Detailed results of SPR104_R3Cons_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
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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.15 0.00 0.00 - 1 [ 0.15 .. 0.15]
21-> MET A 4 HN - MET A 4 HB* [ 1.80 3.18] 0.00 0.06 0.09 0.05 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.16 0.00 0.09 0.00 0.00 0.00 - 6 [ 0.05 .. 0.16]
24-> ALA A 5 HB* - GLU A 6 HN [ 1.80 3.60] 0.00 0.11 0.00 0.00 0.00 0.00 0.11 0.09 0.06 0.00 0.00 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.05 0.10 - 7 [ 0.05 .. 0.11]
34-> PHE A 7 HA - ASN A 35 HD2* [ 1.80 4.47] 0.00 0.00 0.00 0.05 0.00 0.04 0.00 0.00 0.08 0.00 0.00 0.00 0.13 0.00 0.00 0.00 0.01 0.00 0.00 0.00 - 5 [ 0.01 .. 0.13]
41-> PHE A 7 HN - PHE A 7 HB* [ 1.80 3.25] 0.00 0.00 0.12 0.05 0.00 0.00 0.00 0.05 0.00 0.00 0.00 0.02 0.00 0.01 0.00 0.00 0.00 0.05 0.00 0.00 - 6 [ 0.01 .. 0.12]
47-> THR A 8 HG2* - ASN A 35 HN [ 1.80 4.80] 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.11 - 4 [ 0.08 .. 0.11]
51-> THR A 8 HN - ASN A 35 HA [ 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 0.11 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.00 .. 0.11]
53-> THR A 8 HN - ASN A 35 HN [ 1.80 4.10] 0.00 0.00 0.08 0.02 0.00 0.04 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.03 0.00 - 7 [ 0.00 .. 0.12]
141-> GLU A 13 HB* - ALA A 39 HB* [ 1.80 5.40] 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 0.17 0.00 0.00 0.00 0.00 - 1 [ 0.17 .. 0.17]
178-> LEU A 15 HD1* - PHE A 41 HA [ 1.80 4.80] 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 0.00 0.00 0.00 0.00 - 1 [ 0.49 .. 0.49]
186-> LEU A 15 HD2* - PHE A 64 HD* [ 1.80 5.60] 0.12 0.13 0.10 0.12 0.00 0.24 0.05 0.08 0.07 0.00 0.05 0.11 0.02 0.03 0.07 0.08 0.10 0.08 0.56 0.05 - 19 [ 0.00 .. 0.56]
200-> LEU A 16 HD1* - THR A 17 HN [ 1.80 4.80] 0.00 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.11 0.00 0.00 0.00 0.06 0.00 0.14 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.06 .. 0.14]
202-> LEU A 16 HD1* - ILE A 29 HD1* [ 1.80 4.30] 0.00 0.00 0.09 0.00 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.11 0.00 0.00 0.00 - 3 [ 0.07 .. 0.11]
220-> THR A 17 HG2* - ILE A 29 HN [ 1.80 5.18] 0.00 0.00 0.00 0.08 0.00 0.00 0.06 0.03 0.02 0.00 0.00 0.02 0.11 0.00 0.08 0.00 0.03 0.00 0.00 0.00 - 8 [ 0.02 .. 0.11]
243-> LEU A 18 HG - LYS A 27 HG* [ 1.80 5.01] 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 0.00 0.00 - 2 [ 0.00 .. 0.78]
289-> GLY A 24 HA2 - PRO A 48 HG* [ 1.80 6.05] 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 0.00 - 1 [ 0.13 .. 0.13]
309-> TRP A 25 HZ2 - LYS A 52 HD3 [ 1.80 4.43] 0.02 0.00 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.03 0.00 0.00 0.06 0.00 0.13 0.00 0.00 0.00 0.03 0.00 - 6 [ 0.02 .. 0.13]
327-> LYS A 27 HB* - LYS A 27 HE* [ 1.80 3.37] 0.00 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.00 .. 0.28]
332-> LYS A 27 HG* - ARG A 44 HA [ 1.80 5.13] 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.08 0.00 0.00 - 3 [ 0.01 .. 0.11]
345-> GLU A 28 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 0.00 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.11 .. 0.11]
401-> ARG A 31 HN - ARG A 31 HG* [ 1.80 4.04] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.11 .. 0.11]
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 0.17 0.00 0.00 0.00 0.00 0.13 0.00 0.00 0.00 0.02 - 3 [ 0.02 .. 0.17]
441-> ALA A 37 HA - PRO A 38 HD* [ 1.80 3.34] 0.00 0.00 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.21 0.25 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.26 0.14 - 6 [ 0.14 .. 0.26]
520-> ILE A 43 HN - THR A 58 HG2* [ 1.80 5.29] 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.11 0.02 0.01 0.00 0.00 0.00 0.00 0.00 0.05 - 7 [ 0.00 .. 0.11]
529-> ALA A 45 HB* - GLY A 54 HA* [ 1.80 4.30] 0.15 0.00 0.10 0.00 0.00 0.00 0.01 0.08 0.00 0.00 0.00 0.00 0.06 0.01 0.00 0.00 0.08 0.00 0.00 0.05 - 8 [ 0.01 .. 0.15]
558-> LYS A 52 HB2 - MET A 53 HN [ 1.80 4.04] 0.00 0.00 0.00 0.10 0.15 0.00 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.00 - 4 [ 0.01 .. 0.15]
586-> LYS A 55 HN - LYS A 55 HD* [ 1.80 4.58] 0.18 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 0.00 0.00 0.07 0.00 0.00 0.00 - 3 [ 0.07 .. 0.21]
587-> LYS A 55 HN - LYS A 55 HG* [ 1.80 3.87] 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 0.00 0.00 0.00 0.00 - 1 [ 0.10 .. 0.10]
676-> GLN A 65 HA - VAL A 68 HG1* [ 1.80 4.23] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.08 0.00 0.00 0.00 0.21 0.00 0.00 0.00 0.00 - 2 [ 0.08 .. 0.21]
709-> MET A 67 HE* - VAL A 68 HG2* [ 1.80 3.40] 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 0.00 0.12 - 1 [ 0.12 .. 0.12]
749-> PHE A 71 HD* - LEU A 75 HB* [ 1.80 4.88] 0.00 0.00 0.00 0.00 0.00 0.02 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 - 2 [ 0.02 .. 0.10]
770-> ASN A 74 HB2 - LEU A 75 HN [ 1.80 4.48] 0.00 0.24 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 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.24 .. 0.24]
797-> HIS A 81 HN - HIS A 81 HB* [ 1.80 3.29] 0.00 0.00 0.00 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.09 - 2 [ 0.09 .. 0.14]
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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.15 0.00 0.00 - 1 [ 0.15 .. 0.15]
819-> MET B 4 HN - MET B 4 HB* [ 1.80 3.18] 0.00 0.06 0.09 0.05 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.16 0.00 0.09 0.00 0.00 0.00 - 6 [ 0.05 .. 0.16]
822-> ALA B 5 HB* - GLU B 6 HN [ 1.80 3.60] 0.00 0.11 0.00 0.00 0.00 0.00 0.10 0.09 0.06 0.00 0.00 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.05 0.10 - 7 [ 0.05 .. 0.11]
832-> PHE B 7 HA - ASN B 35 HD2* [ 1.80 4.47] 0.00 0.00 0.00 0.05 0.00 0.04 0.00 0.00 0.08 0.00 0.00 0.00 0.12 0.00 0.00 0.00 0.01 0.00 0.00 0.00 - 5 [ 0.01 .. 0.12]
839-> PHE B 7 HN - PHE B 7 HB* [ 1.80 3.25] 0.00 0.00 0.12 0.05 0.00 0.00 0.00 0.05 0.00 0.00 0.00 0.02 0.00 0.01 0.00 0.00 0.00 0.05 0.00 0.00 - 6 [ 0.01 .. 0.12]
840-> PHE B 7 HN - PHE B 7 HD* [ 1.80 4.10] 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 0.00 0.09 0.00 0.00 0.00 0.00 - 2 [ 0.09 .. 0.18]
845-> THR B 8 HG2* - ASN B 35 HN [ 1.80 4.80] 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.11 - 4 [ 0.08 .. 0.11]
849-> THR B 8 HN - ASN B 35 HA [ 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 0.11 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.00 .. 0.11]
851-> THR B 8 HN - ASN B 35 HN [ 1.80 4.10] 0.00 0.00 0.08 0.02 0.00 0.04 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.03 0.00 - 7 [ 0.00 .. 0.12]
973-> LEU B 15 HD1* - ARG B 31 HA [ 1.80 5.07] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.10 0.00 0.00 0.00 0.00 - 2 [ 0.10 .. 0.56]
976-> LEU B 15 HD1* - PHE B 41 HA [ 1.80 4.80] 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 0.00 0.00 0.00 0.00 - 1 [ 0.49 .. 0.49]
984-> LEU B 15 HD2* - PHE B 64 HD* [ 1.80 5.60] 0.12 0.13 0.10 0.12 0.00 0.24 0.05 0.08 0.07 0.00 0.05 0.11 0.02 0.03 0.07 0.08 0.10 0.08 0.56 0.05 - 19 [ 0.00 .. 0.56]
998-> LEU B 16 HD1* - THR B 17 HN [ 1.80 4.80] 0.00 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.11 0.00 0.00 0.00 0.06 0.00 0.14 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.06 .. 0.14]
1000-> LEU B 16 HD1* - ILE B 29 HD1* [ 1.80 4.30] 0.00 0.00 0.09 0.00 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.11 0.00 0.00 0.00 - 3 [ 0.07 .. 0.11]
1002-> LEU B 16 HD2* - ILE B 29 HB [ 1.80 4.49] 0.00 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.24 0.00 0.00 0.00 0.36 0.00 0.31 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.24 .. 0.36]
1018-> THR B 17 HG2* - ILE B 29 HN [ 1.80 5.18] 0.00 0.00 0.00 0.08 0.00 0.00 0.06 0.03 0.02 0.00 0.00 0.02 0.11 0.00 0.08 0.00 0.03 0.00 0.00 0.00 - 8 [ 0.02 .. 0.11]
1033-> LEU B 18 HD1* - LYS B 27 HB2 [ 1.80 4.80] 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.00 0.00 0.00 0.24 0.24 0.02 0.16 0.00 0.00 0.00 0.00 - 6 [ 0.02 .. 0.28]
1041-> LEU B 18 HG - LYS B 27 HG* [ 1.80 5.01] 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 0.00 0.00 - 2 [ 0.00 .. 0.78]
1087-> GLY B 24 HA2 - PRO B 48 HG* [ 1.80 6.05] 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 0.00 - 1 [ 0.13 .. 0.13]
1107-> TRP B 25 HZ2 - LYS B 52 HD3 [ 1.80 4.43] 0.02 0.00 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.03 0.00 0.00 0.06 0.00 0.13 0.00 0.00 0.00 0.03 0.00 - 6 [ 0.02 .. 0.13]
1125-> LYS B 27 HB* - LYS B 27 HE* [ 1.80 3.37] 0.00 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.00 .. 0.28]
1130-> LYS B 27 HG* - ARG B 44 HA [ 1.80 5.13] 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.08 0.00 0.00 - 3 [ 0.01 .. 0.11]
1135-> LYS B 27 HN - LYS B 27 HE* [ 1.80 5.30] 0.00 0.02 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.02 .. 0.74]
1143-> GLU B 28 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 0.00 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.11 .. 0.11]
1199-> ARG B 31 HN - ARG B 31 HG* [ 1.80 4.04] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.11 .. 0.11]
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 0.17 0.00 0.00 0.00 0.00 0.12 0.00 0.00 0.00 0.02 - 3 [ 0.02 .. 0.17]
1239-> ALA B 37 HA - PRO B 38 HD* [ 1.80 3.34] 0.00 0.00 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.21 0.25 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.26 0.14 - 6 [ 0.14 .. 0.26]
1318-> ILE B 43 HN - THR B 58 HG2* [ 1.80 5.29] 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.11 0.02 0.01 0.00 0.00 0.00 0.00 0.00 0.05 - 7 [ 0.00 .. 0.11]
1327-> ALA B 45 HB* - GLY B 54 HA* [ 1.80 4.30] 0.15 0.00 0.10 0.00 0.00 0.00 0.01 0.08 0.00 0.00 0.00 0.00 0.06 0.01 0.00 0.00 0.08 0.00 0.00 0.05 - 8 [ 0.01 .. 0.15]
1356-> LYS B 52 HB2 - MET B 53 HN [ 1.80 4.04] 0.00 0.00 0.00 0.10 0.15 0.00 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.00 - 4 [ 0.01 .. 0.15]
1384-> LYS B 55 HN - LYS B 55 HD* [ 1.80 4.58] 0.18 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 0.07 0.00 0.00 0.00 - 3 [ 0.07 .. 0.22]
1385-> LYS B 55 HN - LYS B 55 HG* [ 1.80 3.87] 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 0.00 0.00 0.00 0.00 - 1 [ 0.10 .. 0.10]
1474-> GLN B 65 HA - VAL B 68 HG1* [ 1.80 4.23] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.08 0.00 0.00 0.00 0.21 0.00 0.00 0.00 0.00 - 2 [ 0.08 .. 0.21]
1507-> MET B 67 HE* - VAL B 68 HG2* [ 1.80 3.40] 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 0.00 0.12 - 1 [ 0.12 .. 0.12]
1547-> PHE B 71 HD* - LEU B 75 HB* [ 1.80 4.88] 0.00 0.00 0.00 0.00 0.00 0.02 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 - 2 [ 0.02 .. 0.10]
1568-> ASN B 74 HB2 - LEU B 75 HN [ 1.80 4.48] 0.00 0.24 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 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.24 .. 0.24]
1595-> HIS B 81 HN - HIS B 81 HB* [ 1.80 3.29] 0.00 0.00 0.00 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.09 - 2 [ 0.09 .. 0.14]
1605-> LEU A 16 HD1* - MET B 67 HN [ 1.80 4.63] 0.00 0.00 0.10 0.00 0.00 0.00 0.12 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 - 3 [ 0.10 .. 0.12]
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 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 - 1 [ 0.36 .. 0.36]
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 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 - 1 [ 0.36 .. 0.36]
1735-> MET A 67 HE* - PHE B 71 HB* [ 1.80 3.77] 0.00 0.02 0.02 0.13 0.04 0.00 0.05 0.06 0.08 0.05 0.00 0.01 0.06 0.09 0.09 0.06 0.02 0.12 0.00 0.02 - 18 [ 0.00 .. 0.13]
1739-> MET A 67 HE* - LEU B 75 HD2* [ 1.80 4.20] 0.04 0.00 0.08 0.04 0.00 0.04 0.07 0.06 0.00 0.11 0.05 0.04 0.05 0.00 0.06 0.05 0.07 0.05 0.07 0.04 - 16 [ 0.04 .. 0.11]
