998 0.998 13 13
HIS M 14 0.924 0.993 0.603 0.208 14 14
LEU M 15 0.993 0.995 0.604 0.658 15 15
LEU M 16 0.995 0.968 0.431 0.857 16 16
THR M 17 0.975 0.995 1.000 17 17
LEU M 18 0.985 0.996 0.998 0.999 18 18
SER M 19 0.998 0.953 0.550 19 19
GLU M 20 0.916 0.953 0.743 0.998 0.971 20 20
ASN M 21 0.925 0.946 0.640 0.815 21 21
GLU M 22 0.721 0.487 0.833 0.874 0.947
LYS M 23 0.377 0.749 0.796 0.858 0.999 0.999
GLY M 24 0.763 0.913
TRP M 25 0.965 0.875 0.686 0.227 25
THR M 26 0.939 0.988 0.922 26 26
LYS M 27 0.974 0.991 0.765 0.994 0.662 0.995 27 27
GLU M 28 0.978 0.994 0.522 0.996 0.713 28 28
ILE M 29 0.991 0.995 1.000 0.998 29 29
ASN M 30 0.986 0.986 0.780 0.795 30 30
ARG M 31 0.985 0.998 0.836 0.996 0.870 0.921 0.999 31 31
VAL M 32 0.990 0.996 0.846 32 32
SER M 33 0.978 0.980 0.367 33 33
PHE M 34 0.985 0.926 0.934 0.778 34 34
ASN M 35 0.897 0.565 0.654 0.845
GLY M 36 0.499 0.212
ALA M 37 0.660 0.144
PRO M 38 0.979 0.691 0.878 0.813
ALA M 39 0.497 0.928
LYS M 40 0.965 0.992 0.998 0.794 0.998 1.000 40 40
PHE M 41 0.979 0.955 0.997 0.995 41 41
ASP M 42 0.939 0.989 0.996 0.859 42 42
ILE M 43 0.985 0.990 1.000 0.999 43 43
ARG M 44 0.962 0.965 0.363 0.991 0.314 0.682 1.000 44 44
ALA M 45 0.965 0.929 45 45
TRP M 46 0.890 0.924 0.263 0.314 46
SER M 47 0.834 0.792 0.562
PRO M 48 0.985 0.261 0.891 0.823
ASP M 49 0.214 0.268 0.549 0.880
HIS M 50 0.234 0.425 0.578 0.663
THR M 51 0.657 0.395 0.546
LYS M 52 0.813 0.378 0.649 0.661 0.998 0.930
MET M 53 0.697 0.518 0.404 0.178 0.174
GLY M 54 0.491 0.402
LYS M 55 0.557 0.665 0.929 0.745 0.997 0.937
GLY M 56 0.861 0.885 56
ILE M 57 0.974 0.990 0.853 0.999 57 57
THR M 58 0.986 0.996 1.000 58 58
LEU M 59 0.987 0.994 0.997 0.910 59 59
SER M 60 0.983 0.996 0.928 60 60
ASN M 61 0.992 0.964 0.749 0.547 61 61
GLU M 62 0.958 0.997 0.929 0.845 0.969 62 62
GLU M 63 0.999 0.996 0.906 0.912 0.902 63 63
PHE M 64 0.998 0.996 0.947 0.995 64 64
GLN M 65 0.998 0.993 0.636 0.568 0.921 65 65
THR M 66 0.997 0.997 1.000 66 66
MET M 67 0.988 0.972 0.304 0.991 0.565 67 67
VAL M 68 0.996 0.994 0.917 68 68
ASP M 69 0.980 0.992 0.938 0.941 69 69
ALA M 70 0.994 0.989 70 70
PHE M 71 0.966 0.985 0.988 0.693 71 71
LYS M 72 0.977 0.976 0.507 0.899 0.994 0.804 72 72
GLY M 73 0.958 0.853 73
ASN M 74 0.904 0.327 0.497 0.875
LEU M 75 0.186 0.308 0.677 0.750
GLU M 76 0.452 0.268 0.509 0.507 0.831
HIS M 77 0.919 0.418 0.485 0.582
HIS M 78 0.758 0.498 0.396 0.267
HIS M 79 0.610 0.340 0.507 0.644
HIS M 80 0.629 0.367 0.591 0.628
HIS M 81 0.590 0.594 0.661 0.728
HIS M 82 0.954 0.114 0.732 0.758
MET M 93 0.370 0.308 0.688 0.478 0.253
LYS M 94 0.624 0.568 0.656 0.793 0.930 0.998
LYS M 95 0.766 0.387 0.745 0.926 0.999 0.999
MET M 96 0.559 0.091 0.467 0.479 0.207
ALA M 97 0.249 0.326
GLU M 98 0.593 0.424 0.747 0.862 0.985
PHE M 99 0.761 0.527 0.777 0.789
THR M 100 0.907 0.917 0.635 100 100
PHE M 101 0.893 0.871 0.465 0.744 101
GLU M 102 0.937 0.966 0.700 0.999 0.999 102 102
ILE M 103 0.994 0.996 0.939 1.000 103 103
GLU M 104 0.983 0.992 0.540 0.297 0.836 104 104
GLU M 105 0.979 0.939 0.443 0.998 0.998 105 105
HIS M 106 0.924 0.993 0.603 0.208 106 106
LEU M 107 0.993 0.995 0.604 0.658 107 107
LEU M 108 0.995 0.968 0.431 0.857 108 108
THR M 109 0.975 0.995 1.000 109 109
LEU M 110 0.985 0.996 0.998 0.999 110 110
SER M 111 0.998 0.953 0.550 111 111
GLU M 112 0.916 0.953 0.743 0.998 0.971 112 112
ASN M 113 0.925 0.946 0.640 0.815 113 113
GLU M 114 0.721 0.487 0.833 0.874 0.947
LYS M 115 0.377 0.749 0.796 0.857 0.999 0.999
GLY M 116 0.763 0.913
TRP M 117 0.965 0.874 0.686 0.227 117
THR M 118 0.939 0.988 0.922 118 118
LYS M 119 0.974 0.991 0.765 0.994 0.663 0.996 119 119
GLU M 120 0.978 0.994 0.523 0.996 0.713 120 120
ILE M 121 0.991 0.995 1.000 0.998 121 121
ASN M 122 0.986 0.986 0.780 0.795 122 122
ARG M 123 0.985 0.998 0.835 0.996 0.870 0.921 0.999 123 123
VAL M 124 0.990 0.996 0.846 124 124
SER M 125 0.978 0.980 0.367 125 125
PHE M 126 0.985 0.926 0.934 0.778 126 126
ASN M 127 0.897 0.565 0.654 0.845
GLY M 128 0.499 0.212
ALA M 129 0.660 0.144
PRO M 130 0.979 0.691 0.878 0.813
ALA M 131 0.497 0.928
LYS M 132 0.965 0.992 0.998 0.794 0.998 1.000 132 132
PHE M 133 0.979 0.955 0.997 0.995 133 133
ASP M 134 0.939 0.989 0.996 0.859 134 134
ILE M 135 0.985 0.990 1.000 0.999 135 135
ARG M 136 0.962 0.965 0.364 0.991 0.314 0.682 1.000 136 136
ALA M 137 0.965 0.929 137 137
TRP M 138 0.890 0.924 0.263 0.314 138
SER M 139 0.834 0.792 0.562
PRO M 140 0.985 0.261 0.891 0.823
ASP M 141 0.214 0.268 0.549 0.880
HIS M 142 0.234 0.425 0.578 0.663
THR M 143 0.657 0.395 0.546
LYS M 144 0.813 0.379 0.649 0.661 0.998 0.930
MET M 145 0.696 0.518 0.404 0.178 0.174
GLY M 146 0.490 0.402
LYS M 147 0.557 0.665 0.929 0.745 0.998 0.937
GLY M 148 0.861 0.885 148
ILE M 149 0.974 0.990 0.853 0.999 149 149
THR M 150 0.986 0.996 1.000 150 150
LEU M 151 0.987 0.994 0.997 0.910 151 151
SER M 152 0.983 0.996 0.928 152 152
ASN M 153 0.992 0.963 0.749 0.547 153 153
GLU M 154 0.958 0.997 0.929 0.845 0.969 154 154
GLU M 155 0.999 0.996 0.906 0.912 0.902 155 155
PHE M 156 0.998 0.996 0.947 0.995 156 156
GLN M 157 0.998 0.993 0.636 0.568 0.921 157 157
THR M 158 0.997 0.997 1.000 158 158
MET M 159 0.988 0.972 0.304 0.991 0.565 159 159
VAL M 160 0.996 0.994 0.917 160 160
ASP M 161 0.980 0.992 0.937 0.941 161 161
ALA M 162 0.994 0.989 162 162
PHE M 163 0.966 0.985 0.988 0.693 163 163
LYS M 164 0.977 0.976 0.507 0.899 0.994 0.804 164 164
GLY M 165 0.958 0.853 165
ASN M 166 0.904 0.327 0.497 0.875
LEU M 167 0.186 0.308 0.677 0.750
GLU M 168 0.452 0.268 0.509 0.507 0.830
HIS M 169 0.919 0.418 0.485 0.582
HIS M 170 0.758 0.498 0.396 0.268
HIS M 171 0.610 0.340 0.507 0.645
HIS M 172 0.629 0.367 0.591 0.628
HIS M 173 0.590 0.594 0.661 0.728
HIS M 174 0.954 0.732 0.758
JPEG image of S(phi)~Residue_number Plot
JPEG image of S(psi)~Residue_number Plot
Table of Backbone and Heavy Atom RMSD
Text report of backbone and heavy atom RMSD for ordered regions
>
> Kabsch RMSD data for family `SPR104_R3_em_bcr3.pdb'
>
> Kabsch RMSD of backbone atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 1 is: 0.599
> Kabsch RMSD of backbone atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 2 is: 0.702
> Kabsch RMSD of backbone atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 3 is: 0.933
> Kabsch RMSD of backbone atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 4 is: 0.739
> Kabsch RMSD of backbone atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 5 is: 0.626
> Kabsch RMSD of backbone atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 6 is: 0.743
> Kabsch RMSD of backbone atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 7 is: 1.021
> Kabsch RMSD of backbone atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 8 is: 0.821
> Kabsch RMSD of backbone atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 9 is: 1.590
> Kabsch RMSD of backbone atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 10 is: 0.776
> Kabsch RMSD of backbone atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 11 is: 0.849
> Kabsch RMSD of backbone atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 12 is: 0.622
> Kabsch RMSD of backbone atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 13 is: 0.944
> Kabsch RMSD of backbone atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 14 is: 0.591 (*)
> Kabsch RMSD of backbone atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 15 is: 0.994
> Kabsch RMSD of backbone atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 16 is: 0.633
> Kabsch RMSD of backbone atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 17 is: 0.975
> Kabsch RMSD of backbone atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 18 is: 0.904
> Kabsch RMSD of backbone atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 19 is: 1.187
> Kabsch RMSD of backbone atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 20 is: 1.035
>
> Kabsch RMSD statistics for 20 structures:
> Mean RMSD using as refer. str. `average' for res.[10..21],[26..34],[40..45],[57..72],[102..113],[118..126],[132..137],[149..164], is: 0.864
> Range of RMSD values to reference struct. is 0.591 to 1.590
> Kabsch RMSD of heavy atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 1 is: 0.909
> Kabsch RMSD of heavy atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 2 is: 0.992
> Kabsch RMSD of heavy atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 3 is: 1.099
> Kabsch RMSD of heavy atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 4 is: 1.121
> Kabsch RMSD of heavy atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 5 is: 0.868
> Kabsch RMSD of heavy atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 6 is: 1.194
> Kabsch RMSD of heavy atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 7 is: 1.345
> Kabsch RMSD of heavy atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 8 is: 1.264
> Kabsch RMSD of heavy atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 9 is: 1.809
> Kabsch RMSD of heavy atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 10 is: 1.100
> Kabsch RMSD of heavy atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 11 is: 1.226
> Kabsch RMSD of heavy atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 12 is: 1.123
> Kabsch RMSD of heavy atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 13 is: 1.341
> Kabsch RMSD of heavy atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 14 is: 0.833 (*)
> Kabsch RMSD of heavy atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 15 is: 1.326
> Kabsch RMSD of heavy atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 16 is: 1.024
> Kabsch RMSD of heavy atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 17 is: 1.273
> Kabsch RMSD of heavy atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 18 is: 1.261
> Kabsch RMSD of heavy atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 19 is: 1.830
> Kabsch RMSD of heavy atoms in res. M[10..21],M[26..34],M[40..45],M[57..72],M[102..113],M[118..126],M[132..137],M[149..164],for model 20 is: 1.224
>
> Kabsch RMSD statistics for 20 structures:
> Mean RMSD using as refer. str. `average' for res.[10..21],[26..34],[40..45],[57..72],[102..113],[118..126],[132..137],[149..164], is: 1.208
> Range of RMSD values to reference struct. is 0.833 to 1.830
Text report of backbone RMSD for entire protein
> Kabsch RMSD of backb atoms in res. *[1..174],for model 1 is: 3.509
> Kabsch RMSD of backb atoms in res. *[1..174],for model 2 is: 4.214
> Kabsch RMSD of backb atoms in res. *[1..174],for model 3 is: 3.792
> Kabsch RMSD of backb atoms in res. *[1..174],for model 4 is: 2.960 (*)
> Kabsch RMSD of backb atoms in res. *[1..174],for model 5 is: 4.288
> Kabsch RMSD of backb atoms in res. *[1..174],for model 6 is: 4.308
> Kabsch RMSD of backb atoms in res. *[1..174],for model 7 is: 4.125
> Kabsch RMSD of backb atoms in res. *[1..174],for model 8 is: 3.483
> Kabsch RMSD of backb atoms in res. *[1..174],for model 9 is: 4.712
> Kabsch RMSD of backb atoms in res. *[1..174],for model 10 is: 4.690
> Kabsch RMSD of backb atoms in res. *[1..174],for model 11 is: 4.565
> Kabsch RMSD of backb atoms in res. *[1..174],for model 12 is: 3.980
> Kabsch RMSD of backb atoms in res. *[1..174],for model 13 is: 3.742
> Kabsch RMSD of backb atoms in res. *[1..174],for model 14 is: 3.745
> Kabsch RMSD of backb atoms in res. *[1..174],for model 15 is: 2.974
> Kabsch RMSD of backb atoms in res. *[1..174],for model 16 is: 3.208
> Kabsch RMSD of backb atoms in res. *[1..174],for model 17 is: 5.547
> Kabsch RMSD of backb atoms in res. *[1..174],for model 18 is: 6.183
> Kabsch RMSD of backb atoms in res. *[1..174],for model 19 is: 4.387
> Kabsch RMSD of backb atoms in res. *[1..174],for model 20 is: 4.109
>
> Kabsch RMSD statistics for 20 structures:
> Mean RMSD using as refer. str. `average' for res.[1..174], is: 4.126
> Range of RMSD values to reference struct. is 2.960 to 6.183
Text report of heavy atom RMSD for entire protein
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 1 is: 4.043
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 2 is: 4.844
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 3 is: 4.362
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 4 is: 3.571 (*)
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 5 is: 4.785
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 6 is: 4.880
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 7 is: 4.585
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 8 is: 4.150
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 9 is: 5.162
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 10 is: 5.099
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 11 is: 5.264
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 12 is: 4.455
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 13 is: 4.428
