Detailed results of PFR193A_R3_em_bcr3 by PSVS
Output from PDBStat
Constraints analysis
table of NOE constraints
# -------------- SUMMARY OF RESTRAINTS ---------------
# TOTAL NUMBER OF NOE RESTRAINTS : 2719
# INTRA-RESIDUE RESTRAINTS (I=J) : 523
# SEQUENTIAL RESTRAINTS (I-J)=1 : 686
# BACKBONE-BACKBONE : 167
# BACKBONE-SIDE CHAIN : 137
# SIDE CHAIN-SIDE CHAIN : 382
# MEDIUM RANGE RESTRAINTS 1<(I-J)<5 : 271
# BACKBONE-BACKBONE : 25
# BACKBONE-SIDE CHAIN : 32
# SIDE CHAIN-SIDE CHAIN : 214
# LONG RANGE RESTRAINTS (I-J)>=5 : 1239
# TOTAL HYDROGEN BOND RESTRAINTS : 0
# LONG RANGE H-BOND RESTR. (I-J)>=5 : 0
# DISULFIDE RESTRAINTS : 0
# INTRA-CHAIN RESTRAINTS : 2719
# INTER-CHAIN RESTRAINTS : 0
# AMBIGUOUS RESTRAINTS : 0
# -----------------------------------------------------
# -----------------------------------------------------
# -----------------------------------------------------
# RES # INTRA INTER seq med lng InterChain
MET 1 1 2.5 0.0 2.5 0.0 0.0
GLU 2 1 9.0 2.0 0.0 7.0 0.0
PHE 3 3 23.0 7.5 2.5 13.0 0.0
PRO 4 0 29.5 9.5 1.5 18.5 0.0
ASP 5 0 23.5 6.0 0.5 17.0 0.0
LEU 6 11 29.5 6.0 1.5 22.0 0.0
THR 7 3 26.0 10.0 1.5 14.5 0.0
VAL 8 2 29.0 10.5 0.5 18.0 0.0
GLU 9 2 21.0 8.0 1.5 11.5 0.0
ILE 10 12 33.0 6.5 1.0 25.5 0.0
LYS 11 18 12.5 6.5 0.5 5.5 0.0
GLY 12 0 13.5 7.5 0.5 5.5 0.0
PRO 13 0 21.0 6.0 5.0 10.0 0.0
ASP 14 2 14.0 6.5 1.0 6.5 0.0
VAL 15 5 18.0 8.0 2.0 8.0 0.0
VAL 16 4 27.0 8.0 6.0 13.0 0.0
GLY 17 0 16.0 7.5 5.5 3.0 0.0
VAL 18 5 31.5 10.0 2.0 19.5 0.0
ASN 19 4 16.5 9.0 0.0 7.5 0.0
LYS 20 18 19.0 7.5 8.5 3.0 0.0
LEU 21 12 20.5 10.0 2.0 8.5 0.0
ALA 22 1 20.0 7.0 2.0 11.0 0.0
GLU 23 6 18.0 6.5 2.0 9.5 0.0
TYR 24 6 39.0 7.0 2.0 30.0 0.0
GLU 25 5 20.0 5.0 1.0 14.0 0.0
VAL 26 5 25.5 4.0 0.0 21.5 0.0
HIS 27 3 19.5 4.0 1.0 14.5 0.0
VAL 28 2 22.0 7.5 0.0 14.5 0.0
LYS 29 11 28.0 8.5 4.5 15.0 0.0
ASN 30 6 34.5 6.5 2.0 26.0 0.0
LEU 31 9 22.0 5.5 5.0 11.5 0.0
GLY 32 0 11.5 3.0 3.5 5.0 0.0
GLY 33 0 9.0 3.0 0.5 5.5 0.0
ILE 34 10 33.0 7.0 3.5 22.5 0.0
GLY 35 0 17.5 6.0 0.0 11.5 0.0
VAL 36 5 23.5 6.0 4.5 13.0 0.0
PRO 37 0 12.5 9.5 0.5 2.5 0.0
SER 38 1 10.0 7.5 2.5 0.0 0.0
THR 39 2 16.0 6.5 2.5 7.0 0.0
LYS 40 16 17.0 8.0 0.0 9.0 0.0
VAL 41 5 24.0 6.5 0.0 17.5 0.0
ARG 42 1 18.5 5.5 1.0 12.0 0.0
VAL 43 5 29.5 6.5 1.5 21.5 0.0
TYR 44 3 32.0 6.5 4.5 21.0 0.0
ILE 45 11 30.0 8.0 3.0 19.0 0.0
ASN 46 4 12.0 5.0 0.0 7.0 0.0
GLY 47 0 2.0 1.0 1.0 0.0 0.0
THR 48 3 8.5 4.5 4.0 0.0 0.0
LEU 49 12 27.0 8.5 6.0 12.5 0.0
TYR 50 3 29.5 11.0 0.5 18.0 0.0
LYS 51 12 26.5 12.0 10.0 4.5 0.0
ASN 52 3 19.0 8.5 3.5 7.0 0.0
TRP 53 8 41.0 6.0 11.0 24.0 0.0
THR 54 3 11.0 7.0 0.0 4.0 0.0
VAL 55 4 25.5 8.5 3.5 13.5 0.0
SER 56 1 11.0 7.5 0.0 3.5 0.0
LEU 57 9 38.5 6.5 5.5 26.5 0.0
GLY 58 0 17.0 7.0 5.5 4.5 0.0
PRO 59 0 21.5 6.0 0.5 15.0 0.0
LYS 60 17 10.5 5.0 0.0 5.5 0.0
GLU 61 7 23.5 6.0 12.5 5.0 0.0
GLU 62 7 18.0 7.5 1.5 9.0 0.0
LYS 63 13 31.0 8.5 7.0 15.5 0.0
VAL 64 5 20.5 8.5 2.0 10.0 0.0
LEU 65 9 33.5 7.5 5.5 20.5 0.0
THR 66 3 17.5 6.0 0.5 11.0 0.0
PHE 67 3 32.0 5.5 1.5 25.0 0.0
SER 68 1 17.0 4.5 0.0 12.5 0.0
TRP 69 2 31.5 4.0 5.0 22.5 0.0
THR 70 3 17.5 6.0 2.0 9.5 0.0
PRO 71 0 22.5 4.0 4.5 14.0 0.0
THR 72 4 10.5 1.5 2.0 7.0 0.0
GLN 73 8 10.0 5.0 2.0 3.0 0.0
GLU 74 7 28.5 8.0 2.0 18.5 0.0
GLY 75 0 13.0 6.5 1.5 5.0 0.0
MET 76 10 12.5 5.5 0.0 7.0 0.0
TYR 77 3 35.0 6.0 4.5 24.5 0.0
ARG 78 16 17.0 5.5 1.0 10.5 0.0
ILE 79 9 33.5 6.0 0.5 27.0 0.0
ASN 80 3 26.0 6.5 2.5 17.0 0.0
ALA 81 1 21.5 5.0 0.5 16.0 0.0
THR 82 3 25.0 4.5 8.5 12.0 0.0
VAL 83 4 26.5 7.0 1.0 18.5 0.0
ASP 84 0 18.0 7.0 1.5 9.5 0.0
GLU 85 4 14.5 4.5 8.5 1.5 0.0
GLU 86 7 6.0 3.0 3.0 0.0 0.0
ASN 87 2 5.0 2.5 2.5 0.0 0.0
THR 88 2 7.0 4.0 3.0 0.0 0.0
VAL 89 7 14.0 5.5 3.0 5.5 0.0
VAL 90 5 10.5 8.0 0.0 2.5 0.0
GLU 91 6 21.0 9.0 4.5 7.5 0.0
LEU 92 7 22.0 7.0 0.0 15.0 0.0
ASN 93 7 10.5 3.0 6.0 1.5 0.0
GLU 94 1 2.0 0.5 1.5 0.0 0.0
ASN 95 6 3.5 2.5 1.0 0.0 0.0
ASN 96 1 11.5 2.5 4.5 4.5 0.0
ASN 97 6 17.5 5.0 1.5 11.0 0.0
VAL 98 5 23.0 8.5 2.0 12.5 0.0
ALA 99 1 18.5 7.5 0.0 11.0 0.0
THR 100 3 17.5 6.0 1.0 10.5 0.0
PHE 101 1 29.0 6.5 2.0 20.5 0.0
ASP 102 3 11.0 8.0 0.5 2.5 0.0
VAL 103 5 35.0 9.0 3.5 22.5 0.0
SER 104 3 23.0 9.0 1.0 13.0 0.0
VAL 105 5 37.0 7.0 1.5 28.5 0.0
VAL 106 4 20.0 7.5 4.0 8.5 0.0
LEU 107 9 20.0 7.5 0.0 12.5 0.0
GLU 108 7 7.0 3.0 3.0 1.0 0.0
# TOTAL 523 2196.0 686.0 271.0 1239.0 0.0
# TOTAL NUMBER OF RESTRAINTS (CHECKING): 2719.0
List of conformationally-resticting NOE constraints
assign ((resid 10 and name HN )) ( (resid 10 and name HB )) 3.38 1.58 0.34
assign ((resid 10 and name HN )) ( (resid 10 and name HG11 )) 3.73 1.93 0.37
assign ((resid 15 and name HN )) ( (resid 15 and name HB )) 3.16 1.36 0.32
assign ((resid 18 and name HN )) ( (resid 18 and name HB )) 2.99 1.19 0.30
assign ((resid 22 and name HN )) ( (resid 22 and name HB* )) 3.32 1.52 0.33
assign ((resid 26 and name HN )) ( (resid 26 and name HB )) 3.52 1.72 0.35
assign ((resid 34 and name HN )) ( (resid 34 and name HB )) 3.49 1.69 0.35
assign ((resid 36 and name HN )) ( (resid 36 and name HB )) 3.44 1.64 0.34
assign ((resid 41 and name HN )) ( (resid 41 and name HB )) 3.69 1.89 0.37
assign ((resid 43 and name HN )) ( (resid 43 and name HB )) 3.42 1.62 0.34
assign ((resid 45 and name HN )) ( (resid 45 and name HB )) 3.51 1.71 0.35
assign ((resid 48 and name HN )) ( (resid 48 and name HB )) 3.05 1.25 0.31
assign ((resid 54 and name HN )) ( (resid 54 and name HB )) 3.25 1.45 0.33
assign ((resid 64 and name HN )) ( (resid 64 and name HB )) 3.13 1.33 0.31
assign ((resid 66 and name HN )) ( (resid 66 and name HB )) 3.78 1.98 0.38
assign ((resid 72 and name HN )) ( (resid 72 and name HB )) 3.85 2.05 0.38
assign ((resid 79 and name HN )) ( (resid 79 and name HB )) 3.69 1.89 0.37
assign ((resid 81 and name HN )) ( (resid 81 and name HB* )) 3.34 1.54 0.33
assign ((resid 89 and name HN )) ( (resid 89 and name HB )) 3.47 1.67 0.35
assign ((resid 90 and name HN )) ( (resid 90 and name HB )) 3.20 1.40 0.32
assign ((resid 98 and name HN )) ( (resid 98 and name HB )) 3.29 1.49 0.33
assign ((resid 99 and name HN )) ( (resid 99 and name HB* )) 3.34 1.54 0.33
assign ((resid 100 and name HN )) ( (resid 100 and name HB )) 3.52 1.72 0.35
assign ((resid 103 and name HN )) ( (resid 103 and name HB )) 3.65 1.85 0.37
assign ((resid 105 and name HN )) ( (resid 105 and name HB )) 3.55 1.75 0.35
assign ((resid 6 and name HN )) ( (resid 6 and name HB2 )) 3.46 1.66 0.35
assign ((resid 9 and name HN )) ( (resid 9 and name HB2 )) 3.66 1.86 0.37
assign ((resid 14 and name HN )) ( (resid 14 and name HB2 )) 3.80 2.00 0.38
assign ((resid 20 and name HN )) ( (resid 20 and name HB2 )) 3.39 1.59 0.34
assign ((resid 21 and name HN )) ( (resid 21 and name HB1 )) 2.97 1.17 0.30
assign ((resid 23 and name HN )) ( (resid 23 and name HB1 )) 3.54 1.74 0.35
assign ((resid 25 and name HN )) ( (resid 25 and name HB2 )) 3.59 1.79 0.36
assign ((resid 30 and name HN )) ( (resid 30 and name HB2 )) 3.71 1.91 0.37
assign ((resid 49 and name HN )) ( (resid 49 and name HB2 )) 3.59 1.79 0.36
assign ((resid 51 and name HN )) ( (resid 51 and name HB1 )) 3.80 2.00 0.38
assign ((resid 61 and name HN )) ( (resid 61 and name HB1 )) 3.27 1.47 0.33
assign ((resid 65 and name HN )) ( (resid 65 and name HB2 )) 3.80 2.00 0.38
assign ((resid 73 and name HN )) ( (resid 73 and name HB2 )) 3.67 1.87 0.37
assign ((resid 74 and name HN )) ( (resid 74 and name HB1 )) 3.21 1.41 0.32
assign ((resid 76 and name HN )) ( (resid 76 and name HB2 )) 3.45 1.65 0.34
assign ((resid 78 and name HN )) ( (resid 78 and name HB2 )) 3.88 2.08 0.39
assign ((resid 85 and name HN )) ( (resid 85 and name HB1 )) 3.75 1.95 0.38
assign ((resid 86 and name HN )) ( (resid 86 and name HB2 )) 3.80 2.00 0.38
assign ((resid 91 and name HN )) ( (resid 91 and name HB2 )) 3.82 2.02 0.38
assign ((resid 93 and name HN )) ( (resid 93 and name HB2 )) 3.71 1.91 0.37
assign ((resid 95 and name HN )) ( (resid 95 and name HB2 )) 3.82 2.02 0.38
assign ((resid 97 and name HN )) ( (resid 97 and name HB2 )) 3.81 2.01 0.38
assign ((resid 102 and name HN )) ( (resid 102 and name HB2 )) 3.86 2.06 0.39
assign ((resid 104 and name HN )) ( (resid 104 and name HB2 )) 3.50 1.70 0.35
assign ((resid 107 and name HN )) ( (resid 107 and name HB* )) 2.87 1.07 0.29
assign ((resid 108 and name HN )) ( (resid 108 and name HB* )) 3.09 1.29 0.31
assign ((resid 3 and name HN )) ( (resid 3 and name HB2 )) 3.54 1.74 0.35
assign ((resid 6 and name HN )) ( (resid 6 and name HB1 )) 3.82 2.02 0.38
assign ((resid 11 and name HN )) ( (resid 11 and name HB2 )) 3.68 1.88 0.37
assign ((resid 14 and name HN )) ( (resid 14 and name HB1 )) 3.80 2.00 0.38
assign ((resid 21 and name HN )) ( (resid 21 and name HB2 )) 3.23 1.43 0.32
assign ((resid 23 and name HN )) ( (resid 23 and name HB2 )) 3.23 1.43 0.32
assign ((resid 24 and name HN )) ( (resid 24 and name HB2 )) 3.79 1.99 0.38
assign ((resid 29 and name HN )) ( (resid 29 and name HB1 )) 3.67 1.87 0.37
assign ((resid 30 and name HN )) ( (resid 30 and name HB1 )) 3.78 1.98 0.38
assign ((resid 31 and name HN )) ( (resid 31 and name HB* )) 3.45 1.65 0.34
assign ((resid 40 and name HN )) ( (resid 40 and name HB2 )) 3.82 2.02 0.38
assign ((resid 42 and name HN )) ( (resid 81 and name HB* )) 4.67 2.87 0.47
assign ((resid 48 and name HG2* )) ( (resid 49 and name HN )) 3.36 1.56 0.34
assign ((resid 49 and name HN )) ( (resid 49 and name HB1 )) 3.59 1.79 0.36
assign ((resid 53 and name HN )) ( (resid 53 and name HB2 )) 3.86 2.06 0.39
assign ((resid 61 and name HN )) ( (resid 61 and name HB2 )) 3.26 1.46 0.33
assign ((resid 62 and name HN )) ( (resid 62 and name HB2 )) 3.65 1.85 0.37
assign ((resid 73 and name HN )) ( (resid 73 and name HB1 )) 3.67 1.87 0.37
assign ((resid 74 and name HN )) ( (resid 74 and name HB2 )) 3.65 1.85 0.37
assign ((resid 76 and name HN )) ( (resid 76 and name HB1 )) 3.45 1.65 0.34
assign ((resid 78 and name HN )) ( (resid 78 and name HB1 )) 3.88 2.08 0.39
assign ((resid 80 and name HN )) ( (resid 80 and name HB2 )) 3.85 2.05 0.38
assign ((resid 85 and name HN )) ( (resid 85 and name HB2 )) 3.66 1.86 0.37
assign ((resid 86 and name HN )) ( (resid 86 and name HB1 )) 3.80 2.00 0.38
assign ((resid 91 and name HN )) ( (resid 91 and name HB1 )) 3.82 2.02 0.38
assign ((resid 93 and name HN )) ( (resid 93 and name HB1 )) 3.71 1.91 0.37
assign ((resid 95 and name HN )) ( (resid 95 and name HB1 )) 3.82 2.02 0.38
assign ((resid 97 and name HN )) ( (resid 97 and name HB1 )) 3.81 2.01 0.38
assign ((resid 102 and name HN )) ( (resid 102 and name HB1 )) 3.86 2.06 0.39
assign ((resid 104 and name HN )) ( (resid 104 and name HB1 )) 3.50 1.70 0.35
assign ((resid 7 and name HN )) ( (resid 8 and name HN )) 4.58 2.78 0.46
assign ((resid 8 and name HN )) ( (resid 9 and name HN )) 4.49 2.69 0.45
assign ((resid 15 and name HN )) ( (resid 16 and name HN )) 4.48 2.68 0.45
assign ((resid 16 and name HN )) ( (resid 17 and name HN )) 4.83 3.03 0.48
assign ((resid 18 and name HN )) ( (resid 106 and name HN )) 3.91 2.11 0.39
assign ((resid 18 and name HN )) ( (resid 19 and name HN )) 4.82 3.02 0.48
assign ((resid 19 and name HN )) ( (resid 20 and name HN )) 3.51 1.71 0.35
assign ((resid 22 and name HN )) ( (resid 23 and name HN )) 4.53 2.73 0.45
assign ((resid 23 and name HN )) ( (resid 24 and name HN )) 4.51 2.71 0.45
assign ((resid 25 and name HN )) ( (resid 26 and name HN )) 4.55 2.75 0.46
assign ((resid 27 and name HN )) ( (resid 28 and name HN )) 4.44 2.64 0.44
assign ((resid 28 and name HN )) ( (resid 29 and name HN )) 4.43 2.63 0.44
assign ((resid 30 and name HN )) ( (resid 31 and name HN )) 4.75 2.95 0.47
assign ((resid 31 and name HN )) ( (resid 32 and name HN )) 3.40 1.60 0.34
assign ((resid 33 and name HN )) ( (resid 34 and name HN )) 3.55 1.75 0.35
assign ((resid 39 and name HN )) ( (resid 40 and name HN )) 4.44 2.64 0.44
assign ((resid 42 and name HN )) ( (resid 82 and name HN )) 3.71 1.91 0.37
assign ((resid 44 and name HN )) ( (resid 45 and name HN )) 5.25 3.45 0.53
assign ((resid 46 and name HN )) ( (resid 47 and name HN )) 3.98 2.18 0.40
assign ((resid 47 and name HN )) ( (resid 48 and name HN )) 3.75 1.95 0.38
assign ((resid 48 and name HN )) ( (resid 49 and name HN )) 4.92 3.12 0.49
assign ((resid 50 and name HN )) ( (resid 51 and name HN )) 3.32 1.52 0.33
assign ((resid 52 and name HN )) ( (resid 53 and name HN )) 4.44 2.64 0.44
assign ((resid 53 and name HN )) ( (resid 54 and name HN )) 4.51 2.71 0.45
assign ((resid 54 and name HN )) ( (resid 55 and name HN )) 4.40 2.60 0.44
assign ((resid 55 and name HN )) ( (resid 56 and name HN )) 4.47 2.67 0.45
assign ((resid 57 and name HN )) ( (resid 58 and name HN )) 4.81 3.01 0.48
assign ((resid 60 and name HN )) ( (resid 61 and name HN )) 3.58 1.78 0.36
assign ((resid 61 and name HN )) ( (resid 62 and name HN )) 4.73 2.93 0.47
assign ((resid 62 and name HN )) ( (resid 63 and name HN )) 5.07 3.27 0.51
assign ((resid 104 and name HN )) ( (resid 105 and name HN )) 4.96 3.16 0.50
assign ((resid 72 and name HN )) ( (resid 73 and name HN )) 3.15 1.35 0.32
assign ((resid 74 and name HN )) ( (resid 75 and name HN )) 4.80 3.00 0.48
assign ((resid 76 and name HN )) ( (resid 77 and name HN )) 4.64 2.84 0.46
assign ((resid 46 and name HN )) ( (resid 78 and name HN )) 4.24 2.44 0.42
assign ((resid 44 and name HN )) ( (resid 80 and name HN )) 3.69 1.89 0.37
assign ((resid 82 and name HN )) ( (resid 83 and name HN )) 4.79 2.99 0.48
assign ((resid 84 and name HN )) ( (resid 85 and name HN )) 4.06 2.26 0.41
assign ((resid 86 and name HN )) ( (resid 87 and name HN )) 3.70 1.90 0.37
assign ((resid 90 and name HN )) ( (resid 91 and name HN )) 4.60 2.80 0.46
assign ((resid 91 and name HN )) ( (resid 92 and name HN )) 4.65 2.85 0.47
assign ((resid 92 and name HN )) ( (resid 93 and name HN )) 3.41 1.61 0.34
assign ((resid 99 and name HN )) ( (resid 100 and name HN )) 4.65 2.85 0.47
assign ((resid 100 and name HN )) ( (resid 101 and name HN )) 4.63 2.83 0.46
assign ((resid 101 and name HN )) ( (resid 102 and name HN )) 4.53 2.73 0.45
assign ((resid 103 and name HN )) ( (resid 104 and name HN )) 4.42 2.62 0.44
assign ((resid 107 and name HN )) ( (resid 108 and name HN )) 3.69 1.89 0.37
assign ((resid 2 and name HA )) ( (resid 3 and name HN )) 2.80 1.00 0.28
assign ((resid 4 and name HA )) ( (resid 5 and name HN )) 3.12 1.32 0.31
assign ((resid 5 and name HA )) ( (resid 6 and name HN )) 3.23 1.43 0.32
assign ((resid 6 and name HA )) ( (resid 7 and name HN )) 3.00 1.20 0.30
assign ((resid 7 and name HA )) ( (resid 8 and name HN )) 3.03 1.23 0.30
assign ((resid 8 and name HA )) ( (resid 9 and name HN )) 2.86 1.06 0.29
assign ((resid 9 and name HA )) ( (resid 10 and name HN )) 2.89 1.09 0.29
assign ((resid 10 and name HA )) ( (resid 11 and name HN )) 2.88 1.08 0.29
assign ((resid 11 and name HA )) ( (resid 12 and name HN )) 2.77 0.97 0.28
assign ((resid 13 and name HA )) ( (resid 14 and name HN )) 2.85 1.05 0.28
assign ((resid 15 and name HA )) ( (resid 16 and name HN )) 2.90 1.10 0.29
assign ((resid 16 and name HA )) ( (resid 17 and name HN )) 3.00 1.20 0.30
assign ((resid 18 and name HA )) ( (resid 19 and name HN )) 3.11 1.31 0.31
assign ((resid 20 and name HN )) ( (resid 71 and name HD2 )) 4.15 2.35 0.42
assign ((resid 20 and name HA )) ( (resid 21 and name HN )) 2.92 1.12 0.29
assign ((resid 21 and name HA )) ( (resid 22 and name HN )) 3.02 1.22 0.30
assign ((resid 22 and name HA )) ( (resid 23 and name HN )) 2.77 0.97 0.28
assign ((resid 23 and name HA )) ( (resid 24 and name HN )) 3.05 1.25 0.31
assign ((resid 24 and name HA )) ( (resid 25 and name HN )) 3.08 1.28 0.31
assign ((resid 25 and name HA )) ( (resid 26 and name HN )) 3.09 1.29 0.31
assign ((resid 26 and name HA )) ( (resid 27 and name HN )) 3.08 1.28 0.31
assign ((resid 27 and name HA )) ( (resid 28 and name HN )) 3.00 1.20 0.30
assign ((resid 28 and name HA )) ( (resid 29 and name HN )) 2.89 1.09 0.29
assign ((resid 29 and name HA )) ( (resid 30 and name HN )) 3.02 1.22 0.30
assign ((resid 30 and name HA )) ( (resid 31 and name HN )) 3.15 1.35 0.32
assign ((resid 34 and name HA )) ( (resid 35 and name HN )) 3.08 1.28 0.31
assign ((resid 39 and name HA )) ( (resid 40 and name HN )) 2.99 1.19 0.30
assign ((resid 40 and name HA )) ( (resid 41 and name HN )) 3.04 1.24 0.30
assign ((resid 41 and name HA )) ( (resid 42 and name HN )) 3.11 1.31 0.31
assign ((resid 42 and name HA )) ( (resid 43 and name HN )) 3.08 1.28 0.31
assign ((resid 43 and name HA )) ( (resid 44 and name HN )) 3.11 1.31 0.31
assign ((resid 44 and name HA )) ( (resid 45 and name HN )) 3.16 1.36 0.32
assign ((resid 45 and name HA )) ( (resid 46 and name HN )) 3.28 1.48 0.33
assign ((resid 48 and name HA )) ( (resid 49 and name HN )) 3.15 1.35 0.32
assign ((resid 49 and name HA )) ( (resid 50 and name HN )) 3.54 1.74 0.35
assign ((resid 51 and name HA )) ( (resid 52 and name HN )) 2.77 0.97 0.28
assign ((resid 52 and name HA )) ( (resid 53 and name HN )) 3.04 1.24 0.30
assign ((resid 53 and name HA )) ( (resid 54 and name HN )) 2.91 1.11 0.29
assign ((resid 54 and name HA )) ( (resid 55 and name HN )) 2.92 1.12 0.29
assign ((resid 55 and name HA )) ( (resid 56 and name HN )) 2.92 1.12 0.29
assign ((resid 56 and name HA )) ( (resid 57 and name HN )) 3.01 1.21 0.30
assign ((resid 57 and name HA )) ( (resid 58 and name HN )) 3.24 1.44 0.32
assign ((resid 59 and name HA )) ( (resid 60 and name HN )) 3.09 1.29 0.31
assign ((resid 60 and name HA )) ( (resid 61 and name HN )) 3.41 1.61 0.34
assign ((resid 61 and name HA )) ( (resid 62 and name HN )) 2.88 1.08 0.29
assign ((resid 62 and name HA )) ( (resid 63 and name HN )) 3.02 1.22 0.30
assign ((resid 63 and name HA )) ( (resid 64 and name HN )) 2.81 1.01 0.28
assign ((resid 103 and name HA )) ( (resid 104 and name HN )) 3.00 1.20 0.30
assign ((resid 64 and name HA )) ( (resid 65 and name HN )) 3.09 1.29 0.31
assign ((resid 65 and name HA )) ( (resid 66 and name HN )) 2.84 1.04 0.28
assign ((resid 66 and name HA )) ( (resid 67 and name HN )) 2.91 1.11 0.29
assign ((resid 67 and name HA )) ( (resid 68 and name HN )) 3.03 1.23 0.30
assign ((resid 68 and name HA )) ( (resid 69 and name HN )) 3.26 1.46 0.33
assign ((resid 71 and name HA )) ( (resid 72 and name HN )) 3.13 1.33 0.31
assign ((resid 73 and name HA )) ( (resid 74 and name HN )) 3.00 1.20 0.30
assign ((resid 74 and name HA )) ( (resid 75 and name HN )) 3.06 1.26 0.31
assign ((resid 76 and name HA )) ( (resid 77 and name HN )) 3.07 1.27 0.31
assign ((resid 77 and name HA )) ( (resid 78 and name HN )) 2.96 1.16 0.30
assign ((resid 78 and name HA )) ( (resid 79 and name HN )) 3.19 1.39 0.32
assign ((resid 79 and name HA )) ( (resid 80 and name HN )) 3.00 1.20 0.30
assign ((resid 80 and name HA )) ( (resid 81 and name HN )) 2.97 1.17 0.30
assign ((resid 81 and name HA )) ( (resid 82 and name HN )) 2.99 1.19 0.30
assign ((resid 82 and name HA )) ( (resid 83 and name HN )) 3.06 1.26 0.31
assign ((resid 83 and name HA )) ( (resid 84 and name HN )) 3.38 1.58 0.34
assign ((resid 84 and name HA )) ( (resid 85 and name HN )) 3.29 1.49 0.33
assign ((resid 85 and name HA )) ( (resid 87 and name HN )) 4.48 2.68 0.45
assign ((resid 89 and name HA )) ( (resid 90 and name HN )) 2.98 1.18 0.30
assign ((resid 90 and name HA )) ( (resid 91 and name HN )) 2.93 1.13 0.29
assign ((resid 91 and name HA )) ( (resid 92 and name HN )) 3.44 1.64 0.34
assign ((resid 98 and name HA )) ( (resid 99 and name HN )) 2.89 1.09 0.29
assign ((resid 99 and name HA )) ( (resid 100 and name HN )) 2.68 0.88 0.27
assign ((resid 100 and name HA )) ( (resid 101 and name HN )) 3.01 1.21 0.30
assign ((resid 101 and name HA )) ( (resid 102 and name HN )) 2.82 1.02 0.28
assign ((resid 102 and name HA )) ( (resid 103 and name HN )) 2.98 1.18 0.30
assign ((resid 104 and name HA )) ( (resid 105 and name HN )) 2.99 1.19 0.30
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assign ((resid 29 and name HB2 )) ( (resid 29 and name HE* )) 4.40 2.60 0.44
assign ((resid 29 and name HE* )) ( (resid 31 and name HD1* )) 3.99 2.19 0.40
assign ((resid 29 and name HE* )) ( (resid 31 and name HD2* )) 3.36 1.56 0.34
assign ((resid 29 and name HE* )) ( (resid 62 and name HG1 )) 4.30 2.50 0.43
assign ((resid 30 and name HN )) ( (resid 30 and name HD2* )) 4.60 2.80 0.46
assign ((resid 30 and name HA )) ( (resid 30 and name HD2* )) 4.72 2.92 0.47
assign ((resid 30 and name HB2 )) ( (resid 30 and name HD2* )) 3.56 1.76 0.36
assign ((resid 30 and name HB1 )) ( (resid 30 and name HD2* )) 3.54 1.74 0.35
assign ((resid 30 and name HD2* )) ( (resid 34 and name HN )) 4.35 2.55 0.44
assign ((resid 30 and name HD2* )) ( (resid 35 and name HN )) 4.98 3.18 0.50
assign ((resid 30 and name HD2* )) ( (resid 35 and name HA1 )) 4.21 2.41 0.42
assign ((resid 30 and name HD2* )) ( (resid 57 and name HB2 )) 4.51 2.71 0.45
assign ((resid 30 and name HD2* )) ( (resid 57 and name HB1 )) 4.57 2.77 0.46
assign ((resid 30 and name HD2* )) ( (resid 59 and name HA )) 3.87 2.07 0.39
assign ((resid 30 and name HD2* )) ( (resid 60 and name HN )) 4.52 2.72 0.45
assign ((resid 30 and name HD2* )) ( (resid 61 and name HN )) 4.51 2.71 0.45
assign ((resid 31 and name HD1* )) ( (resid 96 and name HB* )) 5.34 3.54 0.53
assign ((resid 31 and name HD1* )) ( (resid 96 and name HD2* )) 3.73 1.93 0.37
assign ((resid 31 and name HD2* )) ( (resid 60 and name HG* )) 5.25 3.45 0.53
assign ((resid 32 and name HA* )) ( (resid 33 and name HN )) 3.09 1.29 0.31
assign ((resid 32 and name HA* )) ( (resid 34 and name HN )) 4.04 2.24 0.40
assign ((resid 32 and name HA* )) ( (resid 34 and name HG2* )) 4.79 2.99 0.48
assign ((resid 32 and name HA* )) ( (resid 92 and name HD1* )) 4.34 2.54 0.43
assign ((resid 33 and name HA* )) ( (resid 34 and name HA )) 4.88 3.08 0.49
assign ((resid 33 and name HA* )) ( (resid 34 and name HB )) 5.33 3.53 0.53
assign ((resid 33 and name HA* )) ( (resid 59 and name HA )) 4.54 2.74 0.45
assign ((resid 33 and name HA* )) ( (resid 59 and name HB2 )) 3.83 2.03 0.38
assign ((resid 33 and name HA* )) ( (resid 59 and name HB1 )) 3.85 2.05 0.38
assign ((resid 33 and name HA* )) ( (resid 60 and name HE* )) 3.98 2.18 0.40
assign ((resid 34 and name HN )) ( (resid 60 and name HG* )) 4.59 2.79 0.46
assign ((resid 35 and name HN )) ( (resid 58 and name HA* )) 4.41 2.61 0.44
assign ((resid 35 and name HA2 )) ( (resid 58 and name HA* )) 4.05 2.25 0.41
assign ((resid 35 and name HA1 )) ( (resid 58 and name HA* )) 4.21 2.41 0.42
assign ((resid 36 and name HN )) ( (resid 58 and name HA* )) 4.74 2.94 0.47
assign ((resid 36 and name HB )) ( (resid 37 and name HD* )) 5.24 3.44 0.52
assign ((resid 36 and name HG1* )) ( (resid 37 and name HD* )) 3.38 1.58 0.34
assign ((resid 37 and name HB2 )) ( (resid 38 and name HB* )) 4.88 3.08 0.49
assign ((resid 37 and name HD* )) ( (resid 38 and name HN )) 3.34 1.54 0.33
assign ((resid 38 and name HN )) ( (resid 38 and name HB* )) 3.40 1.60 0.34
assign ((resid 38 and name HB* )) ( (resid 39 and name HN )) 3.98 2.18 0.40
assign ((resid 40 and name HN )) ( (resid 40 and name HD* )) 4.16 2.36 0.42
assign ((resid 40 and name HA )) ( (resid 40 and name HD* )) 4.66 2.86 0.47
assign ((resid 40 and name HB2 )) ( (resid 40 and name HD* )) 2.39 0.59 0.24
assign ((resid 40 and name HB1 )) ( (resid 40 and name HD* )) 3.38 1.58 0.34
assign ((resid 40 and name HG1 )) ( (resid 40 and name HD* )) 2.53 0.73 0.25
assign ((resid 40 and name HD* )) ( (resid 52 and name HB* )) 5.34 3.54 0.53
assign ((resid 40 and name HD* )) ( (resid 54 and name HA )) 4.62 2.82 0.46
assign ((resid 40 and name HD* )) ( (resid 84 and name HA )) 4.91 3.11 0.49
assign ((resid 42 and name HN )) ( (resid 42 and name HB* )) 3.37 1.57 0.34
assign ((resid 42 and name HB* )) ( (resid 43 and name HN )) 3.87 2.07 0.39
assign ((resid 42 and name HB* )) ( (resid 43 and name HA )) 4.72 2.92 0.47
assign ((resid 42 and name HB* )) ( (resid 44 and name HE* )) 3.84 2.04 0.38
assign ((resid 42 and name HB* )) ( (resid 49 and name HD1* )) 3.73 1.93 0.37
assign ((resid 42 and name HB* )) ( (resid 52 and name HB* )) 4.61 2.81 0.46
assign ((resid 42 and name HB* )) ( (resid 82 and name HN )) 4.64 2.84 0.46
assign ((resid 42 and name HG* )) ( (resid 49 and name HD1* )) 4.21 2.41 0.42
assign ((resid 42 and name HG* )) ( (resid 52 and name HB* )) 3.60 1.80 0.36
assign ((resid 42 and name HD* )) ( (resid 44 and name HE* )) 4.39 2.59 0.44
assign ((resid 42 and name HD* )) ( (resid 49 and name HD1* )) 3.68 1.88 0.37
assign ((resid 42 and name HD* )) ( (resid 49 and name HD2* )) 4.74 2.94 0.47
assign ((resid 43 and name HB )) ( (resid 50 and name HB* )) 4.72 2.92 0.47
assign ((resid 44 and name HA )) ( (resid 50 and name HB* )) 4.50 2.70 0.45
assign ((resid 44 and name HD* )) ( (resid 49 and name HB* )) 4.11 2.31 0.41
assign ((resid 44 and name HE* )) ( (resid 49 and name HB* )) 4.06 2.26 0.41
assign ((resid 45 and name HB )) ( (resid 50 and name HB* )) 4.67 2.87 0.47
assign ((resid 45 and name HG2* )) ( (resid 46 and name HB* )) 4.39 2.59 0.44
assign ((resid 45 and name HG2* )) ( (resid 46 and name HD2* )) 4.23 2.43 0.42
assign ((resid 45 and name HG11 )) ( (resid 50 and name HB* )) 4.30 2.50 0.43
assign ((resid 45 and name HD1* )) ( (resid 50 and name HB* )) 3.95 2.15 0.40
assign ((resid 46 and name HA )) ( (resid 46 and name HD2* )) 4.60 2.80 0.46
assign ((resid 46 and name HA )) ( (resid 78 and name HB* )) 4.58 2.78 0.46
assign ((resid 46 and name HB* )) ( (resid 46 and name HD2* )) 2.91 1.11 0.29
assign ((resid 46 and name HB* )) ( (resid 77 and name HD* )) 4.43 2.63 0.44
assign ((resid 46 and name HD2* )) ( (resid 77 and name HA )) 3.57 1.77 0.36
assign ((resid 46 and name HD2* )) ( (resid 77 and name HD* )) 3.64 1.84 0.36
assign ((resid 46 and name HD2* )) ( (resid 77 and name HE* )) 4.27 2.47 0.43
assign ((resid 46 and name HD2* )) ( (resid 78 and name HN )) 4.37 2.57 0.44
assign ((resid 49 and name HA )) ( (resid 50 and name HB* )) 4.50 2.70 0.45
assign ((resid 49 and name HB* )) ( (resid 49 and name HD1* )) 3.13 1.33 0.31
assign ((resid 49 and name HD1* )) ( (resid 50 and name HB* )) 5.34 3.54 0.53
assign ((resid 49 and name HD1* )) ( (resid 52 and name HD2* )) 4.54 2.74 0.45
assign ((resid 49 and name HD2* )) ( (resid 52 and name HD2* )) 3.70 1.90 0.37
assign ((resid 50 and name HB* )) ( (resid 51 and name HN )) 3.42 1.62 0.34
assign ((resid 50 and name HE* )) ( (resid 51 and name HE* )) 4.74 2.94 0.47
assign ((resid 50 and name HE* )) ( (resid 69 and name HB* )) 3.80 2.00 0.38
assign ((resid 51 and name HA )) ( (resid 52 and name HD2* )) 4.48 2.68 0.45
assign ((resid 51 and name HB1 )) ( (resid 51 and name HE* )) 4.60 2.80 0.46
assign ((resid 51 and name HG2 )) ( (resid 51 and name HE* )) 3.60 1.80 0.36
assign ((resid 51 and name HG1 )) ( (resid 51 and name HE* )) 3.49 1.69 0.35
assign ((resid 51 and name HE* )) ( (resid 53 and name HE1 )) 4.40 2.60 0.44
assign ((resid 51 and name HE* )) ( (resid 53 and name HZ2 )) 3.99 2.19 0.40
assign ((resid 52 and name HN )) ( (resid 52 and name HD2* )) 3.84 2.04 0.38
assign ((resid 55 and name HB )) ( (resid 63 and name HD* )) 5.34 3.54 0.53
assign ((resid 55 and name HB )) ( (resid 63 and name HE* )) 4.43 2.63 0.44
assign ((resid 55 and name HG1* )) ( (resid 63 and name HD* )) 4.90 3.10 0.49
assign ((resid 55 and name HG1* )) ( (resid 63 and name HE* )) 4.38 2.58 0.44
assign ((resid 55 and name HG2* )) ( (resid 63 and name HD* )) 4.64 2.84 0.46
assign ((resid 55 and name HG2* )) ( (resid 63 and name HE* )) 4.66 2.86 0.47
assign ((resid 56 and name HN )) ( (resid 63 and name HE* )) 5.02 3.22 0.50
assign ((resid 57 and name HA )) ( (resid 58 and name HA* )) 4.50 2.70 0.45
assign ((resid 57 and name HB1 )) ( (resid 61 and name HG* )) 5.34 3.54 0.53
assign ((resid 57 and name HD2* )) ( (resid 58 and name HA* )) 5.34 3.54 0.53
assign ((resid 57 and name HD2* )) ( (resid 61 and name HG* )) 3.36 1.56 0.34
assign ((resid 57 and name HD2* )) ( (resid 63 and name HD* )) 3.74 1.94 0.37
assign ((resid 57 and name HD2* )) ( (resid 63 and name HE* )) 4.10 2.30 0.41
assign ((resid 58 and name HN )) ( (resid 61 and name HG* )) 4.09 2.29 0.41
assign ((resid 58 and name HA* )) ( (resid 59 and name HG1 )) 4.34 2.54 0.43
assign ((resid 58 and name HA* )) ( (resid 61 and name HB2 )) 4.01 2.21 0.40
assign ((resid 60 and name HN )) ( (resid 60 and name HG* )) 3.71 1.91 0.37
assign ((resid 60 and name HA )) ( (resid 60 and name HG* )) 3.42 1.62 0.34
assign ((resid 60 and name HB* )) ( (resid 60 and name HE* )) 4.15 2.35 0.42
assign ((resid 60 and name HG* )) ( (resid 61 and name HN )) 4.73 2.93 0.47
assign ((resid 61 and name HN )) ( (resid 61 and name HG* )) 4.21 2.41 0.42
assign ((resid 61 and name HG* )) ( (resid 62 and name HN )) 3.28 1.48 0.33
assign ((resid 61 and name HG* )) ( (resid 63 and name HG* )) 3.90 2.10 0.39
assign ((resid 63 and name HA )) ( (resid 63 and name HD* )) 3.66 1.86 0.37
assign ((resid 63 and name HA )) ( (resid 63 and name HE* )) 3.91 2.11 0.39
assign ((resid 63 and name HB2 )) ( (resid 63 and name HD* )) 3.50 1.70 0.35
assign ((resid 63 and name HB1 )) ( (resid 63 and name HD* )) 2.76 0.96 0.28
assign ((resid 63 and name HB1 )) ( (resid 63 and name HE* )) 3.53 1.73 0.35
assign ((resid 63 and name HG* )) ( (resid 63 and name HE* )) 2.99 1.19 0.30
assign ((resid 63 and name HD* )) ( (resid 65 and name HD2* )) 5.19 3.39 0.52
assign ((resid 63 and name HE* )) ( (resid 64 and name HN )) 5.34 3.54 0.53
assign ((resid 63 and name HE* )) ( (resid 65 and name HD2* )) 4.37 2.57 0.44
assign ((resid 67 and name HA )) ( (resid 68 and name HB* )) 4.44 2.64 0.44
assign ((resid 67 and name HD* )) ( (resid 69 and name HB* )) 4.72 2.92 0.47
assign ((resid 68 and name HN )) ( (resid 68 and name HB* )) 3.47 1.67 0.35
assign ((resid 68 and name HB* )) ( (resid 69 and name HN )) 3.70 1.90 0.37
assign ((resid 69 and name HH2 )) ( (resid 77 and name HB* )) 3.62 1.82 0.36
assign ((resid 73 and name HN )) ( (resid 73 and name HG* )) 4.13 2.33 0.41
assign ((resid 73 and name HA )) ( (resid 74 and name HG* )) 5.33 3.53 0.53
assign ((resid 73 and name HB* )) ( (resid 77 and name HE* )) 5.10 3.30 0.51
assign ((resid 73 and name HG* )) ( (resid 73 and name HE* )) 3.23 1.43 0.32
assign ((resid 73 and name HG* )) ( (resid 74 and name HN )) 3.72 1.92 0.37
assign ((resid 73 and name HG* )) ( (resid 77 and name HE* )) 5.34 3.54 0.53
assign ((resid 74 and name HN )) ( (resid 74 and name HG* )) 3.35 1.55 0.34
assign ((resid 74 and name HA )) ( (resid 74 and name HG* )) 3.55 1.75 0.35
assign ((resid 74 and name HB2 )) ( (resid 75 and name HA* )) 5.04 3.24 0.50
assign ((resid 74 and name HB1 )) ( (resid 74 and name HG* )) 2.57 0.77 0.26
assign ((resid 74 and name HG* )) ( (resid 75 and name HN )) 4.40 2.60 0.44
assign ((resid 74 and name HG* )) ( (resid 105 and name HG1* )) 4.84 3.04 0.48
assign ((resid 74 and name HG* )) ( (resid 106 and name HA )) 4.88 3.08 0.49
assign ((resid 74 and name HG* )) ( (resid 107 and name HN )) 4.26 2.46 0.43
assign ((resid 74 and name HG* )) ( (resid 107 and name HA )) 4.79 2.99 0.48
assign ((resid 74 and name HG* )) ( (resid 107 and name HG )) 3.88 2.08 0.39
assign ((resid 74 and name HG* )) ( (resid 107 and name HD1* )) 3.52 1.72 0.35
assign ((resid 75 and name HA* )) ( (resid 76 and name HA )) 4.64 2.84 0.46
assign ((resid 75 and name HA* )) ( (resid 76 and name HB* )) 4.14 2.34 0.41
assign ((resid 75 and name HA* )) ( (resid 77 and name HE* )) 4.00 2.20 0.40
assign ((resid 75 and name HA* )) ( (resid 105 and name HB )) 4.22 2.42 0.42
assign ((resid 76 and name HN )) ( (resid 76 and name HB* )) 3.01 1.21 0.30
assign ((resid 76 and name HN )) ( (resid 76 and name HG* )) 4.14 2.34 0.41
assign ((resid 76 and name HA )) ( (resid 104 and name HB* )) 5.24 3.44 0.52
assign ((resid 76 and name HG* )) ( (resid 76 and name HE* )) 3.27 1.47 0.33
assign ((resid 76 and name HG* )) ( (resid 77 and name HN )) 4.65 2.85 0.47
assign ((resid 76 and name HG* )) ( (resid 104 and name HA )) 5.34 3.54 0.53
assign ((resid 76 and name HE* )) ( (resid 104 and name HB* )) 3.74 1.94 0.37
assign ((resid 77 and name HB* )) ( (resid 78 and name HN )) 3.70 1.90 0.37
assign ((resid 77 and name HB* )) ( (resid 103 and name HN )) 4.60 2.80 0.46
assign ((resid 77 and name HB* )) ( (resid 103 and name HB )) 3.93 2.13 0.39
assign ((resid 77 and name HB* )) ( (resid 103 and name HG1* )) 4.05 2.25 0.41
assign ((resid 77 and name HB* )) ( (resid 103 and name HG2* )) 4.83 3.03 0.48
assign ((resid 77 and name HB* )) ( (resid 105 and name HG2* )) 4.21 2.41 0.42
assign ((resid 78 and name HN )) ( (resid 78 and name HB* )) 3.30 1.50 0.33
assign ((resid 78 and name HN )) ( (resid 78 and name HG* )) 3.94 2.14 0.39
assign ((resid 78 and name HA )) ( (resid 78 and name HG* )) 3.38 1.58 0.34
assign ((resid 78 and name HA )) ( (resid 78 and name HD* )) 4.66 2.86 0.47
assign ((resid 78 and name HB* )) ( (resid 78 and name HD* )) 3.33 1.53 0.33
assign ((resid 78 and name HB* )) ( (resid 78 and name HE )) 3.77 1.97 0.38
assign ((resid 78 and name HB* )) ( (resid 79 and name HN )) 4.41 2.61 0.44
assign ((resid 78 and name HB* )) ( (resid 100 and name HG2* )) 4.29 2.49 0.43
assign ((resid 78 and name HB* )) ( (resid 103 and name HG2* )) 5.34 3.54 0.53
assign ((resid 78 and name HG* )) ( (resid 78 and name HE )) 3.65 1.85 0.37
assign ((resid 78 and name HG* )) ( (resid 79 and name HN )) 4.55 2.75 0.46
assign ((resid 78 and name HG* )) ( (resid 80 and name HD22 )) 4.74 2.94 0.47
assign ((resid 78 and name HG* )) ( (resid 100 and name HA )) 4.47 2.67 0.45
assign ((resid 78 and name HG* )) ( (resid 100 and name HG2* )) 4.09 2.29 0.41
assign ((resid 78 and name HG* )) ( (resid 101 and name HN )) 4.29 2.49 0.43
assign ((resid 78 and name HD* )) ( (resid 80 and name HD22 )) 4.03 2.23 0.40
assign ((resid 78 and name HD* )) ( (resid 100 and name HA )) 4.60 2.80 0.46
assign ((resid 78 and name HD* )) ( (resid 100 and name HG2* )) 3.32 1.52 0.33
assign ((resid 83 and name HN )) ( (resid 97 and name HB* )) 4.01 2.21 0.40
assign ((resid 83 and name HN )) ( (resid 97 and name HD2* )) 5.33 3.53 0.53
assign ((resid 83 and name HG1* )) ( (resid 91 and name HG* )) 5.25 3.45 0.53
assign ((resid 83 and name HG1* )) ( (resid 97 and name HB* )) 3.68 1.88 0.37
assign ((resid 84 and name HA )) ( (resid 89 and name HG* )) 5.14 3.34 0.51
assign ((resid 84 and name HB2 )) ( (resid 89 and name HG* )) 4.15 2.35 0.42
assign ((resid 84 and name HB2 )) ( (resid 97 and name HD2* )) 4.23 2.43 0.42
assign ((resid 84 and name HB1 )) ( (resid 89 and name HG* )) 4.60 2.80 0.46
assign ((resid 86 and name HN )) ( (resid 86 and name HB* )) 3.30 1.50 0.33
assign ((resid 86 and name HN )) ( (resid 86 and name HG* )) 3.21 1.41 0.32
assign ((resid 86 and name HA )) ( (resid 86 and name HG* )) 3.36 1.56 0.34
assign ((resid 86 and name HB* )) ( (resid 87 and name HN )) 4.38 2.58 0.44
assign ((resid 86 and name HB* )) ( (resid 88 and name HG2* )) 3.16 1.36 0.32
assign ((resid 86 and name HG* )) ( (resid 88 and name HG2* )) 3.63 1.83 0.36
assign ((resid 87 and name HN )) ( (resid 87 and name HB* )) 3.54 1.74 0.35
assign ((resid 87 and name HB* )) ( (resid 87 and name HD2* )) 3.04 1.24 0.30
assign ((resid 87 and name HB* )) ( (resid 88 and name HN )) 4.15 2.35 0.42
assign ((resid 87 and name HB* )) ( (resid 89 and name HN )) 5.34 3.54 0.53
assign ((resid 88 and name HN )) ( (resid 89 and name HG* )) 4.13 2.33 0.41
assign ((resid 89 and name HN )) ( (resid 89 and name HG* )) 3.21 1.41 0.32
assign ((resid 89 and name HN )) ( (resid 91 and name HG* )) 5.34 3.54 0.53
assign ((resid 89 and name HA )) ( (resid 89 and name HG* )) 2.96 1.16 0.30
assign ((resid 89 and name HG* )) ( (resid 90 and name HN )) 3.32 1.52 0.33
assign ((resid 89 and name HG* )) ( (resid 91 and name HA )) 4.34 2.54 0.43
assign ((resid 89 and name HG* )) ( (resid 91 and name HG* )) 3.70 1.90 0.37
assign ((resid 90 and name HA )) ( (resid 91 and name HB* )) 4.73 2.93 0.47
assign ((resid 90 and name HG1* )) ( (resid 91 and name HG* )) 5.25 3.45 0.53
assign ((resid 90 and name HG2* )) ( (resid 91 and name HG* )) 5.34 3.54 0.53
assign ((resid 91 and name HN )) ( (resid 91 and name HB* )) 3.30 1.50 0.33
assign ((resid 91 and name HN )) ( (resid 91 and name HG* )) 3.51 1.71 0.35
assign ((resid 91 and name HB* )) ( (resid 92 and name HN )) 3.64 1.84 0.36
assign ((resid 91 and name HB* )) ( (resid 93 and name HN )) 3.18 1.38 0.32
assign ((resid 91 and name HG* )) ( (resid 92 and name HN )) 5.34 3.54 0.53