1747-> MET A 67 HN - LEU B 16 HD1* [ 1.80 4.63] 0.00 0.00 0.10 0.00 0.00 0.00 0.12 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 - 3 [ 0.10 .. 0.12]
1751-> VAL A 68 HA - PHE B 71 HA [ 1.80 6.05] 0.00 0.09 0.08 0.07 0.06 0.00 0.01 0.00 0.09 0.13 0.00 0.07 0.00 0.00 0.12 0.00 0.01 0.09 0.00 0.11 - 13 [ 0.00 .. 0.13]
1784-> PHE A 71 HA - VAL B 68 HA [ 1.80 6.05] 0.00 0.09 0.08 0.07 0.06 0.00 0.02 0.00 0.10 0.13 0.00 0.07 0.00 0.00 0.12 0.00 0.01 0.09 0.00 0.11 - 13 [ 0.00 .. 0.13]
1786-> PHE A 71 HB* - MET B 67 HE* [ 1.80 3.77] 0.00 0.02 0.02 0.13 0.04 0.00 0.05 0.06 0.08 0.05 0.00 0.01 0.06 0.09 0.09 0.06 0.02 0.12 0.00 0.02 - 18 [ 0.00 .. 0.13]
1793-> PHE A 71 HD* - LEU B 15 HD2* [ 1.80 4.92] 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.10 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.06 0.00 0.06 0.30 - 7 [ 0.00 .. 0.63]
1836-> LEU A 75 HD2* - MET B 67 HE* [ 1.80 4.20] 0.04 0.00 0.08 0.04 0.00 0.04 0.07 0.06 0.00 0.11 0.05 0.04 0.05 0.00 0.06 0.05 0.07 0.05 0.07 0.04 - 16 [ 0.04 .. 0.11]
1848-> LEU B 15 HD2* - PHE A 71 HD* [ 1.80 4.92] 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.10 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.06 0.00 0.06 0.30 - 7 [ 0.00 .. 0.63]
1853-> LEU B 16 HD1* - MET A 67 HN [ 1.80 4.63] 0.00 0.00 0.10 0.00 0.00 0.00 0.12 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 - 3 [ 0.10 .. 0.12]
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 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 - 1 [ 0.36 .. 0.36]
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 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 - 1 [ 0.36 .. 0.36]
1983-> MET B 67 HE* - PHE A 71 HB* [ 1.80 3.77] 0.00 0.02 0.02 0.13 0.04 0.00 0.05 0.06 0.08 0.05 0.00 0.01 0.06 0.09 0.09 0.06 0.02 0.12 0.00 0.02 - 18 [ 0.00 .. 0.13]
1987-> MET B 67 HE* - LEU A 75 HD2* [ 1.80 4.20] 0.04 0.00 0.08 0.04 0.00 0.04 0.07 0.06 0.00 0.11 0.05 0.04 0.05 0.00 0.06 0.05 0.07 0.05 0.07 0.04 - 16 [ 0.04 .. 0.11]
1995-> MET B 67 HN - LEU A 16 HD1* [ 1.80 4.63] 0.00 0.00 0.10 0.00 0.00 0.00 0.12 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 - 3 [ 0.10 .. 0.12]
1999-> VAL B 68 HA - PHE A 71 HA [ 1.80 6.05] 0.00 0.09 0.08 0.07 0.06 0.00 0.02 0.00 0.10 0.13 0.00 0.07 0.00 0.00 0.12 0.00 0.01 0.09 0.00 0.11 - 13 [ 0.00 .. 0.13]
2032-> PHE B 71 HA - VAL A 68 HA [ 1.80 6.05] 0.00 0.09 0.08 0.07 0.06 0.00 0.01 0.00 0.09 0.13 0.00 0.07 0.00 0.00 0.12 0.00 0.01 0.09 0.00 0.11 - 13 [ 0.00 .. 0.13]
2034-> PHE B 71 HB* - MET A 67 HE* [ 1.80 3.77] 0.00 0.02 0.02 0.13 0.04 0.00 0.05 0.06 0.08 0.05 0.00 0.01 0.06 0.09 0.09 0.06 0.02 0.12 0.00 0.02 - 18 [ 0.00 .. 0.13]
2084-> LEU B 75 HD2* - MET A 67 HE* [ 1.80 4.20] 0.04 0.00 0.08 0.04 0.00 0.04 0.07 0.06 0.00 0.11 0.05 0.04 0.05 0.00 0.06 0.05 0.07 0.05 0.07 0.04 - 16 [ 0.04 .. 0.11]
2095-> SER A 19 HN - LYS A 27 O [ 1.70 2.30] 0.00 0.01 0.09 0.12 0.06 0.00 0.10 0.05 0.00 0.00 0.00 0.09 0.00 0.00 0.00 0.01 0.00 0.00 0.13 0.00 - 10 [ 0.00 .. 0.13]
2099-> TRP A 25 HN - ASN A 21 O [ 1.70 2.30] 0.15 0.03 0.00 0.05 0.00 0.14 0.00 0.00 0.32 0.00 0.07 0.00 0.00 0.06 0.24 0.00 0.08 0.05 0.08 0.02 - 13 [ 0.00 .. 0.32]
2137-> VAL A 68 HN - PHE A 64 O [ 1.70 2.30] 0.00 0.12 0.21 0.05 0.01 0.00 0.18 0.02 0.18 0.00 0.00 0.00 0.12 0.06 0.08 0.00 0.04 0.06 0.00 0.05 - 13 [ 0.01 .. 0.21]
2138-> VAL A 68 N - PHE A 64 O [ 2.70 3.30] 0.00 0.00 0.10 0.00 0.00 0.00 0.09 0.00 0.11 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.01 .. 0.11]
2147-> GLY A 73 HN - ASP A 69 O [ 1.70 2.30] 0.11 0.00 0.02 0.14 0.08 0.13 0.13 0.08 0.13 0.02 0.10 0.04 0.23 0.02 0.09 0.11 0.13 0.02 0.12 0.00 - 18 [ 0.02 .. 0.23]
2151-> SER B 19 HN - LYS B 27 O [ 1.70 2.30] 0.00 0.01 0.09 0.12 0.06 0.00 0.10 0.04 0.00 0.00 0.00 0.09 0.00 0.00 0.00 0.01 0.00 0.00 0.13 0.00 - 10 [ 0.00 .. 0.13]
2155-> TRP B 25 HN - ASN B 21 O [ 1.70 2.30] 0.15 0.03 0.00 0.05 0.00 0.14 0.00 0.00 0.32 0.00 0.07 0.00 0.00 0.06 0.24 0.00 0.08 0.05 0.08 0.02 - 13 [ 0.00 .. 0.32]
2193-> VAL B 68 HN - PHE B 64 O [ 1.70 2.30] 0.00 0.12 0.21 0.05 0.01 0.00 0.18 0.01 0.18 0.00 0.00 0.00 0.12 0.06 0.07 0.00 0.04 0.06 0.00 0.06 - 13 [ 0.01 .. 0.21]
2194-> VAL B 68 N - PHE B 64 O [ 2.70 3.30] 0.00 0.00 0.10 0.00 0.00 0.00 0.09 0.00 0.11 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.01 .. 0.11]
2203-> GLY B 73 HN - ASP B 69 O [ 1.70 2.30] 0.11 0.00 0.02 0.14 0.08 0.13 0.13 0.08 0.13 0.02 0.10 0.04 0.23 0.02 0.09 0.11 0.12 0.02 0.12 0.00 - 18 [ 0.02 .. 0.23]
-------------------------------------------
Number of Violations greater than 0.10 16 8 14 16 4 10 12 0 17 15 8 8 10 3 18 8 6 6 12 12
-------------------------------------------
---- 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: 15 6 12 10 2 6 12 0 14 8 6 8 6 0 14 6 6 6 4 10 7.55
0.2 - 0.5 ang: 1 2 2 4 2 4 0 0 3 4 2 0 4 3 3 2 0 0 6 2 2.20
> 0.5 ang: 0 0 0 2 0 0 0 0 0 3 0 0 0 0 1 0 0 0 2 0 0.40
Total : 91 91 88 86 91 70 97 74 94 88 87 91 85 96 84 80 108 68 90 113 88.60
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 : 0.283 0.244 0.207 0.778 0.231 0.241 0.183 0.093 0.317 0.630 0.249 0.114 0.356 0.239 0.743 0.211 0.125 0.147 0.559 0.299 0.778
Max Intra Viol : 0.179 0.063 0.123 0.277 0.000 0.215 0.058 0.051 0.113 0.049 0.075 0.030 0.000 0.033 0.743 0.091 0.092 0.049 0.078 0.092 0.743
Max Inter Viol : 0.096 0.093 0.103 0.135 0.070 0.063 0.124 0.065 0.105 0.630 0.059 0.077 0.078 0.090 0.118 0.093 0.100 0.121 0.360 0.299 0.630
Max Seque Viol : 0.084 0.244 0.069 0.099 0.231 0.083 0.105 0.093 0.109 0.207 0.249 0.058 0.092 0.204 0.145 0.061 0.000 0.147 0.263 0.145 0.263
Max Medium Viol : 0.149 0.120 0.207 0.144 0.077 0.139 0.183 0.079 0.317 0.018 0.104 0.076 0.229 0.064 0.238 0.211 0.125 0.060 0.118 0.073 0.317
Max Long Viol : 0.283 0.128 0.102 0.778 0.088 0.241 0.102 0.082 0.242 0.563 0.169 0.114 0.356 0.239 0.312 0.171 0.107 0.079 0.559 0.108 0.778
Average Violation : 0.003 0.002 0.002 0.003 0.002 0.002 0.002 0.001 0.002 0.003 0.002 0.002 0.002 0.001 0.003 0.002 0.002 0.001 0.003 0.002 0.00216
Avge Intra Viol : 0.001 0.001 0.001 0.002 0.000 0.002 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.003 0.001 0.001 0.000 0.000 0.001 0.00075
Avge Inter Viol : 0.005 0.004 0.004 0.004 0.003 0.002 0.005 0.003 0.003 0.007 0.003 0.003 0.004 0.003 0.004 0.002 0.005 0.003 0.007 0.005 0.00400
Avge Seque Viol : 0.001 0.001 0.002 0.001 0.001 0.001 0.002 0.001 0.004 0.000 0.001 0.001 0.002 0.001 0.002 0.001 0.001 0.000 0.001 0.001 0.00120
Avge Mediu Viol : 0.003 0.005 0.002 0.003 0.007 0.001 0.002 0.002 0.004 0.003 0.005 0.002 0.002 0.004 0.006 0.001 0.000 0.003 0.005 0.005 0.00330
Avge Long Viol : 0.003 0.002 0.002 0.006 0.001 0.002 0.002 0.001 0.002 0.004 0.001 0.003 0.003 0.001 0.003 0.003 0.002 0.001 0.003 0.002 0.00231
RMS Violation : 0.016 0.013 0.014 0.029 0.012 0.014 0.013 0.008 0.017 0.029 0.012 0.011 0.016 0.011 0.024 0.013 0.012 0.010 0.026 0.015 0.01694
RMS Inter : 0.018 0.014 0.017 0.017 0.013 0.011 0.018 0.012 0.015 0.044 0.011 0.013 0.015 0.012 0.018 0.011 0.017 0.016 0.036 0.025 0.01940
RMS Intra : 0.015 0.006 0.012 0.021 0.000 0.017 0.005 0.003 0.007 0.004 0.005 0.002 0.000 0.002 0.037 0.005 0.008 0.003 0.005 0.007 0.01187
RMS Sequential : 0.012 0.008 0.015 0.010 0.006 0.012 0.015 0.006 0.025 0.002 0.010 0.007 0.017 0.006 0.016 0.015 0.010 0.005 0.011 0.006 0.01189
RMS Medium range : 0.013 0.031 0.009 0.017 0.034 0.010 0.013 0.013 0.017 0.024 0.031 0.008 0.013 0.025 0.024 0.008 0.000 0.020 0.031 0.024 0.02056
RMS Long range : 0.020 0.011 0.013 0.050 0.009 0.015 0.011 0.008 0.015 0.039 0.011 0.016 0.022 0.012 0.019 0.016 0.012 0.009 0.035 0.012 0.02077
Final --global-- Summary for 20 models, 2204 NOEs/model, 44080 NOEs total
~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
Summ of viol : 95.207
Summ sq. viol : 12.643
Maximum viol : 0.778
Average viol : 0.00216
RMSD viol : 0.01694
Std. Dev. viol : 0.01680
RMS Inter : 0.01940
RMS Intra : 0.01187
RMS Seque : 0.01189
RMS Medi : 0.02056
RMS Long : 0.02077
table of dihedral angle constraints violations
1-> [THR A 8] PHI -132.1 -73.1 0.0 3.4 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 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 3.4]
12-> [HIS A 14] PSI 77.1 143.5 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 3.6 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 3.6]
22-> [ASN A 21] PSI 125.8 -143.0 3.1 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 .. 3.1]
26-> [THR A 26] PSI 139.9 -178.3 0.0 0.0 6.1 0.0 0.9 3.0 5.7 2.3 1.0 1.8 5.0 0.0 0.0 0.0 0.0 0.0 4.8 0.0 0.0 0.0 - 10 [ 0.0 .. 6.1]
87-> [THR B 8] PHI -132.1 -73.1 0.0 3.4 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 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 3.4]
98-> [HIS B 14] PSI 77.1 143.5 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 3.6 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 3.6]
108-> [ASN B 21] PSI 125.8 -143.0 3.2 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 .. 3.2]
112-> [THR B 26] PSI 139.9 -178.3 0.1 0.0 6.1 0.0 0.9 2.9 5.7 2.3 1.0 1.8 5.0 0.0 0.0 0.0 0.0 0.0 4.8 0.0 0.0 0.0 - 10 [ 0.0 .. 6.1]
---- 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 : 2 2 2 0 0 2 2 2 1 2 2 0 0 0 0 2 2 0 0 0 1.05
> 10. degrees : 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0.00
Total : 4 2 2 0 2 2 2 2 2 2 2 0 0 0 0 2 2 0 0 0 1.30
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 : 3.2 3.4 6.1 0.0 0.9 3.0 5.7 2.3 1.0 1.8 5.0 0.0 0.0 0.0 0.0 3.6 4.8 0.0 0.0 0.0 6.11
Max PHI Viol : 0.0 3.4 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 0.0 0.0 0.0 0.0 3.37
Max PSI Viol : 3.2 0.0 6.1 0.0 0.9 3.0 5.7 2.3 1.0 1.8 5.0 0.0 0.0 0.0 0.0 3.6 4.8 0.0 0.0 0.0 6.11
Average Violation : 0.0 0.0 0.1 0.0 0.0 0.0 0.1 0.0 0.0 0.0 0.1 0.0 0.0 0.0 0.0 0.0 0.1 0.0 0.0 0.0 0.024
Avge PHI Viol : 0.000 0.280 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 0.062
Avge PSI Viol : 0.273 0.000 0.376 0.000 0.144 0.262 0.365 0.231 0.154 0.203 0.340 0.000 0.000 0.000 0.000 0.290 0.334 0.000 0.000 0.000 0.208
RMS Violation : 0.342 0.362 0.657 0.000 0.096 0.319 0.618 0.248 0.110 0.192 0.538 0.000 0.000 0.000 0.000 0.389 0.517 0.000 0.000 0.000 0.315
RMS PHI Viol : 0.000 0.512 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 0.115
RMS PSI Viol : 0.484 0.000 0.928 0.000 0.135 0.450 0.874 0.350 0.155 0.271 0.760 0.000 0.000 0.000 0.000 0.550 0.731 0.000 0.000 0.000 0.431
Final --global-- Summary for 20 models, 172 ACOs/model, 3440 ACOs total
~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
Summ. Viol. : 81.40
Summ. Sq. Viol. : 342.01
Max. Viol. : 6.105
Avg. Viol. : 0.02366
RMS Viol. : 0.31531
Std. Dev. Viol. : 0.31442
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 0.336 0.693 0.506 0.216
LYS M 2 0.627 0.601 0.607 0.927 0.999 0.999
LYS M 3 0.752 0.410 0.695 0.998 0.928 0.999
MET M 4 0.552 0.052 0.481 0.618 0.347
ALA M 5 0.237 0.282
GLU M 6 0.582 0.379 0.695 0.924 0.978
PHE M 7 0.707 0.594 0.490 0.792
THR M 8 0.975 0.992 0.612 8 8
PHE M 9 0.957 0.991 0.639 0.717 9 9
GLU M 10 0.994 0.998 0.564 0.998 1.000 10 10
ILE M 11 0.999 1.000 1.000 1.000 11 11
GLU M 12 0.997 0.996 1.000 0.996 0.973 12 12
GLU M 13 0.999 0.998 0.933 1.000 0.972 13 13
HIS M 14 0.999 0.995 0.559 0.626 14 14
LEU M 15 0.995 0.995 0.998 0.907 15 15
LEU M 16 0.995 0.981 0.464 0.842 16 16
THR M 17 0.998 0.996 1.000 17 17
LEU M 18 0.996 0.998 0.998 0.998 18 18
SER M 19 0.997 0.997 0.706 19 19
GLU M 20 0.988 0.996 1.000 1.000 0.979 20 20
ASN M 21 0.994 0.981 0.826 0.891 21 21
GLU M 22 0.751 0.468 0.687 0.875 0.902
LYS M 23 0.398 0.741 0.800 0.999 0.999 1.000
GLY M 24 0.773 0.910
TRP M 25 0.977 0.908 0.996 0.903 25 25
THR M 26 0.985 0.988 0.571 26 26
LYS M 27 0.985 0.998 0.907 0.864 0.596 0.759 27 27