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 14 is: 4.294
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 15 is: 3.622
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 16 is: 3.751
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 17 is: 6.189
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 18 is: 6.975
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 19 is: 4.925
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 20 is: 4.658
>
> Kabsch RMSD statistics for 20 structures:
> Mean RMSD using as refer. str. `average' for res.[1..174], is: 4.702
> Range of RMSD values to reference struct. is 3.571 to 6.975
Summary of heavy atom and backbone RMSDs over the whole protein and ordered residues
RMSD Values
all residues ordered residues selected residues
All backbone atoms 4.1 0.9 1.1
All heavy atoms 4.7 1.4 1.5
Contact Map (constraints list and 3D Coordinates)
JPEG image of Contact Map for Constraints
JPEG image of Contact Map for Coordinates
Output from PROCHECK
Ramachandran Plot for all models
Text summary of Ramachandran Plot
+----------<<< P R O C H E C K S U M M A R Y >>>----------+
| |
| SPR104_R3_em_bcr3_020.rin 0.0 1940 residues |
| |
+| Ramachandran plot: 86.3% core 13.7% allow 0.0% gener 0.0% disall |
| |
+| All Ramachandrans: 10 labelled residues (out of1940) |
+| Chi1-chi2 plots: 4 labelled residues (out of1400) |
JPEG image for all model Ramachandran Plot
Residue Properties for all models
JPEG for all model Residue Properties - page $num_n
JPEG for all model Residue Properties - page $num_n
Model Secondary Structures from Procheck
JPEG for Model Secondary Structures - page $num_n
JPEG for Model Secondary Structures - page $num_n
JPEG for Model Secondary Structures - page $num_n
JPEG for Model Secondary Structures - page $num_n
JPEG for Model Secondary Structures - page $num_n
JPEG for Model Secondary Structures - page $num_n
Ramachandran Plots for each residue
JPEG for residue Ramachandran Plots - page $num_n
JPEG for residue Ramachandran Plots - page $num_n
JPEG for residue Ramachandran Plots - page $num_n
JPEG for residue Ramachandran Plots - page $num_n
JPEG for residue Ramachandran Plots - page $num_n
Ramachandran analysis for each residue from Molprobity
Chi1-Chi2 Plots for each residue
JPEG for residue Chi1-Chi2 Plots - page $num_n
JPEG for residue Chi1-Chi2 Plots - page $num_n
JPEG for residue Chi1-Chi2 Plots - page $num_n
JPEG for residue Chi1-Chi2 Plots - page $num_n
Procheck G-factors for phi-psi for each residue
JPEG image for residue phi-psi G-factors
Table of Procheck G-factors for phi-psi for ordered residues
#phipsi_gfactor
#Residue\Model average
8 -0.58
9 -0.37
10 -1.01
11 -0.59
12 -1.70
13 -1.14
14 -0.24
15 -2.11
16 -1.86
17 0.21
18 -1.48
19 -2.05
20 -0.99
21 -0.63
25 -1.42
26 -0.09
27 -0.43
28 -1.38
29 0.30
30 -0.52
31 -0.44
32 0.38
33 -0.46
34 -0.88
40 -0.80
41 -0.52
42 -0.81
43 -0.51
44 -0.61
45 -1.38
46 -0.66
57 -0.75
58 0.12
59 -0.37
61 0.48
62 -0.89
63 0.87
64 1.02
65 0.90
66 0.95
67 0.34
68 0.77
69 0.86
70 0.55
71 0.13
72 0.23
73 -1.10
100 -0.58
101 -0.37
102 -1.01
103 -0.59
104 -1.64
105 -1.14
106 -0.24
107 -2.11
108 -1.82
109 0.21
110 -1.51
111 -2.05
112 -1.00
113 -0.63
117 -1.41
118 -0.09
119 -0.43
120 -1.38
121 0.30
122 -0.52
123 -0.45
124 0.38
125 -0.46
126 -0.88
132 -0.80
133 -0.52
134 -0.79
135 -0.51
136 -0.60
137 -1.38
138 -0.67
139 -0.33
149 -0.75
150 0.12
151 -0.37
152 -0.94
153 0.48
154 -0.89
155 0.87
156 1.02
157 0.90
158 0.95
159 0.34
160 0.77
161 0.86
162 0.55
163 0.13
164 0.20
165 -1.10
#Reported_Model_Average -0.443
#Overall_Average_Reported -0.443
Procheck G-factors for all dihedral angles for each residue
JPEG image for residue all dihedral G-factors
Table of Procheck G-factors for all dihedrals for ordered residues
#alldih_gfactor
#Residue\Model average
8 -0.02
9 -0.42
10 -0.05
11 0.11
12 -0.64
13 -0.20
14 0.31
15 -0.67
16 -1.30
17 0.37
18 -0.31
19 -0.98
20 -0.06
21 -0.14
25 -0.70
26 0.27
27 0.25
28 -0.61
29 0.48
30 -0.38
31 0.21
32 0.46
33 -0.30
34 -0.24
40 0.12
41 -0.01
42 -0.57
43 0.08
44 -0.09
45 -1.38
46 -0.14
57 -0.57
58 0.34
59 0.16
61 0.66
62 0.11
63 0.80
64 0.67
65 0.77
66 0.85
67 0.28
68 0.67
69 0.92
70 0.55
71 -0.56
72 0.28
73 -1.10
100 0.00
101 -0.42
102 -0.05
103 0.11
104 -0.62
105 -0.20
106 0.31
107 -0.67
108 -1.28
109 0.38
110 -0.33
111 -1.00
112 -0.07
113 -0.14
117 -0.70
118 0.32
119 0.25
120 -0.61
121 0.48
122 -0.38
123 0.21
124 0.43
125 -0.13
126 -0.24
132 0.12
133 -0.02
134 -0.56
135 0.08
136 -0.09
137 -1.38
138 -0.14
139 0.05
149 -0.57
150 0.27
151 0.16
152 -0.33
153 0.67
154 0.11
155 0.80
156 0.69
157 0.77
158 0.86
159 0.28
160 0.68
161 0.92
162 0.55
163 -0.56
164 0.27
165 -1.10
#Reported_Model_Average -0.037
#Overall_Average_Reported -0.037
Output from Verify3D
Verify3D Score over a window of $winsize_s residues
JPEG image for Verify3D Score
Table of Verify3D scores for ordered residues across all models
#verify3d
#Residue\Model 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20
8 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08
9 1.04 -1.29 -0.84 -0.84 1.04 1.04 0.71 0.71 1.04 0.71 1.04 -0.84 -0.84 -0.84 -0.84 1.04 -0.84 0.71 -0.84 0.71
10 0.04 0.04 0.04 0.04 -0.59 0.04 0.04 0.28 0.04 0.04 0.04 0.04 0.28 0.04 0.04 0.28 0.28 0.28 0.28 0.04
11 -0.54 -0.94 -0.94 -0.94 -0.94 -0.94 -0.28 0.81 0.81 -0.94 0.81 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.54 -0.94 -0.54
12 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28
13 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.04 0.28 0.28 0.28 0.28 0.28 0.28 0.04 0.28
14 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20
15 1.06 1.06 1.06 0.77 1.06 1.06 1.06 0.77 1.06 1.06 0.77 1.06 1.06 1.06 0.77 1.06 1.06 1.06 0.77 0.77
16 0.77 1.06 -0.68 0.77 1.06 0.77 0.29 -0.68 1.06 1.06 0.77 0.77 0.77 0.77 0.77 0.77 -0.68 0.77 0.29 0.77
17 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08
18 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06
19 0.17 0.17 0.17 0.34 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.59 0.34 0.17 0.17 0.59 0.34 0.17 0.17
20 0.04 0.28 0.28 0.28 0.28 0.28 0.28 0.04 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28
21 -0.26 0.51 0.51 -0.26 0.51 0.51 0.51 -0.56 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.41 -0.26 0.51
25 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 0.96 1.12 1.62 1.12 1.12 1.12 1.12 1.12
26 0.08 0.55 0.55 0.08 0.08 0.08 0.08 0.08 0.55 0.08 0.08 0.55 0.55 0.55 0.08 0.08 0.55 0.08 0.08 0.08
27 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08
28 -0.46 -0.46 0.28 -0.46 -0.46 -0.59 0.28 -0.46 -1.13 -0.46 -0.46 0.28 0.28 0.28 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46
29 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93
30 -2.61 -0.26 -0.56 -0.56 -2.61 -0.56 -0.56 -0.56 -2.61 -0.56 -0.56 -0.26 -0.56 -0.56 -0.56 -0.56 -0.56 -2.61 -0.56 -0.56
31 0.71 -0.44 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71
32 0.66 0.66 0.66 0.66 1.00 0.66 0.66 0.66 0.66 0.66 0.66 -0.40 0.66 -0.40 0.66 1.00 -0.40 0.66 0.66 0.66
33 0.17 0.17 0.17 0.59 0.17 0.17 0.17 0.17 0.17 0.17 0.59 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.59
34 0.71 1.04 0.71 1.04 0.71 0.71 0.71 0.71 0.71 1.40 0.71 1.40 1.40 1.04 0.71 1.04 1.04 1.04 0.71 1.04
40 0.47 -0.72 0.47 0.47 0.47 0.47 -0.72 0.47 0.47 0.08 0.47 0.08 0.08 -0.72 0.47 -2.12 0.47 0.47 -0.72 0.08
41 1.04 1.40 1.04 1.40 1.40 1.04 1.04 1.04 1.04 1.40 1.04 1.04 1.40 1.40 1.04 1.04 1.04 1.04 1.40 1.40
42 -0.83 0.34 0.34 -0.83 -0.83 -0.83 0.34 0.34 -0.83 0.51 -0.83 0.34 -0.83 0.34 -0.83 0.34 0.51 -1.97 0.34 -0.83
43 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93
44 0.71 0.71 0.24 0.71 -0.44 -0.44 0.71 0.71 -0.44 -0.44 0.71 0.71 0.71 0.71 0.71 -0.44 0.71 0.71 0.71 0.71
45 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49
46 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.62 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12
57 0.81 0.93 0.93 0.81 0.93 0.81 0.93 0.81 0.81 0.93 0.81 0.81 0.93 0.81 0.81 0.93 0.93 0.81 0.93 0.93
58 0.08 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.08 0.55 0.55 0.55 0.55 0.08 0.55 0.55 0.55
59 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06
60 0.59 0.59 0.59 0.17 0.59 0.59 0.17 0.59 0.17 0.17 0.59 0.59 0.59 0.59 0.17 0.59 0.59 0.17 0.59 0.59
61 0.51 0.51 0.51 0.51 0.51 0.51 0.41 0.51 -0.26 0.51 0.51 0.51 0.51 0.51 0.41 -0.56 0.51 0.51 -0.26 0.51
62 0.04 0.04 0.04 0.04 0.04 0.04 0.28 0.04 0.04 0.28 0.04 0.28 0.04 0.28 0.28 0.28 0.04 0.04 0.04 0.28
63 -0.46 -0.46 -0.46 -1.13 -0.46 -0.46 -1.13 -0.46 -1.13 -0.46 -1.13 -0.46 -0.46 -1.13 -1.13 -0.46 -0.46 -1.13 -0.46 -0.46
64 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40
65 0.25 0.25 0.25 0.25 -0.57 -0.57 -0.57 0.10 0.25 0.10 -0.57 0.10 0.25 0.10 0.25 0.10 0.25 0.25 0.25 -0.87
66 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08
67 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91
68 1.00 1.00 1.00 1.00 1.00 0.66 0.66 1.00 0.66 0.66 1.00 0.66 1.00 1.00 0.66 1.00 0.66 1.00 0.66 -0.40
69 0.51 0.51 0.51 0.34 0.51 -0.83 -1.97 0.34 0.51 0.51 0.51 0.51 0.34 0.51 0.23 0.51 0.51 0.23 0.51 0.51
70 0.14 0.14 0.49 0.14 0.49 0.49 0.49 0.49 0.49 0.14 0.14 0.14 -0.25 0.14 0.49 0.49 0.49 0.14 0.49 0.49
71 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40
72 0.08 0.47 0.47 0.08 0.08 0.08 0.08 0.47 0.47 0.08 0.08 0.47 0.08 0.47 0.47 0.08 0.47 0.47 0.08 0.08
73 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10
100 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08
101 1.04 0.71 -0.84 -1.29 1.04 1.04 0.71 0.71 1.04 0.71 1.04 -0.84 -0.84 -0.84 0.71 0.71 -1.29 0.71 -0.84 0.71
102 0.04 0.28 0.04 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.04 0.28 0.28 0.04 0.04 0.28 0.28 0.28 0.28 0.04
103 0.81 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 0.81 0.81 -0.94 0.81 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.54 -0.94 -0.54
104 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28
105 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28
106 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20
107 1.06 1.06 1.06 1.06 1.06 1.06 1.06 0.77 1.06 1.06 0.77 1.06 1.06 1.06 0.77 1.06 1.06 1.06 0.77 0.77
108 0.77 1.06 -0.68 0.77 1.06 0.77 0.29 -0.68 1.06 1.06 0.29 0.29 0.77 1.06 1.06 0.77 -0.68 0.77 0.77 0.77
109 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08
110 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06
111 0.17 0.17 0.17 0.34 0.17 0.17 0.17 0.17 0.34 0.17 0.17 0.17 0.59 0.34 0.17 0.17 0.59 0.34 0.17 0.17
112 0.04 0.28 0.28 0.28 0.28 0.28 0.28 0.04 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28
113 -0.26 0.51 0.51 -0.26 0.51 0.51 0.51 -0.26 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.41 -0.26 0.51
117 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 0.96 1.12 1.12 1.12 1.12 1.12 1.12 1.12
118 0.08 0.55 0.55 0.08 0.08 0.08 0.08 0.08 0.55 0.08 0.08 0.55 0.55 0.55 0.08 0.08 0.55 0.08 0.08 0.08
119 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08
120 -0.46 -0.46 0.28 -0.46 -0.46 -0.59 0.28 -0.46 -1.13 -0.46 -0.46 0.28 0.28 -0.46 -0.46 -0.46 -0.46 -1.13 -0.46 -0.46
121 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93
122 -2.61 -0.26 -0.56 -0.56 -2.61 -2.61 -0.56 -0.56 -0.56 -0.56 -0.56 -0.26 -0.56 -0.56 -0.56 -0.56 -0.56 -2.61 -0.56 -0.56
123 0.71 -0.44 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71
124 0.66 0.66 0.66 0.66 0.66 -0.40 0.66 0.66 0.66 0.66 0.66 -0.40 0.66 -0.40 0.66 1.00 0.66 0.66 0.66 0.66
125 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.59 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.59
126 0.71 1.04 1.04 1.04 0.71 0.71 0.71 0.71 0.71 1.40 0.71 1.04 1.40 1.04 0.71 1.04 1.04 1.04 0.71 1.04
132 0.47 -0.72 0.47 0.47 0.47 0.47 0.47 0.47 0.47 0.08 0.47 0.08 0.08 -0.72 0.47 0.08 0.47 0.47 -0.72 0.08
133 1.40 1.40 1.40 1.40 1.40 1.40 1.04 1.04 1.04 1.40 1.40 1.40 1.40 1.40 1.40 1.04 1.40 1.40 1.40 1.40
134 -0.83 0.34 0.51 -1.97 -0.83 -0.83 0.51 0.34 -0.83 -0.83 -0.83 0.51 -1.97 -0.83 0.34 0.34 0.51 -1.97 0.34 -0.83
135 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93
136 0.71 0.71 0.24 0.71 -0.44 -0.44 0.71 0.71 -0.44 0.71 0.71 0.71 0.71 0.71 0.71 -0.44 0.71 0.71 0.71 0.71
137 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49
138 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.62 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12
139 0.17 0.59 0.59 0.59 0.59 0.59 0.59 0.17 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59
149 0.81 0.81 0.93 0.81 0.93 0.93 0.93 0.81 0.81 0.81 0.81 0.81 0.93 0.81 0.81 0.81 0.93 0.81 0.93 0.93
150 0.08 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.08 0.55 0.55 0.08 0.55 0.55 0.55 0.55 0.08 0.55 0.55 0.55
151 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06
