Detailed results of SRR115C_NMR_em_bcr3 by PSVS
Output from PDBStat
Constraints analysis
table of NOE constraints
# -------------- SUMMARY OF RESTRAINTS ---------------
# TOTAL NUMBER OF NOE RESTRAINTS : 3081
# INTRA-RESIDUE RESTRAINTS (I=J) : 557
# SEQUENTIAL RESTRAINTS (I-J)=1 : 703
# BACKBONE-BACKBONE : 106
# BACKBONE-SIDE CHAIN : 112
# SIDE CHAIN-SIDE CHAIN : 485
# MEDIUM RANGE RESTRAINTS 1<(I-J)<5 : 1017
# BACKBONE-BACKBONE : 276
# BACKBONE-SIDE CHAIN : 266
# SIDE CHAIN-SIDE CHAIN : 475
# LONG RANGE RESTRAINTS (I-J)>=5 : 804
# TOTAL HYDROGEN BOND RESTRAINTS : 0
# LONG RANGE H-BOND RESTR. (I-J)>=5 : 0
# DISULFIDE RESTRAINTS : 0
# INTRA-CHAIN RESTRAINTS : 3081
# INTER-CHAIN RESTRAINTS : 0
# AMBIGUOUS RESTRAINTS : 0
# -----------------------------------------------------
# -----------------------------------------------------
# -----------------------------------------------------
# RES # INTRA INTER seq med lng InterChain
GLU 1 0 2.5 2.5 0.0 0.0 0.0
ASP 2 3 10.5 9.0 1.5 0.0 0.0
PRO 3 0 15.5 9.5 2.0 4.0 0.0
GLU 4 7 7.5 5.5 0.5 1.5 0.0
ASP 5 1 15.5 7.0 8.5 0.0 0.0
PRO 6 0 17.5 9.0 4.5 4.0 0.0
PHE 7 4 21.5 7.5 12.0 2.0 0.0
THR 8 3 19.5 7.0 8.0 4.5 0.0
ARG 9 16 34.0 9.5 11.0 13.5 0.0
TYR 10 4 38.5 8.5 15.5 14.5 0.0
ALA 11 1 17.0 5.0 12.0 0.0 0.0
LEU 12 10 24.0 6.5 15.0 2.5 0.0
ALA 13 1 34.5 7.5 14.0 13.0 0.0
GLN 14 8 29.0 6.5 14.0 8.5 0.0
GLU 15 5 19.5 7.0 12.5 0.0 0.0
HIS 16 5 40.0 8.0 12.0 20.0 0.0
LEU 17 10 35.0 9.0 12.0 14.0 0.0
LYS 18 15 17.0 10.5 6.5 0.0 0.0
HIS 19 5 15.0 8.5 6.5 0.0 0.0
ASP 20 3 10.5 5.5 5.0 0.0 0.0
ASN 21 6 34.0 7.5 19.0 7.5 0.0
ALA 22 1 23.0 6.5 6.5 10.0 0.0
SER 23 1 16.5 4.5 10.5 1.5 0.0
ARG 24 14 24.0 5.5 16.0 2.5 0.0
ALA 25 1 39.0 5.5 17.0 16.5 0.0
LEU 26 11 43.5 6.0 16.5 21.0 0.0
ALA 27 1 18.0 8.0 9.0 1.0 0.0
LEU 28 12 39.0 8.5 12.5 18.0 0.0
PHE 29 4 56.5 6.5 16.0 34.0 0.0
GLU 30 5 25.0 5.0 13.0 7.0 0.0
GLU 31 4 20.5 7.0 11.5 2.0 0.0
LEU 32 10 47.5 10.5 16.5 20.5 0.0
VAL 33 5 34.5 11.0 12.0 11.5 0.0
GLU 34 4 17.0 11.5 5.5 0.0 0.0
THR 35 2 17.0 8.0 9.0 0.0 0.0
ASP 36 1 18.0 4.0 14.0 0.0 0.0
PRO 37 0 13.0 5.0 4.0 4.0 0.0
ASP 38 0 9.0 5.0 1.5 2.5 0.0
TYR 39 5 34.0 10.0 13.5 10.5 0.0
VAL 40 5 42.0 11.0 7.5 23.5 0.0
GLY 41 0 11.0 4.5 6.5 0.0 0.0
THR 42 5 30.5 4.5 13.5 12.5 0.0
TYR 43 6 46.0 5.0 14.5 26.5 0.0
TYR 44 3 34.0 7.0 9.5 17.5 0.0
HIS 45 7 26.5 10.0 9.0 7.5 0.0
LEU 46 11 54.0 9.0 20.0 25.0 0.0
GLY 47 0 26.0 5.5 11.0 9.5 0.0
LYS 48 25 21.5 5.0 12.5 4.0 0.0
LEU 49 11 53.5 8.0 21.0 24.5 0.0
TYR 50 6 57.5 8.0 17.0 32.5 0.0
GLU 51 5 23.0 6.5 5.5 11.0 0.0
ARG 52 13 21.0 8.5 10.0 2.5 0.0
LEU 53 10 31.0 10.0 17.0 4.0 0.0
ASP 54 3 13.0 9.0 4.0 0.0 0.0
ARG 55 13 31.5 8.5 13.5 9.5 0.0
THR 56 3 29.5 6.5 8.5 14.5 0.0
ASP 57 1 13.5 5.0 8.0 0.5 0.0
ASP 58 2 21.5 5.0 10.0 6.5 0.0
ALA 59 1 35.5 7.0 12.0 16.5 0.0
ILE 60 11 48.0 9.5 18.0 20.5 0.0
ASP 61 2 15.0 7.0 8.0 0.0 0.0
THR 62 3 31.0 5.0 10.5 15.5 0.0
TYR 63 5 47.5 7.5 14.0 26.0 0.0
ALA 64 1 26.0 8.0 13.0 5.0 0.0
GLN 65 14 32.5 8.0 15.0 9.5 0.0
GLY 66 0 29.0 6.5 12.5 10.0 0.0
ILE 67 12 56.0 8.5 19.0 28.5 0.0
GLU 68 5 27.5 11.0 16.0 0.5 0.0
VAL 69 5 43.5 9.0 23.5 11.0 0.0
ALA 70 1 38.0 6.0 17.5 14.5 0.0
ARG 71 18 25.5 9.0 10.0 6.5 0.0
GLU 72 8 20.5 12.0 8.5 0.0 0.0
GLU 73 4 24.0 8.5 12.0 3.5 0.0
GLY 74 0 15.5 5.5 5.0 5.0 0.0
THR 75 2 13.0 6.0 6.5 0.5 0.0
GLN 76 9 18.5 6.5 10.0 2.0 0.0
LYS 77 17 13.0 6.0 7.0 0.0 0.0
ASP 78 2 25.5 7.0 12.0 6.5 0.0
LEU 79 11 46.5 9.5 22.5 14.5 0.0
SER 80 1 20.5 8.0 11.0 1.5 0.0
GLU 81 3 18.0 5.0 9.0 4.0 0.0
LEU 82 12 55.0 7.0 13.0 35.0 0.0
GLN 83 13 36.5 8.5 18.0 10.0 0.0
ASP 84 2 20.0 8.0 11.5 0.5 0.0
ALA 85 1 23.5 6.0 11.0 6.5 0.0
LYS 86 24 44.5 8.5 10.5 25.5 0.0
LEU 87 9 26.0 11.0 13.5 1.5 0.0
LYS 88 19 21.0 11.0 9.5 0.5 0.0
ALA 89 1 21.0 9.5 6.5 5.0 0.0
GLU 90 6 22.5 6.0 9.0 7.5 0.0
GLY 91 0 9.5 6.0 3.5 0.0 0.0
LEU 92 11 15.0 7.5 2.5 5.0 0.0
GLU 93 7 11.5 8.5 1.0 2.0 0.0
HIS 94 0 6.5 6.5 0.0 0.0 0.0
HIS 95 0 2.0 2.0 0.0 0.0 0.0
HIS 96 0 0.0 0.0 0.0 0.0 0.0
HIS 97 0 0.0 0.0 0.0 0.0 0.0
HIS 98 0 0.0 0.0 0.0 0.0 0.0
HIS 99 0 0.0 0.0 0.0 0.0 0.0
# TOTAL 557 2524.0 703.0 1017.0 804.0 0.0
# TOTAL NUMBER OF RESTRAINTS (CHECKING): 3081.0
List of conformationally-resticting NOE constraints
assign ((resid 1 and name HA )) ( (resid 2 and name HN )) 3.00 1.20 0.45
assign ((resid 1 and name HB2 )) ( (resid 2 and name HN )) 4.10 2.30 0.62
assign ((resid 1 and name HB1 )) ( (resid 2 and name HN )) 4.10 2.30 0.62
assign ((resid 2 and name HN )) ( (resid 2 and name HB2 )) 3.61 1.81 0.54
assign ((resid 2 and name HN )) ( (resid 2 and name HB1 )) 3.61 1.81 0.54
assign ((resid 51 and name HN )) ( (resid 51 and name HG2 )) 3.43 1.63 0.51
assign ((resid 4 and name HN )) ( (resid 4 and name HG1 )) 3.83 2.03 0.57
assign ((resid 4 and name HN )) ( (resid 5 and name HN )) 3.00 1.20 0.45
assign ((resid 5 and name HN )) ( (resid 8 and name HB )) 4.26 2.46 0.64
assign ((resid 4 and name HB2 )) ( (resid 5 and name HN )) 3.87 2.07 0.58
assign ((resid 4 and name HB1 )) ( (resid 5 and name HN )) 3.87 2.07 0.58
assign ((resid 5 and name HN )) ( (resid 5 and name HB2 )) 2.81 1.01 0.42
assign ((resid 6 and name HB2 )) ( (resid 7 and name HN )) 4.19 2.39 0.63
assign ((resid 6 and name HB1 )) ( (resid 7 and name HN )) 4.19 2.39 0.63
assign ((resid 6 and name HG1 )) ( (resid 7 and name HN )) 4.09 2.29 0.61
assign ((resid 6 and name HG2 )) ( (resid 7 and name HN )) 4.09 2.29 0.61
assign ((resid 6 and name HD2 )) ( (resid 7 and name HN )) 4.15 2.35 0.62
assign ((resid 6 and name HD1 )) ( (resid 7 and name HN )) 4.15 2.35 0.62
assign ((resid 7 and name HN )) ( (resid 7 and name HB1 )) 3.13 1.33 0.47
assign ((resid 7 and name HN )) ( (resid 7 and name HB2 )) 3.20 1.40 0.48
assign ((resid 7 and name HN )) ( (resid 7 and name HD* )) 4.20 2.40 0.63
assign ((resid 7 and name HN )) ( (resid 8 and name HN )) 3.16 1.36 0.47
assign ((resid 7 and name HB1 )) ( (resid 8 and name HN )) 3.49 1.69 0.52
assign ((resid 7 and name HB2 )) ( (resid 8 and name HN )) 3.81 2.01 0.57
assign ((resid 7 and name HD* )) ( (resid 8 and name HN )) 4.40 2.60 0.66
assign ((resid 8 and name HN )) ( (resid 8 and name HB )) 2.91 1.11 0.44
assign ((resid 8 and name HN )) ( (resid 9 and name HN )) 3.22 1.42 0.48
assign ((resid 8 and name HN )) ( (resid 10 and name HN )) 4.24 2.44 0.64
assign ((resid 7 and name HN )) ( (resid 9 and name HN )) 5.15 3.35 0.77
assign ((resid 8 and name HB )) ( (resid 9 and name HN )) 3.51 1.71 0.53
assign ((resid 9 and name HN )) ( (resid 9 and name HB1 )) 3.40 1.60 0.51
assign ((resid 9 and name HN )) ( (resid 9 and name HG2 )) 3.74 1.94 0.56
assign ((resid 9 and name HN )) ( (resid 9 and name HG1 )) 3.70 1.90 0.56
assign ((resid 9 and name HN )) ( (resid 9 and name HD1 )) 4.37 2.57 0.66
assign ((resid 9 and name HN )) ( (resid 9 and name HD2 )) 4.58 2.78 0.69
assign ((resid 7 and name HA )) ( (resid 10 and name HN )) 4.09 2.29 0.61
assign ((resid 7 and name HA )) ( (resid 11 and name HN )) 4.34 2.54 0.65
assign ((resid 9 and name HN )) ( (resid 10 and name HN )) 3.57 1.77 0.54
assign ((resid 9 and name HB1 )) ( (resid 10 and name HN )) 3.97 2.17 0.60
assign ((resid 9 and name HB2 )) ( (resid 10 and name HN )) 4.40 2.60 0.66
assign ((resid 9 and name HG2 )) ( (resid 10 and name HN )) 4.51 2.71 0.68
assign ((resid 9 and name HG1 )) ( (resid 10 and name HN )) 3.93 2.13 0.59
assign ((resid 9 and name HD1 )) ( (resid 10 and name HN )) 4.22 2.42 0.63
assign ((resid 9 and name HD2 )) ( (resid 10 and name HN )) 4.53 2.73 0.68
assign ((resid 10 and name HN )) ( (resid 10 and name HB2 )) 3.34 1.54 0.50
assign ((resid 10 and name HN )) ( (resid 10 and name HB1 )) 3.57 1.77 0.54
assign ((resid 10 and name HB1 )) ( (resid 11 and name HN )) 3.84 2.04 0.58
assign ((resid 10 and name HD* )) ( (resid 11 and name HN )) 3.47 1.67 0.52
assign ((resid 11 and name HN )) ( (resid 11 and name HB* )) 2.76 0.96 0.41
assign ((resid 11 and name HN )) ( (resid 12 and name HN )) 3.30 1.50 0.50
assign ((resid 9 and name HA )) ( (resid 12 and name HN )) 3.97 2.17 0.60
assign ((resid 10 and name HA )) ( (resid 12 and name HN )) 4.98 3.18 0.75
assign ((resid 12 and name HN )) ( (resid 12 and name HB2 )) 3.07 1.27 0.46
assign ((resid 12 and name HN )) ( (resid 12 and name HB1 )) 3.37 1.57 0.51
assign ((resid 12 and name HN )) ( (resid 28 and name HD1* )) 4.63 2.83 0.69
assign ((resid 12 and name HN )) ( (resid 14 and name HN )) 4.62 2.82 0.69
assign ((resid 10 and name HA )) ( (resid 13 and name HN )) 4.02 2.22 0.60
assign ((resid 12 and name HN )) ( (resid 13 and name HN )) 3.01 1.21 0.45
assign ((resid 12 and name HB1 )) ( (resid 13 and name HN )) 3.01 1.21 0.45
assign ((resid 22 and name HN )) ( (resid 22 and name HB* )) 2.66 0.86 0.40
assign ((resid 13 and name HN )) ( (resid 28 and name HD1* )) 3.36 1.56 0.50
assign ((resid 13 and name HN )) ( (resid 13 and name HB* )) 2.70 0.90 0.41
assign ((resid 13 and name HN )) ( (resid 14 and name HN )) 2.94 1.14 0.44
assign ((resid 13 and name HN )) ( (resid 15 and name HN )) 4.23 2.43 0.63
assign ((resid 10 and name HA )) ( (resid 14 and name HN )) 5.15 3.35 0.77
assign ((resid 13 and name HB* )) ( (resid 14 and name HN )) 3.12 1.32 0.47
assign ((resid 14 and name HN )) ( (resid 14 and name HB2 )) 3.08 1.28 0.46
assign ((resid 14 and name HN )) ( (resid 14 and name HB1 )) 3.71 1.91 0.56
assign ((resid 14 and name HN )) ( (resid 14 and name HG2 )) 3.17 1.37 0.48
assign ((resid 14 and name HN )) ( (resid 14 and name HG1 )) 3.26 1.46 0.49
assign ((resid 14 and name HN )) ( (resid 15 and name HN )) 3.24 1.44 0.49
assign ((resid 14 and name HN )) ( (resid 16 and name HN )) 4.34 2.54 0.65
assign ((resid 13 and name HA )) ( (resid 15 and name HN )) 6.50 4.70 0.98
assign ((resid 52 and name HN )) ( (resid 52 and name HG2 )) 5.00 3.20 0.75
assign ((resid 14 and name HG2 )) ( (resid 15 and name HN )) 4.76 2.96 0.71
assign ((resid 14 and name HG1 )) ( (resid 15 and name HN )) 4.13 2.33 0.62
assign ((resid 15 and name HN )) ( (resid 15 and name HB2 )) 2.95 1.15 0.44
assign ((resid 15 and name HN )) ( (resid 15 and name HG2 )) 3.47 1.67 0.52
assign ((resid 15 and name HN )) ( (resid 17 and name HN )) 4.16 2.36 0.62
assign ((resid 13 and name HA )) ( (resid 16 and name HN )) 3.95 2.15 0.59
assign ((resid 15 and name HN )) ( (resid 16 and name HN )) 3.12 1.32 0.47
assign ((resid 15 and name HB2 )) ( (resid 16 and name HN )) 3.12 1.32 0.47
assign ((resid 15 and name HG1 )) ( (resid 16 and name HN )) 5.00 3.20 0.75
assign ((resid 16 and name HN )) ( (resid 16 and name HB1 )) 3.58 1.78 0.54
assign ((resid 16 and name HN )) ( (resid 16 and name HB2 )) 3.37 1.57 0.51
assign ((resid 16 and name HN )) ( (resid 16 and name HD2 )) 3.93 2.13 0.59
assign ((resid 13 and name HA )) ( (resid 17 and name HN )) 5.98 4.18 0.90
assign ((resid 14 and name HA )) ( (resid 17 and name HN )) 3.93 2.13 0.59
assign ((resid 15 and name HA )) ( (resid 17 and name HN )) 5.68 3.88 0.85
assign ((resid 16 and name HN )) ( (resid 17 and name HN )) 3.20 1.40 0.48
assign ((resid 16 and name HB1 )) ( (resid 17 and name HN )) 3.62 1.82 0.54
assign ((resid 16 and name HB2 )) ( (resid 17 and name HN )) 3.72 1.92 0.56
assign ((resid 16 and name HD2 )) ( (resid 17 and name HN )) 5.49 3.69 0.82
assign ((resid 17 and name HN )) ( (resid 17 and name HB2 )) 2.70 0.90 0.41
assign ((resid 17 and name HN )) ( (resid 17 and name HG )) 3.23 1.43 0.48
assign ((resid 17 and name HN )) ( (resid 17 and name HD2* )) 3.65 1.85 0.55
assign ((resid 17 and name HN )) ( (resid 18 and name HN )) 3.06 1.26 0.46
assign ((resid 17 and name HB2 )) ( (resid 18 and name HN )) 2.77 0.97 0.42
assign ((resid 17 and name HG )) ( (resid 18 and name HN )) 4.35 2.55 0.65
assign ((resid 17 and name HD2* )) ( (resid 18 and name HN )) 4.62 2.82 0.69
assign ((resid 17 and name HD1* )) ( (resid 18 and name HN )) 4.83 3.03 0.72
assign ((resid 18 and name HN )) ( (resid 18 and name HG2 )) 3.54 1.74 0.53
assign ((resid 18 and name HN )) ( (resid 18 and name HG1 )) 3.54 1.74 0.53
assign ((resid 18 and name HN )) ( (resid 19 and name HN )) 3.06 1.26 0.46
assign ((resid 18 and name HB2 )) ( (resid 19 and name HN )) 4.97 3.17 0.75
assign ((resid 18 and name HB1 )) ( (resid 19 and name HN )) 4.97 3.17 0.75
assign ((resid 18 and name HG2 )) ( (resid 19 and name HN )) 5.27 3.47 0.79
assign ((resid 18 and name HG1 )) ( (resid 19 and name HN )) 5.27 3.47 0.79
assign ((resid 19 and name HN )) ( (resid 19 and name HB2 )) 3.71 1.91 0.56
assign ((resid 19 and name HN )) ( (resid 19 and name HB1 )) 3.71 1.91 0.56
assign ((resid 19 and name HN )) ( (resid 19 and name HD2 )) 4.28 2.48 0.64
assign ((resid 19 and name HN )) ( (resid 20 and name HN )) 3.08 1.28 0.46
assign ((resid 19 and name HB2 )) ( (resid 20 and name HN )) 4.25 2.45 0.64
assign ((resid 19 and name HB1 )) ( (resid 20 and name HN )) 4.25 2.45 0.64
assign ((resid 19 and name HD2 )) ( (resid 20 and name HN )) 5.27 3.47 0.79
assign ((resid 20 and name HN )) ( (resid 20 and name HB2 )) 3.57 1.77 0.54
assign ((resid 20 and name HN )) ( (resid 20 and name HB1 )) 3.57 1.77 0.54