assign ((resid 91 and name HG* )) ( (resid 93 and name HN )) 5.18 3.38 0.52
assign ((resid 92 and name HB* )) ( (resid 93 and name HB* )) 3.92 2.12 0.39
assign ((resid 93 and name HN )) ( (resid 93 and name HB* )) 3.25 1.45 0.33
assign ((resid 93 and name HB* )) ( (resid 96 and name HD2* )) 3.83 2.03 0.38
assign ((resid 93 and name HD21 )) ( (resid 96 and name HB* )) 4.49 2.69 0.45
assign ((resid 93 and name HD22 )) ( (resid 96 and name HB* )) 4.05 2.25 0.41
assign ((resid 93 and name HD22 )) ( (resid 96 and name HD2* )) 4.99 3.19 0.50
assign ((resid 94 and name HA )) ( (resid 97 and name HD2* )) 5.34 3.54 0.53
assign ((resid 94 and name HB* )) ( (resid 94 and name HG* )) 2.18 0.38 0.22
assign ((resid 94 and name HG* )) ( (resid 95 and name HN )) 5.32 3.52 0.53
assign ((resid 95 and name HN )) ( (resid 95 and name HB* )) 3.29 1.49 0.33
assign ((resid 95 and name HN )) ( (resid 95 and name HD2* )) 4.50 2.70 0.45
assign ((resid 95 and name HA )) ( (resid 95 and name HD2* )) 4.42 2.62 0.44
assign ((resid 95 and name HB* )) ( (resid 95 and name HD2* )) 2.98 1.18 0.30
assign ((resid 95 and name HB* )) ( (resid 96 and name HN )) 3.83 2.03 0.38
assign ((resid 96 and name HB* )) ( (resid 96 and name HD2* )) 3.17 1.37 0.32
assign ((resid 97 and name HN )) ( (resid 97 and name HB* )) 3.17 1.37 0.32
assign ((resid 97 and name HN )) ( (resid 97 and name HD2* )) 5.07 3.27 0.51
assign ((resid 97 and name HA )) ( (resid 97 and name HD2* )) 4.60 2.80 0.46
assign ((resid 97 and name HB* )) ( (resid 97 and name HD2* )) 3.15 1.35 0.32
assign ((resid 97 and name HB* )) ( (resid 98 and name HN )) 3.89 2.09 0.39
assign ((resid 97 and name HB* )) ( (resid 98 and name HG2* )) 3.68 1.88 0.37
assign ((resid 101 and name HA )) ( (resid 102 and name HB* )) 4.68 2.88 0.47
assign ((resid 102 and name HN )) ( (resid 102 and name HB* )) 3.16 1.36 0.32
assign ((resid 102 and name HB* )) ( (resid 103 and name HN )) 3.62 1.82 0.36
assign ((resid 102 and name HB* )) ( (resid 103 and name HG2* )) 5.34 3.54 0.53
assign ((resid 103 and name HA )) ( (resid 104 and name HB* )) 4.26 2.46 0.43
assign ((resid 103 and name HG1* )) ( (resid 104 and name HB* )) 4.53 2.73 0.45
assign ((resid 104 and name HN )) ( (resid 104 and name HB* )) 3.04 1.24 0.30
assign ((resid 104 and name HB* )) ( (resid 105 and name HN )) 3.96 2.16 0.40
assign ((resid 104 and name HB* )) ( (resid 106 and name HG1* )) 4.23 2.43 0.42
assign ((resid 104 and name HB* )) ( (resid 106 and name HG2* )) 4.97 3.17 0.50
assign ((resid 106 and name HG2* )) ( (resid 108 and name HG* )) 4.22 2.42 0.42
assign ((resid 107 and name HB* )) ( (resid 108 and name HG* )) 5.04 3.24 0.50
assign ((resid 108 and name HN )) ( (resid 108 and name HG* )) 3.43 1.63 0.34
assign ((resid 108 and name HA )) ( (resid 108 and name HG* )) 3.37 1.57 0.34
list of removed NOE constraints
1-> VAL 8 HN - VAL 8 HB 1.80 4.57 # NoRestrctn I [2.00 4.30] -- intra
5-> VAL 16 HN - VAL 16 HB 1.80 4.33 # NoRestrctn I [2.00 4.30] -- intra
11-> THR 39 HN - THR 39 HB 1.80 4.46 # NoRestrctn I [2.00 4.30] -- intra
17-> VAL 55 HN - VAL 55 HB 1.80 4.55 # NoRestrctn I [2.00 4.30] -- intra
23-> VAL 83 HN - VAL 83 HB 1.80 4.52 # NoRestrctn I [2.00 4.30] -- intra
31-> PHE 3 HN - PHE 3 HB1 1.80 4.37 # NoRestrctn I [2.00 4.30] -- intra
34-> LYS 11 HN - LYS 11 HB1 1.80 4.54 # NoRestrctn I [2.00 4.30] -- intra
36-> ASN 19 HN - ASN 19 HB2 1.80 4.57 # NoRestrctn I [2.00 4.30] -- intra
40-> TYR 24 HN - TYR 24 HB1 1.80 4.35 # NoRestrctn I [2.00 4.30] -- intra
42-> HIS 27 HN - HIS 27 HB2 1.80 4.52 # NoRestrctn I [2.00 4.30] -- intra
43-> LYS 29 HN - LYS 29 HB2 1.80 4.30 # NoRestrctn I [2.00 4.30] -- intra
45-> LYS 40 HN - LYS 40 HB1 1.80 4.41 # NoRestrctn I [2.00 4.30] -- intra
46-> TYR 44 HN - TYR 44 HB2 1.80 4.44 # NoRestrctn I [2.00 4.30] -- intra
48-> TYR 50 HN - TYR 50 HB2 1.80 4.48 # NoRestrctn I [2.00 4.30] -- intra
50-> ASN 52 HN - ASN 52 HB* 1.80 4.00 # NoRestrctn I [2.29 3.93] -- intra
51-> TRP 53 HN - TRP 53 HB1 1.80 4.49 # NoRestrctn I [2.00 4.30] -- intra
52-> LEU 57 HN - LEU 57 HB2 1.80 4.30 # NoRestrctn I [2.00 4.30] -- intra
53-> LYS 60 HN - LYS 60 HB2 1.80 4.61 # NoRestrctn I [2.00 4.30] -- intra
59-> TYR 77 HN - TYR 77 HB2 1.80 4.53 # NoRestrctn I [2.00 4.30] -- intra
61-> ASN 80 HN - ASN 80 HB1 1.80 4.48 # NoRestrctn I [2.00 4.30] -- intra
68-> PHE 101 HN - PHE 101 HB1 1.80 4.35 # NoRestrctn I [2.00 4.30] -- intra
77-> ASN 19 HN - ASN 19 HB1 1.80 4.61 # NoRestrctn I [2.00 4.30] -- intra
81-> GLU 25 HN - GLU 25 HB1 1.80 4.30 # NoRestrctn I [2.00 4.30] -- intra
82-> HIS 27 HN - HIS 27 HB1 1.80 4.52 # NoRestrctn I [2.00 4.30] -- intra
86-> SER 38 HN - SER 38 HB2 1.80 4.33 # NoRestrctn I [2.00 4.30] -- intra
91-> TYR 50 HN - TYR 50 HB1 1.80 4.48 # NoRestrctn I [2.00 4.30] -- intra
92-> LYS 51 HN - LYS 51 HB2 1.80 4.51 # NoRestrctn I [2.00 4.30] -- intra
94-> LYS 60 HN - LYS 60 HB1 1.80 4.61 # NoRestrctn I [2.00 4.30] -- intra
100-> TYR 77 HN - TYR 77 HB1 1.80 4.53 # NoRestrctn I [2.00 4.30] -- intra
109-> PHE 101 HN - PHE 101 HB2 1.80 4.48 # NoRestrctn I [2.00 4.30] -- intra
185-> THR 39 HN - THR 39 HA 1.80 3.23 # NoRestrctn I [2.22 2.95] -- intra
305-> LEU 65 HN - LEU 65 HB1 1.80 4.51 # NoRestrctn I [2.00 4.30] -- intra
318-> LYS 63 HN - LYS 63 HB1 1.80 4.36 # NoRestrctn I [2.00 4.30] -- intra
352-> ASN 19 HB2 - ASN 19 HD21 1.80 3.62 # NoRestrctn I [2.10 3.57] -- intra
353-> ASN 46 HB2 - ASN 46 HD21 1.80 4.25 # NoRestrctn I [2.10 3.57] -- intra
354-> ASN 19 HB1 - ASN 19 HD21 1.80 3.83 # NoRestrctn I [2.10 3.57] -- intra
355-> ASN 46 HB1 - ASN 46 HD21 1.80 4.25 # NoRestrctn I [2.10 3.57] -- intra
534-> GLU 86 HN - ASN 87 HA 1.80 5.40 # NoRestrctn S [2.00 3.99] -- sequential
613-> LYS 20 HN - LEU 21 HA 1.80 5.75 # NoRestrctn S [2.00 3.99] -- sequential
631-> ASN 96 HN - ASN 97 HA 1.80 5.41 # NoRestrctn S [2.00 3.99] -- sequential
642-> VAL 36 HN - PRO 37 HA 1.80 5.46 # NoRestrctn S [2.00 3.99] -- sequential
655-> ASP 14 HN - VAL 15 HA 1.80 5.67 # NoRestrctn S [2.00 3.99] -- sequential
697-> VAL 106 HN - LEU 107 HA 1.80 5.69 # NoRestrctn S [2.00 3.99] -- sequential
821-> VAL 16 HN - GLY 17 HA2 1.80 5.52 # NoRestrctn S [2.00 3.99] -- sequential
954-> LEU 107 HA - LEU 107 HB* 1.80 3.29 # FixedDistn I [0.00 0.00] -- intra
963-> ILE 45 HA - ILE 45 HG2* 1.80 3.79 # NoRestrctn I [2.63 3.78] -- intra
990-> LEU 49 HA - LEU 49 HG 1.80 4.63 # NoRestrctn I [2.06 4.26] -- intra
991-> LEU 65 HA - LEU 65 HG 1.80 4.39 # NoRestrctn I [2.06 4.26] -- intra
1010-> VAL 28 HN - VAL 28 HB 1.80 4.39 # NoRestrctn I [2.00 4.30] -- intra
1012-> SER 56 HA - SER 56 HB* 1.80 3.30 # FixedDistn I [0.00 0.00] -- intra
1021-> LEU 57 HA - LEU 57 HG 1.80 4.70 # NoRestrctn I [2.06 4.26] -- intra
1022-> LEU 92 HA - LEU 92 HG 1.80 4.64 # NoRestrctn I [2.06 4.26] -- intra
1038-> GLU 74 HB1 - GLU 74 HG1 1.80 3.30 # NoRestrctn I [1.99 3.26] -- intra
1040-> GLU 74 HB1 - GLU 74 HG2 1.80 3.30 # NoRestrctn I [1.99 3.26] -- intra
1045-> SER 38 HN - SER 38 HB1 1.80 4.33 # NoRestrctn I [2.00 4.30] -- intra
1108-> ILE 34 HB - ILE 34 HD1* 1.80 3.92 # NoRestrctn I [2.63 3.78] -- intra
1109-> ILE 45 HB - ILE 45 HD1* 1.80 3.82 # NoRestrctn I [2.63 3.78] -- intra
1110-> ILE 79 HB - ILE 79 HD1* 1.80 4.06 # NoRestrctn I [2.63 3.78] -- intra
1121-> ILE 34 HA - ILE 34 HG2* 1.80 3.87 # NoRestrctn I [2.63 3.78] -- intra
1130-> ILE 79 HA - ILE 79 HG2* 1.80 3.85 # NoRestrctn I [2.63 3.78] -- intra
1290-> ASN 97 HN - VAL 98 HA 1.80 5.94 # NoRestrctn S [2.00 3.99] -- sequential
2196-> GLU 9 HN - GLU 9 HB1 1.80 4.33 # NoRestrctn I [2.00 4.30] -- intra
2216-> LEU 6 HA - LEU 6 HG 1.80 4.48 # NoRestrctn I [2.06 4.26] -- intra
2249-> GLU 9 HA - GLU 9 HG* 1.80 4.49 # NoRestrctn I [2.23 4.01] -- intra
2550-> LEU 31 HN - GLY 32 HA* 1.80 5.15 # NoRestrctn S [2.00 3.55] -- sequential
2643-> LYS 60 HN - LYS 60 HB* 1.80 3.98 # NoRestrctn I [2.29 3.93] -- intra
2693-> TYR 77 HN - TYR 77 HB* 1.80 3.97 # NoRestrctn I [2.15 3.88] -- intra
2748-> GLU 91 HA - GLU 91 HG* 1.80 4.06 # NoRestrctn I [2.23 4.01] -- intra
====== TOTAL ======: 68
table of distance constraints violations
Residual Violations greater than 0.10
38-> LEU 21 HN - LEU 21 HB3 [ 1.80 3.27] 0.00 0.45 0.00 0.45 0.25 0.26 0.41 0.00 0.41 0.43 0.00 0.42 0.27 0.00 0.46 0.00 0.44 0.43 0.00 0.00 - 12 [ 0.25 .. 0.46]
241-> LEU 65 HN - LEU 65 HG [ 1.80 3.89] 0.00 0.00 0.00 0.00 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.42 0.43 0.00 0.41 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.41 .. 0.43]
243-> LEU 92 HN - LEU 92 HG [ 1.80 4.02] 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 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 [ 0.45 .. 0.45]
246-> VAL 8 HN - VAL 8 HG2* [ 1.80 3.50] 0.00 0.00 0.00 0.37 0.39 0.42 0.39 0.38 0.39 0.00 0.48 0.00 0.40 0.42 0.34 0.00 0.48 0.00 0.42 0.41 - 13 [ 0.34 .. 0.48]
249-> VAL 16 HN - VAL 16 HG2* [ 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 0.13 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.13 .. 0.13]
250-> GLU 23 HN - GLU 23 HG3 [ 1.80 4.15] 0.39 0.32 0.45 0.30 0.33 0.33 0.30 0.36 0.30 0.33 0.38 0.27 0.34 0.43 0.30 0.42 0.44 0.33 0.44 0.44 - 20 [ 0.27 .. 0.45]
251-> VAL 28 HN - VAL 28 HG2* [ 1.80 3.44] 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.50 0.00 0.48 0.00 0.49 0.00 0.00 0.00 0.49 0.00 0.49 0.00 - 6 [ 0.46 .. 0.50]
261-> VAL 64 HN - VAL 64 HG2* [ 1.80 3.59] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.30 .. 0.30]
266-> GLU 74 HN - GLU 74 HG2 [ 1.80 4.23] 0.31 0.32 0.31 0.34 0.31 0.29 0.33 0.37 0.34 0.33 0.37 0.00 0.32 0.32 0.33 0.30 0.31 0.31 0.30 0.33 - 19 [ 0.29 .. 0.37]
282-> LYS 20 HN - LYS 20 HG2 [ 1.80 3.93] 0.00 0.00 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.18 .. 0.24]
283-> PRO 13 HG3 - GLU 23 HN [ 1.80 4.47] 0.12 0.00 0.00 0.32 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.12 .. 0.43]
285-> LYS 29 HN - LYS 29 HG3 [ 1.80 4.19] 0.58 0.57 0.00 0.57 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.53 0.59 0.56 0.55 0.00 0.00 0.53 0.00 0.56 - 10 [ 0.53 .. 0.59]
292-> GLU 74 HN - GLU 74 HG3 [ 1.80 4.23] 0.17 0.17 0.18 0.13 0.18 0.22 0.17 0.11 0.14 0.15 0.12 0.00 0.17 0.15 0.15 0.20 0.18 0.19 0.18 0.16 - 19 [ 0.11 .. 0.22]
296-> GLU 108 HN - GLU 108 HG3 [ 1.80 4.37] 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.44 0.00 0.03 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.43 - 6 [ 0.02 .. 0.44]
322-> LYS 20 HN - LYS 20 HD2 [ 1.80 4.73] 0.16 0.32 0.20 0.37 0.00 0.25 0.35 0.27 0.32 0.38 0.00 0.33 0.21 0.15 0.32 0.22 0.35 0.37 0.17 0.20 - 18 [ 0.15 .. 0.38]
323-> LYS 29 HN - LYS 29 HD3 [ 1.80 5.14] 0.22 0.24 0.00 0.34 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.25 0.47 0.28 0.24 0.00 0.00 0.27 0.00 0.43 - 10 [ 0.22 .. 0.47]
333-> ASN 19 HB2 - LYS 20 HN [ 1.80 4.64] 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.00 0.00 - 3 [ 0.07 .. 0.12]
334-> TRP 53 HN - TRP 53 HE3 [ 1.80 3.90] 0.00 1.82 0.00 0.00 0.00 0.00 1.58 0.00 1.76 1.84 0.00 1.64 1.65 0.00 1.73 0.00 0.00 0.00 0.00 0.00 - 7 [ 1.58 .. 1.84]
340-> VAL 15 HN - VAL 16 HG1* [ 1.80 3.92] 2.16 1.93 2.28 1.93 2.07 2.04 0.00 2.07 2.08 2.00 2.03 2.23 2.09 2.21 1.18 2.24 2.09 1.99 2.25 2.20 - 19 [ 1.18 .. 2.28]
343-> VAL 18 HN - VAL 18 HG1* [ 1.80 3.50] 0.26 0.26 0.26 0.26 0.25 0.25 0.26 0.27 0.26 0.27 0.26 0.26 0.26 0.26 0.27 0.26 0.26 0.26 0.26 0.26 - 20 [ 0.25 .. 0.27]
345-> LEU 6 HD2* - VAL 36 HN [ 1.80 4.49] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.02 0.14 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.00 - 4 [ 0.02 .. 0.14]
348-> VAL 83 HN - VAL 83 HG1* [ 1.80 3.45] 0.38 0.46 0.39 0.35 0.38 0.40 0.39 0.37 0.37 0.38 0.38 0.43 0.37 0.38 0.36 0.43 0.36 0.39 0.39 0.38 - 20 [ 0.35 .. 0.46]
364-> GLY 33 HN - LEU 92 HD1* [ 1.80 6.05] 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 1.92 .. 1.92]
373-> GLY 32 HN - ILE 34 HG2* [ 1.80 4.84] 1.96 1.99 1.94 1.85 1.88 0.00 0.00 2.02 1.88 1.96 0.00 1.88 1.91 0.00 1.92 0.00 1.87 0.00 1.89 1.96 - 14 [ 1.85 .. 2.02]
382-> THR 70 HG2* - THR 72 HN [ 1.80 4.86] 0.09 0.00 0.03 0.03 2.19 2.22 0.03 0.07 0.07 0.06 0.10 0.25 0.20 0.06 0.06 0.11 0.12 0.08 0.05 0.05 - 19 [ 0.03 .. 2.22]
383-> GLU 91 HN - ASN 93 HN [ 1.80 6.05] 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.15 .. 0.15]
387-> GLU 91 HB2 - ASN 93 HN [ 1.80 4.00] 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.33 .. 0.61]
390-> LEU 92 HD1* - ASN 93 HN [ 1.80 4.80] 0.01 0.00 0.08 0.00 0.00 0.29 0.04 0.00 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.02 0.00 0.00 0.00 - 6 [ 0.01 .. 0.29]
398-> GLU 74 HB2 - GLY 75 HN [ 1.80 3.77] 0.32 0.31 0.35 0.32 0.30 0.32 0.33 0.38 0.33 0.40 0.37 0.00 0.33 0.33 0.29 0.30 0.32 0.33 0.32 0.32 - 19 [ 0.29 .. 0.40]
399-> GLY 75 HN - VAL 105 HG2* [ 1.80 4.28] 0.00 0.00 0.02 0.00 0.02 0.00 0.00 0.00 0.00 0.09 0.00 0.14 0.01 0.03 0.00 0.02 0.04 0.00 0.01 0.00 - 9 [ 0.01 .. 0.14]
410-> ASN 93 HD21 - ASN 96 HD22 [ 1.80 5.09] 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.13 1.10 - 4 [ 0.13 .. 1.32]
411-> ASN 80 HD21 - PHE 101 HN [ 1.80 5.46] 0.79 1.12 0.90 0.88 1.26 0.92 1.15 1.08 0.81 0.58 0.76 1.24 0.81 0.77 0.81 0.73 0.82 0.74 0.70 0.71 - 20 [ 0.58 .. 1.26]
412-> ASN 80 HD21 - ALA 81 HN [ 1.80 4.79] 1.31 1.11 1.30 1.28 1.33 1.32 1.36 1.34 1.28 1.27 1.28 1.36 1.27 1.27 1.30 1.29 1.28 1.28 1.26 1.30 - 20 [ 1.11 .. 1.36]
413-> ASN 80 HA - ASN 80 HD21 [ 1.80 4.02] 0.18 0.20 0.20 0.16 0.25 0.20 0.24 0.23 0.14 0.08 0.14 0.24 0.14 0.15 0.15 0.13 0.13 0.17 0.12 0.16 - 20 [ 0.08 .. 0.25]
414-> ASN 80 HD21 - THR 100 HA [ 1.80 4.15] 1.62 1.83 1.73 1.62 1.83 1.60 1.80 1.78 1.64 1.54 1.53 1.89 1.56 1.57 1.61 1.59 1.58 1.61 1.47 1.53 - 20 [ 1.47 .. 1.89]
415-> ASN 80 HD21 - THR 82 HG2* [ 1.80 5.31] 2.44 0.17 2.42 2.92 2.40 2.40 0.00 2.48 2.49 2.86 2.85 0.00 2.50 2.68 2.51 0.28 2.68 2.78 2.57 2.43 - 18 [ 0.17 .. 2.92]
416-> ASN 80 HD21 - VAL 98 HG1* [ 1.80 3.89] 1.77 3.15 1.63 1.73 1.75 1.12 1.72 1.78 1.69 2.11 1.72 1.91 1.64 1.51 1.68 1.96 1.71 1.92 1.45 1.35 - 20 [ 1.12 .. 3.15]
417-> ASN 80 HD22 - ALA 81 HN [ 1.80 5.91] 0.72 0.55 0.73 0.76 0.77 0.75 0.79 0.77 0.72 0.69 0.73 0.78 0.72 0.72 0.74 0.72 0.71 0.69 0.68 0.69 - 20 [ 0.55 .. 0.79]
419-> ASN 80 HD22 - THR 100 HA [ 1.80 4.42] 0.85 1.18 1.01 0.91 1.14 0.82 1.10 1.07 0.94 0.83 0.78 1.22 0.82 0.83 0.88 0.88 0.85 0.84 0.70 0.74 - 20 [ 0.70 .. 1.22]
421-> ASN 80 HD22 - VAL 98 HG1* [ 1.80 4.00] 1.72 2.72 1.61 1.70 1.72 1.11 1.73 1.72 1.60 1.98 1.71 1.88 1.56 1.50 1.61 1.91 1.66 1.81 1.36 1.25 - 20 [ 1.11 .. 2.72]
426-> VAL 8 HG1* - THR 82 HN [ 1.80 5.16] 0.08 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.16 0.00 0.08 0.00 0.00 0.00 0.00 - 4 [ 0.08 .. 0.16]
432-> GLY 17 HN - LYS 20 HG3 [ 1.80 4.76] 0.00 0.00 0.00 0.00 0.46 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 - 2 [ 0.11 .. 0.46]
433-> GLY 17 HN - LYS 20 HG2 [ 1.80 5.28] 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.39 .. 0.62]
436-> ASN 46 HD22 - TYR 77 HA [ 1.80 4.66] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 - 1 [ 1.04 .. 1.04]
438-> ASN 46 HD21 - TYR 77 HA [ 1.80 4.66] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 - 1 [ 1.39 .. 1.39]
451-> ILE 34 HG13 - GLY 35 HN [ 1.80 4.59] 0.91 1.04 0.98 0.86 1.02 0.00 0.00 0.43 1.01 1.01 0.00 1.03 0.44 0.00 0.44 0.00 1.11 0.00 0.98 0.85 - 14 [ 0.43 .. 1.11]
453-> ILE 34 HD1* - GLY 35 HN [ 1.80 4.65] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.62 0.00 0.62 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.55 .. 0.62]
465-> ASP 5 HN - ILE 34 HG2* [ 1.80 4.32] 1.78 1.73 1.76 1.57 1.66 0.07 0.03 1.93 1.69 1.91 0.00 1.78 1.90 0.00 1.90 0.06 1.65 0.19 1.68 1.72 - 18 [ 0.03 .. 1.93]
466-> TRP 53 HE1 - THR 66 HN [ 1.80 5.65] 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.07 0.00 0.70 2.07 0.00 2.25 0.00 0.00 0.00 0.00 0.00 - 5 [ 0.07 .. 2.25]
468-> TRP 53 HZ2 - THR 66 HN [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.23 1.31 0.00 1.51 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.23 .. 1.51]
469-> VAL 26 HG2* - THR 66 HN [ 1.80 5.30] 0.29 0.76 0.74 0.01 0.60 0.12 0.48 0.24 0.57 0.83 0.34 0.73 0.01 0.32 0.21 0.60 0.30 0.02 0.39 0.29 - 20 [ 0.01 .. 0.83]
471-> LEU 65 HD2* - THR 66 HN [ 1.80 4.46] 0.00 0.00 0.00 0.00 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.34 0.22 0.00 0.26 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.22 .. 0.34]
472-> LEU 65 HB3 - THR 66 HN [ 1.80 4.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.43 0.38 0.00 0.41 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.38 .. 0.43]
473-> ASN 19 HD22 - THR 72 HA [ 1.80 5.27] 0.00 0.00 0.00 0.00 0.00 0.00 2.22 1.12 0.13 3.24 0.67 0.00 0.00 0.00 0.19 0.00 0.00 2.25 0.00 0.00 - 7 [ 0.13 .. 3.24]
474-> ASN 19 HD22 - THR 72 HB [ 1.80 5.70] 0.00 0.85 0.00 0.91 0.00 0.00 2.94 2.38 1.14 4.87 1.92 0.15 0.00 0.06 1.20 0.00 0.00 3.32 0.00 0.00 - 11 [ 0.06 .. 4.87]
476-> VAL 18 HG1* - ASN 19 HD22 [ 1.80 4.35] 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 - 3 [ 1.35 .. 1.43]
477-> VAL 18 HG2* - ASN 19 HD22 [ 1.80 4.51] 1.46 1.47 1.48 1.48 1.40 1.39 3.76 1.49 1.49 3.74 1.42 1.54 1.46 1.46 1.52 1.47 1.54 3.70 1.46 1.47 - 20 [ 1.39 .. 3.76]
479-> ASN 19 HD21 - THR 72 HG2* [ 1.80 5.20] 0.29 1.94 0.19 1.84 0.27 0.56 1.56 3.36 2.39 4.13 2.93 1.23 0.20 0.86 1.87 1.04 1.03 2.34 1.00 0.38 - 20 [ 0.19 .. 4.13]
480-> VAL 18 HG2* - ASN 19 HD21 [ 1.80 4.51] 1.44 1.46 1.45 1.45 1.36 1.37 2.75 1.48 1.46 2.70 1.38 1.53 1.44 1.45 1.50 1.45 1.52 2.67 1.43 1.45 - 20 [ 1.36 .. 2.75]
483-> THR 88 HN - VAL 89 HB [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.13 0.12 0.00 0.00 0.00 0.18 0.00 0.00 0.10 0.00 0.25 0.00 0.00 0.00 0.00 - 5 [ 0.10 .. 0.25]
486-> GLY 58 HN - PRO 59 HD2 [ 1.80 4.85] 0.02 0.00 0.00 0.00 0.03 0.02 0.09 0.01 0.03 0.02 0.00 0.00 0.07 0.02 0.06 0.07 0.00 0.11 0.00 0.00 - 12 [ 0.01 .. 0.11]
498-> VAL 55 HB - SER 56 HN [ 1.80 3.40] 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.70 0.69 0.00 0.68 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.61 .. 0.70]
501-> THR 7 HG2* - ASN 96 HD21 [ 1.80 4.80] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 - 1 [ 0.75 .. 0.75]
502-> LEU 31 HD1* - ASN 96 HD21 [ 1.80 4.66] 0.47 1.50 0.16 0.00 0.08 0.16 0.75 0.56 0.52 0.45 0.00 0.63 0.71 0.76 0.02 0.29 0.62 0.55 1.70 0.72 - 18 [ 0.02 .. 1.70]
503-> THR 7 HB - ASN 96 HD22 [ 1.80 4.86] 1.69 2.46 0.00 0.00 0.00 0.28 0.51 0.00 0.00 1.37 0.52 1.56 1.08 1.58 0.78 0.86 0.54 1.48 1.39 0.57 - 15 [ 0.28 .. 2.46]
504-> THR 7 HG2* - ASN 96 HD22 [ 1.80 4.80] 0.00 0.00 0.00 0.14 0.00 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 1.96 0.00 - 4 [ 0.03 .. 1.96]
505-> LEU 31 HD1* - ASN 96 HD22 [ 1.80 4.66] 0.77 2.76 0.00 0.00 0.00 1.09 1.79 0.61 0.37 0.64 0.74 0.88 1.46 1.61 0.19 0.52 1.67 0.81 2.75 1.33 - 17 [ 0.19 .. 2.76]
517-> THR 82 HG2* - VAL 98 HN [ 1.80 5.64] 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 0.00 - 1 [ 0.10 .. 0.10]
518-> VAL 8 HG2* - VAL 98 HN [ 1.80 4.60] 0.00 0.00 0.00 1.38 1.23 1.37 1.17 1.46 1.64 0.00 1.79 0.00 1.27 1.14 1.17 0.00 1.77 0.00 1.73 1.28 - 13 [ 1.14 .. 1.79]
520-> PHE 3 HD* - LEU 92 HN [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 1.45 .. 1.45]
521-> PRO 4 HD2 - LEU 92 HN [ 1.80 5.95] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.93 .. 0.93]
522-> PHE 3 HB3 - LEU 92 HN [ 1.80 4.28] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.13 0.00 0.00 0.08 0.00 0.00 0.00 - 3 [ 0.08 .. 1.92]
524-> PHE 3 HB2 - LEU 92 HN [ 1.80 4.44] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 1.92 .. 1.92]
525-> GLU 25 HN - PHE 67 HE* [ 1.80 5.25] 0.00 0.00 0.00 0.12 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 0.11 0.00 0.00 - 4 [ 0.11 .. 0.17]
532-> GLU 25 HN - VAL 64 HG1* [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 0.00 0.00 0.00 1.14 0.00 0.11 0.00 0.19 0.00 - 4 [ 0.10 .. 1.14]
538-> LYS 51 HD* - ASN 52 HN [ 1.80 4.49] 0.00 0.00 0.00 0.00 0.00 0.12 0.39 0.08 0.00 0.00 0.00 0.00 0.07 0.00 0.17 0.00 0.07 0.00 0.00 0.05 - 7 [ 0.05 .. 0.39]
540-> LYS 51 HG2 - ASN 52 HN [ 1.80 4.25] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.33 .. 0.33]
549-> THR 66 HB - PHE 67 HN [ 1.80 3.79] 0.00 0.38 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.35 0.00 0.40 0.00 0.00 0.00 0.29 0.00 0.00 0.00 0.00 - 5 [ 0.29 .. 0.40]
554-> ASN 19 HN - THR 72 HA [ 1.80 4.35] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.71 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.31 .. 0.71]
557-> ASN 19 HN - THR 72 HG2* [ 1.80 4.59] 0.00 0.45 0.00 0.31 0.00 0.00 0.00 1.50 0.78 1.62 1.19 0.00 0.00 0.00 0.11 0.00 0.00 0.23 0.00 0.00 - 8 [ 0.11 .. 1.62]
558-> VAL 18 HG2* - ASN 19 HN [ 1.80 3.61] 0.25 0.22 0.24 0.25 0.21 0.22 0.23 0.27 0.28 0.28 0.26 0.19 0.25 0.27 0.25 0.26 0.26 0.27 0.25 0.24 - 20 [ 0.19 .. 0.28]
560-> ILE 34 HN - LYS 60 HN [ 1.80 4.74] 0.36 0.62 0.79 0.00 0.59 0.00 0.24 0.62 0.79 0.61 0.11 0.47 0.43 0.00 0.31 0.00 0.68 0.00 0.68 0.25 - 15 [ 0.11 .. 0.79]
564-> ASN 30 HB3 - ILE 34 HN [ 1.80 5.17] 0.50 0.50 0.90 0.36 0.46 0.38 0.25 0.80 0.72 0.70 0.22 0.61 0.78 0.15 0.45 0.15 0.47 0.41 0.71 0.65 - 20 [ 0.15 .. 0.90]
565-> GLU 2 HG* - ILE 34 HN [ 1.80 5.92] 0.00 0.00 0.00 1.73 0.00 0.08 0.44 0.00 1.26 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.23 - 7 [ 0.08 .. 1.73]
566-> ILE 34 HN - PRO 59 HB2 [ 1.80 5.16] 0.98 1.37 1.21 0.92 1.12 0.16 0.28 0.87 1.07 1.23 0.71 1.19 0.80 0.33 0.76 0.09 1.32 0.12 1.30 0.59 - 20 [ 0.09 .. 1.37]
569-> PHE 3 HN - LEU 92 HG [ 1.80 4.93] 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.39 .. 0.45]
572-> VAL 83 HN - VAL 98 HA [ 1.80 4.85] 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.51 .. 0.51]
573-> THR 7 HA - VAL 83 HN [ 1.80 6.05] 1.33 1.93 0.00 0.41 0.04 0.56 0.73 0.16 0.50 1.46 0.00 2.24 1.26 0.76 1.13 1.63 0.00 1.50 0.35 0.59 - 17 [ 0.04 .. 2.24]
574-> THR 82 HB - VAL 83 HN [ 1.80 3.92] 0.38 0.00 0.28 0.40 0.31 0.34 0.00 0.37 0.38 0.34 0.33 0.00 0.36 0.36 0.37 0.00 0.35 0.27 0.35 0.36 - 16 [ 0.27 .. 0.40]
577-> ASN 30 HN - GLU 61 HB3 [ 1.80 4.95] 0.00 0.16 0.14 0.00 0.33 0.23 0.17 0.14 0.00 0.16 0.00 0.00 0.00 0.27 0.23 0.00 0.15 0.10 0.26 0.29 - 13 [ 0.10 .. 0.33]
578-> ASN 30 HN - GLU 62 HB2 [ 1.80 5.24] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.06 - 2 [ 0.06 .. 0.32]
579-> LYS 29 HB2 - ASN 30 HN [ 1.80 4.05] 0.09 0.12 0.00 0.03 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.15 0.07 0.14 0.12 0.00 0.00 0.16 0.00 0.11 - 10 [ 0.03 .. 0.16]
584-> THR 7 HG1 - VAL 8 HN [ 1.80 3.79] 0.60 0.76 0.00 0.00 0.00 0.86 0.86 0.00 0.00 1.29 0.61 1.39 1.06 0.62 0.90 0.87 0.53 1.36 0.00 0.86 - 14 [ 0.53 .. 1.39]
587-> VAL 8 HN - VAL 83 HG1* [ 1.80 4.42] 1.98 2.50 1.36 1.31 1.55 1.34 1.25 1.31 1.32 2.10 1.32 2.07 1.30 1.62 1.38 1.75 1.34 2.08 1.30 1.36 - 20 [ 1.25 .. 2.50]
603-> THR 7 HN - VAL 28 HA [ 1.80 4.99] 0.19 0.00 0.00 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.00 .. 0.19]
607-> THR 7 HN - LYS 29 HD2 [ 1.80 5.72] 1.55 1.36 0.57 1.49 0.65 1.48 0.27 0.60 0.56 0.07 0.82 1.24 1.48 1.55 1.61 0.00 0.63 1.19 0.66 1.51 - 19 [ 0.07 .. 1.61]
609-> THR 7 HN - VAL 8 HG1* [ 1.80 5.26] 1.39 1.27 0.00 0.00 0.00 0.21 0.04 0.00 0.00 1.15 0.06 1.31 0.20 0.07 0.25 1.24 0.11 1.24 0.00 0.27 - 14 [ 0.04 .. 1.39]
615-> VAL 16 HG2* - LYS 20 HN [ 1.80 5.39] 0.92 0.87 0.98 0.92 1.24 0.98 0.00 0.67 0.89 0.64 0.81 0.98 0.91 0.87 0.00 0.91 0.85 0.85 0.84 0.96 - 18 [ 0.64 .. 1.24]
617-> LYS 20 HN - THR 70 HG2* [ 1.80 4.03] 0.00 0.00 0.00 0.00 1.05 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 1.05 .. 1.24]
619-> VAL 43 HN - TYR 50 HD* [ 1.80 5.10] 1.29 1.27 1.09 1.30 1.37 1.28 1.13 1.16 1.40 1.30 1.42 1.24 1.48 0.00 1.46 1.22 1.32 1.12 1.26 1.23 - 19 [ 1.09 .. 1.48]
620-> VAL 43 HN - TRP 53 HZ3 [ 1.80 5.20] 0.00 5.29 0.00 0.00 0.00 0.00 4.25 0.00 5.16 5.44 0.00 4.07 5.18 0.00 5.26 0.00 0.00 0.00 0.00 0.00 - 7 [ 4.07 .. 5.44]
625-> GLU 94 HA - ASN 97 HN [ 1.80 5.31] 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.32 .. 0.32]
634-> ASN 96 HN - VAL 98 HG2* [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.18 0.00 0.00 0.28 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.20 0.00 0.04 0.13 - 6 [ 0.04 .. 0.28]
635-> ASN 30 HB2 - LYS 60 HN [ 1.80 5.01] 0.00 0.00 0.39 0.01 0.05 0.06 0.00 0.42 0.22 0.17 0.21 0.13 0.01 0.08 0.00 0.16 0.26 0.00 0.36 0.21 - 15 [ 0.01 .. 0.42]
648-> LYS 40 HG3 - VAL 55 HN [ 1.80 5.32] 0.26 0.16 0.16 0.00 0.36 0.00 0.10 0.25 0.00 0.08 0.00 0.12 0.00 0.00 0.00 0.00 0.23 0.00 0.03 0.05 - 11 [ 0.03 .. 0.36]
650-> TRP 53 HD1 - THR 54 HN [ 1.80 4.82] 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 1.03 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 1.02 .. 1.03]
651-> TRP 53 HB3 - THR 54 HN [ 1.80 3.94] 0.00 0.00 0.00 0.00 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.08 0.01 0.00 0.10 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.01 .. 0.30]
659-> ASP 14 HN - VAL 16 HG1* [ 1.80 5.17] 1.93 2.08 2.26 1.94 2.20 2.19 0.00 2.22 1.87 2.20 2.21 2.08 2.27 2.06 1.39 2.13 2.26 2.13 2.10 2.06 - 19 [ 1.39 .. 2.27]
665-> TRP 53 HN - TRP 53 HZ3 [ 1.80 5.65] 0.00 2.13 0.00 0.00 0.00 0.00 2.18 0.00 2.04 2.14 0.00 2.24 2.26 0.00 2.34 0.00 0.00 0.00 0.00 0.00 - 7 [ 2.04 .. 2.34]
669-> VAL 18 HN - GLU 108 HN [ 1.80 5.14] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.11 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.06 - 3 [ 0.06 .. 0.11]
675-> VAL 18 HN - LYS 20 HG2 [ 1.80 5.26] 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 1.10 .. 1.17]
681-> ASN 30 HB2 - GLU 61 HN [ 1.80 4.23] 0.03 0.02 0.70 0.00 0.47 0.26 0.31 0.66 0.68 0.42 0.69 0.23 0.36 0.25 0.00 0.37 0.44 0.18 0.70 0.33 - 18 [ 0.02 .. 0.70]
684-> LEU 6 HD2* - GLU 61 HN [ 1.80 5.63] 0.04 0.09 0.48 0.00 0.40 0.24 0.12 0.43 0.42 0.28 0.60 0.14 0.40 0.33 0.26 0.42 0.38 0.02 0.50 0.28 - 19 [ 0.02 .. 0.60]
685-> LEU 57 HD2* - GLU 61 HN [ 1.80 4.77] 0.00 0.00 0.00 0.00 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.17 0.00 0.00 - 3 [ 0.00 .. 0.19]
688-> TYR 24 HN - THR 66 HA [ 1.80 5.04] 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 0.00 0.00 0.01 0.00 0.00 0.00 0.12 - 3 [ 0.01 .. 0.21]
689-> TYR 24 HN - THR 66 HB [ 1.80 5.58] 0.00 1.03 0.00 0.00 0.89 0.00 0.00 0.00 0.00 1.01 0.00 1.43 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 - 5 [ 0.89 .. 1.43]
690-> GLU 23 HB3 - TYR 24 HN [ 1.80 4.14] 0.01 0.07 0.13 0.01 0.04 0.00 0.05 0.00 0.04 0.08 0.01 0.06 0.00 0.05 0.04 0.09 0.06 0.05 0.06 0.07 - 19 [ 0.00 .. 0.13]
692-> TYR 24 HN - THR 66 HG2* [ 1.80 5.21] 0.01 0.00 0.52 0.00 0.00 0.00 0.46 0.01 0.35 0.00 0.00 0.00 0.22 0.49 0.05 0.00 0.04 0.00 0.19 0.39 - 11 [ 0.01 .. 0.52]
699-> ASP 84 HB2 - ASN 97 HD21 [ 1.80 5.35] 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.23 1.60 0.00 0.25 0.00 0.00 0.33 - 6 [ 0.23 .. 1.60]
700-> VAL 83 HG1* - ASN 97 HD21 [ 1.80 4.22] 0.00 0.00 0.00 0.00 0.14 1.82 0.77 1.03 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.16 0.18 1.28 - 10 [ 0.00 .. 1.85]
704-> THR 7 HG2* - LEU 31 HN [ 1.80 5.63] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.38 0.00 0.33 0.39 0.00 0.10 0.16 0.00 0.45 0.00 0.00 - 6 [ 0.10 .. 0.45]
711-> THR 7 HG2* - GLU 9 HN [ 1.80 6.05] 0.00 0.72 0.00 0.00 0.00 0.77 0.73 0.00 0.00 0.00 0.84 0.00 0.00 0.86 0.00 0.00 0.86 0.00 0.00 0.79 - 7 [ 0.72 .. 0.86]
712-> GLU 9 HN - VAL 28 HG1* [ 1.80 4.51] 0.63 0.60 1.16 0.84 0.56 0.71 0.70 0.56 1.09 0.47 1.13 0.67 1.06 0.55 0.59 0.62 1.12 0.74 1.17 0.66 - 20 [ 0.47 .. 1.17]
729-> GLU 62 HG2 - VAL 64 HN [ 1.80 5.50] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.78 - 2 [ 0.78 .. 1.71]
749-> THR 82 HB - GLU 85 HN [ 1.80 4.95] 0.00 0.13 0.10 0.00 0.00 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.18 0.00 0.00 0.00 0.00 - 4 [ 0.09 .. 0.18]
755-> THR 82 HG2* - GLU 85 HN [ 1.80 6.05] 0.00 0.12 0.00 0.00 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.08 0.00 0.00 0.00 0.00 - 3 [ 0.05 .. 0.12]
764-> GLU 74 HB3 - LEU 107 HN [ 1.80 4.94] 0.00 0.00 0.00 0.00 0.00 0.03 0.04 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.03 .. 0.48]
778-> VAL 26 HN - THR 66 HG2* [ 1.80 4.71] 0.00 0.48 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.53 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.40 .. 0.57]
779-> VAL 26 HN - LEU 65 HB2 [ 1.80 4.86] 0.00 0.00 0.00 0.00 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.39 0.00 0.51 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.13 .. 0.51]
789-> GLU 61 HG3 - GLU 62 HN [ 1.80 4.13] 0.00 0.86 0.77 0.00 0.72 0.90 0.85 0.76 0.00 0.83 0.00 0.00 0.00 0.81 0.88 0.89 0.86 0.90 0.77 0.80 - 14 [ 0.72 .. 0.90]
794-> LYS 29 HN - LEU 57 HD1* [ 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 0.00 0.00 0.00 0.00 0.00 0.00 0.18 0.00 0.00 - 1 [ 0.18 .. 0.18]
796-> LYS 11 HN - HIS 27 HD2 [ 1.80 5.44] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.60 - 1 [ 3.60 .. 3.60]
797-> LYS 11 HN - GLU 25 HB2 [ 1.80 4.87] 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.00 - 3 [ 0.21 .. 0.41]
801-> LEU 21 HD1* - THR 70 HN [ 1.80 5.33] 0.00 2.26 0.00 2.11 0.40 0.41 2.11 0.00 2.07 2.19 0.00 2.15 0.15 0.00 1.82 0.00 2.27 2.17 0.00 0.00 - 12 [ 0.15 .. 2.27]
803-> GLU 9 HB3 - ILE 10 HN [ 1.80 3.92] 0.30 0.36 0.35 0.20 0.33 0.04 0.00 0.29 0.00 0.00 0.07 0.00 0.16 0.24 0.06 0.00 0.05 0.20 0.00 0.03 - 14 [ 0.03 .. 0.36]
807-> VAL 83 HG2* - ASP 84 HN [ 1.80 3.74] 0.22 0.27 0.28 0.21 0.28 0.19 0.18 0.19 0.28 0.24 0.28 0.18 0.21 0.27 0.27 0.18 0.28 0.24 0.28 0.22 - 20 [ 0.18 .. 0.28]
815-> ASN 87 HN - VAL 89 HN [ 1.80 4.91] 0.00 0.00 0.00 0.11 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.03 .. 0.11]
827-> VAL 28 HN - LYS 29 HG2 [ 1.80 6.05] 1.38 1.37 0.00 1.39 0.00 1.42 0.00 0.00 0.00 0.00 0.00 1.44 1.33 1.40 1.47 0.00 0.00 1.39 0.00 1.54 - 10 [ 1.33 .. 1.54]
828-> LYS 29 HG2 - LYS 63 HN [ 1.80 6.05] 0.28 0.20 0.00 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.35 0.21 0.32 0.35 0.00 0.00 0.31 0.00 0.16 - 9 [ 0.16 .. 0.35]
829-> VAL 28 HN - LYS 29 HG3 [ 1.80 6.05] 0.57 0.51 0.73 0.60 0.62 0.56 0.76 0.70 0.79 0.72 0.73 0.57 0.48 0.50 0.62 0.62 0.77 0.50 0.66 0.71 - 20 [ 0.48 .. 0.79]
832-> LYS 63 HN - VAL 64 HG2* [ 1.80 5.15] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.98 .. 0.98]
836-> LEU 6 HN - GLU 91 HB2 [ 1.80 5.37] 0.02 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.02 .. 0.32]
840-> GLU 9 HB2 - HIS 27 HN [ 1.80 4.77] 0.48 0.50 0.27 0.72 0.33 0.36 0.00 0.45 0.00 0.00 0.39 0.00 0.88 0.58 0.38 0.00 0.35 0.43 0.00 0.32 - 14 [ 0.27 .. 0.88]
845-> GLN 73 HG2 - GLU 74 HN [ 1.80 4.86] 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.00 0.00 - 2 [ 0.30 .. 0.36]
852-> VAL 41 HN - VAL 55 HG2* [ 1.80 4.96] 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 1.46 1.28 0.00 1.11 0.00 0.00 0.00 0.00 0.00 - 4 [ 1.11 .. 1.46]
855-> VAL 41 HN - TRP 53 HE3 [ 1.80 5.54] 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 1.55 .. 1.64]
862-> LEU 21 HG - TRP 69 HN [ 1.80 5.19] 0.03 2.81 0.00 2.65 0.30 0.39 2.86 0.00 2.81 2.42 0.00 2.77 0.51 0.00 2.41 0.00 2.24 2.75 0.00 0.00 - 13 [ 0.03 .. 2.86]
863-> LEU 21 HD1* - TRP 69 HN [ 1.80 4.43] 0.00 2.81 0.00 2.74 1.96 1.97 2.76 0.00 2.73 2.36 0.00 2.72 2.09 0.00 2.61 0.00 2.32 2.69 0.00 0.00 - 12 [ 1.96 .. 2.81]
871-> THR 82 HG2* - ALA 99 HN [ 1.80 4.87] 0.61 0.00 0.64 0.64 0.56 0.57 0.00 0.57 0.63 0.54 0.65 0.00 0.66 0.67 0.54 0.00 0.59 0.39 0.63 0.54 - 16 [ 0.39 .. 0.67]
873-> VAL 8 HG2* - ALA 99 HN [ 1.80 3.79] 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.12 0.05 0.00 0.00 0.00 0.00 0.07 0.30 0.00 0.00 - 5 [ 0.05 .. 0.70]
886-> LYS 51 HE2 - TRP 53 HE1 [ 1.80 5.75] 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 3.16 1.22 0.00 1.45 0.00 0.00 0.00 0.00 0.00 - 4 [ 1.08 .. 3.16]
887-> LYS 51 HE3 - TRP 53 HE1 [ 1.80 5.75] 0.00 0.00 0.00 0.00 0.00 0.00 2.48 0.00 0.00 0.00 0.00 1.87 2.35 0.00 2.64 0.00 0.00 0.00 0.00 0.00 - 4 [ 1.87 .. 2.64]
888-> LYS 51 HD* - TRP 53 HE1 [ 1.80 6.01] 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 2.80 2.42 0.00 2.58 0.00 0.00 0.00 0.00 0.00 - 4 [ 2.10 .. 2.80]
889-> TRP 53 HE1 - LEU 65 HB2 [ 1.80 6.05] 0.19 0.00 0.20 0.22 0.23 0.00 0.00 0.00 0.00 0.00 0.10 0.00 0.17 0.73 0.28 0.00 0.00 0.00 0.40 0.00 - 9 [ 0.10 .. 0.73]
890-> TRP 53 HE1 - LEU 65 HB3 [ 1.80 4.61] 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 2.19 3.37 0.39 3.48 0.00 0.00 0.00 0.14 0.00 - 6 [ 0.14 .. 3.48]
906-> VAL 64 HG1* - LEU 65 HN [ 1.80 3.82] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.13 .. 0.13]
911-> ILE 79 HN - VAL 103 HG1* [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.17 .. 0.17]
918-> ASP 84 HB2 - ASN 97 HD22 [ 1.80 5.35] 0.07 1.07 0.00 0.00 0.77 0.15 1.11 0.00 0.83 0.72 0.00 0.08 1.05 0.33 1.50 0.94 0.00 0.63 1.06 0.23 - 15 [ 0.07 .. 1.50]
922-> ILE 45 HG2* - ASN 46 HD22 [ 1.80 5.31] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 - 1 [ 0.69 .. 0.69]
927-> ASP 84 HB3 - ASN 97 HD21 [ 1.80 4.52] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.20 0.00 0.00 0.77 1.74 0.00 0.53 0.00 0.00 0.00 - 5 [ 0.20 .. 1.74]
928-> ASP 84 HB3 - ASN 97 HD22 [ 1.80 4.52] 0.00 0.40 0.00 0.00 0.02 0.00 0.85 0.00 0.34 0.00 0.00 0.00 0.26 0.76 1.57 0.25 0.00 0.00 0.31 0.10 - 10 [ 0.02 .. 1.57]
929-> VAL 83 HG1* - ASN 97 HD22 [ 1.80 4.22] 1.29 1.45 0.00 0.00 1.62 1.64 1.95 0.76 1.57 1.47 0.00 1.16 1.38 0.64 0.19 1.34 0.00 1.64 1.64 1.17 - 16 [ 0.19 .. 1.95]
932-> GLU 62 HG3 - LYS 63 HN [ 1.80 3.86] 0.00 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 0.00 0.00 - 1 [ 0.11 .. 0.11]
933-> GLU 62 HG2 - LYS 63 HN [ 1.80 4.10] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.56 - 2 [ 0.56 .. 0.76]
936-> LEU 21 HG - ALA 22 HN [ 1.80 4.16] 0.00 1.03 0.00 1.01 0.00 0.00 1.05 0.00 1.06 1.04 0.00 1.06 0.00 0.00 0.96 0.00 1.05 1.04 0.00 0.00 - 9 [ 0.96 .. 1.06]
943-> PRO 4 HG2 - LEU 92 HN [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.25 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.25 .. 0.44]
950-> ASN 52 HB* - TRP 53 HE3 [ 1.80 6.05] 0.00 1.34 0.00 0.00 0.00 0.00 1.27 0.00 1.23 1.36 0.00 1.21 1.32 0.00 1.26 0.00 0.00 0.00 0.00 0.00 - 7 [ 1.21 .. 1.36]
951-> TRP 53 HZ2 - PHE 67 HB2 [ 1.80 5.01] 0.00 0.00 0.00 0.00 0.00 0.00 7.42 0.00 0.00 0.00 0.00 6.83 7.97 0.00 8.25 0.00 0.00 0.00 0.00 0.00 - 4 [ 6.83 .. 8.25]
983-> THR 70 HG2* - PRO 71 HA [ 1.80 5.42] 0.00 0.00 0.00 0.00 0.40 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.40 .. 0.40]
987-> PRO 4 HG2 - GLU 91 HA [ 1.80 4.59] 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.13 0.00 0.04 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.01 .. 0.13]
995-> LYS 20 HA - LYS 20 HD2 [ 1.80 3.43] 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 1.23 .. 1.24]
998-> LYS 29 HA - LYS 29 HD3 [ 1.80 4.63] 0.09 0.08 0.08 0.11 0.06 0.11 0.07 0.06 0.86 0.08 0.84 0.09 0.13 0.07 0.09 0.00 0.85 0.10 0.10 0.12 - 19 [ 0.06 .. 0.86]
1009-> TRP 53 HA - TRP 53 HE3 [ 1.80 4.98] 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.23 0.24 0.00 0.24 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.23 .. 0.26]
1032-> GLU 108 HN - GLU 108 HG2 [ 1.80 4.37] 0.00 0.00 0.19 0.00 0.24 0.00 0.00 0.32 0.00 0.18 0.17 0.00 0.00 0.00 0.20 0.00 0.00 0.00 0.17 0.32 - 8 [ 0.17 .. 0.32]
1036-> VAL 26 HG2* - LEU 65 HB2 [ 1.80 3.33] 0.80 0.10 0.28 0.40 0.40 0.66 1.59 0.68 0.33 0.11 0.49 1.50 1.57 0.23 1.75 0.58 0.48 0.50 0.43 0.70 - 20 [ 0.10 .. 1.75]
1052-> LYS 29 HB2 - LYS 29 HD3 [ 1.80 3.58] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.34 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.00 - 3 [ 0.34 .. 0.36]
1070-> LYS 20 HB3 - LYS 20 HE* [ 1.80 3.29] 0.64 0.64 0.66 0.63 0.71 0.65 0.64 0.64 0.63 0.64 0.67 0.64 0.65 0.66 0.64 0.66 0.63 0.63 0.66 0.66 - 20 [ 0.63 .. 0.71]
1073-> LEU 6 HD1* - VAL 36 HG1* [ 1.80 3.30] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.05 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.28 0.00 0.00 - 3 [ 0.05 .. 0.28]
1074-> VAL 41 HG1* - LEU 65 HD1* [ 1.80 3.37] 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 1.16 0.96 0.00 0.98 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.96 .. 1.16]
1089-> VAL 55 HG1* - LEU 65 HD2* [ 1.80 3.70] 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 2.06 1.50 0.00 1.52 0.00 0.00 0.00 0.00 0.00 - 4 [ 1.50 .. 2.06]
1141-> VAL 55 HN - VAL 55 HG2* [ 1.80 3.56] 0.00 0.00 0.00 0.00 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.38 0.37 0.00 0.38 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.37 .. 0.42]