152 0.59 0.59 0.59 0.17 0.59 0.59 0.17 0.59 0.34 0.59 0.59 0.59 0.59 0.59 0.17 0.17 0.59 0.17 0.59 0.59
153 0.51 0.51 0.51 0.51 0.51 0.51 0.41 0.51 0.41 -0.26 0.51 0.51 -0.26 0.51 0.41 -0.56 0.51 0.51 -0.26 0.51
154 0.04 0.04 0.04 0.28 0.04 0.04 0.28 0.04 0.04 0.28 0.04 0.28 0.04 0.28 0.28 0.28 0.04 0.04 0.04 0.28
155 -0.46 -0.46 -0.46 -1.13 -0.46 -0.46 -1.13 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -1.13 -0.46 -0.46
156 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40
157 0.25 0.25 0.25 0.25 0.10 -0.57 -0.57 0.10 0.25 0.10 -0.57 0.10 -0.57 0.10 0.25 0.10 0.25 0.25 0.25 -0.87
158 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08
159 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91
160 1.00 0.66 1.00 0.66 1.00 0.66 1.00 1.00 0.66 0.66 1.00 0.66 1.00 0.66 0.66 1.00 0.66 1.00 1.00 0.66
161 0.51 0.23 0.51 0.34 0.51 -0.83 -1.97 0.34 0.51 0.51 0.51 0.51 0.34 0.51 0.23 0.51 0.51 0.23 0.51 0.51
162 0.14 0.14 0.49 0.14 -0.25 0.49 0.49 0.49 0.49 0.14 0.14 0.14 -0.25 0.14 0.49 0.49 0.49 0.14 0.49 0.49
163 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40
164 0.08 0.47 0.47 0.08 0.08 0.08 0.08 0.47 0.47 0.08 0.08 0.47 0.08 0.47 0.47 0.08 0.08 0.47 0.08 0.47
165 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10
#Reported_Model_Average 0.414 0.455 0.462 0.388 0.404 0.369 0.405 0.468 0.443 0.466 0.489 0.456 0.438 0.429 0.450 0.434 0.439 0.390 0.399 0.453
#Overall_Average_Reported 0.433
Output from ProsaII
ProsaII Score over a window of $winsize_s residues
JPEG image for ProsaII Score
Table of Verify3D scores for ordered residues across all models
#verify3d
#Residue\Model 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20
8 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08
9 1.04 -1.29 -0.84 -0.84 1.04 1.04 0.71 0.71 1.04 0.71 1.04 -0.84 -0.84 -0.84 -0.84 1.04 -0.84 0.71 -0.84 0.71
10 0.04 0.04 0.04 0.04 -0.59 0.04 0.04 0.28 0.04 0.04 0.04 0.04 0.28 0.04 0.04 0.28 0.28 0.28 0.28 0.04
11 -0.54 -0.94 -0.94 -0.94 -0.94 -0.94 -0.28 0.81 0.81 -0.94 0.81 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.54 -0.94 -0.54
12 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28
13 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.04 0.28 0.28 0.28 0.28 0.28 0.28 0.04 0.28
14 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20
15 1.06 1.06 1.06 0.77 1.06 1.06 1.06 0.77 1.06 1.06 0.77 1.06 1.06 1.06 0.77 1.06 1.06 1.06 0.77 0.77
16 0.77 1.06 -0.68 0.77 1.06 0.77 0.29 -0.68 1.06 1.06 0.77 0.77 0.77 0.77 0.77 0.77 -0.68 0.77 0.29 0.77
17 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08
18 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06
19 0.17 0.17 0.17 0.34 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.59 0.34 0.17 0.17 0.59 0.34 0.17 0.17
20 0.04 0.28 0.28 0.28 0.28 0.28 0.28 0.04 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28
21 -0.26 0.51 0.51 -0.26 0.51 0.51 0.51 -0.56 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.41 -0.26 0.51
25 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 0.96 1.12 1.62 1.12 1.12 1.12 1.12 1.12
26 0.08 0.55 0.55 0.08 0.08 0.08 0.08 0.08 0.55 0.08 0.08 0.55 0.55 0.55 0.08 0.08 0.55 0.08 0.08 0.08
27 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08
28 -0.46 -0.46 0.28 -0.46 -0.46 -0.59 0.28 -0.46 -1.13 -0.46 -0.46 0.28 0.28 0.28 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46
29 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93
30 -2.61 -0.26 -0.56 -0.56 -2.61 -0.56 -0.56 -0.56 -2.61 -0.56 -0.56 -0.26 -0.56 -0.56 -0.56 -0.56 -0.56 -2.61 -0.56 -0.56
31 0.71 -0.44 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71
32 0.66 0.66 0.66 0.66 1.00 0.66 0.66 0.66 0.66 0.66 0.66 -0.40 0.66 -0.40 0.66 1.00 -0.40 0.66 0.66 0.66
33 0.17 0.17 0.17 0.59 0.17 0.17 0.17 0.17 0.17 0.17 0.59 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.59
34 0.71 1.04 0.71 1.04 0.71 0.71 0.71 0.71 0.71 1.40 0.71 1.40 1.40 1.04 0.71 1.04 1.04 1.04 0.71 1.04
40 0.47 -0.72 0.47 0.47 0.47 0.47 -0.72 0.47 0.47 0.08 0.47 0.08 0.08 -0.72 0.47 -2.12 0.47 0.47 -0.72 0.08
41 1.04 1.40 1.04 1.40 1.40 1.04 1.04 1.04 1.04 1.40 1.04 1.04 1.40 1.40 1.04 1.04 1.04 1.04 1.40 1.40
42 -0.83 0.34 0.34 -0.83 -0.83 -0.83 0.34 0.34 -0.83 0.51 -0.83 0.34 -0.83 0.34 -0.83 0.34 0.51 -1.97 0.34 -0.83
43 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93
44 0.71 0.71 0.24 0.71 -0.44 -0.44 0.71 0.71 -0.44 -0.44 0.71 0.71 0.71 0.71 0.71 -0.44 0.71 0.71 0.71 0.71
45 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49
46 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.62 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12
57 0.81 0.93 0.93 0.81 0.93 0.81 0.93 0.81 0.81 0.93 0.81 0.81 0.93 0.81 0.81 0.93 0.93 0.81 0.93 0.93
58 0.08 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.08 0.55 0.55 0.55 0.55 0.08 0.55 0.55 0.55
59 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06
60 0.59 0.59 0.59 0.17 0.59 0.59 0.17 0.59 0.17 0.17 0.59 0.59 0.59 0.59 0.17 0.59 0.59 0.17 0.59 0.59
61 0.51 0.51 0.51 0.51 0.51 0.51 0.41 0.51 -0.26 0.51 0.51 0.51 0.51 0.51 0.41 -0.56 0.51 0.51 -0.26 0.51
62 0.04 0.04 0.04 0.04 0.04 0.04 0.28 0.04 0.04 0.28 0.04 0.28 0.04 0.28 0.28 0.28 0.04 0.04 0.04 0.28
63 -0.46 -0.46 -0.46 -1.13 -0.46 -0.46 -1.13 -0.46 -1.13 -0.46 -1.13 -0.46 -0.46 -1.13 -1.13 -0.46 -0.46 -1.13 -0.46 -0.46
64 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40
65 0.25 0.25 0.25 0.25 -0.57 -0.57 -0.57 0.10 0.25 0.10 -0.57 0.10 0.25 0.10 0.25 0.10 0.25 0.25 0.25 -0.87
66 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08
67 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91
68 1.00 1.00 1.00 1.00 1.00 0.66 0.66 1.00 0.66 0.66 1.00 0.66 1.00 1.00 0.66 1.00 0.66 1.00 0.66 -0.40
69 0.51 0.51 0.51 0.34 0.51 -0.83 -1.97 0.34 0.51 0.51 0.51 0.51 0.34 0.51 0.23 0.51 0.51 0.23 0.51 0.51
70 0.14 0.14 0.49 0.14 0.49 0.49 0.49 0.49 0.49 0.14 0.14 0.14 -0.25 0.14 0.49 0.49 0.49 0.14 0.49 0.49
71 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40
72 0.08 0.47 0.47 0.08 0.08 0.08 0.08 0.47 0.47 0.08 0.08 0.47 0.08 0.47 0.47 0.08 0.47 0.47 0.08 0.08
73 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10
100 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08
101 1.04 0.71 -0.84 -1.29 1.04 1.04 0.71 0.71 1.04 0.71 1.04 -0.84 -0.84 -0.84 0.71 0.71 -1.29 0.71 -0.84 0.71
102 0.04 0.28 0.04 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.04 0.28 0.28 0.04 0.04 0.28 0.28 0.28 0.28 0.04
103 0.81 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 0.81 0.81 -0.94 0.81 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.54 -0.94 -0.54
104 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28
105 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28
106 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20
107 1.06 1.06 1.06 1.06 1.06 1.06 1.06 0.77 1.06 1.06 0.77 1.06 1.06 1.06 0.77 1.06 1.06 1.06 0.77 0.77
108 0.77 1.06 -0.68 0.77 1.06 0.77 0.29 -0.68 1.06 1.06 0.29 0.29 0.77 1.06 1.06 0.77 -0.68 0.77 0.77 0.77
109 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08
110 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06
111 0.17 0.17 0.17 0.34 0.17 0.17 0.17 0.17 0.34 0.17 0.17 0.17 0.59 0.34 0.17 0.17 0.59 0.34 0.17 0.17
112 0.04 0.28 0.28 0.28 0.28 0.28 0.28 0.04 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28
113 -0.26 0.51 0.51 -0.26 0.51 0.51 0.51 -0.26 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.41 -0.26 0.51
117 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 0.96 1.12 1.12 1.12 1.12 1.12 1.12 1.12
118 0.08 0.55 0.55 0.08 0.08 0.08 0.08 0.08 0.55 0.08 0.08 0.55 0.55 0.55 0.08 0.08 0.55 0.08 0.08 0.08
119 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08
120 -0.46 -0.46 0.28 -0.46 -0.46 -0.59 0.28 -0.46 -1.13 -0.46 -0.46 0.28 0.28 -0.46 -0.46 -0.46 -0.46 -1.13 -0.46 -0.46
121 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93
122 -2.61 -0.26 -0.56 -0.56 -2.61 -2.61 -0.56 -0.56 -0.56 -0.56 -0.56 -0.26 -0.56 -0.56 -0.56 -0.56 -0.56 -2.61 -0.56 -0.56
123 0.71 -0.44 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71 0.71
124 0.66 0.66 0.66 0.66 0.66 -0.40 0.66 0.66 0.66 0.66 0.66 -0.40 0.66 -0.40 0.66 1.00 0.66 0.66 0.66 0.66
125 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.59 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.59
126 0.71 1.04 1.04 1.04 0.71 0.71 0.71 0.71 0.71 1.40 0.71 1.04 1.40 1.04 0.71 1.04 1.04 1.04 0.71 1.04
132 0.47 -0.72 0.47 0.47 0.47 0.47 0.47 0.47 0.47 0.08 0.47 0.08 0.08 -0.72 0.47 0.08 0.47 0.47 -0.72 0.08
133 1.40 1.40 1.40 1.40 1.40 1.40 1.04 1.04 1.04 1.40 1.40 1.40 1.40 1.40 1.40 1.04 1.40 1.40 1.40 1.40
134 -0.83 0.34 0.51 -1.97 -0.83 -0.83 0.51 0.34 -0.83 -0.83 -0.83 0.51 -1.97 -0.83 0.34 0.34 0.51 -1.97 0.34 -0.83
135 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93 0.93
136 0.71 0.71 0.24 0.71 -0.44 -0.44 0.71 0.71 -0.44 0.71 0.71 0.71 0.71 0.71 0.71 -0.44 0.71 0.71 0.71 0.71
137 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49
138 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.62 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12 1.12
139 0.17 0.59 0.59 0.59 0.59 0.59 0.59 0.17 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59
149 0.81 0.81 0.93 0.81 0.93 0.93 0.93 0.81 0.81 0.81 0.81 0.81 0.93 0.81 0.81 0.81 0.93 0.81 0.93 0.93
150 0.08 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.08 0.55 0.55 0.08 0.55 0.55 0.55 0.55 0.08 0.55 0.55 0.55
151 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06 1.06
152 0.59 0.59 0.59 0.17 0.59 0.59 0.17 0.59 0.34 0.59 0.59 0.59 0.59 0.59 0.17 0.17 0.59 0.17 0.59 0.59
153 0.51 0.51 0.51 0.51 0.51 0.51 0.41 0.51 0.41 -0.26 0.51 0.51 -0.26 0.51 0.41 -0.56 0.51 0.51 -0.26 0.51
154 0.04 0.04 0.04 0.28 0.04 0.04 0.28 0.04 0.04 0.28 0.04 0.28 0.04 0.28 0.28 0.28 0.04 0.04 0.04 0.28
155 -0.46 -0.46 -0.46 -1.13 -0.46 -0.46 -1.13 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -1.13 -0.46 -0.46
156 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40
157 0.25 0.25 0.25 0.25 0.10 -0.57 -0.57 0.10 0.25 0.10 -0.57 0.10 -0.57 0.10 0.25 0.10 0.25 0.25 0.25 -0.87
158 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08
159 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91 0.91
160 1.00 0.66 1.00 0.66 1.00 0.66 1.00 1.00 0.66 0.66 1.00 0.66 1.00 0.66 0.66 1.00 0.66 1.00 1.00 0.66
161 0.51 0.23 0.51 0.34 0.51 -0.83 -1.97 0.34 0.51 0.51 0.51 0.51 0.34 0.51 0.23 0.51 0.51 0.23 0.51 0.51
162 0.14 0.14 0.49 0.14 -0.25 0.49 0.49 0.49 0.49 0.14 0.14 0.14 -0.25 0.14 0.49 0.49 0.49 0.14 0.49 0.49
163 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40 1.40
164 0.08 0.47 0.47 0.08 0.08 0.08 0.08 0.47 0.47 0.08 0.08 0.47 0.08 0.47 0.47 0.08 0.08 0.47 0.08 0.47
165 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10 1.10
#Reported_Model_Average 0.414 0.455 0.462 0.388 0.404 0.369 0.405 0.468 0.443 0.466 0.489 0.456 0.438 0.429 0.450 0.434 0.439 0.390 0.399 0.453
#Overall_Average_Reported 0.433
Output from MolProbity
VdW violations from MAGE
JPEG image for MAGE VdW violation
Table of MAGE VdW violations for ordered residues across all models
#mage_clash
#Residue\Model 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20
8.000 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0
9.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 0 0 0 0
10.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
11.000 0 0 0 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0
12.000 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
13.000 1 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0
14.000 0 0 0 0 0 0 0 0 0 0 2 1 2 0 0 0 0 0 0 1
15.000 0 0 0 0 0 0 1 1 0 0 0 1 1 0 0 0 0 0 0 0
16.000 2 2 0 0 2 0 1 0 0 2 0 1 0 6 4 0 0 4 0 2
17.000 2 1 1 0 1 0 0 2 1 0 0 0 1 0 0 0 0 1 0 0
18.000 1 1 0 0 0 0 1 0 0 1 0 0 0 0 2 0 2 0 0 0
19.000 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
20.000 0 0 0 0 1 1 0 0 0 0 1 0 0 0 0 1 0 0 0 0
21.000 0 0 0 0 0 0 0 0 1 0 0 1 0 1 0 1 0 0 0 1
25.000 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 1
26.000 0 1 0 0 1 1 0 0 0 0 1 1 0 0 0 1 0 0 0 0
27.000 1 0 0 1 0 0 1 1 0 0 0 1 0 0 0 0 0 1 0 1
28.000 2 2 1 0 1 0 0 2 1 0 0 0 1 0 1 0 0 1 0 0
29.000 0 0 0 0 1 1 1 2 1 1 0 1 0 0 1 0 0 1 0 1
30.000 0 0 0 0 0 1 0 0 0 0 2 1 2 0 0 0 0 0 0 1
31.000 1 0 0 0 0 0 1 0 0 0 0 1 1 0 0 1 1 0 1 0
32.000 0 0 0 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0
33.000 0 0 0 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0
34.000 0 0 0 0 0 0 3 0 0 0 0 0 1 1 0 0 0 0 1 0
40.000 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
41.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
42.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
43.000 1 0 0 0 1 1 1 1 1 1 0 2 0 0 1 0 0 2 0 1
44.000 1 0 0 0 2 0 0 0 1 0 0 0 0 0 0 0 0 0 0 1
45.000 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 1 0 1