assign ((resid 20 and name HN )) ( (resid 21 and name HN )) 3.11 1.31 0.47
assign ((resid 20 and name HA )) ( (resid 21 and name HN )) 3.03 1.23 0.45
assign ((resid 20 and name HB2 )) ( (resid 21 and name HN )) 4.65 2.85 0.70
assign ((resid 20 and name HB1 )) ( (resid 21 and name HN )) 4.65 2.85 0.70
assign ((resid 21 and name HN )) ( (resid 21 and name HB2 )) 3.01 1.21 0.45
assign ((resid 21 and name HA )) ( (resid 21 and name HD21 )) 4.87 3.07 0.73
assign ((resid 21 and name HN )) ( (resid 21 and name HD22 )) 5.54 3.74 0.83
assign ((resid 21 and name HA )) ( (resid 21 and name HD22 )) 4.78 2.98 0.72
assign ((resid 21 and name HB1 )) ( (resid 21 and name HD22 )) 3.78 1.98 0.57
assign ((resid 21 and name HN )) ( (resid 22 and name HN )) 3.28 1.48 0.49
assign ((resid 21 and name HA )) ( (resid 22 and name HN )) 2.91 1.11 0.44
assign ((resid 21 and name HB2 )) ( (resid 22 and name HN )) 4.32 2.52 0.65
assign ((resid 22 and name HN )) ( (resid 23 and name HN )) 3.78 1.98 0.57
assign ((resid 22 and name HB* )) ( (resid 23 and name HN )) 3.52 1.72 0.53
assign ((resid 23 and name HN )) ( (resid 24 and name HN )) 3.75 1.95 0.56
assign ((resid 22 and name HN )) ( (resid 24 and name HN )) 4.68 2.88 0.70
assign ((resid 22 and name HA )) ( (resid 24 and name HN )) 4.60 2.80 0.69
assign ((resid 23 and name HB2 )) ( (resid 24 and name HN )) 4.48 2.68 0.67
assign ((resid 23 and name HB1 )) ( (resid 24 and name HN )) 4.48 2.68 0.67
assign ((resid 24 and name HN )) ( (resid 24 and name HB1 )) 3.51 1.71 0.53
assign ((resid 24 and name HN )) ( (resid 24 and name HB2 )) 3.20 1.40 0.48
assign ((resid 24 and name HN )) ( (resid 24 and name HG1 )) 3.77 1.97 0.57
assign ((resid 24 and name HN )) ( (resid 24 and name HG2 )) 3.42 1.62 0.51
assign ((resid 24 and name HN )) ( (resid 24 and name HD2 )) 5.12 3.32 0.77
assign ((resid 22 and name HA )) ( (resid 25 and name HN )) 3.61 1.81 0.54
assign ((resid 23 and name HN )) ( (resid 25 and name HN )) 4.83 3.03 0.72
assign ((resid 23 and name HA )) ( (resid 25 and name HN )) 4.78 2.98 0.72
assign ((resid 24 and name HN )) ( (resid 25 and name HN )) 3.18 1.38 0.48
assign ((resid 24 and name HB1 )) ( (resid 25 and name HN )) 3.59 1.79 0.54
assign ((resid 24 and name HB2 )) ( (resid 25 and name HN )) 3.51 1.71 0.53
assign ((resid 24 and name HG1 )) ( (resid 25 and name HN )) 4.80 3.00 0.72
assign ((resid 24 and name HG2 )) ( (resid 25 and name HN )) 4.44 2.64 0.67
assign ((resid 25 and name HN )) ( (resid 25 and name HB* )) 2.84 1.04 0.43
assign ((resid 25 and name HN )) ( (resid 26 and name HN )) 3.31 1.51 0.50
assign ((resid 25 and name HN )) ( (resid 27 and name HN )) 4.67 2.87 0.70
assign ((resid 22 and name HA )) ( (resid 26 and name HN )) 4.00 2.20 0.60
assign ((resid 23 and name HA )) ( (resid 26 and name HN )) 3.85 2.05 0.58
assign ((resid 24 and name HN )) ( (resid 26 and name HN )) 4.62 2.82 0.69
assign ((resid 24 and name HA )) ( (resid 26 and name HN )) 4.53 2.73 0.68
assign ((resid 25 and name HB* )) ( (resid 26 and name HN )) 3.13 1.33 0.47
assign ((resid 26 and name HN )) ( (resid 26 and name HB2 )) 3.13 1.33 0.47
assign ((resid 26 and name HN )) ( (resid 26 and name HB1 )) 3.19 1.39 0.48
assign ((resid 26 and name HN )) ( (resid 26 and name HG )) 4.77 2.97 0.72
assign ((resid 26 and name HN )) ( (resid 26 and name HD2* )) 3.76 1.96 0.56
assign ((resid 26 and name HN )) ( (resid 28 and name HN )) 4.91 3.11 0.74
assign ((resid 23 and name HA )) ( (resid 27 and name HN )) 5.21 3.41 0.78
assign ((resid 26 and name HN )) ( (resid 27 and name HN )) 3.30 1.50 0.50
assign ((resid 26 and name HB2 )) ( (resid 27 and name HN )) 3.53 1.73 0.53
assign ((resid 26 and name HB1 )) ( (resid 27 and name HN )) 3.22 1.42 0.48
assign ((resid 26 and name HD1* )) ( (resid 27 and name HN )) 4.20 2.40 0.63
assign ((resid 27 and name HN )) ( (resid 27 and name HB* )) 2.61 0.81 0.39
assign ((resid 27 and name HN )) ( (resid 28 and name HN )) 3.24 1.44 0.49
assign ((resid 24 and name HA )) ( (resid 28 and name HN )) 4.73 2.93 0.71
assign ((resid 25 and name HA )) ( (resid 28 and name HN )) 4.14 2.34 0.62
assign ((resid 26 and name HA )) ( (resid 28 and name HN )) 4.92 3.12 0.74
assign ((resid 27 and name HB* )) ( (resid 28 and name HN )) 3.13 1.33 0.47
assign ((resid 28 and name HN )) ( (resid 28 and name HB1 )) 3.65 1.85 0.55
assign ((resid 28 and name HN )) ( (resid 28 and name HB2 )) 3.52 1.72 0.53
assign ((resid 28 and name HN )) ( (resid 28 and name HG )) 3.06 1.26 0.46
assign ((resid 28 and name HN )) ( (resid 28 and name HD1* )) 3.48 1.68 0.52
assign ((resid 28 and name HN )) ( (resid 28 and name HD2* )) 3.43 1.63 0.51
assign ((resid 28 and name HN )) ( (resid 30 and name HN )) 4.74 2.94 0.71
assign ((resid 25 and name HA )) ( (resid 29 and name HN )) 4.66 2.86 0.70
assign ((resid 26 and name HA )) ( (resid 29 and name HN )) 3.87 2.07 0.58
assign ((resid 27 and name HN )) ( (resid 29 and name HN )) 4.84 3.04 0.73
assign ((resid 27 and name HA )) ( (resid 29 and name HN )) 4.84 3.04 0.73
assign ((resid 28 and name HN )) ( (resid 29 and name HN )) 3.30 1.50 0.50
assign ((resid 28 and name HB1 )) ( (resid 29 and name HN )) 3.58 1.78 0.54
assign ((resid 28 and name HB2 )) ( (resid 29 and name HN )) 3.84 2.04 0.58
assign ((resid 64 and name HN )) ( (resid 67 and name HD1* )) 3.67 1.87 0.55
assign ((resid 28 and name HD2* )) ( (resid 29 and name HN )) 4.68 2.88 0.70
assign ((resid 29 and name HN )) ( (resid 29 and name HB2 )) 3.33 1.53 0.50
assign ((resid 29 and name HN )) ( (resid 29 and name HD* )) 3.72 1.92 0.56
assign ((resid 29 and name HN )) ( (resid 30 and name HN )) 3.39 1.59 0.51
assign ((resid 29 and name HN )) ( (resid 31 and name HN )) 4.55 2.75 0.68
assign ((resid 27 and name HA )) ( (resid 30 and name HN )) 4.12 2.32 0.62
assign ((resid 28 and name HA )) ( (resid 30 and name HN )) 5.28 3.48 0.79
assign ((resid 29 and name HB1 )) ( (resid 30 and name HN )) 4.35 2.55 0.65
assign ((resid 29 and name HB2 )) ( (resid 30 and name HN )) 4.07 2.27 0.61
assign ((resid 29 and name HD* )) ( (resid 30 and name HN )) 4.81 3.01 0.72
assign ((resid 30 and name HN )) ( (resid 30 and name HB2 )) 3.28 1.48 0.49
assign ((resid 30 and name HN )) ( (resid 30 and name HG1 )) 3.70 1.90 0.56
assign ((resid 27 and name HA )) ( (resid 31 and name HN )) 4.13 2.33 0.62
assign ((resid 28 and name HA )) ( (resid 31 and name HN )) 4.05 2.25 0.61
assign ((resid 29 and name HA )) ( (resid 31 and name HN )) 5.32 3.52 0.80
assign ((resid 30 and name HN )) ( (resid 31 and name HN )) 3.32 1.52 0.50
assign ((resid 30 and name HB1 )) ( (resid 31 and name HN )) 3.76 1.96 0.56
assign ((resid 30 and name HB2 )) ( (resid 31 and name HN )) 2.90 1.10 0.44
assign ((resid 30 and name HG1 )) ( (resid 31 and name HN )) 4.38 2.58 0.66
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assign ((resid 81 and name HN )) ( (resid 81 and name HG* )) 3.00 1.20 0.45
assign ((resid 81 and name HA )) ( (resid 81 and name HG* )) 3.06 1.26 0.46
assign ((resid 81 and name HG* )) ( (resid 82 and name HN )) 4.75 2.95 0.71
assign ((resid 85 and name HA )) ( (resid 88 and name HD* )) 4.63 2.83 0.69
assign ((resid 88 and name HN )) ( (resid 88 and name HD* )) 4.34 2.54 0.65
assign ((resid 88 and name HA )) ( (resid 88 and name HD* )) 4.19 2.39 0.63
assign ((resid 88 and name HG2 )) ( (resid 88 and name HD* )) 2.51 0.71 0.38
assign ((resid 88 and name HG2 )) ( (resid 88 and name HE* )) 3.62 1.82 0.54
assign ((resid 88 and name HG1 )) ( (resid 88 and name HE* )) 3.72 1.92 0.56
assign ((resid 88 and name HD* )) ( (resid 89 and name HN )) 5.00 3.20 0.75
assign ((resid 88 and name HD* )) ( (resid 89 and name HA )) 4.60 2.80 0.69
assign ((resid 88 and name HE* )) ( (resid 89 and name HN )) 5.20 3.40 0.78
assign ((resid 91 and name HA* )) ( (resid 92 and name HA )) 4.61 2.81 0.69
assign ((resid 91 and name HA* )) ( (resid 92 and name HG )) 4.84 3.04 0.73
assign ((resid 91 and name HA* )) ( (resid 92 and name HD2* )) 5.40 3.60 0.81
assign ((resid 91 and name HA* )) ( (resid 93 and name HN )) 5.01 3.21 0.75
assign ((resid 93 and name HN )) ( (resid 93 and name HB* )) 3.15 1.35 0.47
assign ((resid 93 and name HN )) ( (resid 93 and name HG* )) 3.39 1.59 0.51
assign ((resid 93 and name HN )) ( (resid 94 and name HB* )) 5.09 3.29 0.76
assign ((resid 93 and name HA )) ( (resid 93 and name HG* )) 3.34 1.54 0.50
assign ((resid 93 and name HB* )) ( (resid 94 and name HN )) 3.75 1.95 0.56
assign ((resid 93 and name HG* )) ( (resid 94 and name HN )) 4.74 2.94 0.71
assign ((resid 93 and name HG* )) ( (resid 94 and name HA )) 6.50 4.70 0.98
assign ((resid 94 and name HB* )) ( (resid 95 and name HN )) 4.15 2.35 0.62
list of removed NOE constraints
6-> PRO 3 HA - GLU 4 HN 1.80 3.99 # NoRestrctn S [2.00 3.99] -- sequential
7-> GLU 4 HN - GLU 4 HB2 1.80 4.35 # NoRestrctn I [2.00 4.30] -- intra
9-> GLU 4 HN - GLU 4 HB1 1.80 4.35 # NoRestrctn I [2.00 4.30] -- intra
35-> ARG 9 HN - ARG 9 HB2 1.80 4.45 # NoRestrctn I [2.00 4.30] -- intra
86-> GLU 15 HA - HIS 16 HN 1.80 4.03 # NoRestrctn S [2.00 3.99] -- sequential
107-> LYS 18 HN - LYS 18 HA 1.80 3.32 # NoRestrctn I [2.22 2.95] -- intra
122-> ASP 20 HN - ASP 20 HA 1.80 3.06 # NoRestrctn I [2.22 2.95] -- intra
196-> PHE 29 HN - PHE 29 HB1 1.80 4.31 # NoRestrctn I [2.00 4.30] -- intra
206-> GLU 30 HN - GLU 30 HB1 1.80 4.31 # NoRestrctn I [2.00 4.30] -- intra
257-> ASP 36 HN - ASP 36 HB1 1.80 4.50 # NoRestrctn I [2.00 4.30] -- intra
259-> ASP 38 HN - ASP 38 HB2 1.80 4.81 # NoRestrctn I [2.00 4.30] -- intra
260-> ASP 38 HN - ASP 38 HB1 1.80 4.81 # NoRestrctn I [2.00 4.30] -- intra
298-> TYR 44 HN - HIS 45 HA 1.80 7.48 # NoRestrctn S [2.00 3.99] -- sequential
301-> TYR 44 HN - TYR 44 HB2 1.80 4.52 # NoRestrctn I [2.00 4.30] -- intra
302-> TYR 44 HN - TYR 44 HB1 1.80 4.52 # NoRestrctn I [2.00 4.30] -- intra
383-> GLU 51 HN - GLU 51 HB1 1.80 4.75 # NoRestrctn I [2.00 4.30] -- intra
392-> ARG 52 HN - ARG 52 HA 1.80 3.36 # NoRestrctn I [2.22 2.95] -- intra
407-> ASP 54 HN - ASP 54 HA 1.80 3.09 # NoRestrctn I [2.22 2.95] -- intra
430-> ASP 57 HN - ASP 57 HB2 1.80 4.30 # NoRestrctn I [2.00 4.30] -- intra
431-> ASP 57 HN - ASP 57 HB1 1.80 4.30 # NoRestrctn I [2.00 4.30] -- intra
480-> TYR 63 HN - TYR 63 HB1 1.80 4.37 # NoRestrctn I [2.00 4.30] -- intra
496-> GLN 65 HN - GLN 65 HA 1.80 3.38 # NoRestrctn I [2.22 2.95] -- intra
507-> GLN 65 HG2 - GLN 65 HE22 1.80 4.32 # NoRestrctn I [3.46 4.15] -- intra
569-> GLU 73 HN - GLU 73 HB1 1.80 4.32 # NoRestrctn I [2.00 4.30] -- intra
574-> GLU 73 HA - GLY 74 HN 1.80 4.09 # NoRestrctn S [2.00 3.99] -- sequential
579-> GLY 74 HN - GLY 74 HA1 1.80 3.28 # NoRestrctn I [2.00 2.99] -- intra
584-> GLN 76 HN - GLN 76 HB1 1.80 4.67 # NoRestrctn I [2.00 4.30] -- intra
593-> LYS 77 HN - LYS 77 HB1 1.80 4.34 # NoRestrctn I [2.00 4.30] -- intra
626-> GLU 81 HN - GLU 81 HA 1.80 3.37 # NoRestrctn I [2.22 2.95] -- intra
634-> LEU 82 HN - LEU 82 HB1 1.80 4.76 # NoRestrctn I [2.00 4.30] -- intra
694-> LEU 87 HA - LYS 88 HN 1.80 4.09 # NoRestrctn S [2.00 3.99] -- sequential
723-> GLY 91 HA2 - LEU 92 HN 1.80 4.01 # NoRestrctn S [2.00 3.99] -- sequential
724-> GLY 91 HA1 - LEU 92 HN 1.80 4.01 # NoRestrctn S [2.00 3.99] -- sequential
817-> ARG 24 HN - ALA 25 HA 1.80 6.31 # NoRestrctn S [2.00 3.99] -- sequential
870-> ASP 36 HN - PRO 37 HA 1.80 5.97 # NoRestrctn S [2.00 3.99] -- sequential
960-> GLN 65 HN - GLY 66 HA1 1.80 6.03 # NoRestrctn S [2.00 3.99] -- sequential
1005-> GLU 73 HN - GLY 74 HA2 1.80 6.27 # NoRestrctn S [2.00 3.99] -- sequential
1007-> GLY 74 HN - THR 75 HA 1.80 6.15 # NoRestrctn S [2.00 3.99] -- sequential
1087-> ASP 20 HN - ASN 21 HA 1.80 6.73 # NoRestrctn S [2.00 3.99] -- sequential
1102-> THR 35 HN - ASP 36 HA 1.80 6.85 # NoRestrctn S [2.00 3.99] -- sequential
1125-> THR 56 HN - ASP 57 HA 1.80 6.51 # NoRestrctn S [2.00 3.99] -- sequential
1147-> GLU 68 HN - VAL 69 HA 1.80 6.29 # NoRestrctn S [2.00 3.99] -- sequential
1150-> VAL 69 HN - ALA 70 HA 1.80 5.70 # NoRestrctn S [2.00 3.99] -- sequential
1160-> LYS 77 HN - ASP 78 HA 1.80 6.30 # NoRestrctn S [2.00 3.99] -- sequential
1252-> ASP 84 HN - ALA 85 HA 1.80 6.24 # NoRestrctn S [2.00 3.99] -- sequential
1257-> GLY 91 HN - LEU 92 HA 1.80 6.13 # NoRestrctn S [2.00 3.99] -- sequential
1261-> GLU 93 HN - HIS 94 HA 1.80 5.88 # NoRestrctn S [2.00 3.99] -- sequential
1265-> ALA 22 HN - SER 23 HA 1.80 7.48 # NoRestrctn S [2.00 3.99] -- sequential
1268-> ARG 71 HN - GLU 72 HA 1.80 6.13 # NoRestrctn S [2.00 3.99] -- sequential
1283-> GLU 1 HA - GLU 1 HG2 1.80 4.86 # NoRestrctn I [2.06 4.60] -- intra
1284-> GLU 1 HA - GLU 1 HG1 1.80 4.86 # NoRestrctn I [2.06 4.60] -- intra
1292-> GLU 4 HA - ASP 5 HN 1.80 4.09 # NoRestrctn S [2.00 3.99] -- sequential
1318-> LEU 12 HA - LEU 12 HG 1.80 4.54 # NoRestrctn I [2.06 4.26] -- intra
1337-> GLN 14 HB1 - GLN 14 HG2 1.80 3.46 # NoRestrctn I [1.99 3.26] -- intra
1344-> LEU 17 HA - LEU 17 HG 1.80 4.31 # NoRestrctn I [2.06 4.26] -- intra
1358-> ASN 21 HN - ASN 21 HB1 1.80 4.37 # NoRestrctn I [2.00 4.30] -- intra