1146-> PHE 3 HN - ILE 34 HG2* [ 1.80 5.53] 0.09 0.23 0.10 0.00 0.08 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.68 0.00 0.64 0.00 0.13 0.00 0.00 0.00 - 8 [ 0.08 .. 0.68]
1151-> ALA 81 HN - THR 82 HG2* [ 1.80 4.99] 1.37 0.00 1.37 1.47 1.35 1.40 0.00 1.37 1.37 1.39 1.43 0.00 1.37 1.42 1.34 0.00 1.39 1.33 1.37 1.37 - 16 [ 1.33 .. 1.47]
1166-> VAL 8 HN - ASN 97 HA [ 1.80 4.30] 0.00 0.30 0.09 0.07 0.00 0.00 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 - 5 [ 0.07 .. 0.45]
1168-> ILE 34 HA - PRO 59 HA [ 1.80 4.59] 0.38 0.66 0.60 0.00 0.52 0.00 0.00 0.31 0.69 0.54 0.08 0.59 0.16 0.00 0.01 0.00 0.72 0.00 0.70 0.18 - 14 [ 0.01 .. 0.72]
1194-> VAL 18 HB - LEU 107 HN [ 1.80 5.22] 0.00 0.12 0.00 0.18 0.00 0.00 0.16 0.00 0.18 0.17 0.00 0.00 0.00 0.06 0.27 0.03 0.06 0.19 0.00 0.00 - 10 [ 0.03 .. 0.27]
1202-> GLU 2 HG* - PHE 3 HN [ 1.80 4.36] 0.00 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.16 .. 0.16]
1206-> GLU 61 HG2 - GLU 62 HN [ 1.80 4.13] 0.00 0.01 0.00 0.56 0.00 0.06 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.05 0.05 0.02 0.09 0.00 0.00 - 9 [ 0.00 .. 0.56]
1214-> GLN 73 HG3 - GLU 74 HN [ 1.80 4.86] 0.00 0.08 0.00 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.05 0.00 0.00 0.00 0.16 0.08 0.01 0.07 0.00 - 7 [ 0.01 .. 0.16]
1219-> LEU 21 HA - LEU 21 HD1* [ 1.80 3.55] 0.00 0.31 0.00 0.31 0.00 0.00 0.31 0.00 0.30 0.30 0.00 0.30 0.00 0.00 0.31 0.00 0.31 0.31 0.00 0.00 - 9 [ 0.30 .. 0.31]
1227-> LEU 92 HA - LEU 92 HD2* [ 1.80 3.42] 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 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 [ 0.45 .. 0.45]
1234-> LEU 65 HA - LEU 65 HD2* [ 1.80 3.41] 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.48 0.48 0.00 0.48 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.48 .. 0.51]
1239-> VAL 8 HG2* - ALA 81 HA [ 1.80 5.14] 0.31 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 - 5 [ 0.20 .. 0.72]
1240-> ILE 10 HG13 - ASN 80 HA [ 1.80 5.33] 0.83 0.45 0.37 0.40 0.39 0.33 0.56 0.52 0.52 0.81 0.43 0.84 0.20 0.28 0.45 0.76 0.46 0.32 0.43 0.30 - 20 [ 0.20 .. 0.84]
1247-> GLU 23 HG2 - SER 68 HA [ 1.80 4.95] 0.00 0.11 0.17 0.12 0.18 0.12 0.02 0.00 0.02 0.16 0.02 0.07 0.00 0.00 0.10 0.08 0.31 0.05 0.02 0.12 - 16 [ 0.02 .. 0.31]
1250-> ASN 52 HA - TRP 53 HE3 [ 1.80 4.50] 0.00 2.38 0.00 0.00 0.00 0.00 2.16 0.00 2.29 2.46 0.00 2.18 2.17 0.00 2.17 0.00 0.00 0.00 0.00 0.00 - 7 [ 2.16 .. 2.46]
1251-> ASN 52 HA - TRP 53 HZ3 [ 1.80 5.32] 0.00 3.15 0.00 0.00 0.00 0.00 3.75 0.00 3.02 3.25 0.00 3.77 3.76 0.00 3.75 0.00 0.00 0.00 0.00 0.00 - 7 [ 3.02 .. 3.77]
1260-> THR 7 HG2* - ASN 30 HA [ 1.80 5.17] 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 1.22 1.23 0.00 1.11 1.19 0.00 1.31 0.00 0.00 - 7 [ 1.03 .. 1.31]
1269-> VAL 8 HA - GLU 9 HB2 [ 1.80 4.81] 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.91 0.00 0.91 0.00 0.00 0.93 - 5 [ 0.91 .. 0.93]
1271-> THR 7 HG2* - VAL 8 HA [ 1.80 5.03] 0.00 0.50 0.00 0.00 0.00 0.48 0.48 0.00 0.00 0.00 0.46 0.00 0.00 0.48 0.00 0.00 0.47 0.00 0.00 0.49 - 7 [ 0.46 .. 0.50]
1272-> VAL 8 HA - VAL 28 HG1* [ 1.80 4.07] 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.79 0.00 0.67 0.00 0.00 0.00 0.81 0.00 0.79 0.00 - 6 [ 0.67 .. 0.85]
1274-> THR 82 HA - VAL 98 HG2* [ 1.80 3.95] 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.65 .. 0.65]
1283-> TRP 53 HH2 - PHE 67 HA [ 1.80 5.65] 0.00 0.00 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 6.13 6.34 0.00 6.52 0.00 0.00 0.00 0.00 0.00 - 4 [ 6.13 .. 6.58]
1287-> VAL 41 HA - VAL 83 HB [ 1.80 5.03] 0.00 0.12 0.11 0.32 0.20 0.03 0.21 0.11 0.21 0.00 0.09 0.00 0.36 0.18 0.19 0.04 0.23 0.00 0.22 0.12 - 16 [ 0.03 .. 0.36]
1288-> VAL 41 HA - ALA 81 HB* [ 1.80 5.01] 0.14 0.46 0.01 0.28 0.40 0.22 0.40 0.24 0.13 0.34 0.00 0.54 0.13 0.00 0.08 0.26 0.14 0.66 0.10 0.09 - 18 [ 0.01 .. 0.66]
1300-> VAL 8 HG2* - ALA 99 HA [ 1.80 4.62] 0.54 1.06 0.00 0.00 0.08 0.00 0.08 0.32 0.28 0.65 0.40 0.80 0.08 0.00 0.00 0.58 0.37 0.88 0.20 0.00 - 14 [ 0.08 .. 1.06]
1305-> LYS 29 HA - GLU 62 HG3 [ 1.80 4.83] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.73 - 2 [ 0.73 .. 0.98]
1306-> VAL 28 HB - LYS 29 HA [ 1.80 5.21] 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.53 0.00 0.54 0.00 0.00 0.00 0.54 0.00 0.53 0.00 - 6 [ 0.52 .. 0.57]
1314-> GLU 62 HA - LYS 63 HG* [ 1.80 5.60] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.28 - 1 [ 0.28 .. 0.28]
1316-> VAL 28 HA - LYS 29 HG3 [ 1.80 5.31] 1.12 1.06 0.00 1.12 0.00 1.08 0.00 0.00 0.16 0.00 0.07 1.10 1.07 1.05 1.12 0.00 0.09 1.10 0.00 1.08 - 13 [ 0.07 .. 1.12]
1318-> GLU 9 HB3 - ILE 10 HA [ 1.80 5.42] 0.00 0.00 0.00 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.44 0.00 0.00 0.00 0.44 0.00 0.44 0.00 0.00 0.43 - 5 [ 0.43 .. 0.45]
1320-> TRP 53 HA - VAL 55 HG1* [ 1.80 5.59] 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.42 0.47 0.00 0.16 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.07 .. 0.47]
1321-> TRP 69 HA - THR 70 HB [ 1.80 5.18] 0.00 0.00 0.00 0.00 0.52 0.55 0.00 0.00 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 [ 0.52 .. 0.55]
1326-> ASP 14 HA - VAL 16 HG1* [ 1.80 5.37] 1.89 1.47 2.09 1.60 1.63 1.73 0.00 1.52 1.79 1.42 1.46 1.75 1.68 1.96 0.44 1.83 1.60 1.40 2.03 1.95 - 19 [ 0.44 .. 2.09]
1328-> ASP 5 HA - GLU 91 HB2 [ 1.80 4.64] 0.23 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.16 0.00 0.13 0.00 - 6 [ 0.13 .. 0.95]
1340-> ALA 22 HB* - THR 70 HA [ 1.80 4.80] 0.00 0.00 0.00 0.00 0.16 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 0.00 - 2 [ 0.14 .. 0.16]
1342-> THR 70 HA - THR 72 HG2* [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.10 .. 0.27]
1347-> ARG 42 HA - TRP 53 HE3 [ 1.80 5.24] 0.00 3.45 0.00 0.00 0.00 0.00 1.17 0.00 3.44 4.03 0.00 1.37 2.37 0.00 2.52 0.00 0.00 0.00 0.00 0.00 - 7 [ 1.17 .. 4.03]
1350-> ARG 78 HA - VAL 103 HG1* [ 1.80 6.05] 0.10 0.00 0.00 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.10 .. 0.40]
1353-> PRO 4 HD3 - GLU 91 HA [ 1.80 5.38] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.04 0.00 0.62 0.00 0.00 0.41 0.00 0.00 0.17 0.00 0.00 0.00 - 4 [ 0.04 .. 0.62]
1354-> PHE 3 HB3 - GLU 91 HA [ 1.80 4.49] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.12 .. 0.12]
1355-> PHE 3 HB2 - GLU 91 HA [ 1.80 4.76] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.34 .. 0.68]
1356-> GLU 91 HA - LEU 92 HG [ 1.80 4.43] 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 2.21 .. 2.21]
1359-> LEU 21 HG - GLU 23 HA [ 1.80 5.48] 0.00 3.08 0.00 3.05 1.25 1.40 3.07 0.00 3.10 3.09 0.00 3.00 1.46 0.00 2.94 0.00 3.29 2.96 0.00 0.00 - 12 [ 1.25 .. 3.29]
1368-> VAL 43 HG2* - ILE 45 HD1* [ 1.80 5.83] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.11 0.00 0.02 0.08 0.00 0.00 0.17 0.00 - 4 [ 0.02 .. 0.17]
1373-> TRP 69 HZ3 - ILE 79 HD1* [ 1.80 4.36] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.15 0.00 0.47 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.15 .. 0.47]
1380-> VAL 16 HG2* - PRO 71 HD2 [ 1.80 4.54] 0.07 0.41 0.08 0.48 0.26 0.13 0.00 0.66 0.56 0.79 0.78 0.52 0.00 0.30 0.00 0.34 0.29 0.43 0.37 0.03 - 18 [ 0.00 .. 0.79]
1392-> PRO 13 HD2 - VAL 16 HG1* [ 1.80 5.12] 0.67 1.01 1.21 0.51 1.11 0.74 0.00 1.41 0.93 1.17 1.26 0.89 1.31 0.82 1.24 1.29 1.28 1.17 0.83 1.27 - 19 [ 0.51 .. 1.41]
1409-> THR 82 HB - GLU 85 HB2 [ 1.80 5.20] 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 0.00 0.00 - 2 [ 0.41 .. 0.44]
1410-> GLU 23 HG2 - THR 66 HB [ 1.80 5.27] 0.00 0.48 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.48 0.00 0.95 0.00 0.00 0.00 0.67 0.00 0.00 0.00 0.00 - 5 [ 0.48 .. 0.95]
1411-> THR 7 HB - ASN 96 HD21 [ 1.80 4.86] 0.85 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.72 0.00 0.61 0.00 0.00 0.00 0.59 0.00 0.00 - 6 [ 0.54 .. 1.30]
1414-> LEU 65 HA - THR 66 HG2* [ 1.80 4.91] 0.00 0.65 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.66 0.00 0.60 0.00 0.00 0.00 0.60 0.00 0.00 0.00 0.00 - 5 [ 0.54 .. 0.66]
1420-> VAL 64 HA - LEU 65 HG [ 1.80 4.85] 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 1.58 1.59 0.00 1.60 0.00 0.00 0.00 0.00 0.00 - 4 [ 1.53 .. 1.60]
1422-> VAL 64 HA - LEU 65 HD1* [ 1.80 5.63] 0.00 0.00 0.00 0.00 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.19 0.18 0.00 0.20 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.18 .. 0.25]
1427-> VAL 83 HG1* - GLU 85 HA [ 1.80 6.05] 0.33 0.26 0.20 0.08 0.29 0.21 0.04 0.19 0.17 0.14 0.34 0.18 0.13 0.29 0.15 0.20 0.31 0.22 0.18 0.21 - 20 [ 0.04 .. 0.34]
1428-> GLU 85 HA - VAL 98 HG2* [ 1.80 6.05] 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 1.54 .. 1.54]
1436-> VAL 15 HG1* - SER 104 HB2 [ 1.80 4.70] 0.00 0.19 0.00 0.00 0.31 0.22 0.00 0.62 0.04 0.45 0.57 0.41 0.45 0.00 0.00 0.13 0.28 0.27 0.00 0.00 - 13 [ 0.00 .. 0.62]
1437-> GLY 35 HN - PRO 59 HA [ 1.80 5.15] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.02 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.19 0.00 - 3 [ 0.02 .. 0.25]
1446-> VAL 55 HB - SER 56 HB* [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.16 0.14 0.00 0.11 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.06 .. 0.16]
1448-> THR 39 HG2* - SER 56 HB* [ 1.80 6.05] 0.23 0.52 0.53 0.41 0.53 0.00 0.45 0.32 0.33 0.49 0.03 0.41 0.40 0.08 0.26 0.05 0.52 0.22 0.50 0.38 - 19 [ 0.03 .. 0.53]
1453-> GLU 23 HG3 - SER 68 HB3 [ 1.80 5.35] 0.00 0.00 0.00 0.04 0.31 0.13 0.00 0.00 0.00 0.17 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 5 [ 0.04 .. 0.31]
1454-> VAL 18 HA - THR 72 HA [ 1.80 5.31] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.03 0.86 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.03 .. 0.86]
1464-> GLU 74 HA - VAL 105 HG2* [ 1.80 4.35] 0.19 0.19 0.30 0.13 0.25 0.23 0.17 0.25 0.20 0.46 0.29 0.00 0.27 0.31 0.01 0.30 0.35 0.22 0.34 0.17 - 19 [ 0.01 .. 0.46]
1470-> LYS 51 HB3 - TRP 53 HH2 [ 1.80 5.18] 0.00 1.66 0.00 0.00 0.00 0.00 6.46 0.00 1.57 1.96 0.00 6.41 6.75 0.00 6.83 0.00 0.00 0.00 0.00 0.00 - 7 [ 1.57 .. 6.83]
1475-> PRO 4 HG3 - ILE 34 HD1* [ 1.80 4.70] 0.97 0.86 1.34 1.10 1.16 0.00 0.45 0.00 1.13 1.34 0.43 1.30 0.00 0.30 0.00 0.36 1.02 0.62 1.20 1.27 - 16 [ 0.30 .. 1.34]
1500-> ILE 34 HG2* - PRO 59 HA [ 1.80 4.79] 1.30 1.57 1.57 0.95 1.44 0.26 0.51 1.33 1.55 1.48 0.48 1.52 1.16 0.15 1.07 0.27 1.67 0.37 1.61 1.26 - 20 [ 0.15 .. 1.67]
1502-> PHE 3 HB3 - ILE 34 HG2* [ 1.80 5.51] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.16 0.00 0.14 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.12 .. 0.16]
1503-> PHE 3 HB2 - ILE 34 HG2* [ 1.80 5.60] 0.41 0.52 0.44 0.51 0.42 0.00 0.00 0.97 0.42 0.38 0.00 0.36 1.02 0.00 1.00 0.00 0.51 0.00 0.25 0.30 - 14 [ 0.25 .. 1.02]
1504-> PRO 4 HB2 - ILE 34 HG2* [ 1.80 4.28] 0.42 0.34 0.60 0.32 0.40 0.00 0.00 0.73 0.43 0.69 0.00 0.61 0.75 0.00 0.72 0.00 0.36 0.00 0.47 0.53 - 14 [ 0.32 .. 0.75]
1505-> GLU 2 HG* - ILE 34 HG2* [ 1.80 4.61] 0.00 0.02 0.00 1.15 0.00 0.00 0.00 0.15 1.61 0.00 0.00 1.54 0.12 0.00 0.07 0.00 0.00 0.00 1.52 1.65 - 9 [ 0.02 .. 1.65]
1516-> VAL 41 HN - LEU 65 HD1* [ 1.80 5.50] 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.98 0.71 0.00 0.50 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.50 .. 0.98]
1519-> TRP 53 HZ3 - LEU 65 HD1* [ 1.80 5.50] 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.40 .. 0.53]
1522-> VAL 41 HB - LEU 65 HD1* [ 1.80 4.25] 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.57 0.29 0.00 0.20 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.20 .. 0.66]
1523-> VAL 26 HB - LEU 65 HD1* [ 1.80 4.28] 0.00 0.00 0.00 0.00 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.49 0.37 0.00 0.48 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.31 .. 0.49]
1524-> LYS 63 HB3 - LEU 65 HD1* [ 1.80 5.08] 0.00 0.05 0.50 0.08 0.01 0.00 1.68 0.00 0.00 0.00 0.00 1.79 1.47 0.24 1.71 0.13 0.00 0.00 0.00 0.00 - 10 [ 0.01 .. 1.79]
1525-> LYS 63 HB2 - LEU 65 HD1* [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 1.57 1.32 0.00 1.44 0.00 0.00 0.00 0.00 0.00 - 4 [ 1.29 .. 1.57]
1526-> LYS 63 HG* - LEU 65 HD1* [ 1.80 6.05] 0.00 0.00 0.50 0.27 0.00 0.00 1.92 0.00 0.13 0.00 0.00 2.02 1.69 0.05 1.94 0.27 0.00 0.00 0.00 0.00 - 10 [ 0.00 .. 2.02]
1527-> VAL 26 HG1* - LEU 65 HD1* [ 1.80 3.98] 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 1.42 1.18 0.00 1.28 0.00 0.00 0.00 0.00 0.00 - 4 [ 1.13 .. 1.42]
1532-> GLY 17 HA3 - VAL 18 HG1* [ 1.80 5.07] 0.70 0.72 0.72 0.72 0.73 0.70 0.66 0.72 0.71 0.73 0.74 0.71 0.72 0.71 0.67 0.71 0.71 0.71 0.72 0.70 - 20 [ 0.66 .. 0.74]
1539-> VAL 83 HG2* - ASP 84 HB2 [ 1.80 4.39] 0.97 0.79 0.77 1.04 0.95 0.85 0.87 0.94 0.99 0.91 0.85 0.90 0.98 0.80 0.99 0.68 1.13 0.99 0.96 0.98 - 20 [ 0.68 .. 1.13]
1541-> VAL 83 HG2* - ASP 84 HB3 [ 1.80 4.59] 1.15 0.92 0.96 1.02 1.08 1.08 1.09 1.06 1.03 1.03 1.10 1.08 0.97 1.03 0.97 0.88 1.14 1.14 1.03 1.09 - 20 [ 0.88 .. 1.15]
1542-> LYS 29 HB2 - ASN 30 HB2 [ 1.80 5.71] 1.10 1.09 0.00 1.12 0.00 1.15 0.00 0.00 0.00 0.00 0.00 1.15 1.10 1.16 1.08 0.00 0.00 1.17 0.00 1.14 - 10 [ 1.08 .. 1.17]
1543-> ASN 30 HB2 - GLU 61 HB2 [ 1.80 6.05] 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.61 0.28 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 5 [ 0.03 .. 0.75]
1549-> VAL 83 HG1* - ASN 97 HB2 [ 1.80 4.72] 0.00 0.00 0.41 0.90 0.00 1.27 0.00 0.61 1.12 0.00 1.05 0.00 0.00 0.77 0.31 0.00 0.87 0.00 0.00 0.94 - 10 [ 0.31 .. 1.27]
1550-> TRP 53 HB2 - VAL 55 HG1* [ 1.80 5.10] 0.00 0.00 0.00 0.00 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.75 0.74 0.00 0.42 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.42 .. 0.75]
1556-> GLU 9 HB2 - HIS 27 HB3 [ 1.80 4.82] 0.55 0.67 0.43 1.06 0.79 1.51 0.00 0.65 0.00 0.00 1.52 0.00 1.43 0.90 1.61 0.00 1.43 0.47 0.00 0.00 - 13 [ 0.43 .. 1.61]
1563-> VAL 28 HG2* - LYS 63 HB2 [ 1.80 4.37] 0.12 0.08 0.33 0.68 0.30 0.66 1.02 0.52 0.49 0.24 0.07 0.90 0.70 0.25 0.82 0.82 0.07 0.57 0.16 1.77 - 20 [ 0.07 .. 1.77]
1565-> VAL 43 HB - TRP 53 HZ3 [ 1.80 5.04] 0.00 4.80 0.00 0.00 0.00 0.00 4.81 0.00 4.94 5.08 0.00 4.75 5.44 0.00 5.71 0.00 0.00 0.00 0.00 0.00 - 7 [ 4.75 .. 5.71]
1570-> LYS 29 HB2 - LEU 31 HD2* [ 1.80 4.48] 0.12 0.16 0.00 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.27 0.25 0.22 0.02 0.00 0.00 0.27 0.00 0.16 - 9 [ 0.02 .. 0.27]
1571-> GLU 9 HB3 - LYS 11 HB2 [ 1.80 5.25] 1.30 1.06 1.06 1.10 1.02 2.80 1.11 1.15 1.05 0.88 2.86 0.95 1.41 1.34 2.76 0.70 2.92 1.14 1.02 2.86 - 20 [ 0.70 .. 2.92]
1575-> LYS 20 HA - LEU 21 HB3 [ 1.80 5.65] 0.00 0.14 0.00 0.13 0.03 0.01 0.10 0.00 0.05 0.11 0.00 0.07 0.02 0.00 0.11 0.00 0.08 0.12 0.00 0.00 - 12 [ 0.01 .. 0.14]
1578-> GLU 74 HB3 - LEU 107 HB* [ 1.80 5.14] 0.00 0.01 0.05 0.01 0.04 0.07 0.10 0.12 0.05 0.54 0.28 0.00 0.02 0.07 0.02 0.01 0.02 0.06 0.10 0.03 - 19 [ 0.00 .. 0.54]
1585-> GLU 2 HB2 - ILE 34 HB [ 1.80 5.02] 2.32 2.40 2.12 1.78 2.26 0.00 0.00 2.10 0.93 2.11 0.00 0.79 2.11 0.00 2.06 0.00 2.28 0.00 0.99 0.71 - 14 [ 0.71 .. 2.40]
1586-> GLU 2 HB3 - ILE 34 HB [ 1.80 5.02] 1.02 1.12 0.82 0.66 1.01 0.00 0.00 0.87 0.31 0.79 0.00 0.26 0.94 0.00 0.91 0.00 0.93 0.00 0.30 0.29 - 14 [ 0.26 .. 1.12]
1589-> ASP 5 HA - GLU 91 HG2 [ 1.80 5.39] 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.09 0.00 0.00 0.12 0.00 0.00 0.00 - 4 [ 0.00 .. 0.42]
1596-> VAL 8 HG2* - ALA 81 HB* [ 1.80 3.16] 0.31 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.63 0.00 0.00 0.00 0.01 0.00 0.76 0.00 0.00 - 6 [ 0.01 .. 0.76]
1599-> THR 82 HG2* - GLU 85 HA [ 1.80 5.36] 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.30 0.00 0.00 0.00 0.00 - 2 [ 0.30 .. 0.41]
1600-> THR 82 HG2* - GLU 85 HG* [ 1.80 4.09] 0.00 0.00 0.00 0.00 0.00 0.00 1.33 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 - 2 [ 0.14 .. 1.33]
1601-> THR 82 HG2* - VAL 98 HB [ 1.80 4.55] 0.18 1.39 0.27 0.35 0.35 0.20 0.00 0.26 0.25 0.18 0.22 0.00 0.31 0.21 0.18 0.00 0.12 0.21 0.22 0.19 - 17 [ 0.12 .. 1.39]
1616-> VAL 8 HG2* - ALA 99 HB* [ 1.80 3.10] 0.32 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.59 0.00 0.00 0.00 0.26 0.00 0.71 0.00 0.00 - 6 [ 0.26 .. 0.71]
1623-> GLY 33 HA3 - PRO 59 HB2 [ 1.80 4.83] 0.44 0.43 0.53 0.32 0.53 0.55 0.80 0.61 0.57 0.59 0.50 0.52 0.55 0.36 0.45 0.51 0.48 0.61 0.55 0.00 - 19 [ 0.32 .. 0.80]
1626-> GLY 58 HA2 - GLU 61 HB3 [ 1.80 5.32] 0.00 0.53 0.55 0.00 0.54 0.51 0.51 0.46 0.00 0.56 0.00 0.00 0.00 0.42 0.56 0.59 0.44 0.59 0.41 0.37 - 14 [ 0.37 .. 0.59]
1631-> GLY 35 HN - GLY 58 HA3 [ 1.80 5.51] 0.26 0.12 0.00 0.25 0.04 0.00 0.00 0.00 0.19 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.12 0.09 - 9 [ 0.00 .. 0.26]
1656-> ASN 80 HB3 - THR 82 HG2* [ 1.80 4.87] 0.74 0.00 0.83 1.11 0.81 0.75 0.00 0.81 0.73 0.90 0.98 0.00 0.73 0.90 0.72 0.00 0.82 0.95 0.77 0.72 - 16 [ 0.72 .. 1.11]
1661-> ASN 80 HB2 - THR 82 HG2* [ 1.80 5.65] 0.55 0.00 0.53 0.89 0.55 0.51 0.00 0.60 0.53 0.83 0.83 0.00 0.52 0.68 0.54 0.00 0.70 0.84 0.60 0.56 - 16 [ 0.51 .. 0.89]
1662-> ASN 80 HB2 - VAL 98 HG1* [ 1.80 4.96] 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 1.22 .. 1.22]
1669-> ASN 80 HD21 - THR 100 HG2* [ 1.80 4.69] 0.16 0.06 0.17 0.02 0.12 0.17 0.21 0.11 0.01 0.00 0.03 0.16 0.03 0.06 0.07 0.03 0.01 0.10 0.04 0.14 - 19 [ 0.01 .. 0.21]
1677-> GLU 23 HB3 - THR 66 HG2* [ 1.80 4.75] 1.29 0.00 2.06 1.62 0.06 1.35 2.08 1.49 1.88 0.00 1.48 0.33 1.81 1.94 1.68 0.19 1.79 1.55 1.70 1.79 - 18 [ 0.06 .. 2.08]
1678-> GLU 25 HB3 - THR 66 HG2* [ 1.80 4.11] 0.00 0.62 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.63 0.00 0.50 0.00 0.00 0.00 0.34 0.00 0.00 0.00 0.00 - 5 [ 0.34 .. 0.68]
1680-> VAL 64 HG1* - THR 66 HG2* [ 1.80 3.73] 0.00 0.28 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.40 0.00 0.39 0.00 0.00 0.00 0.38 0.00 0.00 0.00 0.00 - 5 [ 0.28 .. 0.70]
1682-> LYS 51 HG3 - TRP 53 HH2 [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 5.98 0.00 0.00 0.00 0.00 4.55 5.73 0.00 5.84 0.00 0.00 0.00 0.00 0.00 - 4 [ 4.55 .. 5.98]
1684-> TRP 53 HE1 - LEU 65 HD2* [ 1.80 5.28] 0.00 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.48 0.90 0.00 1.07 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.35 .. 1.07]
1688-> VAL 55 HB - LEU 65 HD2* [ 1.80 5.75] 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.40 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.12 .. 0.49]
1689-> LYS 63 HB3 - LEU 65 HD2* [ 1.80 4.33] 0.00 0.00 0.00 0.00 0.00 0.00 3.34 0.00 0.00 0.00 0.00 3.49 3.02 0.00 3.28 0.00 0.00 0.00 0.00 0.00 - 4 [ 3.02 .. 3.49]
1690-> LYS 63 HB2 - LEU 65 HD2* [ 1.80 5.33] 0.00 0.00 0.00 0.00 0.00 0.00 2.45 0.00 0.00 0.00 0.00 2.79 2.35 0.00 2.50 0.00 0.00 0.00 0.00 0.00 - 4 [ 2.35 .. 2.79]
1705-> GLU 25 HA - VAL 64 HG1* [ 1.80 4.43] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.55 .. 0.55]
1707-> VAL 26 HA - VAL 64 HG1* [ 1.80 5.58] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.03 0.00 - 2 [ 0.03 .. 1.07]
1712-> LYS 63 HA - VAL 64 HG2* [ 1.80 4.22] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 - 1 [ 1.12 .. 1.12]
1713-> GLU 62 HG3 - VAL 64 HG2* [ 1.80 4.64] 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.02 0.00 0.00 0.00 1.58 0.00 0.05 0.00 0.02 0.00 - 5 [ 0.01 .. 1.58]
1716-> GLU 25 HB2 - VAL 64 HG1* [ 1.80 4.36] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.51 0.00 - 2 [ 0.51 .. 1.45]
1720-> ILE 34 HA - PRO 59 HG2 [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 - 1 [ 0.56 .. 0.56]
1721-> ILE 34 HA - PRO 59 HB3 [ 1.80 5.02] 0.00 0.33 0.03 0.00 0.00 0.00 0.00 0.00 0.03 0.11 0.00 0.24 0.00 0.00 0.00 0.00 0.36 0.00 0.31 0.00 - 7 [ 0.03 .. 0.36]
1722-> ILE 34 HA - PRO 59 HB2 [ 1.80 4.89] 1.23 1.75 1.41 1.01 1.39 0.19 0.12 0.87 1.40 1.51 0.93 1.64 0.76 0.35 0.64 0.14 1.72 0.15 1.67 0.94 - 20 [ 0.12 .. 1.75]
1723-> ILE 34 HA - PRO 59 HG3 [ 1.80 4.86] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 - 1 [ 0.46 .. 0.46]
1728-> ASN 19 HD21 - THR 72 HA [ 1.80 5.30] 0.32 0.94 0.35 0.95 0.18 0.28 1.86 2.23 1.18 3.24 1.78 0.54 0.31 0.54 1.14 0.41 0.45 1.96 0.42 0.41 - 20 [ 0.18 .. 3.24]
1729-> ASN 19 HA - THR 72 HA [ 1.80 4.77] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.66 0.40 0.00 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.07 .. 0.71]
1730-> ILE 34 HG12 - GLY 35 HN [ 1.80 5.01] 0.13 0.16 0.15 0.14 0.17 0.00 0.00 0.00 0.18 0.17 0.00 0.17 0.00 0.00 0.00 0.00 0.18 0.00 0.18 0.12 - 11 [ 0.12 .. 0.18]
1733-> ILE 34 HG12 - GLY 35 HA3 [ 1.80 6.01] 1.23 1.24 1.24 1.22 1.25 0.00 0.00 0.64 1.25 1.25 0.00 1.24 0.69 0.00 0.68 0.00 1.24 0.00 1.25 1.22 - 14 [ 0.64 .. 1.25]
1734-> PRO 4 HG2 - ILE 34 HG12 [ 1.80 6.05] 0.00 0.00 0.29 0.10 0.14 0.00 0.42 1.60 0.10 0.26 0.53 0.27 0.42 0.59 0.42 0.48 0.00 0.56 0.15 0.23 - 17 [ 0.00 .. 1.60]
1735-> ILE 34 HG13 - GLY 35 HA3 [ 1.80 5.09] 2.45 2.55 2.49 2.40 2.54 0.00 0.00 2.06 2.51 2.52 0.00 2.52 2.07 0.00 2.07 0.00 2.61 0.00 2.51 2.40 - 14 [ 2.06 .. 2.61]
1736-> ASN 19 HN - LYS 20 HG2 [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.18 .. 0.23]
1737-> THR 7 HG2* - LYS 29 HN [ 1.80 4.46] 0.00 0.32 0.00 0.00 0.00 0.27 0.34 0.00 0.00 0.00 0.55 0.00 0.00 0.27 0.00 0.00 0.65 0.00 0.00 0.23 - 8 [ 0.00 .. 0.65]
1740-> LEU 6 HA - THR 7 HG2* [ 1.80 4.61] 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.96 0.95 0.00 1.00 0.92 0.00 0.95 0.00 0.00 - 7 [ 0.92 .. 1.04]
1741-> THR 7 HG2* - VAL 28 HA [ 1.80 5.24] 0.00 0.78 0.00 0.00 0.00 0.75 0.74 0.00 0.00 0.00 0.91 0.00 0.00 0.76 0.00 0.00 0.96 0.00 0.00 0.72 - 7 [ 0.72 .. 0.96]
1742-> ASP 5 HB3 - THR 7 HG2* [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.56 0.46 0.00 0.10 0.25 0.00 0.65 0.00 0.00 - 6 [ 0.10 .. 0.65]
1743-> THR 7 HG2* - GLU 9 HG* [ 1.80 5.15] 0.05 2.48 1.03 1.54 1.12 1.64 0.23 1.16 0.00 0.00 1.85 0.00 0.09 2.54 0.00 0.00 1.86 0.01 0.00 1.63 - 14 [ 0.01 .. 2.54]
1744-> THR 7 HG2* - LEU 31 HB* [ 1.80 4.26] 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 1.15 1.24 0.00 0.82 0.86 0.00 1.23 0.00 0.00 - 7 [ 0.55 .. 1.24]
1745-> THR 7 HG2* - LEU 31 HG [ 1.80 3.74] 0.85 0.00 0.00 0.00 0.00 0.00 0.25 0.00 0.00 1.25 0.18 1.34 1.66 0.00 1.08 1.15 0.95 1.44 0.00 0.00 - 10 [ 0.18 .. 1.66]
1746-> THR 7 HG2* - LYS 29 HD2 [ 1.80 3.55] 3.08 3.22 0.29 1.42 0.35 3.15 1.93 0.23 0.23 1.59 3.02 2.64 3.04 3.25 3.04 1.13 3.10 2.63 0.35 3.27 - 20 [ 0.23 .. 3.27]
1748-> ASP 5 HB2 - LEU 31 HB* [ 1.80 4.22] 0.04 0.00 0.00 0.00 0.12 0.00 0.39 0.15 0.18 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.15 0.00 - 7 [ 0.03 .. 0.39]
1754-> ASN 19 HD22 - THR 72 HG2* [ 1.80 5.15] 0.00 0.98 0.00 0.90 0.00 0.00 1.37 2.43 1.44 3.96 1.99 0.23 0.00 0.00 0.96 0.09 0.02 2.17 0.06 0.00 - 13 [ 0.02 .. 3.96]
1755-> THR 70 HG2* - THR 72 HG2* [ 1.80 3.83] 0.00 0.00 0.00 0.00 1.14 1.12 0.00 0.49 0.08 0.68 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 6 [ 0.08 .. 1.14]
1764-> LEU 57 HD1* - GLU 61 HB3 [ 1.80 4.61] 0.16 1.06 0.75 0.00 1.02 0.46 0.95 0.94 0.36 1.12 0.09 0.16 0.53 0.98 0.88 0.65 1.06 1.09 1.03 0.55 - 19 [ 0.09 .. 1.12]
1766-> VAL 28 HG2* - LEU 57 HD1* [ 1.80 3.48] 0.32 0.32 0.00 0.46 0.53 0.32 0.30 0.50 0.00 0.43 0.00 0.22 0.00 0.32 0.10 0.56 0.00 0.17 0.00 0.39 - 14 [ 0.10 .. 0.56]
1770-> LYS 40 HB2 - ASN 52 HB* [ 1.80 6.05] 0.26 0.50 0.12 0.29 0.28 0.26 0.73 0.27 0.34 0.56 0.00 0.51 0.44 0.00 0.08 0.25 0.11 0.19 0.34 0.37 - 18 [ 0.08 .. 0.73]
1781-> PHE 3 HB3 - LEU 92 HG [ 1.80 4.44] 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.09 .. 1.49]
1784-> VAL 18 HG2* - ASN 19 HB2 [ 1.80 4.65] 1.00 0.91 1.00 0.89 0.89 0.93 0.57 0.92 0.92 0.56 0.88 0.96 1.00 1.01 0.93 0.96 0.94 0.52 0.98 1.00 - 20 [ 0.52 .. 1.01]
1785-> ASN 19 HB3 - LYS 20 HD2 [ 1.80 5.31] 0.99 1.28 0.94 1.31 1.55 0.90 0.50 1.25 1.21 0.59 1.82 1.16 0.94 0.94 1.31 1.02 1.24 0.57 0.96 0.94 - 20 [ 0.50 .. 1.82]
1787-> ASN 19 HA - THR 72 HG2* [ 1.80 4.83] 0.00 0.25 0.00 0.18 0.00 0.00 0.00 1.51 0.65 1.62 1.15 0.00 0.00 0.00 0.15 0.00 0.00 0.04 0.00 0.00 - 8 [ 0.04 .. 1.62]
1789-> THR 7 HB - ASN 97 HA [ 1.80 5.09] 0.96 1.28 0.00 0.57 0.00 0.52 0.00 0.16 0.74 1.32 0.00 1.53 1.38 0.60 1.54 1.40 0.00 1.58 0.17 0.36 - 15 [ 0.16 .. 1.58]
1790-> VAL 83 HG1* - ASN 97 HA [ 1.80 3.62] 0.93 1.04 0.51 0.35 0.72 0.85 0.57 0.52 0.37 0.79 1.15 0.67 0.36 0.84 0.39 0.38 1.04 0.90 0.73 0.71 - 20 [ 0.35 .. 1.15]
1791-> VAL 8 HG2* - ASN 97 HA [ 1.80 4.59] 0.00 0.00 0.00 1.04 1.01 0.93 0.58 1.00 1.47 0.00 1.20 0.00 0.57 0.93 0.72 0.00 1.16 0.00 1.32 0.83 - 13 [ 0.57 .. 1.47]
1792-> LYS 20 HA - THR 70 HG2* [ 1.80 4.37] 0.00 0.00 0.00 0.00 0.55 0.68 0.00 0.00 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 [ 0.55 .. 0.68]
1796-> TYR 77 HB3 - VAL 103 HG1* [ 1.80 5.30] 0.00 0.00 0.00 0.05 0.12 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.02 0.00 0.27 0.00 0.00 0.00 0.00 0.00 - 5 [ 0.02 .. 0.27]
1808-> LEU 6 HB2 - THR 39 HG2* [ 1.80 4.76] 0.00 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.00 0.00 - 3 [ 0.04 .. 0.25]
1809-> VAL 28 HB - THR 39 HG2* [ 1.80 5.01] 0.00 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.11 0.00 0.00 0.00 0.22 0.00 0.00 0.00 - 3 [ 0.04 .. 0.22]
1812-> THR 39 HG2* - VAL 55 HG2* [ 1.80 3.39] 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.68 0.64 0.00 0.63 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.63 .. 0.95]
1813-> THR 54 HA - VAL 55 HG2* [ 1.80 4.61] 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.81 0.83 0.00 0.79 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.79 .. 0.83]
1815-> TRP 53 HB3 - VAL 55 HG2* [ 1.80 5.09] 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.83 0.43 0.00 0.35 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.35 .. 0.99]
1816-> VAL 55 HG2* - LYS 63 HE2 [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.17 .. 0.77]
1817-> VAL 55 HG2* - LYS 63 HE3 [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.25 .. 0.25]
1818-> TRP 53 HB2 - VAL 55 HG2* [ 1.80 5.20] 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 1.59 1.36 0.00 1.24 0.00 0.00 0.00 0.00 0.00 - 4 [ 1.24 .. 1.59]
1819-> VAL 41 HB - VAL 55 HG2* [ 1.80 4.83] 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.85 0.88 0.00 1.12 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.85 .. 1.16]
1824-> VAL 55 HG2* - LEU 65 HD2* [ 1.80 4.44] 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 2.07 1.54 0.00 1.82 0.00 0.00 0.00 0.00 0.00 - 4 [ 1.54 .. 2.10]
1825-> VAL 55 HG2* - LEU 65 HD1* [ 1.80 4.00] 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 2.14 1.84 0.00 2.03 0.00 0.00 0.00 0.00 0.00 - 4 [ 1.84 .. 2.14]
1827-> ASN 19 HN - THR 70 HG2* [ 1.80 4.23] 0.00 0.00 0.00 0.00 1.78 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 1.78 .. 1.88]
1828-> THR 70 HG2* - THR 72 HA [ 1.80 5.06] 0.00 0.00 0.00 0.00 1.93 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 1.89 .. 1.93]
1830-> ASN 19 HA - THR 70 HG2* [ 1.80 3.45] 0.00 0.00 0.00 0.00 1.80 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 1.80 .. 1.80]
1831-> VAL 18 HA - THR 70 HG2* [ 1.80 5.38] 0.00 0.00 0.00 0.00 1.77 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 1.77 .. 1.97]
1832-> ASN 19 HB3 - THR 70 HG2* [ 1.80 4.68] 0.00 0.00 0.00 0.00 1.84 1.76 0.00 0.00 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 [ 1.76 .. 1.84]
1834-> LYS 20 HB3 - THR 70 HG2* [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.11 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.11 .. 0.19]
1835-> LYS 20 HD2 - THR 70 HG2* [ 1.80 6.05] 0.26 0.31 0.03 0.39 2.25 1.49 0.58 0.29 0.38 0.43 0.67 0.50 0.32 0.07 0.48 0.10 0.27 0.34 0.11 0.04 - 20 [ 0.03 .. 2.25]
1836-> LEU 21 HB2 - THR 70 HG2* [ 1.80 5.03] 0.00 1.04 0.00 1.07 0.00 0.00 0.92 0.00 0.93 1.11 0.00 0.88 0.00 0.00 1.09 0.00 0.95 1.05 0.00 0.00 - 9 [ 0.88 .. 1.11]
1837-> ARG 78 HD2 - THR 100 HG2* [ 1.80 4.22] 0.00 0.00 0.00 0.23 0.06 0.00 0.00 0.38 0.08 0.00 0.50 0.06 0.28 0.18 0.09 0.22 0.30 0.00 0.19 0.00 - 12 [ 0.06 .. 0.50]
1842-> VAL 8 HB - VAL 28 HG1* [ 1.80 3.95] 1.02 0.97 1.66 0.00 0.00 0.00 0.00 0.00 0.79 0.97 0.78 1.13 0.57 0.00 0.00 1.21 0.74 1.19 0.70 0.00 - 12 [ 0.57 .. 1.66]
1845-> VAL 18 HG2* - THR 72 HA [ 1.80 4.11] 0.00 0.73 0.00 0.61 0.00 0.00 0.19 1.60 1.19 1.84 1.42 0.02 0.00 0.18 0.19 0.29 0.15 0.48 0.25 0.00 - 14 [ 0.02 .. 1.84]
1850-> VAL 18 HG2* - THR 72 HG2* [ 1.80 4.63] 0.64 1.20 0.58 1.10 0.62 0.72 0.87 1.79 1.46 1.90 1.65 0.68 0.66 0.88 0.77 0.95 0.84 1.05 0.94 0.59 - 20 [ 0.58 .. 1.90]
1851-> VAL 8 HG2* - ALA 81 HN [ 1.80 5.37] 0.29 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 - 5 [ 0.29 .. 0.74]
1852-> VAL 8 HG2* - ILE 10 HN [ 1.80 5.67] 0.83 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 1.13 0.00 0.00 0.00 0.41 0.00 1.04 0.00 0.00 - 6 [ 0.41 .. 1.13]
1853-> VAL 8 HG1* - ARG 42 HN [ 1.80 6.01] 0.09 0.21 0.00 0.40 0.22 0.00 0.28 0.00 0.01 0.15 0.00 0.00 0.20 0.48 0.07 0.06 0.00 0.00 0.00 0.02 - 12 [ 0.01 .. 0.48]
1854-> VAL 8 HG1* - VAL 83 HN [ 1.80 3.56] 1.48 2.39 1.10 0.00 0.00 0.00 0.13 0.00 0.00 1.29 0.00 1.65 0.00 0.00 0.00 2.28 0.00 0.87 0.00 0.00 - 8 [ 0.13 .. 2.39]
1855-> THR 7 HG1 - VAL 8 HG2* [ 1.80 5.27] 0.09 0.58 0.00 1.26 1.02 1.61 1.62 1.15 1.25 1.09 1.51 1.19 2.26 1.62 2.20 0.42 1.53 1.12 1.18 1.59 - 19 [ 0.09 .. 2.26]
1856-> VAL 8 HG1* - VAL 83 HA [ 1.80 4.77] 1.22 1.49 0.00 0.00 0.34 0.12 0.19 0.25 0.11 1.06 0.00 1.10 0.05 0.36 0.17 1.49 0.00 0.77 0.04 0.12 - 17 [ 0.00 .. 1.49]
1857-> VAL 8 HG2* - VAL 98 HA [ 1.80 4.09] 0.00 1.01 0.00 0.57 0.35 0.41 0.33 0.61 0.67 0.00 0.78 0.00 0.52 0.18 0.37 0.00 0.74 0.00 0.75 0.41 - 14 [ 0.18 .. 1.01]
1858-> VAL 8 HG1* - VAL 28 HA [ 1.80 4.06] 0.00 0.00 0.00 0.61 0.78 0.76 0.75 0.82 0.69 0.00 0.57 0.00 0.59 0.69 0.67 0.00 0.61 0.00 0.59 0.77 - 13 [ 0.57 .. 0.82]
1859-> THR 7 HA - VAL 8 HG1* [ 1.80 4.69] 0.73 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.76 0.00 0.00 0.00 0.77 0.00 0.73 0.00 0.00 - 6 [ 0.66 .. 0.77]
1860-> THR 7 HA - VAL 8 HG2* [ 1.80 5.17] 0.00 0.00 0.00 0.19 0.10 0.23 0.25 0.20 0.20 0.00 0.19 0.00 0.26 0.16 0.29 0.00 0.19 0.00 0.18 0.25 - 13 [ 0.10 .. 0.29]
1861-> VAL 8 HG1* - ASN 97 HA [ 1.80 4.68] 0.15 0.19 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.00 0.00 - 5 [ 0.07 .. 0.56]
1862-> THR 7 HB - VAL 8 HG1* [ 1.80 6.05] 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 0.00 0.43 0.00 0.00 0.00 0.39 0.00 0.42 0.00 0.00 - 5 [ 0.38 .. 0.43]
1863-> THR 7 HB - VAL 8 HG2* [ 1.80 6.05] 0.00 0.00 0.00 0.91 0.81 0.00 0.00 0.88 0.90 0.00 0.00 0.00 0.37 0.00 0.44 0.00 0.00 0.00 0.86 0.00 - 7 [ 0.37 .. 0.91]
1864-> VAL 8 HG2* - GLU 9 HG* [ 1.80 4.93] 1.79 1.77 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.35 0.02 0.00 0.00 0.40 0.00 1.77 0.00 0.00 - 8 [ 0.02 .. 1.79]
1865-> VAL 8 HG1* - VAL 28 HG1* [ 1.80 2.94] 0.87 0.88 0.64 1.22 1.22 1.32 1.24 1.27 2.71 0.81 2.65 1.07 2.49 1.16 1.11 1.07 2.62 1.00 2.62 1.32 - 20 [ 0.64 .. 2.71]
1870-> VAL 26 HG2* - TRP 53 HZ3 [ 1.80 4.47] 0.00 3.97 0.00 0.00 0.00 0.00 1.55 0.00 4.12 3.91 0.00 1.67 2.48 0.00 2.79 0.00 0.00 0.00 0.00 0.00 - 7 [ 1.55 .. 4.12]
1873-> VAL 15 HG2* - SER 104 HB2 [ 1.80 3.95] 0.00 0.03 0.00 0.00 0.13 0.05 0.00 0.40 0.00 0.29 0.35 0.19 0.29 0.00 0.00 0.00 0.13 0.08 0.00 0.00 - 10 [ 0.03 .. 0.40]
1881-> VAL 16 HG1* - TYR 24 HH [ 1.80 4.08] 0.75 0.40 0.80 0.60 0.80 0.74 0.00 0.71 0.70 0.48 0.50 0.81 0.79 0.79 0.00 0.85 0.72 0.53 0.69 0.84 - 18 [ 0.40 .. 0.85]
1884-> VAL 16 HG1* - PHE 101 HE* [ 1.80 6.05] 1.42 1.27 1.30 1.59 1.64 1.65 0.00 1.71 1.32 1.31 1.62 1.36 1.70 1.39 0.09 1.41 1.72 1.18 1.38 1.35 - 19 [ 0.09 .. 1.72]
1885-> VAL 15 HA - VAL 16 HG1* [ 1.80 4.28] 1.18 1.20 1.19 1.19 1.20 1.20 0.00 1.23 1.17 1.20 1.22 1.17 1.22 1.17 0.00 1.18 1.20 1.20 1.18 1.21 - 18 [ 1.17 .. 1.23]
1886-> PRO 13 HA - VAL 16 HG1* [ 1.80 5.14] 1.57 1.62 2.07 1.47 2.25 1.83 0.00 2.18 1.72 1.74 1.87 2.11 2.31 1.67 1.78 2.13 2.09 1.81 1.57 2.07 - 19 [ 1.47 .. 2.31]
1888-> LYS 29 HE2 - LEU 31 HD2* [ 1.80 4.33] 0.00 0.00 0.47 0.00 0.15 0.00 0.62 0.34 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.29 0.00 - 7 [ 0.15 .. 0.77]
1890-> PRO 13 HB2 - VAL 16 HG1* [ 1.80 4.42] 0.00 0.06 0.51 0.00 0.79 0.09 0.00 0.67 0.17 0.19 0.32 0.66 0.84 0.00 0.51 0.60 0.57 0.25 0.00 0.52 - 15 [ 0.06 .. 0.84]
1892-> VAL 16 HG2* - GLY 17 HN [ 1.80 3.78] 0.18 0.14 0.17 0.17 0.13 0.14 0.00 0.13 0.16 0.12 0.12 0.17 0.16 0.18 0.00 0.19 0.18 0.14 0.17 0.17 - 18 [ 0.12 .. 0.19]
1895-> VAL 15 HA - VAL 16 HG2* [ 1.80 4.66] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.80 .. 0.80]
1897-> VAL 16 HG2* - THR 70 HA [ 1.80 5.46] 0.24 0.44 0.20 0.47 0.72 0.66 0.03 0.00 0.64 0.06 0.13 0.55 0.22 0.25 0.00 0.22 0.20 0.28 0.23 0.21 - 18 [ 0.03 .. 0.72]
1898-> VAL 16 HG2* - GLY 17 HA3 [ 1.80 5.01] 0.81 0.77 0.80 0.79 0.79 0.78 0.00 0.76 0.78 0.75 0.76 0.80 0.80 0.81 0.00 0.82 0.79 0.77 0.80 0.80 - 18 [ 0.75 .. 0.82]
1899-> VAL 16 HG2* - VAL 18 HA [ 1.80 5.03] 1.64 1.55 1.64 1.58 1.65 1.63 0.00 1.55 1.64 1.52 1.55 1.52 1.60 1.58 0.00 1.60 1.54 1.59 1.56 1.68 - 18 [ 1.52 .. 1.68]
1900-> VAL 41 HG2* - TRP 53 HB2 [ 1.80 4.69] 0.00 0.00 0.00 0.00 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.12 0.26 0.00 0.09 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.09 .. 0.26]
1901-> VAL 16 HG2* - PRO 71 HD3 [ 1.80 3.99] 0.17 0.39 0.18 0.37 0.38 0.36 0.00 0.03 0.52 0.12 0.10 0.38 0.15 0.24 0.00 0.21 0.15 0.14 0.23 0.15 - 18 [ 0.03 .. 0.52]
1903-> VAL 16 HG2* - PRO 71 HG3 [ 1.80 3.55] 0.17 0.51 0.23 0.43 0.20 0.06 0.00 0.93 0.52 0.93 0.88 0.55 0.22 0.48 0.00 0.50 0.46 0.44 0.43 0.23 - 18 [ 0.06 .. 0.93]
1904-> VAL 41 HG2* - LEU 65 HD1* [ 1.80 3.94] 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 1.39 1.02 0.00 0.95 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.95 .. 1.52]
1907-> VAL 18 HG1* - ASN 19 HD21 [ 1.80 4.02] 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 - 3 [ 0.71 .. 0.83]
1909-> GLY 17 HA2 - VAL 18 HG1* [ 1.80 4.89] 0.61 0.63 0.61 0.63 0.61 0.60 0.66 0.63 0.62 0.63 0.62 0.62 0.62 0.61 0.66 0.62 0.60 0.62 0.62 0.62 - 20 [ 0.60 .. 0.66]
1911-> VAL 18 HG1* - LEU 107 HA [ 1.80 3.64] 0.65 0.82 0.51 0.86 0.16 0.54 0.87 0.61 0.87 0.84 0.23 0.34 0.64 0.77 0.88 0.71 0.68 0.75 0.64 0.53 - 20 [ 0.16 .. 0.88]
1915-> VAL 18 HB - GLU 74 HA [ 1.80 5.30] 0.08 0.00 0.08 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.13 0.00 0.00 0.15 0.00 0.02 0.08 0.00 0.16 - 8 [ 0.02 .. 0.16]
1916-> VAL 28 HB - LYS 63 HB2 [ 1.80 5.14] 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.36 .. 0.78]
1917-> VAL 28 HB - LEU 57 HD1* [ 1.80 4.09] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.05 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.16 0.00 0.10 0.00 - 4 [ 0.05 .. 0.22]
1923-> VAL 26 HG1* - TRP 53 HZ3 [ 1.80 6.04] 0.00 2.81 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 2.68 .. 2.81]
1932-> GLU 74 HB3 - VAL 105 HG1* [ 1.80 4.69] 0.18 0.15 0.29 0.10 0.26 0.29 0.20 0.25 0.14 0.44 0.23 0.00 0.31 0.23 0.00 0.24 0.32 0.21 0.28 0.14 - 19 [ 0.00 .. 0.44]
1935-> VAL 18 HB - VAL 105 HG1* [ 1.80 3.83] 0.39 0.30 0.41 0.30 0.33 0.29 0.26 0.28 0.32 0.31 0.31 0.38 0.34 0.38 0.40 0.35 0.34 0.31 0.39 0.42 - 20 [ 0.26 .. 0.42]
1938-> PRO 4 HD3 - VAL 36 HG2* [ 1.80 4.16] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.27 0.00 0.30 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.27 .. 0.30]
1943-> VAL 43 HG2* - TRP 53 HE3 [ 1.80 4.38] 0.00 2.40 0.00 0.00 0.00 0.00 0.64 0.00 2.58 2.48 0.00 0.67 1.30 0.00 1.52 0.00 0.00 0.00 0.00 0.00 - 7 [ 0.64 .. 2.58]
1944-> VAL 43 HG2* - TYR 50 HD* [ 1.80 4.35] 0.76 0.63 0.65 0.77 0.45 0.70 0.37 0.59 0.66 0.64 0.96 0.56 0.95 0.00 0.89 0.92 0.79 0.52 0.91 0.59 - 19 [ 0.37 .. 0.96]
1945-> VAL 43 HG2* - TRP 53 HZ3 [ 1.80 3.66] 0.00 3.96 0.00 0.00 0.00 0.00 2.78 0.00 4.16 4.11 0.00 2.81 3.54 0.00 3.77 0.00 0.00 0.00 0.00 0.00 - 7 [ 2.78 .. 4.16]
1948-> THR 7 HN - VAL 83 HG1* [ 1.80 4.92] 1.09 1.03 0.00 0.00 0.00 0.15 0.00 0.00 0.00 1.03 0.00 1.29 0.49 0.22 0.78 0.60 0.00 1.23 0.00 0.21 - 11 [ 0.15 .. 1.29]
1951-> THR 82 HA - VAL 83 HG1* [ 1.80 4.51] 1.01 0.90 0.98 1.01 0.98 1.01 0.95 1.01 0.98 0.98 0.99 0.96 1.00 0.99 1.01 0.97 1.00 0.97 0.99 1.01 - 20 [ 0.90 .. 1.01]
1952-> VAL 83 HG1* - VAL 98 HA [ 1.80 5.62] 0.64 2.07 0.68 0.64 0.68 0.64 0.47 0.76 0.51 0.78 0.62 0.59 0.44 0.48 0.55 0.66 0.63 0.97 0.55 0.64 - 20 [ 0.44 .. 2.07]
1953-> THR 7 HA - VAL 83 HG1* [ 1.80 4.23] 1.96 1.85 0.21 0.86 0.63 1.01 0.74 0.66 0.75 2.17 0.55 2.31 1.35 1.06 1.57 1.68 0.43 2.32 0.57 0.96 - 20 [ 0.21 .. 2.32]
1954-> VAL 83 HG1* - ASN 97 HB3 [ 1.80 4.72] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 1.32 0.15 0.35 0.00 - 4 [ 0.15 .. 1.49]
1958-> VAL 8 HG1* - VAL 83 HG1* [ 1.80 3.49] 1.69 2.02 0.11 0.77 1.06 0.80 0.88 1.01 0.84 1.69 0.85 1.72 0.72 0.87 0.95 2.04 0.89 1.49 0.75 0.85 - 20 [ 0.11 .. 2.04]
1959-> LEU 6 HN - VAL 83 HG2* [ 1.80 5.74] 0.43 0.13 0.35 0.77 0.70 0.86 0.41 0.82 0.69 0.71 0.74 0.55 0.62 0.63 0.35 0.44 0.65 0.82 0.83 0.60 - 20 [ 0.13 .. 0.86]