46.000 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0
57.000 0 0 0 1 0 0 1 0 2 0 1 2 0 0 1 0 0 1 0 1
58.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
59.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
60.000 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
61.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
62.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
63.000 1 0 0 0 0 0 4 0 0 0 0 0 0 0 1 0 0 0 0 0
64.000 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0
65.000 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0
66.000 1 1 0 0 0 0 1 0 0 1 0 1 0 0 0 0 1 0 0 0
67.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0
68.000 0 1 0 0 0 1 0 0 1 0 0 0 0 0 2 0 0 0 1 0
69.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
70.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0
71.000 4 6 0 0 2 0 0 1 0 0 0 1 0 0 1 0 4 0 3 1
72.000 1 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
73.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
100.000 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0
101.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 0 0 0 0
102.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
103.000 0 0 0 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0
104.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
105.000 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0
106.000 0 0 0 0 0 0 0 0 0 0 2 1 2 0 0 0 0 0 0 1
107.000 0 0 0 0 0 0 1 1 0 0 0 1 1 0 0 0 0 0 0 0
108.000 2 2 0 0 2 0 1 0 0 2 0 1 0 6 4 0 0 4 0 2
109.000 2 0 1 0 1 0 0 2 1 0 0 0 1 0 0 0 0 1 0 0
110.000 1 1 0 0 0 0 1 0 0 1 0 0 0 0 2 0 2 0 0 0
111.000 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
112.000 0 0 0 0 1 1 0 0 0 0 1 0 0 0 0 1 0 0 0 0
113.000 0 0 0 0 0 0 0 0 1 0 0 1 0 1 0 1 0 0 0 1
117.000 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 1
118.000 0 1 0 0 1 1 0 0 0 0 1 1 0 0 0 1 0 0 0 0
119.000 1 0 0 1 0 0 1 1 0 0 0 1 0 0 0 0 0 1 0 1
120.000 2 1 1 0 1 0 0 2 1 0 0 0 1 0 1 0 0 1 0 0
121.000 0 0 0 0 1 2 1 2 2 1 0 1 0 0 1 1 0 1 0 2
122.000 0 0 0 0 0 1 0 0 0 0 2 1 2 0 0 0 0 0 0 1
123.000 0 0 0 0 0 0 1 0 0 0 0 1 1 0 0 1 0 0 1 0
124.000 0 0 0 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0
125.000 1 0 0 1 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0
126.000 0 0 0 0 0 0 3 0 0 0 1 0 1 1 0 0 0 0 1 0
132.000 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
133.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
134.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
135.000 0 0 0 0 1 2 1 1 2 1 0 2 0 0 1 1 0 2 0 2
136.000 1 0 0 0 2 0 0 1 1 0 0 0 0 0 0 0 0 0 0 1
137.000 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 1 0 1
138.000 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0
139.000 2 0 1 0 0 0 1 2 0 0 1 0 0 0 0 1 0 0 1 0
149.000 1 0 0 1 0 0 1 0 2 0 1 2 0 0 0 0 0 1 0 1
150.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
151.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
152.000 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
153.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
154.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
155.000 1 0 0 0 0 0 2 0 0 0 0 0 0 0 1 0 0 0 0 0
156.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
157.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
158.000 1 1 0 0 0 0 1 0 0 1 0 1 0 0 0 0 1 0 0 0
159.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0
160.000 0 1 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 1 0
161.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
162.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0
163.000 4 6 0 0 2 0 0 1 0 2 0 1 0 0 1 0 4 0 3 1
164.000 1 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
165.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
#Reported_Model_Average 0.485 0.289 0.072 0.124 0.309 0.165 0.330 0.258 0.227 0.165 0.165 0.371 0.186 0.206 0.309 0.196 0.227 0.247 0.134 0.289
#Overall_Average_Reported 0.238
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 16 LEU 2HD1 :M 16 LEU C : -0.540: 0
: 2613:M 108 LEU 2HD1 :M 108 LEU C : -0.539: 0
: 2613:M 38 PRO CD :M 37 ALA N : -0.526: 0
: 2613:M 66 THR 1HG2 :M 110 LEU HA : -0.514: 0
: 2613:M 130 PRO CD :M 129 ALA N : -0.510: 0
: 2613:M 120 GLU CB :M 109 THR HA : -0.507: 0
: 2613:M 109 THR HA :M 120 GLU 2HB : -0.425: 0
: 2613:M 28 GLU CB :M 17 THR HA : -0.503: 0
: 2613:M 28 GLU 2HB :M 17 THR HA : -0.415: 0
: 2613:M 71 PHE N :M 71 PHE CD1 : -0.500: 0
: 2613:M 71 PHE HD1 :M 71 PHE N : -0.454: 0
: 2613:M 18 LEU HA :M 158 THR 1HG2 : -0.495: 0
: 2613:M 47 SER 1HB :M 48 PRO 2HD : -0.490: 0
: 2613:M 47 SER 1HB :M 48 PRO CD : -0.480: 0
: 2613:M 163 PHE N :M 163 PHE CD1 : -0.486: 0
: 2613:M 140 PRO 2HD :M 139 SER 1HB : -0.486: 0
: 2613:M 140 PRO CD :M 139 SER 1HB : -0.470: 0
: 2613:M 163 PHE HD1 :M 163 PHE N : -0.441: 0
: 2613:M 44 ARG HA :M 56 GLY 2HA : -0.471: 0
: 2613:M 148 GLY 2HA :M 136 ARG HA : -0.458: 0
: 2613:M 63 GLU 1HG :M 111 SER 1HB : -0.428: 0
: 2613:M 72 LYS HA :M 164 LYS HA : -0.425: 0
: 2613:M 19 SER 1HB :M 155 GLU 1HG : -0.423: 0
: 2613:M 40 LYS 2HD :M 60 SER HA : -0.412: 0
: 2613:M 166 ASN O :M 167 LEU 1HB : -0.412: 0
: 2613:M 152 SER HA :M 132 LYS 2HD : -0.412: 0
: 2613:M 131 ALA HA :M 125 SER HA : -0.409: 0
: 2613:M 45 ALA 2HB :M 27 LYS 1HG : -0.408: 0
: 2613:M 75 LEU 1HB :M 74 ASN O : -0.408: 0
: 2613:M 137 ALA 2HB :M 119 LYS 1HG : -0.403: 0
: 2613:M 149 ILE 1HG2 :M 43 ILE 2HG2 : -0.401: 0
: 2613:M 13 GLU 1HB :M 31 ARG 1HB : -0.400: 0
#sum2 ::12.25 clashscore : 12.25 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:296101 potential dots:18510.0 A^2:32 bumps:32 bumps B<40:872.8 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 16 LEU 2HD1 :M 16 LEU C : -0.540: 0
: 2613:M 108 LEU 2HD1 :M 108 LEU C : -0.536: 0
: 2613:M 28 GLU 2HG :M 26 THR 2HG2 : -0.492: 0
: 2613:M 17 THR 3HG2 :M 28 GLU 1HG : -0.402: 0
: 2613:M 118 THR 2HG2 :M 120 GLU 2HG : -0.482: 0
: 2613:M 163 PHE N :M 163 PHE CD1 : -0.479: 0
: 2613:M 163 PHE N :M 163 PHE HD1 : -0.474: 0
: 2613:M 168 GLU 2HB :M 167 LEU O : -0.468: 0
: 2613:M 163 PHE HA :M 167 LEU 2HD1 : -0.448: 0
: 2613:M 163 PHE 2HB :M 68 VAL HA : -0.419: 0
: 2613:M 71 PHE N :M 71 PHE CD1 : -0.476: 0
: 2613:M 71 PHE N :M 71 PHE HD1 : -0.475: 0
: 2613:M 76 GLU 2HB :M 75 LEU O : -0.467: 0
: 2613:M 71 PHE HA :M 75 LEU 2HD1 : -0.451: 0
: 2613:M 160 VAL HA :M 71 PHE 2HB : -0.423: 0
: 2613:M 66 THR 1HG2 :M 110 LEU HA : -0.461: 0
: 2613:M 158 THR 1HG2 :M 18 LEU HA : -0.452: 0
#sum2 ::6.51 clashscore : 6.51 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:296061 potential dots:18500.0 A^2:17 bumps:17 bumps B<40:938.6 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 166 ASN O :M 167 LEU 2HB : -0.474: 0
: 2613:M 74 ASN O :M 75 LEU 2HB : -0.471: 0
: 2613:M 130 PRO 1HD :M 129 ALA N : -0.457: 0
: 2613:M 130 PRO 2HD :M 129 ALA 3HB : -0.402: 0
: 2613:M 38 PRO 1HD :M 37 ALA N : -0.446: 0
: 2613:M 139 SER 2HB :M 140 PRO 1HD : -0.440: 0
: 2613:M 17 THR HA :M 28 GLU CB : -0.440: 0
: 2613:M 48 PRO 1HD :M 47 SER 2HB : -0.434: 0
: 2613:M 120 GLU CB :M 109 THR HA : -0.430: 0
: 2613:M 13 GLU 2HG :M 12 GLU 1HG : -0.400: 0
#sum2 ::3.83 clashscore : 3.83 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:295984 potential dots:18500.0 A^2:10 bumps:10 bumps B<40:881.5 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 45 ALA HA :M 27 LYS HA : -0.602: 0
: 2613:M 137 ALA HA :M 119 LYS HA : -0.588: 0
: 2613:M 129 ALA N :M 130 PRO CD : -0.585: 0
: 2613:M 125 SER 2HB :M 129 ALA HA : -0.460: 0
: 2613:M 129 ALA N :M 130 PRO 2HD : -0.446: 0
: 2613:M 38 PRO CD :M 37 ALA N : -0.581: 0
: 2613:M 37 ALA HA :M 33 SER 2HB : -0.457: 0
: 2613:M 37 ALA N :M 38 PRO 2HD : -0.439: 0
: 2613:M 57 ILE HB :M 148 GLY 1HA : -0.456: 0
: 2613:M 11 ILE 1HG1 :M 32 VAL 2HG2 : -0.454: 0
: 2613:M 103 ILE 1HG1 :M 124 VAL 2HG2 : -0.446: 0
: 2613:M 56 GLY 1HA :M 149 ILE HB : -0.441: 0
#sum2 ::4.59 clashscore : 4.59 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:296124 potential dots:18510.0 A^2:12 bumps:12 bumps B<40:938.7 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 16 LEU 2HD1 :M 16 LEU C : -0.504: 0
: 2613:M 108 LEU 2HD1 :M 108 LEU C : -0.498: 0
: 2613:M 164 LYS C :M 164 LYS 1HD : -0.478: 0
: 2613:M 164 LYS O :M 164 LYS 1HD : -0.405: 0
: 2613:M 121 ILE 1HG1 :M 135 ILE 1HG1 : -0.474: 0
: 2613:M 6 GLU O :M 7 PHE 1HB : -0.472: 0
: 2613:M 71 PHE CD1 :M 71 PHE N : -0.467: 0
: 2613:M 72 LYS C :M 72 LYS 1HD : -0.466: 0
: 2613:M 120 GLU CB :M 109 THR HA : -0.464: 0
: 2613:M 163 PHE N :M 163 PHE CD1 : -0.463: 0
: 2613:M 98 GLU O :M 99 PHE 1HB : -0.463: 0
: 2613:M 29 ILE 1HG1 :M 43 ILE 1HG1 : -0.461: 0
: 2613:M 20 GLU HA :M 26 THR HA : -0.461: 0
: 2613:M 17 THR HA :M 28 GLU CB : -0.460: 0
: 2613:M 118 THR HA :M 112 GLU HA : -0.450: 0
: 2613:M 56 GLY 2HA :M 44 ARG 2HB : -0.422: 0
: 2613:M 44 ARG CB :M 56 GLY 2HA : -0.415: 0
: 2613:M 136 ARG CB :M 148 GLY 2HA : -0.410: 0
: 2613:M 136 ARG 2HB :M 148 GLY 2HA : -0.403: 0
#sum2 ::7.27 clashscore : 7.27 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:295850 potential dots:18490.0 A^2:19 bumps:19 bumps B<40:1006 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 30 ASN 1HB :M 13 GLU O : -0.475: 0
: 2613:M 105 GLU O :M 122 ASN 1HB : -0.471: 0
: 2613:M 129 ALA N :M 130 PRO CD : -0.463: 0
: 2613:M 118 THR HA :M 112 GLU HA : -0.459: 0
: 2613:M 20 GLU HA :M 26 THR HA : -0.459: 0
: 2613:M 38 PRO CD :M 37 ALA N : -0.459: 0
: 2613:M 121 ILE 1HG1 :M 135 ILE 1HG1 : -0.458: 0
: 2613:M 135 ILE 3HG2 :M 121 ILE 1HG1 : -0.405: 0
: 2613:M 29 ILE 1HG1 :M 43 ILE 1HG1 : -0.453: 0
: 2613:M 75 LEU 1HB :M 160 VAL 1HG1 : -0.411: 0
: 2613:M 68 VAL 1HG1 :M 167 LEU 1HB : -0.402: 0
#sum2 ::4.21 clashscore : 4.21 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:295937 potential dots:18500.0 A^2:11 bumps:11 bumps B<40:903.5 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 119 LYS 1HD :M 63 GLU 1HG : -0.503: 0
: 2613:M 110 LEU 2HB :M 63 GLU HA : -0.453: 0
: 2613:M 63 GLU OE1 :M 63 GLU N : -0.426: 0
: 2613:M 147 LYS 2HB :M 57 ILE HA : -0.495: 0
: 2613:M 149 ILE HA :M 55 LYS 2HB : -0.493: 0
: 2613:M 155 GLU 1HG :M 27 LYS 1HD : -0.485: 0
: 2613:M 155 GLU HA :M 18 LEU 2HB : -0.442: 0
: 2613:M 37 ALA 3HB :M 34 PHE H : -0.480: 0
: 2613:M 35 ASN CB :M 34 PHE O : -0.451: 0
: 2613:M 34 PHE O :M 35 ASN 2HB : -0.401: 0
: 2613:M 129 ALA 3HB :M 126 PHE H : -0.477: 0
: 2613:M 127 ASN CB :M 126 PHE O : -0.443: 0
: 2613:M 126 PHE O :M 127 ASN 2HB : -0.404: 0
: 2613:M 121 ILE 1HG1 :M 135 ILE 1HG1 : -0.443: 0
: 2613:M 123 ARG 2HG :M 107 LEU 1HD1 : -0.442: 0
: 2613:M 15 LEU 1HD1 :M 31 ARG 2HG : -0.434: 0
: 2613:M 43 ILE 1HG1 :M 29 ILE 1HG1 : -0.423: 0
: 2613:M 47 SER 2HB :M 48 PRO 1HD : -0.422: 0
: 2613:M 66 THR 2HG2 :M 108 LEU 1HD2 : -0.419: 0
: 2613:M 65 GLN 2HG :M 169 HIS 1HB : -0.417: 0
: 2613:M 140 PRO 1HD :M 139 SER 2HB : -0.412: 0
: 2613:M 158 THR 2HG2 :M 16 LEU 1HD2 : -0.412: 0
#sum2 ::8.42 clashscore : 8.42 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:295917 potential dots:18490.0 A^2:22 bumps:22 bumps B<40:890.7 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 38 PRO CD :M 37 ALA N : -0.645: 0
: 2613:M 130 PRO CD :M 129 ALA N : -0.643: 0
: 2613:M 120 GLU CB :M 109 THR HA : -0.568: 0
: 2613:M 109 THR HA :M 120 GLU 1HB : -0.431: 0
: 2613:M 28 GLU CB :M 17 THR HA : -0.558: 0
: 2613:M 28 GLU 1HB :M 17 THR HA : -0.425: 0
: 2613:M 139 SER H :M 140 PRO 1HD : -0.522: 0
: 2613:M 140 PRO 2HD :M 139 SER 1HB : -0.479: 0
: 2613:M 168 GLU 1HB :M 167 LEU O : -0.499: 0
: 2613:M 48 PRO 1HD :M 47 SER H : -0.495: 0
: 2613:M 47 SER 1HB :M 48 PRO 2HD : -0.486: 0
: 2613:M 75 LEU O :M 76 GLU 1HB : -0.481: 0
: 2613:M 74 ASN 2HB :M 71 PHE HA : -0.442: 0
: 2613:M 75 LEU 2HB :M 74 ASN O : -0.400: 0
: 2613:M 137 ALA HA :M 119 LYS HA : -0.462: 0
: 2613:M 45 ALA HA :M 27 LYS HA : -0.454: 0
: 2613:M 166 ASN 2HB :M 163 PHE HA : -0.442: 0
: 2613:M 121 ILE 1HG1 :M 135 ILE 1HG1 : -0.433: 0
: 2613:M 121 ILE 2HG2 :M 107 LEU 2HD1 : -0.412: 0
: 2613:M 43 ILE 1HG1 :M 29 ILE 1HG1 : -0.425: 0
: 2613:M 15 LEU 2HD1 :M 29 ILE 2HG2 : -0.413: 0
: 2613:M 136 ARG CB :M 148 GLY 2HA : -0.406: 0
#sum2 ::8.42 clashscore : 8.42 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:295884 potential dots:18490.0 A^2:22 bumps:22 bumps B<40:956.2 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 109 THR HA :M 120 GLU 1HB : -0.512: 0
: 2613:M 57 ILE HB :M 148 GLY 1HA : -0.484: 0
: 2613:M 136 ARG HA :M 57 ILE 2HD1 : -0.437: 0
: 2613:M 28 GLU 1HB :M 17 THR HA : -0.483: 0
: 2613:M 56 GLY 1HA :M 149 ILE HB : -0.466: 0
: 2613:M 149 ILE 2HD1 :M 44 ARG HA : -0.435: 0
: 2613:M 29 ILE 1HG1 :M 43 ILE 1HG1 : -0.455: 0
: 2613:M 121 ILE 1HG1 :M 135 ILE 1HG1 : -0.451: 0
: 2613:M 135 ILE 1HG1 :M 121 ILE 3HG2 : -0.405: 0
: 2613:M 25 TRP O :M 21 ASN 2HB : -0.422: 0
: 2613:M 117 TRP O :M 113 ASN 2HB : -0.421: 0
: 2613:M 64 PHE O :M 68 VAL 3HG2 : -0.404: 0