1366-> ARG 24 HB2 - ARG 24 HG1 1.80 3.29 # NoRestrctn I [1.99 3.26] -- intra
1415-> ARG 52 HA - ARG 52 HB1 1.80 3.42 # NoRestrctn I [2.22 3.02] -- intra
1418-> GLU 31 HN - GLU 31 HG2 1.80 6.18 # NoRestrctn I [2.35 6.01] -- intra
1419-> GLU 31 HN - GLU 31 HG1 1.80 6.18 # NoRestrctn I [2.35 6.01] -- intra
1423-> LEU 32 HN - LEU 32 HB1 1.80 4.63 # NoRestrctn I [2.00 4.30] -- intra
1435-> GLU 34 HA - GLU 34 HB1 1.80 3.35 # NoRestrctn I [2.22 3.02] -- intra
1437-> GLU 31 HA - GLU 31 HB2 1.80 3.23 # NoRestrctn I [2.22 3.02] -- intra
1438-> GLU 34 HA - GLU 34 HB2 1.80 3.45 # NoRestrctn I [2.22 3.02] -- intra
1445-> ASP 36 HA - PRO 37 HD2 1.80 4.12 # NoRestrctn S [2.00 3.95] -- sequential
1446-> ASP 36 HA - PRO 37 HD1 1.80 4.12 # NoRestrctn S [2.00 3.95] -- sequential
1452-> VAL 40 HA - GLY 41 HN 1.80 3.99 # NoRestrctn S [2.00 3.99] -- sequential
1498-> LEU 49 HA - LEU 49 HG 1.80 4.40 # NoRestrctn I [2.06 4.26] -- intra
1520-> ARG 52 HN - ARG 52 HB1 1.80 4.35 # NoRestrctn I [2.00 4.30] -- intra
1521-> ARG 52 HB1 - ARG 52 HG2 1.80 3.45 # NoRestrctn I [1.99 3.26] -- intra
1529-> LEU 53 HA - LEU 53 HB1 1.80 3.46 # NoRestrctn I [2.22 3.02] -- intra
1531-> LEU 53 HN - LEU 53 HB1 1.80 4.74 # NoRestrctn I [2.00 4.30] -- intra
1538-> ARG 55 HA - ARG 55 HG1 1.80 4.62 # NoRestrctn I [2.06 4.60] -- intra
1540-> ARG 55 HN - ARG 55 HB1 1.80 4.45 # NoRestrctn I [2.00 4.30] -- intra
1551-> ILE 60 HA - ILE 60 HG12 1.80 4.72 # NoRestrctn I [2.06 4.60] -- intra
1556-> ILE 60 HB - ILE 60 HD1* 1.80 3.89 # NoRestrctn I [2.63 3.78] -- intra
1580-> GLN 65 HB1 - GLN 65 HG1 1.80 3.38 # NoRestrctn I [1.99 3.26] -- intra
1598-> ILE 67 HG2* - ILE 67 HD1* 1.80 2.76 # TooRestrct I [2.92 5.00] -- intra
1600-> GLU 68 HA - GLU 68 HG1 1.80 4.65 # NoRestrctn I [2.06 4.60] -- intra
1603-> GLU 68 HB1 - GLU 68 HG2 1.80 3.35 # NoRestrctn I [1.99 3.26] -- intra
1616-> ARG 71 HA - ARG 71 HB1 1.80 3.44 # NoRestrctn I [2.22 3.02] -- intra
1642-> GLU 73 HA - GLU 73 HG1 1.80 4.70 # NoRestrctn I [2.06 4.60] -- intra
1646-> GLU 68 HA - GLU 68 HB1 1.80 3.44 # NoRestrctn I [2.22 3.02] -- intra
1650-> GLN 76 HN - GLN 76 HG2 1.80 6.06 # NoRestrctn I [2.35 6.01] -- intra
1651-> GLN 76 HN - GLN 76 HG1 1.80 6.06 # NoRestrctn I [2.35 6.01] -- intra
1656-> LYS 77 HA - LYS 77 HB2 1.80 3.35 # NoRestrctn I [2.22 3.02] -- intra
1664-> LEU 79 HA - LEU 79 HG 1.80 4.28 # NoRestrctn I [2.06 4.26] -- intra
1694-> GLU 15 HA - GLU 15 HB1 1.80 3.27 # NoRestrctn I [2.22 3.02] -- intra
1698-> GLN 83 HA - GLN 83 HB1 1.80 3.36 # NoRestrctn I [2.22 3.02] -- intra
1751-> LYS 88 HA - LYS 88 HG2 1.80 4.89 # NoRestrctn I [2.06 4.60] -- intra
1772-> LEU 92 HA - LEU 92 HB2 1.80 3.44 # NoRestrctn I [2.22 3.02] -- intra
1776-> LEU 92 HA - LEU 92 HG 1.80 4.80 # NoRestrctn I [2.06 4.26] -- intra
1832-> LEU 12 HA - ALA 13 HB* 1.80 6.07 # NoRestrctn S [2.00 6.01] -- sequential
1858-> HIS 19 HN - ASP 20 HA 1.80 5.35 # NoRestrctn S [2.00 3.99] -- sequential
1880-> ASN 21 HN - ALA 22 HA 1.80 6.56 # NoRestrctn S [2.00 3.99] -- sequential
1882-> LEU 26 HN - ALA 27 HB* 1.80 7.48 # NoRestrctn S [2.00 6.01] -- sequential
1925-> LEU 26 HN - ALA 27 HA 1.80 7.48 # NoRestrctn S [2.00 3.99] -- sequential
1969-> GLU 34 HN - THR 35 HA 1.80 6.28 # NoRestrctn S [2.00 3.99] -- sequential
2103-> LEU 53 HN - ASP 54 HA 1.80 5.83 # NoRestrctn S [2.00 3.99] -- sequential
2294-> GLU 73 HN - GLY 74 HA1 1.80 5.91 # NoRestrctn S [2.00 3.99] -- sequential
2334-> ASP 84 HA - ALA 85 HB* 1.80 6.11 # NoRestrctn S [2.00 6.01] -- sequential
2499-> LYS 86 HN - LEU 87 HA 1.80 6.14 # NoRestrctn S [2.00 3.99] -- sequential
2560-> GLN 65 HN - GLY 66 HA2 1.80 6.19 # NoRestrctn S [2.00 3.99] -- sequential
2783-> GLU 72 HN - GLU 73 HA 1.80 6.39 # NoRestrctn S [2.00 3.99] -- sequential
2982-> GLU 1 HA - GLU 1 HG* 1.80 4.14 # NoRestrctn I [2.23 4.01] -- intra
2983-> GLU 1 HA - ASP 2 HB* 1.80 7.48 # NoRestrctn S [2.00 6.01] -- sequential
2997-> GLU 4 HB* - GLU 4 HG* 1.80 2.59 # NoRestrctn I [2.26 2.50] -- intra
3002-> PRO 6 HB* - PHE 7 HA 1.80 6.58 # NoRestrctn S [2.00 6.01] -- sequential
3034-> LYS 18 HG* - LYS 18 HD* 1.80 2.68 # NoRestrctn I [2.26 2.50] -- intra
3035-> LYS 18 HG* - LYS 18 HE* 1.80 3.83 # NoRestrctn I [2.52 3.73] -- intra
3041-> HIS 19 HN - ASP 20 HB* 1.80 6.27 # NoRestrctn S [2.00 6.01] -- sequential
3065-> ASP 38 HN - ASP 38 HB* 1.80 4.15 # NoRestrctn I [2.29 3.93] -- intra
3067-> ASP 38 HB* - TYR 39 HA 1.80 6.26 # NoRestrctn S [2.00 6.01] -- sequential
3070-> VAL 40 HN - GLY 41 HA* 1.80 6.04 # NoRestrctn S [2.00 3.55] -- sequential
3077-> TYR 43 HN - TYR 44 HB* 1.80 6.46 # NoRestrctn S [2.00 6.01] -- sequential
3079-> TYR 44 HN - TYR 44 HB* 1.80 3.89 # NoRestrctn I [2.15 3.88] -- intra
3080-> TYR 44 HB* - HIS 45 HA 1.80 6.08 # NoRestrctn S [2.00 6.01] -- sequential
3113-> LEU 53 HN - ASP 54 HB* 1.80 6.31 # NoRestrctn S [2.00 6.01] -- sequential
3146-> GLN 76 HB1 - GLN 76 HG* 1.80 2.94 # NoRestrctn I [2.32 2.75] -- intra
3172-> SER 80 HA - SER 80 HB* 1.80 3.02 # FixedDistn I [0.00 0.00] -- intra
3190-> GLU 90 HN - GLY 91 HA* 1.80 5.90 # NoRestrctn S [2.00 3.55] -- sequential
3199-> GLU 93 HA - HIS 94 HB* 1.80 6.15 # NoRestrctn S [2.00 6.01] -- sequential
3200-> GLU 93 HB* - GLU 93 HG* 1.80 2.54 # NoRestrctn I [2.26 2.50] -- intra
3204-> HIS 94 HA - HIS 94 HB* 1.80 3.02 # FixedDistn I [0.00 0.00] -- intra
====== TOTAL ======: 124
table of distance constraints violations
Residual Violations greater than 0.10
1-> GLU 1 HA - ASP 2 HN [ 1.80 3.45] 0.00 0.00 0.00 0.00 0.00 0.11 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 - 2 [ 0.03 .. 0.11]
706-> LYS 88 HD2 - ALA 89 HN [ 1.80 4.75] 0.00 0.10 0.00 0.13 0.00 0.11 0.00 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.18 0.00 0.00 0.14 0.00 0.00 - 6 [ 0.08 .. 0.18]
721-> GLU 90 HG2 - GLY 91 HN [ 1.80 5.06] 0.00 0.03 0.12 0.00 0.12 0.00 0.00 0.05 0.00 0.03 0.10 0.08 0.00 0.00 0.00 0.00 0.01 0.02 0.00 0.00 - 9 [ 0.01 .. 0.12]
748-> PHE 7 HN - ARG 9 HD2 [ 1.80 6.92] 0.00 0.00 0.00 0.00 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.16 .. 0.30]
797-> ASN 21 HD22 - ARG 24 HD2 [ 1.80 7.48] 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.02 0.00 0.05 0.01 0.00 0.00 0.00 0.12 0.00 0.03 - 6 [ 0.01 .. 0.12]
878-> ASP 36 HB2 - TYR 39 HN [ 1.80 5.53] 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 0.17 0.00 0.00 - 1 [ 0.17 .. 0.17]
969-> GLN 65 HE22 - VAL 69 HG1* [ 1.80 4.83] 0.05 0.00 0.08 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 0.06 0.00 0.00 0.16 - 5 [ 0.05 .. 0.16]
977-> VAL 40 HG2* - ILE 67 HN [ 1.80 6.47] 0.08 0.06 0.00 0.07 0.02 0.15 0.08 0.05 0.04 0.00 0.00 0.05 0.07 0.05 0.03 0.04 0.00 0.00 0.05 0.05 - 15 [ 0.02 .. 0.15]
1048-> TYR 44 HE* - ALA 85 HN [ 1.80 4.90] 0.00 0.00 0.00 0.00 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 - 1 [ 0.11 .. 0.11]
1390-> ALA 27 HA - GLU 30 HB3 [ 1.80 4.27] 0.03 0.08 0.12 0.04 0.05 0.04 0.06 0.04 0.05 0.03 0.15 0.09 0.04 0.16 0.00 0.00 0.06 0.02 0.08 0.07 - 18 [ 0.02 .. 0.16]
1748-> ARG 9 HG3 - LEU 32 HD2* [ 1.80 2.97] 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.17 0.00 0.00 0.00 0.10 0.00 - 4 [ 0.01 .. 0.17]
1756-> LYS 88 HB2 - LYS 88 HD3 [ 1.80 3.61] 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 0.00 0.12 0.00 0.00 - 2 [ 0.12 .. 0.17]
1757-> ALA 85 HA - LYS 88 HB3 [ 1.80 4.61] 0.00 0.00 0.03 0.09 0.06 0.19 0.00 0.08 0.00 0.14 0.08 0.15 0.00 0.05 0.19 0.00 0.08 0.00 0.04 0.08 - 14 [ 0.00 .. 0.19]
1977-> LEU 32 HB3 - ASP 36 HB2 [ 1.80 5.80] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.06 0.00 0.16 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.01 .. 0.16]
2068-> TYR 44 HE* - LYS 48 HE2 [ 1.80 4.92] 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 0.02 0.23 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.02 .. 0.23]
2110-> LEU 53 HB3 - ARG 55 HD3 [ 1.80 4.65] 0.00 0.00 0.00 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.13 .. 0.13]
2197-> ALA 64 HB* - LYS 86 HE2 [ 1.80 4.89] 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.12 0.00 0.00 0.07 0.03 0.00 0.00 0.09 0.00 0.01 0.00 0.00 - 6 [ 0.01 .. 0.12]
2215-> ALA 64 HB* - GLN 65 HG2 [ 1.80 5.09] 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.13 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.11 .. 0.13]
2276-> ARG 9 HD2 - LEU 28 HD2* [ 1.80 5.36] 0.00 0.00 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.11 .. 0.11]
2289-> VAL 69 HG2* - GLU 73 HG3 [ 1.80 4.73] 0.03 0.02 0.00 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.05 0.00 - 4 [ 0.02 .. 0.19]
2309-> LEU 79 HD1* - GLN 83 HA [ 1.80 5.28] 0.00 0.00 0.03 0.04 0.08 0.03 0.08 0.00 0.06 0.11 0.00 0.00 0.03 0.07 0.00 0.00 0.00 0.04 0.05 0.00 - 11 [ 0.03 .. 0.11]
2484-> VAL 40 HG1* - ASP 78 HB3 [ 1.80 4.07] 0.00 0.08 0.00 0.00 0.01 0.00 0.00 0.00 0.03 0.05 0.03 0.05 0.00 0.01 0.03 0.00 0.13 0.03 0.00 0.00 - 10 [ 0.01 .. 0.13]
2610-> THR 75 HG2* - LYS 77 HB2 [ 1.80 5.84] 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 0.00 0.00 0.00 0.00 - 1 [ 0.12 .. 0.12]
2652-> ASP 84 HB2 - LEU 87 HB3 [ 1.80 6.97] 0.00 0.00 0.03 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.02 0.00 0.00 0.15 0.03 0.00 - 6 [ 0.01 .. 0.15]
2678-> LEU 26 HD2* - LEU 46 HD1* [ 1.80 4.09] 0.08 0.00 0.04 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.00 0.01 0.00 0.00 0.00 0.08 0.00 0.00 0.11 - 8 [ 0.00 .. 0.11]
2684-> TYR 44 HA - TYR 63 HE* [ 1.80 5.16] 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.13 0.00 0.00 0.00 - 3 [ 0.00 .. 0.13]
2704-> PRO 3 HB2 - THR 8 HB [ 1.80 6.12] 0.00 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 2 [ 0.01 .. 0.11]
2741-> TYR 44 HA - LYS 48 HD3 [ 1.80 6.06] 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 0.00 0.00 0.00 0.12 0.00 0.00 0.00 - 1 [ 0.12 .. 0.12]
2826-> LEU 32 HD1* - ASP 36 HB3 [ 1.80 6.75] 0.00 0.00 0.00 0.00 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.11 .. 0.11]
2916-> ARG 9 HD3 - TYR 39 HE* [ 1.80 7.37] 0.00 0.07 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 3 [ 0.01 .. 0.15]
2919-> TYR 39 HE* - VAL 40 HG1* [ 1.80 6.66] 0.00 0.09 0.00 0.00 0.00 0.10 0.04 0.00 0.10 0.01 0.06 0.17 0.00 0.00 0.00 0.05 0.00 0.06 0.05 0.08 - 11 [ 0.01 .. 0.17]
2962-> TYR 44 HE* - HIS 45 HE1 [ 1.80 5.24] 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.09 0.08 0.12 0.08 0.04 0.00 0.05 0.02 0.00 0.00 0.03 0.00 0.01 - 10 [ 0.01 .. 0.12]
2967-> HIS 16 HE1 - ARG 24 HD3 [ 1.80 7.48] 0.00 0.00 0.00 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.00 - 2 [ 0.03 .. 0.11]
3188-> LYS 88 HD* - ALA 89 HA [ 1.80 5.29] 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 0.00 0.06 0.00 0.00 - 2 [ 0.06 .. 0.17]
3216-> ALA 13 O - LEU 17 HN [ 1.80 2.30] 0.00 0.00 0.00 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 - 1 [ 0.11 .. 0.11]
3234-> GLU 31 O - THR 35 HN [ 1.80 2.30] 0.00 0.00 0.00 0.12 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.03 0.00 0.03 0.00 0.00 0.00 0.00 0.00 - 4 [ 0.03 .. 0.14]
3242-> HIS 45 O - LEU 49 HN [ 1.80 2.30] 0.00 0.00 0.06 0.01 0.00 0.00 0.03 0.00 0.00 0.12 0.00 0.04 0.00 0.00 0.04 0.04 0.00 0.10 0.11 0.00 - 9 [ 0.01 .. 0.12]
3248-> THR 56 O - ILE 60 HN [ 1.80 2.30] 0.00 0.00 0.00 0.00 0.08 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 [ 0.08 .. 0.11]
3280-> GLN 83 O - LEU 87 HN [ 1.80 2.30] 0.02 0.04 0.00 0.00 0.00 0.00 0.04 0.02 0.04 0.00 0.05 0.01 0.00 0.11 0.06 0.04 0.06 0.11 0.04 0.09 - 14 [ 0.01 .. 0.11]
3282-> ASP 84 O - LYS 88 HN [ 1.80 2.30] 0.03 0.01 0.02 0.00 0.10 0.02 0.00 0.00 0.02 0.01 0.06 0.00 0.04 0.00 0.00 0.00 0.07 0.07 0.00 0.00 - 11 [ 0.01 .. 0.10]
3284-> ALA 85 O - ALA 89 HN [ 1.80 2.30] 0.13 0.06 0.00 0.00 0.02 0.00 0.11 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 - 6 [ 0.00 .. 0.13]
-------------------------------------------
Number of Violations greater than 0.10 1 2 3 3 3 8 5 1 2 5 4 2 2 2 4 1 3 7 2 2
-------------------------------------------
---- 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: 1 2 3 3 3 8 5 1 2 5 4 2 1 2 3 1 3 7 2 2 3.00
0.2 - 0.5 ang: 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 0 0 0 0 0 0.10
> 0.5 ang: 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0.00
Total : 36 40 34 40 37 37 41 33 34 42 35 35 40 34 34 31 31 42 30 23 35.45
Minimum Violation : 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000
Maximum Violation : 0.130 0.168 0.154 0.126 0.118 0.190 0.157 0.127 0.123 0.158 0.149 0.172 0.305 0.158 0.231 0.112 0.126 0.167 0.114 0.164 0.305
Max Intra Viol : 0.028 0.168 0.052 0.078 0.029 0.074 0.047 0.044 0.014 0.032 0.051 0.043 0.027 0.036 0.061 0.032 0.032 0.119 0.036 0.030 0.168
Max Seque Viol : 0.081 0.167 0.119 0.126 0.118 0.111 0.057 0.127 0.103 0.123 0.108 0.172 0.075 0.054 0.178 0.067 0.062 0.141 0.047 0.086 0.178
Max Medium Viol : 0.130 0.084 0.123 0.122 0.104 0.190 0.157 0.099 0.065 0.158 0.149 0.149 0.305 0.158 0.231 0.096 0.117 0.167 0.114 0.164 0.305
Max Long Viol : 0.092 0.082 0.154 0.107 0.106 0.153 0.091 0.089 0.123 0.072 0.060 0.074 0.065 0.089 0.172 0.112 0.126 0.045 0.105 0.105 0.172