1961-> VAL 83 HG2* - ASP 84 HA [ 1.80 4.55] 1.24 1.26 1.26 1.25 1.29 1.21 1.21 1.23 1.29 1.27 1.27 1.22 1.23 1.25 1.30 1.18 1.30 1.27 1.30 1.26 - 20 [ 1.18 .. 1.30]
1963-> THR 39 HB - VAL 83 HG2* [ 1.80 5.38] 0.57 0.72 0.70 0.86 0.68 1.08 0.89 0.74 0.84 0.54 0.97 0.58 0.66 1.09 0.71 0.70 0.61 0.72 0.69 0.71 - 20 [ 0.54 .. 1.09]
1967-> LEU 6 HD1* - ASN 97 HD22 [ 1.80 5.40] 0.49 1.43 0.00 0.00 1.25 0.00 1.05 0.00 0.00 0.71 0.00 0.00 1.22 0.00 0.00 0.82 0.00 1.11 1.54 0.00 - 9 [ 0.49 .. 1.54]
1969-> LEU 6 HD1* - ASN 97 HD21 [ 1.80 5.40] 0.00 0.17 0.00 0.00 0.00 0.58 0.00 0.01 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.13 0.51 - 6 [ 0.01 .. 0.84]
1970-> LEU 6 HD1* - ASP 84 HA [ 1.80 5.05] 0.00 0.23 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.12 0.00 0.19 0.00 0.00 0.57 0.00 0.06 0.16 0.00 0.00 - 7 [ 0.01 .. 0.57]
1971-> LEU 6 HD1* - VAL 36 HA [ 1.80 5.29] 0.36 0.48 0.00 0.26 0.50 0.13 0.00 0.16 0.26 0.95 0.06 0.87 0.41 0.42 0.19 0.31 0.00 0.83 0.46 0.00 - 16 [ 0.06 .. 0.95]
1976-> LEU 6 HD2* - THR 39 HA [ 1.80 4.92] 0.00 0.24 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.15 0.00 0.32 0.01 0.00 0.00 0.00 0.00 0.59 0.00 0.00 - 6 [ 0.01 .. 0.59]
1977-> LEU 6 HD2* - VAL 36 HA [ 1.80 5.68] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.19 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 - 3 [ 0.19 .. 0.36]
1980-> LEU 21 HA - TRP 69 HN [ 1.80 5.20] 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.23 .. 0.23]
1982-> LEU 21 HD2* - GLU 23 HN [ 1.80 6.05] 0.00 0.18 0.00 0.06 0.13 0.25 0.20 0.00 0.18 0.34 0.00 0.19 0.26 0.00 0.02 0.00 0.69 0.15 0.00 0.00 - 12 [ 0.02 .. 0.69]
1984-> LEU 21 HD2* - GLU 23 HA [ 1.80 6.05] 0.00 0.28 0.00 0.16 0.00 0.23 0.32 0.00 0.32 0.34 0.00 0.25 0.31 0.00 0.00 0.00 0.51 0.20 0.00 0.00 - 10 [ 0.16 .. 0.51]
1985-> LEU 21 HD2* - ALA 22 HA [ 1.80 5.79] 0.00 0.00 0.00 0.00 0.10 0.17 0.01 0.00 0.00 0.00 0.00 0.02 0.14 0.00 0.00 0.00 0.01 0.01 0.00 0.00 - 7 [ 0.01 .. 0.17]
1986-> LEU 21 HD2* - SER 68 HB2 [ 1.80 4.47] 0.00 0.16 0.00 0.00 0.00 0.00 0.23 0.00 0.29 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.27 0.11 0.00 0.00 - 6 [ 0.03 .. 0.29]
1988-> LEU 21 HD2* - GLU 23 HG3 [ 1.80 4.15] 1.65 3.14 1.73 3.08 2.54 2.77 3.30 2.18 3.28 3.37 1.69 3.27 2.85 1.66 2.88 1.73 3.42 3.01 1.72 1.78 - 20 [ 1.65 .. 3.42]
1989-> LEU 21 HD1* - ALA 22 HN [ 1.80 3.93] 0.00 1.61 0.00 1.63 0.49 0.48 1.59 0.00 1.59 1.57 0.00 1.62 0.49 0.00 1.63 0.00 1.61 1.59 0.00 0.00 - 12 [ 0.48 .. 1.63]
1990-> LEU 21 HD1* - SER 68 HA [ 1.80 4.58] 0.00 2.00 0.00 1.92 1.85 2.04 1.97 0.00 1.96 1.64 0.00 1.93 2.20 0.00 1.63 0.00 2.37 1.75 0.00 0.00 - 12 [ 1.63 .. 2.37]
1992-> LEU 21 HD1* - THR 70 HA [ 1.80 4.58] 0.00 2.01 0.00 1.94 0.00 0.00 1.85 0.00 1.80 2.15 0.00 1.96 0.00 0.00 1.74 0.00 2.15 2.08 0.00 0.00 - 9 [ 1.74 .. 2.15]
1994-> THR 7 HB - LEU 31 HD1* [ 1.80 4.43] 0.00 0.00 0.40 0.00 0.00 0.03 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 - 4 [ 0.03 .. 0.81]
1995-> LYS 20 HE* - LEU 21 HD1* [ 1.80 6.05] 2.26 1.16 2.27 1.17 0.36 0.00 1.28 2.19 1.13 1.18 2.55 1.25 0.00 2.26 1.24 2.28 1.12 1.16 2.25 2.30 - 18 [ 0.36 .. 2.55]
1996-> ASP 5 HB3 - LEU 31 HD1* [ 1.80 4.28] 0.36 0.02 0.46 0.08 0.53 0.26 0.76 0.56 0.61 0.41 0.21 0.36 0.41 0.19 0.07 0.39 0.30 0.39 0.58 0.35 - 20 [ 0.02 .. 0.76]
2001-> PHE 3 HB2 - LEU 92 HB* [ 1.80 5.38] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.33 .. 0.33]
2003-> GLY 17 HN - LYS 20 HE* [ 1.80 5.35] 0.00 0.00 0.11 0.00 0.26 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 5 [ 0.00 .. 0.26]
2007-> ASN 30 HB2 - LYS 60 HA [ 1.80 5.35] 0.36 0.51 1.12 0.29 0.62 0.58 0.72 1.14 1.00 0.70 0.68 0.59 0.67 0.52 0.35 0.98 0.93 0.65 0.88 0.73 - 20 [ 0.29 .. 1.14]
2011-> VAL 16 HG2* - LYS 20 HB2 [ 1.80 4.61] 0.46 0.27 0.61 0.34 1.25 0.65 0.00 0.15 0.37 0.17 0.80 0.45 0.53 0.40 0.00 0.48 0.37 0.34 0.40 0.51 - 18 [ 0.15 .. 1.25]
2012-> LYS 29 HG2 - GLU 62 HG3 [ 1.80 4.87] 0.08 0.07 0.00 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.09 1.86 0.07 0.07 0.00 0.00 0.20 0.00 1.83 - 9 [ 0.07 .. 1.86]
2013-> LYS 29 HG2 - GLU 62 HG2 [ 1.80 5.52] 0.91 0.93 0.17 0.77 0.15 0.91 0.06 0.05 0.34 0.01 0.41 0.90 0.63 0.91 0.90 0.00 0.42 0.98 0.07 0.66 - 19 [ 0.01 .. 0.98]
2014-> GLU 62 HG2 - VAL 64 HG2* [ 1.80 4.95] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.55 0.00 0.00 0.00 0.00 0.37 - 3 [ 0.37 .. 0.71]
2016-> VAL 8 HG2* - GLU 9 HA [ 1.80 4.32] 1.18 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 1.16 0.00 0.00 0.00 1.14 0.00 1.15 0.00 0.00 - 6 [ 1.14 .. 1.18]
2017-> GLU 61 HG2 - LYS 63 HG* [ 1.80 4.99] 0.00 1.46 1.29 0.00 1.69 1.11 0.89 1.53 0.00 1.49 0.00 0.00 0.00 1.30 0.93 0.90 1.72 0.88 1.81 4.53 - 14 [ 0.88 .. 4.53]
2018-> THR 82 HG1 - GLU 85 HG* [ 1.80 4.59] 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.05 1.28 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.05 .. 1.28]
2019-> ASP 84 HA - GLU 85 HG* [ 1.80 5.76] 0.24 0.00 0.21 0.11 0.25 0.28 0.18 0.24 0.22 0.26 0.24 0.24 0.20 0.23 0.00 0.00 0.14 0.24 0.19 0.27 - 17 [ 0.11 .. 0.28]
2020-> THR 82 HB - GLU 85 HG* [ 1.80 4.43] 0.00 0.00 0.21 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.19 0.60 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.19 .. 1.02]
2021-> THR 82 HG1 - GLU 85 HB3 [ 1.80 5.22] 0.92 0.00 1.41 1.14 0.80 0.87 0.00 0.85 0.77 0.86 1.23 0.00 0.92 0.82 0.00 0.00 0.70 0.81 0.86 0.70 - 15 [ 0.70 .. 1.41]
2022-> THR 82 HB - GLU 85 HB3 [ 1.80 5.20] 0.00 0.46 0.14 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.09 0.00 0.00 0.00 0.45 0.00 0.00 0.00 0.00 - 5 [ 0.09 .. 0.87]
2023-> THR 82 HG2* - GLU 85 HB3 [ 1.80 5.73] 0.00 0.24 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.07 0.00 0.00 0.00 0.00 - 4 [ 0.01 .. 0.81]
2025-> ASP 84 HA - GLU 85 HB2 [ 1.80 5.41] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.50 .. 0.50]
2026-> THR 82 HG2* - GLU 85 HB2 [ 1.80 6.05] 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.00 .. 0.12]
2028-> VAL 8 HA - GLU 9 HG* [ 1.80 5.30] 0.51 0.51 0.52 0.52 0.50 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.48 0.49 0.00 0.00 0.00 0.51 0.00 0.00 - 9 [ 0.48 .. 0.52]
2030-> GLU 9 HG* - HIS 27 HB3 [ 1.80 4.82] 0.65 0.76 0.73 1.14 1.00 0.00 0.59 0.82 0.55 0.24 0.00 0.41 1.44 0.96 0.00 0.26 0.00 0.64 0.76 0.00 - 15 [ 0.24 .. 1.44]
2031-> GLU 9 HG* - ALA 99 HB* [ 1.80 4.08] 0.54 0.63 0.01 0.00 0.00 0.44 0.00 0.08 0.00 0.16 0.44 0.10 0.00 0.00 0.47 0.37 0.45 0.00 0.00 0.44 - 12 [ 0.01 .. 0.63]
2037-> GLU 2 HA - ILE 34 HG2* [ 1.80 5.48] 0.93 1.02 0.94 0.00 0.92 0.00 0.00 1.48 0.76 0.84 0.00 0.68 1.52 0.00 1.49 0.00 0.89 0.00 0.60 0.75 - 13 [ 0.60 .. 1.52]
2040-> PRO 13 HB3 - VAL 16 HG1* [ 1.80 4.42] 0.51 1.06 1.47 0.45 1.79 0.86 0.00 1.74 1.09 1.23 1.37 1.60 1.88 0.63 1.87 1.59 1.59 1.28 0.50 1.49 - 19 [ 0.45 .. 1.88]
2041-> VAL 16 HG2* - LYS 20 HB3 [ 1.80 5.73] 0.08 0.00 0.26 0.00 0.74 0.32 0.00 0.00 0.01 0.00 0.27 0.11 0.17 0.04 0.00 0.13 0.03 0.00 0.07 0.15 - 13 [ 0.01 .. 0.74]
2044-> GLY 35 HN - PRO 59 HG2 [ 1.80 6.01] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.25 - 1 [ 0.25 .. 0.25]
2046-> GLY 35 HN - PRO 59 HB3 [ 1.80 4.99] 0.27 0.44 0.40 0.06 0.25 0.13 0.04 0.17 0.30 0.36 0.89 0.46 0.00 0.25 0.00 0.11 0.40 0.11 0.68 0.00 - 17 [ 0.04 .. 0.89]
2052-> PRO 13 HG3 - VAL 16 HG1* [ 1.80 4.38] 1.48 0.18 0.47 1.39 0.57 1.79 0.00 0.77 0.09 0.38 0.51 0.34 0.75 1.68 1.20 0.56 0.58 0.38 1.58 0.48 - 19 [ 0.09 .. 1.79]
2055-> VAL 41 HB - TRP 53 HE3 [ 1.80 4.37] 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 1.73 .. 1.98]
2060-> LYS 63 HE2 - LEU 65 HD2* [ 1.80 5.67] 1.01 1.17 0.80 0.67 1.32 0.84 5.24 1.29 0.52 1.14 0.94 5.35 4.62 1.69 5.11 0.80 0.88 0.46 1.00 0.00 - 19 [ 0.46 .. 5.35]
2061-> LYS 51 HE2 - TRP 53 HZ2 [ 1.80 5.26] 0.00 0.00 0.00 0.00 0.00 0.00 3.32 0.00 0.00 0.00 0.00 6.01 3.13 0.00 3.33 0.00 0.00 0.00 0.00 0.00 - 4 [ 3.13 .. 6.01]
2071-> LYS 20 HD2 - LEU 21 HN [ 1.80 4.77] 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.89 .. 1.37]
2073-> PHE 3 HD* - LEU 92 HD2* [ 1.80 4.06] 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.57 .. 0.57]
2074-> GLU 91 HA - LEU 92 HD2* [ 1.80 5.84] 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.25 .. 0.25]
2076-> ASP 5 HA - LEU 92 HD1* [ 1.80 4.83] 0.00 1.22 0.12 0.00 0.00 0.43 0.00 0.29 0.00 0.00 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.20 - 6 [ 0.12 .. 1.22]
2078-> PHE 3 HB3 - LEU 92 HD2* [ 1.80 4.16] 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 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 [ 0.93 .. 0.93]
2079-> ASP 5 HB2 - LEU 92 HD1* [ 1.80 4.07] 0.00 1.18 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 0.00 0.00 0.00 0.00 - 1 [ 1.18 .. 1.18]
2080-> PHE 3 HB2 - LEU 92 HD2* [ 1.80 3.76] 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.13 .. 0.13]
2089-> LEU 57 HD2* - GLU 61 HG2 [ 1.80 4.21] 0.00 1.10 1.15 0.00 1.14 0.93 1.45 1.28 0.00 1.16 0.00 0.00 0.00 1.28 1.30 1.15 1.25 1.54 1.18 1.09 - 14 [ 0.93 .. 1.54]
2090-> LEU 57 HD2* - GLU 61 HG3 [ 1.80 4.21] 0.00 0.84 1.01 0.00 0.91 0.78 1.29 1.13 0.00 0.89 0.02 0.03 0.32 1.08 1.13 0.94 1.04 1.33 0.98 1.01 - 18 [ 0.00 .. 1.33]
2094-> VAL 28 HG2* - LEU 57 HD2* [ 1.80 3.60] 1.29 1.17 0.03 1.04 1.37 1.49 1.31 1.37 0.04 1.25 0.00 1.24 0.00 1.04 1.17 1.50 0.00 0.99 0.00 1.59 - 16 [ 0.03 .. 1.59]
2097-> VAL 28 HG2* - LYS 29 HA [ 1.80 4.43] 1.11 1.14 0.00 1.07 1.10 1.11 1.08 1.11 0.00 1.10 0.00 1.12 0.00 1.12 1.10 1.13 0.00 1.12 0.00 1.09 - 14 [ 1.07 .. 1.14]
2098-> VAL 28 HG2* - GLU 62 HA [ 1.80 4.76] 1.24 1.30 0.13 1.76 1.37 1.26 1.38 1.44 0.35 1.38 0.15 1.25 0.15 1.20 1.25 1.53 0.17 1.21 0.20 1.45 - 20 [ 0.13 .. 1.76]
2100-> VAL 28 HG2* - VAL 64 HA [ 1.80 4.75] 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 1.75 0.12 1.98 0.00 1.25 0.00 0.00 0.00 1.98 0.00 1.91 0.06 - 8 [ 0.06 .. 1.98]
2101-> VAL 28 HG2* - LYS 63 HB3 [ 1.80 3.60] 1.83 1.81 2.40 2.05 2.08 2.14 2.54 2.33 2.55 1.99 2.28 2.37 2.69 1.85 2.33 2.29 2.29 2.11 2.35 1.07 - 20 [ 1.07 .. 2.69]
2102-> VAL 83 HN - VAL 98 HG2* [ 1.80 4.37] 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.83 .. 0.83]
2103-> ASN 80 HD21 - VAL 98 HG2* [ 1.80 5.48] 2.28 2.97 1.76 1.91 1.84 1.35 1.97 1.91 1.87 2.45 2.18 2.11 1.93 1.81 1.97 2.33 2.11 2.13 1.67 1.62 - 20 [ 1.35 .. 2.97]
2106-> ASN 80 HB3 - VAL 98 HG2* [ 1.80 5.94] 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.16 .. 0.16]
2107-> GLU 85 HG* - VAL 98 HG2* [ 1.80 5.57] 0.00 0.83 0.11 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.12 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 - 5 [ 0.11 .. 1.29]
2108-> THR 82 HG2* - VAL 98 HG2* [ 1.80 3.23] 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.44 .. 0.44]
2109-> ALA 81 HN - VAL 98 HG1* [ 1.80 4.76] 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 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 [ 0.29 .. 0.29]
2111-> ASN 80 HA - VAL 98 HG1* [ 1.80 5.14] 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.28 .. 0.28]
2112-> THR 82 HA - VAL 98 HG1* [ 1.80 4.75] 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.65 .. 0.65]
2114-> ASN 80 HB3 - VAL 98 HG1* [ 1.80 4.61] 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.19 .. 0.19]
2115-> THR 82 HG2* - VAL 98 HG1* [ 1.80 3.53] 0.00 0.57 0.24 0.40 0.24 0.17 0.00 0.21 0.17 0.07 0.02 0.00 0.13 0.15 0.05 0.00 0.00 0.18 0.21 0.11 - 15 [ 0.02 .. 0.57]
2117-> LYS 63 HB2 - LEU 65 HG [ 1.80 5.58] 0.00 0.00 0.00 0.00 0.00 0.00 3.86 0.00 0.00 0.00 0.00 4.23 3.91 0.00 4.02 0.00 0.00 0.00 0.00 0.00 - 4 [ 3.86 .. 4.23]
2123-> GLU 74 HB2 - LEU 107 HD2* [ 1.80 3.97] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.65 .. 0.65]
2125-> TRP 53 HB3 - VAL 55 HG1* [ 1.80 4.19] 0.00 0.00 0.00 0.00 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.34 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.21 .. 0.34]
2126-> VAL 55 HG1* - LEU 65 HD1* [ 1.80 4.17] 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 1.89 1.63 0.00 1.56 0.00 0.00 0.00 0.00 0.00 - 4 [ 1.53 .. 1.89]
2127-> ILE 34 HG13 - PRO 59 HB3 [ 1.80 6.05] 1.75 2.20 1.92 1.50 1.89 0.20 0.16 0.00 1.92 2.02 1.00 2.07 0.00 0.29 0.00 0.13 2.16 0.19 2.17 1.23 - 17 [ 0.13 .. 2.20]
2128-> LYS 63 HG* - LEU 65 HD2* [ 1.80 5.36] 0.00 0.00 0.00 0.00 0.00 0.01 3.35 0.00 0.00 0.00 0.00 3.54 3.12 0.00 3.33 0.00 0.00 0.00 0.00 0.00 - 5 [ 0.01 .. 3.54]
2132-> ALA 22 HA - GLU 23 HG3 [ 1.80 5.14] 1.33 1.33 1.21 1.35 1.26 1.25 1.34 1.27 1.34 1.32 1.24 1.33 1.27 1.24 1.33 1.24 1.27 1.35 1.26 1.25 - 20 [ 1.21 .. 1.35]
2133-> GLU 23 HG3 - SER 68 HB2 [ 1.80 5.35] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.00 0.29 0.00 0.00 0.00 - 3 [ 0.00 .. 0.29]
2134-> GLU 61 HG3 - LYS 63 HG* [ 1.80 4.99] 0.00 1.71 1.88 0.00 1.96 1.66 1.49 1.92 0.00 1.72 0.00 0.00 0.00 1.62 1.52 1.42 2.01 1.40 2.09 4.94 - 14 [ 1.40 .. 4.94]
2135-> GLU 9 HB2 - HIS 27 HB2 [ 1.80 4.82] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.02 0.00 0.00 0.00 0.00 1.31 - 3 [ 0.01 .. 1.31]
2137-> PHE 3 HA - LEU 92 HG [ 1.80 5.61] 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.40 .. 1.64]
2140-> THR 7 HG2* - LEU 31 HD1* [ 1.80 3.13] 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.66 0.98 0.00 0.30 0.39 0.74 0.73 0.00 0.00 - 8 [ 0.04 .. 0.98]
2152-> VAL 41 HG1* - TRP 53 HE3 [ 1.80 4.08] 0.00 2.78 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 2.50 .. 2.78]
2153-> VAL 41 HG1* - TRP 53 HZ3 [ 1.80 4.70] 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 3.64 3.41 0.00 0.00 0.41 0.00 0.65 0.00 0.00 0.00 0.00 0.00 - 5 [ 0.41 .. 3.72]
2157-> VAL 28 HG1* - LEU 65 HD1* [ 1.80 4.27] 0.00 0.00 0.00 0.00 0.00 0.03 2.88 0.00 0.00 0.00 0.00 3.34 1.58 0.45 3.34 0.00 0.00 0.06 0.00 0.19 - 8 [ 0.03 .. 3.34]
2158-> VAL 28 HG2* - LEU 65 HD1* [ 1.80 4.49] 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 1.42 3.02 0.00 1.43 0.00 0.00 0.00 0.00 0.00 - 4 [ 1.12 .. 3.02]
2165-> GLU 25 HG3 - VAL 64 HG1* [ 1.80 5.10] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.01 0.00 - 2 [ 0.01 .. 0.82]
2180-> THR 82 HA - VAL 98 HB [ 1.80 6.05] 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 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 [ 0.64 .. 0.64]
2185-> LYS 20 HA - LYS 20 HD3 [ 1.80 4.02] 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.29 .. 0.36]
2187-> ILE 10 HA - LYS 11 HB3 [ 1.80 5.61] 0.12 0.12 0.11 0.12 0.15 0.15 0.12 0.14 0.12 0.11 0.11 0.11 0.12 0.12 0.13 0.14 0.13 0.16 0.13 0.11 - 20 [ 0.11 .. 0.16]
2190-> LYS 11 HB3 - GLU 25 HB2 [ 1.80 4.59] 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.00 - 3 [ 0.63 .. 1.70]
2193-> LEU 57 HD2* - LYS 63 HE3 [ 1.80 5.47] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 - 1 [ 0.50 .. 0.50]
2194-> LYS 63 HE3 - LEU 65 HD2* [ 1.80 5.67] 0.12 0.44 1.23 1.22 0.57 1.39 5.39 0.46 1.10 0.41 0.10 5.69 5.07 2.03 5.35 1.20 0.05 1.10 0.20 0.00 - 19 [ 0.05 .. 5.69]
2195-> GLU 9 HB3 - HIS 27 HN [ 1.80 5.04] 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.39 0.00 0.00 0.00 0.37 0.00 0.38 0.00 0.00 0.39 - 5 [ 0.36 .. 0.39]
2197-> GLU 9 HB3 - HIS 27 HD2 [ 1.80 5.33] 0.00 0.43 0.00 0.46 0.00 1.95 0.94 0.00 1.42 1.14 1.01 0.65 0.51 0.12 1.19 0.53 1.00 0.00 0.00 2.59 - 14 [ 0.12 .. 2.59]
2198-> GLU 9 HB3 - HIS 27 HB2 [ 1.80 4.87] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 - 1 [ 1.49 .. 1.49]
2199-> GLU 25 HB3 - HIS 27 HD2 [ 1.80 4.99] 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 - 2 [ 0.87 .. 2.22]
2200-> GLU 25 HB3 - VAL 64 HG1* [ 1.80 4.50] 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 0.11 0.00 0.00 0.00 - 2 [ 0.11 .. 0.11]
2202-> VAL 26 HN - VAL 64 HG1* [ 1.80 4.21] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.00 .. 0.78]
2207-> MET 76 HE* - ASP 102 HB2 [ 1.80 4.64] 0.00 0.27 0.00 0.34 0.35 0.00 0.26 0.17 0.36 0.31 0.19 0.31 0.29 0.23 0.31 0.25 0.27 0.00 0.21 0.00 - 15 [ 0.17 .. 0.36]
2211-> VAL 16 HG2* - GLY 17 HA2 [ 1.80 4.51] 1.19 1.17 1.19 1.18 1.16 1.17 0.00 1.17 1.18 1.16 1.16 1.15 1.17 1.18 0.00 1.18 1.17 1.17 1.18 1.19 - 18 [ 1.15 .. 1.19]
2221-> VAL 8 HG1* - THR 82 HA [ 1.80 4.76] 0.26 0.18 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.28 0.00 0.00 0.00 0.00 - 4 [ 0.18 .. 0.39]
2222-> VAL 8 HG2* - THR 82 HA [ 1.80 4.92] 0.00 0.00 0.00 0.23 0.00 0.00 0.00 0.02 0.25 0.00 0.32 0.00 0.22 0.00 0.01 0.00 0.24 0.00 0.31 0.00 - 8 [ 0.01 .. 0.32]
2225-> GLU 74 HG2 - LEU 107 HD1* [ 1.80 4.44] 0.25 0.30 0.30 0.30 0.38 0.26 0.30 0.34 0.30 0.56 0.60 0.00 0.26 0.31 0.32 0.29 0.32 0.31 0.36 0.30 - 19 [ 0.25 .. 0.60]
2226-> GLU 74 HG3 - LEU 107 HD1* [ 1.80 4.44] 0.09 0.05 0.12 0.08 0.27 0.05 0.04 0.06 0.09 0.00 0.42 0.00 0.07 0.07 0.09 0.08 0.09 0.13 0.12 0.09 - 18 [ 0.04 .. 0.42]
2227-> GLU 74 HG2 - LEU 107 HD2* [ 1.80 4.21] 1.19 1.02 1.18 1.03 0.95 1.18 1.08 1.08 1.06 1.10 0.94 0.00 1.14 1.08 0.99 1.06 1.08 1.01 1.08 1.20 - 19 [ 0.94 .. 1.20]
2228-> GLU 74 HG3 - LEU 107 HD2* [ 1.80 4.21] 0.38 0.13 0.37 0.17 0.26 0.32 0.17 0.18 0.20 0.06 0.28 0.80 0.31 0.20 0.12 0.20 0.21 0.20 0.21 0.35 - 20 [ 0.06 .. 0.80]
2229-> LYS 29 HD2 - LEU 31 HD2* [ 1.80 3.26] 0.46 0.45 0.00 0.33 0.00 0.52 0.00 0.00 1.40 0.00 1.31 0.57 0.45 0.64 0.37 0.00 1.32 0.56 0.00 0.53 - 13 [ 0.33 .. 1.40]
2230-> VAL 16 HG2* - PRO 71 HG2 [ 1.80 3.64] 1.18 0.20 1.21 0.24 1.22 1.04 0.00 2.20 0.29 2.23 2.19 1.71 1.20 1.58 0.00 1.61 1.59 1.66 1.56 1.23 - 18 [ 0.20 .. 2.23]
2231-> LYS 29 HD2 - LEU 31 HD1* [ 1.80 3.79] 1.15 1.17 0.00 1.36 0.00 1.00 0.00 0.00 0.70 0.00 1.03 0.92 0.71 1.31 1.04 0.00 0.73 0.86 0.00 1.11 - 13 [ 0.70 .. 1.36]
2232-> LYS 29 HD3 - LEU 31 HD1* [ 1.80 4.07] 0.00 0.00 0.00 0.00 0.45 0.00 0.11 0.19 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.29 0.00 - 5 [ 0.11 .. 0.45]
2233-> LYS 29 HD3 - LEU 31 HD2* [ 1.80 3.60] 0.00 0.00 0.36 0.00 0.42 0.00 0.71 0.42 0.50 0.38 0.26 0.00 0.00 0.00 0.00 0.24 0.51 0.00 0.44 0.00 - 10 [ 0.24 .. 0.71]
2235-> VAL 43 HB - LYS 51 HB2 [ 1.80 4.98] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.37 .. 0.37]
2239-> LEU 6 HD2* - LEU 57 HB3 [ 1.80 3.54] 0.00 0.00 0.08 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.11 0.00 0.00 0.00 0.01 - 5 [ 0.01 .. 0.11]
2241-> VAL 28 HG2* - LEU 65 HD2* [ 1.80 4.27] 0.60 0.00 0.25 0.22 0.00 0.64 0.07 0.41 0.91 0.00 1.17 0.53 2.09 0.44 0.46 0.00 1.17 0.68 1.08 0.65 - 16 [ 0.07 .. 2.09]
2244-> VAL 8 HG1* - VAL 83 HB [ 1.80 3.37] 1.70 2.48 0.70 0.15 0.42 0.00 0.37 0.30 0.31 1.74 0.26 1.73 0.07 0.20 0.29 2.30 0.29 1.29 0.17 0.10 - 19 [ 0.07 .. 2.48]
2247-> PRO 4 HG3 - VAL 89 HG2* [ 1.80 3.89] 0.29 0.25 0.41 0.00 0.41 0.00 0.00 0.62 0.42 0.37 0.00 0.24 1.63 0.00 1.63 0.00 0.25 0.22 0.45 0.41 - 14 [ 0.22 .. 1.63]
2248-> PRO 4 HG2 - VAL 89 HG2* [ 1.80 4.17] 0.57 0.77 0.60 0.00 0.57 0.00 0.00 0.63 0.62 0.68 0.00 0.69 0.05 0.00 0.05 0.00 0.49 0.65 0.67 0.57 - 14 [ 0.05 .. 0.77]
2250-> GLU 9 HB3 - HIS 27 HB3 [ 1.80 4.87] 0.00 0.00 0.00 0.00 0.00 1.09 1.12 0.00 1.12 0.68 1.06 0.88 0.00 0.00 1.18 0.48 1.01 0.00 1.24 0.00 - 10 [ 0.48 .. 1.24]
2251-> GLU 9 HB3 - ALA 99 HB* [ 1.80 5.37] 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.13 .. 0.13]
2257-> PRO 4 HD2 - GLU 91 HA [ 1.80 4.42] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.32 .. 0.32]
2260-> ASN 19 HB3 - THR 72 HG2* [ 1.80 5.16] 0.00 1.38 0.00 1.32 0.00 0.00 0.91 2.75 1.80 3.35 2.36 0.91 0.00 0.21 1.36 0.52 0.68 1.67 0.44 0.00 - 14 [ 0.21 .. 3.35]
2266-> VAL 8 HB - VAL 26 HG1* [ 1.80 4.43] 0.09 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.17 0.00 0.18 0.00 0.00 0.00 0.02 0.00 0.38 0.00 0.00 - 6 [ 0.02 .. 0.38]
2267-> LYS 29 HB3 - GLU 62 HG3 [ 1.80 5.20] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 1.52 - 2 [ 1.48 .. 1.52]
2269-> ASP 5 HB3 - LEU 92 HD1* [ 1.80 4.71] 0.00 2.02 0.00 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.04 .. 2.02]
2273-> THR 7 HG2* - LYS 29 HD3 [ 1.80 4.40] 1.31 1.22 0.00 0.00 0.00 1.22 1.54 0.00 0.00 0.71 1.16 1.07 1.67 1.26 1.39 0.59 1.22 1.10 0.00 1.41 - 14 [ 0.59 .. 1.67]
2294-> VAL 16 HG1* - TYR 24 HE* [ 1.80 4.03] 0.03 0.11 0.00 0.00 0.00 0.00 0.00 0.12 0.00 0.28 0.10 0.00 0.00 0.06 0.00 0.01 0.06 0.24 0.12 0.00 - 10 [ 0.01 .. 0.28]
2297-> PRO 13 HG2 - TYR 24 HE* [ 1.80 4.18] 0.02 0.00 0.00 0.23 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.02 0.00 - 5 [ 0.02 .. 0.23]
2304-> PRO 13 HG3 - TYR 24 HE* [ 1.80 4.63] 0.64 0.00 0.00 0.75 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.63 0.00 - 5 [ 0.61 .. 0.75]
2316-> GLU 74 HA - TYR 77 HD* [ 1.80 5.28] 0.28 0.15 0.37 0.13 0.27 0.41 0.17 0.39 0.17 0.52 0.37 0.00 0.27 0.18 0.01 0.20 0.22 0.22 0.21 0.28 - 19 [ 0.01 .. 0.52]
2326-> ILE 45 HG2* - TYR 77 HE* [ 1.80 4.29] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 - 2 [ 0.00 .. 0.60]
2328-> PRO 71 HB2 - TYR 77 HE* [ 1.80 4.88] 0.00 0.33 0.00 0.46 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.33 .. 0.85]
2329-> GLU 74 HB2 - TYR 77 HE* [ 1.80 6.05] 0.06 0.00 0.11 0.00 0.04 0.09 0.00 0.22 0.00 0.29 0.18 0.00 0.02 0.00 0.00 0.00 0.00 0.03 0.00 0.05 - 10 [ 0.02 .. 0.29]
2330-> HIS 27 HN - HIS 27 HD2 [ 1.80 4.53] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 - 1 [ 0.70 .. 0.70]
2331-> HIS 27 HD2 - VAL 64 HG1* [ 1.80 4.73] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.12 0.00 0.00 0.00 1.05 0.00 0.12 0.00 0.00 0.00 - 3 [ 0.12 .. 1.05]
2332-> LYS 11 HB2 - HIS 27 HD2 [ 1.80 3.84] 0.54 0.70 0.00 0.55 0.00 0.23 0.33 0.22 0.76 0.57 0.00 0.26 0.06 0.36 0.00 0.00 0.00 0.00 0.00 5.03 - 12 [ 0.06 .. 5.03]
2333-> GLU 25 HB2 - HIS 27 HD2 [ 1.80 4.40] 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 3.94 - 4 [ 0.38 .. 3.94]
2334-> HIS 27 HA - HIS 27 HD2 [ 1.80 4.26] 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.08 0.00 0.00 0.00 0.03 0.00 0.10 0.00 0.03 0.00 - 5 [ 0.03 .. 0.10]
2335-> HIS 27 HE1 - VAL 64 HG2* [ 1.80 4.52] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.30 - 1 [ 0.30 .. 0.30]
2336-> TYR 44 HD* - ILE 45 HN [ 1.80 4.28] 0.00 0.00 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.18 0.00 0.00 - 2 [ 0.17 .. 0.18]
2345-> TYR 44 HD* - ASN 80 HB3 [ 1.80 4.77] 0.15 0.00 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.00 0.00 - 3 [ 0.15 .. 0.39]
2346-> VAL 43 HB - TYR 50 HD* [ 1.80 3.86] 0.55 0.42 0.37 0.57 0.53 0.53 0.21 0.36 0.52 0.44 0.73 0.41 0.74 0.00 0.72 0.60 0.55 0.34 0.59 0.41 - 19 [ 0.21 .. 0.74]
2347-> TYR 44 HD* - THR 82 HG2* [ 1.80 4.22] 0.63 0.00 0.77 0.99 0.57 0.48 0.00 0.72 0.67 0.62 0.95 0.00 0.75 0.80 0.59 0.00 1.02 0.83 0.84 0.72 - 16 [ 0.48 .. 1.02]
2351-> VAL 43 HG1* - TYR 50 HD* [ 1.80 3.44] 0.40 0.17 0.34 0.40 0.40 0.37 0.00 0.19 0.16 0.18 0.55 0.24 0.51 0.00 0.57 0.48 0.26 0.33 0.37 0.17 - 18 [ 0.16 .. 0.57]
2357-> TYR 44 HE* - THR 82 HG2* [ 1.80 3.88] 0.33 0.00 0.31 0.44 0.49 0.00 0.00 0.37 0.18 0.31 0.65 0.00 0.21 0.09 0.20 0.00 0.73 0.75 0.13 0.34 - 16 [ 0.00 .. 0.75]
2359-> TYR 44 HE* - GLU 85 HG* [ 1.80 4.21] 0.33 0.00 0.67 0.10 0.16 0.39 0.00 0.32 0.35 0.24 0.24 0.43 0.26 0.77 0.61 0.08 0.09 0.20 0.40 0.25 - 18 [ 0.08 .. 0.77]
2364-> VAL 43 HG1* - TYR 50 HE* [ 1.80 4.63] 0.87 0.66 0.77 0.87 0.87 0.82 0.47 0.67 0.68 0.65 1.05 0.71 1.00 0.00 1.05 0.94 0.76 0.79 0.85 0.65 - 19 [ 0.47 .. 1.05]
2365-> VAL 43 HG2* - TYR 50 HE* [ 1.80 5.15] 1.49 1.30 1.33 1.51 1.28 1.46 1.04 1.25 1.38 1.21 1.68 1.29 1.74 0.00 1.69 1.64 1.48 1.26 1.61 1.30 - 19 [ 1.04 .. 1.74]
2367-> TYR 50 HE* - LYS 51 HG2 [ 1.80 5.74] 0.00 0.00 0.00 0.00 0.00 0.92 0.81 0.48 0.00 0.00 0.00 0.00 1.16 0.00 1.14 0.71 0.72 0.73 0.00 0.72 - 9 [ 0.48 .. 1.16]
2368-> VAL 43 HB - TYR 50 HE* [ 1.80 5.10] 1.47 1.29 1.27 1.49 1.51 1.47 1.12 1.24 1.43 1.25 1.61 1.34 1.67 0.00 1.67 1.50 1.43 1.29 1.46 1.32 - 19 [ 1.12 .. 1.67]
2369-> TYR 50 HE* - LYS 51 HD* [ 1.80 5.27] 0.00 0.00 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.06 .. 0.32]
2372-> TYR 50 HE* - TRP 69 HB3 [ 1.80 4.92] 0.00 0.00 0.00 0.00 0.20 0.13 0.00 0.00 0.00 0.00 0.00 0.01 0.04 0.08 0.04 0.00 0.00 0.03 0.00 0.00 - 7 [ 0.01 .. 0.20]
2384-> TRP 69 HZ2 - PRO 71 HB2 [ 1.80 4.60] 0.00 0.30 0.00 0.31 0.00 0.00 0.00 0.00 0.33 0.04 0.00 0.00 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 - 5 [ 0.04 .. 0.42]
2399-> TRP 53 HZ2 - PHE 67 HA [ 1.80 4.63] 0.00 0.00 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 6.51 7.24 0.00 7.50 0.00 0.00 0.00 0.00 0.00 - 4 [ 6.51 .. 7.50]
2400-> TRP 53 HZ2 - PHE 67 HB3 [ 1.80 4.07] 0.00 0.00 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 6.01 7.26 0.00 7.52 0.00 0.00 0.00 0.00 0.00 - 4 [ 6.01 .. 7.52]
2401-> LYS 51 HE3 - TRP 53 HZ2 [ 1.80 5.26] 0.00 0.00 0.00 0.00 0.00 0.00 4.92 0.00 0.00 0.00 0.00 4.53 4.53 0.00 4.77 0.00 0.00 0.00 0.00 0.00 - 4 [ 4.53 .. 4.92]
2402-> LYS 51 HD* - TRP 53 HZ2 [ 1.80 4.59] 0.00 0.00 0.04 0.00 0.13 0.00 4.74 0.00 0.00 0.00 0.00 6.06 4.88 0.00 5.01 0.00 0.00 0.00 0.00 0.00 - 6 [ 0.04 .. 6.06]
2403-> LYS 51 HB3 - TRP 53 HZ2 [ 1.80 4.61] 0.00 0.00 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.17 0.00 6.60 7.13 0.00 7.24 0.00 0.00 0.00 0.00 0.00 - 5 [ 0.17 .. 7.24]
2404-> LYS 51 HG2 - TRP 53 HZ2 [ 1.80 4.75] 0.00 0.00 0.00 0.00 0.00 0.00 5.01 0.00 0.00 0.00 0.00 5.35 5.08 0.00 5.20 0.00 0.00 0.00 0.00 0.00 - 4 [ 5.01 .. 5.35]
2405-> LYS 51 HB2 - TRP 53 HZ2 [ 1.80 5.86] 0.00 0.00 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 6.54 6.83 0.00 6.97 0.00 0.00 0.00 0.00 0.00 - 4 [ 6.54 .. 6.97]
2406-> LYS 51 HG3 - TRP 53 HZ2 [ 1.80 6.05] 0.00 0.00 0.00 0.00 0.00 0.00 5.07 0.00 0.00 0.00 0.00 3.73 4.90 0.00 5.05 0.00 0.00 0.00 0.00 0.00 - 4 [ 3.73 .. 5.07]
2407-> TRP 53 HH2 - PHE 67 HD* [ 1.80 3.96] 0.00 1.34 0.00 0.00 0.00 0.00 5.64 0.00 1.99 1.04 0.00 5.25 6.50 0.00 6.67 0.00 0.00 0.00 0.00 0.00 - 7 [ 1.04 .. 6.67]
2408-> TRP 53 HH2 - PHE 67 HB2 [ 1.80 4.53] 0.00 0.91 0.00 0.00 0.00 0.00 8.31 0.05 1.44 0.86 0.00 7.83 8.55 0.00 8.77 0.00 0.00 0.06 0.00 0.00 - 9 [ 0.05 .. 8.77]
2409-> TRP 53 HH2 - PHE 67 HB3 [ 1.80 4.47] 0.00 0.00 0.00 0.00 0.00 0.00 6.60 0.00 0.29 0.00 0.00 6.12 6.88 0.00 7.09 0.00 0.00 0.00 0.00 0.00 - 5 [ 0.29 .. 7.09]
2410-> VAL 43 HB - TRP 53 HH2 [ 1.80 4.85] 0.00 3.95 0.00 0.00 0.00 0.00 6.87 0.00 4.11 4.31 0.00 6.79 7.59 0.00 7.87 0.00 0.00 0.00 0.00 0.00 - 7 [ 3.95 .. 7.87]
2411-> LYS 51 HD* - TRP 53 HH2 [ 1.80 5.14] 0.35 0.29 0.00 0.00 0.00 0.00 4.74 0.00 0.12 0.37 0.09 6.46 4.68 0.00 4.77 0.00 0.00 0.00 0.00 0.00 - 9 [ 0.09 .. 6.46]
2412-> VAL 26 HG2* - TRP 53 HH2 [ 1.80 4.93] 0.00 2.63 0.00 0.00 0.00 0.00 2.59 0.00 2.78 2.59 0.00 2.73 3.76 0.00 4.13 0.00 0.00 0.00 0.00 0.00 - 7 [ 2.59 .. 4.13]
2413-> VAL 43 HG2* - TRP 53 HH2 [ 1.80 3.94] 0.00 2.99 0.00 0.00 0.00 0.00 4.15 0.00 3.20 3.21 0.00 4.18 5.05 0.00 5.29 0.00 0.00 0.00 0.00 0.00 - 7 [ 2.99 .. 5.29]
2414-> LYS 51 HG2 - TRP 53 HH2 [ 1.80 4.58] 0.00 0.04 0.00 0.00 0.00 0.00 5.88 0.00 0.00 0.29 0.00 6.36 5.83 0.00 5.92 0.00 0.00 0.00 0.00 0.00 - 6 [ 0.04 .. 6.36]
2415-> VAL 43 HG1* - TRP 53 HH2 [ 1.80 5.09] 0.00 3.18 0.00 0.00 0.00 0.00 5.38 0.00 3.41 3.38 0.00 5.42 6.20 0.00 6.48 0.00 0.00 0.00 0.00 0.00 - 7 [ 3.18 .. 6.48]
2418-> TRP 69 HD1 - PRO 71 HA [ 1.80 5.57] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.27 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.16 .. 0.27]
2422-> TRP 53 HD1 - VAL 55 HG1* [ 1.80 4.89] 0.00 0.88 0.00 0.00 0.00 0.00 0.30 0.00 0.75 0.92 0.18 0.99 1.28 0.00 0.88 0.00 0.00 0.00 0.00 0.00 - 8 [ 0.18 .. 1.28]
2423-> TRP 53 HD1 - LEU 65 HD2* [ 1.80 3.97] 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.09 0.08 0.00 0.60 0.89 0.00 0.94 0.00 0.00 0.00 0.00 0.00 - 7 [ 0.00 .. 0.94]
2424-> TRP 53 HD1 - LEU 65 HD1* [ 1.80 4.32] 0.19 0.00 0.30 0.13 0.30 0.00 0.00 0.07 0.00 0.00 0.38 0.00 0.00 0.06 0.00 0.18 0.27 0.01 0.38 0.00 - 12 [ 0.00 .. 0.38]
2447-> TRP 53 HZ2 - PHE 67 HD* [ 1.80 4.48] 0.00 0.00 0.00 0.00 0.00 0.00 5.23 0.00 0.00 0.00 0.00 4.78 6.43 0.00 6.62 0.00 0.00 0.00 0.00 0.00 - 4 [ 4.78 .. 6.62]
2451-> TYR 44 HD* - LEU 49 HG [ 1.80 5.27] 0.22 0.10 0.22 0.13 0.24 0.12 0.10 0.16 0.10 0.14 0.21 0.13 0.12 0.00 0.08 0.12 0.20 0.33 0.07 0.20 - 19 [ 0.07 .. 0.33]
2454-> TYR 44 HE* - THR 82 HG1 [ 1.80 3.61] 0.75 0.00 0.57 0.18 0.82 0.14 0.00 0.60 0.25 0.73 0.83 0.00 0.15 0.00 0.43 0.00 0.95 1.29 0.02 0.54 - 15 [ 0.02 .. 1.29]
2460-> GLU 2 HB* - ILE 34 HB [ 1.80 4.39] 1.38 1.47 1.20 1.02 1.36 0.00 0.00 1.24 0.58 1.18 0.00 0.51 1.28 0.00 1.25 0.00 1.31 0.00 0.59 0.51 - 14 [ 0.51 .. 1.47]
2461-> GLU 2 HB* - ILE 34 HG2* [ 1.80 4.03] 0.89 0.98 0.90 0.00 0.94 0.00 0.00 1.32 0.38 0.80 0.00 0.32 1.39 0.00 1.38 0.00 0.81 0.00 0.29 0.45 - 14 [ 0.00 .. 1.39]
2465-> PHE 3 HB3 - VAL 89 HG* [ 1.80 5.13] 0.00 0.00 0.00 0.00 0.00 0.20 0.37 0.00 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.14 0.00 0.00 0.00 0.00 - 4 [ 0.04 .. 0.37]
2472-> PRO 4 HB* - ILE 34 HG2* [ 1.80 3.69] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.31 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.31 .. 0.36]
2475-> PRO 4 HG3 - VAL 89 HG* [ 1.80 3.34] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.00 0.30 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.30 .. 0.39]
2478-> ASP 5 HA - GLU 91 HG* [ 1.80 4.65] 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.09 .. 0.12]
2481-> LEU 6 HD1* - ASN 97 HD2* [ 1.80 4.73] 0.00 0.61 0.00 0.00 0.39 0.18 0.13 0.00 0.32 0.00 0.00 0.00 0.35 0.00 0.00 0.07 0.00 0.24 0.60 0.11 - 10 [ 0.07 .. 0.61]
2482-> THR 7 HA - ASN 97 HD2* [ 1.80 5.87] 0.85 1.80 0.00 0.00 0.66 0.29 0.25 0.17 0.96 1.33 0.00 1.07 1.28 0.00 0.00 1.34 0.00 1.62 0.97 0.12 - 14 [ 0.12 .. 1.80]
2483-> THR 7 HG2* - LYS 29 HE* [ 1.80 5.87] 0.96 0.53 0.00 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.87 1.33 0.52 1.08 0.00 0.00 0.91 0.00 0.64 - 9 [ 0.52 .. 1.33]
2486-> GLU 9 HB2 - HIS 27 HB* [ 1.80 4.15] 0.00 0.00 0.00 0.19 0.00 0.40 0.00 0.00 0.00 0.00 0.47 0.00 0.53 0.07 0.56 0.00 0.41 0.00 0.00 0.32 - 8 [ 0.07 .. 0.56]
2487-> GLU 9 HB3 - HIS 27 HB* [ 1.80 4.18] 0.00 0.00 0.00 0.00 0.00 0.23 0.04 0.00 0.06 0.00 0.32 0.00 0.00 0.00 0.42 0.00 0.30 0.00 0.20 0.33 - 8 [ 0.04 .. 0.42]
2493-> LYS 11 HG* - GLU 25 HB2 [ 1.80 5.29] 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.00 - 3 [ 0.59 .. 0.73]
2497-> PRO 13 HB* - VAL 16 HG1* [ 1.80 3.83] 0.23 0.46 0.86 0.13 1.13 0.44 0.00 1.03 0.55 0.58 0.71 1.00 1.18 0.32 0.93 0.95 0.93 0.64 0.25 0.88 - 19 [ 0.13 .. 1.18]
2502-> ASP 14 HB* - PHE 101 HZ [ 1.80 4.39] 0.13 0.00 0.09 0.00 0.00 0.00 0.04 0.00 0.12 0.00 0.00 0.28 0.00 0.06 0.28 0.14 0.00 0.00 0.18 0.06 - 10 [ 0.04 .. 0.28]
2509-> GLY 17 HA2 - GLU 108 HG* [ 1.80 5.13] 1.78 1.75 1.43 1.70 0.60 1.82 1.79 1.94 1.80 1.55 0.56 1.81 1.80 1.73 1.21 1.73 1.74 0.00 1.44 1.93 - 19 [ 0.56 .. 1.94]
2510-> VAL 18 HB - GLU 74 HG* [ 1.80 5.19] 0.66 0.51 0.63 0.60 0.53 0.50 0.58 0.31 0.58 0.60 0.48 0.84 0.59 0.56 0.72 0.53 0.63 0.76 0.57 0.65 - 20 [ 0.31 .. 0.84]
2511-> VAL 18 HG1* - GLU 74 HG* [ 1.80 5.32] 0.35 0.22 0.31 0.33 0.27 0.20 0.34 0.00 0.18 0.10 0.08 0.09 0.29 0.28 0.56 0.23 0.37 0.43 0.26 0.35 - 19 [ 0.08 .. 0.56]
2515-> LEU 21 HG - SER 68 HB* [ 1.80 4.04] 0.00 2.35 0.00 2.19 0.00 0.21 2.23 0.00 2.33 2.11 0.00 2.02 0.42 0.00 0.90 0.00 2.14 2.18 0.00 0.00 - 11 [ 0.21 .. 2.35]
2516-> LEU 21 HD1* - SER 68 HB* [ 1.80 3.30] 0.00 1.47 0.00 1.40 1.71 2.09 1.28 0.00 1.35 1.06 0.00 1.15 2.26 0.00 0.60 0.00 1.55 1.22 0.00 0.00 - 12 [ 0.60 .. 2.26]
2517-> LEU 21 HD1* - TRP 69 HB* [ 1.80 5.87] 0.00 2.08 0.00 1.96 0.60 0.60 1.97 0.00 1.95 1.85 0.00 1.96 0.76 0.00 1.79 0.00 2.02 1.96 0.00 0.00 - 12 [ 0.60 .. 2.08]
2519-> ALA 22 HN - SER 68 HB* [ 1.80 4.91] 0.00 0.13 0.00 0.18 0.00 0.03 0.07 0.00 0.15 0.18 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.15 0.00 0.00 - 8 [ 0.03 .. 0.18]
2522-> GLU 23 HG2 - SER 68 HB* [ 1.80 4.49] 1.19 0.59 1.39 0.72 0.99 0.85 0.58 1.33 0.54 0.88 1.44 0.74 0.71 1.10 1.55 1.23 1.74 0.50 1.33 1.22 - 20 [ 0.50 .. 1.74]
2523-> GLU 23 HG3 - SER 68 HB* [ 1.80 4.70] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.15 0.00 0.00 0.00 - 1 [ 0.15 .. 0.15]
2526-> GLU 25 HN - GLU 25 HG* [ 1.80 3.98] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.13 0.00 0.00 0.00 - 2 [ 0.13 .. 0.13]
2533-> HIS 27 HB* - VAL 28 HG1* [ 1.80 5.26] 0.32 0.30 0.00 0.35 0.26 0.30 0.33 0.33 0.00 0.31 0.00 0.29 0.00 0.31 0.28 0.34 0.00 0.27 0.00 0.74 - 14 [ 0.26 .. 0.74]
2536-> LYS 29 HE* - LEU 31 HD2* [ 1.80 3.70] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.29 0.00 0.00 0.00 0.00 - 1 [ 0.29 .. 0.29]
2537-> LYS 29 HE* - GLU 62 HG3 [ 1.80 4.73] 0.15 0.02 0.25 0.00 0.07 0.01 0.13 0.01 0.00 0.14 0.00 0.03 0.00 0.14 0.12 0.00 0.00 0.09 0.17 0.06 - 14 [ 0.01 .. 0.25]
2547-> ASN 30 HD2* - PRO 59 HA [ 1.80 4.26] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.12 0.00 0.00 0.00 - 1 [ 0.12 .. 0.12]
2549-> ASN 30 HD2* - GLU 61 HN [ 1.80 4.96] 0.00 0.00 0.00 0.00 0.29 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.18 0.33 0.00 0.00 0.00 - 4 [ 0.18 .. 0.33]
2551-> LEU 31 HD1* - ASN 96 HB* [ 1.80 5.87] 0.00 0.00 0.24 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.39 0.00 - 4 [ 0.01 .. 0.39]
2552-> LEU 31 HD1* - ASN 96 HD2* [ 1.80 4.10] 0.59 1.77 0.00 0.00 0.00 0.48 1.05 0.57 0.45 0.53 0.14 0.71 0.95 1.01 0.14 0.40 0.93 0.65 1.91 0.91 - 17 [ 0.14 .. 1.91]
2556-> GLY 32 HA* - ILE 34 HG2* [ 1.80 5.27] 0.27 0.29 0.30 0.04 0.30 0.00 0.00 0.44 0.32 0.30 0.00 0.20 0.29 0.00 0.26 0.00 0.34 0.00 0.27 0.22 - 14 [ 0.04 .. 0.44]
2557-> GLY 32 HA* - LEU 92 HD1* [ 1.80 4.77] 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.23 .. 0.23]
2564-> ILE 34 HN - LYS 60 HG* [ 1.80 5.05] 0.96 1.40 1.30 0.76 1.04 0.40 0.68 1.22 1.17 1.16 0.86 1.14 0.84 0.43 0.69 0.37 1.41 0.53 1.21 1.00 - 20 [ 0.37 .. 1.41]
2580-> LYS 40 HD* - ASN 52 HB* [ 1.80 5.87] 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.00 .. 0.24]
2581-> LYS 40 HD* - THR 54 HA [ 1.80 5.08] 0.58 0.56 0.32 0.06 0.56 0.00 0.79 0.43 0.00 0.57 0.00 0.51 0.00 0.00 0.00 0.00 0.37 0.00 0.49 0.48 - 12 [ 0.06 .. 0.79]
2608-> ASN 46 HD2* - TYR 77 HA [ 1.80 3.93] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 - 1 [ 1.29 .. 1.29]
2611-> ASN 46 HD2* - ARG 78 HN [ 1.80 4.81] 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 0.75 0.00 0.00 - 1 [ 0.75 .. 0.75]
2618-> TYR 50 HE* - LYS 51 HE* [ 1.80 5.21] 1.13 1.05 1.18 1.23 1.59 0.90 0.91 0.48 1.33 0.66 1.02 1.48 1.22 0.00 1.16 0.75 0.72 0.69 1.04 0.69 - 19 [ 0.48 .. 1.59]
2620-> LYS 51 HA - ASN 52 HD2* [ 1.80 4.93] 0.00 0.00 0.52 0.00 0.00 0.56 0.60 0.47 0.00 0.00 0.00 0.63 0.00 0.00 0.52 0.00 0.46 0.45 0.00 0.48 - 9 [ 0.45 .. 0.63]
2624-> LYS 51 HE* - TRP 53 HE1 [ 1.80 4.84] 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 2.37 1.75 0.00 1.97 0.00 0.00 0.00 0.00 0.00 - 4 [ 1.68 .. 2.37]
2625-> LYS 51 HE* - TRP 53 HZ2 [ 1.80 4.39] 0.00 0.00 0.00 0.00 0.00 0.00 3.76 0.00 0.00 0.00 0.00 4.83 3.55 0.00 3.74 0.00 0.00 0.00 0.00 0.00 - 4 [ 3.55 .. 4.83]
2628-> VAL 55 HB - LYS 63 HE* [ 1.80 4.87] 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 1.44 1.32 0.32 1.39 0.00 0.00 0.00 0.00 0.00 - 5 [ 0.32 .. 1.44]
2630-> VAL 55 HG1* - LYS 63 HE* [ 1.80 4.82] 0.00 0.00 0.00 0.35 0.00 0.32 0.70 0.00 0.00 0.00 0.00 1.09 1.08 0.67 0.94 0.18 0.00 0.03 0.00 0.00 - 9 [ 0.03 .. 1.09]
2632-> VAL 55 HG2* - LYS 63 HE* [ 1.80 5.13] 0.00 0.00 0.00 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.17 .. 0.68]
2637-> LEU 57 HD2* - GLU 61 HG* [ 1.80 3.70] 0.00 0.91 1.01 0.00 0.96 0.81 1.26 1.12 0.00 0.95 0.00 0.00 0.00 1.10 1.13 0.98 1.07 1.32 1.01 0.99 - 14 [ 0.81 .. 1.32]
2639-> LEU 57 HD2* - LYS 63 HE* [ 1.80 4.51] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 - 1 [ 0.57 .. 0.57]
2649-> GLU 61 HG* - GLU 62 HN [ 1.80 3.61] 0.00 0.34 0.29 0.00 0.27 0.38 0.36 0.26 0.00 0.33 0.00 0.00 0.00 0.30 0.37 0.37 0.34 0.40 0.30 0.31 - 14 [ 0.26 .. 0.40]
2650-> GLU 61 HG* - LYS 63 HG* [ 1.80 4.29] 0.00 1.56 1.53 0.00 1.77 1.36 1.17 1.68 0.00 1.58 0.00 0.00 0.00 1.44 1.20 1.16 1.81 1.14 1.88 4.36 - 14 [ 1.14 .. 4.36]
2652-> LYS 63 HA - LYS 63 HE* [ 1.80 4.30] 0.00 0.00 0.24 0.23 0.00 0.25 0.27 0.00 0.12 0.00 0.00 0.24 0.23 0.00 0.29 0.20 0.00 0.17 0.00 0.00 - 10 [ 0.12 .. 0.29]
2654-> LYS 63 HB3 - LYS 63 HD* [ 1.80 3.04] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 - 1 [ 0.26 .. 0.26]
2655-> LYS 63 HB3 - LYS 63 HE* [ 1.80 3.88] 0.06 0.05 0.03 0.05 0.05 0.08 0.10 0.06 0.00 0.05 0.04 0.06 0.05 0.28 0.09 0.03 0.05 0.00 0.04 0.38 - 18 [ 0.03 .. 0.38]
2657-> LYS 63 HD* - LEU 65 HD2* [ 1.80 5.71] 0.00 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 2.51 1.90 0.00 2.20 0.00 0.00 0.00 0.00 0.00 - 4 [ 1.90 .. 2.51]