#sum2 ::4.59 clashscore : 4.59 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:296317 potential dots:18520.0 A^2:12 bumps:12 bumps B<40:861 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 16 LEU 2HD1 :M 16 LEU C : -0.531: 0
: 2613:M 108 LEU 2HD1 :M 108 LEU C : -0.522: 0
: 2613:M 172 HIS O :M 173 HIS 1HB : -0.491: 0
: 2613:M 80 HIS O :M 81 HIS 1HB : -0.491: 0
: 2613:M 158 THR 1HG2 :M 18 LEU HA : -0.467: 0
: 2613:M 66 THR 1HG2 :M 110 LEU HA : -0.465: 0
: 2613:M 121 ILE 1HG1 :M 135 ILE 1HG1 : -0.448: 0
: 2613:M 29 ILE 1HG1 :M 43 ILE 1HG1 : -0.439: 0
: 2613:M 8 THR H :M 35 ASN 1HB : -0.419: 0
: 2613:M 100 THR H :M 127 ASN 1HB : -0.408: 0
: 2613:M 163 PHE CD1 :M 163 PHE N : -0.403: 0
#sum2 ::4.21 clashscore : 4.21 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:295548 potential dots:18470.0 A^2:11 bumps:11 bumps B<40:958.2 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 129 ALA N :M 130 PRO CD : -0.578: 0
: 2613:M 38 PRO CD :M 37 ALA N : -0.576: 0
: 2613:M 14 HIS HA :M 30 ASN 2HB : -0.549: 0
: 2613:M 30 ASN CB :M 14 HIS HA : -0.445: 0
: 2613:M 122 ASN 2HB :M 106 HIS HA : -0.539: 0
: 2613:M 122 ASN CB :M 106 HIS HA : -0.442: 0
: 2613:M 56 GLY 1HA :M 149 ILE HB : -0.471: 0
: 2613:M 57 ILE HB :M 148 GLY 1HA : -0.470: 0
: 2613:M 139 SER 2HB :M 140 PRO 1HD : -0.452: 0
: 2613:M 118 THR HA :M 112 GLU HA : -0.451: 0
: 2613:M 48 PRO 1HD :M 47 SER 2HB : -0.445: 0
: 2613:M 20 GLU HA :M 26 THR HA : -0.436: 0
: 2613:M 98 GLU O :M 99 PHE 1HB : -0.424: 0
: 2613:M 6 GLU O :M 7 PHE 1HB : -0.424: 0
: 2613:M 126 PHE O :M 127 ASN 1HB : -0.402: 0
#sum2 ::5.74 clashscore : 5.74 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:296503 potential dots:18530.0 A^2:15 bumps:15 bumps B<40:903.2 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 7 PHE HA :M 35 ASN 2HB : -0.623: 0
: 2613:M 99 PHE HA :M 127 ASN 2HB : -0.616: 0
: 2613:M 166 ASN 2HB :M 163 PHE HA : -0.514: 0
: 2613:M 74 ASN 2HB :M 71 PHE HA : -0.499: 0
: 2613:M 56 GLY 1HA :M 149 ILE HB : -0.483: 0
: 2613:M 43 ILE 2HG2 :M 149 ILE 3HD1 : -0.425: 0
: 2613:M 43 ILE 1HG1 :M 29 ILE 1HG1 : -0.401: 0
: 2613:M 45 ALA HA :M 27 LYS HA : -0.481: 0
: 2613:M 148 GLY 1HA :M 57 ILE HB : -0.475: 0
: 2613:M 57 ILE 3HD1 :M 135 ILE 2HG2 : -0.433: 0
: 2613:M 121 ILE 1HG1 :M 135 ILE 1HG1 : -0.408: 0
: 2613:M 137 ALA HA :M 119 LYS HA : -0.451: 0
: 2613:M 106 HIS HA :M 122 ASN CB : -0.421: 0
: 2613:M 30 ASN CB :M 14 HIS HA : -0.416: 0
: 2613:M 21 ASN O :M 25 TRP N : -0.414: 0
: 2613:M 15 LEU 1HD1 :M 31 ARG 2HG : -0.414: 0
: 2613:M 113 ASN O :M 117 TRP N : -0.411: 0
: 2613:M 118 THR O :M 138 TRP N : -0.411: 0
: 2613:M 123 ARG 2HG :M 107 LEU 1HD1 : -0.406: 0
: 2613:M 46 TRP N :M 26 THR O : -0.404: 0
: 2613:M 158 THR 2HG2 :M 16 LEU 1HD2 : -0.404: 0
: 2613:M 66 THR 2HG2 :M 108 LEU 1HD2 : -0.403: 0
#sum2 ::8.42 clashscore : 8.42 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:296045 potential dots:18500.0 A^2:22 bumps:22 bumps B<40:914 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 170 HIS O :M 171 HIS 2HB : -0.479: 0
: 2613:M 78 HIS O :M 79 HIS 2HB : -0.479: 0
: 2613:M 17 THR 3HG2 :M 28 GLU 1HG : -0.475: 0
: 2613:M 14 HIS HA :M 30 ASN 2HB : -0.474: 0
: 2613:M 14 HIS HA :M 30 ASN CB : -0.415: 0
: 2613:M 122 ASN 2HB :M 106 HIS HA : -0.471: 0
: 2613:M 122 ASN CB :M 106 HIS HA : -0.409: 0
: 2613:M 15 LEU 1HD1 :M 31 ARG 2HG : -0.464: 0
: 2613:M 120 GLU 1HG :M 109 THR 3HG2 : -0.457: 0
: 2613:M 34 PHE 1HB :M 37 ALA 3HB : -0.454: 0
: 2613:M 123 ARG 2HG :M 107 LEU 1HD1 : -0.453: 0
: 2613:M 129 ALA 3HB :M 126 PHE 1HB : -0.438: 0
: 2613:M 142 HIS ND1 :M 143 THR N : -0.423: 0
: 2613:M 50 HIS ND1 :M 51 THR N : -0.418: 0
#sum2 ::5.36 clashscore : 5.36 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:295908 potential dots:18490.0 A^2:14 bumps:14 bumps B<40:1002 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 108 LEU 2HD1 :M 108 LEU O : -0.792: 0
: 2613:M 108 LEU 2HD1 :M 108 LEU C : -0.727: 0
: 2613:M 108 LEU CD1 :M 108 LEU C : -0.520: 0
: 2613:M 16 LEU O :M 16 LEU 2HD1 : -0.773: 0
: 2613:M 16 LEU 2HD1 :M 16 LEU C : -0.721: 0
: 2613:M 16 LEU C :M 16 LEU CD1 : -0.511: 0
: 2613:M 34 PHE O :M 35 ASN 1HB : -0.468: 0
: 2613:M 126 PHE O :M 127 ASN 1HB : -0.463: 0
: 2613:M 37 ALA 3HB :M 38 PRO 2HD : -0.449: 0
: 2613:M 130 PRO 2HD :M 129 ALA 3HB : -0.443: 0
: 2613:M 142 HIS 1HB :M 141 ASP O : -0.433: 0
: 2613:M 11 ILE 1HG1 :M 32 VAL 2HG2 : -0.426: 0
: 2613:M 49 ASP O :M 50 HIS 1HB : -0.424: 0
: 2613:M 113 ASN O :M 115 LYS N : -0.421: 0
: 2613:M 21 ASN O :M 23 LYS N : -0.416: 0
: 2613:M 103 ILE 1HG1 :M 124 VAL 2HG2 : -0.413: 0
#sum2 ::6.12 clashscore : 6.12 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:295600 potential dots:18480.0 A^2:16 bumps:16 bumps B<40:936.3 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 168 GLU OE1 :M 168 GLU O : -0.598: 0
: 2613:M 68 VAL 1HG2 :M 168 GLU 1HB : -0.439: 0
: 2613:M 64 PHE O :M 68 VAL 3HG2 : -0.405: 0
: 2613:M 76 GLU O :M 76 GLU OE1 : -0.591: 0
: 2613:M 76 GLU 1HB :M 160 VAL 1HG2 : -0.435: 0
: 2613:M 16 LEU 2HD1 :M 16 LEU C : -0.584: 0
: 2613:M 16 LEU 2HD1 :M 16 LEU O : -0.436: 0
: 2613:M 108 LEU 2HD1 :M 108 LEU C : -0.582: 0
: 2613:M 108 LEU 2HD1 :M 108 LEU O : -0.441: 0
: 2613:M 163 PHE HA :M 167 LEU 1HB : -0.544: 0
: 2613:M 71 PHE HA :M 75 LEU 1HB : -0.534: 0
: 2613:M 97 ALA O :M 98 GLU 1HB : -0.495: 0
: 2613:M 5 ALA O :M 6 GLU 1HB : -0.491: 0
: 2613:M 130 PRO CD :M 129 ALA N : -0.453: 0
: 2613:M 131 ALA HA :M 125 SER HA : -0.414: 0
: 2613:M 130 PRO O :M 125 SER HA : -0.402: 0
: 2613:M 38 PRO CD :M 37 ALA N : -0.447: 0
: 2613:M 121 ILE 1HG1 :M 135 ILE 1HG1 : -0.442: 0
: 2613:M 43 ILE 1HG1 :M 29 ILE 1HG1 : -0.428: 0
: 2613:M 18 LEU H :M 28 GLU HA : -0.426: 0
: 2613:M 155 GLU 2HG :M 18 LEU 2HB : -0.408: 0
: 2613:M 120 GLU HA :M 110 LEU H : -0.424: 0
: 2613:M 63 GLU 2HG :M 110 LEU 2HB : -0.402: 0
: 2613:M 33 SER HA :M 39 ALA HA : -0.411: 0
: 2613:M 148 GLY 1HA :M 57 ILE HB : -0.400: 0
#sum2 ::9.57 clashscore : 9.57 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:296323 potential dots:18520.0 A^2:25 bumps:25 bumps B<40:778.8 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 9 PHE N :M 9 PHE HD1 : -0.472: 0
: 2613:M 9 PHE CD1 :M 9 PHE N : -0.432: 0
: 2613:M 101 PHE HD1 :M 101 PHE N : -0.465: 0
: 2613:M 101 PHE N :M 101 PHE CD1 : -0.428: 0
: 2613:M 23 LYS 1HB :M 22 GLU O : -0.456: 0
: 2613:M 22 GLU 1HB :M 21 ASN O : -0.424: 0
: 2613:M 114 GLU O :M 115 LYS 1HB : -0.455: 0
: 2613:M 113 ASN O :M 114 GLU 1HB : -0.432: 0
: 2613:M 75 LEU O :M 76 GLU C : -0.429: 0
: 2613:M 167 LEU O :M 168 GLU C : -0.428: 0
: 2613:M 139 SER 2HB :M 140 PRO 1HD : -0.426: 0
: 2613:M 31 ARG 1HG :M 39 ALA 1HB : -0.423: 0
: 2613:M 123 ARG 1HG :M 131 ALA 1HB : -0.415: 0
: 2613:M 48 PRO 1HD :M 47 SER 2HB : -0.413: 0
: 2613:M 118 THR HA :M 112 GLU HA : -0.412: 0
: 2613:M 135 ILE 1HG1 :M 121 ILE 1HG1 : -0.409: 0
: 2613:M 20 GLU HA :M 26 THR HA : -0.405: 0
#sum2 ::6.51 clashscore : 6.51 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:296059 potential dots:18500.0 A^2:17 bumps:17 bumps B<40:892.4 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 66 THR 1HG2 :M 110 LEU HA : -0.496: 0
: 2613:M 67 MET 1HG :M 67 MET H : -0.418: 0
: 2613:M 67 MET 2HB :M 110 LEU 1HD2 : -0.400: 0
: 2613:M 130 PRO CD :M 129 ALA N : -0.494: 0
: 2613:M 129 ALA 3HB :M 130 PRO 2HD : -0.403: 0
: 2613:M 38 PRO CD :M 37 ALA N : -0.493: 0
: 2613:M 37 ALA 3HB :M 38 PRO 2HD : -0.413: 0
: 2613:M 18 LEU HA :M 158 THR 1HG2 : -0.492: 0
: 2613:M 159 MET 2HB :M 18 LEU 1HD2 : -0.402: 0
: 2613:M 71 PHE HD1 :M 71 PHE N : -0.483: 0
: 2613:M 71 PHE N :M 71 PHE CD1 : -0.472: 0
: 2613:M 163 PHE HD1 :M 163 PHE N : -0.479: 0
: 2613:M 163 PHE N :M 163 PHE CD1 : -0.462: 0
: 2613:M 144 LYS O :M 145 MET 1HB : -0.478: 0
: 2613:M 53 MET 1HB :M 52 LYS O : -0.477: 0
: 2613:M 162 ALA O :M 166 ASN 1HB : -0.455: 0
: 2613:M 70 ALA O :M 74 ASN 1HB : -0.450: 0
: 2613:M 172 HIS 2HB :M 171 HIS O : -0.416: 0
: 2613:M 13 GLU 2HB :M 31 ARG 2HB : -0.416: 0
: 2613:M 79 HIS O :M 80 HIS 2HB : -0.411: 0
#sum2 ::7.65 clashscore : 7.65 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:295962 potential dots:18500.0 A^2:20 bumps:20 bumps B<40:885.6 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 108 LEU 2HD1 :M 108 LEU C : -0.595: 0
: 2613:M 108 LEU 2HD1 :M 108 LEU O : -0.530: 0
: 2613:M 16 LEU 2HD1 :M 16 LEU C : -0.585: 0
: 2613:M 16 LEU O :M 16 LEU 2HD1 : -0.530: 0
: 2613:M 43 ILE 3HG2 :M 29 ILE 1HG1 : -0.480: 0
: 2613:M 135 ILE 3HG2 :M 121 ILE 1HG1 : -0.480: 0
: 2613:M 135 ILE 2HG2 :M 57 ILE 1HG2 : -0.420: 0
: 2613:M 43 ILE 2HG2 :M 149 ILE 1HG2 : -0.418: 0
: 2613:M 45 ALA HA :M 27 LYS HA : -0.447: 0
: 2613:M 137 ALA HA :M 119 LYS HA : -0.442: 0
: 2613:M 120 GLU CB :M 109 THR HA : -0.428: 0
: 2613:M 17 THR HA :M 28 GLU CB : -0.420: 0
#sum2 ::4.59 clashscore : 4.59 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:295901 potential dots:18490.0 A^2:12 bumps:12 bumps B<40:973.1 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 126 PHE O :M 127 ASN 1HB : -0.495: 0
: 2613:M 34 PHE O :M 35 ASN 1HB : -0.492: 0
: 2613:M 160 VAL 2HG2 :M 71 PHE 2HB : -0.475: 0
: 2613:M 71 PHE N :M 71 PHE HD1 : -0.416: 0
: 2613:M 68 VAL 2HG2 :M 163 PHE 2HB : -0.473: 0
: 2613:M 163 PHE N :M 163 PHE HD1 : -0.422: 0
: 2613:M 48 PRO 1HD :M 47 SER 2HB : -0.433: 0
: 2613:M 76 GLU 2HB :M 75 LEU O : -0.429: 0
: 2613:M 75 LEU O :M 76 GLU CB : -0.418: 0
: 2613:M 168 GLU 2HB :M 167 LEU O : -0.428: 0
: 2613:M 167 LEU O :M 168 GLU CB : -0.422: 0
: 2613:M 139 SER 2HB :M 140 PRO 1HD : -0.421: 0
: 2613:M 39 ALA 1HB :M 31 ARG 2HB : -0.421: 0
: 2613:M 131 ALA 1HB :M 123 ARG 2HB : -0.413: 0
#sum2 ::5.36 clashscore : 5.36 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:295924 potential dots:18500.0 A^2:14 bumps:14 bumps B<40:844.7 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 45 ALA HA :M 27 LYS HA : -0.484: 0
: 2613:M 137 ALA HA :M 119 LYS HA : -0.481: 0
: 2613:M 16 LEU 2HD1 :M 16 LEU C : -0.479: 0
: 2613:M 108 LEU 2HD1 :M 108 LEU C : -0.478: 0
: 2613:M 121 ILE 1HG1 :M 135 ILE 1HG1 : -0.469: 0
: 2613:M 29 ILE 1HG1 :M 43 ILE 1HG1 : -0.469: 0
: 2613:M 135 ILE 3HG2 :M 121 ILE 1HG1 : -0.406: 0
: 2613:M 74 ASN 1HB :M 71 PHE HA : -0.466: 0
: 2613:M 122 ASN CB :M 106 HIS HA : -0.460: 0
: 2613:M 30 ASN CB :M 14 HIS HA : -0.455: 0
: 2613:M 163 PHE HA :M 166 ASN 1HB : -0.450: 0
: 2613:M 117 TRP 1HB :M 113 ASN 1HB : -0.438: 0
: 2613:M 136 ARG HA :M 57 ILE 2HD1 : -0.434: 0
: 2613:M 21 ASN 1HB :M 25 TRP 1HB : -0.432: 0
: 2613:M 129 ALA N :M 130 PRO CD : -0.425: 0
: 2613:M 149 ILE 2HD1 :M 44 ARG HA : -0.418: 0
: 2613:M 38 PRO CD :M 37 ALA N : -0.416: 0
#sum2 ::6.51 clashscore : 6.51 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:296224 potential dots:18510.0 A^2:17 bumps:17 bumps B<40:897.5 score
Output from PDB validation software
Summary from PDB validation
May. 10, 22:33:02 2013
[ Text modified to reflect that this was run under PSVS - Aneerban Bhattacharya: Dec 2005 ]
The following checks were made on :
-----------------------------------------
CLOSE CONTACTS
==> Distances smaller than 2.2 Angstroms are considered as close contacts
for heavy atoms, 1.6 Angstroms for hydrogens.
none
DISTANCES AND ANGLES
We have checked your intra and intermolecular distances and angles with the
procedures currently in place at PDB:
==> Bond and angle checks are performed by first computing the average rms
error for all bonds and angles relative to standard values for nucleotide
units [L. Clowney et al., Geometric Parameters in Nucleic Acids: Nitrogenous
Bases, J.Am.Chem.Soc. 1996, 118, 509-518; A. Gelbin et al., Geometric
Parameters in Nucleic Acids: Sugar and Phosphate Constituents, J.Am.Chem.Soc.
1996, 118, 519-529] and amino acid units [R.A. Engh and R. Huber, Accurate
Bond and Angle Parameters for X-ray protein structure refinement, Acta
Crystallogr. 1991, A47, 392-400]. Any bond or angle which deviates from the
dictionary values by more than six times this computed rms error is
identified as an outlier.
*** Covalent Bond Lengths:
The RMS deviation for covalent bonds relative to the standard
dictionary is 0.010 Angstroms
The following table contains a list of the covalent bonds
greater than 6.0*RMSD.
Deviation Residue Chain Sequence Model AT1 - AT2 Bond Dictionary
Name ID Number Distance Value
------------------------------------------------------------------------
0.068 PRO A 48 1 CD - N 1.541 1.473
0.068 PRO B 48 1 CD - N 1.541 1.473
0.086 PRO A 38 4 CD - N 1.559 1.473
0.085 PRO B 38 4 CD - N 1.558 1.473
0.069 PRO A 38 8 CD - N 1.542 1.473
0.073 PRO A 48 8 CD - N 1.546 1.473
0.069 PRO B 38 8 CD - N 1.542 1.473
0.074 PRO B 48 8 CD - N 1.547 1.473
0.064 PRO A 38 11 CD - N 1.537 1.473
0.064 PRO B 38 11 CD - N 1.537 1.473
*** Covalent Angle Values:
The RMS deviation for covalent angles relative to the standard
dictionary is 0.6 degrees.