Average Violation : 0.000 0.001 0.000 0.001 0.000 0.001 0.001 0.000 0.000 0.001 0.001 0.000 0.001 0.000 0.001 0.000 0.000 0.001 0.000 0.000 0.00049
Avge Intra Viol : 0.000 0.001 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 0.001 0.000 0.000 0.00019
Avge Seque Viol : 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.000 0.001 0.002 0.001 0.001 0.00097
Avge Mediu Viol : 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.00029
Avge Long Viol : 0.001 0.000 0.001 0.001 0.001 0.001 0.000 0.000 0.001 0.000 0.000 0.001 0.001 0.001 0.000 0.001 0.001 0.000 0.000 0.000 0.00056
RMS Violation : 0.005 0.007 0.006 0.006 0.005 0.008 0.007 0.005 0.005 0.007 0.006 0.006 0.007 0.006 0.008 0.005 0.006 0.008 0.004 0.005 0.00618
RMS Intra : 0.001 0.008 0.003 0.004 0.001 0.004 0.002 0.002 0.001 0.001 0.002 0.002 0.001 0.002 0.003 0.002 0.002 0.008 0.002 0.002 0.00329
RMS Sequential : 0.007 0.005 0.008 0.007 0.008 0.012 0.012 0.007 0.005 0.011 0.009 0.008 0.014 0.010 0.012 0.004 0.008 0.013 0.007 0.009 0.00925
RMS Medium range : 0.003 0.008 0.005 0.005 0.004 0.006 0.003 0.005 0.004 0.006 0.007 0.006 0.002 0.002 0.006 0.003 0.003 0.006 0.001 0.004 0.00482
RMS Long range : 0.007 0.005 0.007 0.008 0.006 0.008 0.005 0.005 0.007 0.005 0.003 0.006 0.005 0.006 0.007 0.007 0.008 0.003 0.006 0.005 0.00598
Final --global-- Summary for 20 models, 3285 NOEs/model, 65700 NOEs total
~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
Summ of viol : 32.305
Summ sq. viol : 2.508
Maximum viol : 0.305
Average viol : 0.00049
RMSD viol : 0.00618
Std. Dev. viol : 0.00616
RMS Intra : 0.00329
RMS Seque : 0.00925
RMS Medi : 0.00482
RMS Long : 0.00598
table of dihedral angle constraints violations
4-> [THR A 8] PSI -55.0 -23.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.8 0.0 0.0 0.0 0.0 0.2 2.3 0.0 0.0 0.0 0.0 - 3 [ 0.0 .. 2.3]
5-> [ARG A 9] PHI -72.0 -52.0 2.5 2.7 2.2 0.5 2.2 2.4 3.0 2.6 1.4 2.2 1.0 2.4 2.2 0.0 0.0 2.0 1.4 1.8 0.0 3.1 - 17 [ 0.0 .. 3.1]
6-> [ARG A 9] PSI -56.0 -28.0 1.0 3.6 3.9 0.0 0.6 2.3 1.6 1.5 1.8 0.3 1.0 0.9 3.1 0.6 0.5 2.3 1.8 0.3 0.0 1.5 - 18 [ 0.0 .. 3.9]
44-> [GLU A 31] PSI -53.0 -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 0.0 0.0 0.0 0.0 0.0 1.1 0.0 0.0 - 1 [ 0.0 .. 1.1]
54-> [THR A 42] PSI -57.0 -37.0 0.0 0.0 0.0 0.0 0.0 0.0 1.4 0.0 0.0 0.0 0.4 0.0 0.6 0.0 2.3 0.0 0.0 0.0 0.3 0.0 - 5 [ 0.0 .. 2.3]
58-> [TYR A 44] PSI -65.0 -21.0 0.0 0.0 0.0 0.2 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.2 0.9 0.0 3.0 0.0 0.0 2.7 0.0 - 5 [ 0.0 .. 3.0]
59-> [HIS A 45] PHI -74.0 -54.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.3 0.0 0.0 - 1 [ 0.0 .. 1.3]
60-> [HIS A 45] PSI -50.0 -30.0 0.0 0.0 1.3 0.6 0.2 2.4 0.8 1.9 1.6 1.0 0.1 0.0 0.0 0.0 0.0 0.0 2.0 0.0 0.0 0.5 - 11 [ 0.0 .. 2.4]
78-> [THR A 56] PSI -51.0 -31.0 0.0 0.0 0.0 0.0 1.8 2.9 0.9 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 - 3 [ 0.0 .. 2.9]
103-> [VAL A 69] PHI -81.0 -53.0 0.5 0.3 3.1 2.0 5.5 2.3 0.8 2.4 2.3 4.6 1.3 3.6 3.7 1.0 0.4 4.5 2.8 4.6 1.7 3.4 - 20 [ 0.3 .. 5.5]
104-> [VAL A 69] PSI -63.0 -23.0 3.3 2.9 4.1 3.2 2.8 0.9 4.1 4.1 4.0 2.9 3.2 1.5 2.6 3.1 3.5 2.1 3.8 4.5 4.0 3.7 - 20 [ 0.9 .. 4.5]
105-> [ALA A 70] PHI -73.0 -53.0 1.0 1.4 0.1 0.0 1.3 1.5 0.0 0.0 1.3 0.0 0.4 1.5 0.7 0.2 0.3 1.5 0.0 0.3 0.0 2.4 - 14 [ 0.0 .. 2.4]
109-> [GLU A 72] PHI -87.0 -47.0 3.1 1.2 2.3 5.4 4.8 3.3 2.4 3.1 2.0 2.7 1.5 2.4 2.9 2.6 1.0 3.5 2.7 1.7 2.9 5.3 - 20 [ 1.0 .. 5.4]
110-> [GLU A 72] PSI -51.0 -15.0 3.5 5.2 4.0 5.8 3.5 2.5 4.7 1.5 4.4 0.6 3.0 4.0 3.7 3.2 3.2 3.6 2.7 5.4 2.8 5.0 - 20 [ 0.6 .. 5.8]
114-> [LYS A 77] PSI -49.0 -29.0 1.6 0.8 0.2 0.3 1.4 0.0 0.0 3.4 1.9 0.0 1.2 0.0 0.0 1.5 0.7 1.0 0.5 0.0 1.9 1.9 - 14 [ 0.0 .. 3.4]
123-> [LEU A 82] PHI -73.0 -49.0 0.7 1.0 0.4 0.4 0.0 0.0 0.4 0.0 0.9 0.0 0.0 0.2 1.0 1.0 0.0 0.0 1.8 0.9 0.0 0.0 - 11 [ 0.0 .. 1.8]
135-> [LYS A 88] PHI -74.0 -54.0 0.0 0.0 1.2 0.4 0.0 2.4 0.0 0.0 1.0 0.7 0.0 2.1 1.2 2.9 2.8 0.9 2.0 0.0 1.4 1.3 - 13 [ 0.0 .. 2.9]
139-> [GLU A 90] PHI -89.0 -53.0 0.0 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 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 3.0]
143-> [TYR A 39] CHI2 40.0 90.0 0.0 121.7 123.6 127.4 126.9 1.0 123.4 127.5 125.2 0.0 128.9 118.6 0.6 128.3 128.5 0.0 0.0 126.3 0.0 123.8 - 15 [ 0.0 .. 128.9]
---- 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 : 7 7 8 4 8 9 6 8 10 5 6 7 8 6 4 9 9 7 7 9 7.20
> 10. degrees : 0 1 1 1 1 0 1 1 1 0 1 1 0 1 1 0 0 1 0 1 0.65
Total : 9 12 14 11 11 13 12 9 12 12 11 13 12 12 12 12 12 11 9 13 11.60
Minimum Violation : 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.00
Maximum Violation : 3.5 121.7 123.6 127.4 126.9 3.3 123.4 127.5 125.2 4.6 128.9 118.6 3.7 128.3 128.5 4.5 3.8 126.3 4.0 123.8 128.91
Max PHI Viol : 3.1 2.7 3.1 5.4 5.5 3.3 3.0 3.1 2.3 4.6 1.5 3.6 3.7 3.0 2.8 4.5 2.8 4.6 2.9 5.3 5.49
Max PSI Viol : 3.5 5.2 4.1 5.8 3.5 2.9 4.7 4.1 4.4 2.9 3.2 4.0 3.7 3.2 3.5 3.6 3.8 5.4 4.0 5.0 5.79
Max CHI2 Viol : 0.0 121.7 123.6 127.4 126.9 1.0 123.4 127.5 125.2 0.0 128.9 118.6 0.6 128.3 128.5 0.0 0.0 126.3 0.0 123.8 128.91
Average Violation : 0.1 1.0 1.0 1.0 1.1 0.2 1.0 1.0 1.0 0.1 1.0 1.0 0.2 1.0 1.0 0.2 0.2 1.0 0.1 1.1 0.716
Avge PHI Viol : 0.333 0.307 0.367 0.349 0.441 0.420 0.317 0.339 0.355 0.388 0.246 0.425 0.405 0.389 0.252 0.419 0.389 0.387 0.291 0.472 0.369
Avge PSI Viol : 0.367 0.433 0.436 0.374 0.380 0.394 0.437 0.418 0.439 0.283 0.356 0.311 0.378 0.364 0.384 0.457 0.411 0.400 0.415 0.427 0.395
Avge CHI2 Viol : 0.000 11.032 11.117 11.286 11.265 0.980 11.109 11.292 11.189 0.000 11.354 10.891 0.746 11.329 11.335 0.000 0.000 11.238 0.000 11.126 9.032
RMS Violation : 0.562 10.198 10.360 10.677 10.640 0.636 10.341 10.683 10.489 0.560 10.789 9.937 0.649 10.749 10.757 0.742 0.620 10.588 0.584 10.386 8.481
RMS PHI Viol : 0.500 0.409 0.543 0.683 0.917 0.654 0.470 0.562 0.458 0.695 0.273 0.667 0.644 0.609 0.359 0.751 0.589 0.651 0.436 0.900 0.610
RMS PSI Viol : 0.621 0.834 0.837 0.787 0.596 0.612 0.799 0.714 0.793 0.384 0.555 0.524 0.654 0.576 0.635 0.739 0.653 0.846 0.705 0.797 0.694
RMS CHI2 Viol : 0.000 121.698 123.598 127.381 126.898 0.961 123.409 127.516 125.192 0.000 128.908 118.608 0.556 128.345 128.492 0.000 0.000 126.295 0.000 123.787 101.124
Final --global-- Summary for 20 models, 143 ACOs/model, 2860 ACOs total
~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
Summ. Viol. : 2047.47
Summ. Sq. Viol. : 205734.09
Max. Viol. : 128.908
Avg. Viol. : 0.71590
RMS Viol. : 8.48145
Std. Dev. Viol. : 8.45118
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
# -----------------------------------------------------------------------------------
GLU A 1 0.450 0.337 0.259 0.325
ASP A 2 0.887 0.977 0.467 0.146 2
PRO A 3 0.981 0.965 0.906 0.851 3 3
GLU A 4 0.982 0.986 0.997 0.520 0.281 4 4
ASP A 5 0.997 0.997 0.548 0.288 5 5
PRO A 6 0.997 0.995 0.922 0.838 6 6
PHE A 7 0.999 0.998 0.996 0.899 7 7
THR A 8 0.996 0.996 0.995 8 8
ARG A 9 1.000 1.000 0.996 0.950 0.874 0.763 0.996 9 9
TYR A 10 0.999 0.999 0.997 0.997 10 10
ALA A 11 0.998 0.999 11 11
LEU A 12 0.999 0.998 0.999 0.998 12 12
ALA A 13 0.999 0.999 13 13
GLN A 14 0.999 0.998 0.999 0.996 0.603 14 14
GLU A 15 0.998 0.998 0.996 0.480 0.520 15 15
HIS A 16 0.999 0.998 0.997 0.963 16 16
LEU A 17 0.999 0.996 0.999 0.999 17 17
LYS A 18 0.998 0.995 0.550 0.993 0.218 0.594 18 18
HIS A 19 0.997 0.993 0.993 0.638 19 19
ASP A 20 0.998 0.988 0.929 0.905 20 20
ASN A 21 0.998 0.996 0.995 0.907 21 21
ALA A 22 0.999 0.998 22 22
SER A 23 0.999 0.995 0.359 23 23
ARG A 24 0.998 0.999 0.992 0.997 0.999 0.926 1.000 24 24
ALA A 25 1.000 0.999 25 25
LEU A 26 1.000 0.999 0.999 0.999 26 26
ALA A 27 0.999 0.999 27 27
LEU A 28 0.999 0.997 0.996 0.997 28 28
PHE A 29 0.999 0.999 0.999 0.999 29 29
GLU A 30 0.998 0.996 0.999 0.998 0.459 30 30
GLU A 31 0.998 0.996 0.930 0.665 0.748 31 31
LEU A 32 0.999 0.996 0.989 0.998 32 32
VAL A 33 0.998 0.999 0.999 33 33
GLU A 34 0.998 0.995 0.999 0.997 0.246 34 34
THR A 35 0.994 0.998 0.688 35 35
ASP A 36 0.995 0.990 0.627 0.464 36 36
PRO A 37 0.997 0.990 0.937 0.849 37 37
ASP A 38 0.964 0.931 0.195 0.211 38 38
TYR A 39 0.955 0.996 0.993 0.417 39 39
VAL A 40 0.999 0.999 0.999 40 40
GLY A 41 0.999 0.998 41 41
THR A 42 0.999 0.998 0.998 42 42
TYR A 43 0.999 0.999 0.999 0.797 43 43
TYR A 44 1.000 0.996 0.998 0.993 44 44
HIS A 45 0.998 0.999 0.999 0.991 45 45
LEU A 46 0.999 0.999 1.000 0.999 46 46
GLY A 47 1.000 0.998 47 47
LYS A 48 0.999 0.999 0.994 0.998 0.595 0.469 48 48
LEU A 49 0.999 0.999 0.998 1.000 49 49
TYR A 50 0.999 0.998 0.998 0.999 50 50
GLU A 51 0.999 0.997 0.998 0.994 0.550 51 51
ARG A 52 0.995 0.998 0.997 0.994 0.510 0.868 0.998 52 52
LEU A 53 0.999 0.998 0.998 0.999 53 53
ASP A 54 0.998 0.992 0.649 0.624 54 54
ARG A 55 0.992 0.993 0.999 0.996 0.998 0.904 0.998 55 55
THR A 56 0.999 0.998 0.997 56 56
ASP A 57 0.998 0.999 0.521 0.527 57 57
ASP A 58 0.999 0.998 0.995 0.803 58 58
ALA A 59 1.000 0.998 59 59
ILE A 60 0.999 0.999 0.998 0.999 60 60
ASP A 61 0.998 0.997 0.996 0.508 61 61
THR A 62 0.999 0.997 0.998 62 62
TYR A 63 0.999 0.999 0.998 0.999 63 63
ALA A 64 0.999 0.998 64 64
GLN A 65 0.998 0.999 0.856 0.991 0.950 65 65
GLY A 66 1.000 0.998 66 66
ILE A 67 0.999 0.999 0.999 0.999 67 67
GLU A 68 1.000 0.999 0.999 0.861 0.698 68 68
VAL A 69 1.000 1.000 0.999 69 69
ALA A 70 1.000 0.999 70 70
ARG A 71 0.998 0.996 0.998 0.994 0.499 0.715 0.998 71 71
GLU A 72 1.000 1.000 0.997 0.471 0.262 72 72
GLU A 73 0.996 0.996 0.996 0.998 0.781 73 73
GLY A 74 0.996 0.994 74 74
THR A 75 0.987 0.998 0.999 75 75
GLN A 76 0.998 0.998 0.995 0.544 0.485 76 76
LYS A 77 0.998 0.999 0.947 0.944 0.636 0.414 77 77
ASP A 78 0.998 0.999 0.996 0.539 78 78
LEU A 79 1.000 0.999 0.999 0.999 79 79
SER A 80 0.999 0.998 0.560 80 80
GLU A 81 0.998 0.997 0.996 0.662 0.638 81 81
LEU A 82 0.999 0.998 0.998 0.993 82 82
GLN A 83 0.999 0.998 0.999 0.999 0.978 83 83
ASP A 84 0.998 0.998 0.945 0.795 84 84
ALA A 85 0.999 0.998 85 85
LYS A 86 1.000 0.999 0.998 0.995 0.999 0.808 86 86
LEU A 87 0.999 0.999 0.996 0.999 87 87
LYS A 88 0.999 0.999 0.996 0.756 0.855 0.258 88 88
ALA A 89 0.997 0.997 89 89
GLU A 90 0.994 0.996 0.998 0.578 0.291 90 90
GLY A 91 0.980 0.965 91 91
LEU A 92 0.975 0.972 0.996 0.999 92 92
GLU A 93 0.859 0.567 0.589 0.509 0.253
HIS A 94 0.581 0.518 0.661 0.278
HIS A 95 0.601 0.681 0.231 0.256
HIS A 96 0.886 0.622 0.150 0.270
HIS A 97 0.539 0.461 0.273 0.337
HIS A 98 0.577 0.375 0.369 0.177
HIS A 99 0.713 0.438 0.228
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 `SRR115C_NMR_em_bcr3.pdb'
>
> Kabsch RMSD of backbone atoms in res. A[3..92],for model 1 is: 0.324
> Kabsch RMSD of backbone atoms in res. A[3..92],for model 2 is: 0.385
> Kabsch RMSD of backbone atoms in res. A[3..92],for model 3 is: 0.396
> Kabsch RMSD of backbone atoms in res. A[3..92],for model 4 is: 0.443
> Kabsch RMSD of backbone atoms in res. A[3..92],for model 5 is: 0.397
> Kabsch RMSD of backbone atoms in res. A[3..92],for model 6 is: 0.479
> Kabsch RMSD of backbone atoms in res. A[3..92],for model 7 is: 0.279 (*)
> Kabsch RMSD of backbone atoms in res. A[3..92],for model 8 is: 0.413
> Kabsch RMSD of backbone atoms in res. A[3..92],for model 9 is: 0.429
> Kabsch RMSD of backbone atoms in res. A[3..92],for model 10 is: 0.434
> Kabsch RMSD of backbone atoms in res. A[3..92],for model 11 is: 0.402
> Kabsch RMSD of backbone atoms in res. A[3..92],for model 12 is: 0.340
> Kabsch RMSD of backbone atoms in res. A[3..92],for model 13 is: 0.339
> Kabsch RMSD of backbone atoms in res. A[3..92],for model 14 is: 0.361
> Kabsch RMSD of backbone atoms in res. A[3..92],for model 15 is: 0.396
> Kabsch RMSD of backbone atoms in res. A[3..92],for model 16 is: 0.520
> Kabsch RMSD of backbone atoms in res. A[3..92],for model 17 is: 0.375
> Kabsch RMSD of backbone atoms in res. A[3..92],for model 18 is: 0.358
> Kabsch RMSD of backbone atoms in res. A[3..92],for model 19 is: 0.443
> Kabsch RMSD of backbone atoms in res. A[3..92],for model 20 is: 0.357
>
> Kabsch RMSD statistics for 20 structures:
> Mean RMSD using as refer. str. `average' for res.[3..92], is: 0.393
> Range of RMSD values to reference struct. is 0.279 to 0.520
> Kabsch RMSD of heavy atoms in res. A[3..92],for model 1 is: 0.675
> Kabsch RMSD of heavy atoms in res. A[3..92],for model 2 is: 0.705
> Kabsch RMSD of heavy atoms in res. A[3..92],for model 3 is: 0.696
> Kabsch RMSD of heavy atoms in res. A[3..92],for model 4 is: 0.760
> Kabsch RMSD of heavy atoms in res. A[3..92],for model 5 is: 0.731
> Kabsch RMSD of heavy atoms in res. A[3..92],for model 6 is: 0.776
> Kabsch RMSD of heavy atoms in res. A[3..92],for model 7 is: 0.671
> Kabsch RMSD of heavy atoms in res. A[3..92],for model 8 is: 0.686
> Kabsch RMSD of heavy atoms in res. A[3..92],for model 9 is: 0.700
> Kabsch RMSD of heavy atoms in res. A[3..92],for model 10 is: 0.762
> Kabsch RMSD of heavy atoms in res. A[3..92],for model 11 is: 0.725
> Kabsch RMSD of heavy atoms in res. A[3..92],for model 12 is: 0.714
> Kabsch RMSD of heavy atoms in res. A[3..92],for model 13 is: 0.663