2659-> LYS 63 HE* - LEU 65 HD2* [ 1.80 4.81] 0.65 0.89 1.13 1.05 1.02 1.20 4.98 0.94 0.92 0.87 0.62 5.15 4.54 1.89 4.89 1.11 0.57 0.89 0.70 0.00 - 19 [ 0.57 .. 5.15]
2669-> GLN 73 HG* - GLU 74 HN [ 1.80 4.09] 0.00 0.40 0.00 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.03 0.00 0.00 0.00 0.46 0.06 0.00 0.05 0.00 - 6 [ 0.03 .. 0.46]
2671-> GLU 74 HN - GLU 74 HG* [ 1.80 3.69] 0.29 0.29 0.29 0.28 0.29 0.30 0.30 0.28 0.28 0.29 0.29 0.00 0.29 0.28 0.29 0.30 0.29 0.30 0.29 0.29 - 19 [ 0.28 .. 0.30]
2681-> GLU 74 HG* - LEU 107 HD1* [ 1.80 3.87] 0.23 0.23 0.27 0.25 0.37 0.22 0.22 0.25 0.25 0.26 0.54 0.00 0.23 0.25 0.26 0.24 0.26 0.27 0.29 0.25 - 19 [ 0.22 .. 0.54]
2708-> ARG 78 HB* - VAL 103 HG2* [ 1.80 5.87] 0.01 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.01 .. 0.22]
2711-> ARG 78 HG* - ASN 80 HD22 [ 1.80 5.21] 0.00 0.31 0.00 0.02 0.23 0.00 0.36 0.16 0.04 0.00 0.00 0.40 0.00 0.00 0.05 0.01 0.00 0.00 0.00 0.00 - 11 [ 0.00 .. 0.40]
2712-> ARG 78 HG* - THR 100 HA [ 1.80 4.92] 0.00 1.15 0.00 1.21 1.16 0.00 1.06 1.32 1.15 0.00 1.28 1.21 1.19 1.15 1.12 1.27 1.22 0.00 1.13 0.00 - 14 [ 1.06 .. 1.32]
2714-> ARG 78 HG* - PHE 101 HN [ 1.80 4.72] 0.00 0.36 0.00 0.43 0.56 0.00 0.27 0.56 0.28 0.00 0.55 0.39 0.44 0.33 0.24 0.31 0.48 0.00 0.36 0.00 - 14 [ 0.24 .. 0.56]
2715-> ARG 78 HD* - ASN 80 HD22 [ 1.80 4.43] 0.00 0.21 0.00 0.00 0.11 0.00 0.23 0.00 0.00 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.11 .. 0.23]
2716-> ARG 78 HD* - THR 100 HA [ 1.80 5.06] 0.00 0.92 0.00 1.05 0.95 0.00 0.84 1.17 0.94 0.00 1.16 0.98 1.02 0.94 0.90 1.01 1.04 0.00 0.88 0.00 - 14 [ 0.84 .. 1.17]
2718-> VAL 83 HN - ASN 97 HB* [ 1.80 4.41] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.18 0.00 0.00 0.00 - 2 [ 0.18 .. 0.25]
2720-> VAL 83 HG1* - GLU 91 HG* [ 1.80 5.78] 0.00 0.00 0.00 0.12 0.00 0.18 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.05 .. 0.18]
2721-> VAL 83 HG1* - ASN 97 HB* [ 1.80 4.05] 0.00 0.00 0.00 0.07 0.00 0.35 0.00 0.00 0.24 0.00 1.26 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.07 - 6 [ 0.07 .. 1.26]
2722-> ASP 84 HA - VAL 89 HG* [ 1.80 5.65] 0.00 0.10 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.10 .. 0.62]
2724-> ASP 84 HB2 - ASN 97 HD2* [ 1.80 4.65] 0.00 0.21 0.00 0.00 0.00 0.38 0.32 0.00 1.05 0.00 0.00 0.00 0.13 0.36 1.49 0.03 0.00 0.00 0.10 0.36 - 10 [ 0.03 .. 1.49]
2725-> ASP 84 HB3 - VAL 89 HG* [ 1.80 5.06] 0.08 0.16 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 0.00 0.00 0.07 0.00 0.00 - 4 [ 0.07 .. 0.16]
2731-> GLU 86 HG* - THR 88 HG2* [ 1.80 3.99] 0.00 0.00 0.00 0.00 0.00 0.11 0.00 0.00 0.00 0.23 0.10 0.10 0.00 0.00 0.00 0.00 0.00 0.12 0.00 0.02 - 6 [ 0.02 .. 0.23]
2756-> ASN 93 HD21 - ASN 96 HB* [ 1.80 4.94] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.28 0.00 0.95 - 4 [ 0.04 .. 0.95]
2757-> ASN 93 HD22 - ASN 96 HB* [ 1.80 4.46] 0.61 0.00 0.00 0.70 0.36 0.00 0.01 1.87 1.73 1.56 1.12 0.72 1.73 0.81 0.79 1.22 0.00 0.91 1.44 2.61 - 16 [ 0.01 .. 2.61]
2758-> ASN 93 HD22 - ASN 96 HD2* [ 1.80 5.49] 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.07 - 2 [ 0.07 .. 0.38]
2759-> GLU 94 HA - ASN 97 HD2* [ 1.80 5.87] 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 0.00 - 1 [ 0.10 .. 0.10]
2770-> ASN 97 HA - ASN 97 HD2* [ 1.80 5.06] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.11 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.01 .. 0.11]
2773-> ASN 97 HB* - VAL 98 HG2* [ 1.80 4.05] 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.13 .. 0.13]
2784-> VAL 106 HG2* - GLU 108 HG* [ 1.80 4.64] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.25 - 2 [ 0.21 .. 0.25]
2786-> GLU 108 HN - GLU 108 HG* [ 1.80 3.77] 0.00 0.00 0.21 0.00 0.20 0.00 0.00 0.46 0.00 0.21 0.21 0.00 0.00 0.00 0.20 0.00 0.00 0.00 0.21 0.46 - 8 [ 0.20 .. 0.46]
-------------------------------------------
Number of Violations greater than 0.10 226 347 222 231 266 260 295 241 278 308 244 339 351 224 355 215 271 269 242 262
-------------------------------------------
---- 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: 26 45 28 28 27 36 23 28 27 34 30 29 34 25 33 27 31 36 38 29 30.70
0.2 - 0.5 ang: 62 87 70 67 85 85 77 66 69 70 68 68 89 77 77 68 77 65 67 77 73.55
> 0.5 ang: 138 215 124 136 154 139 195 147 182 204 146 242 228 122 245 120 163 168 137 156 168.05
Total : 266 384 250 267 299 301 335 267 311 348 285 374 390 264 415 256 311 308 271 296 309.90
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 : 3.081 5.289 2.491 3.083 2.539 3.151 8.310 3.356 5.165 5.436 3.018 7.832 8.552 3.250 8.767 2.325 3.424 3.704 2.748 5.031 8.767
Max Intra Viol : 0.645 2.129 0.658 0.635 1.228 0.647 2.185 0.641 2.044 2.145 1.245 2.243 2.259 0.656 2.340 0.656 0.852 0.634 0.656 0.700 2.340
Max Seque Viol : 2.447 3.147 2.491 2.401 2.536 2.038 3.760 2.193 3.020 3.742 2.545 3.768 3.755 2.255 3.750 2.282 2.607 3.704 2.515 2.401 3.768
Max Medium Viol : 2.436 3.141 2.418 3.083 2.539 2.800 6.763 2.481 3.283 3.367 2.856 6.597 7.127 2.684 7.236 2.126 3.424 3.015 2.571 4.940 7.236
Max Long Viol : 3.081 5.289 2.403 2.744 2.261 3.151 8.310 3.356 5.165 5.436 3.018 7.832 8.552 3.250 8.767 2.325 3.101 3.319 2.748 5.031 8.767
Average Violation : 0.065 0.123 0.060 0.069 0.075 0.070 0.149 0.072 0.101 0.118 0.072 0.169 0.168 0.061 0.177 0.058 0.084 0.083 0.068 0.081 0.09619
Avge Intra Viol : 0.007 0.017 0.007 0.009 0.010 0.009 0.017 0.008 0.017 0.014 0.012 0.017 0.019 0.008 0.020 0.006 0.011 0.009 0.008 0.012 0.01181
Avge Seque Viol : 0.040 0.069 0.063 0.049 0.077 0.068 0.194 0.063 0.054 0.073 0.053 0.217 0.209 0.062 0.219 0.049 0.074 0.061 0.054 0.088 0.09176
Avge Mediu Viol : 0.163 0.207 0.129 0.154 0.145 0.142 0.166 0.133 0.162 0.208 0.124 0.214 0.190 0.129 0.212 0.131 0.151 0.185 0.129 0.164 0.16194
Avge Long Viol : 0.086 0.185 0.068 0.090 0.089 0.084 0.181 0.093 0.153 0.172 0.100 0.204 0.211 0.070 0.220 0.072 0.110 0.109 0.090 0.091 0.12392
RMS Violation : 0.280 0.465 0.265 0.298 0.300 0.290 0.691 0.304 0.422 0.475 0.303 0.712 0.728 0.265 0.754 0.258 0.339 0.338 0.288 0.358 0.44020
RMS Intra : 0.050 0.132 0.051 0.059 0.073 0.056 0.128 0.055 0.130 0.127 0.084 0.131 0.135 0.055 0.139 0.045 0.069 0.056 0.053 0.072 0.09205
RMS Sequential : 0.231 0.316 0.290 0.289 0.334 0.322 0.883 0.302 0.295 0.334 0.278 0.948 0.885 0.305 0.921 0.240 0.360 0.302 0.279 0.460 0.49365
RMS Medium range : 0.455 0.531 0.402 0.429 0.406 0.380 0.517 0.394 0.479 0.569 0.391 0.548 0.513 0.390 0.530 0.377 0.424 0.500 0.406 0.445 0.45843
RMS Long range : 0.317 0.600 0.271 0.333 0.318 0.313 0.756 0.348 0.542 0.606 0.356 0.751 0.828 0.266 0.856 0.291 0.380 0.387 0.325 0.352 0.49925
Final --global-- Summary for 20 models, 2787 NOEs/model, 55740 NOEs total
~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
Summ of viol : 5361.505
Summ sq. viol : 10801.284
Maximum viol : 8.767
Average viol : 0.09619
RMSD viol : 0.44020
Std. Dev. viol : 0.42957
RMS Intra : 0.09205
RMS Seque : 0.49365
RMS Medi : 0.45843
RMS Long : 0.49925
table of dihedral angle constraints violations
1-> [GLU A 2] PHI -135.0 -88.2 4.4 10.6 4.6 8.5 5.5 0.0 3.0 12.9 2.3 3.5 11.0 0.0 12.5 0.0 12.2 17.3 17.2 3.7 0.0 2.5 - 16 [ 0.0 .. 17.3]
2-> [GLU A 2] PSI 118.4 177.5 0.0 0.0 0.0 48.0 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 .. 48.0]
3-> [PHE A 3] PHI -138.5 -113.7 0.0 0.0 0.0 2.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 3.3 0.0 1.6 0.0 0.0 - 3 [ 0.0 .. 3.3]
4-> [PHE A 3] PSI 84.0 156.0 0.8 0.0 3.3 0.0 1.7 0.0 0.0 2.0 0.0 2.6 0.0 0.0 0.3 0.0 1.6 0.0 0.0 0.0 0.0 0.3 - 8 [ 0.0 .. 3.3]
5-> [PRO A 4] PSI 136.4 172.8 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 9.9 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 9.9]
6-> [THR A 7] PHI -160.4 -113.3 42.6 24.9 0.0 0.0 0.0 19.5 0.0 0.0 0.0 10.9 0.0 27.8 13.4 23.5 24.9 11.1 0.0 25.4 0.0 19.7 - 11 [ 0.0 .. 42.6]
7-> [THR A 7] PSI 140.4 171.8 8.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 10.4 0.0 15.4 11.6 0.0 15.7 8.1 0.0 14.3 0.0 0.0 - 7 [ 0.0 .. 15.7]
8-> [VAL A 8] PHI -145.7 -121.4 10.2 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 11.5 4.7 13.9 0.0 1.6 7.1 15.7 3.5 11.5 0.0 0.0 - 9 [ 0.0 .. 15.7]
9-> [VAL A 8] PSI 149.2 165.2 12.2 11.8 0.0 6.3 7.4 5.6 9.3 9.1 9.2 14.2 1.4 17.5 6.1 5.5 6.4 14.3 1.6 9.3 8.7 5.4 - 19 [ 0.0 .. 17.5]
11-> [GLU A 9] PSI 118.3 146.2 0.0 0.0 0.0 0.0 0.0 4.0 1.1 0.0 0.0 0.0 4.0 0.0 0.0 0.0 3.9 6.0 3.9 0.0 3.9 4.0 - 8 [ 0.0 .. 6.0]
14-> [LYS A 11] PHI -143.9 -128.6 5.5 10.6 4.2 8.1 14.4 7.6 8.2 7.2 8.6 15.3 16.0 11.0 9.4 3.3 11.4 12.2 17.9 8.5 0.7 7.5 - 20 [ 0.7 .. 17.9]
16-> [VAL A 15] PHI -132.9 -95.8 0.0 0.0 0.0 1.5 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 0.0 - 1 [ 0.0 .. 1.5]
18-> [VAL A 16] PHI -135.6 -122.4 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 5.7 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 5.7]
19-> [VAL A 16] PSI 136.2 163.1 1.2 0.0 1.2 0.0 0.0 0.0 1.9 0.0 0.0 0.0 0.0 1.6 0.0 1.2 0.0 1.2 1.5 0.0 1.1 1.7 - 9 [ 0.0 .. 1.9]
23-> [ASN A 19] PSI 9.2 42.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 1.1]
24-> [LEU A 21] PHI -116.0 -65.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 2.4 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 2.4]
25-> [LEU A 21] PSI 117.6 140.7 0.0 25.7 3.3 27.1 0.0 0.0 24.8 7.6 23.6 22.6 0.0 25.9 0.0 2.1 26.7 2.5 22.9 22.7 0.0 2.4 - 14 [ 0.0 .. 27.1]
26-> [ALA A 22] PHI -135.7 -114.4 0.0 19.3 10.2 19.0 0.0 0.0 18.8 1.9 17.0 19.3 0.0 19.1 0.0 4.9 19.7 4.7 18.8 20.7 2.2 6.2 - 15 [ 0.0 .. 20.7]
27-> [ALA A 22] PSI 133.0 156.2 14.2 27.1 0.0 28.0 12.2 12.2 28.5 1.7 27.3 22.0 0.3 27.5 11.8 0.0 25.4 0.0 5.3 29.1 0.0 0.0 - 15 [ 0.0 .. 29.1]
28-> [GLU A 23] PHI -136.2 -100.7 7.4 16.6 0.0 22.3 17.1 14.9 23.0 11.3 21.6 18.4 8.6 27.3 14.2 0.0 22.1 1.2 0.0 15.6 0.0 0.0 - 15 [ 0.0 .. 27.3]
30-> [TYR A 24] PHI -141.9 -123.4 4.7 3.3 3.4 1.0 0.1 1.2 0.0 0.0 0.5 2.1 0.0 0.0 0.9 2.3 0.8 2.9 1.0 1.9 3.7 1.2 - 16 [ 0.0 .. 4.7]
31-> [TYR A 24] PSI 151.3 166.2 6.2 3.0 0.0 6.7 6.3 5.9 0.2 2.6 4.2 4.4 1.4 6.2 0.0 0.0 6.2 6.5 1.7 5.9 6.3 0.0 - 16 [ 0.0 .. 6.7]
32-> [GLU A 25] PHI -142.8 -122.0 12.1 0.0 0.0 8.2 0.0 11.9 0.0 5.0 2.5 0.0 0.0 0.0 0.0 0.0 8.1 0.0 0.0 11.7 10.1 0.0 - 8 [ 0.0 .. 12.1]
33-> [GLU A 25] PSI 128.1 157.9 0.0 13.1 0.0 7.1 11.6 0.0 0.0 0.0 7.0 13.1 13.1 0.0 0.0 0.0 8.6 12.0 15.9 5.8 4.0 0.0 - 11 [ 0.0 .. 15.9]
35-> [VAL A 26] PSI 115.1 130.4 7.9 5.7 2.3 14.2 0.6 5.4 8.7 8.1 6.5 3.0 0.0 6.1 13.6 7.4 13.2 5.2 0.0 2.2 4.2 6.0 - 18 [ 0.0 .. 14.2]
38-> [VAL A 28] PHI -124.1 -106.6 0.0 0.6 0.0 0.0 5.9 0.9 2.8 1.9 10.6 0.9 3.9 0.0 8.4 2.3 0.0 0.0 5.7 2.5 4.8 0.0 - 13 [ 0.0 .. 10.6]
39-> [VAL A 28] PSI 123.9 136.0 4.5 0.0 0.4 0.0 0.0 0.0 0.0 0.0 0.0 0.4 3.8 3.3 0.0 0.0 0.0 1.3 3.8 3.8 3.9 0.0 - 9 [ 0.0 .. 4.5]
40-> [LYS A 29] PHI -152.5 -109.9 0.0 0.0 0.2 0.0 0.0 0.0 0.0 0.0 0.0 0.0 7.5 0.0 0.0 0.0 0.0 0.0 6.2 0.0 3.9 0.0 - 4 [ 0.0 .. 7.5]
41-> [LYS A 29] PSI 139.1 164.2 6.6 6.3 0.0 0.0 0.0 6.7 0.0 0.0 0.0 0.0 0.0 9.9 3.5 8.1 6.3 0.0 0.0 9.4 0.0 3.7 - 9 [ 0.0 .. 9.9]
42-> [ASN A 30] PHI -143.0 -100.4 12.4 8.5 0.0 6.3 0.0 6.2 0.0 0.0 0.0 0.0 0.0 8.1 4.6 8.7 11.2 0.0 0.0 8.4 0.0 4.3 - 10 [ 0.0 .. 12.4]
43-> [ASN A 30] PSI 130.4 162.2 25.4 25.2 18.9 16.6 19.8 21.7 16.9 17.4 14.8 21.0 17.6 23.7 24.5 20.1 25.9 23.6 19.2 21.6 17.0 20.3 - 20 [ 14.8 .. 25.9]
44-> [GLY A 33] PHI 46.9 87.4 3.0 9.7 9.5 0.0 7.8 0.0 4.2 18.7 9.4 10.4 0.0 1.2 5.5 0.0 3.2 2.4 4.6 1.0 3.2 5.1 - 16 [ 0.0 .. 18.7]
45-> [GLY A 33] PSI 13.3 55.5 11.9 16.0 23.3 10.3 18.6 0.0 6.1 20.7 19.6 20.1 0.0 16.9 18.9 0.0 15.6 0.0 15.8 1.5 17.4 16.1 - 16 [ 0.0 .. 23.3]
46-> [ILE A 34] PHI -136.9 -108.4 0.0 6.0 0.0 0.0 0.0 13.9 13.2 0.0 0.0 0.0 6.6 0.0 0.0 6.2 0.0 17.7 0.0 14.8 0.5 0.0 - 9 [ 0.0 .. 17.7]
47-> [ILE A 34] PSI 133.9 162.0 13.2 23.4 18.9 10.0 20.8 3.5 2.8 14.1 19.3 20.1 7.0 21.4 18.4 3.5 18.8 3.6 29.9 3.2 18.4 10.1 - 20 [ 2.8 .. 29.9]
49-> [VAL A 36] PSI 114.4 154.0 11.7 9.0 4.0 13.8 4.1 0.9 5.3 7.0 10.3 8.8 5.2 5.6 5.2 5.3 1.7 0.0 4.6 0.0 7.2 6.5 - 18 [ 0.0 .. 13.8]
50-> [PRO A 37] PSI -28.8 -12.2 0.0 0.9 0.0 4.7 2.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 2.4 0.0 - 4 [ 0.0 .. 4.7]
51-> [SER A 38] PHI -111.9 -82.0 0.0 8.1 8.1 2.6 8.1 0.0 3.1 0.0 0.0 4.2 0.0 0.0 0.0 0.0 0.0 0.0 3.0 0.0 9.9 3.1 - 9 [ 0.0 .. 9.9]
52-> [SER A 38] PSI -20.9 5.0 58.1 45.0 45.1 37.9 45.1 1.0 30.0 5.4 4.5 35.8 0.0 4.6 0.0 0.0 0.3 34.9 35.8 11.8 46.8 35.5 - 17 [ 0.0 .. 58.1]
53-> [THR A 39] PHI -128.9 -96.1 1.2 12.2 12.6 7.2 8.3 41.3 25.7 41.1 39.9 25.5 38.2 40.6 40.7 40.1 40.2 11.2 14.6 36.4 9.4 26.2 - 20 [ 1.2 .. 41.3]
55-> [LYS A 40] PHI -121.2 -89.8 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 2.4 0.0 0.0 0.0 8.7 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 8.7]
56-> [LYS A 40] PSI 114.6 130.5 0.0 0.0 0.0 9.4 4.7 10.3 17.3 4.9 8.9 2.5 11.3 3.6 12.9 17.7 6.9 5.7 7.7 8.8 1.8 0.7 - 17 [ 0.0 .. 17.7]
57-> [VAL A 41] PHI -130.9 -104.9 0.0 0.0 0.0 5.1 0.0 0.0 6.8 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 6.8]
58-> [VAL A 41] PSI 119.2 139.1 6.1 0.0 0.0 0.0 0.0 0.0 0.0 3.1 0.0 0.0 0.2 0.0 0.0 0.0 0.0 0.0 4.0 0.0 0.3 0.0 - 5 [ 0.0 .. 6.1]
59-> [ARG A 42] PHI -141.1 -115.7 0.0 5.6 0.0 0.0 0.0 0.0 0.3 0.0 2.4 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.3 0.0 0.0 0.0 - 4 [ 0.0 .. 5.6]
60-> [ARG A 42] PSI 138.0 166.6 23.7 0.0 15.3 15.7 0.0 25.2 0.0 20.6 13.3 24.0 23.4 21.0 18.2 22.8 24.3 24.8 18.4 0.0 19.0 20.6 - 16 [ 0.0 .. 25.2]
61-> [VAL A 43] PHI -139.2 -122.2 25.6 6.6 19.4 22.6 7.7 28.8 11.5 22.8 20.9 24.6 23.3 26.7 18.8 24.2 25.0 23.0 20.5 3.2 19.8 24.9 - 20 [ 3.2 .. 28.8]
62-> [VAL A 43] PSI 120.7 146.8 10.8 11.6 8.4 11.8 9.4 12.4 17.5 11.9 15.3 18.0 13.6 13.9 10.4 7.9 13.0 7.1 10.7 1.2 5.7 8.9 - 20 [ 1.2 .. 18.0]
63-> [TYR A 44] PHI -137.5 -112.4 11.3 13.7 10.3 15.2 2.3 14.9 17.3 16.4 13.8 18.7 21.4 12.5 12.3 12.0 14.1 13.0 16.3 4.4 8.0 9.6 - 20 [ 2.3 .. 21.4]
64-> [TYR A 44] PSI 137.7 163.4 0.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 20.6 0.0 0.0 - 2 [ 0.0 .. 25.0]
66-> [ILE A 45] PSI 108.1 141.4 1.6 7.8 1.1 11.5 6.3 0.0 4.5 0.9 6.7 0.0 3.4 1.8 7.3 6.0 7.8 6.8 7.2 0.0 7.5 0.4 - 17 [ 0.0 .. 11.5]
67-> [ASN A 46] PHI 48.6 59.9 0.7 2.9 0.0 3.8 2.5 0.0 0.0 0.0 0.7 0.0 0.0 0.0 2.7 2.7 0.0 2.8 2.2 0.1 3.3 0.0 - 11 [ 0.0 .. 3.8]
68-> [ASN A 46] PSI 35.1 48.0 2.8 3.4 0.8 4.7 4.7 0.9 4.9 3.8 4.6 5.1 2.5 3.1 4.8 3.9 1.8 4.1 5.2 0.7 3.4 0.1 - 20 [ 0.1 .. 5.2]
69-> [THR A 48] PHI -113.7 -82.5 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 0.0 0.0 4.8 0.0 0.0 - 1 [ 0.0 .. 4.8]
70-> [THR A 48] PSI 117.6 152.5 2.6 0.7 0.0 6.0 1.9 0.0 1.9 0.0 3.2 0.0 1.3 0.0 2.7 2.5 5.3 3.5 0.0 0.0 2.7 0.9 - 13 [ 0.0 .. 6.0]
71-> [LEU A 49] PHI -81.6 -62.6 2.4 2.4 2.4 2.5 2.3 1.4 1.9 2.2 2.3 0.0 0.2 2.4 2.5 3.9 0.1 2.6 0.9 5.3 2.7 2.7 - 19 [ 0.0 .. 5.3]
72-> [LEU A 49] PSI 115.5 135.1 2.5 1.7 0.0 5.3 5.5 1.1 0.0 0.7 2.7 0.0 2.0 0.0 3.8 1.7 2.6 2.9 0.9 5.5 2.7 4.4 - 16 [ 0.0 .. 5.5]
73-> [TYR A 50] PHI -105.0 -83.0 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 9.8 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 9.8]
74-> [TYR A 50] PSI -42.6 -33.4 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 16.2 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 16.2]
76-> [LYS A 51] PSI 150.7 167.4 7.4 9.4 4.0 8.1 0.0 10.7 19.4 10.4 10.7 9.6 8.8 20.6 7.6 0.0 10.6 5.3 9.4 4.1 6.9 8.9 - 18 [ 0.0 .. 20.6]
77-> [ASN A 52] PHI -160.7 -124.6 0.0 0.0 0.0 0.0 0.0 0.0 27.0 0.0 0.0 0.0 0.0 35.8 0.0 0.0 4.1 0.0 0.0 0.0 0.0 0.0 - 3 [ 0.0 .. 35.8]
78-> [ASN A 52] PSI 136.4 166.7 0.0 0.0 0.0 0.0 0.0 0.0 6.8 0.0 0.0 0.0 0.0 14.0 4.7 0.0 13.2 0.0 0.0 0.1 0.0 0.0 - 5 [ 0.0 .. 14.0]
79-> [TRP A 53] PHI -154.6 -130.3 0.0 0.0 0.0 0.0 0.0 0.0 2.2 0.0 0.0 0.0 0.0 10.5 6.1 0.0 10.4 0.0 0.0 0.0 0.0 0.0 - 4 [ 0.0 .. 10.5]
80-> [TRP A 53] PSI 133.9 148.6 13.1 1.3 6.4 6.3 14.7 14.1 7.5 16.7 1.4 1.3 16.2 0.0 0.0 6.8 0.0 9.4 16.2 16.4 12.0 17.2 - 17 [ 0.0 .. 17.2]
81-> [THR A 54] PHI -131.2 -83.4 0.0 0.0 0.0 0.0 0.4 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.8 1.6 - 3 [ 0.0 .. 1.6]
82-> [THR A 54] PSI 120.6 150.1 2.3 0.8 9.0 10.2 0.0 0.0 0.0 0.0 0.0 2.6 0.0 0.0 0.0 0.0 0.0 11.1 0.5 1.1 1.2 1.4 - 10 [ 0.0 .. 11.1]
83-> [VAL A 55] PHI -147.1 -130.9 2.2 0.0 6.9 0.0 2.3 0.0 0.0 2.3 0.0 0.0 0.0 0.0 0.0 0.2 0.0 4.0 2.1 1.6 1.3 5.2 - 10 [ 0.0 .. 6.9]
84-> [VAL A 55] PSI 161.4 172.5 0.0 0.0 0.0 0.0 0.0 1.4 13.3 0.0 1.4 0.0 0.0 21.3 22.1 0.0 21.2 0.0 0.0 0.0 0.0 0.0 - 6 [ 0.0 .. 22.1]
85-> [SER A 56] PHI -134.2 -106.2 0.0 0.7 1.2 0.0 0.0 0.0 3.9 0.0 0.0 1.2 0.0 1.1 2.3 0.0 4.3 0.0 0.9 0.0 1.6 0.0 - 9 [ 0.0 .. 4.3]
86-> [SER A 56] PSI 134.1 153.7 9.4 12.7 11.9 7.8 12.9 3.1 16.6 18.6 13.8 11.9 19.8 16.5 17.6 15.2 13.5 1.0 14.1 9.5 11.7 12.6 - 20 [ 1.0 .. 19.8]
87-> [LEU A 57] PHI -148.0 -118.6 0.0 0.0 0.0 1.1 0.0 0.0 0.0 0.0 0.0 0.0 5.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 5.1]
88-> [LEU A 57] PSI 121.8 141.8 15.8 19.2 3.0 18.1 16.7 0.0 5.9 12.9 12.7 18.7 7.1 0.0 16.0 7.7 9.6 0.0 16.9 6.7 16.0 0.0 - 16 [ 0.0 .. 19.2]
90-> [GLU A 61] PSI 123.8 155.3 0.0 0.0 0.0 2.8 2.9 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 0.6 0.0 - 3 [ 0.0 .. 2.9]
91-> [GLU A 62] PHI -134.6 -104.7 0.0 0.0 10.4 0.0 6.8 0.0 0.0 6.9 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 9.7 0.0 - 4 [ 0.0 .. 10.4]
92-> [GLU A 62] PSI 126.5 153.6 0.0 0.0 0.0 14.1 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 4.8 - 2 [ 0.0 .. 14.1]
93-> [LYS A 63] PHI -145.1 -117.2 0.0 2.2 0.0 0.0 0.0 0.0 0.0 0.0 0.0 3.5 0.8 0.0 1.0 0.0 0.0 0.0 0.1 0.0 0.9 4.7 - 7 [ 0.0 .. 4.7]
94-> [LYS A 63] PSI 116.6 160.7 0.0 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 - 1 [ 0.0 .. 3.4]
95-> [VAL A 64] PHI -119.7 -101.4 0.0 0.0 0.0 5.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 6.1 5.8 0.0 4.9 0.0 0.0 0.0 0.0 2.1 - 5 [ 0.0 .. 6.1]
96-> [VAL A 64] PSI 114.0 125.5 0.2 0.0 0.2 1.6 0.0 0.0 1.6 0.0 0.0 0.0 0.0 9.6 4.8 0.0 10.4 0.5 0.0 0.0 0.0 0.0 - 8 [ 0.0 .. 10.4]
97-> [LEU A 65] PHI -113.7 -82.5 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 4.9 0.0 0.0 0.0 0.0 0.0 4.7 0.0 0.0 0.0 - 2 [ 0.0 .. 4.9]
98-> [LEU A 65] PSI 126.3 146.0 3.4 26.3 30.0 1.1 0.0 0.0 3.9 7.1 26.2 26.3 23.8 11.2 6.0 0.1 6.4 17.2 25.3 0.0 25.8 3.8 - 17 [ 0.0 .. 30.0]
99-> [THR A 66] PHI -137.9 -114.1 0.0 9.6 18.9 0.0 0.0 0.0 0.3 0.0 12.6 10.2 14.3 3.7 1.8 0.0 2.4 7.9 15.7 0.0 10.6 0.0 - 12 [ 0.0 .. 18.9]
100-> [THR A 66] PSI 147.5 170.5 0.0 17.4 0.0 0.0 11.6 0.0 0.0 0.0 0.0 15.3 0.0 19.3 0.0 0.0 0.0 9.2 0.0 0.0 0.0 0.0 - 5 [ 0.0 .. 19.3]
101-> [PHE A 67] PHI -159.2 -144.6 0.0 0.1 0.1 0.0 0.0 0.0 2.4 0.0 0.0 0.0 0.0 0.0 0.0 0.4 0.0 1.8 0.0 0.0 0.0 0.0 - 5 [ 0.0 .. 2.4]
102-> [PHE A 67] PSI 149.3 162.1 0.0 7.8 1.8 0.0 0.0 0.0 7.4 0.0 7.6 0.0 0.0 8.3 1.7 4.9 2.9 0.0 0.0 2.8 2.9 0.0 - 10 [ 0.0 .. 8.3]
103-> [SER A 68] PHI -140.7 -111.1 0.0 0.0 0.0 3.5 6.1 4.9 0.0 1.5 0.0 4.5 1.6 0.0 0.0 0.0 0.0 0.0 1.6 0.0 0.0 0.0 - 7 [ 0.0 .. 6.1]
104-> [SER A 68] PSI 115.7 156.1 19.7 5.6 0.0 6.8 5.7 6.0 3.8 0.0 6.7 0.1 0.0 0.0 6.1 0.0 12.8 0.0 0.0 14.9 0.0 0.0 - 11 [ 0.0 .. 19.7]
105-> [TRP A 69] PHI -150.5 -98.8 8.8 7.7 0.0 12.2 20.5 15.8 13.4 0.0 12.4 0.0 0.0 13.6 8.7 0.0 20.6 0.0 0.0 13.9 0.0 0.0 - 11 [ 0.0 .. 20.6]
106-> [TRP A 69] PSI 121.2 136.5 0.0 1.6 0.0 0.0 0.0 0.0 0.0 6.6 0.0 8.8 3.5 0.0 0.0 1.6 0.0 0.0 0.0 0.0 0.0 0.0 - 5 [ 0.0 .. 8.8]
108-> [THR A 70] PSI 101.7 126.1 2.5 0.0 1.6 1.1 24.4 24.7 1.4 5.4 1.2 1.5 2.6 4.6 11.7 0.0 0.5 0.0 0.0 0.0 0.0 3.0 - 14 [ 0.0 .. 24.7]
109-> [GLN A 73] PHI -142.9 -84.2 6.7 0.0 4.3 16.7 1.9 0.0 16.5 22.4 17.2 27.4 21.0 0.0 15.7 14.6 17.1 0.0 0.0 0.0 0.0 2.6 - 13 [ 0.0 .. 27.4]
110-> [GLN A 73] PSI 126.4 145.9 0.0 1.5 0.0 0.0 0.0 0.0 0.0 0.0 14.8 24.0 0.0 3.8 0.0 0.0 0.0 0.0 0.0 4.3 0.0 0.0 - 5 [ 0.0 .. 24.0]
111-> [GLU A 74] PHI -117.6 -58.9 0.0 0.0 0.0 0.0 0.0 0.0 0.0 11.9 0.0 0.8 14.9 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 3 [ 0.0 .. 14.9]
112-> [GLU A 74] PSI 112.4 149.6 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 20.4 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 20.4]
114-> [GLY A 75] PSI 160.4 -168.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 2.4 0.0 0.1 1.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 3 [ 0.0 .. 2.4]
115-> [MET A 76] PHI -99.0 -67.3 0.0 0.0 0.0 0.0 2.8 0.0 0.0 5.7 0.0 5.5 6.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 4 [ 0.0 .. 6.1]
118-> [TYR A 77] PSI 112.4 155.0 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 6.1 0.0 0.0 - 1 [ 0.0 .. 6.1]
119-> [ARG A 78] PHI -123.1 -92.9 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 7.0 0.0 0.0 - 1 [ 0.0 .. 7.0]
120-> [ARG A 78] PSI 111.4 125.1 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 1.2 0.0 0.0 - 1 [ 0.0 .. 1.2]
121-> [ILE A 79] PHI -115.9 -96.0 8.5 13.3 4.7 10.8 12.5 3.0 12.5 10.0 13.7 10.5 7.9 14.7 10.2 10.8 15.5 12.6 9.7 0.0 11.2 4.9 - 19 [ 0.0 .. 15.5]
124-> [ASN A 80] PSI 128.1 163.4 19.7 0.0 15.7 21.9 18.8 20.7 20.2 21.3 19.7 23.1 23.0 23.2 21.0 21.0 23.2 23.1 22.1 17.8 19.6 17.4 - 19 [ 0.0 .. 23.2]
125-> [ALA A 81] PHI -141.4 -112.6 18.3 0.0 16.3 15.9 16.4 20.2 17.2 17.5 17.8 17.0 17.6 18.3 18.9 17.7 18.4 16.2 17.3 15.9 17.6 17.5 - 19 [ 0.0 .. 20.2]
126-> [ALA A 81] PSI 133.6 160.6 28.6 8.4 22.2 20.1 17.9 28.4 24.8 25.0 28.6 22.0 23.5 29.1 28.7 29.0 28.5 25.5 26.5 6.5 28.0 28.2 - 20 [ 6.5 .. 29.1]
127-> [THR A 82] PHI -137.6 -123.8 20.5 0.0 14.2 21.0 9.8 25.0 17.5 16.6 21.4 12.3 19.1 19.6 24.6 26.4 22.3 23.7 18.3 0.0 23.6 22.4 - 18 [ 0.0 .. 26.4]
128-> [THR A 82] PSI 141.4 163.7 17.6 0.0 11.4 21.8 13.6 13.8 6.4 16.5 18.9 16.0 13.4 0.0 16.3 17.8 16.1 0.0 15.4 11.4 16.2 15.4 - 17 [ 0.0 .. 21.8]
129-> [VAL A 83] PHI -149.2 -101.8 0.0 0.0 0.0 10.7 0.0 0.0 0.0 0.0 2.3 0.0 0.0 0.0 0.0 0.0 5.8 0.0 3.5 0.0 0.0 0.0 - 4 [ 0.0 .. 10.7]
130-> [VAL A 83] PSI 142.3 170.8 16.8 10.0 10.9 12.6 18.3 9.8 3.8 11.8 14.3 12.1 14.9 8.7 11.4 15.3 19.5 7.5 21.2 17.4 17.3 13.5 - 20 [ 3.8 .. 21.2]
131-> [GLU A 85] PHI -64.3 -51.8 0.0 0.7 0.0 1.8 0.0 0.0 8.3 0.0 0.0 0.0 0.0 0.0 1.0 0.0 0.0 6.6 0.0 0.0 0.0 0.0 - 5 [ 0.0 .. 8.3]
132-> [GLU A 85] PSI -46.0 -33.9 0.0 8.8 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 13.5 15.1 0.0 0.0 0.0 0.0 - 3 [ 0.0 .. 15.1]
133-> [GLU A 86] PHI -92.3 -68.2 0.0 0.0 0.0 1.6 0.0 0.0 0.0 0.0 4.5 0.0 0.0 0.0 5.5 3.2 0.0 0.0 4.2 0.0 0.0 0.0 - 5 [ 0.0 .. 5.5]
134-> [GLU A 86] PSI -25.2 10.4 0.0 0.0 0.0 4.7 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 5.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 5.0]
136-> [VAL A 89] PSI 112.7 141.0 0.0 0.0 0.0 18.1 0.0 18.0 19.0 0.0 0.0 0.0 24.0 0.0 0.0 19.3 0.0 18.9 0.0 0.0 0.0 0.0 - 6 [ 0.0 .. 24.0]
137-> [VAL A 90] PHI -105.1 -84.0 15.0 9.2 8.9 0.0 9.7 0.0 0.0 6.5 11.9 9.0 0.0 4.9 9.7 7.2 13.5 0.0 11.2 10.9 15.2 7.2 - 15 [ 0.0 .. 15.2]
139-> [GLU A 91] PHI -141.9 -92.7 0.0 6.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 3.0 0.0 0.0 1.3 0.0 0.0 0.0 0.0 0.0 0.0 - 3 [ 0.0 .. 6.1]
140-> [GLU A 91] PSI 156.5 -165.6 6.7 7.5 0.0 0.0 0.0 0.0 5.8 0.0 7.2 0.0 0.0 0.0 0.0 26.9 0.0 0.0 6.6 0.0 6.4 0.0 - 7 [ 0.0 .. 26.9]
141-> [LEU A 92] PHI -85.3 -59.7 0.0 0.0 0.0 0.0 0.0 3.1 0.0 0.0 0.0 0.0 33.5 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 33.5]
142-> [LEU A 92] PSI -38.1 -16.2 0.0 18.7 0.0 0.0 0.0 5.0 0.0 4.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.5 - 4 [ 0.0 .. 18.7]
143-> [GLU A 94] PHI -129.0 -84.9 18.9 22.5 0.0 12.7 5.2 0.0 0.0 0.0 19.2 0.0 21.9 0.0 0.0 21.5 18.5 0.0 0.0 0.0 14.3 0.0 - 9 [ 0.0 .. 22.5]
144-> [GLU A 94] PSI -23.7 30.0 0.0 3.5 0.0 0.0 0.0 0.0 0.0 0.0 0.4 0.0 1.7 0.0 0.0 5.8 0.0 0.0 0.0 0.0 0.0 0.0 - 4 [ 0.0 .. 5.8]
145-> [ASN A 95] PHI -107.2 -64.5 0.0 12.8 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 7.4 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 12.8]
146-> [ASN A 95] PSI -42.5 16.7 0.0 22.9 2.8 0.0 8.7 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 [ 0.0 .. 22.9]
147-> [ASN A 96] PHI -113.2 -87.3 12.4 0.0 6.6 18.5 6.8 0.0 0.0 0.0 12.2 0.0 0.0 15.3 0.0 0.0 15.4 14.1 0.0 0.0 0.0 0.0 - 8 [ 0.0 .. 18.5]
148-> [ASN A 96] PSI -22.5 36.6 12.8 0.0 0.0 1.2 0.0 0.0 0.0 0.0 0.0 5.1 0.0 1.0 0.0 0.0 0.0 1.9 0.0 0.0 0.0 0.0 - 5 [ 0.0 .. 12.8]
150-> [VAL A 98] PSI 130.0 168.3 25.2 28.0 3.4 3.8 0.0 9.5 6.5 5.0 1.4 9.0 5.8 8.5 9.2 5.3 8.9 15.2 7.0 2.8 5.0 10.0 - 19 [ 0.0 .. 28.0]
151-> [ALA A 99] PHI -145.2 -114.9 18.5 0.0 0.3 4.8 0.0 19.9 5.0 0.4 5.8 0.3 14.8 0.4 15.1 14.4 12.3 5.3 17.2 0.0 14.7 16.4 - 17 [ 0.0 .. 19.9]
152-> [ALA A 99] PSI 115.8 142.5 0.0 0.0 1.7 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 1.7]
153-> [THR A 100] PHI -128.2 -105.2 0.0 5.9 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 5.9]
156-> [PHE A 101] PSI 118.1 140.4 7.0 8.1 3.1 7.7 13.6 3.0 8.2 10.6 8.2 15.5 12.2 8.1 8.1 8.9 8.1 10.2 9.7 9.8 10.6 7.2 - 20 [ 3.0 .. 15.5]
157-> [ASP A 102] PHI -130.9 -93.7 9.1 6.8 9.3 8.5 15.3 7.9 4.3 8.2 6.1 9.7 8.5 7.2 8.9 6.2 5.5 6.5 8.8 15.5 7.2 11.8 - 20 [ 4.3 .. 15.5]
158-> [ASP A 102] PSI 118.4 136.9 0.0 4.0 0.0 7.6 10.7 0.0 3.4 9.4 2.8 0.0 12.6 2.5 9.0 8.5 3.0 5.9 8.9 4.5 8.4 0.0 - 15 [ 0.0 .. 12.6]
159-> [VAL A 103] PHI -128.7 -112.9 0.0 1.5 0.0 0.0 0.0 0.0 3.3 7.1 0.0 1.9 10.4 0.0 0.2 12.4 0.0 8.7 2.2 5.0 11.9 0.0 - 11 [ 0.0 .. 12.4]
160-> [VAL A 103] PSI 129.0 146.5 0.0 0.2 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 2.0 - 2 [ 0.0 .. 2.0]
162-> [SER A 104] PSI 114.1 144.9 2.0 0.0 3.4 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 2.1 0.0 0.0 0.0 0.0 1.6 4.2 - 5 [ 0.0 .. 4.2]
163-> [VAL A 105] PHI -112.8 -89.8 0.0 0.0 0.0 0.0 0.0 0.0 0.0 2.9 0.0 0.8 2.2 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 3 [ 0.0 .. 2.9]
---- 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 : 31 36 32 39 32 22 38 31 29 24 32 27 30 35 31 36 31 36 36 35 32.15
> 10. degrees : 30 27 19 32 24 23 24 25 32 35 29 33 28 22 39 25 27 22 24 18 26.90
Total : 64 71 60 72 60 49 65 59 64 69 65 61 64 60 74 63 64 62 66 59 63.55
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 : 58.1 45.0 45.1 48.0 45.1 41.3 30.0 41.1 39.9 35.8 38.2 40.6 40.7 40.1 40.2 34.9 35.8 36.4 46.8 35.5 58.12
Max PHI Viol : 42.6 24.9 19.4 22.6 20.5 41.3 27.0 41.1 39.9 27.4 38.2 40.6 40.7 40.1 40.2 23.7 20.5 36.4 23.6 26.2 42.61
Max PSI Viol : 58.1 45.0 45.1 48.0 45.1 28.4 30.0 25.0 28.6 35.8 24.0 29.1 28.7 29.0 28.5 34.9 35.8 29.1 46.8 35.5 58.12
Average Violation : 4.4 4.3 2.9 4.7 3.6 3.3 3.9 3.5 4.3 4.5 4.1 4.8 4.0 3.7 5.3 3.7 4.0 3.4 3.6 3.1 3.949
Avge PHI Viol : 1.856 1.784 1.512 1.851 1.556 1.789 1.826 1.786 1.943 1.847 2.070 2.042 1.854 1.854 2.230 1.766 1.751 1.750 1.648 1.599 1.823
Avge PSI Viol : 2.296 2.343 1.871 2.421 2.178 1.841 2.092 1.968 2.180 2.373 1.999 2.339 2.116 1.976 2.353 2.045 2.225 1.935 2.112 1.888 2.135
RMS Violation : 9.424 8.753 6.973 9.112 7.652 7.839 7.973 7.528 8.557 9.047 8.541 9.787 7.994 8.052 9.626 7.542 8.291 7.306 7.745 7.070 8.281
RMS PHI Viol : 8.014 6.446 5.165 6.943 5.270 8.247 7.324 7.652 8.262 7.487 9.081 9.669 7.666 8.145 9.581 6.554 6.562 7.206 5.920 6.355 7.481
RMS PSI Viol : 10.621 10.528 8.369 10.818 9.412 7.418 8.560 7.404 8.836 10.345 7.979 9.900 8.302 7.961 9.670 8.396 9.685 7.402 9.182 7.703 8.994
Final --global-- Summary for 20 models, 166 ACOs/model, 3320 ACOs total
~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
Summ. Viol. : 13110.49
Summ. Sq. Viol. : 227665.14
Max. Viol. : 58.122
Avg. Viol. : 3.94894
RMS Viol. : 8.28093
Std. Dev. Viol. : 7.27872
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 A 1 0.963 0.860 0.770 0.751
GLU A 2 0.988 0.969 0.616 0.938 0.959 2 2
PHE A 3 0.991 0.992 0.998 0.845 3 3
PRO A 4 0.996 0.996 0.955 0.913 4 4
ASP A 5 0.997 0.997 0.999 0.992 5 5
LEU A 6 0.996 0.941 0.999 0.998 6 6
THR A 7 0.911 0.973 0.035 7 7
VAL A 8 0.968 0.996 0.480 8 8
GLU A 9 0.996 0.978 0.215 0.998 0.974 9 9
ILE A 10 0.987 0.997 1.000 1.000 10 10
LYS A 11 0.997 0.999 1.000 1.000 1.000 1.000 11 11
GLY A 12 0.999 0.999 12 12
PRO A 13 0.995 0.990 0.927 0.864 13 13
ASP A 14 0.992 0.971 0.433 0.923 14 14
VAL A 15 0.997 0.996 1.000 15 15
VAL A 16 0.998 0.994 0.849 16 16
GLY A 17 0.997 0.998 17 17
VAL A 18 0.999 0.999 1.000 18 18
ASN A 19 0.999 0.989 0.865 0.941 19 19
LYS A 20 0.997 0.968 0.998 0.865 1.000 0.998 20 20
LEU A 21 0.984 0.969 0.587 0.564 21 21
ALA A 22 0.980 0.974 22 22
GLU A 23 0.984 0.999 1.000 1.000 1.000 23 23
TYR A 24 1.000 0.998 0.999 0.999 24 24
GLU A 25 0.991 0.982 0.780 0.998 0.941 25 25
VAL A 26 0.986 0.996 1.000 26 26
HIS A 27 0.996 0.999 0.923 0.890 27 27
VAL A 28 0.997 0.993 0.613 28 28
LYS A 29 0.987 0.977 0.450 0.981 0.812 0.995 29 29
ASN A 30 0.982 0.998 0.998 0.982 30 30
LEU A 31 0.998 0.997 1.000 1.000 31 31
GLY A 32 0.998 0.998 32 32
GLY A 33 0.996 0.989 33 33
ILE A 34 0.952 0.991 0.604 0.435 34 34
GLY A 35 0.997 0.990 35 35
VAL A 36 0.999 0.998 1.000 36 36
PRO A 37 1.000 0.999 1.000 1.000 37 37
SER A 38 0.983 0.937 0.923 38 38
THR A 39 0.970 0.991 1.000 39 39
LYS A 40 0.983 0.977 1.000 0.998 0.999 0.930 40 40
VAL A 41 0.988 0.997 1.000 41 41
ARG A 42 0.995 0.982 0.999 0.994 0.998 0.871 1.000 42 42
VAL A 43 0.993 0.998 1.000 43 43
TYR A 44 0.997 0.980 0.999 0.799 44 44
ILE A 45 0.989 0.997 1.000 1.000 45 45
ASN A 46 0.999 1.000 0.957 0.985 46 46
GLY A 47 0.998 0.997 47 47
THR A 48 0.995 0.999 1.000 48 48
LEU A 49 1.000 0.999 1.000 0.999 49 49
TYR A 50 0.997 0.997 0.995 0.999 50 50
LYS A 51 0.998 0.992 0.998 0.589 1.000 0.935 51 51
ASN A 52 0.968 0.990 1.000 0.840 52 52
TRP A 53 0.986 0.984 0.740 0.418 53 53
THR A 54 0.990 0.995 1.000 54 54
VAL A 55 0.996 0.985 0.710 55 55
SER A 56 0.993 0.997 0.782 56 56
LEU A 57 0.998 0.991 0.999 1.000 57 57
GLY A 58 0.998 0.998 58 58
PRO A 59 0.999 0.999 0.984 0.969 59 59
LYS A 60 0.999 0.999 0.998 0.592 1.000 0.999 60 60
GLU A 61 0.992 0.990 0.670 0.921 0.975 61 61
GLU A 62 0.988 0.990 0.868 0.998 0.997 62 62
LYS A 63 0.985 0.991 0.931 0.501 0.996 0.923 63 63
VAL A 64 0.992 0.994 0.926 64 64
LEU A 65 0.991 0.965 0.674 0.759 65 65
THR A 66 0.986 0.987 0.646 66 66
PHE A 67 0.996 0.992 0.999 1.000 67 67
SER A 68 0.989 0.965 0.494 68 68
TRP A 69 0.931 0.996 0.998 0.969 69 69
THR A 70 0.997 0.972 0.861 70 70
PRO A 71 0.996 0.993 0.940 0.888 71 71
THR A 72 0.981 0.956 1.000 72 72
GLN A 73 0.971 0.983 0.420 0.869 0.864 73 73
GLU A 74 0.990 0.992 0.930 0.999 0.948 74 74
GLY A 75 0.996 0.997 75 75
MET A 76 0.997 0.998 0.999 1.000 1.000 76 76
TYR A 77 0.999 0.984 1.000 0.900 77 77
ARG A 78 0.993 0.999 0.636 0.998 0.613 0.996 1.000 78 78
ILE A 79 0.997 0.998 1.000 1.000 79 79
ASN A 80 0.996 0.995 0.999 0.998 80 80
ALA A 81 0.997 0.994 81 81
THR A 82 0.990 0.987 0.704 82 82
VAL A 83 0.984 0.997 1.000 83 83
ASP A 84 0.996 0.994 0.999 0.987 84 84
GLU A 85 0.995 0.994 0.800 0.931 0.874 85 85
GLU A 86 0.992 0.986 0.999 0.921 0.890 86 86
ASN A 87 0.998 0.995 0.802 0.932 87 87
THR A 88 0.980 0.998 1.000 88 88
VAL A 89 0.988 0.961 0.616 89 89
VAL A 90 0.987 0.996 1.000 90 90
GLU A 91 0.971 0.983 0.997 0.487 0.605 91 91
LEU A 92 0.980 0.988 0.932 0.933 92 92
ASN A 93 0.972 0.935 0.616 0.890 93 93
GLU A 94 0.944 0.961 0.915 0.877 0.984 94 94
ASN A 95 0.957 0.934 0.998 0.922 95 95
ASN A 96 0.966 0.960 0.801 0.949 96 96
ASN A 97 0.983 0.971 0.233 0.549 97 97
VAL A 98 0.998 0.993 1.000 98 98
ALA A 99 0.990 0.997 99 99
THR A 100 0.997 0.998 1.000 100 100
PHE A 101 0.995 0.999 0.998 0.845 101 101
ASP A 102 0.999 0.984 0.731 0.969 102 102
VAL A 103 0.988 0.998 1.000 103 103
SER A 104 0.996 0.994 1.000 104 104
VAL A 105 0.994 0.999 1.000 105 105
VAL A 106 1.000 0.999 1.000 106 106
LEU A 107 0.996 0.994 1.000 1.000 107 107
GLU A 108 0.787 0.590 1.000 1.000
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 `PFR193A_R3_em_bcr3.pdb'
>
> Kabsch RMSD of backbone atoms in res. A[2..107],for model 1 is: 0.481
> Kabsch RMSD of backbone atoms in res. A[2..107],for model 2 is: 0.531
> Kabsch RMSD of backbone atoms in res. A[2..107],for model 3 is: 0.455
> Kabsch RMSD of backbone atoms in res. A[2..107],for model 4 is: 0.493
> Kabsch RMSD of backbone atoms in res. A[2..107],for model 5 is: 0.370
> Kabsch RMSD of backbone atoms in res. A[2..107],for model 6 is: 0.361
> Kabsch RMSD of backbone atoms in res. A[2..107],for model 7 is: 0.416
> Kabsch RMSD of backbone atoms in res. A[2..107],for model 8 is: 0.366
> Kabsch RMSD of backbone atoms in res. A[2..107],for model 9 is: 0.265 (*)
> Kabsch RMSD of backbone atoms in res. A[2..107],for model 10 is: 0.401
> Kabsch RMSD of backbone atoms in res. A[2..107],for model 11 is: 0.616
> Kabsch RMSD of backbone atoms in res. A[2..107],for model 12 is: 0.408
> Kabsch RMSD of backbone atoms in res. A[2..107],for model 13 is: 0.405
> Kabsch RMSD of backbone atoms in res. A[2..107],for model 14 is: 0.386
> Kabsch RMSD of backbone atoms in res. A[2..107],for model 15 is: 0.439
> Kabsch RMSD of backbone atoms in res. A[2..107],for model 16 is: 0.427
> Kabsch RMSD of backbone atoms in res. A[2..107],for model 17 is: 0.449
> Kabsch RMSD of backbone atoms in res. A[2..107],for model 18 is: 0.453
> Kabsch RMSD of backbone atoms in res. A[2..107],for model 19 is: 0.354
> Kabsch RMSD of backbone atoms in res. A[2..107],for model 20 is: 0.359
>
> Kabsch RMSD statistics for 20 structures:
> Mean RMSD using as refer. str. `average' for res.[2..107], is: 0.422
> Range of RMSD values to reference struct. is 0.265 to 0.616
> Kabsch RMSD of heavy atoms in res. A[2..107],for model 1 is: 0.730
> Kabsch RMSD of heavy atoms in res. A[2..107],for model 2 is: 0.865
> Kabsch RMSD of heavy atoms in res. A[2..107],for model 3 is: 0.679
> Kabsch RMSD of heavy atoms in res. A[2..107],for model 4 is: 0.765
> Kabsch RMSD of heavy atoms in res. A[2..107],for model 5 is: 0.619
> Kabsch RMSD of heavy atoms in res. A[2..107],for model 6 is: 0.651
> Kabsch RMSD of heavy atoms in res. A[2..107],for model 7 is: 0.850
> Kabsch RMSD of heavy atoms in res. A[2..107],for model 8 is: 0.616
> Kabsch RMSD of heavy atoms in res. A[2..107],for model 9 is: 0.560 (*)
> Kabsch RMSD of heavy atoms in res. A[2..107],for model 10 is: 0.674
> Kabsch RMSD of heavy atoms in res. A[2..107],for model 11 is: 0.829
> Kabsch RMSD of heavy atoms in res. A[2..107],for model 12 is: 0.804
> Kabsch RMSD of heavy atoms in res. A[2..107],for model 13 is: 0.813
> Kabsch RMSD of heavy atoms in res. A[2..107],for model 14 is: 0.670
> Kabsch RMSD of heavy atoms in res. A[2..107],for model 15 is: 0.844
> Kabsch RMSD of heavy atoms in res. A[2..107],for model 16 is: 0.695
> Kabsch RMSD of heavy atoms in res. A[2..107],for model 17 is: 0.649
> Kabsch RMSD of heavy atoms in res. A[2..107],for model 18 is: 0.677
> Kabsch RMSD of heavy atoms in res. A[2..107],for model 19 is: 0.636
> Kabsch RMSD of heavy atoms in res. A[2..107],for model 20 is: 0.769
>
> Kabsch RMSD statistics for 20 structures:
> Mean RMSD using as refer. str. `average' for res.[2..107], is: 0.720
> Range of RMSD values to reference struct. is 0.560 to 0.865
Text report of backbone RMSD for entire protein
> Kabsch RMSD of backb atoms in res. *[1..108],for model 1 is: 0.506
> Kabsch RMSD of backb atoms in res. *[1..108],for model 2 is: 0.533
> Kabsch RMSD of backb atoms in res. *[1..108],for model 3 is: 0.454
> Kabsch RMSD of backb atoms in res. *[1..108],for model 4 is: 0.552
> Kabsch RMSD of backb atoms in res. *[1..108],for model 5 is: 0.399
> Kabsch RMSD of backb atoms in res. *[1..108],for model 6 is: 0.421
> Kabsch RMSD of backb atoms in res. *[1..108],for model 7 is: 0.474
> Kabsch RMSD of backb atoms in res. *[1..108],for model 8 is: 0.394
> Kabsch RMSD of backb atoms in res. *[1..108],for model 9 is: 0.273 (*)
> Kabsch RMSD of backb atoms in res. *[1..108],for model 10 is: 0.406
> Kabsch RMSD of backb atoms in res. *[1..108],for model 11 is: 0.642
> Kabsch RMSD of backb atoms in res. *[1..108],for model 12 is: 0.428
> Kabsch RMSD of backb atoms in res. *[1..108],for model 13 is: 0.457
> Kabsch RMSD of backb atoms in res. *[1..108],for model 14 is: 0.394
> Kabsch RMSD of backb atoms in res. *[1..108],for model 15 is: 0.520
> Kabsch RMSD of backb atoms in res. *[1..108],for model 16 is: 0.440
> Kabsch RMSD of backb atoms in res. *[1..108],for model 17 is: 0.454
> Kabsch RMSD of backb atoms in res. *[1..108],for model 18 is: 0.484
> Kabsch RMSD of backb atoms in res. *[1..108],for model 19 is: 0.363
> Kabsch RMSD of backb atoms in res. *[1..108],for model 20 is: 0.382
>
> Kabsch RMSD statistics for 20 structures:
> Mean RMSD using as refer. str. `average' for res.[1..108], is: 0.449
> Range of RMSD values to reference struct. is 0.273 to 0.642
Text report of heavy atom RMSD for entire protein