GLU M 28 0.992 0.997 0.665 0.998 0.756 28 28
ILE M 29 0.999 0.998 1.000 0.967 29 29
ASN M 30 0.989 0.999 0.794 0.846 30 30
ARG M 31 0.995 0.995 0.948 0.996 0.940 0.994 1.000 31 31
VAL M 32 0.998 0.999 1.000 32 32
SER M 33 0.996 0.997 0.494 33 33
PHE M 34 0.995 0.974 0.998 0.535 34 34
ASN M 35 0.902 0.555 0.642 0.745
GLY M 36 0.519 0.159
ALA M 37 0.657 0.138
PRO M 38 0.979 0.686 0.885 0.822
ALA M 39 0.560 0.947
LYS M 40 0.993 0.999 0.998 0.598 0.869 0.999 40 40
PHE M 41 0.995 0.998 0.998 0.990 41 41
ASP M 42 0.996 0.998 0.723 0.756 42 42
ILE M 43 0.997 0.998 0.998 0.795 43 43
ARG M 44 0.988 0.986 0.180 0.851 0.339 0.643 1.000 44 44
ALA M 45 0.983 0.988 45 45
TRP M 46 0.986 0.989 0.581 0.407 46 46
SER M 47 0.849 0.819 0.615 47
PRO M 48 0.987 0.227 0.901 0.833
ASP M 49 0.203 0.282 0.379 0.910
HIS M 50 0.240 0.485 0.704 0.802
THR M 51 0.657 0.364 0.552
LYS M 52 0.836 0.433 0.848 0.873 0.871 0.922
MET M 53 0.741 0.517 0.417 0.511 0.269
GLY M 54 0.485 0.364
LYS M 55 0.530 0.764 0.931 0.804 0.936 0.999
GLY M 56 0.852 0.908 56
ILE M 57 0.996 0.999 1.000 0.948 57 57
THR M 58 0.997 0.999 1.000 58 58
LEU M 59 0.998 0.997 0.999 0.956 59 59
SER M 60 0.986 0.987 0.814 60 60
ASN M 61 1.000 0.999 0.999 0.982 61 61
GLU M 62 0.999 0.999 1.000 0.947 0.999 62 62
GLU M 63 1.000 0.999 0.998 0.908 0.910 63 63
PHE M 64 0.999 0.999 0.976 0.990 64 64
GLN M 65 0.998 0.998 0.994 0.905 0.947 65 65
THR M 66 1.000 0.998 0.999 66 66
MET M 67 0.994 0.990 0.738 0.764 0.699 67 67
VAL M 68 0.999 0.995 1.000 68 68
ASP M 69 0.996 0.996 0.815 0.840 69 69
ALA M 70 0.999 0.999 70 70
PHE M 71 0.996 0.994 0.995 0.600 71 71
LYS M 72 0.995 0.994 0.799 0.900 0.857 0.849 72 72
GLY M 73 0.981 0.905 73 73
ASN M 74 0.929 0.334 0.604 0.862
LEU M 75 0.198 0.317 0.793 0.983
GLU M 76 0.406 0.256 0.721 0.374 0.828
HIS M 77 0.908 0.538 0.625 0.589
HIS M 78 0.755 0.471 0.233 0.254
HIS M 79 0.583 0.359 0.584 0.575
HIS M 80 0.588 0.316 0.584 0.536
HIS M 81 0.611 0.610 0.589 0.717
HIS M 82 0.938 0.240 0.674 0.533
MET M 93 0.277 0.336 0.694 0.506 0.216
LYS M 94 0.627 0.601 0.607 0.927 0.999 0.999
LYS M 95 0.752 0.410 0.694 0.998 0.928 0.999
MET M 96 0.552 0.052 0.481 0.618 0.347
ALA M 97 0.237 0.282
GLU M 98 0.582 0.379 0.695 0.924 0.978
PHE M 99 0.707 0.594 0.491 0.791
THR M 100 0.975 0.992 0.612 100 100
PHE M 101 0.957 0.991 0.639 0.718 101 101
GLU M 102 0.994 0.998 0.564 0.998 1.000 102 102
ILE M 103 0.999 1.000 1.000 1.000 103 103
GLU M 104 0.997 0.996 1.000 0.996 0.974 104 104
GLU M 105 0.999 0.998 0.933 1.000 0.972 105 105
HIS M 106 0.999 0.995 0.559 0.626 106 106
LEU M 107 0.995 0.995 0.998 0.907 107 107
LEU M 108 0.995 0.981 0.464 0.842 108 108
THR M 109 0.998 0.996 1.000 109 109
LEU M 110 0.995 0.998 0.998 0.998 110 110
SER M 111 0.997 0.997 0.706 111 111
GLU M 112 0.988 0.996 1.000 1.000 0.979 112 112
ASN M 113 0.994 0.981 0.826 0.891 113 113
GLU M 114 0.752 0.468 0.687 0.875 0.902
LYS M 115 0.398 0.741 0.800 0.999 0.999 1.000
GLY M 116 0.773 0.910
TRP M 117 0.977 0.908 0.996 0.903 117 117
THR M 118 0.985 0.988 0.571 118 118
LYS M 119 0.985 0.998 0.907 0.864 0.596 0.759 119 119
GLU M 120 0.992 0.997 0.665 0.998 0.756 120 120
ILE M 121 0.999 0.998 1.000 0.967 121 121
ASN M 122 0.989 0.999 0.795 0.846 122 122
ARG M 123 0.995 0.995 0.948 0.996 0.940 0.994 1.000 123 123
VAL M 124 0.998 0.999 1.000 124 124
SER M 125 0.996 0.997 0.494 125 125
PHE M 126 0.995 0.974 0.998 0.535 126 126
ASN M 127 0.902 0.555 0.642 0.745
GLY M 128 0.519 0.159
ALA M 129 0.657 0.138
PRO M 130 0.979 0.686 0.885 0.822
ALA M 131 0.560 0.947
LYS M 132 0.993 0.999 0.998 0.598 0.869 0.999 132 132
PHE M 133 0.995 0.998 0.998 0.990 133 133
ASP M 134 0.996 0.998 0.723 0.756 134 134
ILE M 135 0.997 0.998 0.998 0.795 135 135
ARG M 136 0.988 0.986 0.180 0.851 0.339 0.643 1.000 136 136
ALA M 137 0.983 0.988 137 137
TRP M 138 0.986 0.989 0.581 0.407 138 138
SER M 139 0.849 0.819 0.615 139
PRO M 140 0.987 0.227 0.901 0.833
ASP M 141 0.203 0.282 0.379 0.910
HIS M 142 0.240 0.485 0.704 0.802
THR M 143 0.657 0.364 0.552
LYS M 144 0.836 0.433 0.848 0.873 0.870 0.922
MET M 145 0.741 0.518 0.417 0.511 0.269
GLY M 146 0.485 0.364
LYS M 147 0.530 0.764 0.931 0.804 0.936 0.999
GLY M 148 0.852 0.908 148
ILE M 149 0.996 0.999 1.000 0.948 149 149
THR M 150 0.997 0.999 1.000 150 150
LEU M 151 0.998 0.997 0.999 0.956 151 151
SER M 152 0.986 0.987 0.814 152 152
ASN M 153 1.000 0.999 0.999 0.982 153 153
GLU M 154 0.999 0.999 1.000 0.947 0.999 154 154
GLU M 155 1.000 0.999 0.998 0.907 0.910 155 155
PHE M 156 0.999 0.999 0.976 0.990 156 156
GLN M 157 0.998 0.998 0.994 0.905 0.947 157 157
THR M 158 1.000 0.998 0.999 158 158
MET M 159 0.994 0.990 0.738 0.764 0.699 159 159
VAL M 160 0.999 0.995 1.000 160 160
ASP M 161 0.996 0.996 0.815 0.839 161 161
ALA M 162 0.999 0.999 162 162
PHE M 163 0.996 0.994 0.995 0.600 163 163
LYS M 164 0.995 0.994 0.799 0.900 0.857 0.849 164 164
GLY M 165 0.981 0.905 165 165
ASN M 166 0.929 0.334 0.604 0.862
LEU M 167 0.198 0.317 0.793 0.983
GLU M 168 0.406 0.256 0.721 0.374 0.828
HIS M 169 0.908 0.538 0.625 0.589
HIS M 170 0.756 0.471 0.233 0.253
HIS M 171 0.583 0.359 0.584 0.575
HIS M 172 0.588 0.316 0.584 0.536
HIS M 173 0.611 0.610 0.589 0.717
HIS M 174 0.938 0.674 0.533
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_R3Cons_em_bcr3.pdb'
>
> Kabsch RMSD of backbone atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 1 is: 0.906
> Kabsch RMSD of backbone atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 2 is: 0.901
> Kabsch RMSD of backbone atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 3 is: 0.441
> Kabsch RMSD of backbone atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 4 is: 0.410
> Kabsch RMSD of backbone atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 5 is: 0.861
> Kabsch RMSD of backbone atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 6 is: 0.452
> Kabsch RMSD of backbone atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 7 is: 0.467
> Kabsch RMSD of backbone atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 8 is: 0.391
> Kabsch RMSD of backbone atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 9 is: 0.598
> Kabsch RMSD of backbone atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 10 is: 0.638
> Kabsch RMSD of backbone atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 11 is: 0.730
> Kabsch RMSD of backbone atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 12 is: 0.629
> Kabsch RMSD of backbone atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 13 is: 0.484
> Kabsch RMSD of backbone atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 14 is: 0.779
> Kabsch RMSD of backbone atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 15 is: 0.719
> Kabsch RMSD of backbone atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 16 is: 0.552
> Kabsch RMSD of backbone atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 17 is: 0.313 (*)
> Kabsch RMSD of backbone atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 18 is: 0.345
> Kabsch RMSD of backbone atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 19 is: 0.989
> Kabsch RMSD of backbone atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 20 is: 1.408
>
> Kabsch RMSD statistics for 20 structures:
> Mean RMSD using as refer. str. `average' for res.[8..21],[25..34],[40..46],[57..73],[100..113],[117..126],[132..138],[149..165], is: 0.651
> Range of RMSD values to reference struct. is 0.313 to 1.408
> Kabsch RMSD of heavy atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 1 is: 1.309
> Kabsch RMSD of heavy atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 2 is: 1.289
> Kabsch RMSD of heavy atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 3 is: 0.726
> Kabsch RMSD of heavy atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 4 is: 0.881
> Kabsch RMSD of heavy atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 5 is: 1.310
> Kabsch RMSD of heavy atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 6 is: 0.892
> Kabsch RMSD of heavy atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 7 is: 0.794
> Kabsch RMSD of heavy atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 8 is: 0.688
> Kabsch RMSD of heavy atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 9 is: 0.983
> Kabsch RMSD of heavy atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 10 is: 1.030
> Kabsch RMSD of heavy atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 11 is: 1.009
> Kabsch RMSD of heavy atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 12 is: 0.858
> Kabsch RMSD of heavy atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 13 is: 0.895
> Kabsch RMSD of heavy atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 14 is: 1.091
> Kabsch RMSD of heavy atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 15 is: 1.419
> Kabsch RMSD of heavy atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 16 is: 0.846
> Kabsch RMSD of heavy atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 17 is: 0.844
> Kabsch RMSD of heavy atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 18 is: 0.647 (*)
> Kabsch RMSD of heavy atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 19 is: 1.157
> Kabsch RMSD of heavy atoms in res. M[8..21],M[25..34],M[40..46],M[57..73],M[100..113],M[117..126],M[132..138],M[149..165],for model 20 is: 1.586
>
> Kabsch RMSD statistics for 20 structures:
> Mean RMSD using as refer. str. `average' for res.[8..21],[25..34],[40..46],[57..73],[100..113],[117..126],[132..138],[149..165], is: 1.013
> Range of RMSD values to reference struct. is 0.647 to 1.586
Text report of backbone RMSD for entire protein
> Kabsch RMSD of backb atoms in res. *[1..174],for model 1 is: 3.699
> Kabsch RMSD of backb atoms in res. *[1..174],for model 2 is: 3.009
> Kabsch RMSD of backb atoms in res. *[1..174],for model 3 is: 4.012
> Kabsch RMSD of backb atoms in res. *[1..174],for model 4 is: 4.070
> Kabsch RMSD of backb atoms in res. *[1..174],for model 5 is: 3.521
> Kabsch RMSD of backb atoms in res. *[1..174],for model 6 is: 3.368
> Kabsch RMSD of backb atoms in res. *[1..174],for model 7 is: 3.367
> Kabsch RMSD of backb atoms in res. *[1..174],for model 8 is: 3.988
> Kabsch RMSD of backb atoms in res. *[1..174],for model 9 is: 3.522
> Kabsch RMSD of backb atoms in res. *[1..174],for model 10 is: 3.418
> Kabsch RMSD of backb atoms in res. *[1..174],for model 11 is: 3.189
> Kabsch RMSD of backb atoms in res. *[1..174],for model 12 is: 2.910
> Kabsch RMSD of backb atoms in res. *[1..174],for model 13 is: 3.445
> Kabsch RMSD of backb atoms in res. *[1..174],for model 14 is: 3.944
> Kabsch RMSD of backb atoms in res. *[1..174],for model 15 is: 3.203
> Kabsch RMSD of backb atoms in res. *[1..174],for model 16 is: 2.846
> Kabsch RMSD of backb atoms in res. *[1..174],for model 17 is: 2.925
> Kabsch RMSD of backb atoms in res. *[1..174],for model 18 is: 2.746 (*)
> Kabsch RMSD of backb atoms in res. *[1..174],for model 19 is: 4.279
> Kabsch RMSD of backb atoms in res. *[1..174],for model 20 is: 3.366
>
> Kabsch RMSD statistics for 20 structures:
> Mean RMSD using as refer. str. `average' for res.[1..174], is: 3.441
> Range of RMSD values to reference struct. is 2.746 to 4.279
Text report of heavy atom RMSD for entire protein
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 1 is: 4.247
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 2 is: 3.519
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 3 is: 4.536
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 4 is: 4.645
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 5 is: 4.137
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 6 is: 3.704