> Kabsch RMSD of heavy atoms in res. A[3..92],for model 14 is: 0.649
> Kabsch RMSD of heavy atoms in res. A[3..92],for model 15 is: 0.713
> Kabsch RMSD of heavy atoms in res. A[3..92],for model 16 is: 0.802
> Kabsch RMSD of heavy atoms in res. A[3..92],for model 17 is: 0.687
> Kabsch RMSD of heavy atoms in res. A[3..92],for model 18 is: 0.734
> Kabsch RMSD of heavy atoms in res. A[3..92],for model 19 is: 0.762
> Kabsch RMSD of heavy atoms in res. A[3..92],for model 20 is: 0.648 (*)
>
> Kabsch RMSD statistics for 20 structures:
> Mean RMSD using as refer. str. `average' for res.[3..92], is: 0.713
> Range of RMSD values to reference struct. is 0.648 to 0.802
Text report of backbone RMSD for entire protein
> Kabsch RMSD of backb atoms in res. *[1..99],for model 1 is: 2.164
> Kabsch RMSD of backb atoms in res. *[1..99],for model 2 is: 2.338
> Kabsch RMSD of backb atoms in res. *[1..99],for model 3 is: 1.265
> Kabsch RMSD of backb atoms in res. *[1..99],for model 4 is: 1.693
> Kabsch RMSD of backb atoms in res. *[1..99],for model 5 is: 1.315
> Kabsch RMSD of backb atoms in res. *[1..99],for model 6 is: 2.363
> Kabsch RMSD of backb atoms in res. *[1..99],for model 7 is: 2.173
> Kabsch RMSD of backb atoms in res. *[1..99],for model 8 is: 1.346
> Kabsch RMSD of backb atoms in res. *[1..99],for model 9 is: 2.225
> Kabsch RMSD of backb atoms in res. *[1..99],for model 10 is: 2.180
> Kabsch RMSD of backb atoms in res. *[1..99],for model 11 is: 1.419
> Kabsch RMSD of backb atoms in res. *[1..99],for model 12 is: 1.112
> Kabsch RMSD of backb atoms in res. *[1..99],for model 13 is: 0.875 (*)
> Kabsch RMSD of backb atoms in res. *[1..99],for model 14 is: 0.906
> Kabsch RMSD of backb atoms in res. *[1..99],for model 15 is: 1.478
> Kabsch RMSD of backb atoms in res. *[1..99],for model 16 is: 1.370
> Kabsch RMSD of backb atoms in res. *[1..99],for model 17 is: 1.622
> Kabsch RMSD of backb atoms in res. *[1..99],for model 18 is: 1.722
> Kabsch RMSD of backb atoms in res. *[1..99],for model 19 is: 1.797
> Kabsch RMSD of backb atoms in res. *[1..99],for model 20 is: 1.302
>
> Kabsch RMSD statistics for 20 structures:
> Mean RMSD using as refer. str. `average' for res.[1..99], is: 1.633
> Range of RMSD values to reference struct. is 0.875 to 2.363
Text report of heavy atom RMSD for entire protein
> Kabsch RMSD of heavy atoms in res. *[1..99],for model 1 is: 2.790
> Kabsch RMSD of heavy atoms in res. *[1..99],for model 2 is: 2.917
> Kabsch RMSD of heavy atoms in res. *[1..99],for model 3 is: 1.713
> Kabsch RMSD of heavy atoms in res. *[1..99],for model 4 is: 2.241
> Kabsch RMSD of heavy atoms in res. *[1..99],for model 5 is: 1.829
> Kabsch RMSD of heavy atoms in res. *[1..99],for model 6 is: 2.910
> Kabsch RMSD of heavy atoms in res. *[1..99],for model 7 is: 2.877
> Kabsch RMSD of heavy atoms in res. *[1..99],for model 8 is: 1.834
> Kabsch RMSD of heavy atoms in res. *[1..99],for model 9 is: 2.676
> Kabsch RMSD of heavy atoms in res. *[1..99],for model 10 is: 2.793
> Kabsch RMSD of heavy atoms in res. *[1..99],for model 11 is: 2.021
> Kabsch RMSD of heavy atoms in res. *[1..99],for model 12 is: 1.692
> Kabsch RMSD of heavy atoms in res. *[1..99],for model 13 is: 1.513 (*)
> Kabsch RMSD of heavy atoms in res. *[1..99],for model 14 is: 1.667
> Kabsch RMSD of heavy atoms in res. *[1..99],for model 15 is: 1.863
> Kabsch RMSD of heavy atoms in res. *[1..99],for model 16 is: 1.877
> Kabsch RMSD of heavy atoms in res. *[1..99],for model 17 is: 2.144
> Kabsch RMSD of heavy atoms in res. *[1..99],for model 18 is: 2.200
> Kabsch RMSD of heavy atoms in res. *[1..99],for model 19 is: 2.294
> Kabsch RMSD of heavy atoms in res. *[1..99],for model 20 is: 1.900
>
> Kabsch RMSD statistics for 20 structures:
> Mean RMSD using as refer. str. `average' for res.[1..99], is: 2.187
> Range of RMSD values to reference struct. is 1.513 to 2.917
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 1.6 0.4 0.4
All heavy atoms 2.2 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 >>>----------+
| |
| SRR115C_NMR_em_bcr3_020.rin 0.0 1820 residues |
| |
+| Ramachandran plot: 91.7% core 8.2% allow 0.1% gener 0.0% disall |
| |
+| All Ramachandrans: 15 labelled residues (out of1820) |
+| Chi1-chi2 plots: 7 labelled residues (out of1240) |
JPEG image for all model Ramachandran Plot
Residue Properties for all models
JPEG for all model Residue Properties - page $num_n
JPEG for all model Residue Properties - page $num_n
Model Secondary Structures from Procheck
JPEG for Model Secondary Structures - page $num_n
JPEG for Model Secondary Structures - page $num_n
JPEG for Model Secondary Structures - page $num_n
JPEG for Model Secondary Structures - page $num_n
JPEG for Model Secondary Structures - page $num_n
JPEG for Model Secondary Structures - page $num_n
Ramachandran Plots for each residue
JPEG for residue Ramachandran Plots - page $num_n
JPEG for residue Ramachandran Plots - page $num_n
JPEG for residue Ramachandran Plots - page $num_n
JPEG for residue Ramachandran Plots - page $num_n
JPEG for residue Ramachandran Plots - page $num_n
Ramachandran analysis for each residue from Molprobity
Chi1-Chi2 Plots for each residue
JPEG for residue Chi1-Chi2 Plots - page $num_n
JPEG for residue Chi1-Chi2 Plots - page $num_n
JPEG for residue Chi1-Chi2 Plots - page $num_n
JPEG for residue Chi1-Chi2 Plots - page $num_n
Procheck G-factors for phi-psi for each residue
JPEG image for residue phi-psi G-factors
Table of Procheck G-factors for phi-psi for ordered residues
#phipsi_gfactor
#Residue\Model average
2 -0.58
3 -1.44
4 0.05
5 -0.30
6 -1.13
7 1.01
8 0.82
9 0.32
10 0.90
11 0.81
12 0.93
13 0.93
14 1.00
15 0.92
16 1.18
17 0.82
18 0.51
19 -0.75
20 -2.12
21 -1.38
22 0.82
23 0.92
24 0.76
25 0.96
26 0.86
27 0.72
28 1.00
29 0.90
30 0.81
31 0.73
32 0.89
33 0.45
34 0.87
35 -0.40
36 -1.13
37 -0.41
38 0.00
39 -2.52
40 0.73
41 0.74
42 0.48
43 1.14
44 -0.28
45 0.92
46 0.86
47 0.77
48 1.12
49 1.02
50 1.15
51 0.83
52 0.87
53 -1.50
54 -1.10
55 -2.32
56 0.97
57 1.18
58 1.19
59 0.57
60 0.77
61 1.16
62 1.01
63 1.04
64 0.76
65 1.13
66 1.18
67 0.75
68 0.83
69 -1.12
70 0.51
71 0.85
72 -1.31
73 -0.68
74 -0.37
75 -0.65
76 0.60
77 1.00
78 1.12
79 0.82
80 1.09
81 0.87
82 0.81
83 1.06
84 1.10
85 0.79
86 0.87
87 0.89
88 0.59
89 0.57
90 0.61
91 -0.10
92 -0.83
#Reported_Model_Average 0.393
#Overall_Average_Reported 0.393
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 -0.99
3 -1.44
4 0.36
5 -0.64
6 -1.13
7 0.73
8 0.39
9 -0.67
10 0.63
11 0.81
12 0.70
13 0.93
14 1.03
15 0.77
16 0.81
17 0.85
18 0.56
19 -0.64
20 -1.28
21 -0.57
22 0.82
23 0.52
24 0.43
25 0.96
26 0.58
27 0.72
28 0.85
29 0.25
30 0.99
31 0.53
32 0.48
33 0.56
34 0.28
35 -0.11
36 -1.04
37 -0.41
38 -0.64
39 -2.53
40 0.43
41 0.74
42 0.48
43 0.86
44 -0.08
45 0.19
46 0.49
47 0.77
48 0.59
49 0.52
50 0.10
51 0.93
52 0.85
53 -0.36
54 -0.96
55 -1.19
56 0.53
57 0.14
58 -0.23
59 0.57
60 0.29
61 0.12
62 0.72
63 0.35
64 0.76
65 -0.25
66 1.18
67 0.77
68 0.77
69 -0.88
70 0.51
71 0.31
72 -0.35
73 -0.35
74 -0.37
75 -0.10
76 0.43
77 0.69
78 0.20
79 0.66
80 0.41
81 0.73
82 0.68
83 1.11
84 0.12
85 0.79
86 0.44
87 -0.58
88 -0.55
89 0.57
90 0.71
91 -0.10
92 0.02
#Reported_Model_Average 0.216
#Overall_Average_Reported 0.216
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 0.23 0.23 0.51 0.23 0.51 0.51 0.23 0.51 0.51 0.23 0.23 0.23 0.51 0.51 0.23 0.23 0.23 0.51 0.23 0.51
3 0.44 0.64 0.44 0.44 0.44 0.25 0.64 0.44 0.44 0.44 0.44 0.44 0.44 0.64 0.64 0.25 0.64 0.44 0.64 0.44
4 0.04 0.28 0.28 0.04 0.28 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.28 0.04 0.04 0.04 0.04
5 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.34 0.51 0.51 0.51 0.51 0.23 0.51 0.51 0.51
6 -0.25 -0.25 -0.41 -0.25 -0.25 -0.25 -0.25 -0.25 -0.25 -0.25 -0.25 -0.25 -0.25 -0.25 -0.25 -0.25 -0.25 -0.25 -0.25 -0.25
7 -1.35 -1.35 -1.81 -1.35 -1.35 -1.35 -1.35 -1.81 -1.35 -1.81 -1.35 -1.35 -1.81 -1.35 -1.35 -1.35 -1.81 -1.35 -1.35 -1.35
8 0.39 -0.13 -0.13 -0.13 0.39 -0.13 -0.13 0.39 -0.13 0.39 -0.13 0.39 -0.13 0.39 0.39 0.39 -0.13 -0.13 0.39 0.39
9 1.10 1.10 1.10 -0.11 1.10 1.10 1.10 1.10 1.10 -0.11 1.10 1.10 1.10 1.10 -0.11 1.10 1.10 1.10 1.10 1.10
10 0.50 0.50 0.50 0.50 0.50 0.86 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50
11 -0.02 0.44 -0.02 0.76 0.76 -0.02 -0.02 -0.02 -0.02 0.76 -0.02 -0.02 -0.02 0.76 0.76 -0.02 -0.02 -0.02 0.76 0.76
12 -0.30 -0.30 -0.30 -0.30 -0.30 -0.46 -0.30 -0.30 -0.30 -0.30 -0.30 -0.30 -0.30 -0.30 -0.30 -0.46 -0.30 -0.46 -0.30 -0.46
13 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
14 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 0.62 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32
15 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62
16 0.82 0.61 0.61 0.82 0.61 0.82 0.61 0.61 0.82 0.61 0.82 0.82 0.61 0.61 0.82 0.82 0.61 0.82 0.82 0.82
17 0.16 0.16 0.16 0.71 0.16 0.16 0.16 0.16 0.16 0.16 -0.30 0.16 0.16 0.16 -0.30 -0.30 0.16 0.71 0.16 0.16
18 0.66 0.66 0.66 0.66 0.07 0.07 0.66 0.66 0.66 0.66 0.07 0.66 0.66 0.07 0.07 0.66 0.66 0.07 0.07 0.66
19 0.20 0.20 0.20 0.20 -0.41 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 -0.41 0.20 0.20
20 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23
21 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
22 0.76 0.76 0.76 0.76 0.76 0.76 0.76 0.76 0.76 0.76 0.76 0.76 0.44 0.44 0.76 0.76 0.76 0.76 0.76 0.76
23 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16
24 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56
25 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
26 0.71 0.71 0.71 0.16 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
27 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
28 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 -0.30 0.16 0.16 -0.30 0.16 0.16 0.16 0.16
29 1.28 1.28 1.28 1.28 1.28 1.28 1.28 1.28 1.28 1.28 1.28 1.28 1.28 1.28 1.28 1.28 1.28 1.28 1.28 1.28
30 -0.43 0.62 -0.43 0.62 -0.43 0.62 0.62 -0.43 0.62 -0.43 -0.43 0.62 0.62 0.62 0.62 0.62 -0.43 -0.43 0.62 -0.43
31 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62
32 0.71 1.30 0.71 1.30 0.71 0.71 1.30 1.30 0.71 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 0.71 1.30 1.30
33 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30
34 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62
35 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13
36 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.34 0.34 0.34 0.51 0.51 0.51 0.51 0.34 0.51 0.34 0.51
37 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
38 0.23 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
39 1.14 1.25 1.14 1.14 1.14 1.25 1.14 1.14 1.25 1.25 1.14 1.25 1.25 1.25 1.14 1.25 1.25 1.25 1.14 1.14
40 0.41 0.41 0.41 0.74 0.41 0.41 0.74 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.74 0.74
41 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63
42 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39
43 0.27 0.27 0.27 0.27 0.27 0.27 0.27 0.27 0.86 0.27 0.27 0.27 0.27 0.27 0.27 0.27 0.27 0.27 0.27 0.27
44 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50
45 0.61 -0.91 -0.91 0.61 0.61 0.17 0.61 -0.91 0.61 -0.91 -0.91 -0.91 0.61 0.61 0.61 0.61 -0.91 0.61 0.61 -0.91
46 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30
47 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63
48 0.56 0.56 0.56 0.56 0.56 0.66 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56
49 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30
50 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86
51 0.09 0.09 0.09 0.09 -0.58 -0.58 0.09 0.09 -2.15 -0.58 -0.58 -0.58 -0.58 -0.58 -2.15 -0.58 -0.58 0.09 0.09 -0.58
52 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 -0.20 0.56 0.56 -0.20 0.56 -0.20 0.56 0.56 -0.20 0.56
53 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33
54 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23
55 0.24 0.24 0.24 0.24 0.24 0.24 0.24 0.24 0.24 0.24 0.24 0.24 0.24 0.24 0.24 0.24 0.24 0.24 0.24 0.24
56 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39
57 0.29 0.44 0.44 0.29 0.29 0.29 0.44 0.29 0.44 0.44 0.44 0.44 0.44 0.44 0.29 0.44 0.44 0.44 0.44 0.44
58 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29
59 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
60 0.55 0.55 -0.02 -0.02 0.55 -0.02 -0.02 0.55 0.55 -0.02 -0.02 -0.02 -0.02 -0.02 -0.02 -0.02 0.55 0.55 -0.02 -0.02
61 0.44 0.44 0.44 0.44 0.44 0.29 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
62 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39
63 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86
64 0.76 0.76 -0.02 0.44 -0.02 -0.02 -0.02 -0.02 -0.02 -0.02 -0.02 -0.02 -0.02 -0.02 -0.02 -0.02 -0.02 -0.02 -0.02 -0.02
65 0.62 -0.32 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62
66 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63
67 0.55 0.55 0.55 0.55 -0.02 0.55 -0.02 0.55 0.55 0.55 0.55 0.55 0.55 -0.02 0.55 -0.02 -0.02 -0.02 0.55 0.55
68 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62