> Kabsch RMSD of heavy atoms in res. *[1..108],for model 1 is: 0.755
> Kabsch RMSD of heavy atoms in res. *[1..108],for model 2 is: 0.864
> Kabsch RMSD of heavy atoms in res. *[1..108],for model 3 is: 0.691
> Kabsch RMSD of heavy atoms in res. *[1..108],for model 4 is: 0.827
> Kabsch RMSD of heavy atoms in res. *[1..108],for model 5 is: 0.695
> Kabsch RMSD of heavy atoms in res. *[1..108],for model 6 is: 0.678
> Kabsch RMSD of heavy atoms in res. *[1..108],for model 7 is: 0.877
> Kabsch RMSD of heavy atoms in res. *[1..108],for model 8 is: 0.699
> Kabsch RMSD of heavy atoms in res. *[1..108],for model 9 is: 0.579 (*)
> Kabsch RMSD of heavy atoms in res. *[1..108],for model 10 is: 0.698
> Kabsch RMSD of heavy atoms in res. *[1..108],for model 11 is: 0.869
> Kabsch RMSD of heavy atoms in res. *[1..108],for model 12 is: 0.830
> Kabsch RMSD of heavy atoms in res. *[1..108],for model 13 is: 0.853
> Kabsch RMSD of heavy atoms in res. *[1..108],for model 14 is: 0.682
> Kabsch RMSD of heavy atoms in res. *[1..108],for model 15 is: 0.907
> Kabsch RMSD of heavy atoms in res. *[1..108],for model 16 is: 0.709
> Kabsch RMSD of heavy atoms in res. *[1..108],for model 17 is: 0.682
> Kabsch RMSD of heavy atoms in res. *[1..108],for model 18 is: 0.872
> Kabsch RMSD of heavy atoms in res. *[1..108],for model 19 is: 0.656
> Kabsch RMSD of heavy atoms in res. *[1..108],for model 20 is: 0.835
>
> Kabsch RMSD statistics for 20 structures:
> Mean RMSD using as refer. str. `average' for res.[1..108], is: 0.763
> Range of RMSD values to reference struct. is 0.579 to 0.907
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 0.4 0.4 0.4
All heavy atoms 0.8 0.7 0.7
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 >>>----------+
| |
| PFR193A_R3_em_bcr3_020.rin 0.0 2120 residues |
| |
| Ramachandran plot: 91.6% core 8.4% allow 0.0% gener 0.0% disall |
| |
| All Ramachandrans: 0 labelled residues (out of2120) |
+| Chi1-chi2 plots: 7 labelled residues (out of1160) |
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
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
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
2 -0.54
3 0.10
4 -0.58
5 -1.35
6 -0.95
7 -0.05
8 -0.05
9 -0.64
10 0.24
11 -0.28
12 -0.51
13 0.03
14 0.08
15 0.27
16 0.24
17 -0.78
18 -0.71
19 0.06
20 -0.68
21 -0.98
22 -1.31
23 -0.49
24 0.50
25 -0.69
26 -0.40
27 -0.52
28 0.33
29 -0.46
30 -0.10
31 -1.16
32 -0.82
33 0.92
34 -0.48
35 -0.85
36 -0.56
37 -0.83
38 -1.50
39 -0.95
40 -0.43
41 0.21
42 -0.66
43 -0.44
44 -0.32
45 -1.04
46 0.44
47 0.92
48 -0.13
49 -1.46
50 -1.14
51 -1.51
52 -0.55
53 -0.79
54 0.03
55 -0.35
56 -0.69
57 -0.82
58 -0.15
59 -0.76
60 -1.01
61 -0.53
62 -0.64
63 -0.33
64 0.33
65 -0.47
66 0.05
67 -0.10
68 -0.80
69 -0.23
70 -1.05
71 0.36
72 -0.68
73 -0.95
74 -0.56
75 -0.52
76 -0.31
77 -0.06
78 -0.55
79 -0.25
80 -0.35
81 -1.60
82 0.26
83 0.27
84 -1.17
85 0.52
86 -0.06
87 -0.61
88 -0.19
89 0.27
90 -0.45
91 -0.95
92 0.39
93 -0.92
94 -0.45
95 0.06
96 0.16
97 0.38
98 0.18
99 -0.79
100 0.40
101 -0.90
102 -0.06
103 0.29
104 -0.69
105 0.25
106 -0.07
107 -0.38
#Reported_Model_Average -0.383
#Overall_Average_Reported -0.383
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
2 0.16
3 0.39
4 -0.58
5 -0.51
6 -0.09
7 0.16
8 -0.35
9 0.00
10 0.56
11 0.46
12 -0.51
13 0.03
14 0.23
15 0.45
16 0.39
17 -0.78
18 0.01
19 0.55
20 -0.13
21 -0.26
22 -1.31
23 0.15
24 0.48
25 0.16
26 0.08
27 -0.66
28 0.21
29 -0.12
30 -0.10
31 -0.14
32 -0.82
33 0.92
34 -0.28
35 -0.85
36 0.01
37 -0.83
38 -0.59
39 -0.20
40 0.41
41 0.35
42 0.08
43 0.16
44 0.02
45 -0.13
46 0.71
47 0.92
48 0.40
49 -0.55
50 -0.39
51 -0.64
52 -0.41
53 -0.83
54 0.28
55 -0.40
56 -0.24
57 0.04
58 -0.15
59 -0.76
60 -0.13
61 0.19
62 0.01
63 0.21
64 0.48
65 0.01
66 0.31
67 -0.13
68 -0.32
69 -0.38
70 -0.21
71 0.36
72 -0.09
73 -0.16
74 0.10
75 -0.52
76 0.26
77 0.18
78 0.11
79 0.32
80 0.32
81 -1.60
82 0.46
83 0.43
84 -0.61
85 0.61
86 0.57
87 -0.16
88 0.10
89 0.31
90 0.18
91 -0.10
92 0.64
93 -0.28
94 0.29
95 0.58
96 0.60
97 -0.03
98 0.44
99 -0.79
100 0.58
101 -1.08
102 0.14
103 0.50
104 -0.42
105 0.47
106 -0.06
107 0.27
#Reported_Model_Average -0.018
#Overall_Average_Reported -0.018
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
2 0.28 0.28 0.28 0.04 0.28 0.28 0.28 0.28 0.04 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.04 0.28
3 0.71 0.71 0.71 1.04 0.71 0.71 0.71 0.71 1.04 0.71 0.71 1.04 0.71 1.04 0.71 1.04 1.04 0.71 1.04 0.71
4 -0.07 -0.11 -0.07 -0.07 -0.07 0.64 -0.07 0.64 -0.11 -0.07 -0.07 -0.07 0.64 -0.07 0.64 -0.07 -0.07 -0.07 -0.11 -0.07
5 0.34 0.34 0.51 0.34 0.51 0.34 0.34 0.51 0.51 0.51 0.34 0.34 0.51 0.34 0.34 0.51 0.34 0.34 0.34 0.34
6 1.07 1.07 1.07 0.36 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07
7 0.79 0.79 0.95 0.79 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.79 0.79 0.79 0.79 0.95 0.79 0.79 0.95 0.95
8 0.71 1.18 1.18 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
9 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41
10 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50
11 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55
12 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
13 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44
14 0.51 0.51 0.23 0.23 0.23 0.23 0.51 0.51 0.51 0.51 0.51 0.51 0.23 0.51 0.51 0.51 0.51 0.23 0.51 0.51
15 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
16 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
17 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75
18 0.66 -0.09 0.66 -0.09 -0.40 -0.40 -0.09 -0.09 0.66 -0.09 -0.09 0.66 0.66 0.66 -0.09 0.66 0.66 -0.09 0.66 0.66
19 0.51 0.41 0.51 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.51 0.51 0.41 0.51 0.41 0.41 0.51 0.51
20 0.47 0.47 0.47 0.47 0.47 0.47 0.47 0.47 0.47 0.47 0.47 0.47 0.47 0.47 0.47 0.47 0.47 0.47 0.47 0.47
21 -0.68 -1.14 -0.68 -1.14 -0.68 -0.68 -1.14 -0.68 -1.14 -1.14 -0.68 -1.14 -0.68 -0.68 -1.14 -0.68 -1.14 -1.14 -0.68 -0.68
22 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59
23 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41
24 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
25 0.41 0.41 -0.68 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41
26 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18
27 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80
28 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18
29 0.55 0.55 0.35 0.35 0.55 0.55 0.35 0.35 0.35 0.35 0.35 0.55 0.35 0.55 0.55 0.35 0.35 0.55 0.35 0.35
30 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26
31 -0.68 -0.68 -0.68 -0.68 -0.33 -0.68 -0.68 -0.33 -0.33 -0.68 -0.33 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.33 -0.68
32 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
33 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
34 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94
35 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
36 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
37 -0.88 -0.88 -0.88 -1.01 -0.88 -0.88 -0.88 -0.88 -0.88 -0.88 -0.88 -0.88 -0.88 -0.88 -0.88 -0.88 -0.88 -0.88 -0.88 -0.88
38 0.65 0.65 0.65 0.49 0.65 0.49 0.49 0.65 0.65 0.65 0.49 0.65 0.65 0.49 0.65 0.49 0.65 0.65 0.65 0.49
39 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95
40 0.35 0.55 0.55 0.35 0.55 0.35 0.55 0.35 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55
41 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18
42 0.84 0.19 0.84 0.84 0.84 0.84 0.84 0.84 0.84 0.84 0.84 0.84 0.84 0.84 0.84 0.84 0.84 0.84 0.84 0.84
43 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18
44 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09
45 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50
46 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 0.51
47 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
48 -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
49 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33
50 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.30 1.09 1.09 1.09 1.09 1.09 1.09
51 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55
52 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00
53 0.83 0.83 0.83 0.83 0.83 0.83 0.83 0.83 0.07 0.83 0.83 0.83 0.07 0.83 0.07 0.83 0.83 0.83 0.83 0.83
54 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 -0.17 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79
55 1.18 1.18 1.18 0.44 1.18 1.18 1.18 1.18 1.18 0.44 1.18 1.18 1.18 1.18 1.18 0.44 1.18 1.18 1.18 1.18
56 0.65 0.65 0.49 0.49 0.65 0.49 0.49 0.65 0.49 0.65 0.65 0.49 0.49 0.65 0.49 0.49 0.65 0.49 0.65 0.65
57 1.07 0.36 1.07 1.07 0.36 1.07 1.07 1.07 1.07 0.36 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07 0.36
58 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
59 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44
60 0.47 0.47 0.47 0.47 0.47 0.47 -0.10 0.47 0.47 -0.10 -0.10 -0.10 0.47 0.47 0.47 0.47 0.47 -0.10 0.47 0.47
61 0.28 0.28 0.28 -0.59 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
62 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41
63 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55
64 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.44 0.08 0.44 0.08 0.08 0.44 0.08 0.08
65 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07 0.36 1.07 1.07 0.36 1.07 1.07 1.07 1.07 1.07
66 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79
67 0.96 0.96 0.96 0.96 0.96 0.96 0.96 0.96 0.96 0.96 0.96 0.96 0.96 0.96 0.96 0.96 0.96 0.96 0.96 0.96
68 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.65 0.49 0.49 0.49
69 0.92 0.92 0.92 0.92 0.92 0.92 0.92 0.92 0.92 0.92 0.92 0.92 0.92 0.92 0.92 0.92 0.92 0.92 0.92 0.92
70 0.08 0.08 0.55 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.55 0.08 0.08 0.08 0.08 0.08 0.08 0.08
71 -0.11 -0.07 -0.11 -0.07 -0.11 -0.11 -0.11 -0.07 -0.07 -0.07 -0.07 -0.11 -0.11 -0.07 -0.07 -0.07 -0.11 -0.07 -0.11 -0.11
72 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
73 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03
74 -0.59 -0.59 -0.59 -0.59 -0.59 -0.59 -0.59 -0.59 -0.59 0.28 -0.59 -0.59 -0.59 -0.59 -0.59 -0.59 -0.59 -0.59 -0.59 -0.59
75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75
76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76
77 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09
78 0.19 0.19 0.19 0.19 0.19 0.19 0.19 0.19 0.19 0.19 0.19 0.19 0.19 0.19 0.19 0.19 0.19 0.19 0.19 0.19
79 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50
80 0.00 0.00 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 0.00
81 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59
82 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.79 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95
83 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18
84 0.34 0.34 0.34 -0.83 0.34 -0.83 -1.97 -1.97 0.34 0.34 0.34 0.34 0.34 -0.83 0.34 -1.97 0.34 0.34 0.34 0.34
85 0.28 0.28 0.28 0.28 0.28 0.28 -0.46 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
86 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
87 0.41 0.41 0.41 0.51 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.51 0.41 0.41 0.51 0.41 0.41
88 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
89 -0.74 -0.09 -0.09 -0.74 -0.09 -0.09 -0.09 -0.09 -0.09 -0.09 -0.09 -0.09 -0.09 -0.09 -0.74 -0.09 -0.09 -0.74 -0.74 -0.09
90 -0.74 -0.80 -0.74 -0.80 -0.80 -0.80 -0.80 -0.74 -0.74 -0.74 -0.74 -0.74 -0.74 -0.74 -0.80 -0.80 -0.74 -0.74 -0.74 -0.80
91 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -1.13 -0.46 -0.46 -0.46 -0.46 -1.13 -1.13 -0.46
92 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68
93 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 0.51
94 0.04 0.04 0.28 0.28 0.28 0.28 0.28 0.04 0.28 0.04 0.04 0.28 0.28 0.04 0.28 0.04 0.28 0.28 0.28 0.28
95 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41
96 0.51 -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
97 -0.26 0.51 0.51 0.51 0.51 0.51 0.51 0.51 -0.26 0.51 -0.26 0.09 0.51 0.51 0.51 0.51 -0.26 -0.26 -0.26 0.51
98 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
99 0.59 0.59 -0.52 0.59 -0.52 0.59 0.59 -0.52 0.59 0.59 0.59 -0.52 0.59 0.59 0.59 -0.52 0.59 0.59 0.59 0.59
100 0.79 0.95 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79
101 0.37 0.37 0.37 0.37 0.37 0.37 0.37 0.37 0.37 0.37 0.37 0.37 0.37 0.37 0.37 0.37 0.37 0.37 0.37 0.37
102 -0.03 -0.61 -0.03 -0.61 -0.61 -0.03 -0.61 -0.61 -0.61 -0.61 -0.61 -0.03 -0.61 -0.61 -0.61 -0.61 -0.61 -0.03 -0.61 -0.03
103 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
104 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49
105 0.71 0.71 1.18 0.71 0.71 1.18 1.18 1.18 1.18 0.71 1.18 1.18 0.71 1.18 1.18 1.18 1.18 1.18 1.18 0.71
106 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
107 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68
#Reported_Model_Average 0.462 0.445 0.469 0.413 0.449 0.462 0.419 0.446 0.463 0.450 0.456 0.445 0.471 0.469 0.455 0.429 0.469 0.447 0.462 0.470
#Overall_Average_Reported 0.453
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
2 0.28 0.28 0.28 0.04 0.28 0.28 0.28 0.28 0.04 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.28 0.04 0.28
3 0.71 0.71 0.71 1.04 0.71 0.71 0.71 0.71 1.04 0.71 0.71 1.04 0.71 1.04 0.71 1.04 1.04 0.71 1.04 0.71
4 -0.07 -0.11 -0.07 -0.07 -0.07 0.64 -0.07 0.64 -0.11 -0.07 -0.07 -0.07 0.64 -0.07 0.64 -0.07 -0.07 -0.07 -0.11 -0.07
5 0.34 0.34 0.51 0.34 0.51 0.34 0.34 0.51 0.51 0.51 0.34 0.34 0.51 0.34 0.34 0.51 0.34 0.34 0.34 0.34
6 1.07 1.07 1.07 0.36 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07
7 0.79 0.79 0.95 0.79 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.79 0.79 0.79 0.79 0.95 0.79 0.79 0.95 0.95
8 0.71 1.18 1.18 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
9 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41
10 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50
11 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55
12 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
13 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44
14 0.51 0.51 0.23 0.23 0.23 0.23 0.51 0.51 0.51 0.51 0.51 0.51 0.23 0.51 0.51 0.51 0.51 0.23 0.51 0.51
15 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
16 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
17 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75
18 0.66 -0.09 0.66 -0.09 -0.40 -0.40 -0.09 -0.09 0.66 -0.09 -0.09 0.66 0.66 0.66 -0.09 0.66 0.66 -0.09 0.66 0.66
19 0.51 0.41 0.51 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.51 0.51 0.41 0.51 0.41 0.41 0.51 0.51
20 0.47 0.47 0.47 0.47 0.47 0.47 0.47 0.47 0.47 0.47 0.47 0.47 0.47 0.47 0.47 0.47 0.47 0.47 0.47 0.47
21 -0.68 -1.14 -0.68 -1.14 -0.68 -0.68 -1.14 -0.68 -1.14 -1.14 -0.68 -1.14 -0.68 -0.68 -1.14 -0.68 -1.14 -1.14 -0.68 -0.68
22 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59
23 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41
24 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
25 0.41 0.41 -0.68 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41
26 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18
27 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80
28 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18
29 0.55 0.55 0.35 0.35 0.55 0.55 0.35 0.35 0.35 0.35 0.35 0.55 0.35 0.55 0.55 0.35 0.35 0.55 0.35 0.35
30 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26 -0.26
31 -0.68 -0.68 -0.68 -0.68 -0.33 -0.68 -0.68 -0.33 -0.33 -0.68 -0.33 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.33 -0.68
32 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
33 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
34 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94 -0.94
35 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
36 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
37 -0.88 -0.88 -0.88 -1.01 -0.88 -0.88 -0.88 -0.88 -0.88 -0.88 -0.88 -0.88 -0.88 -0.88 -0.88 -0.88 -0.88 -0.88 -0.88 -0.88
38 0.65 0.65 0.65 0.49 0.65 0.49 0.49 0.65 0.65 0.65 0.49 0.65 0.65 0.49 0.65 0.49 0.65 0.65 0.65 0.49
39 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95
40 0.35 0.55 0.55 0.35 0.55 0.35 0.55 0.35 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55
41 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18
42 0.84 0.19 0.84 0.84 0.84 0.84 0.84 0.84 0.84 0.84 0.84 0.84 0.84 0.84 0.84 0.84 0.84 0.84 0.84 0.84
43 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18
44 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09
45 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50
46 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 0.51
47 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
48 -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
49 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33 -1.33
50 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.30 1.09 1.09 1.09 1.09 1.09 1.09
51 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55
52 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00
53 0.83 0.83 0.83 0.83 0.83 0.83 0.83 0.83 0.07 0.83 0.83 0.83 0.07 0.83 0.07 0.83 0.83 0.83 0.83 0.83
54 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 -0.17 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79
55 1.18 1.18 1.18 0.44 1.18 1.18 1.18 1.18 1.18 0.44 1.18 1.18 1.18 1.18 1.18 0.44 1.18 1.18 1.18 1.18
56 0.65 0.65 0.49 0.49 0.65 0.49 0.49 0.65 0.49 0.65 0.65 0.49 0.49 0.65 0.49 0.49 0.65 0.49 0.65 0.65
57 1.07 0.36 1.07 1.07 0.36 1.07 1.07 1.07 1.07 0.36 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07 0.36
58 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
59 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44 0.44
60 0.47 0.47 0.47 0.47 0.47 0.47 -0.10 0.47 0.47 -0.10 -0.10 -0.10 0.47 0.47 0.47 0.47 0.47 -0.10 0.47 0.47
61 0.28 0.28 0.28 -0.59 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
62 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41
63 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55 0.55
64 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.44 0.08 0.44 0.08 0.08 0.44 0.08 0.08
65 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07 1.07 0.36 1.07 1.07 0.36 1.07 1.07 1.07 1.07 1.07
66 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79
67 0.96 0.96 0.96 0.96 0.96 0.96 0.96 0.96 0.96 0.96 0.96 0.96 0.96 0.96 0.96 0.96 0.96 0.96 0.96 0.96
68 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.65 0.49 0.49 0.49
69 0.92 0.92 0.92 0.92 0.92 0.92 0.92 0.92 0.92 0.92 0.92 0.92 0.92 0.92 0.92 0.92 0.92 0.92 0.92 0.92
70 0.08 0.08 0.55 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.55 0.08 0.08 0.08 0.08 0.08 0.08 0.08
71 -0.11 -0.07 -0.11 -0.07 -0.11 -0.11 -0.11 -0.07 -0.07 -0.07 -0.07 -0.11 -0.11 -0.07 -0.07 -0.07 -0.11 -0.07 -0.11 -0.11
72 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
73 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03 -0.03
74 -0.59 -0.59 -0.59 -0.59 -0.59 -0.59 -0.59 -0.59 -0.59 0.28 -0.59 -0.59 -0.59 -0.59 -0.59 -0.59 -0.59 -0.59 -0.59 -0.59
75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75 1.75
76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76 -0.76
77 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09 1.09
78 0.19 0.19 0.19 0.19 0.19 0.19 0.19 0.19 0.19 0.19 0.19 0.19 0.19 0.19 0.19 0.19 0.19 0.19 0.19 0.19
79 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50 1.50
80 0.00 0.00 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 0.00
81 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59 0.59
82 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.79 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95 0.95
83 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18 1.18
84 0.34 0.34 0.34 -0.83 0.34 -0.83 -1.97 -1.97 0.34 0.34 0.34 0.34 0.34 -0.83 0.34 -1.97 0.34 0.34 0.34 0.34
85 0.28 0.28 0.28 0.28 0.28 0.28 -0.46 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
86 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
87 0.41 0.41 0.41 0.51 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.51 0.41 0.41 0.51 0.41 0.41
88 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
89 -0.74 -0.09 -0.09 -0.74 -0.09 -0.09 -0.09 -0.09 -0.09 -0.09 -0.09 -0.09 -0.09 -0.09 -0.74 -0.09 -0.09 -0.74 -0.74 -0.09
90 -0.74 -0.80 -0.74 -0.80 -0.80 -0.80 -0.80 -0.74 -0.74 -0.74 -0.74 -0.74 -0.74 -0.74 -0.80 -0.80 -0.74 -0.74 -0.74 -0.80
91 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -1.13 -0.46 -0.46 -0.46 -0.46 -1.13 -1.13 -0.46
92 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68
93 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 0.51
94 0.04 0.04 0.28 0.28 0.28 0.28 0.28 0.04 0.28 0.04 0.04 0.28 0.28 0.04 0.28 0.04 0.28 0.28 0.28 0.28
95 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41
96 0.51 -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
97 -0.26 0.51 0.51 0.51 0.51 0.51 0.51 0.51 -0.26 0.51 -0.26 0.09 0.51 0.51 0.51 0.51 -0.26 -0.26 -0.26 0.51
98 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
99 0.59 0.59 -0.52 0.59 -0.52 0.59 0.59 -0.52 0.59 0.59 0.59 -0.52 0.59 0.59 0.59 -0.52 0.59 0.59 0.59 0.59
100 0.79 0.95 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79 0.79
101 0.37 0.37 0.37 0.37 0.37 0.37 0.37 0.37 0.37 0.37 0.37 0.37 0.37 0.37 0.37 0.37 0.37 0.37 0.37 0.37
102 -0.03 -0.61 -0.03 -0.61 -0.61 -0.03 -0.61 -0.61 -0.61 -0.61 -0.61 -0.03 -0.61 -0.61 -0.61 -0.61 -0.61 -0.03 -0.61 -0.03
103 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
104 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49 0.49
105 0.71 0.71 1.18 0.71 0.71 1.18 1.18 1.18 1.18 0.71 1.18 1.18 0.71 1.18 1.18 1.18 1.18 1.18 1.18 0.71
106 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
107 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68 -0.68
#Reported_Model_Average 0.462 0.445 0.469 0.413 0.449 0.462 0.419 0.446 0.463 0.450 0.456 0.445 0.471 0.469 0.455 0.429 0.469 0.447 0.462 0.470
#Overall_Average_Reported 0.453
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
2.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
3.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
4.000 1 0 0 1 0 1 0 1 0 1 1 0 0 1 0 0 0 1 0 0
5.000 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0
6.000 0 0 1 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 1 0
7.000 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 1 0 0
8.000 0 0 1 2 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 0
10.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
11.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
14.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
15.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
16.000 0 1 0 0 0 0 0 2 0 2 1 1 0 1 0 0 1 1 0 0
17.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
18.000 1 0 1 0 0 1 0 1 0 0 0 1 1 1 1 1 1 0 1 1
19.000 1 0 1 0 0 1 0 1 0 0 0 0 1 1 1 1 1 0 1 1
20.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
21.000 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0
22.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
23.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
24.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
25.000 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0
26.000 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0
27.000 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
28.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
29.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
30.000 0 0 1 0 0 0 0 1 1 0 0 0 1 0 0 0 0 0 1 0
31.000 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0
32.000 1 0 0 1 0 1 0 1 0 1 1 0 0 1 0 0 0 1 0 0
33.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
34.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
35.000 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 0
36.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
37.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
38.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
39.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 1 0 1 0 0 0 1 0 1 1 1 2 0 0 0 1 0 1 0 1
42.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
43.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
44.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
45.000 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
46.000 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
47.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
48.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
49.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
50.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0
51.000 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 1 1 1 0 1
52.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
53.000 0 0 0 0 0 0 2 0 0 0 0 2 0 0 0 0 0 0 0 0
54.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
55.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
56.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
57.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
58.000 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 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 1 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
64.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
65.000 0 1 0 0 0 0 1 0 0 1 0 1 0 0 0 0 0 0 0 0
66.000 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0
67.000 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 1 1 1 0 1
68.000 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0
69.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 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 0
71.000 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 0 1
72.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
73.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
74.000 1 1 1 1 1 1 1 1 1 0 1 0 2 1 1 1 2 1 1 1
75.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
76.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
77.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
78.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
79.000 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
80.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
81.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
82.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
83.000 1 0 1 0 0 0 0 0 1 1 1 2 0 0 0 2 0 1 0 1
84.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
85.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
86.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
87.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
88.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
89.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
90.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
91.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0
92.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
93.000 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
94.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0
95.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
96.000 0 1 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 1 0 0
97.000 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0
98.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
99.000 0 0 0 1 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 0
102.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
103.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
104.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
105.000 0 1 0 0 0 0 0 2 0 2 1 1 0 1 0 0 1 2 0 1
106.000 1 1 1 1 1 1 1 1 1 0 1 0 1 1 1 1 1 1 1 1
107.000 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0
#Reported_Model_Average 0.094 0.075 0.094 0.094 0.038 0.075 0.057 0.132 0.094 0.094 0.094 0.113 0.094 0.094 0.057 0.113 0.094 0.151 0.094 0.094
#Overall_Average_Reported 0.092
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1688:A 4 PRO HA :A 32 GLY 2HA : -0.490: 0
: 1688:A 68 SER 1HB :A 21 LEU 1HD1 : -0.487: 0
: 1688:A 19 ASN 1HB :A 18 VAL O : -0.474: 0
: 1688:A 106 VAL HA :A 74 GLU 2HG : -0.432: 0
: 1688:A 41 VAL 2HG2 :A 83 VAL 2HG2 : -0.408: 0
#sum2 ::2.96 clashscore : 2.96 clashscore B<40
#summary::1688 atoms:1688 atoms B<40:189232 potential dots:11830.0 A^2:5 bumps:5 bumps B<40:601.3 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1688:A 96 ASN 2HB :A 93 ASN 2HB : -0.500: 0
: 1688:A 106 VAL HA :A 74 GLU 2HG : -0.487: 0
: 1688:A 65 LEU 1HB :A 26 VAL HB : -0.470: 0
: 1688:A 16 VAL O :A 105 VAL HA : -0.404: 0
#sum2 ::2.37 clashscore : 2.37 clashscore B<40
#summary::1688 atoms:1688 atoms B<40:189188 potential dots:11820.0 A^2:4 bumps:4 bumps B<40:624.9 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1688:A 19 ASN 1HB :A 18 VAL O : -0.476: 0
: 1688:A 106 VAL HA :A 74 GLU 2HG : -0.440: 0
: 1688:A 41 VAL 2HG2 :A 83 VAL 2HG2 : -0.436: 0
: 1688:A 27 HIS O :A 8 VAL HA : -0.432: 0
: 1688:A 30 ASN 1HB :A 6 LEU 3HD2 : -0.430: 0
#sum2 ::2.96 clashscore : 2.96 clashscore B<40
#summary::1688 atoms:1688 atoms B<40:189482 potential dots:11840.0 A^2:5 bumps:5 bumps B<40:612.1 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1688:A 106 VAL HA :A 74 GLU 2HG : -0.473: 0
: 1688:A 27 HIS O :A 8 VAL HA : -0.428: 0
: 1688:A 8 VAL 3HG1 :A 99 ALA 2HB : -0.411: 0
: 1688:A 4 PRO HA :A 32 GLY 2HA : -0.418: 0
: 1688:A 46 ASN 1HB :A 45 ILE O : -0.402: 0
#sum2 ::2.96 clashscore : 2.96 clashscore B<40
#summary::1688 atoms:1688 atoms B<40:189185 potential dots:11820.0 A^2:5 bumps:5 bumps B<40:650.9 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1688:A 106 VAL HA :A 74 GLU 2HG : -0.457: 0
: 1688:A 79 ILE 1HG1 :A 45 ILE 1HG1 : -0.424: 0
#sum2 ::1.18 clashscore : 1.18 clashscore B<40
#summary::1688 atoms:1688 atoms B<40:189249 potential dots:11830.0 A^2:2 bumps:2 bumps B<40:642.9 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1688:A 67 PHE 2HB :A 51 LYS 2HD : -0.481: 0
: 1688:A 106 VAL HA :A 74 GLU 2HG : -0.462: 0
: 1688:A 19 ASN 1HB :A 18 VAL O : -0.434: 0
: 1688:A 4 PRO HA :A 32 GLY 2HA : -0.433: 0
#sum2 ::2.37 clashscore : 2.37 clashscore B<40
#summary::1688 atoms:1688 atoms B<40:189272 potential dots:11830.0 A^2:4 bumps:4 bumps B<40:622.5 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1688:A 106 VAL HA :A 74 GLU 2HG : -0.462: 0
: 1688:A 53 TRP 2HB :A 41 VAL HB : -0.459: 0
: 1688:A 65 LEU 1HB :A 53 TRP CE3 : -0.413: 0
#sum2 ::1.78 clashscore : 1.78 clashscore B<40
#summary::1688 atoms:1688 atoms B<40:189350 potential dots:11830.0 A^2:3 bumps:3 bumps B<40:611.5 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1688:A 67 PHE 2HB :A 51 LYS 2HD : -0.505: 0
: 1688:A 4 PRO HA :A 32 GLY 2HA : -0.468: 0
: 1688:A 106 VAL HA :A 74 GLU 2HG : -0.460: 0
: 1688:A 105 VAL 2HG2 :A 16 VAL HB : -0.434: 0
: 1688:A 16 VAL O :A 105 VAL HA : -0.408: 0
: 1688:A 30 ASN 1HB :A 6 LEU 3HD2 : -0.431: 0
: 1688:A 19 ASN 1HB :A 18 VAL O : -0.412: 0
#sum2 ::4.15 clashscore : 4.15 clashscore B<40
#summary::1688 atoms:1688 atoms B<40:189349 potential dots:11830.0 A^2:7 bumps:7 bumps B<40:629.8 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1688:A 106 VAL HA :A 74 GLU 2HG : -0.469: 0
: 1688:A 66 THR 2HG2 :A 25 GLU 1HG : -0.434: 0
: 1688:A 31 LEU 3HD2 :A 60 LYS HA : -0.415: 0
: 1688:A 30 ASN 1HB :A 6 LEU 3HD2 : -0.415: 0
: 1688:A 41 VAL 2HG2 :A 83 VAL 2HG2 : -0.406: 0
#sum2 ::2.96 clashscore : 2.96 clashscore B<40
#summary::1688 atoms:1688 atoms B<40:189107 potential dots:11820.0 A^2:5 bumps:5 bumps B<40:616 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1688:A 41 VAL 2HG2 :A 83 VAL 2HG2 : -0.483: 0
: 1688:A 65 LEU 1HB :A 26 VAL HB : -0.432: 0
: 1688:A 16 VAL O :A 105 VAL HA : -0.422: 0
: 1688:A 105 VAL 2HG2 :A 16 VAL HB : -0.420: 0
: 1688:A 4 PRO HA :A 32 GLY 2HA : -0.407: 0
#sum2 ::2.96 clashscore : 2.96 clashscore B<40
#summary::1688 atoms:1688 atoms B<40:189143 potential dots:11820.0 A^2:5 bumps:5 bumps B<40:610.2 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1688:A 4 PRO HA :A 32 GLY 2HA : -0.500: 0
: 1688:A 106 VAL HA :A 74 GLU 2HG : -0.452: 0
: 1688:A 105 VAL 2HG2 :A 16 VAL HB : -0.424: 0
: 1688:A 41 VAL 2HG2 :A 83 VAL 2HG2 : -0.421: 0
: 1688:A 58 GLY 1HA :A 35 GLY 1HA : -0.404: 0
#sum2 ::2.96 clashscore : 2.96 clashscore B<40
#summary::1688 atoms:1688 atoms B<40:189170 potential dots:11820.0 A^2:5 bumps:5 bumps B<40:642.7 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1688:A 97 ASN 1HB :A 83 VAL HB : -0.512: 0
: 1688:A 53 TRP 2HB :A 41 VAL HB : -0.509: 0
: 1688:A 41 VAL 2HG2 :A 83 VAL 2HG2 : -0.439: 0
: 1688:A 65 LEU 1HB :A 53 TRP CE3 : -0.426: 0
: 1688:A 18 VAL HA :A 71 PRO 1HG : -0.419: 0
: 1688:A 105 VAL 2HG2 :A 16 VAL HB : -0.410: 0
#sum2 ::3.55 clashscore : 3.55 clashscore B<40
#summary::1688 atoms:1688 atoms B<40:189032 potential dots:11810.0 A^2:6 bumps:6 bumps B<40:599.9 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1688:A 19 ASN 1HB :A 18 VAL O : -0.466: 0
: 1688:A 106 VAL HA :A 74 GLU 2HG : -0.453: 0
: 1688:A 74 GLU 1HB :A 107 LEU HG : -0.400: 0
: 1688:A 5 ASP O :A 30 ASN HA : -0.423: 0
: 1688:A 7 THR 3HG2 :A 96 ASN 2HB : -0.419: 0
#sum2 ::2.96 clashscore : 2.96 clashscore B<40
#summary::1688 atoms:1688 atoms B<40:189288 potential dots:11830.0 A^2:5 bumps:5 bumps B<40:618.8 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1688:A 4 PRO HA :A 32 GLY 2HA : -0.510: 0
: 1688:A 19 ASN 1HB :A 18 VAL O : -0.490: 0
: 1688:A 106 VAL HA :A 74 GLU 2HG : -0.461: 0
: 1688:A 16 VAL O :A 105 VAL HA : -0.413: 0
: 1688:A 66 THR 2HG2 :A 25 GLU 1HG : -0.400: 0
#sum2 ::2.96 clashscore : 2.96 clashscore B<40
#summary::1688 atoms:1688 atoms B<40:189303 potential dots:11830.0 A^2:5 bumps:5 bumps B<40:605.5 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1688:A 106 VAL HA :A 74 GLU 2HG : -0.445: 0
: 1688:A 19 ASN 1HB :A 18 VAL O : -0.412: 0
: 1688:A 50 TYR CZ :A 69 TRP HA : -0.406: 0
#sum2 ::1.78 clashscore : 1.78 clashscore B<40
#summary::1688 atoms:1688 atoms B<40:189277 potential dots:11830.0 A^2:3 bumps:3 bumps B<40:649.7 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1688:A 96 ASN 2HB :A 7 THR HA : -0.479: 0
: 1688:A 106 VAL HA :A 74 GLU 2HG : -0.471: 0
: 1688:A 67 PHE 2HB :A 51 LYS 2HD : -0.460: 0
: 1688:A 19 ASN 1HB :A 18 VAL O : -0.440: 0
: 1688:A 41 VAL 2HG2 :A 83 VAL 2HG2 : -0.438: 0
: 1688:A 97 ASN 1HB :A 83 VAL HB : -0.421: 0
#sum2 ::3.55 clashscore : 3.55 clashscore B<40
#summary::1688 atoms:1688 atoms B<40:189337 potential dots:11830.0 A^2:6 bumps:6 bumps B<40:622.3 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1688:A 106 VAL HA :A 74 GLU 2HG : -0.470: 0
: 1688:A 107 LEU HG :A 74 GLU 1HB : -0.416: 0
: 1688:A 67 PHE 2HB :A 51 LYS 2HD : -0.469: 0
: 1688:A 19 ASN 1HB :A 18 VAL O : -0.405: 0
: 1688:A 16 VAL O :A 105 VAL HA : -0.404: 0
#sum2 ::2.96 clashscore : 2.96 clashscore B<40
#summary::1688 atoms:1688 atoms B<40:189176 potential dots:11820.0 A^2:5 bumps:5 bumps B<40:641.3 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1688:A 91 GLU 1HB :A 94 GLU 2HG : -0.549: 0
: 1688:A 67 PHE 2HB :A 51 LYS 2HD : -0.493: 0
: 1688:A 106 VAL HA :A 74 GLU 2HG : -0.452: 0
: 1688:A 4 PRO HA :A 32 GLY 2HA : -0.441: 0
: 1688:A 41 VAL 2HG2 :A 83 VAL 2HG2 : -0.429: 0
: 1688:A 71 PRO 1HB :A 105 VAL 1HG1 : -0.416: 0
: 1688:A 16 VAL O :A 105 VAL HA : -0.406: 0
: 1688:A 96 ASN 2HB :A 7 THR HA : -0.401: 0
#sum2 ::4.74 clashscore : 4.74 clashscore B<40
#summary::1688 atoms:1688 atoms B<40:189164 potential dots:11820.0 A^2:8 bumps:8 bumps B<40:626.6 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1688:A 19 ASN 1HB :A 18 VAL O : -0.474: 0
: 1688:A 106 VAL HA :A 74 GLU 2HG : -0.466: 0
: 1688:A 68 SER 1HB :A 21 LEU 1HD1 : -0.428: 0
: 1688:A 58 GLY 1HA :A 35 GLY 1HA : -0.427: 0
: 1688:A 30 ASN 1HB :A 6 LEU 3HD2 : -0.406: 0
#sum2 ::2.96 clashscore : 2.96 clashscore B<40
#summary::1688 atoms:1688 atoms B<40:189124 potential dots:11820.0 A^2:5 bumps:5 bumps B<40:617.3 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1688:A 19 ASN 1HB :A 18 VAL O : -0.471: 0
: 1688:A 67 PHE 2HB :A 51 LYS 2HD : -0.445: 0
: 1688:A 106 VAL HA :A 74 GLU 2HG : -0.435: 0
: 1688:A 41 VAL 2HG2 :A 83 VAL 2HG2 : -0.415: 0
: 1688:A 71 PRO 1HB :A 105 VAL 1HG1 : -0.407: 0
#sum2 ::2.96 clashscore : 2.96 clashscore B<40
#summary::1688 atoms:1688 atoms B<40:189340 potential dots:11830.0 A^2:5 bumps:5 bumps B<40:610.6 score
Output from PDB validation software
Summary from PDB validation
May. 10, 14:26:34 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 0.011 Angstroms
All covalent bonds lie within a 6.0*RMSD range about the
standard dictionary values.