The following table contains a list of the covalent bond angles
greater than 6.0*RMSD.
Deviation Residue Chain Sequence Model AT1 - AT2 - AT3 Bond Dictionary
Name ID Number Angle Value
--------------------------------------------------------------------------------
-4.6 MET A 4 12 N - CA - C 106.6 111.2
-4.6 MET B 4 12 N - CA - C 106.6 111.2
-4.0 HIS A 81 13 N - CA - C 107.2 111.2
-4.0 HIS B 81 13 N - CA - C 107.2 111.2
-4.0 HIS A 78 15 N - CA - C 107.2 111.2
-4.0 HIS B 78 15 N - CA - C 107.2 111.2
-3.8 ASP A 49 18 N - CA - C 107.4 111.2
-3.8 ASP B 49 18 N - CA - C 107.4 111.2
TORSION ANGLES
The torsion angle distributions have been checked. The postscript file of the
conformation rings showing the torsion angle distributions will be sent in a
separate E-mail message.
CHIRALITY
The chirality has been checked. O1P, O2P, and hydrogen atoms which do not
follow the convention defined in the IUBMB (Liebecq, C. Compendium of
Biochemical Nomenclature and Related Documents, 2nd ed.; Portland Press:
London and Chapel Hill, 1992) and IUPAC nomenclature (J.L. Markley, A. Bax,
Y. Arata, C.W. Hilbers, R. Kaptein, B.D. Sykes, P.E. Wright and K. Wüthrich,
Recommendations for the Presentation of NMR Structures of Proteins and
Nucleic Acids, Pure & Appl. Chem., Vol. 70, pp. 117-142, 1998) have been
standardized. Any other stereochemical violations are listed below.
E/Z NOMENCLATURE
E/Z nomenclature of hydrogens and/or nitrogens on Arg, Asn or Gln residues needs
to be corrected to conform with the standard for E/Z orientation presented in
[J.L. Markley, et al., Recommendations for the Presentation of NMR Structures of
Proteins and Nucleic Acids, Pure & Appl. Chem., 1998, 70, 117-142].
Model Chain Residue Residue Atom Name Original
Name Number Atom Name
----- ----- ------- ------- -------- ---------
1 A ASN 21 1HD2
1 A ASN 21 2HD2
1 A ASN 30 1HD2
1 A ASN 30 2HD2
1 A ASN 35 1HD2
1 A ASN 35 2HD2
1 A ASN 61 1HD2
1 A ASN 61 2HD2
1 A GLN 65 1HE2
1 A GLN 65 2HE2
1 A ASN 74 1HD2
1 A ASN 74 2HD2
1 B ASN 21 1HD2
1 B ASN 21 2HD2
1 B ASN 30 1HD2
1 B ASN 30 2HD2
1 B ASN 35 1HD2
1 B ASN 35 2HD2
1 B ASN 61 1HD2
1 B ASN 61 2HD2
1 B GLN 65 1HE2
1 B GLN 65 2HE2
1 B ASN 74 1HD2
1 B ASN 74 2HD2
2 A ASN 21 1HD2
2 A ASN 21 2HD2
2 A ASN 30 1HD2
2 A ASN 30 2HD2
2 A ASN 35 1HD2
2 A ASN 35 2HD2
2 A ASN 61 1HD2
2 A ASN 61 2HD2
2 A GLN 65 1HE2
2 A GLN 65 2HE2
2 A ASN 74 1HD2
2 A ASN 74 2HD2
2 B ASN 21 1HD2
2 B ASN 21 2HD2
2 B ASN 30 1HD2
2 B ASN 30 2HD2
2 B ASN 35 1HD2
2 B ASN 35 2HD2
2 B ASN 61 1HD2
2 B ASN 61 2HD2
2 B GLN 65 1HE2
2 B GLN 65 2HE2
2 B ASN 74 1HD2
2 B ASN 74 2HD2
3 A ASN 21 1HD2
3 A ASN 21 2HD2
3 A ASN 30 1HD2
3 A ASN 30 2HD2
3 A ASN 35 1HD2
3 A ASN 35 2HD2
3 A ASN 61 1HD2
3 A ASN 61 2HD2
3 A GLN 65 1HE2
3 A GLN 65 2HE2
3 A ASN 74 1HD2
3 A ASN 74 2HD2
3 B ASN 21 1HD2
3 B ASN 21 2HD2
3 B ASN 30 1HD2
3 B ASN 30 2HD2
3 B ASN 35 1HD2
3 B ASN 35 2HD2
3 B ASN 61 1HD2
3 B ASN 61 2HD2
3 B GLN 65 1HE2
3 B GLN 65 2HE2
3 B ASN 74 1HD2
3 B ASN 74 2HD2
4 A ASN 21 1HD2
4 A ASN 21 2HD2
4 A ASN 30 1HD2
4 A ASN 30 2HD2
4 A ASN 35 1HD2
4 A ASN 35 2HD2
4 A ASN 61 1HD2
4 A ASN 61 2HD2
4 A GLN 65 1HE2
4 A GLN 65 2HE2
4 A ASN 74 1HD2
4 A ASN 74 2HD2
4 B ASN 21 1HD2
4 B ASN 21 2HD2
4 B ASN 30 1HD2
4 B ASN 30 2HD2
4 B ASN 35 1HD2
4 B ASN 35 2HD2
4 B ASN 61 1HD2
4 B ASN 61 2HD2
4 B GLN 65 1HE2
4 B GLN 65 2HE2
4 B ASN 74 1HD2
4 B ASN 74 2HD2
5 A ASN 21 1HD2
5 A ASN 21 2HD2
5 A ASN 30 1HD2
5 A ASN 30 2HD2
5 A ASN 35 1HD2
5 A ASN 35 2HD2
5 A ASN 61 1HD2
5 A ASN 61 2HD2
5 A GLN 65 1HE2
5 A GLN 65 2HE2
5 A ASN 74 1HD2
5 A ASN 74 2HD2
5 B ASN 21 1HD2
5 B ASN 21 2HD2
5 B ASN 30 1HD2
5 B ASN 30 2HD2
5 B ASN 35 1HD2
5 B ASN 35 2HD2
5 B ASN 61 1HD2
5 B ASN 61 2HD2
5 B GLN 65 1HE2
5 B GLN 65 2HE2
5 B ASN 74 1HD2
5 B ASN 74 2HD2
6 A ASN 21 1HD2
6 A ASN 21 2HD2
6 A ASN 30 1HD2
6 A ASN 30 2HD2
6 A ASN 35 1HD2
6 A ASN 35 2HD2
6 A ASN 61 1HD2
6 A ASN 61 2HD2
6 A GLN 65 1HE2
6 A GLN 65 2HE2
6 A ASN 74 1HD2
6 A ASN 74 2HD2
6 B ASN 21 1HD2
6 B ASN 21 2HD2
6 B ASN 30 1HD2
6 B ASN 30 2HD2
6 B ASN 35 1HD2
6 B ASN 35 2HD2
6 B ASN 61 1HD2
6 B ASN 61 2HD2
6 B GLN 65 1HE2
6 B GLN 65 2HE2
6 B ASN 74 1HD2
6 B ASN 74 2HD2
7 A ASN 21 1HD2
7 A ASN 21 2HD2
7 A ASN 30 1HD2
7 A ASN 30 2HD2
7 A ASN 35 1HD2
7 A ASN 35 2HD2
7 A ASN 61 1HD2
7 A ASN 61 2HD2
7 A GLN 65 1HE2
7 A GLN 65 2HE2
7 A ASN 74 1HD2
7 A ASN 74 2HD2
7 B ASN 21 1HD2
7 B ASN 21 2HD2
7 B ASN 30 1HD2
7 B ASN 30 2HD2
7 B ASN 35 1HD2
7 B ASN 35 2HD2
7 B ASN 61 1HD2
7 B ASN 61 2HD2
7 B GLN 65 1HE2
7 B GLN 65 2HE2
7 B ASN 74 1HD2
7 B ASN 74 2HD2
8 A ASN 21 1HD2
8 A ASN 21 2HD2
8 A ASN 30 1HD2
8 A ASN 30 2HD2
8 A ASN 35 1HD2
8 A ASN 35 2HD2
8 A ASN 61 1HD2
8 A ASN 61 2HD2
8 A GLN 65 1HE2
8 A GLN 65 2HE2
8 A ASN 74 1HD2
8 A ASN 74 2HD2
8 B ASN 21 1HD2
8 B ASN 21 2HD2
8 B ASN 30 1HD2
8 B ASN 30 2HD2
8 B ASN 35 1HD2
8 B ASN 35 2HD2
8 B ASN 61 1HD2
8 B ASN 61 2HD2
8 B GLN 65 1HE2
8 B GLN 65 2HE2
8 B ASN 74 1HD2
8 B ASN 74 2HD2
9 A ASN 21 1HD2
9 A ASN 21 2HD2
9 A ASN 30 1HD2
9 A ASN 30 2HD2
9 A ASN 35 1HD2
9 A ASN 35 2HD2
9 A ASN 61 1HD2
9 A ASN 61 2HD2
9 A GLN 65 1HE2
9 A GLN 65 2HE2
9 A ASN 74 1HD2
9 A ASN 74 2HD2
9 B ASN 21 1HD2
9 B ASN 21 2HD2
9 B ASN 30 1HD2
9 B ASN 30 2HD2
9 B ASN 35 1HD2
9 B ASN 35 2HD2
9 B ASN 61 1HD2
9 B ASN 61 2HD2
9 B GLN 65 1HE2
9 B GLN 65 2HE2
9 B ASN 74 1HD2
9 B ASN 74 2HD2
10 A ASN 21 1HD2
10 A ASN 21 2HD2
10 A ASN 30 1HD2
10 A ASN 30 2HD2
10 A ASN 35 1HD2
10 A ASN 35 2HD2
10 A ASN 61 1HD2
10 A ASN 61 2HD2
10 A GLN 65 1HE2
10 A GLN 65 2HE2
10 A ASN 74 1HD2
10 A ASN 74 2HD2
10 B ASN 21 1HD2
10 B ASN 21 2HD2
10 B ASN 30 1HD2
10 B ASN 30 2HD2
10 B ASN 35 1HD2
10 B ASN 35 2HD2
10 B ASN 61 1HD2
10 B ASN 61 2HD2
10 B GLN 65 1HE2
10 B GLN 65 2HE2
10 B ASN 74 1HD2
10 B ASN 74 2HD2
11 A ASN 21 1HD2
11 A ASN 21 2HD2
11 A ASN 30 1HD2
11 A ASN 30 2HD2
11 A ASN 35 1HD2
11 A ASN 35 2HD2
11 A ASN 61 1HD2
11 A ASN 61 2HD2
11 A GLN 65 1HE2
11 A GLN 65 2HE2
11 A ASN 74 1HD2
11 A ASN 74 2HD2
11 B ASN 21 1HD2
11 B ASN 21 2HD2
11 B ASN 30 1HD2
11 B ASN 30 2HD2
11 B ASN 35 1HD2
11 B ASN 35 2HD2
11 B ASN 61 1HD2
11 B ASN 61 2HD2
11 B GLN 65 1HE2
11 B GLN 65 2HE2
11 B ASN 74 1HD2
11 B ASN 74 2HD2
12 A ASN 21 1HD2
12 A ASN 21 2HD2
12 A ASN 30 1HD2
12 A ASN 30 2HD2
12 A ASN 35 1HD2
12 A ASN 35 2HD2
12 A ASN 61 1HD2
12 A ASN 61 2HD2
12 A GLN 65 1HE2
12 A GLN 65 2HE2
12 A ASN 74 1HD2
12 A ASN 74 2HD2
12 B ASN 21 1HD2
12 B ASN 21 2HD2
12 B ASN 30 1HD2
12 B ASN 30 2HD2
12 B ASN 35 1HD2
12 B ASN 35 2HD2
12 B ASN 61 1HD2
12 B ASN 61 2HD2
12 B GLN 65 1HE2
12 B GLN 65 2HE2
12 B ASN 74 1HD2
12 B ASN 74 2HD2
13 A ASN 21 1HD2
13 A ASN 21 2HD2
13 A ASN 30 1HD2
13 A ASN 30 2HD2
13 A ASN 35 1HD2
13 A ASN 35 2HD2
13 A ASN 61 1HD2
13 A ASN 61 2HD2
13 A GLN 65 1HE2
13 A GLN 65 2HE2
13 A ASN 74 1HD2
13 A ASN 74 2HD2
13 B ASN 21 1HD2
13 B ASN 21 2HD2
13 B ASN 30 1HD2
13 B ASN 30 2HD2
13 B ASN 35 1HD2
13 B ASN 35 2HD2
13 B ASN 61 1HD2
13 B ASN 61 2HD2
13 B GLN 65 1HE2
13 B GLN 65 2HE2
13 B ASN 74 1HD2
13 B ASN 74 2HD2
14 A ASN 21 1HD2
14 A ASN 21 2HD2
14 A ASN 30 1HD2
14 A ASN 30 2HD2
14 A ASN 35 1HD2
14 A ASN 35 2HD2
14 A ASN 61 1HD2
14 A ASN 61 2HD2
14 A GLN 65 1HE2
14 A GLN 65 2HE2
14 A ASN 74 1HD2
14 A ASN 74 2HD2
14 B ASN 21 1HD2
14 B ASN 21 2HD2
14 B ASN 30 1HD2
14 B ASN 30 2HD2
14 B ASN 35 1HD2
14 B ASN 35 2HD2
14 B ASN 61 1HD2
14 B ASN 61 2HD2
14 B GLN 65 1HE2
14 B GLN 65 2HE2
14 B ASN 74 1HD2
14 B ASN 74 2HD2
15 A ASN 21 1HD2
15 A ASN 21 2HD2
15 A ASN 30 1HD2
15 A ASN 30 2HD2
15 A ASN 35 1HD2
15 A ASN 35 2HD2
15 A ASN 61 1HD2
15 A ASN 61 2HD2
15 A GLN 65 1HE2
15 A GLN 65 2HE2
15 A ASN 74 1HD2
15 A ASN 74 2HD2
15 B ASN 21 1HD2
15 B ASN 21 2HD2
15 B ASN 30 1HD2
15 B ASN 30 2HD2
15 B ASN 35 1HD2
15 B ASN 35 2HD2
15 B ASN 61 1HD2
15 B ASN 61 2HD2
15 B GLN 65 1HE2
15 B GLN 65 2HE2
15 B ASN 74 1HD2
15 B ASN 74 2HD2
16 A ASN 21 1HD2
16 A ASN 21 2HD2
16 A ASN 30 1HD2
16 A ASN 30 2HD2
16 A ASN 35 1HD2
16 A ASN 35 2HD2
16 A ASN 61 1HD2
16 A ASN 61 2HD2
16 A GLN 65 1HE2
16 A GLN 65 2HE2
16 A ASN 74 1HD2
16 A ASN 74 2HD2
16 B ASN 21 1HD2
16 B ASN 21 2HD2
16 B ASN 30 1HD2
16 B ASN 30 2HD2
16 B ASN 35 1HD2
16 B ASN 35 2HD2
16 B ASN 61 1HD2
16 B ASN 61 2HD2
16 B GLN 65 1HE2
16 B GLN 65 2HE2
16 B ASN 74 1HD2
16 B ASN 74 2HD2
17 A ASN 21 1HD2
17 A ASN 21 2HD2
17 A ASN 30 1HD2
17 A ASN 30 2HD2
17 A ASN 35 1HD2
17 A ASN 35 2HD2
17 A ASN 61 1HD2
17 A ASN 61 2HD2
17 A GLN 65 1HE2
17 A GLN 65 2HE2
17 A ASN 74 1HD2
17 A ASN 74 2HD2
17 B ASN 21 1HD2
17 B ASN 21 2HD2
17 B ASN 30 1HD2
17 B ASN 30 2HD2
17 B ASN 35 1HD2
17 B ASN 35 2HD2
17 B ASN 61 1HD2