69 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 -0.29 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30
70 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
71 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56
72 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.60 0.62 0.62 0.62 0.62 0.62 0.62
73 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
74 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
75 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08
76 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29
77 0.07 0.07 0.66 0.07 0.07 0.07 0.66 0.66 0.07 0.07 0.66 0.07 0.07 0.07 0.07 0.07 0.07 0.07 0.07 0.07
78 -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
79 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.71 0.16 0.16 0.16 0.71 0.71 0.16 0.16 0.16
80 0.16 0.16 0.16 0.16 -0.38 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 -0.38 0.16 0.16 0.16 0.16 0.16
81 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62
82 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30
83 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32
84 0.29 0.29 0.44 0.29 0.44 0.29 0.29 0.44 0.44 0.29 0.44 0.44 0.44 0.29 0.29 0.44 0.29 0.29 0.29 0.44
85 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
86 -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
87 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46
88 0.66 0.66 0.66 0.66 0.66 0.66 0.66 0.66 0.66 0.66 0.66 0.66 0.66 0.66 0.66 0.66 0.66 0.66 0.66 0.66
89 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
90 -0.59 -1.13 0.28 0.28 -0.59 0.28 -0.59 -0.59 -0.59 -0.59 -1.13 -0.59 0.28 0.28 0.28 -0.59 -0.59 -0.59 0.28 0.28
91 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
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
#Reported_Model_Average 0.393 0.386 0.375 0.407 0.368 0.382 0.399 0.381 0.383 0.346 0.350 0.382 0.387 0.391 0.364 0.377 0.357 0.373 0.408 0.390
#Overall_Average_Reported 0.380
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 0.23 0.23 0.51 0.23 0.51 0.51 0.23 0.51 0.51 0.23 0.23 0.23 0.51 0.51 0.23 0.23 0.23 0.51 0.23 0.51
3 0.44 0.64 0.44 0.44 0.44 0.25 0.64 0.44 0.44 0.44 0.44 0.44 0.44 0.64 0.64 0.25 0.64 0.44 0.64 0.44
4 0.04 0.28 0.28 0.04 0.28 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.04 0.28 0.04 0.04 0.04 0.04
5 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.34 0.51 0.51 0.51 0.51 0.23 0.51 0.51 0.51
6 -0.25 -0.25 -0.41 -0.25 -0.25 -0.25 -0.25 -0.25 -0.25 -0.25 -0.25 -0.25 -0.25 -0.25 -0.25 -0.25 -0.25 -0.25 -0.25 -0.25
7 -1.35 -1.35 -1.81 -1.35 -1.35 -1.35 -1.35 -1.81 -1.35 -1.81 -1.35 -1.35 -1.81 -1.35 -1.35 -1.35 -1.81 -1.35 -1.35 -1.35
8 0.39 -0.13 -0.13 -0.13 0.39 -0.13 -0.13 0.39 -0.13 0.39 -0.13 0.39 -0.13 0.39 0.39 0.39 -0.13 -0.13 0.39 0.39
9 1.10 1.10 1.10 -0.11 1.10 1.10 1.10 1.10 1.10 -0.11 1.10 1.10 1.10 1.10 -0.11 1.10 1.10 1.10 1.10 1.10
10 0.50 0.50 0.50 0.50 0.50 0.86 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50
11 -0.02 0.44 -0.02 0.76 0.76 -0.02 -0.02 -0.02 -0.02 0.76 -0.02 -0.02 -0.02 0.76 0.76 -0.02 -0.02 -0.02 0.76 0.76
12 -0.30 -0.30 -0.30 -0.30 -0.30 -0.46 -0.30 -0.30 -0.30 -0.30 -0.30 -0.30 -0.30 -0.30 -0.30 -0.46 -0.30 -0.46 -0.30 -0.46
13 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
14 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 0.62 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32
15 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62
16 0.82 0.61 0.61 0.82 0.61 0.82 0.61 0.61 0.82 0.61 0.82 0.82 0.61 0.61 0.82 0.82 0.61 0.82 0.82 0.82
17 0.16 0.16 0.16 0.71 0.16 0.16 0.16 0.16 0.16 0.16 -0.30 0.16 0.16 0.16 -0.30 -0.30 0.16 0.71 0.16 0.16
18 0.66 0.66 0.66 0.66 0.07 0.07 0.66 0.66 0.66 0.66 0.07 0.66 0.66 0.07 0.07 0.66 0.66 0.07 0.07 0.66
19 0.20 0.20 0.20 0.20 -0.41 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 -0.41 0.20 0.20
20 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23
21 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
22 0.76 0.76 0.76 0.76 0.76 0.76 0.76 0.76 0.76 0.76 0.76 0.76 0.44 0.44 0.76 0.76 0.76 0.76 0.76 0.76
23 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16
24 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56
25 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
26 0.71 0.71 0.71 0.16 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
27 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
28 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 -0.30 0.16 0.16 -0.30 0.16 0.16 0.16 0.16
29 1.28 1.28 1.28 1.28 1.28 1.28 1.28 1.28 1.28 1.28 1.28 1.28 1.28 1.28 1.28 1.28 1.28 1.28 1.28 1.28
30 -0.43 0.62 -0.43 0.62 -0.43 0.62 0.62 -0.43 0.62 -0.43 -0.43 0.62 0.62 0.62 0.62 0.62 -0.43 -0.43 0.62 -0.43
31 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62
32 0.71 1.30 0.71 1.30 0.71 0.71 1.30 1.30 0.71 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 0.71 1.30 1.30
33 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30
34 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62
35 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13 -0.13
36 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.51 0.34 0.34 0.34 0.51 0.51 0.51 0.51 0.34 0.51 0.34 0.51
37 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
38 0.23 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
39 1.14 1.25 1.14 1.14 1.14 1.25 1.14 1.14 1.25 1.25 1.14 1.25 1.25 1.25 1.14 1.25 1.25 1.25 1.14 1.14
40 0.41 0.41 0.41 0.74 0.41 0.41 0.74 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.41 0.74 0.74
41 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63
42 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39
43 0.27 0.27 0.27 0.27 0.27 0.27 0.27 0.27 0.86 0.27 0.27 0.27 0.27 0.27 0.27 0.27 0.27 0.27 0.27 0.27
44 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50 0.50
45 0.61 -0.91 -0.91 0.61 0.61 0.17 0.61 -0.91 0.61 -0.91 -0.91 -0.91 0.61 0.61 0.61 0.61 -0.91 0.61 0.61 -0.91
46 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30
47 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63
48 0.56 0.56 0.56 0.56 0.56 0.66 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56
49 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30
50 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86
51 0.09 0.09 0.09 0.09 -0.58 -0.58 0.09 0.09 -2.15 -0.58 -0.58 -0.58 -0.58 -0.58 -2.15 -0.58 -0.58 0.09 0.09 -0.58
52 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 -0.20 0.56 0.56 -0.20 0.56 -0.20 0.56 0.56 -0.20 0.56
53 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33 -0.33
54 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23 0.23
55 0.24 0.24 0.24 0.24 0.24 0.24 0.24 0.24 0.24 0.24 0.24 0.24 0.24 0.24 0.24 0.24 0.24 0.24 0.24 0.24
56 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39
57 0.29 0.44 0.44 0.29 0.29 0.29 0.44 0.29 0.44 0.44 0.44 0.44 0.44 0.44 0.29 0.44 0.44 0.44 0.44 0.44
58 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29
59 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
60 0.55 0.55 -0.02 -0.02 0.55 -0.02 -0.02 0.55 0.55 -0.02 -0.02 -0.02 -0.02 -0.02 -0.02 -0.02 0.55 0.55 -0.02 -0.02
61 0.44 0.44 0.44 0.44 0.44 0.29 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
62 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39 0.39
63 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86 0.86
64 0.76 0.76 -0.02 0.44 -0.02 -0.02 -0.02 -0.02 -0.02 -0.02 -0.02 -0.02 -0.02 -0.02 -0.02 -0.02 -0.02 -0.02 -0.02 -0.02
65 0.62 -0.32 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62
66 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63 0.63
67 0.55 0.55 0.55 0.55 -0.02 0.55 -0.02 0.55 0.55 0.55 0.55 0.55 0.55 -0.02 0.55 -0.02 -0.02 -0.02 0.55 0.55
68 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62
69 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 -0.29 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30
70 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
71 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56 0.56
72 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.60 0.62 0.62 0.62 0.62 0.62 0.62
73 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
74 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
75 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08 0.08
76 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29 0.29
77 0.07 0.07 0.66 0.07 0.07 0.07 0.66 0.66 0.07 0.07 0.66 0.07 0.07 0.07 0.07 0.07 0.07 0.07 0.07 0.07
78 -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
79 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.71 0.16 0.16 0.16 0.71 0.71 0.16 0.16 0.16
80 0.16 0.16 0.16 0.16 -0.38 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 0.16 -0.38 0.16 0.16 0.16 0.16 0.16
81 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62 0.62
82 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30 1.30
83 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32 -0.32
84 0.29 0.29 0.44 0.29 0.44 0.29 0.29 0.44 0.44 0.29 0.44 0.44 0.44 0.29 0.29 0.44 0.29 0.29 0.29 0.44
85 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
86 -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
87 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46 -0.46
88 0.66 0.66 0.66 0.66 0.66 0.66 0.66 0.66 0.66 0.66 0.66 0.66 0.66 0.66 0.66 0.66 0.66 0.66 0.66 0.66
89 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
90 -0.59 -1.13 0.28 0.28 -0.59 0.28 -0.59 -0.59 -0.59 -0.59 -1.13 -0.59 0.28 0.28 0.28 -0.59 -0.59 -0.59 0.28 0.28
91 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
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
#Reported_Model_Average 0.393 0.386 0.375 0.407 0.368 0.382 0.399 0.381 0.383 0.346 0.350 0.382 0.387 0.391 0.364 0.377 0.357 0.373 0.408 0.390
#Overall_Average_Reported 0.380
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 1 1 0 0 0 0 1 1 1 0 1 1 0 1 0 1 1 0 0 1
4.000 0 1 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 0 0 1
5.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
6.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0
7.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
8.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0
9.000 1 3 2 3 0 1 2 1 2 1 1 3 3 1 2 0 1 1 1 2
10.000 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0
11.000 1 0 1 1 0 1 0 0 0 1 1 1 1 0 1 0 0 0 0 1
12.000 0 1 1 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 0 0
13.000 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
14.000 1 1 0 0 1 0 1 1 1 0 0 1 0 1 1 1 1 1 0 0
15.000 1 0 1 1 0 1 0 0 0 1 1 1 1 0 1 0 0 0 0 1
16.000 0 0 0 0 1 1 1 0 0 1 1 0 0 1 1 0 0 0 1 0
17.000 2 2 1 0 2 1 2 2 0 1 1 2 0 2 2 1 2 2 0 3
18.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
19.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
20.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
21.000 0 0 0 0 1 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0
22.000 1 1 1 1 1 1 1 1 1 2 0 0 1 1 1 1 1 0 0 2
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 1 0 0 0 1 0 0 0 1 0 0 0 0 1 0
26.000 0 1 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 1 1 0
27.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
28.000 0 0 1 0 1 0 0 0 1 1 0 1 0 0 0 0 0 1 1 0
29.000 2 2 2 2 2 2 3 2 2 2 5 3 3 2 4 2 2 2 2 3
30.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
31.000 0 2 0 2 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 1
32.000 0 0 2 2 0 0 1 0 0 0 2 2 3 0 2 0 0 1 1 1
33.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0
34.000 0 1 0 1 0 0 1 0 0 1 1 0 1 1 1 0 0 0 1 1
35.000 0 1 0 1 0 0 1 0 0 0 1 0 1 1 1 0 1 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 1 1 0 1 1 0 0 1 1 1 0 0 1 0 0 1 1 1 0 1
38.000 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 2 1 1 0 0
39.000 0 1 0 0 0 0 0 0 1 0 0 1 0 0 0 0 0 1 0 1
40.000 2 2 2 1 2 1 2 1 2 2 2 2 2 2 2 1 2 2 1 2
41.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
42.000 0 1 0 0 0 0 0 0 1 0 0 2 0 0 0 0 0 2 0 1
43.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
44.000 1 1 0 1 1 1 1 0 0 1 1 0 1 1 1 2 1 0 2 1
45.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
46.000 2 2 2 2 2 2 2 2 2 2 3 2 2 2 3 2 2 2 1 2
47.000 0 0 0 0 0 1 0 0 1 0 0 0 0 0 0 1 0 0 0 1
48.000 1 1 1 1 2 1 0 2 1 2 1 0 3 1 2 1 0 0 2 2
49.000 3 2 2 2 3 2 2 2 1 1 1 1 1 3 2 1 2 1 0 3
50.000 0 1 1 0 0 2 1 0 1 1 0 1 0 0 0 1 1 1 1 0
51.000 0 0 0 0 1 0 0 0 1 0 1 0 0 0 0 1 0 0 0 1
52.000 1 0 1 0 1 0 0 0 1 1 0 0 1 0 0 0 0 0 0 2
53.000 0 0 0 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1
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 1 0 0 3 1 0 1 1 0 1 0 0 0 0 1 0 0 0
56.000 2 1 1 1 0 4 1 1 1 1 1 1 1 1 1 2 1 1 2 1
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 0 0 0 0 0 0 0 0 0 0
59.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
60.000 1 1 2 1 1 1 2 1 1 1 1 2 1 2 1 1 2 2 1 2
61.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
62.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
63.000 1 1 1 1 2 2 2 1 1 1 1 0 1 1 2 1 1 1 1 0
64.000 0 1 2 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0