*** Covalent Angle Values:
The RMS deviation for covalent angles relative to the standard
dictionary is 0.6 degrees.
All covalent bond angles lie within a 6.0*RMSD range about the
standard dictionary values.
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 19 1HD2
1 A ASN 19 2HD2
1 A ASN 30 1HD2
1 A ASN 30 2HD2
1 A ASN 46 1HD2
1 A ASN 46 2HD2
1 A ASN 52 1HD2
1 A ASN 52 2HD2
1 A GLN 73 1HE2
1 A GLN 73 2HE2
1 A ASN 80 1HD2
1 A ASN 80 2HD2
1 A ASN 87 1HD2
1 A ASN 87 2HD2
1 A ASN 93 1HD2
1 A ASN 93 2HD2
1 A ASN 95 1HD2
1 A ASN 95 2HD2
1 A ASN 96 1HD2
1 A ASN 96 2HD2
1 A ASN 97 1HD2
1 A ASN 97 2HD2
2 A ASN 19 1HD2
2 A ASN 19 2HD2
2 A ASN 30 1HD2
2 A ASN 30 2HD2
2 A ASN 46 1HD2
2 A ASN 46 2HD2
2 A ASN 52 1HD2
2 A ASN 52 2HD2
2 A GLN 73 1HE2
2 A GLN 73 2HE2
2 A ASN 80 1HD2
2 A ASN 80 2HD2
2 A ASN 87 1HD2
2 A ASN 87 2HD2
2 A ASN 93 1HD2
2 A ASN 93 2HD2
2 A ASN 95 1HD2
2 A ASN 95 2HD2
2 A ASN 96 1HD2
2 A ASN 96 2HD2
2 A ASN 97 1HD2
2 A ASN 97 2HD2
3 A ASN 19 1HD2
3 A ASN 19 2HD2
3 A ASN 30 1HD2
3 A ASN 30 2HD2
3 A ASN 46 1HD2
3 A ASN 46 2HD2
3 A ASN 52 1HD2
3 A ASN 52 2HD2
3 A GLN 73 1HE2
3 A GLN 73 2HE2
3 A ASN 80 1HD2
3 A ASN 80 2HD2
3 A ASN 87 1HD2
3 A ASN 87 2HD2
3 A ASN 93 1HD2
3 A ASN 93 2HD2
3 A ASN 95 1HD2
3 A ASN 95 2HD2
3 A ASN 96 1HD2
3 A ASN 96 2HD2
3 A ASN 97 1HD2
3 A ASN 97 2HD2
4 A ASN 19 1HD2
4 A ASN 19 2HD2
4 A ASN 30 1HD2
4 A ASN 30 2HD2
4 A ASN 46 1HD2
4 A ASN 46 2HD2
4 A ASN 52 1HD2
4 A ASN 52 2HD2
4 A GLN 73 1HE2
4 A GLN 73 2HE2
4 A ASN 80 1HD2
4 A ASN 80 2HD2
4 A ASN 87 1HD2
4 A ASN 87 2HD2
4 A ASN 93 1HD2
4 A ASN 93 2HD2
4 A ASN 95 1HD2
4 A ASN 95 2HD2
4 A ASN 96 1HD2
4 A ASN 96 2HD2
4 A ASN 97 1HD2
4 A ASN 97 2HD2
5 A ASN 19 1HD2
5 A ASN 19 2HD2
5 A ASN 30 1HD2
5 A ASN 30 2HD2
5 A ASN 46 1HD2
5 A ASN 46 2HD2
5 A ASN 52 1HD2
5 A ASN 52 2HD2
5 A GLN 73 1HE2
5 A GLN 73 2HE2
5 A ASN 80 1HD2
5 A ASN 80 2HD2
5 A ASN 87 1HD2
5 A ASN 87 2HD2
5 A ASN 93 1HD2
5 A ASN 93 2HD2
5 A ASN 95 1HD2
5 A ASN 95 2HD2
5 A ASN 96 1HD2
5 A ASN 96 2HD2
5 A ASN 97 1HD2
5 A ASN 97 2HD2
6 A ASN 19 1HD2
6 A ASN 19 2HD2
6 A ASN 30 1HD2
6 A ASN 30 2HD2
6 A ASN 46 1HD2
6 A ASN 46 2HD2
6 A ASN 52 1HD2
6 A ASN 52 2HD2
6 A GLN 73 1HE2
6 A GLN 73 2HE2
6 A ASN 80 1HD2
6 A ASN 80 2HD2
6 A ASN 87 1HD2
6 A ASN 87 2HD2
6 A ASN 93 1HD2
6 A ASN 93 2HD2
6 A ASN 95 1HD2
6 A ASN 95 2HD2
6 A ASN 96 1HD2
6 A ASN 96 2HD2
6 A ASN 97 1HD2
6 A ASN 97 2HD2
7 A ASN 19 1HD2
7 A ASN 19 2HD2
7 A ASN 30 1HD2
7 A ASN 30 2HD2
7 A ASN 46 1HD2
7 A ASN 46 2HD2
7 A ASN 52 1HD2
7 A ASN 52 2HD2
7 A GLN 73 1HE2
7 A GLN 73 2HE2
7 A ASN 80 1HD2
7 A ASN 80 2HD2
7 A ASN 87 1HD2
7 A ASN 87 2HD2
7 A ASN 93 1HD2
7 A ASN 93 2HD2
7 A ASN 95 1HD2
7 A ASN 95 2HD2
7 A ASN 96 1HD2
7 A ASN 96 2HD2
7 A ASN 97 1HD2
7 A ASN 97 2HD2
8 A ASN 19 1HD2
8 A ASN 19 2HD2
8 A ASN 30 1HD2
8 A ASN 30 2HD2
8 A ASN 46 1HD2
8 A ASN 46 2HD2
8 A ASN 52 1HD2
8 A ASN 52 2HD2
8 A GLN 73 1HE2
8 A GLN 73 2HE2
8 A ASN 80 1HD2
8 A ASN 80 2HD2
8 A ASN 87 1HD2
8 A ASN 87 2HD2
8 A ASN 93 1HD2
8 A ASN 93 2HD2
8 A ASN 95 1HD2
8 A ASN 95 2HD2
8 A ASN 96 1HD2
8 A ASN 96 2HD2
8 A ASN 97 1HD2
8 A ASN 97 2HD2
9 A ASN 19 1HD2
9 A ASN 19 2HD2
9 A ASN 30 1HD2
9 A ASN 30 2HD2
9 A ASN 46 1HD2
9 A ASN 46 2HD2
9 A ASN 52 1HD2
9 A ASN 52 2HD2
9 A GLN 73 1HE2
9 A GLN 73 2HE2
9 A ASN 80 1HD2
9 A ASN 80 2HD2
9 A ASN 87 1HD2
9 A ASN 87 2HD2
9 A ASN 93 1HD2
9 A ASN 93 2HD2
9 A ASN 95 1HD2
9 A ASN 95 2HD2
9 A ASN 96 1HD2
9 A ASN 96 2HD2
9 A ASN 97 1HD2
9 A ASN 97 2HD2
10 A ASN 19 1HD2
10 A ASN 19 2HD2
10 A ASN 30 1HD2
10 A ASN 30 2HD2
10 A ASN 46 1HD2
10 A ASN 46 2HD2
10 A ASN 52 1HD2
10 A ASN 52 2HD2
10 A GLN 73 1HE2
10 A GLN 73 2HE2
10 A ASN 80 1HD2
10 A ASN 80 2HD2
10 A ASN 87 1HD2
10 A ASN 87 2HD2
10 A ASN 93 1HD2
10 A ASN 93 2HD2
10 A ASN 95 1HD2
10 A ASN 95 2HD2
10 A ASN 96 1HD2
10 A ASN 96 2HD2
10 A ASN 97 1HD2
10 A ASN 97 2HD2
11 A ASN 19 1HD2
11 A ASN 19 2HD2
11 A ASN 30 1HD2
11 A ASN 30 2HD2
11 A ASN 46 1HD2
11 A ASN 46 2HD2
11 A ASN 52 1HD2
11 A ASN 52 2HD2
11 A GLN 73 1HE2
11 A GLN 73 2HE2
11 A ASN 80 1HD2
11 A ASN 80 2HD2
11 A ASN 87 1HD2
11 A ASN 87 2HD2
11 A ASN 93 1HD2
11 A ASN 93 2HD2
11 A ASN 95 1HD2
11 A ASN 95 2HD2
11 A ASN 96 1HD2
11 A ASN 96 2HD2
11 A ASN 97 1HD2
11 A ASN 97 2HD2
12 A ASN 19 1HD2
12 A ASN 19 2HD2
12 A ASN 30 1HD2
12 A ASN 30 2HD2
12 A ASN 46 1HD2
12 A ASN 46 2HD2
12 A ASN 52 1HD2
12 A ASN 52 2HD2
12 A GLN 73 1HE2
12 A GLN 73 2HE2
12 A ASN 80 1HD2
12 A ASN 80 2HD2
12 A ASN 87 1HD2
12 A ASN 87 2HD2
12 A ASN 93 1HD2
12 A ASN 93 2HD2
12 A ASN 95 1HD2
12 A ASN 95 2HD2
12 A ASN 96 1HD2
12 A ASN 96 2HD2
12 A ASN 97 1HD2
12 A ASN 97 2HD2
13 A ASN 19 1HD2
13 A ASN 19 2HD2
13 A ASN 30 1HD2
13 A ASN 30 2HD2
13 A ASN 46 1HD2
13 A ASN 46 2HD2
13 A ASN 52 1HD2
13 A ASN 52 2HD2
13 A GLN 73 1HE2
13 A GLN 73 2HE2
13 A ASN 80 1HD2
13 A ASN 80 2HD2
13 A ASN 87 1HD2
13 A ASN 87 2HD2
13 A ASN 93 1HD2
13 A ASN 93 2HD2
13 A ASN 95 1HD2
13 A ASN 95 2HD2
13 A ASN 96 1HD2
13 A ASN 96 2HD2
13 A ASN 97 1HD2
13 A ASN 97 2HD2
14 A ASN 19 1HD2
14 A ASN 19 2HD2
14 A ASN 30 1HD2
14 A ASN 30 2HD2
14 A ASN 46 1HD2
14 A ASN 46 2HD2
14 A ASN 52 1HD2
14 A ASN 52 2HD2
14 A GLN 73 1HE2
14 A GLN 73 2HE2
14 A ASN 80 1HD2
14 A ASN 80 2HD2
14 A ASN 87 1HD2
14 A ASN 87 2HD2
14 A ASN 93 1HD2
14 A ASN 93 2HD2
14 A ASN 95 1HD2
14 A ASN 95 2HD2
14 A ASN 96 1HD2
14 A ASN 96 2HD2
14 A ASN 97 1HD2
14 A ASN 97 2HD2
15 A ASN 19 1HD2
15 A ASN 19 2HD2
15 A ASN 30 1HD2
15 A ASN 30 2HD2
15 A ASN 46 1HD2
15 A ASN 46 2HD2
15 A ASN 52 1HD2
15 A ASN 52 2HD2
15 A GLN 73 1HE2
15 A GLN 73 2HE2
15 A ASN 80 1HD2
15 A ASN 80 2HD2
15 A ASN 87 1HD2
15 A ASN 87 2HD2
15 A ASN 93 1HD2
15 A ASN 93 2HD2
15 A ASN 95 1HD2
15 A ASN 95 2HD2
15 A ASN 96 1HD2
15 A ASN 96 2HD2
15 A ASN 97 1HD2
15 A ASN 97 2HD2
16 A ASN 19 1HD2
16 A ASN 19 2HD2
16 A ASN 30 1HD2
16 A ASN 30 2HD2
16 A ASN 46 1HD2
16 A ASN 46 2HD2
16 A ASN 52 1HD2
16 A ASN 52 2HD2
16 A GLN 73 1HE2
16 A GLN 73 2HE2
16 A ASN 80 1HD2
16 A ASN 80 2HD2
16 A ASN 87 1HD2
16 A ASN 87 2HD2
16 A ASN 93 1HD2
16 A ASN 93 2HD2
16 A ASN 95 1HD2
16 A ASN 95 2HD2
16 A ASN 96 1HD2
16 A ASN 96 2HD2
16 A ASN 97 1HD2
16 A ASN 97 2HD2
17 A ASN 19 1HD2
17 A ASN 19 2HD2
17 A ASN 30 1HD2
17 A ASN 30 2HD2
17 A ASN 46 1HD2
17 A ASN 46 2HD2
17 A ASN 52 1HD2
17 A ASN 52 2HD2
17 A GLN 73 1HE2
17 A GLN 73 2HE2
17 A ASN 80 1HD2
17 A ASN 80 2HD2
17 A ASN 87 1HD2
17 A ASN 87 2HD2
17 A ASN 93 1HD2
17 A ASN 93 2HD2
17 A ASN 95 1HD2
17 A ASN 95 2HD2
17 A ASN 96 1HD2
17 A ASN 96 2HD2
17 A ASN 97 1HD2
17 A ASN 97 2HD2
18 A ASN 19 1HD2
18 A ASN 19 2HD2
18 A ASN 30 1HD2
18 A ASN 30 2HD2
18 A ASN 46 1HD2
18 A ASN 46 2HD2
18 A ASN 52 1HD2
18 A ASN 52 2HD2
18 A GLN 73 1HE2
18 A GLN 73 2HE2
18 A ASN 80 1HD2
18 A ASN 80 2HD2
18 A ASN 87 1HD2
18 A ASN 87 2HD2
18 A ASN 93 1HD2
18 A ASN 93 2HD2
18 A ASN 95 1HD2
18 A ASN 95 2HD2
18 A ASN 96 1HD2
18 A ASN 96 2HD2
18 A ASN 97 1HD2
18 A ASN 97 2HD2
19 A ASN 19 1HD2
19 A ASN 19 2HD2
19 A ASN 30 1HD2
19 A ASN 30 2HD2
19 A ASN 46 1HD2
19 A ASN 46 2HD2
19 A ASN 52 1HD2
19 A ASN 52 2HD2
19 A GLN 73 1HE2
19 A GLN 73 2HE2
19 A ASN 80 1HD2
19 A ASN 80 2HD2
19 A ASN 87 1HD2
19 A ASN 87 2HD2
19 A ASN 93 1HD2
19 A ASN 93 2HD2
19 A ASN 95 1HD2
19 A ASN 95 2HD2
19 A ASN 96 1HD2
19 A ASN 96 2HD2
19 A ASN 97 1HD2
19 A ASN 97 2HD2
20 A ASN 19 1HD2
20 A ASN 19 2HD2
20 A ASN 30 1HD2
20 A ASN 30 2HD2
20 A ASN 46 1HD2
20 A ASN 46 2HD2
20 A ASN 52 1HD2
20 A ASN 52 2HD2
20 A GLN 73 1HE2
20 A GLN 73 2HE2
20 A ASN 80 1HD2
20 A ASN 80 2HD2
20 A ASN 87 1HD2
20 A ASN 87 2HD2
20 A ASN 93 1HD2
20 A ASN 93 2HD2
20 A ASN 95 1HD2
20 A ASN 95 2HD2
20 A ASN 96 1HD2
20 A ASN 96 2HD2
20 A ASN 97 1HD2
20 A ASN 97 2HD2
OTHER IMPORTANT ISSUES
==> The following residues are missing:
(Note: The SEQ number starts from 1 for each chain according to SEQRES
sequence record.)
RES MOD#C SEQ
MET( 1 A-107 )
GLU( 1 A-106 )
PHE( 1 A-105 )
PRO( 1 A-104 )
ASP( 1 A-103 )
LEU( 1 A-102 )
THR( 1 A-101 )
VAL( 1 A-100 )
GLU( 1 A -99 )
ILE( 1 A -98 )
LYS( 1 A -97 )
GLY( 1 A -96 )
PRO( 1 A -95 )
ASP( 1 A -94 )
VAL( 1 A -93 )
VAL( 1 A -92 )
GLY( 1 A -91 )
VAL( 1 A -90 )
ASN( 1 A -89 )
LYS( 1 A -88 )
LEU( 1 A -87 )
ALA( 1 A -86 )
GLU( 1 A -85 )
TYR( 1 A -84 )
GLU( 1 A -83 )
VAL( 1 A -82 )
HIS( 1 A -81 )
VAL( 1 A -80 )
LYS( 1 A -79 )
ASN( 1 A -78 )
LEU( 1 A -77 )
GLY( 1 A -76 )
GLY( 1 A -75 )
ILE( 1 A -74 )
GLY( 1 A -73 )
VAL( 1 A -72 )
PRO( 1 A -71 )
SER( 1 A -70 )
THR( 1 A -69 )
LYS( 1 A -68 )
VAL( 1 A -67 )
ARG( 1 A -66 )
VAL( 1 A -65 )
TYR( 1 A -64 )
ILE( 1 A -63 )
ASN( 1 A -62 )
GLY( 1 A -61 )
THR( 1 A -60 )
LEU( 1 A -59 )
TYR( 1 A -58 )
LYS( 1 A -57 )
ASN( 1 A -56 )
TRP( 1 A -55 )
THR( 1 A -54 )
VAL( 1 A -53 )
SER( 1 A -52 )
LEU( 1 A -51 )
GLY( 1 A -50 )
PRO( 1 A -49 )
LYS( 1 A -48 )
GLU( 1 A -47 )
GLU( 1 A -46 )
LYS( 1 A -45 )
VAL( 1 A -44 )
LEU( 1 A -43 )
THR( 1 A -42 )
PHE( 1 A -41 )
SER( 1 A -40 )
TRP( 1 A -39 )
THR( 1 A -38 )
PRO( 1 A -37 )
THR( 1 A -36 )
GLN( 1 A -35 )
GLU( 1 A -34 )
GLY( 1 A -33 )
MET( 1 A -32 )
TYR( 1 A -31 )
ARG( 1 A -30 )
ILE( 1 A -29 )
ASN( 1 A -28 )
ALA( 1 A -27 )
THR( 1 A -26 )
VAL( 1 A -25 )
ASP( 1 A -24 )
GLU( 1 A -23 )
GLU( 1 A -22 )
ASN( 1 A -21 )
THR( 1 A -20 )
VAL( 1 A -19 )
VAL( 1 A -18 )
GLU( 1 A -17 )
LEU( 1 A -16 )
ASN( 1 A -15 )
GLU( 1 A -14 )
ASN( 1 A -13 )
ASN( 1 A -12 )
ASN( 1 A -11 )
VAL( 1 A -10 )
ALA( 1 A -9 )
THR( 1 A -8 )
PHE( 1 A -7 )
ASP( 1 A -6 )
VAL( 1 A -5 )
SER( 1 A -4 )
VAL( 1 A -3 )
VAL( 1 A -2 )
LEU( 1 A -1 )
GLU( 1 A 0 )
MET( 2 A-107 )
GLU( 2 A-106 )
PHE( 2 A-105 )
PRO( 2 A-104 )
ASP( 2 A-103 )
LEU( 2 A-102 )
THR( 2 A-101 )
VAL( 2 A-100 )
GLU( 2 A -99 )
ILE( 2 A -98 )
LYS( 2 A -97 )
GLY( 2 A -96 )
PRO( 2 A -95 )
ASP( 2 A -94 )
VAL( 2 A -93 )
VAL( 2 A -92 )
GLY( 2 A -91 )
VAL( 2 A -90 )
ASN( 2 A -89 )
LYS( 2 A -88 )
LEU( 2 A -87 )
ALA( 2 A -86 )
GLU( 2 A -85 )
TYR( 2 A -84 )
GLU( 2 A -83 )
VAL( 2 A -82 )
HIS( 2 A -81 )
VAL( 2 A -80 )
LYS( 2 A -79 )
ASN( 2 A -78 )
LEU( 2 A -77 )
GLY( 2 A -76 )
GLY( 2 A -75 )
ILE( 2 A -74 )
GLY( 2 A -73 )
VAL( 2 A -72 )
PRO( 2 A -71 )
SER( 2 A -70 )
THR( 2 A -69 )
LYS( 2 A -68 )
VAL( 2 A -67 )
ARG( 2 A -66 )
VAL( 2 A -65 )
TYR( 2 A -64 )
ILE( 2 A -63 )
ASN( 2 A -62 )
GLY( 2 A -61 )
THR( 2 A -60 )
LEU( 2 A -59 )
TYR( 2 A -58 )
LYS( 2 A -57 )
ASN( 2 A -56 )
TRP( 2 A -55 )
THR( 2 A -54 )
VAL( 2 A -53 )
SER( 2 A -52 )
LEU( 2 A -51 )
GLY( 2 A -50 )
PRO( 2 A -49 )
LYS( 2 A -48 )
GLU( 2 A -47 )
GLU( 2 A -46 )
LYS( 2 A -45 )
VAL( 2 A -44 )
LEU( 2 A -43 )
THR( 2 A -42 )
PHE( 2 A -41 )
SER( 2 A -40 )
TRP( 2 A -39 )
THR( 2 A -38 )
PRO( 2 A -37 )
THR( 2 A -36 )
GLN( 2 A -35 )
GLU( 2 A -34 )
GLY( 2 A -33 )
MET( 2 A -32 )
TYR( 2 A -31 )
ARG( 2 A -30 )
ILE( 2 A -29 )
ASN( 2 A -28 )
ALA( 2 A -27 )
THR( 2 A -26 )
VAL( 2 A -25 )
ASP( 2 A -24 )
GLU( 2 A -23 )
GLU( 2 A -22 )
ASN( 2 A -21 )
THR( 2 A -20 )
VAL( 2 A -19 )
VAL( 2 A -18 )
GLU( 2 A -17 )
LEU( 2 A -16 )
ASN( 2 A -15 )
GLU( 2 A -14 )
ASN( 2 A -13 )
ASN( 2 A -12 )
ASN( 2 A -11 )
VAL( 2 A -10 )
ALA( 2 A -9 )
THR( 2 A -8 )
PHE( 2 A -7 )
ASP( 2 A -6 )
VAL( 2 A -5 )
SER( 2 A -4 )
VAL( 2 A -3 )
VAL( 2 A -2 )
LEU( 2 A -1 )
GLU( 2 A 0 )
MET( 3 A-107 )
GLU( 3 A-106 )
PHE( 3 A-105 )
PRO( 3 A-104 )
ASP( 3 A-103 )
LEU( 3 A-102 )
THR( 3 A-101 )
VAL( 3 A-100 )
GLU( 3 A -99 )
ILE( 3 A -98 )
LYS( 3 A -97 )
GLY( 3 A -96 )
PRO( 3 A -95 )
ASP( 3 A -94 )
VAL( 3 A -93 )
VAL( 3 A -92 )
GLY( 3 A -91 )
VAL( 3 A -90 )
ASN( 3 A -89 )
LYS( 3 A -88 )
LEU( 3 A -87 )
ALA( 3 A -86 )
GLU( 3 A -85 )
TYR( 3 A -84 )
GLU( 3 A -83 )
VAL( 3 A -82 )
HIS( 3 A -81 )
VAL( 3 A -80 )
LYS( 3 A -79 )
ASN( 3 A -78 )
LEU( 3 A -77 )
GLY( 3 A -76 )
GLY( 3 A -75 )
ILE( 3 A -74 )
GLY( 3 A -73 )
VAL( 3 A -72 )
PRO( 3 A -71 )
SER( 3 A -70 )
THR( 3 A -69 )
LYS( 3 A -68 )
VAL( 3 A -67 )
ARG( 3 A -66 )
VAL( 3 A -65 )
TYR( 3 A -64 )
ILE( 3 A -63 )
ASN( 3 A -62 )
GLY( 3 A -61 )
THR( 3 A -60 )
LEU( 3 A -59 )
TYR( 3 A -58 )
LYS( 3 A -57 )
ASN( 3 A -56 )
TRP( 3 A -55 )
THR( 3 A -54 )
VAL( 3 A -53 )
SER( 3 A -52 )
LEU( 3 A -51 )
GLY( 3 A -50 )
PRO( 3 A -49 )
LYS( 3 A -48 )
GLU( 3 A -47 )
GLU( 3 A -46 )
LYS( 3 A -45 )
VAL( 3 A -44 )
LEU( 3 A -43 )
THR( 3 A -42 )
PHE( 3 A -41 )
SER( 3 A -40 )
TRP( 3 A -39 )
THR( 3 A -38 )
PRO( 3 A -37 )
THR( 3 A -36 )
GLN( 3 A -35 )
GLU( 3 A -34 )
GLY( 3 A -33 )
MET( 3 A -32 )
TYR( 3 A -31 )
ARG( 3 A -30 )
ILE( 3 A -29 )
ASN( 3 A -28 )
ALA( 3 A -27 )
THR( 3 A -26 )
VAL( 3 A -25 )
ASP( 3 A -24 )
GLU( 3 A -23 )
GLU( 3 A -22 )
ASN( 3 A -21 )
THR( 3 A -20 )
VAL( 3 A -19 )
VAL( 3 A -18 )
GLU( 3 A -17 )
LEU( 3 A -16 )
ASN( 3 A -15 )
GLU( 3 A -14 )
ASN( 3 A -13 )
ASN( 3 A -12 )
ASN( 3 A -11 )
VAL( 3 A -10 )
ALA( 3 A -9 )
THR( 3 A -8 )
PHE( 3 A -7 )
ASP( 3 A -6 )
VAL( 3 A -5 )
SER( 3 A -4 )
VAL( 3 A -3 )
VAL( 3 A -2 )
LEU( 3 A -1 )
GLU( 3 A 0 )
MET( 4 A-107 )
GLU( 4 A-106 )
PHE( 4 A-105 )
PRO( 4 A-104 )
ASP( 4 A-103 )
LEU( 4 A-102 )
THR( 4 A-101 )
VAL( 4 A-100 )
GLU( 4 A -99 )
ILE( 4 A -98 )
LYS( 4 A -97 )
GLY( 4 A -96 )
PRO( 4 A -95 )
ASP( 4 A -94 )
VAL( 4 A -93 )
VAL( 4 A -92 )
GLY( 4 A -91 )
VAL( 4 A -90 )
ASN( 4 A -89 )
LYS( 4 A -88 )
LEU( 4 A -87 )
ALA( 4 A -86 )
GLU( 4 A -85 )
TYR( 4 A -84 )
GLU( 4 A -83 )
VAL( 4 A -82 )
HIS( 4 A -81 )
VAL( 4 A -80 )
LYS( 4 A -79 )
ASN( 4 A -78 )
LEU( 4 A -77 )
GLY( 4 A -76 )
GLY( 4 A -75 )
ILE( 4 A -74 )
GLY( 4 A -73 )
VAL( 4 A -72 )
PRO( 4 A -71 )
SER( 4 A -70 )
THR( 4 A -69 )
LYS( 4 A -68 )
VAL( 4 A -67 )
ARG( 4 A -66 )
VAL( 4 A -65 )
TYR( 4 A -64 )
ILE( 4 A -63 )
ASN( 4 A -62 )
GLY( 4 A -61 )
THR( 4 A -60 )
LEU( 4 A -59 )
TYR( 4 A -58 )
LYS( 4 A -57 )
ASN( 4 A -56 )
TRP( 4 A -55 )
THR( 4 A -54 )
VAL( 4 A -53 )
SER( 4 A -52 )
LEU( 4 A -51 )
GLY( 4 A -50 )
PRO( 4 A -49 )
LYS( 4 A -48 )
GLU( 4 A -47 )
GLU( 4 A -46 )
LYS( 4 A -45 )
VAL( 4 A -44 )
LEU( 4 A -43 )
THR( 4 A -42 )
PHE( 4 A -41 )
SER( 4 A -40 )
TRP( 4 A -39 )
THR( 4 A -38 )
PRO( 4 A -37 )
THR( 4 A -36 )
GLN( 4 A -35 )
GLU( 4 A -34 )
GLY( 4 A -33 )
MET( 4 A -32 )
TYR( 4 A -31 )
ARG( 4 A -30 )
ILE( 4 A -29 )
ASN( 4 A -28 )
ALA( 4 A -27 )
THR( 4 A -26 )
VAL( 4 A -25 )
ASP( 4 A -24 )
GLU( 4 A -23 )
GLU( 4 A -22 )
ASN( 4 A -21 )
THR( 4 A -20 )
VAL( 4 A -19 )
VAL( 4 A -18 )
GLU( 4 A -17 )
LEU( 4 A -16 )
ASN( 4 A -15 )
GLU( 4 A -14 )
ASN( 4 A -13 )
ASN( 4 A -12 )
ASN( 4 A -11 )
VAL( 4 A -10 )
ALA( 4 A -9 )
THR( 4 A -8 )
PHE( 4 A -7 )
ASP( 4 A -6 )
VAL( 4 A -5 )
SER( 4 A -4 )
VAL( 4 A -3 )
VAL( 4 A -2 )
LEU( 4 A -1 )
GLU( 4 A 0 )
MET( 5 A-107 )
GLU( 5 A-106 )
PHE( 5 A-105 )
PRO( 5 A-104 )
ASP( 5 A-103 )
LEU( 5 A-102 )
THR( 5 A-101 )
VAL( 5 A-100 )
GLU( 5 A -99 )
ILE( 5 A -98 )
LYS( 5 A -97 )
GLY( 5 A -96 )
PRO( 5 A -95 )
ASP( 5 A -94 )
VAL( 5 A -93 )
VAL( 5 A -92 )
GLY( 5 A -91 )
VAL( 5 A -90 )
ASN( 5 A -89 )
LYS( 5 A -88 )
LEU( 5 A -87 )
ALA( 5 A -86 )
GLU( 5 A -85 )
TYR( 5 A -84 )
GLU( 5 A -83 )
VAL( 5 A -82 )
HIS( 5 A -81 )
VAL( 5 A -80 )
LYS( 5 A -79 )
ASN( 5 A -78 )
LEU( 5 A -77 )
GLY( 5 A -76 )
GLY( 5 A -75 )
ILE( 5 A -74 )
GLY( 5 A -73 )
VAL( 5 A -72 )
PRO( 5 A -71 )
SER( 5 A -70 )
THR( 5 A -69 )
LYS( 5 A -68 )
VAL( 5 A -67 )
ARG( 5 A -66 )
VAL( 5 A -65 )
TYR( 5 A -64 )
ILE( 5 A -63 )
ASN( 5 A -62 )
GLY( 5 A -61 )
THR( 5 A -60 )
LEU( 5 A -59 )
TYR( 5 A -58 )
LYS( 5 A -57 )
ASN( 5 A -56 )
TRP( 5 A -55 )
THR( 5 A -54 )
VAL( 5 A -53 )
SER( 5 A -52 )
LEU( 5 A -51 )
GLY( 5 A -50 )
PRO( 5 A -49 )
LYS( 5 A -48 )
GLU( 5 A -47 )
GLU( 5 A -46 )
LYS( 5 A -45 )
VAL( 5 A -44 )
LEU( 5 A -43 )
THR( 5 A -42 )
PHE( 5 A -41 )
SER( 5 A -40 )
TRP( 5 A -39 )
THR( 5 A -38 )
PRO( 5 A -37 )
THR( 5 A -36 )
GLN( 5 A -35 )
GLU( 5 A -34 )
GLY( 5 A -33 )
MET( 5 A -32 )
TYR( 5 A -31 )
ARG( 5 A -30 )
ILE( 5 A -29 )
ASN( 5 A -28 )
ALA( 5 A -27 )
THR( 5 A -26 )
VAL( 5 A -25 )
ASP( 5 A -24 )
GLU( 5 A -23 )
GLU( 5 A -22 )
ASN( 5 A -21 )
THR( 5 A -20 )
VAL( 5 A -19 )
VAL( 5 A -18 )
GLU( 5 A -17 )
LEU( 5 A -16 )
ASN( 5 A -15 )
GLU( 5 A -14 )
ASN( 5 A -13 )
ASN( 5 A -12 )
ASN( 5 A -11 )
VAL( 5 A -10 )
ALA( 5 A -9 )
THR( 5 A -8 )
PHE( 5 A -7 )
ASP( 5 A -6 )
VAL( 5 A -5 )
SER( 5 A -4 )
VAL( 5 A -3 )
VAL( 5 A -2 )
LEU( 5 A -1 )
GLU( 5 A 0 )
MET( 6 A-107 )
GLU( 6 A-106 )
PHE( 6 A-105 )
PRO( 6 A-104 )
ASP( 6 A-103 )
LEU( 6 A-102 )
THR( 6 A-101 )
VAL( 6 A-100 )
GLU( 6 A -99 )
ILE( 6 A -98 )
LYS( 6 A -97 )
GLY( 6 A -96 )
PRO( 6 A -95 )
ASP( 6 A -94 )
VAL( 6 A -93 )
VAL( 6 A -92 )
GLY( 6 A -91 )
VAL( 6 A -90 )
ASN( 6 A -89 )
LYS( 6 A -88 )
LEU( 6 A -87 )
ALA( 6 A -86 )
GLU( 6 A -85 )
TYR( 6 A -84 )
GLU( 6 A -83 )
VAL( 6 A -82 )
HIS( 6 A -81 )
VAL( 6 A -80 )
LYS( 6 A -79 )
ASN( 6 A -78 )
LEU( 6 A -77 )
GLY( 6 A -76 )
GLY( 6 A -75 )
ILE( 6 A -74 )
GLY( 6 A -73 )
VAL( 6 A -72 )
PRO( 6 A -71 )
SER( 6 A -70 )
THR( 6 A -69 )
LYS( 6 A -68 )
VAL( 6 A -67 )
ARG( 6 A -66 )
VAL( 6 A -65 )
TYR( 6 A -64 )
ILE( 6 A -63 )
ASN( 6 A -62 )
GLY( 6 A -61 )
THR( 6 A -60 )
LEU( 6 A -59 )
TYR( 6 A -58 )
LYS( 6 A -57 )
ASN( 6 A -56 )
TRP( 6 A -55 )
THR( 6 A -54 )
VAL( 6 A -53 )
SER( 6 A -52 )
LEU( 6 A -51 )
GLY( 6 A -50 )
PRO( 6 A -49 )
LYS( 6 A -48 )
GLU( 6 A -47 )
GLU( 6 A -46 )
LYS( 6 A -45 )
VAL( 6 A -44 )
LEU( 6 A -43 )
THR( 6 A -42 )
PHE( 6 A -41 )
SER( 6 A -40 )
TRP( 6 A -39 )
THR( 6 A -38 )
PRO( 6 A -37 )
THR( 6 A -36 )
GLN( 6 A -35 )
GLU( 6 A -34 )
GLY( 6 A -33 )
MET( 6 A -32 )
TYR( 6 A -31 )
ARG( 6 A -30 )
ILE( 6 A -29 )
ASN( 6 A -28 )
ALA( 6 A -27 )
THR( 6 A -26 )
VAL( 6 A -25 )
ASP( 6 A -24 )
GLU( 6 A -23 )
GLU( 6 A -22 )
ASN( 6 A -21 )
THR( 6 A -20 )
VAL( 6 A -19 )
VAL( 6 A -18 )
GLU( 6 A -17 )
LEU( 6 A -16 )
ASN( 6 A -15 )
GLU( 6 A -14 )
ASN( 6 A -13 )
ASN( 6 A -12 )
ASN( 6 A -11 )
VAL( 6 A -10 )
ALA( 6 A -9 )
THR( 6 A -8 )
PHE( 6 A -7 )
ASP( 6 A -6 )
VAL( 6 A -5 )
SER( 6 A -4 )
VAL( 6 A -3 )
VAL( 6 A -2 )
LEU( 6 A -1 )
GLU( 6 A 0 )
MET( 7 A-107 )
GLU( 7 A-106 )
PHE( 7 A-105 )
PRO( 7 A-104 )
ASP( 7 A-103 )
LEU( 7 A-102 )
THR( 7 A-101 )
VAL( 7 A-100 )
GLU( 7 A -99 )
ILE( 7 A -98 )
LYS( 7 A -97 )
GLY( 7 A -96 )
PRO( 7 A -95 )
ASP( 7 A -94 )
VAL( 7 A -93 )
VAL( 7 A -92 )
GLY( 7 A -91 )
VAL( 7 A -90 )
ASN( 7 A -89 )
LYS( 7 A -88 )
LEU( 7 A -87 )
ALA( 7 A -86 )
GLU( 7 A -85 )
TYR( 7 A -84 )
GLU( 7 A -83 )
VAL( 7 A -82 )
HIS( 7 A -81 )
VAL( 7 A -80 )
LYS( 7 A -79 )
ASN( 7 A -78 )
LEU( 7 A -77 )
GLY( 7 A -76 )
GLY( 7 A -75 )
ILE( 7 A -74 )
GLY( 7 A -73 )
VAL( 7 A -72 )
PRO( 7 A -71 )
SER( 7 A -70 )
THR( 7 A -69 )
LYS( 7 A -68 )
VAL( 7 A -67 )
ARG( 7 A -66 )
VAL( 7 A -65 )
TYR( 7 A -64 )
ILE( 7 A -63 )
ASN( 7 A -62 )
GLY( 7 A -61 )
THR( 7 A -60 )
LEU( 7 A -59 )
TYR( 7 A -58 )
LYS( 7 A -57 )
ASN( 7 A -56 )
TRP( 7 A -55 )
THR( 7 A -54 )
VAL( 7 A -53 )
SER( 7 A -52 )
LEU( 7 A -51 )
GLY( 7 A -50 )
PRO( 7 A -49 )
LYS( 7 A -48 )
GLU( 7 A -47 )
GLU( 7 A -46 )
LYS( 7 A -45 )
VAL( 7 A -44 )
LEU( 7 A -43 )
THR( 7 A -42 )
PHE( 7 A -41 )
SER( 7 A -40 )
TRP( 7 A -39 )
THR( 7 A -38 )
PRO( 7 A -37 )
THR( 7 A -36 )
GLN( 7 A -35 )
GLU( 7 A -34 )
GLY( 7 A -33 )
MET( 7 A -32 )
TYR( 7 A -31 )
ARG( 7 A -30 )
ILE( 7 A -29 )
ASN( 7 A -28 )
ALA( 7 A -27 )
THR( 7 A -26 )
VAL( 7 A -25 )
ASP( 7 A -24 )
GLU( 7 A -23 )
GLU( 7 A -22 )
ASN( 7 A -21 )
THR( 7 A -20 )
VAL( 7 A -19 )
VAL( 7 A -18 )
GLU( 7 A -17 )
LEU( 7 A -16 )
ASN( 7 A -15 )
GLU( 7 A -14 )
ASN( 7 A -13 )
ASN( 7 A -12 )
ASN( 7 A -11 )
VAL( 7 A -10 )
ALA( 7 A -9 )
THR( 7 A -8 )
PHE( 7 A -7 )
ASP( 7 A -6 )
VAL( 7 A -5 )
SER( 7 A -4 )
VAL( 7 A -3 )
VAL( 7 A -2 )
LEU( 7 A -1 )
GLU( 7 A 0 )
MET( 8 A-107 )
GLU( 8 A-106 )
PHE( 8 A-105 )
PRO( 8 A-104 )
ASP( 8 A-103 )
LEU( 8 A-102 )
THR( 8 A-101 )
VAL( 8 A-100 )
GLU( 8 A -99 )
ILE( 8 A -98 )
LYS( 8 A -97 )
GLY( 8 A -96 )
PRO( 8 A -95 )
ASP( 8 A -94 )
VAL( 8 A -93 )
VAL( 8 A -92 )
GLY( 8 A -91 )
VAL( 8 A -90 )
ASN( 8 A -89 )
LYS( 8 A -88 )
LEU( 8 A -87 )
ALA( 8 A -86 )
GLU( 8 A -85 )
TYR( 8 A -84 )
GLU( 8 A -83 )
VAL( 8 A -82 )
HIS( 8 A -81 )
VAL( 8 A -80 )
LYS( 8 A -79 )
ASN( 8 A -78 )
LEU( 8 A -77 )
GLY( 8 A -76 )
GLY( 8 A -75 )
ILE( 8 A -74 )
GLY( 8 A -73 )
VAL( 8 A -72 )
PRO( 8 A -71 )
SER( 8 A -70 )
THR( 8 A -69 )
LYS( 8 A -68 )
VAL( 8 A -67 )
ARG( 8 A -66 )
VAL( 8 A -65 )
TYR( 8 A -64 )
ILE( 8 A -63 )
ASN( 8 A -62 )
GLY( 8 A -61 )
THR( 8 A -60 )
LEU( 8 A -59 )
TYR( 8 A -58 )
LYS( 8 A -57 )
ASN( 8 A -56 )
TRP( 8 A -55 )
THR( 8 A -54 )
VAL( 8 A -53 )
SER( 8 A -52 )
LEU( 8 A -51 )
GLY( 8 A -50 )
PRO( 8 A -49 )
LYS( 8 A -48 )
GLU( 8 A -47 )
GLU( 8 A -46 )
LYS( 8 A -45 )
VAL( 8 A -44 )
LEU( 8 A -43 )
THR( 8 A -42 )
PHE( 8 A -41 )
SER( 8 A -40 )
TRP( 8 A -39 )
THR( 8 A -38 )
PRO( 8 A -37 )
THR( 8 A -36 )
GLN( 8 A -35 )
GLU( 8 A -34 )
GLY( 8 A -33 )
MET( 8 A -32 )
TYR( 8 A -31 )
ARG( 8 A -30 )
ILE( 8 A -29 )
ASN( 8 A -28 )
ALA( 8 A -27 )
THR( 8 A -26 )
VAL( 8 A -25 )
ASP( 8 A -24 )
GLU( 8 A -23 )
GLU( 8 A -22 )
ASN( 8 A -21 )
THR( 8 A -20 )
VAL( 8 A -19 )
VAL( 8 A -18 )
GLU( 8 A -17 )
LEU( 8 A -16 )
ASN( 8 A -15 )
GLU( 8 A -14 )
ASN( 8 A -13 )
ASN( 8 A -12 )
ASN( 8 A -11 )
VAL( 8 A -10 )
ALA( 8 A -9 )
THR( 8 A -8 )
PHE( 8 A -7 )
ASP( 8 A -6 )
VAL( 8 A -5 )
SER( 8 A -4 )
VAL( 8 A -3 )
VAL( 8 A -2 )
LEU( 8 A -1 )
GLU( 8 A 0 )
MET( 9 A-107 )
GLU( 9 A-106 )
PHE( 9 A-105 )
PRO( 9 A-104 )
ASP( 9 A-103 )
LEU( 9 A-102 )
THR( 9 A-101 )
VAL( 9 A-100 )
GLU( 9 A -99 )
ILE( 9 A -98 )
LYS( 9 A -97 )
GLY( 9 A -96 )
PRO( 9 A -95 )
ASP( 9 A -94 )
VAL( 9 A -93 )
VAL( 9 A -92 )
GLY( 9 A -91 )
VAL( 9 A -90 )
ASN( 9 A -89 )
LYS( 9 A -88 )
LEU( 9 A -87 )
ALA( 9 A -86 )
GLU( 9 A -85 )
TYR( 9 A -84 )
GLU( 9 A -83 )
VAL( 9 A -82 )
HIS( 9 A -81 )
VAL( 9 A -80 )
LYS( 9 A -79 )
ASN( 9 A -78 )
LEU( 9 A -77 )
GLY( 9 A -76 )
GLY( 9 A -75 )
ILE( 9 A -74 )
GLY( 9 A -73 )
VAL( 9 A -72 )
PRO( 9 A -71 )
SER( 9 A -70 )
THR( 9 A -69 )
LYS( 9 A -68 )
VAL( 9 A -67 )
ARG( 9 A -66 )
VAL( 9 A -65 )
TYR( 9 A -64 )
ILE( 9 A -63 )
ASN( 9 A -62 )
GLY( 9 A -61 )
THR( 9 A -60 )
LEU( 9 A -59 )
TYR( 9 A -58 )
LYS( 9 A -57 )
ASN( 9 A -56 )
TRP( 9 A -55 )
THR( 9 A -54 )
VAL( 9 A -53 )
SER( 9 A -52 )
LEU( 9 A -51 )
GLY( 9 A -50 )
PRO( 9 A -49 )
LYS( 9 A -48 )
GLU( 9 A -47 )
GLU( 9 A -46 )
LYS( 9 A -45 )
VAL( 9 A -44 )
LEU( 9 A -43 )
THR( 9 A -42 )
PHE( 9 A -41 )
SER( 9 A -40 )
TRP( 9 A -39 )
THR( 9 A -38 )
PRO( 9 A -37 )
THR( 9 A -36 )
GLN( 9 A -35 )
GLU( 9 A -34 )
GLY( 9 A -33 )
MET( 9 A -32 )
TYR( 9 A -31 )
ARG( 9 A -30 )
ILE( 9 A -29 )
ASN( 9 A -28 )
ALA( 9 A -27 )
THR( 9 A -26 )
VAL( 9 A -25 )
ASP( 9 A -24 )
GLU( 9 A -23 )
GLU( 9 A -22 )
ASN( 9 A -21 )
THR( 9 A -20 )
VAL( 9 A -19 )
VAL( 9 A -18 )
GLU( 9 A -17 )
LEU( 9 A -16 )
ASN( 9 A -15 )
GLU( 9 A -14 )
ASN( 9 A -13 )
ASN( 9 A -12 )
ASN( 9 A -11 )
VAL( 9 A -10 )
ALA( 9 A -9 )
THR( 9 A -8 )
PHE( 9 A -7 )
ASP( 9 A -6 )
VAL( 9 A -5 )
SER( 9 A -4 )
VAL( 9 A -3 )
VAL( 9 A -2 )
LEU( 9 A -1 )
GLU( 9 A 0 )
MET( 10 A-107 )
GLU( 10 A-106 )
PHE( 10 A-105 )
PRO( 10 A-104 )
ASP( 10 A-103 )
LEU( 10 A-102 )
THR( 10 A-101 )
VAL( 10 A-100 )
GLU( 10 A -99 )
ILE( 10 A -98 )
LYS( 10 A -97 )
GLY( 10 A -96 )
PRO( 10 A -95 )
ASP( 10 A -94 )
VAL( 10 A -93 )
VAL( 10 A -92 )
GLY( 10 A -91 )
VAL( 10 A -90 )
ASN( 10 A -89 )
LYS( 10 A -88 )
LEU( 10 A -87 )
ALA( 10 A -86 )
GLU( 10 A -85 )
TYR( 10 A -84 )
GLU( 10 A -83 )
VAL( 10 A -82 )
HIS( 10 A -81 )
VAL( 10 A -80 )
LYS( 10 A -79 )
ASN( 10 A -78 )
LEU( 10 A -77 )
GLY( 10 A -76 )
GLY( 10 A -75 )
ILE( 10 A -74 )
GLY( 10 A -73 )
VAL( 10 A -72 )
PRO( 10 A -71 )
SER( 10 A -70 )
THR( 10 A -69 )
LYS( 10 A -68 )
VAL( 10 A -67 )
ARG( 10 A -66 )
VAL( 10 A -65 )
TYR( 10 A -64 )
ILE( 10 A -63 )
ASN( 10 A -62 )
GLY( 10 A -61 )
THR( 10 A -60 )
LEU( 10 A -59 )
TYR( 10 A -58 )
LYS( 10 A -57 )
ASN( 10 A -56 )
TRP( 10 A -55 )
THR( 10 A -54 )
VAL( 10 A -53 )
SER( 10 A -52 )
LEU( 10 A -51 )
GLY( 10 A -50 )
PRO( 10 A -49 )
LYS( 10 A -48 )
GLU( 10 A -47 )
GLU( 10 A -46 )
LYS( 10 A -45 )
VAL( 10 A -44 )
LEU( 10 A -43 )
THR( 10 A -42 )
PHE( 10 A -41 )
SER( 10 A -40 )
TRP( 10 A -39 )
THR( 10 A -38 )
PRO( 10 A -37 )
THR( 10 A -36 )
GLN( 10 A -35 )
GLU( 10 A -34 )
GLY( 10 A -33 )
MET( 10 A -32 )
TYR( 10 A -31 )
ARG( 10 A -30 )
ILE( 10 A -29 )
ASN( 10 A -28 )
ALA( 10 A -27 )
THR( 10 A -26 )
VAL( 10 A -25 )
ASP( 10 A -24 )
GLU( 10 A -23 )
GLU( 10 A -22 )
ASN( 10 A -21 )
THR( 10 A -20 )
VAL( 10 A -19 )
VAL( 10 A -18 )
GLU( 10 A -17 )
LEU( 10 A -16 )
ASN( 10 A -15 )
GLU( 10 A -14 )
ASN( 10 A -13 )
ASN( 10 A -12 )
ASN( 10 A -11 )
VAL( 10 A -10 )
ALA( 10 A -9 )
THR( 10 A -8 )
PHE( 10 A -7 )
ASP( 10 A -6 )
VAL( 10 A -5 )
SER( 10 A -4 )
VAL( 10 A -3 )
VAL( 10 A -2 )
LEU( 10 A -1 )
GLU( 10 A 0 )
MET( 11 A-107 )
GLU( 11 A-106 )
PHE( 11 A-105 )
PRO( 11 A-104 )
ASP( 11 A-103 )
LEU( 11 A-102 )
THR( 11 A-101 )
VAL( 11 A-100 )
GLU( 11 A -99 )
ILE( 11 A -98 )
LYS( 11 A -97 )
GLY( 11 A -96 )
PRO( 11 A -95 )
ASP( 11 A -94 )
VAL( 11 A -93 )
VAL( 11 A -92 )
GLY( 11 A -91 )
VAL( 11 A -90 )
ASN( 11 A -89 )
LYS( 11 A -88 )
LEU( 11 A -87 )
ALA( 11 A -86 )
GLU( 11 A -85 )
TYR( 11 A -84 )
GLU( 11 A -83 )
VAL( 11 A -82 )
HIS( 11 A -81 )
VAL( 11 A -80 )
LYS( 11 A -79 )
ASN( 11 A -78 )
LEU( 11 A -77 )
GLY( 11 A -76 )
GLY( 11 A -75 )
ILE( 11 A -74 )
GLY( 11 A -73 )
VAL( 11 A -72 )
PRO( 11 A -71 )
SER( 11 A -70 )
THR( 11 A -69 )
LYS( 11 A -68 )
VAL( 11 A -67 )
ARG( 11 A -66 )
VAL( 11 A -65 )
TYR( 11 A -64 )
ILE( 11 A -63 )
ASN( 11 A -62 )
GLY( 11 A -61 )
THR( 11 A -60 )
LEU( 11 A -59 )
TYR( 11 A -58 )
LYS( 11 A -57 )
ASN( 11 A -56 )
TRP( 11 A -55 )
THR( 11 A -54 )
VAL( 11 A -53 )
SER( 11 A -52 )
LEU( 11 A -51 )
GLY( 11 A -50 )
PRO( 11 A -49 )
LYS( 11 A -48 )
GLU( 11 A -47 )
GLU( 11 A -46 )
LYS( 11 A -45 )
VAL( 11 A -44 )
LEU( 11 A -43 )