17 B ASN 61 2HD2
17 B GLN 65 1HE2
17 B GLN 65 2HE2
17 B ASN 74 1HD2
17 B ASN 74 2HD2
18 A ASN 21 1HD2
18 A ASN 21 2HD2
18 A ASN 30 1HD2
18 A ASN 30 2HD2
18 A ASN 35 1HD2
18 A ASN 35 2HD2
18 A ASN 61 1HD2
18 A ASN 61 2HD2
18 A GLN 65 1HE2
18 A GLN 65 2HE2
18 A ASN 74 1HD2
18 A ASN 74 2HD2
18 B ASN 21 1HD2
18 B ASN 21 2HD2
18 B ASN 30 1HD2
18 B ASN 30 2HD2
18 B ASN 35 1HD2
18 B ASN 35 2HD2
18 B ASN 61 1HD2
18 B ASN 61 2HD2
18 B GLN 65 1HE2
18 B GLN 65 2HE2
18 B ASN 74 1HD2
18 B ASN 74 2HD2
19 A ASN 21 1HD2
19 A ASN 21 2HD2
19 A ASN 30 1HD2
19 A ASN 30 2HD2
19 A ASN 35 1HD2
19 A ASN 35 2HD2
19 A ASN 61 1HD2
19 A ASN 61 2HD2
19 A GLN 65 1HE2
19 A GLN 65 2HE2
19 A ASN 74 1HD2
19 A ASN 74 2HD2
19 B ASN 21 1HD2
19 B ASN 21 2HD2
19 B ASN 30 1HD2
19 B ASN 30 2HD2
19 B ASN 35 1HD2
19 B ASN 35 2HD2
19 B ASN 61 1HD2
19 B ASN 61 2HD2
19 B GLN 65 1HE2
19 B GLN 65 2HE2
19 B ASN 74 1HD2
19 B ASN 74 2HD2
20 A ASN 21 1HD2
20 A ASN 21 2HD2
20 A ASN 30 1HD2
20 A ASN 30 2HD2
20 A ASN 35 1HD2
20 A ASN 35 2HD2
20 A ASN 61 1HD2
20 A ASN 61 2HD2
20 A GLN 65 1HE2
20 A GLN 65 2HE2
20 A ASN 74 1HD2
20 A ASN 74 2HD2
20 B ASN 21 1HD2
20 B ASN 21 2HD2
20 B ASN 30 1HD2
20 B ASN 30 2HD2
20 B ASN 35 1HD2
20 B ASN 35 2HD2
20 B ASN 61 1HD2
20 B ASN 61 2HD2
20 B GLN 65 1HE2
20 B GLN 65 2HE2
20 B ASN 74 1HD2
20 B ASN 74 2HD2
OTHER IMPORTANT ISSUES
==> The following residues have missing atoms:
RES MOD#C SEQ ATOMS
GLU( 1 A 6) HE2
GLU( 1 A 10) HE2
GLU( 1 A 12) HE2
GLU( 1 A 13) HE2
HIS( 1 A 14) HD1
GLU( 1 A 20) HE2
GLU( 1 A 22) HE2
GLU( 1 A 28) HE2
ASP( 1 A 42) HD2
ASP( 1 A 49) HD2
HIS( 1 A 50) HD1
GLU( 1 A 62) HE2
GLU( 1 A 63) HE2
ASP( 1 A 69) HD2
GLU( 1 A 76) HE2
HIS( 1 A 77) HE2
HIS( 1 A 78) HD1
HIS( 1 A 79) HD1
HIS( 1 A 80) HD1
HIS( 1 A 81) HD1
HIS( 1 A 82) HE2
GLU( 1 B 6) HE2
GLU( 1 B 10) HE2
GLU( 1 B 12) HE2
GLU( 1 B 13) HE2
HIS( 1 B 14) HD1
GLU( 1 B 20) HE2
GLU( 1 B 22) HE2
GLU( 1 B 28) HE2
ASP( 1 B 42) HD2
ASP( 1 B 49) HD2
HIS( 1 B 50) HD1
GLU( 1 B 62) HE2
GLU( 1 B 63) HE2
ASP( 1 B 69) HD2
GLU( 1 B 76) HE2
HIS( 1 B 77) HE2
HIS( 1 B 78) HD1
HIS( 1 B 79) HD1
HIS( 1 B 80) HD1
HIS( 1 B 81) HD1
HIS( 1 B 82) HE2
GLU( 2 A 6) HE2
GLU( 2 A 10) HE2
GLU( 2 A 12) HE2
GLU( 2 A 13) HE2
HIS( 2 A 14) HD1
GLU( 2 A 20) HE2
GLU( 2 A 22) HE2
GLU( 2 A 28) HE2
ASP( 2 A 42) HD2
ASP( 2 A 49) HD2
HIS( 2 A 50) HE2
GLU( 2 A 62) HE2
GLU( 2 A 63) HE2
ASP( 2 A 69) HD2
GLU( 2 A 76) HE2
HIS( 2 A 77) HE2
HIS( 2 A 78) HD1
HIS( 2 A 79) HE2
HIS( 2 A 80) HD1
HIS( 2 A 81) HD1
HIS( 2 A 82) HE2
GLU( 2 B 6) HE2
GLU( 2 B 10) HE2
GLU( 2 B 12) HE2
GLU( 2 B 13) HE2
HIS( 2 B 14) HD1
GLU( 2 B 20) HE2
GLU( 2 B 22) HE2
GLU( 2 B 28) HE2
ASP( 2 B 42) HD2
ASP( 2 B 49) HD2
HIS( 2 B 50) HE2
GLU( 2 B 62) HE2
GLU( 2 B 63) HE2
ASP( 2 B 69) HD2
GLU( 2 B 76) HE2
HIS( 2 B 77) HE2
HIS( 2 B 78) HD1
HIS( 2 B 79) HE2
HIS( 2 B 80) HD1
HIS( 2 B 81) HD1
HIS( 2 B 82) HE2
GLU( 3 A 6) HE2
GLU( 3 A 10) HE2
GLU( 3 A 12) HE2
GLU( 3 A 13) HE2
HIS( 3 A 14) HD1
GLU( 3 A 20) HE2
GLU( 3 A 22) HE2
GLU( 3 A 28) HE2
ASP( 3 A 42) HD2
ASP( 3 A 49) HD2
HIS( 3 A 50) HD1
GLU( 3 A 62) HE2
GLU( 3 A 63) HE2
ASP( 3 A 69) HD2
GLU( 3 A 76) HE2
HIS( 3 A 77) HD1
HIS( 3 A 78) HE2
HIS( 3 A 79) HE2
HIS( 3 A 80) HD1
HIS( 3 A 81) HE2
HIS( 3 A 82) HD1
GLU( 3 B 6) HE2
GLU( 3 B 10) HE2
GLU( 3 B 12) HE2
GLU( 3 B 13) HE2
HIS( 3 B 14) HD1
GLU( 3 B 20) HE2
GLU( 3 B 22) HE2
GLU( 3 B 28) HE2
ASP( 3 B 42) HD2
ASP( 3 B 49) HD2
HIS( 3 B 50) HD1
GLU( 3 B 62) HE2
GLU( 3 B 63) HE2
ASP( 3 B 69) HD2
GLU( 3 B 76) HE2
HIS( 3 B 77) HD1
HIS( 3 B 78) HE2
HIS( 3 B 79) HE2
HIS( 3 B 80) HD1
HIS( 3 B 81) HE2
HIS( 3 B 82) HD1
GLU( 4 A 6) HE2
GLU( 4 A 10) HE2
GLU( 4 A 12) HE2
GLU( 4 A 13) HE2
HIS( 4 A 14) HE2
GLU( 4 A 20) HE2
GLU( 4 A 22) HE2
GLU( 4 A 28) HE2
ASP( 4 A 42) HD2
ASP( 4 A 49) HD2
HIS( 4 A 50) HE2
GLU( 4 A 62) HE2
GLU( 4 A 63) HE2
ASP( 4 A 69) HD2
GLU( 4 A 76) HE2
HIS( 4 A 77) HE2
HIS( 4 A 78) HD1
HIS( 4 A 79) HE2
HIS( 4 A 80) HD1
HIS( 4 A 81) HE2
HIS( 4 A 82) HE2
GLU( 4 B 6) HE2
GLU( 4 B 10) HE2
GLU( 4 B 12) HE2
GLU( 4 B 13) HE2
HIS( 4 B 14) HE2
GLU( 4 B 20) HE2
GLU( 4 B 22) HE2
GLU( 4 B 28) HE2
ASP( 4 B 42) HD2
ASP( 4 B 49) HD2
HIS( 4 B 50) HE2
GLU( 4 B 62) HE2
GLU( 4 B 63) HE2
ASP( 4 B 69) HD2
GLU( 4 B 76) HE2
HIS( 4 B 77) HE2
HIS( 4 B 78) HD1
HIS( 4 B 79) HE2
HIS( 4 B 80) HD1
HIS( 4 B 81) HE2
HIS( 4 B 82) HE2
GLU( 5 A 6) HE2
GLU( 5 A 10) HE2
GLU( 5 A 12) HE2
GLU( 5 A 13) HE2
HIS( 5 A 14) HD1
GLU( 5 A 20) HE2
GLU( 5 A 22) HE2
GLU( 5 A 28) HE2
ASP( 5 A 42) HD2
ASP( 5 A 49) HD2
HIS( 5 A 50) HE2
GLU( 5 A 62) HE2
GLU( 5 A 63) HE2
ASP( 5 A 69) HD2
GLU( 5 A 76) HE2
HIS( 5 A 77) HE2
HIS( 5 A 78) HE2
HIS( 5 A 79) HE2
HIS( 5 A 80) HD1
HIS( 5 A 81) HD1
HIS( 5 A 82) HE2
GLU( 5 B 6) HE2
GLU( 5 B 10) HE2
GLU( 5 B 12) HE2
GLU( 5 B 13) HE2
HIS( 5 B 14) HD1
GLU( 5 B 20) HE2
GLU( 5 B 22) HE2
GLU( 5 B 28) HE2
ASP( 5 B 42) HD2
ASP( 5 B 49) HD2
HIS( 5 B 50) HE2
GLU( 5 B 62) HE2
GLU( 5 B 63) HE2
ASP( 5 B 69) HD2
GLU( 5 B 76) HE2
HIS( 5 B 77) HE2
HIS( 5 B 78) HE2
HIS( 5 B 79) HE2
HIS( 5 B 80) HD1
HIS( 5 B 81) HD1
HIS( 5 B 82) HE2
GLU( 6 A 6) HE2
GLU( 6 A 10) HE2
GLU( 6 A 12) HE2
GLU( 6 A 13) HE2
HIS( 6 A 14) HE2
GLU( 6 A 20) HE2
GLU( 6 A 22) HE2
GLU( 6 A 28) HE2
ASP( 6 A 42) HD2
ASP( 6 A 49) HD2
HIS( 6 A 50) HE2
GLU( 6 A 62) HE2
GLU( 6 A 63) HE2
ASP( 6 A 69) HD2
GLU( 6 A 76) HE2
HIS( 6 A 77) HE2
HIS( 6 A 78) HD1
HIS( 6 A 79) HE2
HIS( 6 A 80) HD1
HIS( 6 A 81) HE2
HIS( 6 A 82) HE2
GLU( 6 B 6) HE2
GLU( 6 B 10) HE2
GLU( 6 B 12) HE2
GLU( 6 B 13) HE2
HIS( 6 B 14) HE2
GLU( 6 B 20) HE2
GLU( 6 B 22) HE2
GLU( 6 B 28) HE2
ASP( 6 B 42) HD2
ASP( 6 B 49) HD2
HIS( 6 B 50) HE2
GLU( 6 B 62) HE2
GLU( 6 B 63) HE2
ASP( 6 B 69) HD2
GLU( 6 B 76) HE2
HIS( 6 B 77) HE2
HIS( 6 B 78) HD1
HIS( 6 B 79) HE2
HIS( 6 B 80) HD1
HIS( 6 B 81) HE2
HIS( 6 B 82) HE2
GLU( 7 A 6) HE2
GLU( 7 A 10) HE2
GLU( 7 A 12) HE2
GLU( 7 A 13) HE2
HIS( 7 A 14) HD1
GLU( 7 A 20) HE2
GLU( 7 A 22) HE2
GLU( 7 A 28) HE2
ASP( 7 A 42) HD2
ASP( 7 A 49) HD2
HIS( 7 A 50) HD1
GLU( 7 A 62) HE2
GLU( 7 A 63) HE2
ASP( 7 A 69) HD2
GLU( 7 A 76) HE2
HIS( 7 A 77) HE2
HIS( 7 A 78) HD1
HIS( 7 A 79) HD1
HIS( 7 A 80) HD1
HIS( 7 A 81) HE2
HIS( 7 A 82) HE2
GLU( 7 B 6) HE2
GLU( 7 B 10) HE2
GLU( 7 B 12) HE2
GLU( 7 B 13) HE2
HIS( 7 B 14) HD1
GLU( 7 B 20) HE2
GLU( 7 B 22) HE2
GLU( 7 B 28) HE2
ASP( 7 B 42) HD2
ASP( 7 B 49) HD2
HIS( 7 B 50) HD1
GLU( 7 B 62) HE2
GLU( 7 B 63) HE2
ASP( 7 B 69) HD2
GLU( 7 B 76) HE2
HIS( 7 B 77) HE2
HIS( 7 B 78) HD1
HIS( 7 B 79) HD1
HIS( 7 B 80) HD1
HIS( 7 B 81) HE2
HIS( 7 B 82) HE2
GLU( 8 A 6) HE2
GLU( 8 A 10) HE2
GLU( 8 A 12) HE2
GLU( 8 A 13) HE2
HIS( 8 A 14) HD1
GLU( 8 A 20) HE2
GLU( 8 A 22) HE2
GLU( 8 A 28) HE2
ASP( 8 A 42) HD2
ASP( 8 A 49) HD2
HIS( 8 A 50) HD1
GLU( 8 A 62) HE2
GLU( 8 A 63) HE2
ASP( 8 A 69) HD2
GLU( 8 A 76) HE2
HIS( 8 A 77) HD1
HIS( 8 A 78) HD1
HIS( 8 A 79) HE2
HIS( 8 A 80) HD1
HIS( 8 A 81) HD1
HIS( 8 A 82) HE2
GLU( 8 B 6) HE2
GLU( 8 B 10) HE2
GLU( 8 B 12) HE2
GLU( 8 B 13) HE2
HIS( 8 B 14) HD1
GLU( 8 B 20) HE2
GLU( 8 B 22) HE2
GLU( 8 B 28) HE2
ASP( 8 B 42) HD2
ASP( 8 B 49) HD2
HIS( 8 B 50) HD1
GLU( 8 B 62) HE2
GLU( 8 B 63) HE2
ASP( 8 B 69) HD2
GLU( 8 B 76) HE2
HIS( 8 B 77) HD1
HIS( 8 B 78) HD1
HIS( 8 B 79) HE2
HIS( 8 B 80) HD1
HIS( 8 B 81) HD1
HIS( 8 B 82) HE2
GLU( 9 A 6) HE2
GLU( 9 A 10) HE2
GLU( 9 A 12) HE2
GLU( 9 A 13) HE2
HIS( 9 A 14) HD1
GLU( 9 A 20) HE2
GLU( 9 A 22) HE2
GLU( 9 A 28) HE2
ASP( 9 A 42) HD2
ASP( 9 A 49) HD2
HIS( 9 A 50) HD1
GLU( 9 A 62) HE2
GLU( 9 A 63) HE2
ASP( 9 A 69) HD2
GLU( 9 A 76) HE2
HIS( 9 A 77) HE2
HIS( 9 A 78) HD1
HIS( 9 A 79) HE2
HIS( 9 A 80) HD1
HIS( 9 A 81) HD1
HIS( 9 A 82) HE2
GLU( 9 B 6) HE2
GLU( 9 B 10) HE2
GLU( 9 B 12) HE2
GLU( 9 B 13) HE2
HIS( 9 B 14) HD1
GLU( 9 B 20) HE2
GLU( 9 B 22) HE2
GLU( 9 B 28) HE2
ASP( 9 B 42) HD2
ASP( 9 B 49) HD2
HIS( 9 B 50) HD1
GLU( 9 B 62) HE2
GLU( 9 B 63) HE2
ASP( 9 B 69) HD2
GLU( 9 B 76) HE2
HIS( 9 B 77) HE2
HIS( 9 B 78) HD1
HIS( 9 B 79) HE2
HIS( 9 B 80) HD1
HIS( 9 B 81) HD1
HIS( 9 B 82) HE2
GLU( 10 A 6) HE2
GLU( 10 A 10) HE2
GLU( 10 A 12) HE2
GLU( 10 A 13) HE2
HIS( 10 A 14) HE2
GLU( 10 A 20) HE2
GLU( 10 A 22) HE2
GLU( 10 A 28) HE2
ASP( 10 A 42) HD2
ASP( 10 A 49) HD2
HIS( 10 A 50) HE2
GLU( 10 A 62) HE2
GLU( 10 A 63) HE2
ASP( 10 A 69) HD2
GLU( 10 A 76) HE2
HIS( 10 A 77) HD1
HIS( 10 A 78) HE2
HIS( 10 A 79) HE2
HIS( 10 A 80) HD1
HIS( 10 A 81) HD1
HIS( 10 A 82) HE2
GLU( 10 B 6) HE2
GLU( 10 B 10) HE2
GLU( 10 B 12) HE2
GLU( 10 B 13) HE2
HIS( 10 B 14) HE2
GLU( 10 B 20) HE2
GLU( 10 B 22) HE2
GLU( 10 B 28) HE2
ASP( 10 B 42) HD2
ASP( 10 B 49) HD2
HIS( 10 B 50) HE2
GLU( 10 B 62) HE2
GLU( 10 B 63) HE2
ASP( 10 B 69) HD2
GLU( 10 B 76) HE2
HIS( 10 B 77) HD1