65.000 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
66.000 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0
67.000 2 1 2 1 3 2 2 2 0 1 1 0 0 1 1 2 1 1 0 0
68.000 0 1 1 0 0 0 0 0 0 0 0 0 0 0 1 0 1 0 0 0
69.000 2 2 1 2 2 1 1 2 2 2 1 1 2 1 1 3 1 2 1 2
70.000 0 0 0 0 0 0 1 0 1 1 1 0 0 0 0 0 0 1 0 0
71.000 1 1 2 0 1 1 0 0 1 1 0 1 1 0 0 1 2 1 0 2
72.000 0 0 1 0 1 0 0 0 1 1 0 1 1 0 1 1 1 1 0 1
73.000 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 1 1 0 0
74.000 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
75.000 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0
76.000 0 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0
77.000 0 1 0 0 1 0 2 0 1 1 1 0 0 1 1 0 0 0 0 1
78.000 1 1 1 0 1 0 1 0 1 1 1 1 1 1 1 0 1 1 0 1
79.000 0 1 1 0 1 0 0 2 0 0 0 0 0 0 0 1 1 0 1 1
80.000 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0
81.000 0 1 0 0 1 0 1 0 1 1 1 0 0 1 1 1 0 0 1 1
82.000 0 0 0 0 0 1 1 0 2 1 1 0 0 1 0 0 1 1 0 0
83.000 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0
84.000 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0
85.000 1 0 0 1 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0
86.000 1 1 0 1 0 1 2 0 0 1 0 2 1 1 0 0 0 0 0 1
87.000 0 0 0 0 0 1 1 0 0 0 0 1 0 0 1 0 1 0 0 0
88.000 1 0 0 2 1 2 2 0 0 0 1 1 0 0 2 0 0 0 0 0
89.000 1 0 1 0 0 1 0 0 0 1 0 1 1 0 0 1 1 0 1 0
90.000 1 2 1 1 1 1 1 0 0 1 1 1 1 0 0 0 1 1 0 0
91.000 0 0 0 0 0 0 1 0 0 1 0 1 1 0 0 0 0 0 0 0
92.000 2 0 1 0 0 1 0 0 0 1 1 1 1 0 0 0 1 0 0 0
#Reported_Model_Average 0.418 0.495 0.462 0.396 0.440 0.473 0.538 0.330 0.396 0.473 0.418 0.473 0.429 0.374 0.505 0.396 0.440 0.374 0.286 0.527
#Overall_Average_Reported 0.432
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1549:A 46 LEU 1HB :A 29 PHE 2HB : -0.597: 0
: 1549:A 29 PHE 1HB :A 46 LEU 3HD1 : -0.489: 0
: 1549:A 49 LEU 2HD2 :A 17 LEU 1HD2 : -0.545: 0
: 1549:A 22 ALA 1HB :A 49 LEU 1HD1 : -0.540: 0
: 1549:A 49 LEU HA :A 52 ARG 2HD : -0.449: 0
: 1549:A 17 LEU 2HD1 :A 14 GLN HA : -0.401: 0
: 1549:A 89 ALA HA :A 92 LEU HG : -0.522: 0
: 1549:A 60 ILE 1HG1 :A 56 THR O : -0.442: 0
: 1549:A 56 THR 1HG2 :A 92 LEU 1HB : -0.412: 0
: 1549:A 40 VAL 2HG2 :A 69 VAL 3HG2 : -0.521: 0
: 1549:A 40 VAL 1HG1 :A 78 ASP 2HB : -0.468: 0
: 1549:A 69 VAL 1HG1 :A 37 PRO O : -0.422: 0
: 1549:A 48 LYS 1HG :A 44 TYR O : -0.493: 0
: 1549:A 88 LYS 2HE :A 85 ALA HA : -0.479: 0
: 1549:A 95 HIS H :A 93 GLU 2HG : -0.474: 0
: 1549:A 3 PRO O :A 9 ARG 2HB : -0.468: 0
: 1549:A 11 ALA O :A 15 GLU 1HG : -0.454: 0
: 1549:A 90 GLU 1HG :A 86 LYS O : -0.439: 0
: 1549:A 71 ARG 1HG :A 67 ILE O : -0.420: 0
: 1549:A 63 TYR O :A 67 ILE 2HG1 : -0.414: 0
#sum2 ::12.91 clashscore : 12.91 clashscore B<40
#summary::1549 atoms:1549 atoms B<40:179186 potential dots:11200.0 A^2:20 bumps:20 bumps B<40:645.6 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1549:A 94 HIS 2HB :A 90 GLU HA : -0.649: 0
: 1549:A 86 LYS O :A 90 GLU 2HG : -0.457: 0
: 1549:A 40 VAL 2HG2 :A 69 VAL 3HG2 : -0.642: 0
: 1549:A 40 VAL 1HG1 :A 78 ASP 2HB : -0.624: 0
: 1549:A 69 VAL 1HG1 :A 37 PRO O : -0.408: 0
: 1549:A 17 LEU 2HD1 :A 14 GLN HA : -0.589: 0
: 1549:A 22 ALA 1HB :A 49 LEU 1HD1 : -0.483: 0
: 1549:A 49 LEU 2HD2 :A 17 LEU 1HD2 : -0.402: 0
: 1549:A 35 THR 2HG2 :A 31 GLU O : -0.523: 0
: 1549:A 34 GLU 1HG :A 31 GLU HA : -0.518: 0
: 1549:A 71 ARG 2HB :A 79 LEU 3HD1 : -0.519: 0
: 1549:A 48 LYS 1HG :A 44 TYR O : -0.517: 0
: 1549:A 60 ILE 1HG1 :A 56 THR O : -0.509: 0
: 1549:A 46 LEU 1HB :A 29 PHE 2HB : -0.505: 0
: 1549:A 29 PHE 1HB :A 46 LEU 3HD1 : -0.458: 0
: 1549:A 4 GLU HA :A 9 ARG NH1 : -0.484: 0
: 1549:A 12 LEU 2HB :A 9 ARG HA : -0.479: 0
: 1549:A 3 PRO O :A 9 ARG 2HB : -0.423: 0
: 1549:A 50 TYR CE1 :A 26 LEU 1HD1 : -0.478: 0
: 1549:A 77 LYS O :A 81 GLU 1HG : -0.459: 0
: 1549:A 63 TYR O :A 67 ILE 2HG1 : -0.418: 0
: 1549:A 42 THR HG1 :A 39 TYR HD1 : -0.407: 0
: 1549:A 68 GLU 1HG :A 64 ALA O : -0.401: 0
#sum2 ::14.85 clashscore : 14.85 clashscore B<40
#summary::1549 atoms:1549 atoms B<40:179300 potential dots:11210.0 A^2:23 bumps:23 bumps B<40:641.2 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1549:A 40 VAL 2HG2 :A 69 VAL 3HG2 : -0.590: 0
: 1549:A 40 VAL 1HG1 :A 78 ASP 2HB : -0.522: 0
: 1549:A 9 ARG 2HG :A 32 LEU 1HD2 : -0.572: 0
: 1549:A 12 LEU 2HB :A 9 ARG HA : -0.511: 0
: 1549:A 32 LEU HG :A 28 LEU O : -0.404: 0
: 1549:A 22 ALA 1HB :A 49 LEU 1HD1 : -0.551: 0
: 1549:A 49 LEU 2HD2 :A 17 LEU 1HD2 : -0.468: 0
: 1549:A 46 LEU 1HB :A 29 PHE 2HB : -0.535: 0
: 1549:A 29 PHE 1HB :A 46 LEU 3HD1 : -0.530: 0
: 1549:A 89 ALA HA :A 92 LEU HG : -0.505: 0
: 1549:A 90 GLU 2HG :A 60 ILE 2HD1 : -0.491: 0
: 1549:A 60 ILE 1HG1 :A 56 THR O : -0.450: 0
: 1549:A 71 ARG 2HB :A 79 LEU 3HD1 : -0.457: 0
: 1549:A 71 ARG 2HG :A 72 GLU 1HG : -0.406: 0
: 1549:A 48 LYS O :A 52 ARG 2HG : -0.456: 0
: 1549:A 63 TYR O :A 67 ILE 2HG1 : -0.449: 0
: 1549:A 64 ALA O :A 68 GLU 2HG : -0.426: 0
: 1549:A 67 ILE 2HD1 :A 64 ALA HA : -0.419: 0
: 1549:A 11 ALA O :A 15 GLU 1HG : -0.447: 0
: 1549:A 65 GLN HA :A 65 GLN 2HE2 : -0.404: 0
: 1549:A 55 ARG O :A 50 TYR 2HB : -0.400: 0
#sum2 ::13.56 clashscore : 13.56 clashscore B<40
#summary::1549 atoms:1549 atoms B<40:179079 potential dots:11190.0 A^2:21 bumps:21 bumps B<40:646.4 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1549:A 9 ARG 1HH2 :A 31 GLU 2HG : -0.737: 0
: 1549:A 9 ARG 2HG :A 32 LEU HG : -0.506: 0
: 1549:A 32 LEU 1HD1 :A 10 TYR 1HB : -0.451: 0
: 1549:A 31 GLU 2HG :A 9 ARG NH2 : -0.410: 0
: 1549:A 22 ALA 1HB :A 49 LEU 1HD1 : -0.606: 0
: 1549:A 53 LEU HG :A 49 LEU O : -0.410: 0
: 1549:A 40 VAL 2HG2 :A 69 VAL 3HG2 : -0.586: 0
: 1549:A 37 PRO O :A 69 VAL 1HG1 : -0.424: 0
: 1549:A 29 PHE 1HB :A 46 LEU 3HD1 : -0.575: 0
: 1549:A 46 LEU 1HB :A 29 PHE 2HB : -0.518: 0
: 1549:A 86 LYS O :A 90 GLU 1HG : -0.483: 0
: 1549:A 56 THR O :A 60 ILE 1HG1 : -0.475: 0
: 1549:A 44 TYR O :A 48 LYS 1HG : -0.461: 0
: 1549:A 11 ALA O :A 15 GLU 1HG : -0.450: 0
: 1549:A 34 GLU 2HG :A 35 THR 3HG2 : -0.435: 0
: 1549:A 67 ILE 2HG1 :A 63 TYR O : -0.431: 0
: 1549:A 94 HIS N :A 93 GLU 2HG : -0.412: 0
: 1549:A 85 ALA HA :A 88 LYS NZ : -0.404: 0
: 1549:A 84 ASP O :A 88 LYS 1HG : -0.402: 0
#sum2 ::12.27 clashscore : 12.27 clashscore B<40
#summary::1549 atoms:1549 atoms B<40:179129 potential dots:11200.0 A^2:19 bumps:19 bumps B<40:659.6 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1549:A 71 ARG 2HG :A 72 GLU 2HG : -0.693: 0
: 1549:A 49 LEU HA :A 52 ARG 2HD : -0.591: 0
: 1549:A 49 LEU 2HD2 :A 17 LEU 1HD2 : -0.543: 0
: 1549:A 22 ALA 1HB :A 49 LEU 1HD1 : -0.536: 0
: 1549:A 17 LEU 2HD1 :A 14 GLN HA : -0.424: 0
: 1549:A 40 VAL 2HG2 :A 69 VAL 3HG2 : -0.556: 0
: 1549:A 40 VAL 1HG1 :A 78 ASP 2HB : -0.517: 0
: 1549:A 69 VAL 1HG1 :A 37 PRO O : -0.471: 0
: 1549:A 46 LEU 1HB :A 29 PHE 2HB : -0.552: 0
: 1549:A 29 PHE 1HB :A 46 LEU 3HD1 : -0.549: 0
: 1549:A 90 GLU 2HG :A 60 ILE 2HD1 : -0.549: 0
: 1549:A 79 LEU 1HD1 :A 67 ILE 3HG2 : -0.532: 0
: 1549:A 67 ILE 2HD1 :A 64 ALA HA : -0.512: 0
: 1549:A 63 TYR O :A 67 ILE 2HG1 : -0.435: 0
: 1549:A 48 LYS 1HG :A 44 TYR O : -0.421: 0
: 1549:A 63 TYR OH :A 48 LYS 1HD : -0.408: 0
: 1549:A 77 LYS O :A 81 GLU 1HG : -0.487: 0
: 1549:A 16 HIS 2HB :A 21 ASN O : -0.439: 0
: 1549:A 13 ALA 2HB :A 28 LEU 1HB : -0.429: 0
: 1549:A 88 LYS 3HZ :A 51 GLU CD : -0.412: 0
#sum2 ::12.91 clashscore : 12.91 clashscore B<40
#summary::1549 atoms:1549 atoms B<40:179214 potential dots:11200.0 A^2:20 bumps:20 bumps B<40:679.1 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1549:A 40 VAL 2HG2 :A 69 VAL 3HG2 : -0.723: 0
: 1549:A 56 THR HB :A 93 GLU 1HG : -0.634: 0
: 1549:A 60 ILE 1HG1 :A 56 THR O : -0.562: 0
: 1549:A 56 THR 3HG2 :A 89 ALA 1HB : -0.532: 0
: 1549:A 56 THR 1HG2 :A 92 LEU 1HB : -0.465: 0
: 1549:A 16 HIS 1HB :A 25 ALA 2HB : -0.570: 0
: 1549:A 4 GLU HA :A 9 ARG NH1 : -0.550: 0
: 1549:A 22 ALA 1HB :A 49 LEU 1HD1 : -0.522: 0
: 1549:A 49 LEU 3HD1 :A 17 LEU 2HD2 : -0.417: 0
: 1549:A 29 PHE 1HB :A 46 LEU 3HD1 : -0.520: 0
: 1549:A 46 LEU 1HB :A 29 PHE 2HB : -0.474: 0
: 1549:A 55 ARG O :A 50 TYR 2HB : -0.474: 0
: 1549:A 47 GLY 1HA :A 50 TYR HD2 : -0.407: 0
: 1549:A 55 ARG HA :A 55 ARG CZ : -0.404: 0
: 1549:A 63 TYR O :A 67 ILE 2HG1 : -0.469: 0
: 1549:A 67 ILE O :A 71 ARG 1HG : -0.408: 0
: 1549:A 63 TYR HD1 :A 82 LEU 3HD2 : -0.405: 0
: 1549:A 11 ALA O :A 15 GLU 2HG : -0.468: 0
: 1549:A 84 ASP O :A 88 LYS 1HG : -0.427: 0
: 1549:A 88 LYS N :A 87 LEU 2HD1 : -0.406: 0
: 1549:A 48 LYS 1HG :A 44 TYR O : -0.422: 0
: 1549:A 90 GLU 1HG :A 86 LYS O : -0.413: 0
#sum2 ::14.20 clashscore : 14.20 clashscore B<40
#summary::1549 atoms:1549 atoms B<40:179346 potential dots:11210.0 A^2:22 bumps:22 bumps B<40:616.8 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1549:A 95 HIS 1HB :A 91 GLY 1HA : -0.582: 0
: 1549:A 40 VAL 2HG2 :A 69 VAL 3HG2 : -0.578: 0
: 1549:A 40 VAL 1HG1 :A 78 ASP 2HB : -0.473: 0
: 1549:A 86 LYS 2HE :A 60 ILE 3HG2 : -0.562: 0
: 1549:A 86 LYS O :A 90 GLU 2HG : -0.500: 0
: 1549:A 60 ILE 1HG1 :A 56 THR O : -0.483: 0
: 1549:A 32 LEU 2HD1 :A 29 PHE HA : -0.543: 0
: 1549:A 29 PHE 1HB :A 46 LEU 3HD1 : -0.434: 0
: 1549:A 46 LEU 1HB :A 29 PHE 2HB : -0.433: 0
: 1549:A 88 LYS 2HE :A 85 ALA HA : -0.538: 0
: 1549:A 88 LYS N :A 87 LEU 2HD1 : -0.422: 0
: 1549:A 22 ALA 1HB :A 49 LEU 1HD1 : -0.517: 0
: 1549:A 49 LEU 2HD2 :A 17 LEU 1HD2 : -0.424: 0
: 1549:A 17 LEU 2HD1 :A 14 GLN HA : -0.421: 0
: 1549:A 63 TYR O :A 67 ILE 2HG1 : -0.478: 0
: 1549:A 67 ILE 2HD1 :A 64 ALA HA : -0.445: 0
: 1549:A 44 TYR HA :A 63 TYR HE1 : -0.421: 0
: 1549:A 82 LEU 2HD1 :A 70 ALA 2HB : -0.470: 0
: 1549:A 77 LYS O :A 81 GLU 2HG : -0.460: 0
: 1549:A 77 LYS 1HG :A 75 THR OG1 : -0.453: 0
: 1549:A 3 PRO O :A 9 ARG 2HB : -0.431: 0
: 1549:A 12 LEU 2HB :A 9 ARG HA : -0.408: 0
: 1549:A 55 ARG O :A 50 TYR 2HB : -0.426: 0
: 1549:A 34 GLU 2HG :A 35 THR 3HG2 : -0.419: 0
: 1549:A 16 HIS 2HB :A 21 ASN O : -0.405: 0
#sum2 ::16.14 clashscore : 16.14 clashscore B<40
#summary::1549 atoms:1549 atoms B<40:179290 potential dots:11210.0 A^2:25 bumps:25 bumps B<40:613.9 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1549:A 22 ALA 1HB :A 49 LEU 1HD1 : -0.640: 0
: 1549:A 17 LEU 1HD2 :A 49 LEU 2HD2 : -0.556: 0
: 1549:A 17 LEU 2HD1 :A 14 GLN HA : -0.424: 0
: 1549:A 29 PHE 1HB :A 46 LEU 3HD1 : -0.560: 0
: 1549:A 46 LEU 1HB :A 29 PHE 2HB : -0.505: 0
: 1549:A 56 THR O :A 60 ILE 1HG1 : -0.507: 0
: 1549:A 9 ARG 2HB :A 3 PRO O : -0.479: 0
: 1549:A 76 GLN NE2 :A 79 LEU 3HD2 : -0.479: 0
: 1549:A 67 ILE 2HG1 :A 63 TYR O : -0.458: 0
: 1549:A 76 GLN 2HE2 :A 76 GLN HA : -0.409: 0
: 1549:A 79 LEU 1HD1 :A 67 ILE 3HG2 : -0.401: 0
: 1549:A 38 ASP 2HB :A 73 GLU 2HG : -0.476: 0
: 1549:A 40 VAL 2HG2 :A 69 VAL 3HG2 : -0.446: 0
: 1549:A 37 PRO O :A 69 VAL 1HG1 : -0.411: 0
: 1549:A 48 LYS HA :A 48 LYS 2HD : -0.400: 0
#sum2 ::9.68 clashscore : 9.68 clashscore B<40
#summary::1549 atoms:1549 atoms B<40:179286 potential dots:11210.0 A^2:15 bumps:15 bumps B<40:675.1 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1549:A 71 ARG 2HG :A 72 GLU 2HG : -0.694: 0
: 1549:A 40 VAL 2HG2 :A 69 VAL 3HG2 : -0.676: 0
: 1549:A 40 VAL 1HG1 :A 78 ASP 2HB : -0.566: 0
: 1549:A 37 PRO O :A 69 VAL 1HG1 : -0.476: 0
: 1549:A 56 THR O :A 60 ILE 1HG1 : -0.577: 0
: 1549:A 29 PHE 1HB :A 46 LEU 3HD1 : -0.545: 0
: 1549:A 46 LEU 1HB :A 29 PHE 2HB : -0.497: 0
: 1549:A 22 ALA 1HB :A 49 LEU 1HD1 : -0.532: 0
: 1549:A 70 ALA 2HB :A 82 LEU 2HD1 : -0.528: 0
: 1549:A 82 LEU 2HD2 :A 63 TYR HD1 : -0.415: 0
: 1549:A 28 LEU 2HD2 :A 9 ARG 1HB : -0.466: 0
: 1549:A 9 ARG 2HB :A 3 PRO O : -0.444: 0
: 1549:A 42 THR HG1 :A 39 TYR HD1 : -0.460: 0
: 1549:A 55 ARG O :A 50 TYR 2HB : -0.442: 0
: 1549:A 48 LYS O :A 52 ARG 2HG : -0.433: 0
: 1549:A 47 GLY O :A 51 GLU 2HG : -0.410: 0
: 1549:A 81 GLU 2HG :A 77 LYS O : -0.408: 0
: 1549:A 14 GLN 2HG :A 10 TYR O : -0.403: 0
#sum2 ::11.62 clashscore : 11.62 clashscore B<40
#summary::1549 atoms:1549 atoms B<40:179228 potential dots:11200.0 A^2:18 bumps:18 bumps B<40:636.1 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1549:A 71 ARG 2HG :A 72 GLU 2HG : -0.763: 0
: 1549:A 95 HIS 1HB :A 91 GLY 1HA : -0.632: 0
: 1549:A 40 VAL 1HG1 :A 78 ASP 2HB : -0.590: 0
: 1549:A 40 VAL 2HG2 :A 69 VAL 3HG2 : -0.510: 0
: 1549:A 69 VAL 1HG1 :A 37 PRO O : -0.473: 0
: 1549:A 29 PHE 1HB :A 46 LEU 3HD1 : -0.576: 0
: 1549:A 46 LEU 1HB :A 29 PHE 2HB : -0.562: 0
: 1549:A 60 ILE 1HG1 :A 56 THR O : -0.531: 0
: 1549:A 77 LYS O :A 81 GLU 1HG : -0.519: 0
: 1549:A 22 ALA 1HB :A 49 LEU 1HD1 : -0.516: 0
: 1549:A 17 LEU 3HD2 :A 22 ALA HA : -0.452: 0
: 1549:A 34 GLU 1HG :A 31 GLU HA : -0.500: 0
: 1549:A 48 LYS 1HG :A 44 TYR O : -0.474: 0
: 1549:A 52 ARG 2HG :A 48 LYS O : -0.405: 0
: 1549:A 82 LEU 2HD1 :A 70 ALA 2HB : -0.473: 0
: 1549:A 63 TYR O :A 67 ILE 2HG1 : -0.472: 0
: 1549:A 9 ARG 1HH2 :A 28 LEU HA : -0.450: 0
: 1549:A 89 ALA HA :A 92 LEU HG : -0.443: 0
: 1549:A 86 LYS O :A 90 GLU 2HG : -0.434: 0
: 1549:A 55 ARG O :A 50 TYR 2HB : -0.417: 0
: 1549:A 16 HIS 1HB :A 25 ALA 2HB : -0.411: 0
: 1549:A 11 ALA O :A 15 GLU 1HG : -0.401: 0
#sum2 ::14.20 clashscore : 14.20 clashscore B<40