THR( 11 A -42 )
PHE( 11 A -41 )
SER( 11 A -40 )
TRP( 11 A -39 )
THR( 11 A -38 )
PRO( 11 A -37 )
THR( 11 A -36 )
GLN( 11 A -35 )
GLU( 11 A -34 )
GLY( 11 A -33 )
MET( 11 A -32 )
TYR( 11 A -31 )
ARG( 11 A -30 )
ILE( 11 A -29 )
ASN( 11 A -28 )
ALA( 11 A -27 )
THR( 11 A -26 )
VAL( 11 A -25 )
ASP( 11 A -24 )
GLU( 11 A -23 )
GLU( 11 A -22 )
ASN( 11 A -21 )
THR( 11 A -20 )
VAL( 11 A -19 )
VAL( 11 A -18 )
GLU( 11 A -17 )
LEU( 11 A -16 )
ASN( 11 A -15 )
GLU( 11 A -14 )
ASN( 11 A -13 )
ASN( 11 A -12 )
ASN( 11 A -11 )
VAL( 11 A -10 )
ALA( 11 A -9 )
THR( 11 A -8 )
PHE( 11 A -7 )
ASP( 11 A -6 )
VAL( 11 A -5 )
SER( 11 A -4 )
VAL( 11 A -3 )
VAL( 11 A -2 )
LEU( 11 A -1 )
GLU( 11 A 0 )
MET( 12 A-107 )
GLU( 12 A-106 )
PHE( 12 A-105 )
PRO( 12 A-104 )
ASP( 12 A-103 )
LEU( 12 A-102 )
THR( 12 A-101 )
VAL( 12 A-100 )
GLU( 12 A -99 )
ILE( 12 A -98 )
LYS( 12 A -97 )
GLY( 12 A -96 )
PRO( 12 A -95 )
ASP( 12 A -94 )
VAL( 12 A -93 )
VAL( 12 A -92 )
GLY( 12 A -91 )
VAL( 12 A -90 )
ASN( 12 A -89 )
LYS( 12 A -88 )
LEU( 12 A -87 )
ALA( 12 A -86 )
GLU( 12 A -85 )
TYR( 12 A -84 )
GLU( 12 A -83 )
VAL( 12 A -82 )
HIS( 12 A -81 )
VAL( 12 A -80 )
LYS( 12 A -79 )
ASN( 12 A -78 )
LEU( 12 A -77 )
GLY( 12 A -76 )
GLY( 12 A -75 )
ILE( 12 A -74 )
GLY( 12 A -73 )
VAL( 12 A -72 )
PRO( 12 A -71 )
SER( 12 A -70 )
THR( 12 A -69 )
LYS( 12 A -68 )
VAL( 12 A -67 )
ARG( 12 A -66 )
VAL( 12 A -65 )
TYR( 12 A -64 )
ILE( 12 A -63 )
ASN( 12 A -62 )
GLY( 12 A -61 )
THR( 12 A -60 )
LEU( 12 A -59 )
TYR( 12 A -58 )
LYS( 12 A -57 )
ASN( 12 A -56 )
TRP( 12 A -55 )
THR( 12 A -54 )
VAL( 12 A -53 )
SER( 12 A -52 )
LEU( 12 A -51 )
GLY( 12 A -50 )
PRO( 12 A -49 )
LYS( 12 A -48 )
GLU( 12 A -47 )
GLU( 12 A -46 )
LYS( 12 A -45 )
VAL( 12 A -44 )
LEU( 12 A -43 )
THR( 12 A -42 )
PHE( 12 A -41 )
SER( 12 A -40 )
TRP( 12 A -39 )
THR( 12 A -38 )
PRO( 12 A -37 )
THR( 12 A -36 )
GLN( 12 A -35 )
GLU( 12 A -34 )
GLY( 12 A -33 )
MET( 12 A -32 )
TYR( 12 A -31 )
ARG( 12 A -30 )
ILE( 12 A -29 )
ASN( 12 A -28 )
ALA( 12 A -27 )
THR( 12 A -26 )
VAL( 12 A -25 )
ASP( 12 A -24 )
GLU( 12 A -23 )
GLU( 12 A -22 )
ASN( 12 A -21 )
THR( 12 A -20 )
VAL( 12 A -19 )
VAL( 12 A -18 )
GLU( 12 A -17 )
LEU( 12 A -16 )
ASN( 12 A -15 )
GLU( 12 A -14 )
ASN( 12 A -13 )
ASN( 12 A -12 )
ASN( 12 A -11 )
VAL( 12 A -10 )
ALA( 12 A -9 )
THR( 12 A -8 )
PHE( 12 A -7 )
ASP( 12 A -6 )
VAL( 12 A -5 )
SER( 12 A -4 )
VAL( 12 A -3 )
VAL( 12 A -2 )
LEU( 12 A -1 )
GLU( 12 A 0 )
MET( 13 A-107 )
GLU( 13 A-106 )
PHE( 13 A-105 )
PRO( 13 A-104 )
ASP( 13 A-103 )
LEU( 13 A-102 )
THR( 13 A-101 )
VAL( 13 A-100 )
GLU( 13 A -99 )
ILE( 13 A -98 )
LYS( 13 A -97 )
GLY( 13 A -96 )
PRO( 13 A -95 )
ASP( 13 A -94 )
VAL( 13 A -93 )
VAL( 13 A -92 )
GLY( 13 A -91 )
VAL( 13 A -90 )
ASN( 13 A -89 )
LYS( 13 A -88 )
LEU( 13 A -87 )
ALA( 13 A -86 )
GLU( 13 A -85 )
TYR( 13 A -84 )
GLU( 13 A -83 )
VAL( 13 A -82 )
HIS( 13 A -81 )
VAL( 13 A -80 )
LYS( 13 A -79 )
ASN( 13 A -78 )
LEU( 13 A -77 )
GLY( 13 A -76 )
GLY( 13 A -75 )
ILE( 13 A -74 )
GLY( 13 A -73 )
VAL( 13 A -72 )
PRO( 13 A -71 )
SER( 13 A -70 )
THR( 13 A -69 )
LYS( 13 A -68 )
VAL( 13 A -67 )
ARG( 13 A -66 )
VAL( 13 A -65 )
TYR( 13 A -64 )
ILE( 13 A -63 )
ASN( 13 A -62 )
GLY( 13 A -61 )
THR( 13 A -60 )
LEU( 13 A -59 )
TYR( 13 A -58 )
LYS( 13 A -57 )
ASN( 13 A -56 )
TRP( 13 A -55 )
THR( 13 A -54 )
VAL( 13 A -53 )
SER( 13 A -52 )
LEU( 13 A -51 )
GLY( 13 A -50 )
PRO( 13 A -49 )
LYS( 13 A -48 )
GLU( 13 A -47 )
GLU( 13 A -46 )
LYS( 13 A -45 )
VAL( 13 A -44 )
LEU( 13 A -43 )
THR( 13 A -42 )
PHE( 13 A -41 )
SER( 13 A -40 )
TRP( 13 A -39 )
THR( 13 A -38 )
PRO( 13 A -37 )
THR( 13 A -36 )
GLN( 13 A -35 )
GLU( 13 A -34 )
GLY( 13 A -33 )
MET( 13 A -32 )
TYR( 13 A -31 )
ARG( 13 A -30 )
ILE( 13 A -29 )
ASN( 13 A -28 )
ALA( 13 A -27 )
THR( 13 A -26 )
VAL( 13 A -25 )
ASP( 13 A -24 )
GLU( 13 A -23 )
GLU( 13 A -22 )
ASN( 13 A -21 )
THR( 13 A -20 )
VAL( 13 A -19 )
VAL( 13 A -18 )
GLU( 13 A -17 )
LEU( 13 A -16 )
ASN( 13 A -15 )
GLU( 13 A -14 )
ASN( 13 A -13 )
ASN( 13 A -12 )
ASN( 13 A -11 )
VAL( 13 A -10 )
ALA( 13 A -9 )
THR( 13 A -8 )
PHE( 13 A -7 )
ASP( 13 A -6 )
VAL( 13 A -5 )
SER( 13 A -4 )
VAL( 13 A -3 )
VAL( 13 A -2 )
LEU( 13 A -1 )
GLU( 13 A 0 )
MET( 14 A-107 )
GLU( 14 A-106 )
PHE( 14 A-105 )
PRO( 14 A-104 )
ASP( 14 A-103 )
LEU( 14 A-102 )
THR( 14 A-101 )
VAL( 14 A-100 )
GLU( 14 A -99 )
ILE( 14 A -98 )
LYS( 14 A -97 )
GLY( 14 A -96 )
PRO( 14 A -95 )
ASP( 14 A -94 )
VAL( 14 A -93 )
VAL( 14 A -92 )
GLY( 14 A -91 )
VAL( 14 A -90 )
ASN( 14 A -89 )
LYS( 14 A -88 )
LEU( 14 A -87 )
ALA( 14 A -86 )
GLU( 14 A -85 )
TYR( 14 A -84 )
GLU( 14 A -83 )
VAL( 14 A -82 )
HIS( 14 A -81 )
VAL( 14 A -80 )
LYS( 14 A -79 )
ASN( 14 A -78 )
LEU( 14 A -77 )
GLY( 14 A -76 )
GLY( 14 A -75 )
ILE( 14 A -74 )
GLY( 14 A -73 )
VAL( 14 A -72 )
PRO( 14 A -71 )
SER( 14 A -70 )
THR( 14 A -69 )
LYS( 14 A -68 )
VAL( 14 A -67 )
ARG( 14 A -66 )
VAL( 14 A -65 )
TYR( 14 A -64 )
ILE( 14 A -63 )
ASN( 14 A -62 )
GLY( 14 A -61 )
THR( 14 A -60 )
LEU( 14 A -59 )
TYR( 14 A -58 )
LYS( 14 A -57 )
ASN( 14 A -56 )
TRP( 14 A -55 )
THR( 14 A -54 )
VAL( 14 A -53 )
SER( 14 A -52 )
LEU( 14 A -51 )
GLY( 14 A -50 )
PRO( 14 A -49 )
LYS( 14 A -48 )
GLU( 14 A -47 )
GLU( 14 A -46 )
LYS( 14 A -45 )
VAL( 14 A -44 )
LEU( 14 A -43 )
THR( 14 A -42 )
PHE( 14 A -41 )
SER( 14 A -40 )
TRP( 14 A -39 )
THR( 14 A -38 )
PRO( 14 A -37 )
THR( 14 A -36 )
GLN( 14 A -35 )
GLU( 14 A -34 )
GLY( 14 A -33 )
MET( 14 A -32 )
TYR( 14 A -31 )
ARG( 14 A -30 )
ILE( 14 A -29 )
ASN( 14 A -28 )
ALA( 14 A -27 )
THR( 14 A -26 )
VAL( 14 A -25 )
ASP( 14 A -24 )
GLU( 14 A -23 )
GLU( 14 A -22 )
ASN( 14 A -21 )
THR( 14 A -20 )
VAL( 14 A -19 )
VAL( 14 A -18 )
GLU( 14 A -17 )
LEU( 14 A -16 )
ASN( 14 A -15 )
GLU( 14 A -14 )
ASN( 14 A -13 )
ASN( 14 A -12 )
ASN( 14 A -11 )
VAL( 14 A -10 )
ALA( 14 A -9 )
THR( 14 A -8 )
PHE( 14 A -7 )
ASP( 14 A -6 )
VAL( 14 A -5 )
SER( 14 A -4 )
VAL( 14 A -3 )
VAL( 14 A -2 )
LEU( 14 A -1 )
GLU( 14 A 0 )
MET( 15 A-107 )
GLU( 15 A-106 )
PHE( 15 A-105 )
PRO( 15 A-104 )
ASP( 15 A-103 )
LEU( 15 A-102 )
THR( 15 A-101 )
VAL( 15 A-100 )
GLU( 15 A -99 )
ILE( 15 A -98 )
LYS( 15 A -97 )
GLY( 15 A -96 )
PRO( 15 A -95 )
ASP( 15 A -94 )
VAL( 15 A -93 )
VAL( 15 A -92 )
GLY( 15 A -91 )
VAL( 15 A -90 )
ASN( 15 A -89 )
LYS( 15 A -88 )
LEU( 15 A -87 )
ALA( 15 A -86 )
GLU( 15 A -85 )
TYR( 15 A -84 )
GLU( 15 A -83 )
VAL( 15 A -82 )
HIS( 15 A -81 )
VAL( 15 A -80 )
LYS( 15 A -79 )
ASN( 15 A -78 )
LEU( 15 A -77 )
GLY( 15 A -76 )
GLY( 15 A -75 )
ILE( 15 A -74 )
GLY( 15 A -73 )
VAL( 15 A -72 )
PRO( 15 A -71 )
SER( 15 A -70 )
THR( 15 A -69 )
LYS( 15 A -68 )
VAL( 15 A -67 )
ARG( 15 A -66 )
VAL( 15 A -65 )
TYR( 15 A -64 )
ILE( 15 A -63 )
ASN( 15 A -62 )
GLY( 15 A -61 )
THR( 15 A -60 )
LEU( 15 A -59 )
TYR( 15 A -58 )
LYS( 15 A -57 )
ASN( 15 A -56 )
TRP( 15 A -55 )
THR( 15 A -54 )
VAL( 15 A -53 )
SER( 15 A -52 )
LEU( 15 A -51 )
GLY( 15 A -50 )
PRO( 15 A -49 )
LYS( 15 A -48 )
GLU( 15 A -47 )
GLU( 15 A -46 )
LYS( 15 A -45 )
VAL( 15 A -44 )
LEU( 15 A -43 )
THR( 15 A -42 )
PHE( 15 A -41 )
SER( 15 A -40 )
TRP( 15 A -39 )
THR( 15 A -38 )
PRO( 15 A -37 )
THR( 15 A -36 )
GLN( 15 A -35 )
GLU( 15 A -34 )
GLY( 15 A -33 )
MET( 15 A -32 )
TYR( 15 A -31 )
ARG( 15 A -30 )
ILE( 15 A -29 )
ASN( 15 A -28 )
ALA( 15 A -27 )
THR( 15 A -26 )
VAL( 15 A -25 )
ASP( 15 A -24 )
GLU( 15 A -23 )
GLU( 15 A -22 )
ASN( 15 A -21 )
THR( 15 A -20 )
VAL( 15 A -19 )
VAL( 15 A -18 )
GLU( 15 A -17 )
LEU( 15 A -16 )
ASN( 15 A -15 )
GLU( 15 A -14 )
ASN( 15 A -13 )
ASN( 15 A -12 )
ASN( 15 A -11 )
VAL( 15 A -10 )
ALA( 15 A -9 )
THR( 15 A -8 )
PHE( 15 A -7 )
ASP( 15 A -6 )
VAL( 15 A -5 )
SER( 15 A -4 )
VAL( 15 A -3 )
VAL( 15 A -2 )
LEU( 15 A -1 )
GLU( 15 A 0 )
MET( 16 A-107 )
GLU( 16 A-106 )
PHE( 16 A-105 )
PRO( 16 A-104 )
ASP( 16 A-103 )
LEU( 16 A-102 )
THR( 16 A-101 )
VAL( 16 A-100 )
GLU( 16 A -99 )
ILE( 16 A -98 )
LYS( 16 A -97 )
GLY( 16 A -96 )
PRO( 16 A -95 )
ASP( 16 A -94 )
VAL( 16 A -93 )
VAL( 16 A -92 )
GLY( 16 A -91 )
VAL( 16 A -90 )
ASN( 16 A -89 )
LYS( 16 A -88 )
LEU( 16 A -87 )
ALA( 16 A -86 )
GLU( 16 A -85 )
TYR( 16 A -84 )
GLU( 16 A -83 )
VAL( 16 A -82 )
HIS( 16 A -81 )
VAL( 16 A -80 )
LYS( 16 A -79 )
ASN( 16 A -78 )
LEU( 16 A -77 )
GLY( 16 A -76 )
GLY( 16 A -75 )
ILE( 16 A -74 )
GLY( 16 A -73 )
VAL( 16 A -72 )
PRO( 16 A -71 )
SER( 16 A -70 )
THR( 16 A -69 )
LYS( 16 A -68 )
VAL( 16 A -67 )
ARG( 16 A -66 )
VAL( 16 A -65 )
TYR( 16 A -64 )
ILE( 16 A -63 )
ASN( 16 A -62 )
GLY( 16 A -61 )
THR( 16 A -60 )
LEU( 16 A -59 )
TYR( 16 A -58 )
LYS( 16 A -57 )
ASN( 16 A -56 )
TRP( 16 A -55 )
THR( 16 A -54 )
VAL( 16 A -53 )
SER( 16 A -52 )
LEU( 16 A -51 )
GLY( 16 A -50 )
PRO( 16 A -49 )
LYS( 16 A -48 )
GLU( 16 A -47 )
GLU( 16 A -46 )
LYS( 16 A -45 )
VAL( 16 A -44 )
LEU( 16 A -43 )
THR( 16 A -42 )
PHE( 16 A -41 )
SER( 16 A -40 )
TRP( 16 A -39 )
THR( 16 A -38 )
PRO( 16 A -37 )
THR( 16 A -36 )
GLN( 16 A -35 )
GLU( 16 A -34 )
GLY( 16 A -33 )
MET( 16 A -32 )
TYR( 16 A -31 )
ARG( 16 A -30 )
ILE( 16 A -29 )
ASN( 16 A -28 )
ALA( 16 A -27 )
THR( 16 A -26 )
VAL( 16 A -25 )
ASP( 16 A -24 )
GLU( 16 A -23 )
GLU( 16 A -22 )
ASN( 16 A -21 )
THR( 16 A -20 )
VAL( 16 A -19 )
VAL( 16 A -18 )
GLU( 16 A -17 )
LEU( 16 A -16 )
ASN( 16 A -15 )
GLU( 16 A -14 )
ASN( 16 A -13 )
ASN( 16 A -12 )
ASN( 16 A -11 )
VAL( 16 A -10 )
ALA( 16 A -9 )
THR( 16 A -8 )
PHE( 16 A -7 )
ASP( 16 A -6 )
VAL( 16 A -5 )
SER( 16 A -4 )
VAL( 16 A -3 )
VAL( 16 A -2 )
LEU( 16 A -1 )
GLU( 16 A 0 )
MET( 17 A-107 )
GLU( 17 A-106 )
PHE( 17 A-105 )
PRO( 17 A-104 )
ASP( 17 A-103 )
LEU( 17 A-102 )
THR( 17 A-101 )
VAL( 17 A-100 )
GLU( 17 A -99 )
ILE( 17 A -98 )
LYS( 17 A -97 )
GLY( 17 A -96 )
PRO( 17 A -95 )
ASP( 17 A -94 )
VAL( 17 A -93 )
VAL( 17 A -92 )
GLY( 17 A -91 )
VAL( 17 A -90 )
ASN( 17 A -89 )
LYS( 17 A -88 )
LEU( 17 A -87 )
ALA( 17 A -86 )
GLU( 17 A -85 )
TYR( 17 A -84 )
GLU( 17 A -83 )
VAL( 17 A -82 )
HIS( 17 A -81 )
VAL( 17 A -80 )
LYS( 17 A -79 )
ASN( 17 A -78 )
LEU( 17 A -77 )
GLY( 17 A -76 )
GLY( 17 A -75 )
ILE( 17 A -74 )
GLY( 17 A -73 )
VAL( 17 A -72 )
PRO( 17 A -71 )
SER( 17 A -70 )
THR( 17 A -69 )
LYS( 17 A -68 )
VAL( 17 A -67 )
ARG( 17 A -66 )
VAL( 17 A -65 )
TYR( 17 A -64 )
ILE( 17 A -63 )
ASN( 17 A -62 )
GLY( 17 A -61 )
THR( 17 A -60 )
LEU( 17 A -59 )
TYR( 17 A -58 )
LYS( 17 A -57 )
ASN( 17 A -56 )
TRP( 17 A -55 )
THR( 17 A -54 )
VAL( 17 A -53 )
SER( 17 A -52 )
LEU( 17 A -51 )
GLY( 17 A -50 )
PRO( 17 A -49 )
LYS( 17 A -48 )
GLU( 17 A -47 )
GLU( 17 A -46 )
LYS( 17 A -45 )
VAL( 17 A -44 )
LEU( 17 A -43 )
THR( 17 A -42 )
PHE( 17 A -41 )
SER( 17 A -40 )
TRP( 17 A -39 )
THR( 17 A -38 )
PRO( 17 A -37 )
THR( 17 A -36 )
GLN( 17 A -35 )
GLU( 17 A -34 )
GLY( 17 A -33 )
MET( 17 A -32 )
TYR( 17 A -31 )
ARG( 17 A -30 )
ILE( 17 A -29 )
ASN( 17 A -28 )
ALA( 17 A -27 )
THR( 17 A -26 )
VAL( 17 A -25 )
ASP( 17 A -24 )
GLU( 17 A -23 )
GLU( 17 A -22 )
ASN( 17 A -21 )
THR( 17 A -20 )
VAL( 17 A -19 )
VAL( 17 A -18 )
GLU( 17 A -17 )
LEU( 17 A -16 )
ASN( 17 A -15 )
GLU( 17 A -14 )
ASN( 17 A -13 )
ASN( 17 A -12 )
ASN( 17 A -11 )
VAL( 17 A -10 )
ALA( 17 A -9 )
THR( 17 A -8 )
PHE( 17 A -7 )
ASP( 17 A -6 )
VAL( 17 A -5 )
SER( 17 A -4 )
VAL( 17 A -3 )
VAL( 17 A -2 )
LEU( 17 A -1 )
GLU( 17 A 0 )
MET( 18 A-107 )
GLU( 18 A-106 )
PHE( 18 A-105 )
PRO( 18 A-104 )
ASP( 18 A-103 )
LEU( 18 A-102 )
THR( 18 A-101 )
VAL( 18 A-100 )
GLU( 18 A -99 )
ILE( 18 A -98 )
LYS( 18 A -97 )
GLY( 18 A -96 )
PRO( 18 A -95 )
ASP( 18 A -94 )
VAL( 18 A -93 )
VAL( 18 A -92 )
GLY( 18 A -91 )
VAL( 18 A -90 )
ASN( 18 A -89 )
LYS( 18 A -88 )
LEU( 18 A -87 )
ALA( 18 A -86 )
GLU( 18 A -85 )
TYR( 18 A -84 )
GLU( 18 A -83 )
VAL( 18 A -82 )
HIS( 18 A -81 )
VAL( 18 A -80 )
LYS( 18 A -79 )
ASN( 18 A -78 )
LEU( 18 A -77 )
GLY( 18 A -76 )
GLY( 18 A -75 )
ILE( 18 A -74 )
GLY( 18 A -73 )
VAL( 18 A -72 )
PRO( 18 A -71 )
SER( 18 A -70 )
THR( 18 A -69 )
LYS( 18 A -68 )
VAL( 18 A -67 )
ARG( 18 A -66 )
VAL( 18 A -65 )
TYR( 18 A -64 )
ILE( 18 A -63 )
ASN( 18 A -62 )
GLY( 18 A -61 )
THR( 18 A -60 )
LEU( 18 A -59 )
TYR( 18 A -58 )
LYS( 18 A -57 )
ASN( 18 A -56 )
TRP( 18 A -55 )
THR( 18 A -54 )
VAL( 18 A -53 )
SER( 18 A -52 )
LEU( 18 A -51 )
GLY( 18 A -50 )
PRO( 18 A -49 )
LYS( 18 A -48 )
GLU( 18 A -47 )
GLU( 18 A -46 )
LYS( 18 A -45 )
VAL( 18 A -44 )
LEU( 18 A -43 )
THR( 18 A -42 )
PHE( 18 A -41 )
SER( 18 A -40 )
TRP( 18 A -39 )
THR( 18 A -38 )
PRO( 18 A -37 )
THR( 18 A -36 )
GLN( 18 A -35 )
GLU( 18 A -34 )
GLY( 18 A -33 )
MET( 18 A -32 )
TYR( 18 A -31 )
ARG( 18 A -30 )
ILE( 18 A -29 )
ASN( 18 A -28 )
ALA( 18 A -27 )
THR( 18 A -26 )
VAL( 18 A -25 )
ASP( 18 A -24 )
GLU( 18 A -23 )
GLU( 18 A -22 )
ASN( 18 A -21 )
THR( 18 A -20 )
VAL( 18 A -19 )
VAL( 18 A -18 )
GLU( 18 A -17 )
LEU( 18 A -16 )
ASN( 18 A -15 )
GLU( 18 A -14 )
ASN( 18 A -13 )
ASN( 18 A -12 )
ASN( 18 A -11 )
VAL( 18 A -10 )
ALA( 18 A -9 )
THR( 18 A -8 )
PHE( 18 A -7 )
ASP( 18 A -6 )
VAL( 18 A -5 )
SER( 18 A -4 )
VAL( 18 A -3 )
VAL( 18 A -2 )
LEU( 18 A -1 )
GLU( 18 A 0 )
MET( 19 A-107 )
GLU( 19 A-106 )
PHE( 19 A-105 )
PRO( 19 A-104 )
ASP( 19 A-103 )
LEU( 19 A-102 )
THR( 19 A-101 )
VAL( 19 A-100 )
GLU( 19 A -99 )
ILE( 19 A -98 )
LYS( 19 A -97 )
GLY( 19 A -96 )
PRO( 19 A -95 )
ASP( 19 A -94 )
VAL( 19 A -93 )
VAL( 19 A -92 )
GLY( 19 A -91 )
VAL( 19 A -90 )
ASN( 19 A -89 )
LYS( 19 A -88 )
LEU( 19 A -87 )
ALA( 19 A -86 )
GLU( 19 A -85 )
TYR( 19 A -84 )
GLU( 19 A -83 )
VAL( 19 A -82 )
HIS( 19 A -81 )
VAL( 19 A -80 )
LYS( 19 A -79 )
ASN( 19 A -78 )
LEU( 19 A -77 )
GLY( 19 A -76 )
GLY( 19 A -75 )
ILE( 19 A -74 )
GLY( 19 A -73 )
VAL( 19 A -72 )
PRO( 19 A -71 )
SER( 19 A -70 )
THR( 19 A -69 )
LYS( 19 A -68 )
VAL( 19 A -67 )
ARG( 19 A -66 )
VAL( 19 A -65 )
TYR( 19 A -64 )
ILE( 19 A -63 )
ASN( 19 A -62 )
GLY( 19 A -61 )
THR( 19 A -60 )
LEU( 19 A -59 )
TYR( 19 A -58 )
LYS( 19 A -57 )
ASN( 19 A -56 )
TRP( 19 A -55 )
THR( 19 A -54 )
VAL( 19 A -53 )
SER( 19 A -52 )
LEU( 19 A -51 )
GLY( 19 A -50 )
PRO( 19 A -49 )
LYS( 19 A -48 )
GLU( 19 A -47 )
GLU( 19 A -46 )
LYS( 19 A -45 )
VAL( 19 A -44 )
LEU( 19 A -43 )
THR( 19 A -42 )
PHE( 19 A -41 )
SER( 19 A -40 )
TRP( 19 A -39 )
THR( 19 A -38 )
PRO( 19 A -37 )
THR( 19 A -36 )
GLN( 19 A -35 )
GLU( 19 A -34 )
GLY( 19 A -33 )
MET( 19 A -32 )
TYR( 19 A -31 )
ARG( 19 A -30 )
ILE( 19 A -29 )
ASN( 19 A -28 )
ALA( 19 A -27 )
THR( 19 A -26 )
VAL( 19 A -25 )
ASP( 19 A -24 )
GLU( 19 A -23 )
GLU( 19 A -22 )
ASN( 19 A -21 )
THR( 19 A -20 )
VAL( 19 A -19 )
VAL( 19 A -18 )
GLU( 19 A -17 )
LEU( 19 A -16 )
ASN( 19 A -15 )
GLU( 19 A -14 )
ASN( 19 A -13 )
ASN( 19 A -12 )
ASN( 19 A -11 )
VAL( 19 A -10 )
ALA( 19 A -9 )
THR( 19 A -8 )
PHE( 19 A -7 )
ASP( 19 A -6 )
VAL( 19 A -5 )
SER( 19 A -4 )
VAL( 19 A -3 )
VAL( 19 A -2 )
LEU( 19 A -1 )
GLU( 19 A 0 )
MET( 20 A-107 )
GLU( 20 A-106 )
PHE( 20 A-105 )
PRO( 20 A-104 )
ASP( 20 A-103 )
LEU( 20 A-102 )
THR( 20 A-101 )
VAL( 20 A-100 )
GLU( 20 A -99 )
ILE( 20 A -98 )
LYS( 20 A -97 )
GLY( 20 A -96 )
PRO( 20 A -95 )
ASP( 20 A -94 )
VAL( 20 A -93 )
VAL( 20 A -92 )
GLY( 20 A -91 )
VAL( 20 A -90 )
ASN( 20 A -89 )
LYS( 20 A -88 )
LEU( 20 A -87 )
ALA( 20 A -86 )
GLU( 20 A -85 )
TYR( 20 A -84 )
GLU( 20 A -83 )
VAL( 20 A -82 )
HIS( 20 A -81 )
VAL( 20 A -80 )
LYS( 20 A -79 )
ASN( 20 A -78 )
LEU( 20 A -77 )
GLY( 20 A -76 )
GLY( 20 A -75 )
ILE( 20 A -74 )
GLY( 20 A -73 )
VAL( 20 A -72 )
PRO( 20 A -71 )
SER( 20 A -70 )
THR( 20 A -69 )
LYS( 20 A -68 )
VAL( 20 A -67 )
ARG( 20 A -66 )
VAL( 20 A -65 )
TYR( 20 A -64 )
ILE( 20 A -63 )
ASN( 20 A -62 )
GLY( 20 A -61 )
THR( 20 A -60 )
LEU( 20 A -59 )
TYR( 20 A -58 )
LYS( 20 A -57 )
ASN( 20 A -56 )
TRP( 20 A -55 )
THR( 20 A -54 )
VAL( 20 A -53 )
SER( 20 A -52 )
LEU( 20 A -51 )
GLY( 20 A -50 )
PRO( 20 A -49 )
LYS( 20 A -48 )
GLU( 20 A -47 )
GLU( 20 A -46 )
LYS( 20 A -45 )
VAL( 20 A -44 )
LEU( 20 A -43 )
THR( 20 A -42 )
PHE( 20 A -41 )
SER( 20 A -40 )
TRP( 20 A -39 )
THR( 20 A -38 )
PRO( 20 A -37 )
THR( 20 A -36 )
GLN( 20 A -35 )
GLU( 20 A -34 )
GLY( 20 A -33 )
MET( 20 A -32 )
TYR( 20 A -31 )
ARG( 20 A -30 )
ILE( 20 A -29 )
ASN( 20 A -28 )
ALA( 20 A -27 )
THR( 20 A -26 )
VAL( 20 A -25 )
ASP( 20 A -24 )
GLU( 20 A -23 )
GLU( 20 A -22 )
ASN( 20 A -21 )
THR( 20 A -20 )
VAL( 20 A -19 )
VAL( 20 A -18 )
GLU( 20 A -17 )
LEU( 20 A -16 )
ASN( 20 A -15 )
GLU( 20 A -14 )
ASN( 20 A -13 )
ASN( 20 A -12 )
ASN( 20 A -11 )
VAL( 20 A -10 )
ALA( 20 A -9 )
THR( 20 A -8 )
PHE( 20 A -7 )
ASP( 20 A -6 )
VAL( 20 A -5 )
SER( 20 A -4 )
VAL( 20 A -3 )
VAL( 20 A -2 )
LEU( 20 A -1 )
GLU( 20 A 0 )
PDB Chain_ID: A
1 15
SEQRES: MET GLU PHE PRO ASP LEU THR VAL GLU ILE LYS GLY PRO ASP VAL
COORDS: ... ... ... ... ... ... ... ... ... ... ... ... ... ... ...
16 30
SEQRES: VAL GLY VAL ASN LYS LEU ALA GLU TYR GLU VAL HIS VAL LYS ASN
COORDS: ... ... ... ... ... ... ... ... ... ... ... ... ... ... ...
31 45
SEQRES: LEU GLY GLY ILE GLY VAL PRO SER THR LYS VAL ARG VAL TYR ILE
COORDS: ... ... ... ... ... ... ... ... ... ... ... ... ... ... ...
46 60
SEQRES: ASN GLY THR LEU TYR LYS ASN TRP THR VAL SER LEU GLY PRO LYS
COORDS: ... ... ... ... ... ... ... ... ... ... ... ... ... ... ...
61 75
SEQRES: GLU GLU LYS VAL LEU THR PHE SER TRP THR PRO THR GLN GLU GLY
COORDS: ... ... ... ... ... ... ... ... ... ... ... ... ... ... ...
76 90
SEQRES: MET TYR ARG ILE ASN ALA THR VAL ASP GLU GLU ASN THR VAL VAL
COORDS: ... ... ... ... ... ... ... ... ... ... ... ... ... ... ...
91 105
SEQRES: GLU LEU ASN GLU ASN ASN ASN VAL ALA THR PHE ASP VAL SER VAL
COORDS: ... ... ... ... ... ... ... ... ... ... ... ... ... ... ...
106 120
SEQRES: VAL LEU GLU MET GLU PHE PRO ASP LEU THR VAL GLU ILE LYS GLY
COORDS: ... ... ... MET GLU PHE PRO ASP LEU THR VAL GLU ILE LYS GLY
1 12
121 135
SEQRES: PRO ASP VAL VAL GLY VAL ASN LYS LEU ALA GLU TYR GLU VAL HIS
COORDS: PRO ASP VAL VAL GLY VAL ASN LYS LEU ALA GLU TYR GLU VAL HIS
13 27
136 150
SEQRES: VAL LYS ASN LEU GLY GLY ILE GLY VAL PRO SER THR LYS VAL ARG
COORDS: VAL LYS ASN LEU GLY GLY ILE GLY VAL PRO SER THR LYS VAL ARG
28 42
151 165
SEQRES: VAL TYR ILE ASN GLY THR LEU TYR LYS ASN TRP THR VAL SER LEU
COORDS: VAL TYR ILE ASN GLY THR LEU TYR LYS ASN TRP THR VAL SER LEU
43 57
166 180
SEQRES: GLY PRO LYS GLU GLU LYS VAL LEU THR PHE SER TRP THR PRO THR
COORDS: GLY PRO LYS GLU GLU LYS VAL LEU THR PHE SER TRP THR PRO THR
58 72
181 195
SEQRES: GLN GLU GLY MET TYR ARG ILE ASN ALA THR VAL ASP GLU GLU ASN
COORDS: GLN GLU GLY MET TYR ARG ILE ASN ALA THR VAL ASP GLU GLU ASN
73 87
196 210
SEQRES: THR VAL VAL GLU LEU ASN GLU ASN ASN ASN VAL ALA THR PHE ASP
COORDS: THR VAL VAL GLU LEU ASN GLU ASN ASN ASN VAL ALA THR PHE ASP
88 102
211 216
SEQRES: VAL SER VAL VAL LEU GLU
COORDS: VAL SER VAL VAL LEU GLU
103 108
==> The following residues have missing atoms:
RES MOD#C SEQ ATOMS
GLU( 1 A 2) HE2
ASP( 1 A 5) HD2
GLU( 1 A 9) HE2
ASP( 1 A 14) HD2
GLU( 1 A 23) HE2
GLU( 1 A 25) HE2
HIS( 1 A 27) HD1
GLU( 1 A 61) HE2
GLU( 1 A 62) HE2
GLU( 1 A 74) HE2
ASP( 1 A 84) HD2
GLU( 1 A 85) HE2
GLU( 1 A 86) HE2
GLU( 1 A 91) HE2
GLU( 1 A 94) HE2
ASP( 1 A 102) HD2
GLU( 1 A 108) HE2
GLU( 2 A 2) HE2
ASP( 2 A 5) HD2
GLU( 2 A 9) HE2
ASP( 2 A 14) HD2
GLU( 2 A 23) HE2
GLU( 2 A 25) HE2
HIS( 2 A 27) HD1
GLU( 2 A 61) HE2
GLU( 2 A 62) HE2
GLU( 2 A 74) HE2
ASP( 2 A 84) HD2
GLU( 2 A 85) HE2
GLU( 2 A 86) HE2
GLU( 2 A 91) HE2
GLU( 2 A 94) HE2
ASP( 2 A 102) HD2
GLU( 2 A 108) HE2
GLU( 3 A 2) HE2
ASP( 3 A 5) HD2
GLU( 3 A 9) HE2
ASP( 3 A 14) HD2
GLU( 3 A 23) HE2
GLU( 3 A 25) HE2
HIS( 3 A 27) HD1
GLU( 3 A 61) HE2
GLU( 3 A 62) HE2
GLU( 3 A 74) HE2
ASP( 3 A 84) HD2
GLU( 3 A 85) HE2
GLU( 3 A 86) HE2
GLU( 3 A 91) HE2
GLU( 3 A 94) HE2
ASP( 3 A 102) HD2
GLU( 3 A 108) HE2
GLU( 4 A 2) HE2
ASP( 4 A 5) HD2
GLU( 4 A 9) HE2
ASP( 4 A 14) HD2
GLU( 4 A 23) HE2
GLU( 4 A 25) HE2
HIS( 4 A 27) HD1
GLU( 4 A 61) HE2
GLU( 4 A 62) HE2
GLU( 4 A 74) HE2
ASP( 4 A 84) HD2
GLU( 4 A 85) HE2
GLU( 4 A 86) HE2
GLU( 4 A 91) HE2
GLU( 4 A 94) HE2
ASP( 4 A 102) HD2
GLU( 4 A 108) HE2
GLU( 5 A 2) HE2
ASP( 5 A 5) HD2
GLU( 5 A 9) HE2
ASP( 5 A 14) HD2
GLU( 5 A 23) HE2
GLU( 5 A 25) HE2
HIS( 5 A 27) HE2
GLU( 5 A 61) HE2
GLU( 5 A 62) HE2
GLU( 5 A 74) HE2
ASP( 5 A 84) HD2
GLU( 5 A 85) HE2
GLU( 5 A 86) HE2
GLU( 5 A 91) HE2
GLU( 5 A 94) HE2
ASP( 5 A 102) HD2
GLU( 5 A 108) HE2
GLU( 6 A 2) HE2
ASP( 6 A 5) HD2
GLU( 6 A 9) HE2
ASP( 6 A 14) HD2
GLU( 6 A 23) HE2
GLU( 6 A 25) HE2
HIS( 6 A 27) HD1
GLU( 6 A 61) HE2
GLU( 6 A 62) HE2
GLU( 6 A 74) HE2
ASP( 6 A 84) HD2
GLU( 6 A 85) HE2
GLU( 6 A 86) HE2
GLU( 6 A 91) HE2
GLU( 6 A 94) HE2
ASP( 6 A 102) HD2
GLU( 6 A 108) HE2
GLU( 7 A 2) HE2
ASP( 7 A 5) HD2
GLU( 7 A 9) HE2
ASP( 7 A 14) HD2
GLU( 7 A 23) HE2
GLU( 7 A 25) HE2
HIS( 7 A 27) HD1
GLU( 7 A 61) HE2
GLU( 7 A 62) HE2
GLU( 7 A 74) HE2
ASP( 7 A 84) HD2
GLU( 7 A 85) HE2
GLU( 7 A 86) HE2
GLU( 7 A 91) HE2
GLU( 7 A 94) HE2
ASP( 7 A 102) HD2
GLU( 7 A 108) HE2
GLU( 8 A 2) HE2
ASP( 8 A 5) HD2
GLU( 8 A 9) HE2
ASP( 8 A 14) HD2
GLU( 8 A 23) HE2
GLU( 8 A 25) HE2
HIS( 8 A 27) HD1
GLU( 8 A 61) HE2
GLU( 8 A 62) HE2
GLU( 8 A 74) HE2
ASP( 8 A 84) HD2
GLU( 8 A 85) HE2
GLU( 8 A 86) HE2
GLU( 8 A 91) HE2
GLU( 8 A 94) HE2
ASP( 8 A 102) HD2
GLU( 8 A 108) HE2
GLU( 9 A 2) HE2
ASP( 9 A 5) HD2
GLU( 9 A 9) HE2
ASP( 9 A 14) HD2
GLU( 9 A 23) HE2
GLU( 9 A 25) HE2
HIS( 9 A 27) HD1
GLU( 9 A 61) HE2
GLU( 9 A 62) HE2
GLU( 9 A 74) HE2
ASP( 9 A 84) HD2
GLU( 9 A 85) HE2
GLU( 9 A 86) HE2
GLU( 9 A 91) HE2
GLU( 9 A 94) HE2
ASP( 9 A 102) HD2
GLU( 9 A 108) HE2
GLU( 10 A 2) HE2
ASP( 10 A 5) HD2
GLU( 10 A 9) HE2
ASP( 10 A 14) HD2
GLU( 10 A 23) HE2
GLU( 10 A 25) HE2
HIS( 10 A 27) HD1
GLU( 10 A 61) HE2
GLU( 10 A 62) HE2
GLU( 10 A 74) HE2
ASP( 10 A 84) HD2
GLU( 10 A 85) HE2
GLU( 10 A 86) HE2
GLU( 10 A 91) HE2
GLU( 10 A 94) HE2
ASP( 10 A 102) HD2
GLU( 10 A 108) HE2
GLU( 11 A 2) HE2
ASP( 11 A 5) HD2
GLU( 11 A 9) HE2
ASP( 11 A 14) HD2
GLU( 11 A 23) HE2
GLU( 11 A 25) HE2
HIS( 11 A 27) HD1
GLU( 11 A 61) HE2
GLU( 11 A 62) HE2
GLU( 11 A 74) HE2
ASP( 11 A 84) HD2
GLU( 11 A 85) HE2
GLU( 11 A 86) HE2
GLU( 11 A 91) HE2
GLU( 11 A 94) HE2
ASP( 11 A 102) HD2
GLU( 11 A 108) HE2
GLU( 12 A 2) HE2
ASP( 12 A 5) HD2
GLU( 12 A 9) HE2
ASP( 12 A 14) HD2
GLU( 12 A 23) HE2
GLU( 12 A 25) HE2
HIS( 12 A 27) HD1
GLU( 12 A 61) HE2
GLU( 12 A 62) HE2
GLU( 12 A 74) HE2
ASP( 12 A 84) HD2
GLU( 12 A 85) HE2
GLU( 12 A 86) HE2
GLU( 12 A 91) HE2
GLU( 12 A 94) HE2
ASP( 12 A 102) HD2
GLU( 12 A 108) HE2
GLU( 13 A 2) HE2
ASP( 13 A 5) HD2
GLU( 13 A 9) HE2
ASP( 13 A 14) HD2
GLU( 13 A 23) HE2
GLU( 13 A 25) HE2
HIS( 13 A 27) HD1
GLU( 13 A 61) HE2
GLU( 13 A 62) HE2
GLU( 13 A 74) HE2
ASP( 13 A 84) HD2
GLU( 13 A 85) HE2
GLU( 13 A 86) HE2
GLU( 13 A 91) HE2
GLU( 13 A 94) HE2
ASP( 13 A 102) HD2
GLU( 13 A 108) HE2
GLU( 14 A 2) HE2
ASP( 14 A 5) HD2
GLU( 14 A 9) HE2
ASP( 14 A 14) HD2
GLU( 14 A 23) HE2
GLU( 14 A 25) HE2
HIS( 14 A 27) HD1
GLU( 14 A 61) HE2
GLU( 14 A 62) HE2
GLU( 14 A 74) HE2
ASP( 14 A 84) HD2
GLU( 14 A 85) HE2
GLU( 14 A 86) HE2
GLU( 14 A 91) HE2
GLU( 14 A 94) HE2
ASP( 14 A 102) HD2
GLU( 14 A 108) HE2
GLU( 15 A 2) HE2
ASP( 15 A 5) HD2
GLU( 15 A 9) HE2
ASP( 15 A 14) HD2
GLU( 15 A 23) HE2
GLU( 15 A 25) HE2
HIS( 15 A 27) HD1
GLU( 15 A 61) HE2
GLU( 15 A 62) HE2
GLU( 15 A 74) HE2
ASP( 15 A 84) HD2
GLU( 15 A 85) HE2
GLU( 15 A 86) HE2
GLU( 15 A 91) HE2
GLU( 15 A 94) HE2
ASP( 15 A 102) HD2
GLU( 15 A 108) HE2
GLU( 16 A 2) HE2
ASP( 16 A 5) HD2
GLU( 16 A 9) HE2
ASP( 16 A 14) HD2
GLU( 16 A 23) HE2
GLU( 16 A 25) HE2
HIS( 16 A 27) HE2
GLU( 16 A 61) HE2
GLU( 16 A 62) HE2
GLU( 16 A 74) HE2
ASP( 16 A 84) HD2
GLU( 16 A 85) HE2
GLU( 16 A 86) HE2
GLU( 16 A 91) HE2
GLU( 16 A 94) HE2
ASP( 16 A 102) HD2
GLU( 16 A 108) HE2
GLU( 17 A 2) HE2
ASP( 17 A 5) HD2
GLU( 17 A 9) HE2
ASP( 17 A 14) HD2
GLU( 17 A 23) HE2
GLU( 17 A 25) HE2
HIS( 17 A 27) HD1
GLU( 17 A 61) HE2
GLU( 17 A 62) HE2
GLU( 17 A 74) HE2
ASP( 17 A 84) HD2
GLU( 17 A 85) HE2
GLU( 17 A 86) HE2
GLU( 17 A 91) HE2
GLU( 17 A 94) HE2
ASP( 17 A 102) HD2
GLU( 17 A 108) HE2
GLU( 18 A 2) HE2
ASP( 18 A 5) HD2
GLU( 18 A 9) HE2
ASP( 18 A 14) HD2
GLU( 18 A 23) HE2
GLU( 18 A 25) HE2
HIS( 18 A 27) HE2
GLU( 18 A 61) HE2
GLU( 18 A 62) HE2
GLU( 18 A 74) HE2
ASP( 18 A 84) HD2
GLU( 18 A 85) HE2
GLU( 18 A 86) HE2
GLU( 18 A 91) HE2
GLU( 18 A 94) HE2
ASP( 18 A 102) HD2
GLU( 18 A 108) HE2
GLU( 19 A 2) HE2
ASP( 19 A 5) HD2
GLU( 19 A 9) HE2
ASP( 19 A 14) HD2
GLU( 19 A 23) HE2
GLU( 19 A 25) HE2
HIS( 19 A 27) HD1
GLU( 19 A 61) HE2
GLU( 19 A 62) HE2
GLU( 19 A 74) HE2
ASP( 19 A 84) HD2
GLU( 19 A 85) HE2
GLU( 19 A 86) HE2
GLU( 19 A 91) HE2
GLU( 19 A 94) HE2
ASP( 19 A 102) HD2
GLU( 19 A 108) HE2
GLU( 20 A 2) HE2
ASP( 20 A 5) HD2
GLU( 20 A 9) HE2
ASP( 20 A 14) HD2
GLU( 20 A 23) HE2
GLU( 20 A 25) HE2
HIS( 20 A 27) HE2
GLU( 20 A 61) HE2
GLU( 20 A 62) HE2
GLU( 20 A 74) HE2
ASP( 20 A 84) HD2
GLU( 20 A 85) HE2
GLU( 20 A 86) HE2
GLU( 20 A 91) HE2
GLU( 20 A 94) HE2
ASP( 20 A 102) HD2
GLU( 20 A 108) HE2
==> The following residues have extra atoms:
RES MOD#C SEQ ATOMS
GLU( 1 A 108) O2
GLU( 2 A 108) O2
GLU( 3 A 108) O2
GLU( 4 A 108) O2
GLU( 5 A 108) O2
GLU( 6 A 108) O2
GLU( 7 A 108) O2
GLU( 8 A 108) O2
GLU( 9 A 108) O2
GLU( 10 A 108) O2
GLU( 11 A 108) O2
GLU( 12 A 108) O2
GLU( 13 A 108) O2
GLU( 14 A 108) O2
GLU( 15 A 108) O2
GLU( 16 A 108) O2
GLU( 17 A 108) O2
GLU( 18 A 108) O2
GLU( 19 A 108) O2
GLU( 20 A 108) O2
CHECK TERMINAL ATOMS
--------------------
Terminal atom(s) showed in middle of sequence will be deleted:
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
PFR193A_R3_em_bcr3.pdb: Missing KEYWDS records
PFR193A_R3_em_bcr3.pdb: Missing TITLE record