HIS( 10 B 78) HE2
HIS( 10 B 79) HE2
HIS( 10 B 80) HD1
HIS( 10 B 81) HD1
HIS( 10 B 82) HE2
GLU( 11 A 6) HE2
GLU( 11 A 10) HE2
GLU( 11 A 12) HE2
GLU( 11 A 13) HE2
HIS( 11 A 14) HD1
GLU( 11 A 20) HE2
GLU( 11 A 22) HE2
GLU( 11 A 28) HE2
ASP( 11 A 42) HD2
ASP( 11 A 49) HD2
HIS( 11 A 50) HD1
GLU( 11 A 62) HE2
GLU( 11 A 63) HE2
ASP( 11 A 69) HD2
GLU( 11 A 76) HE2
HIS( 11 A 77) HE2
HIS( 11 A 78) HE2
HIS( 11 A 79) HE2
HIS( 11 A 80) HE2
HIS( 11 A 81) HD1
HIS( 11 A 82) HD1
GLU( 11 B 6) HE2
GLU( 11 B 10) HE2
GLU( 11 B 12) HE2
GLU( 11 B 13) HE2
HIS( 11 B 14) HD1
GLU( 11 B 20) HE2
GLU( 11 B 22) HE2
GLU( 11 B 28) HE2
ASP( 11 B 42) HD2
ASP( 11 B 49) HD2
HIS( 11 B 50) HD1
GLU( 11 B 62) HE2
GLU( 11 B 63) HE2
ASP( 11 B 69) HD2
GLU( 11 B 76) HE2
HIS( 11 B 77) HE2
HIS( 11 B 78) HE2
HIS( 11 B 79) HE2
HIS( 11 B 80) HE2
HIS( 11 B 81) HD1
HIS( 11 B 82) HD1
GLU( 12 A 6) HE2
GLU( 12 A 10) HE2
GLU( 12 A 12) HE2
GLU( 12 A 13) HE2
HIS( 12 A 14) HD1
GLU( 12 A 20) HE2
GLU( 12 A 22) HE2
GLU( 12 A 28) HE2
ASP( 12 A 42) HD2
ASP( 12 A 49) HD2
HIS( 12 A 50) HE2
GLU( 12 A 62) HE2
GLU( 12 A 63) HE2
ASP( 12 A 69) HD2
GLU( 12 A 76) HE2
HIS( 12 A 77) HD1
HIS( 12 A 78) HD1
HIS( 12 A 79) HE2
HIS( 12 A 80) HD1
HIS( 12 A 81) HE2
HIS( 12 A 82) HE2
GLU( 12 B 6) HE2
GLU( 12 B 10) HE2
GLU( 12 B 12) HE2
GLU( 12 B 13) HE2
HIS( 12 B 14) HD1
GLU( 12 B 20) HE2
GLU( 12 B 22) HE2
GLU( 12 B 28) HE2
ASP( 12 B 42) HD2
ASP( 12 B 49) HD2
HIS( 12 B 50) HE2
GLU( 12 B 62) HE2
GLU( 12 B 63) HE2
ASP( 12 B 69) HD2
GLU( 12 B 76) HE2
HIS( 12 B 77) HD1
HIS( 12 B 78) HD1
HIS( 12 B 79) HE2
HIS( 12 B 80) HD1
HIS( 12 B 81) HE2
HIS( 12 B 82) HE2
GLU( 13 A 6) HE2
GLU( 13 A 10) HE2
GLU( 13 A 12) HE2
GLU( 13 A 13) HE2
HIS( 13 A 14) HD1
GLU( 13 A 20) HE2
GLU( 13 A 22) HE2
GLU( 13 A 28) HE2
ASP( 13 A 42) HD2
ASP( 13 A 49) HD2
HIS( 13 A 50) HD1
GLU( 13 A 62) HE2
GLU( 13 A 63) HE2
ASP( 13 A 69) HD2
GLU( 13 A 76) HE2
HIS( 13 A 77) HD1
HIS( 13 A 78) HD1
HIS( 13 A 79) HD1
HIS( 13 A 80) HD1
HIS( 13 A 81) HD1
HIS( 13 A 82) HE2
GLU( 13 B 6) HE2
GLU( 13 B 10) HE2
GLU( 13 B 12) HE2
GLU( 13 B 13) HE2
HIS( 13 B 14) HD1
GLU( 13 B 20) HE2
GLU( 13 B 22) HE2
GLU( 13 B 28) HE2
ASP( 13 B 42) HD2
ASP( 13 B 49) HD2
HIS( 13 B 50) HD1
GLU( 13 B 62) HE2
GLU( 13 B 63) HE2
ASP( 13 B 69) HD2
GLU( 13 B 76) HE2
HIS( 13 B 77) HD1
HIS( 13 B 78) HD1
HIS( 13 B 79) HD1
HIS( 13 B 80) HD1
HIS( 13 B 81) HD1
HIS( 13 B 82) HE2
GLU( 14 A 6) HE2
GLU( 14 A 10) HE2
GLU( 14 A 12) HE2
GLU( 14 A 13) HE2
HIS( 14 A 14) HD1
GLU( 14 A 20) HE2
GLU( 14 A 22) HE2
GLU( 14 A 28) HE2
ASP( 14 A 42) HD2
ASP( 14 A 49) HD2
HIS( 14 A 50) HE2
GLU( 14 A 62) HE2
GLU( 14 A 63) HE2
ASP( 14 A 69) HD2
GLU( 14 A 76) HE2
HIS( 14 A 77) HD1
HIS( 14 A 78) HD1
HIS( 14 A 79) HD1
HIS( 14 A 80) HE2
HIS( 14 A 81) HE2
HIS( 14 A 82) HD1
GLU( 14 B 6) HE2
GLU( 14 B 10) HE2
GLU( 14 B 12) HE2
GLU( 14 B 13) HE2
HIS( 14 B 14) HD1
GLU( 14 B 20) HE2
GLU( 14 B 22) HE2
GLU( 14 B 28) HE2
ASP( 14 B 42) HD2
ASP( 14 B 49) HD2
HIS( 14 B 50) HE2
GLU( 14 B 62) HE2
GLU( 14 B 63) HE2
ASP( 14 B 69) HD2
GLU( 14 B 76) HE2
HIS( 14 B 77) HD1
HIS( 14 B 78) HD1
HIS( 14 B 79) HD1
HIS( 14 B 80) HE2
HIS( 14 B 81) HE2
HIS( 14 B 82) HD1
GLU( 15 A 6) HE2
GLU( 15 A 10) HE2
GLU( 15 A 12) HE2
GLU( 15 A 13) HE2
HIS( 15 A 14) HE2
GLU( 15 A 20) HE2
GLU( 15 A 22) HE2
GLU( 15 A 28) HE2
ASP( 15 A 42) HD2
ASP( 15 A 49) HD2
HIS( 15 A 50) HE2
GLU( 15 A 62) HE2
GLU( 15 A 63) HE2
ASP( 15 A 69) HD2
GLU( 15 A 76) HE2
HIS( 15 A 77) HE2
HIS( 15 A 78) HE2
HIS( 15 A 79) HD1
HIS( 15 A 80) HD1
HIS( 15 A 81) HE2
HIS( 15 A 82) HD1
GLU( 15 B 6) HE2
GLU( 15 B 10) HE2
GLU( 15 B 12) HE2
GLU( 15 B 13) HE2
HIS( 15 B 14) HE2
GLU( 15 B 20) HE2
GLU( 15 B 22) HE2
GLU( 15 B 28) HE2
ASP( 15 B 42) HD2
ASP( 15 B 49) HD2
HIS( 15 B 50) HE2
GLU( 15 B 62) HE2
GLU( 15 B 63) HE2
ASP( 15 B 69) HD2
GLU( 15 B 76) HE2
HIS( 15 B 77) HE2
HIS( 15 B 78) HE2
HIS( 15 B 79) HD1
HIS( 15 B 80) HD1
HIS( 15 B 81) HE2
HIS( 15 B 82) HD1
GLU( 16 A 6) HE2
GLU( 16 A 10) HE2
GLU( 16 A 12) HE2
GLU( 16 A 13) HE2
HIS( 16 A 14) HE2
GLU( 16 A 20) HE2
GLU( 16 A 22) HE2
GLU( 16 A 28) HE2
ASP( 16 A 42) HD2
ASP( 16 A 49) HD2
HIS( 16 A 50) HD1
GLU( 16 A 62) HE2
GLU( 16 A 63) HE2
ASP( 16 A 69) HD2
GLU( 16 A 76) HE2
HIS( 16 A 77) HE2
HIS( 16 A 78) HE2
HIS( 16 A 79) HE2
HIS( 16 A 80) HE2
HIS( 16 A 81) HD1
HIS( 16 A 82) HE2
GLU( 16 B 6) HE2
GLU( 16 B 10) HE2
GLU( 16 B 12) HE2
GLU( 16 B 13) HE2
HIS( 16 B 14) HE2
GLU( 16 B 20) HE2
GLU( 16 B 22) HE2
GLU( 16 B 28) HE2
ASP( 16 B 42) HD2
ASP( 16 B 49) HD2
HIS( 16 B 50) HD1
GLU( 16 B 62) HE2
GLU( 16 B 63) HE2
ASP( 16 B 69) HD2
GLU( 16 B 76) HE2
HIS( 16 B 77) HE2
HIS( 16 B 78) HE2
HIS( 16 B 79) HE2
HIS( 16 B 80) HE2
HIS( 16 B 81) HD1
HIS( 16 B 82) HE2
GLU( 17 A 6) HE2
GLU( 17 A 10) HE2
GLU( 17 A 12) HE2
GLU( 17 A 13) HE2
HIS( 17 A 14) HE2
GLU( 17 A 20) HE2
GLU( 17 A 22) HE2
GLU( 17 A 28) HE2
ASP( 17 A 42) HD2
ASP( 17 A 49) HD2
HIS( 17 A 50) HD1
GLU( 17 A 62) HE2
GLU( 17 A 63) HE2
ASP( 17 A 69) HD2
GLU( 17 A 76) HE2
HIS( 17 A 77) HD1
HIS( 17 A 78) HE2
HIS( 17 A 79) HD1
HIS( 17 A 80) HD1
HIS( 17 A 81) HD1
HIS( 17 A 82) HD1
GLU( 17 B 6) HE2
GLU( 17 B 10) HE2
GLU( 17 B 12) HE2
GLU( 17 B 13) HE2
HIS( 17 B 14) HE2
GLU( 17 B 20) HE2
GLU( 17 B 22) HE2
GLU( 17 B 28) HE2
ASP( 17 B 42) HD2
ASP( 17 B 49) HD2
HIS( 17 B 50) HD1
GLU( 17 B 62) HE2
GLU( 17 B 63) HE2
ASP( 17 B 69) HD2
GLU( 17 B 76) HE2
HIS( 17 B 77) HD1
HIS( 17 B 78) HE2
HIS( 17 B 79) HD1
HIS( 17 B 80) HD1
HIS( 17 B 81) HD1
HIS( 17 B 82) HD1
GLU( 18 A 6) HE2
GLU( 18 A 10) HE2
GLU( 18 A 12) HE2
GLU( 18 A 13) HE2
HIS( 18 A 14) HD1
GLU( 18 A 20) HE2
GLU( 18 A 22) HE2
GLU( 18 A 28) HE2
ASP( 18 A 42) HD2
ASP( 18 A 49) HD2
HIS( 18 A 50) HD1
GLU( 18 A 62) HE2
GLU( 18 A 63) HE2
ASP( 18 A 69) HD2
GLU( 18 A 76) HE2
HIS( 18 A 77) HD1
HIS( 18 A 78) HD1
HIS( 18 A 79) HE2
HIS( 18 A 80) HE2
HIS( 18 A 81) HD1
HIS( 18 A 82) HD1
GLU( 18 B 6) HE2
GLU( 18 B 10) HE2
GLU( 18 B 12) HE2
GLU( 18 B 13) HE2
HIS( 18 B 14) HD1
GLU( 18 B 20) HE2
GLU( 18 B 22) HE2
GLU( 18 B 28) HE2
ASP( 18 B 42) HD2
ASP( 18 B 49) HD2
HIS( 18 B 50) HD1
GLU( 18 B 62) HE2
GLU( 18 B 63) HE2
ASP( 18 B 69) HD2
GLU( 18 B 76) HE2
HIS( 18 B 77) HD1
HIS( 18 B 78) HD1
HIS( 18 B 79) HE2
HIS( 18 B 80) HE2
HIS( 18 B 81) HD1
HIS( 18 B 82) HD1
GLU( 19 A 6) HE2
GLU( 19 A 10) HE2
GLU( 19 A 12) HE2
GLU( 19 A 13) HE2
HIS( 19 A 14) HE2
GLU( 19 A 20) HE2
GLU( 19 A 22) HE2
GLU( 19 A 28) HE2
ASP( 19 A 42) HD2
ASP( 19 A 49) HD2
HIS( 19 A 50) HD1
GLU( 19 A 62) HE2
GLU( 19 A 63) HE2
ASP( 19 A 69) HD2
GLU( 19 A 76) HE2
HIS( 19 A 77) HD1
HIS( 19 A 78) HE2
HIS( 19 A 79) HD1
HIS( 19 A 80) HE2
HIS( 19 A 81) HE2
HIS( 19 A 82) HE2
GLU( 19 B 6) HE2
GLU( 19 B 10) HE2
GLU( 19 B 12) HE2
GLU( 19 B 13) HE2
HIS( 19 B 14) HE2
GLU( 19 B 20) HE2
GLU( 19 B 22) HE2
GLU( 19 B 28) HE2
ASP( 19 B 42) HD2
ASP( 19 B 49) HD2
HIS( 19 B 50) HD1
GLU( 19 B 62) HE2
GLU( 19 B 63) HE2
ASP( 19 B 69) HD2
GLU( 19 B 76) HE2
HIS( 19 B 77) HD1
HIS( 19 B 78) HE2
HIS( 19 B 79) HD1
HIS( 19 B 80) HE2
HIS( 19 B 81) HE2
HIS( 19 B 82) HE2
GLU( 20 A 6) HE2
GLU( 20 A 10) HE2
GLU( 20 A 12) HE2
GLU( 20 A 13) HE2
HIS( 20 A 14) HD1
GLU( 20 A 20) HE2
GLU( 20 A 22) HE2
GLU( 20 A 28) HE2
ASP( 20 A 42) HD2
ASP( 20 A 49) HD2
HIS( 20 A 50) HE2
GLU( 20 A 62) HE2
GLU( 20 A 63) HE2
ASP( 20 A 69) HD2
GLU( 20 A 76) HE2
HIS( 20 A 77) HE2
HIS( 20 A 78) HE2
HIS( 20 A 79) HD1
HIS( 20 A 80) HD1
HIS( 20 A 81) HE2
HIS( 20 A 82) HE2
GLU( 20 B 6) HE2
GLU( 20 B 10) HE2
GLU( 20 B 12) HE2
GLU( 20 B 13) HE2
HIS( 20 B 14) HD1
GLU( 20 B 20) HE2
GLU( 20 B 22) HE2
GLU( 20 B 28) HE2
ASP( 20 B 42) HD2
ASP( 20 B 49) HD2
HIS( 20 B 50) HE2
GLU( 20 B 62) HE2
GLU( 20 B 63) HE2
ASP( 20 B 69) HD2
GLU( 20 B 76) HE2
HIS( 20 B 77) HE2
HIS( 20 B 78) HE2
HIS( 20 B 79) HD1
HIS( 20 B 80) HD1
HIS( 20 B 81) HE2
HIS( 20 B 82) HE2
==> The following residues have extra atoms:
RES MOD#C SEQ ATOMS
HIS( 1 A 82) O2
HIS( 1 B 82) O2
HIS( 2 A 82) O2
HIS( 2 B 82) O2
HIS( 3 A 82) O2
HIS( 3 B 82) O2
HIS( 4 A 82) O2
HIS( 4 B 82) O2
HIS( 5 A 82) O2
HIS( 5 B 82) O2
HIS( 6 A 82) O2
HIS( 6 B 82) O2
HIS( 7 A 82) O2
HIS( 7 B 82) O2
HIS( 8 A 82) O2
HIS( 8 B 82) O2
HIS( 9 A 82) O2
HIS( 9 B 82) O2
HIS( 10 A 82) O2
HIS( 10 B 82) O2
HIS( 11 A 82) O2
HIS( 11 B 82) O2
HIS( 12 A 82) O2
HIS( 12 B 82) O2
HIS( 13 A 82) O2
HIS( 13 B 82) O2
HIS( 14 A 82) O2
HIS( 14 B 82) O2
HIS( 15 A 82) O2
HIS( 15 B 82) O2
HIS( 16 A 82) O2
HIS( 16 B 82) O2
HIS( 17 A 82) O2
HIS( 17 B 82) O2
HIS( 18 A 82) O2
HIS( 18 B 82) O2
HIS( 19 A 82) O2
HIS( 19 B 82) O2
HIS( 20 A 82) O2
HIS( 20 B 82) O2
SPR104_R3_em_bcr3.pdb: Missing KEYWDS records
SPR104_R3_em_bcr3.pdb: Missing TITLE record