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 7 is: 3.961
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 8 is: 4.598
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 9 is: 3.949
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 10 is: 3.887
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 11 is: 3.757
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 12 is: 3.770
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 13 is: 3.948
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 14 is: 4.566
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 15 is: 3.742
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 16 is: 3.487
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 17 is: 3.469
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 18 is: 3.273 (*)
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 19 is: 4.856
> Kabsch RMSD of heavy atoms in res. *[1..174],for model 20 is: 4.074
>
> Kabsch RMSD statistics for 20 structures:
> Mean RMSD using as refer. str. `average' for res.[1..174], is: 4.006
> Range of RMSD values to reference struct. is 3.273 to 4.856
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 3.4 0.7 0.7
All heavy atoms 4.0 1.0 1.0
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_R3Cons_em_bcr3_020.rin 0.0 1940 residues |
| |
+| Ramachandran plot: 94.0% core 5.9% allow 0.1% gener 0.0% disall |
| |
+| All Ramachandrans: 4 labelled residues (out of1940) |
+| Chi1-chi2 plots: 6 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 0.14
9 0.10
10 -0.67
11 -0.34
12 -1.67
13 -0.77
14 -0.50
15 -2.22
16 -1.59
17 0.14
18 -1.11
19 -1.21
20 -0.92
21 -0.80
25 -1.17
26 0.20
27 -0.24
28 -1.30
29 0.45
30 -0.44
31 -0.43
32 0.34
33 -0.38
34 -0.56
40 -0.59
41 -0.17
42 -1.43
43 -0.04
44 -0.41
45 -0.92
46 -0.13
57 -0.84
58 0.39
59 -0.29
60 -0.76
61 1.34
62 0.73
63 1.02
64 1.17
65 1.05
66 1.02
67 0.68
68 0.83
69 1.03
70 0.84
71 0.01
72 0.82
73 -0.78
100 0.14
101 0.12
102 -0.67
103 -0.34
104 -1.67
105 -0.77
106 -0.50
107 -2.22
108 -1.59
109 0.13
110 -1.11
111 -1.21
112 -0.92
113 -0.80
117 -1.17
118 0.20
119 -0.24
120 -1.30
121 0.45
122 -0.44
123 -0.43
124 0.34
125 -0.38
126 -0.56
132 -0.58
133 -0.17
134 -1.41
135 -0.04
136 -0.44
137 -0.92
138 -0.12
139 -0.33
149 -0.84
150 0.40
151 -0.29
152 -0.76
153 1.34
154 0.73
155 1.02
156 1.17
157 1.05
158 1.01
159 0.68
160 0.83
161 1.03
162 0.84
163 0.01
164 0.80
165 -0.78
#Reported_Model_Average -0.217
#Overall_Average_Reported -0.217
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 0.37
9 -0.13
10 0.19
11 0.27
12 -0.62
13 -0.02
14 0.26
15 -0.74
16 -1.51
17 0.43
18 -0.13
19 -0.44
20 -0.07
21 0.06
25 -0.59
26 0.25
27 -0.09
28 -0.65
29 0.46
30 -0.37
31 0.20
32 0.48
33 -0.22
34 -0.19
40 0.03
41 0.26
42 -1.14
43 0.11
44 0.01
45 -0.92
46 0.23
57 -0.62
58 0.49
59 0.16
60 -0.34
61 1.26
62 0.95
63 0.81
64 0.56
65 0.53
66 0.60
67 0.01
68 0.68
69 0.88
70 0.84
71 -0.41
72 0.44
73 -0.78
100 0.35
101 -0.12
102 0.19
103 0.27
104 -0.62
105 -0.02
106 0.26
107 -0.74
108 -1.51
109 0.42
110 -0.13
111 -0.42
112 -0.07
113 0.06
117 -0.59
118 0.26
119 -0.09
120 -0.65
121 0.46
122 -0.37
123 0.20
124 0.47
125 -0.20
126 -0.19
132 0.03
133 0.26
134 -1.13
135 0.12
136 0.00
137 -0.92
138 0.23
139 0.09
149 -0.62
150 0.49
151 0.17
152 -0.33
153 1.26
154 0.95
155 0.81
156 0.56
157 0.53
158 0.65
159 0.01
160 0.70
161 0.88
162 0.84
163 -0.41
164 0.43
165 -0.78
#Reported_Model_Average 0.040
#Overall_Average_Reported 0.040
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 0.71 0.71 0.71 0.71 -0.84 0.71 -0.84 1.04 1.04 -0.84 0.71 -0.84 -0.84 0.71 0.71 0.71 -0.84 1.04 -0.84 -0.84
10 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.28 0.04 0.28 0.04 0.04 0.04 0.04 0.04 0.04 0.04
11 0.81 0.81 -0.54 -0.94 -0.94 -0.94 -0.28 -0.54 -0.28 -0.94 -0.94 -0.28 -0.94 0.81 -0.94 -0.54 -0.94 -0.94 -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 0.28 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 0.77 1.06 0.77 0.77 1.06 0.77 0.77 0.77 1.06 1.06 1.06 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77
16 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 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 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17
20 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 0.28 0.28 0.28 0.28 0.28 0.28 0.28
21 -0.26 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 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 1.12 1.12 1.12 1.12 1.12 1.62 1.12 1.12
26 0.08 0.08 0.08 0.55 0.55 0.08 0.08 0.55 0.08 0.55 0.08 0.55 0.08 0.08 0.08 0.08 0.55 0.55 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 -2.12 0.08 0.08 0.08 0.08 0.08
28 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 0.28 -0.46 -0.46 -0.46 -0.46 0.28 -0.46 -0.46 0.28 -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 -0.56 -0.56 -0.56 -0.26 -0.56 0.09 -0.56 -0.56 -0.56 -0.26 -0.56 -0.56 -0.56 -0.56 -0.26 -0.56 -0.56 -0.56 -2.61 -0.56
31 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 0.71 0.71
32 0.66 0.66 0.66 0.66 -0.40 0.66 0.66 0.66 1.00 0.66 0.66 -0.40 0.66 0.66 -0.40 0.66 0.66 0.66 0.66 0.66
33 0.59 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17
34 1.04 0.71 0.71 0.71 0.71 1.04 1.04 1.04 0.71 0.71 0.71 0.71 0.71 0.71 0.71 1.04 0.71 1.04 0.71 0.71
40 0.47 0.47 0.47 0.47 -0.72 0.47 0.08 0.08 0.08 0.47 0.47 0.08 0.47 0.47 0.08 0.47 0.47 0.47 0.08 0.47
41 1.04 1.40 1.04 1.04 1.04 1.04 1.04 1.04 1.04 1.40 1.04 1.04 1.04 1.04 1.04 1.04 1.04 1.04 1.04 1.04
42 0.34 -1.97 -0.83 -0.83 0.34 -1.97 0.34 -0.83 0.34 -0.83 0.34 0.34 -0.83 -0.83 0.34 0.34 -0.83 0.34 0.51 -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 -0.44 0.71 0.71 0.71 0.71 0.71 -0.44 0.71 -0.44 0.71 0.71 -0.44 0.71 0.71 0.71 -0.44 -0.44 0.71
45 0.49 -0.25 0.49 -0.25 -0.25 -0.25 -0.25 0.49 0.49 0.49 0.49 0.49 0.49 -0.25 0.49 -0.25 0.49 -0.25 0.49 0.49
46 1.12 1.62 1.12 1.12 1.12 1.12 1.12 1.62 1.12 -0.42 1.12 1.12 1.12 1.12 -0.42 1.12 1.12 1.12 1.12 1.12
57 0.93 0.81 0.93 0.93 0.93 0.81 0.81 0.81 0.93 0.93 0.81 0.81 0.81 0.81 0.93 0.81 0.93 0.81 0.93 0.81
58 0.55 0.55 0.08 0.08 0.55 0.08 0.08 0.08 0.55 0.55 0.55 0.08 0.08 0.55 0.08 0.55 0.55 0.55 0.55 0.08
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 0.17 0.17 0.17 0.59 0.59 0.17 0.17 0.17 0.59 0.17 0.17 0.17 0.17 0.17 0.59 0.17 0.17 0.59 0.17
61 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.41 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.41 0.41
62 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.28 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.28 0.28
63 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -1.13 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -1.13 -0.46 -1.13 -1.13
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 -0.57 0.25 0.25 0.25 0.25 0.10 -0.57 0.25 0.25 0.25 0.25 0.25 0.25 0.25 0.25 0.25 0.25 -0.57 -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 0.66 1.00 1.00 1.00 0.66 1.00 1.00 1.00 1.00 1.00 0.66 1.00 1.00 1.00 0.66 1.00 0.66 0.66
69 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.34 0.51 0.51 0.51 0.51 0.51 0.51 0.34 0.51
70 0.14 0.14 0.14 0.14 0.14 -0.25 0.14 -0.25 0.14 0.14 0.14 0.49 0.14 0.14 0.14 -0.25 0.49 0.14 0.14 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 0.08 0.08 0.08 0.08 0.08 -0.72 0.08 0.08 0.08 0.08 0.08 0.08 0.08 -2.12 0.08 0.08 -0.72 0.08 0.47
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 0.71 0.71 1.04 0.71 -1.29 0.71 -0.84 1.04 1.04 -0.84 0.71 -0.84 -0.84 0.71 0.71 1.04 0.71 1.04 0.71 -0.84
102 0.28 0.28 0.04 0.04 0.28 0.04 0.04 0.28 0.04 0.04 0.28 0.28 0.04 0.04 0.28 0.04 0.04 0.28 0.04 0.28
103 0.81 0.81 -0.54 -0.94 -0.94 -0.94 -0.28 0.81 -0.94 -0.94 -0.94 -0.54 -0.94 0.81 -0.94 -0.54 -0.54 -0.94 -0.94 -0.54
104 -0.59 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 -0.59 0.28 0.28 0.28 -0.59 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 0.77 1.06 0.77 0.77 1.06 0.77 1.06 0.77 1.06 1.06 1.06 1.06 1.06 0.77 1.06 0.77 1.06 1.06 0.77 1.06
108 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 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 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17
112 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
113 -0.26 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 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 1.12 1.12 1.12 1.12 1.12 1.62 1.12 1.12
118 0.08 0.08 0.08 0.55 0.55 0.08 0.08 0.55 0.08 0.55 0.08 0.55 0.08 0.08 0.08 0.08 0.55 0.08 0.55 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 -2.12 0.08 0.08 0.08 -2.12 0.08
120 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 0.28 -0.46 -0.46 0.28 -0.46 -0.46 -0.46 -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 -0.56 -0.56 -0.56 -0.26 0.09 -0.56 -0.56 -0.56 -0.56 -0.26 -0.56 -2.61 -0.56 -0.56 -0.26 -0.56 -2.61 -0.56 -2.61 -0.56
123 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 0.71 0.71
124 0.66 0.66 0.66 0.66 -0.40 0.66 0.66 0.66 1.00 0.66 0.66 0.66 0.66 0.66 -0.40 0.66 0.66 0.66 0.66 -0.40
125 0.59 0.17 0.17 0.17 0.17 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
126 1.04 1.04 0.71 0.71 0.71 1.04 1.04 0.71 0.71 0.71 0.71 1.04 0.71 0.71 0.71 1.04 0.71 0.71 0.71 0.71
132 0.47 0.47 0.47 0.47 -0.72 0.47 0.08 0.47 0.08 0.47 0.47 0.08 0.47 0.47 0.08 0.47 0.47 0.47 0.08 0.08
133 1.40 1.40 1.40 1.40 1.40 1.04 1.40 1.04 1.04 1.40 1.04 1.40 1.40 1.40 1.04 1.40 1.04 1.40 1.40 1.40
134 0.34 -1.97 -0.83 -1.97 0.34 -1.97 0.34 -0.83 0.34 -0.83 -1.97 -0.83 -0.83 -0.83 -0.83 0.34 -0.83 -1.97 0.51 -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 -0.44 0.71 0.71 0.71 0.71 0.71 -0.44 0.71 -0.44 0.71 0.71 -0.44 0.71 0.71 -0.44 -0.44 -0.44 0.71
137 0.49 0.49 0.49 0.49 0.49 -0.25 0.49 0.49 0.49 0.49 0.49 0.49 0.49 -0.25 0.49 0.49 0.49 0.49 0.49 0.49
138 1.12 1.12 1.12 1.12 -0.42 1.12 1.12 1.62 1.12 -0.42 1.12 1.12 1.12 1.12 -0.42 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 0.59 0.59 0.59 0.59 0.59 0.59 0.17 0.59 0.59 0.59 0.59 0.59 0.59
149 0.93 0.81 0.93 0.93 0.93 0.81 0.81 0.81 0.93 0.93 0.93 0.93 0.81 0.81 0.93 0.81 0.93 0.81 0.93 0.81
150 0.55 0.55 0.08 0.08 0.55 0.08 0.08 0.08 0.55 0.55 0.55 0.08 0.08 0.55 0.55 0.08 0.08 0.55 0.55 0.08
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 0.17 0.17 0.17 0.17 0.17 0.59 0.17 0.17 0.17 0.59 0.59 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.59 0.17
153 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.41 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.41 0.51
154 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.28 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.28 0.28
155 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -1.13 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -1.13 -1.13
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 -0.57 -0.57 0.25 0.25 0.25 0.25 0.10 -0.57 0.25 0.25 0.25 0.25 0.25 0.25 0.25 0.25 0.25 0.25 0.25 0.10
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 1.00 0.66 1.00 1.00 1.00 0.66 1.00 0.66 1.00 1.00 1.00 0.66 1.00 1.00 1.00 0.66 1.00 0.66 0.66
161 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.34 0.51 0.51 0.51 0.51 0.51 0.51 0.34 0.51
162 0.14 0.14 0.14 0.49 0.14 0.14 0.14 -0.25 0.14 0.14 0.14 0.49 0.14 0.14 0.14 0.14 0.14 0.14 0.14 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 0.08 0.08 0.08 0.08 0.47 -0.72 0.08 0.08 0.47 0.08 -2.12 0.08 -2.12 0.08 0.08 0.47 -0.72 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 0.492 0.456 0.421 0.440 0.396 0.417 0.418 0.460 0.450 0.424 0.436 0.393 0.404 0.417 0.350 0.473 0.403 0.430 0.348 0.389
#Overall_Average_Reported 0.421
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 0.71 0.71 0.71 0.71 -0.84 0.71 -0.84 1.04 1.04 -0.84 0.71 -0.84 -0.84 0.71 0.71 0.71 -0.84 1.04 -0.84 -0.84
10 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.28 0.04 0.28 0.04 0.04 0.04 0.04 0.04 0.04 0.04
11 0.81 0.81 -0.54 -0.94 -0.94 -0.94 -0.28 -0.54 -0.28 -0.94 -0.94 -0.28 -0.94 0.81 -0.94 -0.54 -0.94 -0.94 -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 0.28 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 0.77 1.06 0.77 0.77 1.06 0.77 0.77 0.77 1.06 1.06 1.06 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77
16 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 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 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17
20 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 0.28 0.28 0.28 0.28 0.28 0.28 0.28
21 -0.26 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 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 1.12 1.12 1.12 1.12 1.12 1.62 1.12 1.12
26 0.08 0.08 0.08 0.55 0.55 0.08 0.08 0.55 0.08 0.55 0.08 0.55 0.08 0.08 0.08 0.08 0.55 0.55 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 -2.12 0.08 0.08 0.08 0.08 0.08
28 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 0.28 -0.46 -0.46 -0.46 -0.46 0.28 -0.46 -0.46 0.28 -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 -0.56 -0.56 -0.56 -0.26 -0.56 0.09 -0.56 -0.56 -0.56 -0.26 -0.56 -0.56 -0.56 -0.56 -0.26 -0.56 -0.56 -0.56 -2.61 -0.56
31 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 0.71 0.71
32 0.66 0.66 0.66 0.66 -0.40 0.66 0.66 0.66 1.00 0.66 0.66 -0.40 0.66 0.66 -0.40 0.66 0.66 0.66 0.66 0.66
33 0.59 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17
34 1.04 0.71 0.71 0.71 0.71 1.04 1.04 1.04 0.71 0.71 0.71 0.71 0.71 0.71 0.71 1.04 0.71 1.04 0.71 0.71
40 0.47 0.47 0.47 0.47 -0.72 0.47 0.08 0.08 0.08 0.47 0.47 0.08 0.47 0.47 0.08 0.47 0.47 0.47 0.08 0.47
41 1.04 1.40 1.04 1.04 1.04 1.04 1.04 1.04 1.04 1.40 1.04 1.04 1.04 1.04 1.04 1.04 1.04 1.04 1.04 1.04
42 0.34 -1.97 -0.83 -0.83 0.34 -1.97 0.34 -0.83 0.34 -0.83 0.34 0.34 -0.83 -0.83 0.34 0.34 -0.83 0.34 0.51 -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 -0.44 0.71 0.71 0.71 0.71 0.71 -0.44 0.71 -0.44 0.71 0.71 -0.44 0.71 0.71 0.71 -0.44 -0.44 0.71
45 0.49 -0.25 0.49 -0.25 -0.25 -0.25 -0.25 0.49 0.49 0.49 0.49 0.49 0.49 -0.25 0.49 -0.25 0.49 -0.25 0.49 0.49
46 1.12 1.62 1.12 1.12 1.12 1.12 1.12 1.62 1.12 -0.42 1.12 1.12 1.12 1.12 -0.42 1.12 1.12 1.12 1.12 1.12
57 0.93 0.81 0.93 0.93 0.93 0.81 0.81 0.81 0.93 0.93 0.81 0.81 0.81 0.81 0.93 0.81 0.93 0.81 0.93 0.81
58 0.55 0.55 0.08 0.08 0.55 0.08 0.08 0.08 0.55 0.55 0.55 0.08 0.08 0.55 0.08 0.55 0.55 0.55 0.55 0.08
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 0.17 0.17 0.17 0.59 0.59 0.17 0.17 0.17 0.59 0.17 0.17 0.17 0.17 0.17 0.59 0.17 0.17 0.59 0.17
61 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.41 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.41 0.41
62 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.28 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.28 0.28
63 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -1.13 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -1.13 -0.46 -1.13 -1.13
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 -0.57 0.25 0.25 0.25 0.25 0.10 -0.57 0.25 0.25 0.25 0.25 0.25 0.25 0.25 0.25 0.25 0.25 -0.57 -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 0.66 1.00 1.00 1.00 0.66 1.00 1.00 1.00 1.00 1.00 0.66 1.00 1.00 1.00 0.66 1.00 0.66 0.66
69 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.34 0.51 0.51 0.51 0.51 0.51 0.51 0.34 0.51
70 0.14 0.14 0.14 0.14 0.14 -0.25 0.14 -0.25 0.14 0.14 0.14 0.49 0.14 0.14 0.14 -0.25 0.49 0.14 0.14 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 0.08 0.08 0.08 0.08 0.08 -0.72 0.08 0.08 0.08 0.08 0.08 0.08 0.08 -2.12 0.08 0.08 -0.72 0.08 0.47
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 0.71 0.71 1.04 0.71 -1.29 0.71 -0.84 1.04 1.04 -0.84 0.71 -0.84 -0.84 0.71 0.71 1.04 0.71 1.04 0.71 -0.84
102 0.28 0.28 0.04 0.04 0.28 0.04 0.04 0.28 0.04 0.04 0.28 0.28 0.04 0.04 0.28 0.04 0.04 0.28 0.04 0.28
103 0.81 0.81 -0.54 -0.94 -0.94 -0.94 -0.28 0.81 -0.94 -0.94 -0.94 -0.54 -0.94 0.81 -0.94 -0.54 -0.54 -0.94 -0.94 -0.54
104 -0.59 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 -0.59 0.28 0.28 0.28 -0.59 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 0.77 1.06 0.77 0.77 1.06 0.77 1.06 0.77 1.06 1.06 1.06 1.06 1.06 0.77 1.06 0.77 1.06 1.06 0.77 1.06
108 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 0.77 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 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.17
112 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
113 -0.26 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 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 1.12 1.12 1.12 1.12 1.12 1.62 1.12 1.12
118 0.08 0.08 0.08 0.55 0.55 0.08 0.08 0.55 0.08 0.55 0.08 0.55 0.08 0.08 0.08 0.08 0.55 0.08 0.55 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 -2.12 0.08 0.08 0.08 -2.12 0.08
120 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 0.28 -0.46 -0.46 0.28 -0.46 -0.46 -0.46 -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 -0.56 -0.56 -0.56 -0.26 0.09 -0.56 -0.56 -0.56 -0.56 -0.26 -0.56 -2.61 -0.56 -0.56 -0.26 -0.56 -2.61 -0.56 -2.61 -0.56
123 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 0.71 0.71
124 0.66 0.66 0.66 0.66 -0.40 0.66 0.66 0.66 1.00 0.66 0.66 0.66 0.66 0.66 -0.40 0.66 0.66 0.66 0.66 -0.40
125 0.59 0.17 0.17 0.17 0.17 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
126 1.04 1.04 0.71 0.71 0.71 1.04 1.04 0.71 0.71 0.71 0.71 1.04 0.71 0.71 0.71 1.04 0.71 0.71 0.71 0.71
132 0.47 0.47 0.47 0.47 -0.72 0.47 0.08 0.47 0.08 0.47 0.47 0.08 0.47 0.47 0.08 0.47 0.47 0.47 0.08 0.08
133 1.40 1.40 1.40 1.40 1.40 1.04 1.40 1.04 1.04 1.40 1.04 1.40 1.40 1.40 1.04 1.40 1.04 1.40 1.40 1.40
134 0.34 -1.97 -0.83 -1.97 0.34 -1.97 0.34 -0.83 0.34 -0.83 -1.97 -0.83 -0.83 -0.83 -0.83 0.34 -0.83 -1.97 0.51 -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 -0.44 0.71 0.71 0.71 0.71 0.71 -0.44 0.71 -0.44 0.71 0.71 -0.44 0.71 0.71 -0.44 -0.44 -0.44 0.71
137 0.49 0.49 0.49 0.49 0.49 -0.25 0.49 0.49 0.49 0.49 0.49 0.49 0.49 -0.25 0.49 0.49 0.49 0.49 0.49 0.49
138 1.12 1.12 1.12 1.12 -0.42 1.12 1.12 1.62 1.12 -0.42 1.12 1.12 1.12 1.12 -0.42 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 0.59 0.59 0.59 0.59 0.59 0.59 0.17 0.59 0.59 0.59 0.59 0.59 0.59
149 0.93 0.81 0.93 0.93 0.93 0.81 0.81 0.81 0.93 0.93 0.93 0.93 0.81 0.81 0.93 0.81 0.93 0.81 0.93 0.81
150 0.55 0.55 0.08 0.08 0.55 0.08 0.08 0.08 0.55 0.55 0.55 0.08 0.08 0.55 0.55 0.08 0.08 0.55 0.55 0.08
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 0.17 0.17 0.17 0.17 0.17 0.59 0.17 0.17 0.17 0.59 0.59 0.17 0.17 0.17 0.17 0.17 0.17 0.17 0.59 0.17
153 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.41 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.41 0.51
154 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.28 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.28 0.28
155 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -1.13 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -1.13 -1.13
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 -0.57 -0.57 0.25 0.25 0.25 0.25 0.10 -0.57 0.25 0.25 0.25 0.25 0.25 0.25 0.25 0.25 0.25 0.25 0.25 0.10
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 1.00 0.66 1.00 1.00 1.00 0.66 1.00 0.66 1.00 1.00 1.00 0.66 1.00 1.00 1.00 0.66 1.00 0.66 0.66
161 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.34 0.51 0.51 0.51 0.51 0.51 0.51 0.34 0.51
162 0.14 0.14 0.14 0.49 0.14 0.14 0.14 -0.25 0.14 0.14 0.14 0.49 0.14 0.14 0.14 0.14 0.14 0.14 0.14 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 0.08 0.08 0.08 0.08 0.47 -0.72 0.08 0.08 0.47 0.08 -2.12 0.08 -2.12 0.08 0.08 0.47 -0.72 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 0.492 0.456 0.421 0.440 0.396 0.417 0.418 0.460 0.450 0.424 0.436 0.393 0.404 0.417 0.350 0.473 0.403 0.430 0.348 0.389
#Overall_Average_Reported 0.421
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 0 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 0 0 0 0 1
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 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0
12.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
13.000 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 1 0
14.000 0 1 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0
15.000 1 1 0 1 1 1 0 1 1 0 0 1 0 0 1 1 0 1 1 1
16.000 0 0 2 0 0 0 2 0 0 0 0 0 0 1 0 0 2 0 0 2
17.000 1 1 1 0 0 0 0 0 0 2 1 0 0 1 0 1 1 1 1 1
18.000 0 2 0 0 0 1 0 1 1 0 0 0 0 0 1 0 0 0 2 1
19.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0
20.000 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
21.000 0 0 0 0 0 0 0 0 1 0 1 0 0 0 1 0 1 0 0 0
25.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 0 0 1
26.000 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
27.000 0 0 1 1 1 2 1 1 1 0 1 2 0 0 0 0 1 3 0 2
28.000 1 1 1 0 0 0 0 0 0 2 1 0 0 1 0 1 1 1 1 1
29.000 4 2 3 1 2 1 3 2 3 1 1 2 0 1 3 1 3 2 2 2
30.000 0 1 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 1 0
31.000 0 1 0 0 0 1 0 1 0 0 0 1 0 0 1 0 0 0 0 0
32.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0
33.000 1 0 0 0 1 0 1 0 0 0 0 1 1 0 0 1 0 0 0 1
34.000 0 0 0 0 0 0 3 0 0 0 1 1 0 0 1 0 0 2 0 0
40.000 0 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 4 1 2 0 2 1 2 2 3 2 2 2 0 2 2 0 2 1 2 1
44.000 0 0 0 1 0 1 0 0 1 0 0 0 0 0 0 0 0 1 0 0
45.000 0 0 1 1 1 0 1 0 0 0 1 0 0 0 0 0 1 1 0 1
46.000 1 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0
57.000 2 1 1 0 2 2 0 1 2 1 1 2 0 0 1 0 0 0 1 0
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 0 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 0 1 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 1
64.000 0 1 2 0 0 1 1 1 1 0 0 0 1 0 0 0 1 2 1 1
65.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
66.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1
67.000 0 2 2 0 0 1 2 2 1 0 0 0 1 1 0 0 2 1 1 1
68.000 1 3 3 1 1 2 1 0 1 0 1 0 0 1 0 1 1 1 2 3
69.000 0 0 0 1 0 0 0 0 0 0 0 0 1 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 0 0 0 1
71.000 1 1 1 0 1 1 1 0 0 0 1 0 0 0 0 0 1 0 0 4
72.000 1 0 0 1 0 0 1 1 0 1 1 0 2 1 1 0 0 0 1 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 0 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 0 0 0 0 1
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 0 0 0 0 0 0 0 0 0 0 0 0 0 1 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 1 0
106.000 0 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0
107.000 1 1 0 1 1 1 0 1 1 0 1 1 0 0 1 1 0 1 1 1
108.000 0 0 2 0 0 0 2 1 0 0 0 0 0 1 0 0 2 0 0 2
109.000 1 1 1 0 0 0 0 0 0 2 1 0 0 1 0 1 1 1 1 1
110.000 0 2 0 0 0 1 0 1 1 0 0 0 0 0 1 0 0 0 3 1
111.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
112.000 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
113.000 0 0 0 0 0 1 0 0 1 0 1 0 0 0 1 0 1 0 0 0
117.000 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 1 0 0 1
118.000 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
119.000 0 0 0 1 1 2 1 1 1 0 1 0 0 0 0 0 1 3 0 2
120.000 1 1 1 0 0 0 0 0 0 2 1 0 0 1 0 1 1 1 2 1
121.000 4 2 3 1 2 1 3 2 3 1 2 2 0 1 3 1 3 2 2 2
122.000 0 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 1 0
123.000 0 1 0 0 0 1 0 1 0 0 0 1 0 0 1 0 0 0 0 0
124.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0
125.000 0 0 0 0 1 0 1 0 0 0 0 0 1 0 0 1 0 0 0 1
126.000 0 0 0 0 0 0 2 0 0 0 1 1 0 0 1 0 0 2 0 0
132.000 0 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 4 1 2 0 2 1 2 2 3 2 2 2 0 2 2 0 2 1 2 1
136.000 0 0 0 1 0 1 0 0 1 0 0 0 0 0 1 0 0 1 0 0
137.000 0 0 0 1 1 0 1 0 0 0 1 0 0 0 0 0 1 1 0 1
138.000 1 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0
139.000 3 0 0 2 1 0 0 1 0 0 1 0 1 3 1 0 0 1 0 0
149.000 2 1 0 0 2 2 0 1 2 1 1 2 0 0 1 0 0 0 1 0
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 0 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 0 1 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 1 1
156.000 1 1 2 0 1 1 1 1 1 0 0 0 1 0 0 0 1 1 1 1
157.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
158.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1
159.000 0 2 2 0 1 1 2 1 1 0 0 0 1 1 0 0 2 1 1 1
160.000 3 3 3 1 1 2 1 0 1 0 1 0 0 1 0 1 1 0 2 3
161.000 0 0 0 1 0 0 0 0 0 0 0 0 1 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 0 0 0 1
163.000 1 1 1 0 1 0 1 0 0 0 1 0 0 0 0 0 1 0 0 4
164.000 1 0 0 1 0 0 1 1 0 1 1 0 2 1 1 0 0 0 1 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 0.423 0.454 0.381 0.186 0.278 0.340 0.381 0.340 0.371 0.186 0.299 0.216 0.134 0.237 0.299 0.124 0.412 0.340 0.412 0.557
#Overall_Average_Reported 0.319
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 130 PRO CD :M 129 ALA N : -0.663: 0
: 2613:M 129 ALA N :M 130 PRO 2HD : -0.412: 0
: 2613:M 38 PRO CD :M 37 ALA N : -0.662: 0
: 2613:M 37 ALA N :M 38 PRO 2HD : -0.413: 0
: 2613:M 37 ALA HA :M 33 SER OG : -0.407: 0
: 2613:M 43 ILE 2HG2 :M 149 ILE 3HD1 : -0.536: 0
: 2613:M 15 LEU 2HD1 :M 29 ILE 2HG2 : -0.482: 0
: 2613:M 43 ILE 1HG1 :M 29 ILE 3HG2 : -0.461: 0
: 2613:M 43 ILE 1HG1 :M 29 ILE 1HG1 : -0.456: 0
: 2613:M 149 ILE 2HG1 :M 55 LYS 2HB : -0.451: 0
: 2613:M 43 ILE 3HG2 :M 29 ILE 1HG1 : -0.432: 0
: 2613:M 55 LYS 1HB :M 54 GLY O : -0.418: 0
: 2613:M 140 PRO CD :M 139 SER 1HB : -0.527: 0
: 2613:M 140 PRO 2HD :M 139 SER 1HB : -0.496: 0
: 2613:M 140 PRO CD :M 139 SER CB : -0.453: 0
: 2613:M 57 ILE 3HD1 :M 135 ILE 2HG2 : -0.526: 0
: 2613:M 121 ILE 2HG2 :M 107 LEU 2HD1 : -0.481: 0
: 2613:M 121 ILE 3HG2 :M 135 ILE 1HG1 : -0.462: 0
: 2613:M 121 ILE 1HG1 :M 135 ILE 1HG1 : -0.437: 0
: 2613:M 57 ILE 2HG1 :M 147 LYS 2HB : -0.424: 0
: 2613:M 146 GLY O :M 147 LYS 1HB : -0.416: 0
: 2613:M 135 ILE 3HG2 :M 121 ILE 1HG1 : -0.415: 0
: 2613:M 47 SER 1HB :M 48 PRO CD : -0.524: 0
: 2613:M 47 SER 1HB :M 48 PRO 2HD : -0.507: 0
: 2613:M 47 SER CB :M 48 PRO CD : -0.463: 0
: 2613:M 144 LYS 2HE :M 138 TRP 1HB : -0.493: 0
: 2613:M 52 LYS 2HE :M 46 TRP 1HB : -0.476: 0
: 2613:M 72 LYS 2HG :M 164 LYS 2HG : -0.451: 0
: 2613:M 74 ASN O :M 75 LEU 2HB : -0.442: 0
: 2613:M 160 VAL 3HG1 :M 71 PHE 2HB : -0.417: 0
: 2613:M 75 LEU 3HD2 :M 160 VAL 1HG2 : -0.403: 0
: 2613:M 156 PHE O :M 160 VAL 3HG2 : -0.401: 0
: 2613:M 167 LEU 2HB :M 166 ASN O : -0.439: 0
: 2613:M 28 GLU CB :M 17 THR HA : -0.422: 0
: 2613:M 163 PHE 2HB :M 68 VAL 3HG1 : -0.416: 0
: 2613:M 120 GLU CB :M 109 THR HA : -0.415: 0
#sum2 ::13.78 clashscore : 13.78 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:296140 potential dots:18510.0 A^2:36 bumps:36 bumps B<40:940.6 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 28 GLU CB :M 17 THR HA : -0.500: 0
: 2613:M 120 GLU CB :M 109 THR HA : -0.496: 0
: 2613:M 159 MET 2HB :M 18 LEU 1HD2 : -0.489: 0
: 2613:M 155 GLU 1HG :M 18 LEU 2HB : -0.412: 0
: 2613:M 159 MET 2HG :M 156 PHE O : -0.411: 0
: 2613:M 121 ILE 2HG2 :M 107 LEU 2HD1 : -0.467: 0
: 2613:M 67 MET 2HB :M 110 LEU 1HD2 : -0.467: 0
: 2613:M 67 MET 2HG :M 64 PHE O : -0.418: 0
: 2613:M 135 ILE 3HG2 :M 121 ILE 1HG1 : -0.415: 0
: 2613:M 110 LEU 2HB :M 63 GLU 1HG : -0.405: 0
: 2613:M 15 LEU 2HD1 :M 29 ILE 2HG2 : -0.465: 0
: 2613:M 43 ILE 3HG2 :M 29 ILE 1HG1 : -0.417: 0
: 2613:M 160 VAL 1HG2 :M 75 LEU 2HD2 : -0.462: 0
: 2613:M 75 LEU CD2 :M 160 VAL 1HG2 : -0.434: 0
: 2613:M 71 PHE 2HB :M 160 VAL CG1 : -0.408: 0
: 2613:M 167 LEU 2HD2 :M 68 VAL 1HG2 : -0.460: 0
: 2613:M 167 LEU CD2 :M 68 VAL 1HG2 : -0.444: 0
: 2613:M 163 PHE 2HB :M 68 VAL CG1 : -0.412: 0
: 2613:M 131 ALA 1HB :M 123 ARG 2HB : -0.452: 0
: 2613:M 56 GLY 1HA :M 149 ILE HB : -0.450: 0
: 2613:M 31 ARG 2HB :M 39 ALA 1HB : -0.447: 0
: 2613:M 148 GLY 1HA :M 57 ILE HB : -0.445: 0
: 2613:M 106 HIS HA :M 122 ASN 2HB : -0.431: 0
: 2613:M 30 ASN 2HB :M 14 HIS HA : -0.419: 0
: 2613:M 20 GLU HA :M 26 THR HA : -0.413: 0
: 2613:M 112 GLU HA :M 118 THR HA : -0.403: 0
#sum2 ::9.95 clashscore : 9.95 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:296080 potential dots:18500.0 A^2:26 bumps:26 bumps B<40:767.4 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 75 LEU O :M 75 LEU HG : -0.722: 0
: 2613:M 75 LEU O :M 75 LEU CG : -0.563: 0
: 2613:M 75 LEU 3HD2 :M 160 VAL 1HG2 : -0.536: 0
: 2613:M 156 PHE O :M 159 MET 1HG : -0.521: 0
: 2613:M 159 MET HA :M 16 LEU CD2 : -0.509: 0
: 2613:M 43 ILE 1HG1 :M 29 ILE 1HG1 : -0.481: 0
: 2613:M 43 ILE 3HG2 :M 29 ILE 1HG1 : -0.470: 0
: 2613:M 29 ILE 2HD1 :M 16 LEU 3HD2 : -0.439: 0
: 2613:M 160 VAL 2HG2 :M 71 PHE CB : -0.408: 0
: 2613:M 156 PHE O :M 160 VAL 3HG2 : -0.406: 0
: 2613:M 167 LEU HG :M 167 LEU O : -0.717: 0
: 2613:M 68 VAL 1HG2 :M 167 LEU 3HD2 : -0.553: 0
: 2613:M 67 MET 1HG :M 64 PHE O : -0.514: 0
: 2613:M 167 LEU O :M 167 LEU CG : -0.514: 0
: 2613:M 108 LEU CD2 :M 67 MET HA : -0.506: 0
: 2613:M 135 ILE 3HG2 :M 121 ILE 1HG1 : -0.475: 0
: 2613:M 121 ILE 1HG1 :M 135 ILE 1HG1 : -0.465: 0
: 2613:M 121 ILE 2HD1 :M 108 LEU 3HD2 : -0.445: 0
: 2613:M 68 VAL 3HG2 :M 64 PHE O : -0.406: 0
: 2613:M 163 PHE CB :M 68 VAL 2HG2 : -0.402: 0
: 2613:M 99 PHE 1HB :M 98 GLU O : -0.463: 0
: 2613:M 7 PHE 1HB :M 6 GLU O : -0.458: 0
: 2613:M 28 GLU CB :M 17 THR HA : -0.432: 0
: 2613:M 120 GLU CB :M 109 THR HA : -0.420: 0
: 2613:M 50 HIS 2HB :M 49 ASP O : -0.410: 0
: 2613:M 45 ALA HA :M 27 LYS HA : -0.404: 0
: 2613:M 148 GLY 1HA :M 57 ILE HB : -0.402: 0
#sum2 ::10.33 clashscore : 10.33 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:296124 potential dots:18510.0 A^2:27 bumps:27 bumps B<40:804 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 : -0.606: 0
: 2613:M 38 PRO CD :M 37 ALA N : -0.601: 0
: 2613:M 148 GLY 2HA :M 136 ARG 1HD : -0.539: 0
: 2613:M 56 GLY 2HA :M 44 ARG 1HD : -0.538: 0
: 2613:M 48 PRO 1HD :M 47 SER 2HB : -0.523: 0
: 2613:M 47 SER 1HB :M 52 LYS 1HB : -0.469: 0
: 2613:M 139 SER 2HB :M 140 PRO 1HD : -0.518: 0
: 2613:M 144 LYS 1HB :M 139 SER 1HB : -0.482: 0
: 2613:M 68 VAL 1HG1 :M 167 LEU 2HB : -0.440: 0
: 2613:M 168 GLU 2HB :M 167 LEU O : -0.425: 0
: 2613:M 75 LEU 2HB :M 160 VAL 1HG1 : -0.430: 0
: 2613:M 76 GLU 2HB :M 75 LEU O : -0.415: 0
: 2613:M 137 ALA 2HB :M 119 LYS 1HG : -0.423: 0
: 2613:M 45 ALA 2HB :M 27 LYS 1HG : -0.421: 0
: 2613:M 72 LYS 1HG :M 69 ASP HA : -0.413: 0
: 2613:M 161 ASP HA :M 164 LYS 1HG : -0.413: 0
: 2613:M 29 ILE 2HG2 :M 15 LEU 2HD1 : -0.411: 0
: 2613:M 141 ASP OD1 :M 141 ASP C : -0.404: 0
: 2613:M 121 ILE 2HG2 :M 107 LEU 2HD1 : -0.402: 0
#sum2 ::7.27 clashscore : 7.27 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:296348 potential dots:18520.0 A^2:19 bumps:19 bumps B<40:860.5 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 57 ILE 3HD1 :M 135 ILE 2HG2 : -0.523: 0
: 2613:M 121 ILE 2HG2 :M 107 LEU 2HD1 : -0.503: 0
: 2613:M 121 ILE 1HG1 :M 135 ILE 1HG1 : -0.440: 0
: 2613:M 147 LYS 2HB :M 57 ILE HA : -0.438: 0
: 2613:M 43 ILE 2HG2 :M 149 ILE 3HD1 : -0.519: 0
: 2613:M 15 LEU 2HD1 :M 29 ILE 2HG2 : -0.495: 0
: 2613:M 43 ILE 1HG1 :M 29 ILE 1HG1 : -0.441: 0
: 2613:M 149 ILE HA :M 55 LYS 2HB : -0.424: 0
: 2613:M 166 ASN 2HB :M 163 PHE HA : -0.514: 0
: 2613:M 74 ASN 2HB :M 71 PHE HA : -0.512: 0
: 2613:M 37 ALA N :M 38 PRO 1HD : -0.495: 0
: 2613:M 37 ALA N :M 38 PRO CD : -0.416: 0
: 2613:M 130 PRO 1HD :M 129 ALA N : -0.493: 0
: 2613:M 129 ALA N :M 130 PRO CD : -0.410: 0
: 2613:M 33 SER HA :M 39 ALA HA : -0.492: 0
: 2613:M 139 SER 1HB :M 143 THR HA : -0.491: 0
: 2613:M 145 MET H :M 143 THR 2HG2 : -0.403: 0
: 2613:M 131 ALA HA :M 125 SER HA : -0.480: 0
: 2613:M 47 SER 1HB :M 51 THR HA : -0.473: 0
: 2613:M 160 VAL 1HG1 :M 75 LEU 1HB : -0.417: 0
: 2613:M 137 ALA HA :M 119 LYS HA : -0.412: 0
: 2613:M 167 LEU 1HB :M 68 VAL 1HG1 : -0.412: 0
: 2613:M 45 ALA HA :M 27 LYS HA : -0.405: 0
: 2613:M 159 MET 2HG :M 156 PHE O : -0.400: 0
#sum2 ::9.18 clashscore : 9.18 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:296076 potential dots:18500.0 A^2:24 bumps:24 bumps B<40:847.6 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 121 ILE 2HG2 :M 107 LEU 2HD1 : -0.531: 0
: 2613:M 15 LEU 2HD1 :M 29 ILE 2HG2 : -0.526: 0
: 2613:M 43 ILE 2HG2 :M 149 ILE 3HD1 : -0.487: 0
: 2613:M 56 GLY 1HA :M 149 ILE HB : -0.421: 0
: 2613:M 44 ARG 1HG :M 56 GLY 2HA : -0.418: 0
: 2613:M 57 ILE 3HD1 :M 135 ILE 2HG2 : -0.477: 0
: 2613:M 136 ARG 1HG :M 148 GLY 2HA : -0.424: 0
: 2613:M 148 GLY 1HA :M 57 ILE HB : -0.407: 0
: 2613:M 167 LEU 1HB :M 68 VAL 1HG1 : -0.467: 0
: 2613:M 68 VAL 3HG2 :M 64 PHE O : -0.410: 0
: 2613:M 81 HIS 1HB :M 80 HIS O : -0.462: 0
: 2613:M 160 VAL 1HG1 :M 75 LEU 1HB : -0.462: 0
: 2613:M 173 HIS 1HB :M 172 HIS O : -0.462: 0
: 2613:M 156 PHE O :M 160 VAL 3HG2 : -0.413: 0
: 2613:M 110 LEU CD2 :M 67 MET 2HB : -0.424: 0
: 2613:M 159 MET 2HB :M 18 LEU CD2 : -0.421: 0
: 2613:M 105 GLU 2HB :M 123 ARG 1HB : -0.413: 0
: 2613:M 55 LYS 1HB :M 54 GLY O : -0.413: 0
: 2613:M 146 GLY O :M 147 LYS 1HB : -0.410: 0
: 2613:M 74 ASN 1HB :M 71 PHE HA : -0.409: 0
: 2613:M 113 ASN O :M 117 TRP 1HB : -0.407: 0
: 2613:M 31 ARG 1HB :M 13 GLU 2HB : -0.404: 0
: 2613:M 119 LYS 1HE :M 119 LYS 1HB : -0.402: 0
: 2613:M 27 LYS 1HB :M 27 LYS 1HE : -0.401: 0
#sum2 ::9.18 clashscore : 9.18 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:296116 potential dots:18510.0 A^2:24 bumps:24 bumps B<40:913.6 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 159 MET HA :M 16 LEU CD2 : -0.552: 0
: 2613:M 29 ILE 2HD1 :M 16 LEU 3HD2 : -0.475: 0
: 2613:M 156 PHE O :M 159 MET 1HG : -0.470: 0
: 2613:M 43 ILE 1HG1 :M 29 ILE 1HG1 : -0.450: 0
: 2613:M 43 ILE 3HG2 :M 29 ILE 1HG1 : -0.418: 0
: 2613:M 108 LEU CD2 :M 67 MET HA : -0.550: 0
: 2613:M 67 MET 1HG :M 64 PHE O : -0.489: 0
: 2613:M 121 ILE 2HD1 :M 108 LEU 3HD2 : -0.468: 0
: 2613:M 121 ILE 1HG1 :M 135 ILE 1HG1 : -0.444: 0
: 2613:M 135 ILE 3HG2 :M 121 ILE 1HG1 : -0.410: 0
: 2613:M 160 VAL 1HG1 :M 75 LEU 1HB : -0.524: 0
: 2613:M 167 LEU 1HB :M 68 VAL 1HG1 : -0.505: 0
: 2613:M 166 ASN 2HB :M 163 PHE HA : -0.481: 0
: 2613:M 45 ALA HA :M 27 LYS HA : -0.470: 0
: 2613:M 33 SER HA :M 39 ALA HA : -0.469: 0
: 2613:M 74 ASN 2HB :M 71 PHE HA : -0.468: 0
: 2613:M 137 ALA HA :M 119 LYS HA : -0.449: 0
: 2613:M 131 ALA HA :M 125 SER HA : -0.446: 0
: 2613:M 126 PHE O :M 127 ASN C : -0.416: 0
: 2613:M 129 ALA N :M 126 PHE O : -0.414: 0
: 2613:M 37 ALA N :M 34 PHE O : -0.413: 0
: 2613:M 36 GLY N :M 34 PHE O : -0.408: 0
: 2613:M 34 PHE O :M 35 ASN C : -0.406: 0
: 2613:M 72 LYS 2HG :M 164 LYS 2HG : -0.403: 0
#sum2 ::9.18 clashscore : 9.18 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:295976 potential dots:18500.0 A^2:24 bumps:24 bumps B<40:828 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 31 ARG 2HB :M 39 ALA 1HB : -0.557: 0
: 2613:M 131 ALA 1HB :M 123 ARG 2HB : -0.550: 0
: 2613:M 72 LYS 2HG :M 164 LYS 2HG : -0.467: 0
: 2613:M 57 ILE 3HD1 :M 135 ILE 2HG2 : -0.460: 0
: 2613:M 121 ILE 2HG2 :M 107 LEU 2HD1 : -0.423: 0
: 2613:M 135 ILE 3HG2 :M 121 ILE 1HG1 : -0.402: 0
: 2613:M 43 ILE 2HG2 :M 149 ILE 3HD1 : -0.457: 0
: 2613:M 15 LEU 2HD1 :M 29 ILE 2HG2 : -0.417: 0
: 2613:M 43 ILE 3HG2 :M 29 ILE 1HG1 : -0.400: 0
: 2613:M 167 LEU O :M 168 GLU 2HB : -0.454: 0
: 2613:M 167 LEU HG :M 168 GLU H : -0.411: 0
: 2613:M 76 GLU 2HB :M 75 LEU O : -0.448: 0
: 2613:M 76 GLU H :M 75 LEU HG : -0.410: 0
: 2613:M 67 MET 1HG :M 64 PHE O : -0.436: 0
: 2613:M 108 LEU 1HD1 :M 67 MET HA : -0.400: 0
: 2613:M 106 HIS HA :M 122 ASN CB : -0.433: 0
: 2613:M 30 ASN CB :M 14 HIS HA : -0.429: 0
: 2613:M 30 ASN 2HB :M 14 HIS HA : -0.400: 0
: 2613:M 156 PHE O :M 159 MET 1HG : -0.428: 0
: 2613:M 119 LYS 1HG :M 110 LEU 2HD1 : -0.416: 0
: 2613:M 18 LEU 2HD1 :M 27 LYS 1HG : -0.413: 0
: 2613:M 140 PRO 1HD :M 139 SER 2HB : -0.406: 0
: 2613:M 47 SER 2HB :M 48 PRO 1HD : -0.404: 0
#sum2 ::8.80 clashscore : 8.80 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:296158 potential dots:18510.0 A^2:23 bumps:23 bumps B<40:934.4 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 68 VAL 1HG2 :M 167 LEU 3HD2 : -0.492: 0
: 2613:M 75 LEU 3HD2 :M 160 VAL 1HG2 : -0.481: 0
: 2613:M 57 ILE 3HD1 :M 135 ILE 2HG2 : -0.476: 0
: 2613:M 121 ILE 2HG2 :M 107 LEU 2HD1 : -0.449: 0
: 2613:M 57 ILE 2HD1 :M 136 ARG HA : -0.428: 0
: 2613:M 121 ILE 1HG1 :M 135 ILE 1HG1 : -0.426: 0
: 2613:M 135 ILE 3HG2 :M 121 ILE 1HG1 : -0.413: 0
: 2613:M 43 ILE 2HG2 :M 149 ILE 3HD1 : -0.465: 0
: 2613:M 15 LEU 2HD1 :M 29 ILE 2HG2 : -0.446: 0
: 2613:M 43 ILE 3HG2 :M 29 ILE 1HG1 : -0.428: 0
: 2613:M 44 ARG HA :M 149 ILE 2HD1 : -0.428: 0
: 2613:M 43 ILE 1HG1 :M 29 ILE 1HG1 : -0.410: 0
: 2613:M 156 PHE O :M 159 MET 1HG : -0.441: 0
: 2613:M 67 MET 1HG :M 64 PHE O : -0.429: 0
: 2613:M 21 ASN O :M 22 GLU 1HB : -0.422: 0
: 2613:M 155 GLU 1HG :M 27 LYS 2HE : -0.421: 0
: 2613:M 18 LEU 3HD1 :M 155 GLU 2HB : -0.402: 0
: 2613:M 63 GLU 1HG :M 119 LYS 2HE : -0.420: 0
: 2613:M 110 LEU 3HD1 :M 63 GLU 2HB : -0.403: 0
: 2613:M 113 ASN O :M 114 GLU 1HB : -0.415: 0
: 2613:M 115 LYS 1HB :M 114 GLU O : -0.413: 0
#sum2 ::8.04 clashscore : 8.04 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:296284 potential dots:18520.0 A^2:21 bumps:21 bumps B<40:738.9 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 120 GLU CB :M 109 THR HA : -0.462: 0
: 2613:M 109 THR HA :M 120 GLU 1HB : -0.431: 0
: 2613:M 17 THR HA :M 28 GLU CB : -0.458: 0
: 2613:M 130 PRO 1HD :M 129 ALA N : -0.458: 0
: 2613:M 28 GLU 1HB :M 17 THR HA : -0.428: 0
: 2613:M 130 PRO 2HD :M 129 ALA 3HB : -0.407: 0
: 2613:M 38 PRO 1HD :M 37 ALA N : -0.457: 0
: 2613:M 37 ALA 3HB :M 38 PRO 2HD : -0.410: 0
: 2613:M 57 ILE 3HD1 :M 135 ILE 2HG2 : -0.437: 0
: 2613:M 135 ILE 3HG2 :M 121 ILE 1HG1 : -0.430: 0
: 2613:M 43 ILE 2HG2 :M 149 ILE 3HD1 : -0.430: 0
: 2613:M 43 ILE 3HG2 :M 29 ILE 1HG1 : -0.422: 0
: 2613:M 164 LYS 2HG :M 72 LYS 2HG : -0.423: 0
: 2613:M 75 LEU 2HB :M 74 ASN O : -0.412: 0
: 2613:M 166 ASN O :M 167 LEU 2HB : -0.412: 0
: 2613:M 4 MET O :M 5 ALA 3HB : -0.407: 0
: 2613:M 97 ALA 3HB :M 96 MET O : -0.402: 0
#sum2 ::6.51 clashscore : 6.51 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:296122 potential dots:18510.0 A^2:17 bumps:17 bumps B<40:847.8 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 127 ASN 1HB :M 126 PHE O : -0.565: 0
: 2613:M 35 ASN 1HB :M 34 PHE O : -0.559: 0
: 2613:M 129 ALA 3HB :M 130 PRO 2HD : -0.482: 0
: 2613:M 37 ALA 3HB :M 38 PRO 2HD : -0.477: 0
: 2613:M 160 VAL 3HG1 :M 71 PHE 2HB : -0.466: 0
: 2613:M 43 ILE 2HG2 :M 149 ILE 3HD1 : -0.466: 0
: 2613:M 43 ILE 3HG2 :M 29 ILE 1HG1 : -0.413: 0
: 2613:M 120 GLU CB :M 109 THR HA : -0.465: 0
: 2613:M 137 ALA HA :M 119 LYS HA : -0.463: 0
: 2613:M 28 GLU CB :M 17 THR HA : -0.461: 0
: 2613:M 57 ILE 3HD1 :M 135 ILE 2HG2 : -0.460: 0
: 2613:M 121 ILE 2HG2 :M 107 LEU 2HD1 : -0.412: 0
: 2613:M 135 ILE 3HG2 :M 121 ILE 1HG1 : -0.401: 0
: 2613:M 45 ALA HA :M 27 LYS HA : -0.459: 0
: 2613:M 163 PHE 2HB :M 68 VAL 3HG1 : -0.457: 0
: 2613:M 72 LYS 2HG :M 164 LYS 2HG : -0.454: 0
: 2613:M 47 SER 1HB :M 48 PRO 1HD : -0.449: 0
: 2613:M 50 HIS 2HB :M 49 ASP O : -0.429: 0
: 2613:M 48 PRO O :M 49 ASP C : -0.423: 0
: 2613:M 50 HIS O :M 51 THR HB : -0.421: 0
: 2613:M 140 PRO 1HD :M 139 SER 1HB : -0.445: 0
: 2613:M 21 ASN O :M 23 LYS N : -0.445: 0
: 2613:M 142 HIS 2HB :M 141 ASP O : -0.433: 0
: 2613:M 141 ASP C :M 140 PRO O : -0.422: 0
: 2613:M 142 HIS O :M 143 THR HB : -0.421: 0
: 2613:M 113 ASN O :M 115 LYS N : -0.444: 0
#sum2 ::9.95 clashscore : 9.95 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:295894 potential dots:18490.0 A^2:26 bumps:26 bumps B<40:845.9 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 80 HIS 1HB :M 79 HIS O : -0.475: 0
: 2613:M 78 HIS O :M 79 HIS 2HB : -0.413: 0
: 2613:M 43 ILE 3HD1 :M 29 ILE 3HG2 : -0.470: 0
: 2613:M 57 ILE 2HG2 :M 43 ILE HB : -0.459: 0
: 2613:M 29 ILE 2HG2 :M 15 LEU 2HD1 : -0.437: 0
: 2613:M 57 ILE HB :M 147 LYS O : -0.414: 0
: 2613:M 121 ILE 3HG2 :M 135 ILE 3HD1 : -0.466: 0
: 2613:M 135 ILE HB :M 149 ILE 2HG2 : -0.449: 0
: 2613:M 121 ILE 2HG2 :M 107 LEU 2HD1 : -0.436: 0
: 2613:M 149 ILE HB :M 55 LYS O : -0.403: 0
: 2613:M 171 HIS O :M 172 HIS 1HB : -0.465: 0
: 2613:M 170 HIS O :M 171 HIS 2HB : -0.414: 0
: 2613:M 34 PHE 1HB :M 37 ALA 3HB : -0.447: 0
: 2613:M 39 ALA 1HB :M 31 ARG 2HB : -0.442: 0
: 2613:M 129 ALA 3HB :M 126 PHE 1HB : -0.442: 0
: 2613:M 39 ALA HA :M 33 SER HA : -0.403: 0
: 2613:M 131 ALA 1HB :M 123 ARG 2HB : -0.434: 0
: 2613:M 27 LYS 1HB :M 27 LYS 2HE : -0.408: 0
: 2613:M 168 GLU HA :M 168 GLU OE1 : -0.402: 0
#sum2 ::7.27 clashscore : 7.27 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:295923 potential dots:18500.0 A^2:19 bumps:19 bumps B<40:916.4 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 : -0.650: 0
: 2613:M 37 ALA HA :M 33 SER 2HB : -0.493: 0
: 2613:M 37 ALA N :M 38 PRO 2HD : -0.465: 0
: 2613:M 129 ALA N :M 130 PRO CD : -0.643: 0
: 2613:M 125 SER 2HB :M 129 ALA HA : -0.479: 0
: 2613:M 129 ALA N :M 130 PRO 2HD : -0.479: 0
: 2613:M 72 LYS 1HE :M 168 GLU 2HG : -0.486: 0
: 2613:M 164 LYS 1HE :M 76 GLU 2HG : -0.486: 0
: 2613:M 69 ASP O :M 72 LYS 1HG : -0.420: 0
: 2613:M 161 ASP O :M 164 LYS 1HG : -0.408: 0
: 2613:M 75 LEU O :M 75 LEU HG : -0.479: 0
: 2613:M 167 LEU HG :M 167 LEU O : -0.478: 0
: 2613:M 67 MET 1HG :M 64 PHE O : -0.419: 0
: 2613:M 159 MET 1HG :M 156 PHE O : -0.416: 0
: 2613:M 48 PRO 1HD :M 47 SER 2HB : -0.409: 0
: 2613:M 139 SER 2HB :M 140 PRO 1HD : -0.408: 0
#sum2 ::6.12 clashscore : 6.12 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:296410 potential dots:18530.0 A^2:16 bumps:16 bumps B<40:823.7 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 48 PRO 2HD :M 47 SER 1HB : -0.549: 0
: 2613:M 46 TRP O :M 47 SER CB : -0.410: 0
: 2613:M 48 PRO 2HD :M 47 SER CB : -0.410: 0
: 2613:M 139 SER 1HB :M 140 PRO 2HD : -0.548: 0
: 2613:M 138 TRP O :M 139 SER CB : -0.415: 0
: 2613:M 140 PRO 2HD :M 139 SER CB : -0.410: 0
: 2613:M 164 LYS 2HG :M 72 LYS 2HG : -0.528: 0
: 2613:M 129 ALA N :M 130 PRO CD : -0.518: 0
: 2613:M 135 ILE 2HD1 :M 43 ILE 2HD1 : -0.516: 0
: 2613:M 121 ILE 1HG1 :M 135 ILE 1HG1 : -0.490: 0
: 2613:M 29 ILE 1HG1 :M 43 ILE 1HG1 : -0.485: 0
: 2613:M 38 PRO CD :M 37 ALA N : -0.513: 0
: 2613:M 108 LEU 1HD1 :M 67 MET HA : -0.477: 0
: 2613:M 167 LEU 3HD2 :M 68 VAL 1HG2 : -0.469: 0
: 2613:M 166 ASN O :M 167 LEU 2HB : -0.418: 0
: 2613:M 120 GLU CB :M 109 THR HA : -0.466: 0
: 2613:M 17 THR HA :M 28 GLU CB : -0.460: 0
: 2613:M 75 LEU 3HD2 :M 160 VAL 1HG2 : -0.457: 0
: 2613:M 74 ASN O :M 75 LEU 2HB : -0.411: 0
: 2613:M 159 MET HA :M 16 LEU 1HD1 : -0.448: 0
#sum2 ::7.65 clashscore : 7.65 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:295982 potential dots:18500.0 A^2:20 bumps:20 bumps B<40:925.6 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 25 TRP 1HB :M 21 ASN 2HB : -0.596: 0
: 2613:M 117 TRP 1HB :M 113 ASN 2HB : -0.585: 0
: 2613:M 131 ALA 1HB :M 123 ARG 2HB : -0.485: 0
: 2613:M 76 GLU 2HB :M 75 LEU O : -0.475: 0
: 2613:M 75 LEU O :M 76 GLU CB : -0.451: 0
: 2613:M 15 LEU 2HD1 :M 29 ILE 2HG2 : -0.474: 0
: 2613:M 43 ILE 3HG2 :M 29 ILE 1HG1 : -0.426: 0
: 2613:M 43 ILE 2HG2 :M 149 ILE 3HD1 : -0.413: 0
: 2613:M 29 ILE 1HD1 :M 18 LEU 1HD1 : -0.401: 0
: 2613:M 167 LEU O :M 168 GLU 2HB : -0.473: 0
: 2613:M 167 LEU O :M 168 GLU CB : -0.447: 0
: 2613:M 31 ARG 2HB :M 39 ALA 1HB : -0.465: 0
: 2613:M 121 ILE 2HG2 :M 107 LEU 2HD1 : -0.460: 0
: 2613:M 135 ILE 3HG2 :M 121 ILE 1HG1 : -0.430: 0
: 2613:M 57 ILE 3HD1 :M 135 ILE 2HG2 : -0.418: 0
: 2613:M 121 ILE 1HD1 :M 110 LEU 1HD1 : -0.400: 0
: 2613:M 35 ASN 1HB :M 34 PHE O : -0.454: 0
: 2613:M 127 ASN 1HB :M 126 PHE O : -0.454: 0
: 2613:M 47 SER 2HB :M 48 PRO 1HD : -0.451: 0
: 2613:M 164 LYS 1HB :M 72 LYS 1HB : -0.446: 0
: 2613:M 140 PRO 1HD :M 139 SER 2HB : -0.439: 0
: 2613:M 36 GLY O :M 37 ALA 3HB : -0.406: 0
: 2613:M 136 ARG 2HB :M 138 TRP CD1 : -0.403: 0
#sum2 ::8.80 clashscore : 8.80 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:296088 potential dots:18510.0 A^2:23 bumps:23 bumps B<40:803.8 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 68 VAL 1HG1 :M 167 LEU 2HB : -0.461: 0
: 2613:M 75 LEU 2HB :M 160 VAL 1HG1 : -0.459: 0
: 2613:M 17 THR HA :M 28 GLU CB : -0.454: 0
: 2613:M 120 GLU CB :M 109 THR HA : -0.453: 0
: 2613:M 121 ILE 2HG2 :M 107 LEU 2HD1 : -0.443: 0
: 2613:M 37 ALA HA :M 33 SER 1HB : -0.443: 0
: 2613:M 129 ALA HA :M 125 SER 1HB : -0.443: 0
: 2613:M 129 ALA N :M 130 PRO CD : -0.427: 0
: 2613:M 37 ALA N :M 38 PRO CD : -0.425: 0
: 2613:M 29 ILE 2HG2 :M 15 LEU 2HD1 : -0.436: 0
#sum2 ::3.83 clashscore : 3.83 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:296192 potential dots:18510.0 A^2:10 bumps:10 bumps B<40:904.2 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 108 LEU CD2 :M 67 MET HA : -0.563: 0
: 2613:M 135 ILE 3HG2 :M 121 ILE 1HG1 : -0.469: 0
: 2613:M 121 ILE 2HD1 :M 108 LEU 3HD2 : -0.466: 0
: 2613:M 121 ILE 1HG1 :M 135 ILE 1HG1 : -0.443: 0
: 2613:M 67 MET 1HG :M 64 PHE O : -0.408: 0
: 2613:M 159 MET HA :M 16 LEU CD2 : -0.554: 0
: 2613:M 43 ILE 3HG2 :M 29 ILE 1HG1 : -0.485: 0
: 2613:M 29 ILE 2HD1 :M 16 LEU 3HD2 : -0.479: 0
: 2613:M 43 ILE 1HG1 :M 29 ILE 1HG1 : -0.440: 0
: 2613:M 156 PHE O :M 159 MET 1HG : -0.404: 0
: 2613:M 54 GLY 1HA :M 52 LYS 2HE : -0.442: 0
: 2613:M 146 GLY 1HA :M 144 LYS 2HE : -0.438: 0
: 2613:M 45 ALA HA :M 27 LYS HA : -0.432: 0
: 2613:M 120 GLU CB :M 109 THR HA : -0.421: 0
: 2613:M 28 GLU CB :M 17 THR HA : -0.420: 0
: 2613:M 137 ALA HA :M 119 LYS HA : -0.419: 0
: 2613:M 163 PHE 2HB :M 68 VAL 2HG2 : -0.419: 0
: 2613:M 11 ILE 1HG1 :M 32 VAL 2HG2 : -0.414: 0
: 2613:M 160 VAL 2HG2 :M 71 PHE 2HB : -0.408: 0
: 2613:M 113 ASN 1HB :M 117 TRP O : -0.403: 0
: 2613:M 21 ASN 1HB :M 25 TRP O : -0.403: 0
: 2613:M 124 VAL 2HG2 :M 103 ILE 1HG1 : -0.402: 0
#sum2 ::8.42 clashscore : 8.42 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:295832 potential dots:18490.0 A^2:22 bumps:22 bumps B<40:777.9 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 44 ARG 1HG :M 56 GLY 2HA : -0.505: 0
: 2613:M 136 ARG 1HG :M 148 GLY 2HA : -0.501: 0
: 2613:M 129 ALA 3HB :M 126 PHE H : -0.471: 0
: 2613:M 126 PHE O :M 127 ASN 1HB : -0.400: 0
: 2613:M 37 ALA 3HB :M 34 PHE H : -0.462: 0
: 2613:M 34 PHE O :M 35 ASN 1HB : -0.405: 0
: 2613:M 94 LYS HA :M 55 LYS 2HE : -0.449: 0
: 2613:M 47 SER 2HB :M 48 PRO 1HD : -0.448: 0
: 2613:M 120 GLU CB :M 109 THR HA : -0.447: 0
: 2613:M 140 PRO 1HD :M 139 SER 2HB : -0.445: 0
: 2613:M 28 GLU CB :M 17 THR HA : -0.440: 0
: 2613:M 156 PHE O :M 159 MET 1HG : -0.437: 0
: 2613:M 27 LYS 1HE :M 27 LYS 1HB : -0.436: 0
: 2613:M 67 MET 1HG :M 64 PHE O : -0.436: 0
: 2613:M 27 LYS 2HD :M 45 ALA 2HB : -0.406: 0
: 2613:M 64 PHE O :M 68 VAL 3HG2 : -0.402: 0
: 2613:M 119 LYS 1HE :M 119 LYS 1HB : -0.434: 0
: 2613:M 147 LYS 2HE :M 2 LYS HA : -0.434: 0
: 2613:M 119 LYS 2HD :M 137 ALA 2HB : -0.429: 0
: 2613:M 43 ILE 3HG2 :M 29 ILE 1HG1 : -0.426: 0
: 2613:M 15 LEU 2HD1 :M 29 ILE 2HG2 : -0.410: 0
: 2613:M 135 ILE 3HG2 :M 121 ILE 1HG1 : -0.416: 0
: 2613:M 121 ILE 2HG2 :M 107 LEU 2HD1 : -0.412: 0
#sum2 ::8.80 clashscore : 8.80 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:296106 potential dots:18510.0 A^2:23 bumps:23 bumps B<40:880.1 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 37 ALA H :M 38 PRO CD : -0.622: 0
: 2613:M 37 ALA H :M 38 PRO 1HD : -0.561: 0
: 2613:M 130 PRO CD :M 129 ALA H : -0.609: 0
: 2613:M 130 PRO 1HD :M 129 ALA H : -0.544: 0
: 2613:M 75 LEU O :M 75 LEU HG : -0.578: 0
: 2613:M 75 LEU 3HD2 :M 160 VAL 1HG2 : -0.477: 0
: 2613:M 156 PHE O :M 160 VAL 3HG2 : -0.409: 0
: 2613:M 167 LEU HG :M 167 LEU O : -0.574: 0
: 2613:M 68 VAL 1HG2 :M 167 LEU 3HD2 : -0.470: 0
: 2613:M 64 PHE O :M 68 VAL 3HG2 : -0.425: 0
: 2613:M 164 LYS 1HG :M 72 LYS 1HG : -0.528: 0
: 2613:M 15 LEU 2HD1 :M 29 ILE 2HG2 : -0.497: 0
: 2613:M 121 ILE 2HG2 :M 107 LEU 2HD1 : -0.497: 0
: 2613:M 43 ILE 2HG2 :M 149 ILE 3HD1 : -0.429: 0
: 2613:M 43 ILE 3HG2 :M 29 ILE 1HG1 : -0.414: 0
: 2613:M 135 ILE 3HG2 :M 121 ILE 1HG1 : -0.414: 0
: 2613:M 57 ILE 3HD1 :M 135 ILE 2HG2 : -0.413: 0
: 2613:M 120 GLU CB :M 109 THR HA : -0.445: 0
: 2613:M 66 THR 1HG2 :M 110 LEU HA : -0.440: 0
: 2613:M 110 LEU CD2 :M 67 MET 2HB : -0.435: 0
: 2613:M 110 LEU HG :M 120 GLU HA : -0.400: 0
: 2613:M 28 GLU CB :M 17 THR HA : -0.435: 0
: 2613:M 18 LEU HA :M 158 THR 1HG2 : -0.433: 0
: 2613:M 13 GLU O :M 30 ASN 1HB : -0.433: 0
: 2613:M 159 MET 2HB :M 18 LEU CD2 : -0.430: 0
: 2613:M 122 ASN 1HB :M 105 GLU O : -0.423: 0
: 2613:M 155 GLU 2HG :M 19 SER 1HB : -0.404: 0
#sum2 ::10.33 clashscore : 10.33 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:296077 potential dots:18500.0 A^2:27 bumps:27 bumps B<40:883.4 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 2613:M 160 VAL 1HG2 :M 75 LEU 1HB : -0.595: 0
: 2613:M 70 ALA 1HB :M 108 LEU 2HD2 : -0.558: 0
: 2613:M 160 VAL 2HG2 :M 71 PHE CB : -0.448: 0
: 2613:M 160 VAL 2HG2 :M 71 PHE 2HB : -0.447: 0
: 2613:M 74 ASN 1HB :M 71 PHE HA : -0.444: 0
: 2613:M 108 LEU 1HD2 :M 71 PHE CZ : -0.418: 0
: 2613:M 68 VAL 1HG2 :M 167 LEU 1HB : -0.593: 0
: 2613:M 16 LEU 2HD2 :M 162 ALA 1HB : -0.566: 0
: 2613:M 166 ASN 1HB :M 163 PHE HA : -0.450: 0
: 2613:M 68 VAL 2HG2 :M 163 PHE CB : -0.445: 0
: 2613:M 163 PHE 2HB :M 68 VAL 2HG2 : -0.433: 0
: 2613:M 16 LEU 1HD2 :M 163 PHE CZ : -0.407: 0
: 2613:M 168 GLU OE1 :M 168 GLU O : -0.538: 0
: 2613:M 76 GLU O :M 76 GLU OE1 : -0.536: 0
: 2613:M 18 LEU HA :M 158 THR 1HG2 : -0.520: 0
: 2613:M 120 GLU CB :M 109 THR HA : -0.508: 0
: 2613:M 28 GLU CB :M 17 THR HA : -0.507: 0
: 2613:M 66 THR 1HG2 :M 110 LEU HA : -0.506: 0
: 2613:M 63 GLU 1HG :M 119 LYS 2HE : -0.480: 0
: 2613:M 119 LYS 2HD :M 137 ALA 2HB : -0.409: 0
: 2613:M 155 GLU 1HG :M 27 LYS 2HE : -0.478: 0
: 2613:M 27 LYS 2HD :M 45 ALA 2HB : -0.408: 0
: 2613:M 130 PRO CD :M 129 ALA N : -0.469: 0
: 2613:M 129 ALA 3HB :M 130 PRO 2HD : -0.457: 0
: 2613:M 38 PRO CD :M 37 ALA N : -0.466: 0
: 2613:M 37 ALA 3HB :M 38 PRO 2HD : -0.445: 0
: 2613:M 5 ALA O :M 6 GLU 1HB : -0.463: 0
: 2613:M 97 ALA O :M 98 GLU 1HB : -0.462: 0
: 2613:M 121 ILE 1HG1 :M 135 ILE 1HG1 : -0.443: 0
: 2613:M 121 ILE 2HG2 :M 107 LEU 2HD1 : -0.441: 0
: 2613:M 15 LEU 2HD1 :M 29 ILE 2HG2 : -0.439: 0
: 2613:M 43 ILE 1HG1 :M 29 ILE 1HG1 : -0.431: 0
: 2613:M 159 MET 2HE :M 156 PHE HA : -0.436: 0
: 2613:M 101 PHE HA :M 125 SER O : -0.432: 0
: 2613:M 33 SER O :M 9 PHE HA : -0.426: 0
: 2613:M 48 PRO 2HD :M 25 TRP HA : -0.425: 0
: 2613:M 117 TRP HA :M 140 PRO 2HD : -0.413: 0
: 2613:M 67 MET 2HE :M 64 PHE HA : -0.407: 0
#sum2 ::14.54 clashscore : 14.54 clashscore B<40
#summary::2613 atoms:2613 atoms B<40:296164 potential dots:18510.0 A^2:38 bumps:38 bumps B<40:805.9 score
Output from PDB validation software
Summary from PDB validation
May. 14, 14:52:08 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
------------------------------------------------------------------------
0.077 PRO A 38 1 CD - N 1.550 1.473
0.077 PRO B 38 1 CD - N 1.550 1.473
0.061 PRO A 38 4 CD - N 1.534 1.473
0.060 PRO B 38 4 CD - N 1.533 1.473
0.063 PRO A 38 5 CD - N 1.536 1.473
0.064 PRO B 38 5 CD - N 1.537 1.473
0.059 PRO B 38 8 CD - N 1.532 1.473
0.087 PRO A 38 13 CD - N 1.560 1.473
0.088 PRO B 38 13 CD - N 1.561 1.473
0.061 PRO A 48 14 CD - N 1.534 1.473
0.060 PRO B 48 14 CD - N 1.533 1.473
0.062 PRO A 38 19 CD - N 1.535 1.473
0.063 PRO B 38 19 CD - N 1.536 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
--------------------------------------------------------------------------------
-4.5 MET A 4 7 N - CA - C 106.7 111.2
-4.5 MET B 4 7 N - CA - C 106.7 111.2
-4.0 HIS A 81 12 N - CA - C 107.2 111.2
-4.0 HIS B 81 12 N - CA - C 107.2 111.2
-4.0 HIS A 78 20 N - CA - C 107.2 111.2
-3.9 HIS B 78 20 N - CA - C 107.3 111.2
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) HD1
HIS( 1 A 78) HE2
HIS( 1 A 79) HE2
HIS( 1 A 80) HE2
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) HD1
HIS( 1 B 78) HE2
HIS( 1 B 79) HE2
HIS( 1 B 80) HE2
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) HD1
GLU( 2 A 62) HE2
GLU( 2 A 63) HE2
ASP( 2 A 69) HD2
GLU( 2 A 76) HE2
HIS( 2 A 77) HD1
HIS( 2 A 78) HD1
HIS( 2 A 79) HD1
HIS( 2 A 80) HD1
HIS( 2 A 81) HE2
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) HD1
GLU( 2 B 62) HE2
GLU( 2 B 63) HE2
ASP( 2 B 69) HD2
GLU( 2 B 76) HE2
HIS( 2 B 77) HD1
HIS( 2 B 78) HD1
HIS( 2 B 79) HD1
HIS( 2 B 80) HD1
HIS( 2 B 81) HE2
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) HE2
HIS( 3 A 78) HE2
HIS( 3 A 79) HE2
HIS( 3 A 80) HD1
HIS( 3 A 81) HD1
HIS( 3 A 82) HE2
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) HE2
HIS( 3 B 78) HE2
HIS( 3 B 79) HE2
HIS( 3 B 80) HD1
HIS( 3 B 81) HD1
HIS( 3 B 82) HE2
GLU( 4 A 6) HE2
GLU( 4 A 10) HE2
GLU( 4 A 12) HE2
GLU( 4 A 13) HE2
HIS( 4 A 14) HD1
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) HD1
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) HE2
HIS( 4 A 79) HD1
HIS( 4 A 80) HE2
HIS( 4 A 81) HD1
HIS( 4 A 82) HD1
GLU( 4 B 6) HE2
GLU( 4 B 10) HE2
GLU( 4 B 12) HE2
GLU( 4 B 13) HE2
HIS( 4 B 14) HD1
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) HD1
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) HE2
HIS( 4 B 79) HD1
HIS( 4 B 80) HE2
HIS( 4 B 81) HD1
HIS( 4 B 82) HD1
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) HD1
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) HD1
HIS( 5 A 79) HE2
HIS( 5 A 80) HD1
HIS( 5 A 81) HD1
HIS( 5 A 82) HD1
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) HD1
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) HD1
HIS( 5 B 79) HE2
HIS( 5 B 80) HD1
HIS( 5 B 81) HD1
HIS( 5 B 82) HD1
GLU( 6 A 6) HE2
GLU( 6 A 10) HE2
GLU( 6 A 12) HE2
GLU( 6 A 13) HE2
HIS( 6 A 14) HD1
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) HD1
GLU( 6 A 62) HE2
GLU( 6 A 63) HE2
ASP( 6 A 69) HD2
GLU( 6 A 76) HE2
HIS( 6 A 77) HD1
HIS( 6 A 78) HE2
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) HD1
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) HD1
GLU( 6 B 62) HE2
GLU( 6 B 63) HE2
ASP( 6 B 69) HD2
GLU( 6 B 76) HE2
HIS( 6 B 77) HD1
HIS( 6 B 78) HE2
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) HE2
HIS( 7 A 79) HE2
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) HE2
HIS( 7 B 79) HE2
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) HE2
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) HE2
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) HE2
HIS( 9 A 79) HE2
HIS( 9 A 80) HE2
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) HE2
HIS( 9 B 79) HE2
HIS( 9 B 80) HE2
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) HD1
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) HD1
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) HD1
HIS( 10 A 79) HE2
HIS( 10 A 80) HD1
HIS( 10 A 81) HE2
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) HD1
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) HD1
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) HD1
HIS( 10 B 79) HE2
HIS( 10 B 80) HD1
HIS( 10 B 81) HE2
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) HD1
HIS( 11 A 79) HD1
HIS( 11 A 80) HD1
HIS( 11 A 81) HE2
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) HD1
HIS( 11 B 79) HD1
HIS( 11 B 80) HD1
HIS( 11 B 81) HE2
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) HD1
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) HE2
HIS( 12 A 79) HD1
HIS( 12 A 80) HD1
HIS( 12 A 81) HD1
HIS( 12 A 82) HD1
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) HD1
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) HE2
HIS( 12 B 79) HD1
HIS( 12 B 80) HD1
HIS( 12 B 81) HD1
HIS( 12 B 82) HD1
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) HE2
HIS( 13 A 78) HD1
HIS( 13 A 79) HE2
HIS( 13 A 80) HD1
HIS( 13 A 81) HE2
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) HE2
HIS( 13 B 78) HD1
HIS( 13 B 79) HE2
HIS( 13 B 80) HD1
HIS( 13 B 81) HE2
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) HD1
GLU( 14 A 62) HE2
GLU( 14 A 63) HE2
ASP( 14 A 69) HD2
GLU( 14 A 76) HE2
HIS( 14 A 77) HE2
HIS( 14 A 78) HD1
HIS( 14 A 79) HE2
HIS( 14 A 80) HE2
HIS( 14 A 81) HD1
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) HD1
GLU( 14 B 62) HE2
GLU( 14 B 63) HE2
ASP( 14 B 69) HD2
GLU( 14 B 76) HE2
HIS( 14 B 77) HE2
HIS( 14 B 78) HD1
HIS( 14 B 79) HE2
HIS( 14 B 80) HE2
HIS( 14 B 81) HD1
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) HD1
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) HD1
GLU( 15 A 62) HE2
GLU( 15 A 63) HE2
ASP( 15 A 69) HD2
GLU( 15 A 76) HE2
HIS( 15 A 77) HD1
HIS( 15 A 78) HD1
HIS( 15 A 79) HE2
HIS( 15 A 80) HD1
HIS( 15 A 81) HD1
HIS( 15 A 82) HE2
GLU( 15 B 6) HE2
GLU( 15 B 10) HE2
GLU( 15 B 12) HE2
GLU( 15 B 13) HE2
HIS( 15 B 14) HD1
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) HD1
GLU( 15 B 62) HE2
GLU( 15 B 63) HE2
ASP( 15 B 69) HD2
GLU( 15 B 76) HE2
HIS( 15 B 77) HD1
HIS( 15 B 78) HD1
HIS( 15 B 79) HE2
HIS( 15 B 80) HD1
HIS( 15 B 81) HD1
HIS( 15 B 82) HE2
GLU( 16 A 6) HE2
GLU( 16 A 10) HE2
GLU( 16 A 12) HE2
GLU( 16 A 13) HE2
HIS( 16 A 14) HD1
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) HD1
HIS( 16 A 80) HD1
HIS( 16 A 81) HE2
HIS( 16 A 82) HD1
GLU( 16 B 6) HE2
GLU( 16 B 10) HE2
GLU( 16 B 12) HE2
GLU( 16 B 13) HE2
HIS( 16 B 14) HD1
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) HD1
HIS( 16 B 80) HD1
HIS( 16 B 81) HE2
HIS( 16 B 82) HD1
GLU( 17 A 6) HE2
GLU( 17 A 10) HE2
GLU( 17 A 12) HE2
GLU( 17 A 13) HE2
HIS( 17 A 14) HD1
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) HE2
HIS( 17 A 78) HD1
HIS( 17 A 79) HE2
HIS( 17 A 80) HD1
HIS( 17 A 81) HD1
HIS( 17 A 82) HE2
GLU( 17 B 6) HE2
GLU( 17 B 10) HE2
GLU( 17 B 12) HE2
GLU( 17 B 13) HE2
HIS( 17 B 14) HD1
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) HE2
HIS( 17 B 78) HD1
HIS( 17 B 79) HE2
HIS( 17 B 80) HD1
HIS( 17 B 81) HD1
HIS( 17 B 82) HE2
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) HE2
HIS( 18 A 78) HD1
HIS( 18 A 79) HE2
HIS( 18 A 80) HD1
HIS( 18 A 81) HD1
HIS( 18 A 82) HE2
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) HE2
HIS( 18 B 78) HD1
HIS( 18 B 79) HE2
HIS( 18 B 80) HD1
HIS( 18 B 81) HD1
HIS( 18 B 82) HE2
GLU( 19 A 6) HE2
GLU( 19 A 10) HE2
GLU( 19 A 12) HE2
GLU( 19 A 13) HE2
HIS( 19 A 14) HD1
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) HE2
HIS( 19 A 78) HD1
HIS( 19 A 79) HE2
HIS( 19 A 80) HD1
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) HD1
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) HE2
HIS( 19 B 78) HD1
HIS( 19 B 79) HE2
HIS( 19 B 80) HD1
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) HD1
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) HD1
HIS( 20 A 79) HD1
HIS( 20 A 80) HE2
HIS( 20 A 81) HE2
HIS( 20 A 82) HD1
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) HD1
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) HD1
HIS( 20 B 79) HD1
HIS( 20 B 80) HE2
HIS( 20 B 81) HE2
HIS( 20 B 82) HD1
==> 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_R3Cons_em_bcr3.pdb: Missing KEYWDS records
SPR104_R3Cons_em_bcr3.pdb: Missing TITLE record