#summary::1549 atoms:1549 atoms B<40:179209 potential dots:11200.0 A^2:22 bumps:22 bumps B<40:591.5 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1549:A 40 VAL 2HG2 :A 69 VAL 3HG2 : -0.645: 0
: 1549:A 40 VAL 1HG1 :A 78 ASP 2HB : -0.572: 0
: 1549:A 98 HIS 2HB :A 95 HIS 2HB : -0.611: 0
: 1549:A 90 GLU 2HG :A 60 ILE 2HD1 : -0.570: 0
: 1549:A 32 LEU 2HD1 :A 29 PHE HA : -0.528: 0
: 1549:A 46 LEU 1HB :A 29 PHE 2HB : -0.486: 0
: 1549:A 29 PHE 1HB :A 46 LEU 3HD1 : -0.446: 0
: 1549:A 46 LEU 3HD1 :A 29 PHE CB : -0.414: 0
: 1549:A 32 LEU 1HB :A 29 PHE O : -0.400: 0
: 1549:A 56 THR 3HG2 :A 51 GLU 1HG : -0.482: 0
: 1549:A 17 LEU 1HD2 :A 49 LEU 2HD2 : -0.468: 0
: 1549:A 70 ALA 2HB :A 82 LEU 2HD1 : -0.464: 0
: 1549:A 81 GLU 1HG :A 77 LYS O : -0.426: 0
: 1549:A 44 TYR O :A 48 LYS 1HG : -0.422: 0
: 1549:A 63 TYR O :A 67 ILE 2HG1 : -0.405: 0
: 1549:A 16 HIS 2HB :A 21 ASN O : -0.404: 0
: 1549:A 3 PRO O :A 9 ARG 2HB : -0.403: 0
: 1549:A 15 GLU 2HG :A 11 ALA O : -0.401: 0
: 1549:A 92 LEU HG :A 88 LYS O : -0.400: 0
: 1549:A 34 GLU 2HG :A 35 THR 3HG2 : -0.400: 0
#sum2 ::12.91 clashscore : 12.91 clashscore B<40
#summary::1549 atoms:1549 atoms B<40:179122 potential dots:11200.0 A^2:20 bumps:20 bumps B<40:641.7 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1549:A 40 VAL 2HG2 :A 69 VAL 3HG2 : -0.599: 0
: 1549:A 40 VAL 1HG1 :A 78 ASP 2HB : -0.582: 0
: 1549:A 28 LEU 2HD2 :A 9 ARG 1HB : -0.563: 0
: 1549:A 3 PRO O :A 9 ARG 2HB : -0.526: 0
: 1549:A 4 GLU HA :A 9 ARG 1HH1 : -0.438: 0
: 1549:A 32 LEU 2HD1 :A 29 PHE HA : -0.536: 0
: 1549:A 29 PHE 1HB :A 46 LEU 3HD1 : -0.522: 0
: 1549:A 42 THR HG1 :A 39 TYR HD1 : -0.456: 0
: 1549:A 46 LEU 1HB :A 29 PHE 2HB : -0.437: 0
: 1549:A 32 LEU 1HB :A 42 THR 1HG2 : -0.409: 0
: 1549:A 60 ILE 1HG1 :A 56 THR O : -0.507: 0
: 1549:A 86 LYS O :A 90 GLU 2HG : -0.439: 0
: 1549:A 86 LYS 2HE :A 60 ILE 3HG2 : -0.428: 0
: 1549:A 17 LEU 2HD1 :A 14 GLN HA : -0.503: 0
: 1549:A 49 LEU 2HD2 :A 17 LEU 1HD2 : -0.462: 0
: 1549:A 71 ARG 2HG :A 72 GLU 1HG : -0.465: 0
: 1549:A 89 ALA HA :A 92 LEU HG : -0.450: 0
: 1549:A 55 ARG O :A 50 TYR 2HB : -0.435: 0
: 1549:A 94 HIS 1HB :A 91 GLY 1HA : -0.429: 0
: 1549:A 88 LYS N :A 87 LEU 2HD1 : -0.427: 0
: 1549:A 83 GLN 2HE2 :A 80 SER HA : -0.424: 0
: 1549:A 11 ALA O :A 15 GLU 2HG : -0.401: 0
#sum2 ::14.20 clashscore : 14.20 clashscore B<40
#summary::1549 atoms:1549 atoms B<40:179245 potential dots:11200.0 A^2:22 bumps:22 bumps B<40:620.1 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1549:A 71 ARG 2HG :A 72 GLU 2HG : -0.733: 0
: 1549:A 93 GLU HA :A 96 HIS 1HB : -0.620: 0
: 1549:A 32 LEU 2HD1 :A 29 PHE HA : -0.590: 0
: 1549:A 46 LEU 1HB :A 29 PHE 2HB : -0.510: 0
: 1549:A 29 PHE 1HB :A 46 LEU 3HD1 : -0.491: 0
: 1549:A 12 LEU 2HB :A 9 ARG HA : -0.435: 0
: 1549:A 32 LEU HA :A 9 ARG 1HH2 : -0.422: 0
: 1549:A 9 ARG NH2 :A 32 LEU HA : -0.403: 0
: 1549:A 89 ALA HA :A 92 LEU HG : -0.568: 0
: 1549:A 22 ALA 1HB :A 49 LEU 1HD1 : -0.535: 0
: 1549:A 60 ILE 1HG1 :A 56 THR O : -0.513: 0
: 1549:A 40 VAL 2HG2 :A 69 VAL 3HG2 : -0.506: 0
: 1549:A 40 VAL 1HG1 :A 78 ASP 2HB : -0.492: 0
: 1549:A 69 VAL 1HG1 :A 37 PRO O : -0.486: 0
: 1549:A 48 LYS 1HG :A 44 TYR O : -0.486: 0
: 1549:A 48 LYS O :A 52 ARG 2HG : -0.436: 0
: 1549:A 63 TYR OH :A 48 LYS 1HD : -0.414: 0
: 1549:A 90 GLU 1HG :A 86 LYS O : -0.485: 0
: 1549:A 34 GLU 2HG :A 35 THR 3HG2 : -0.480: 0
: 1549:A 94 HIS 1HB :A 91 GLY 1HA : -0.406: 0
: 1549:A 15 GLU 1HG :A 11 ALA O : -0.401: 0
#sum2 ::13.56 clashscore : 13.56 clashscore B<40
#summary::1549 atoms:1549 atoms B<40:179289 potential dots:11210.0 A^2:21 bumps:21 bumps B<40:627.4 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1549:A 40 VAL 2HG2 :A 69 VAL 3HG2 : -0.663: 0
: 1549:A 40 VAL 1HG1 :A 78 ASP 2HB : -0.520: 0
: 1549:A 22 ALA 1HB :A 49 LEU 1HD1 : -0.554: 0
: 1549:A 17 LEU 1HD2 :A 49 LEU 2HD2 : -0.508: 0
: 1549:A 17 LEU 2HD1 :A 14 GLN HA : -0.473: 0
: 1549:A 53 LEU HG :A 49 LEU O : -0.459: 0
: 1549:A 29 PHE 1HB :A 46 LEU 3HD1 : -0.546: 0
: 1549:A 46 LEU 1HB :A 29 PHE 2HB : -0.532: 0
: 1549:A 56 THR O :A 60 ILE 1HG1 : -0.528: 0
: 1549:A 60 ILE 3HG2 :A 86 LYS 2HE : -0.468: 0
: 1549:A 81 GLU 1HG :A 77 LYS O : -0.515: 0
: 1549:A 66 GLY 2HA :A 82 LEU 3HD1 : -0.496: 0
: 1549:A 44 TYR O :A 48 LYS 1HG : -0.496: 0
: 1549:A 9 ARG 2HB :A 3 PRO O : -0.483: 0
: 1549:A 67 ILE 2HG1 :A 63 TYR O : -0.482: 0
: 1549:A 34 GLU 2HG :A 35 THR 3HG2 : -0.454: 0
: 1549:A 25 ALA 2HB :A 16 HIS 1HB : -0.414: 0
#sum2 ::10.97 clashscore : 10.97 clashscore B<40
#summary::1549 atoms:1549 atoms B<40:179321 potential dots:11210.0 A^2:17 bumps:17 bumps B<40:659.3 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1549:A 34 GLU 2HG :A 35 THR 3HG2 : -0.637: 0
: 1549:A 29 PHE 1HB :A 46 LEU 3HD1 : -0.614: 0
: 1549:A 46 LEU 1HB :A 29 PHE 2HB : -0.523: 0
: 1549:A 6 PRO HA :A 9 ARG 2HD : -0.506: 0
: 1549:A 32 LEU 2HD1 :A 29 PHE HA : -0.449: 0
: 1549:A 29 PHE O :A 33 VAL 3HG2 : -0.429: 0
: 1549:A 26 LEU 2HD1 :A 46 LEU 2HD1 : -0.408: 0
: 1549:A 32 LEU 3HD2 :A 9 ARG NH1 : -0.407: 0
: 1549:A 40 VAL 1HG1 :A 78 ASP 2HB : -0.565: 0
: 1549:A 40 VAL 2HG2 :A 69 VAL 3HG2 : -0.512: 0
: 1549:A 22 ALA 1HB :A 49 LEU 1HD1 : -0.519: 0
: 1549:A 49 LEU 2HD2 :A 17 LEU 1HD2 : -0.503: 0
: 1549:A 17 LEU 2HD1 :A 14 GLN HA : -0.406: 0
: 1549:A 11 ALA O :A 15 GLU 2HG : -0.500: 0
: 1549:A 85 ALA HA :A 88 LYS NZ : -0.492: 0
: 1549:A 88 LYS N :A 87 LEU 2HD1 : -0.429: 0
: 1549:A 48 LYS 1HG :A 44 TYR O : -0.476: 0
: 1549:A 68 GLU O :A 72 GLU 1HG : -0.476: 0
: 1549:A 63 TYR O :A 67 ILE 2HG1 : -0.417: 0
: 1549:A 63 TYR OH :A 48 LYS 1HD : -0.411: 0
: 1549:A 60 ILE 1HG1 :A 56 THR O : -0.474: 0
: 1549:A 77 LYS O :A 81 GLU 1HG : -0.446: 0
: 1549:A 16 HIS 2HB :A 21 ASN O : -0.441: 0
#sum2 ::14.85 clashscore : 14.85 clashscore B<40
#summary::1549 atoms:1549 atoms B<40:179396 potential dots:11210.0 A^2:23 bumps:23 bumps B<40:610.5 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1549:A 40 VAL 2HG2 :A 69 VAL 3HG2 : -0.633: 0
: 1549:A 73 GLU 2HG :A 38 ASP 1HB : -0.597: 0
: 1549:A 37 PRO O :A 69 VAL 1HG1 : -0.453: 0
: 1549:A 69 VAL 1HG1 :A 38 ASP HA : -0.426: 0
: 1549:A 8 THR 1HG2 :A 3 PRO HA : -0.576: 0
: 1549:A 22 ALA 1HB :A 49 LEU 1HD1 : -0.576: 0
: 1549:A 89 ALA 1HB :A 56 THR 3HG2 : -0.572: 0
: 1549:A 56 THR O :A 60 ILE 1HG1 : -0.525: 0
: 1549:A 46 LEU 1HB :A 29 PHE 2HB : -0.564: 0
: 1549:A 29 PHE 1HB :A 46 LEU 3HD1 : -0.515: 0
: 1549:A 44 TYR O :A 48 LYS 1HG : -0.501: 0
: 1549:A 44 TYR CE1 :A 81 GLU 2HB : -0.421: 0
: 1549:A 79 LEU 1HD1 :A 67 ILE 3HG2 : -0.490: 0
: 1549:A 67 ILE 2HG1 :A 63 TYR O : -0.451: 0
: 1549:A 47 GLY O :A 51 GLU 2HG : -0.426: 0
: 1549:A 17 LEU 2HD1 :A 14 GLN HA : -0.421: 0
: 1549:A 50 TYR CE1 :A 26 LEU 1HD1 : -0.407: 0
: 1549:A 71 ARG 2HG :A 72 GLU 2HG : -0.403: 0
#sum2 ::11.62 clashscore : 11.62 clashscore B<40
#summary::1549 atoms:1549 atoms B<40:179201 potential dots:11200.0 A^2:18 bumps:18 bumps B<40:643.6 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1549:A 40 VAL 1HG1 :A 78 ASP 2HB : -0.683: 0
: 1549:A 82 LEU 1HD1 :A 40 VAL 3HG1 : -0.544: 0
: 1549:A 73 GLU 2HG :A 38 ASP 2HB : -0.558: 0
: 1549:A 29 PHE 1HB :A 46 LEU 3HD1 : -0.543: 0
: 1549:A 46 LEU 1HB :A 29 PHE 2HB : -0.510: 0
: 1549:A 89 ALA HA :A 92 LEU HG : -0.539: 0
: 1549:A 17 LEU 2HD1 :A 14 GLN HA : -0.536: 0
: 1549:A 22 ALA 1HB :A 49 LEU 1HD1 : -0.523: 0
: 1549:A 49 LEU 2HD2 :A 17 LEU 1HD2 : -0.486: 0
: 1549:A 35 THR 2HG2 :A 31 GLU O : -0.531: 0
: 1549:A 44 TYR HA :A 63 TYR HE1 : -0.528: 0
: 1549:A 60 ILE 1HG1 :A 56 THR O : -0.508: 0
: 1549:A 90 GLU 2HG :A 60 ILE 2HD1 : -0.465: 0
: 1549:A 3 PRO O :A 9 ARG 2HB : -0.490: 0
: 1549:A 69 VAL 1HG1 :A 37 PRO O : -0.489: 0
: 1549:A 79 LEU 1HD1 :A 67 ILE 3HG2 : -0.449: 0
: 1549:A 55 ARG O :A 50 TYR 2HB : -0.436: 0
: 1549:A 71 ARG 2HG :A 72 GLU 2HG : -0.431: 0
: 1549:A 68 GLU HA :A 71 ARG CZ : -0.409: 0
: 1549:A 84 ASP O :A 87 LEU HG : -0.419: 0
#sum2 ::12.91 clashscore : 12.91 clashscore B<40
#summary::1549 atoms:1549 atoms B<40:179112 potential dots:11190.0 A^2:20 bumps:20 bumps B<40:580.7 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1549:A 17 LEU 1HD2 :A 49 LEU 2HD2 : -0.639: 0
: 1549:A 17 LEU 2HD1 :A 14 GLN HA : -0.407: 0
: 1549:A 46 LEU 1HB :A 29 PHE 2HB : -0.586: 0
: 1549:A 29 PHE 1HB :A 46 LEU 3HD1 : -0.551: 0
: 1549:A 40 VAL 2HG2 :A 69 VAL 3HG2 : -0.565: 0
: 1549:A 40 VAL 1HG1 :A 78 ASP 2HB : -0.555: 0
: 1549:A 37 PRO O :A 69 VAL 1HG1 : -0.420: 0
: 1549:A 39 TYR HD1 :A 42 THR HG1 : -0.527: 0
: 1549:A 42 THR 1HG2 :A 32 LEU 1HB : -0.400: 0
: 1549:A 56 THR O :A 60 ILE 1HG1 : -0.494: 0
: 1549:A 90 GLU 2HG :A 60 ILE 2HD1 : -0.418: 0
: 1549:A 73 GLU 2HG :A 38 ASP 1HB : -0.464: 0
: 1549:A 72 GLU 1HG :A 71 ARG 2HG : -0.446: 0
: 1549:A 67 ILE 2HG1 :A 63 TYR O : -0.432: 0
: 1549:A 50 TYR CE1 :A 26 LEU 1HD1 : -0.416: 0
: 1549:A 70 ALA 2HB :A 82 LEU 2HD1 : -0.412: 0
: 1549:A 28 LEU 2HD2 :A 9 ARG 1HB : -0.411: 0
#sum2 ::10.97 clashscore : 10.97 clashscore B<40
#summary::1549 atoms:1549 atoms B<40:179210 potential dots:11200.0 A^2:17 bumps:17 bumps B<40:634.9 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1549:A 28 LEU 2HD2 :A 9 ARG 1HB : -0.574: 0
: 1549:A 46 LEU 1HB :A 29 PHE 2HB : -0.563: 0
: 1549:A 32 LEU 2HD1 :A 29 PHE HA : -0.439: 0
: 1549:A 40 VAL 2HG2 :A 69 VAL 3HG2 : -0.557: 0
: 1549:A 56 THR O :A 60 ILE 1HG1 : -0.538: 0
: 1549:A 89 ALA 1HB :A 56 THR 3HG2 : -0.476: 0
: 1549:A 44 TYR O :A 48 LYS 1HG : -0.511: 0
: 1549:A 44 TYR CE1 :A 81 GLU 2HB : -0.484: 0
: 1549:A 48 LYS 1HD :A 63 TYR OH : -0.442: 0
: 1549:A 83 GLN NE2 :A 79 LEU HG : -0.468: 0
: 1549:A 34 GLU 2HG :A 35 THR 3HG2 : -0.430: 0
: 1549:A 25 ALA 2HB :A 16 HIS 1HB : -0.413: 0
: 1549:A 26 LEU 1HD1 :A 50 TYR CE1 : -0.412: 0
#sum2 ::8.39 clashscore : 8.39 clashscore B<40
#summary::1549 atoms:1549 atoms B<40:179430 potential dots:11210.0 A^2:13 bumps:13 bumps B<40:658.2 score
List of bad contacts calculated by MAGE for model $num_n
/farm/software/bin/probe
: 1549:A 71 ARG 2HG :A 72 GLU 2HG : -0.726: 0
: 1549:A 71 ARG 2HB :A 79 LEU 3HD1 : -0.401: 0
: 1549:A 49 LEU 2HD2 :A 17 LEU 1HD2 : -0.606: 0
: 1549:A 48 LYS O :A 52 ARG 2HG : -0.464: 0
: 1549:A 22 ALA 1HB :A 49 LEU 1HD1 : -0.452: 0
: 1549:A 17 LEU 3HD2 :A 22 ALA HA : -0.449: 0
: 1549:A 17 LEU 2HD2 :A 52 ARG NH1 : -0.439: 0
: 1549:A 48 LYS 1HG :A 44 TYR O : -0.434: 0
: 1549:A 53 LEU HG :A 49 LEU O : -0.420: 0
: 1549:A 42 THR HG1 :A 39 TYR HD1 : -0.556: 0
: 1549:A 32 LEU 2HD1 :A 29 PHE HA : -0.543: 0
: 1549:A 46 LEU 1HB :A 29 PHE 2HB : -0.538: 0
: 1549:A 29 PHE 1HB :A 46 LEU 3HD1 : -0.467: 0
: 1549:A 60 ILE 1HG1 :A 56 THR O : -0.533: 0
: 1549:A 86 LYS 2HE :A 60 ILE 3HG2 : -0.404: 0
: 1549:A 40 VAL 2HG2 :A 69 VAL 3HG2 : -0.530: 0
: 1549:A 40 VAL 1HG1 :A 78 ASP 2HB : -0.463: 0
: 1549:A 69 VAL 1HG1 :A 37 PRO O : -0.458: 0
: 1549:A 4 GLU HA :A 9 ARG NH1 : -0.501: 0
: 1549:A 3 PRO O :A 9 ARG 2HB : -0.416: 0
: 1549:A 47 GLY O :A 51 GLU 2HG : -0.469: 0
: 1549:A 77 LYS O :A 81 GLU 1HG : -0.432: 0
: 1549:A 34 GLU 1HG :A 31 GLU HA : -0.430: 0
: 1549:A 11 ALA O :A 15 GLU 2HG : -0.408: 0
#sum2 ::15.49 clashscore : 15.49 clashscore B<40
#summary::1549 atoms:1549 atoms B<40:179338 potential dots:11210.0 A^2:24 bumps:24 bumps B<40:639 score
Output from PDB validation software
Summary from PDB validation
May. 10, 23:52:00 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.
Chain Atom Res Seq Chain Atom Res Seq Mol_ID Distance
-------------------------------------------------------------------------
A 1HH2 ARG 9 - A 2HG GLU 31 4 Dist = 1.44
A HA ALA 85 - A 3HZ LYS 88 15 Dist = 1.44
A HA PHE 7 - A HH TYR 39 3 Dist = 1.49
A HA ALA 85 - A 3HZ LYS 88 10 Dist = 1.49
A HA ALA 85 - A 2HZ LYS 88 4 Dist = 1.50
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 0.018 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 1.1 degrees.
The following table contains a list of the covalent bond angles
greater than 6.0*RMSD.
Deviation Residue Chain Sequence Model AT1 - AT2 - AT3 Bond Dictionary
Name ID Number Angle Value
--------------------------------------------------------------------------------
6.7 HIS A 97 19 C - N - CA 128.4 121.7
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 GLN 14 1HE2
1 A GLN 14 2HE2
1 A ASN 21 1HD2
1 A ASN 21 2HD2
1 A GLN 65 1HE2
1 A GLN 65 2HE2
1 A GLN 76 1HE2
1 A GLN 76 2HE2
1 A GLN 83 1HE2
1 A GLN 83 2HE2
2 A GLN 14 1HE2
2 A GLN 14 2HE2
2 A ASN 21 1HD2
2 A ASN 21 2HD2
2 A GLN 65 1HE2
2 A GLN 65 2HE2
2 A GLN 76 1HE2
2 A GLN 76 2HE2
2 A GLN 83 1HE2
2 A GLN 83 2HE2
3 A GLN 14 1HE2
3 A GLN 14 2HE2
3 A ASN 21 1HD2
3 A ASN 21 2HD2
3 A GLN 65 1HE2
3 A GLN 65 2HE2
3 A GLN 76 1HE2
3 A GLN 76 2HE2
3 A GLN 83 1HE2
3 A GLN 83 2HE2
4 A GLN 14 1HE2
4 A GLN 14 2HE2
4 A ASN 21 1HD2
4 A ASN 21 2HD2
4 A GLN 65 1HE2
4 A GLN 65 2HE2
4 A GLN 76 1HE2
4 A GLN 76 2HE2
4 A GLN 83 1HE2
4 A GLN 83 2HE2
5 A GLN 14 1HE2
5 A GLN 14 2HE2
5 A ASN 21 1HD2
5 A ASN 21 2HD2
5 A GLN 65 1HE2
5 A GLN 65 2HE2
5 A GLN 76 1HE2
5 A GLN 76 2HE2
5 A GLN 83 1HE2
5 A GLN 83 2HE2
6 A GLN 14 1HE2
6 A GLN 14 2HE2
6 A ASN 21 1HD2
6 A ASN 21 2HD2
6 A GLN 65 1HE2
6 A GLN 65 2HE2
6 A GLN 76 1HE2
6 A GLN 76 2HE2
6 A GLN 83 1HE2
6 A GLN 83 2HE2
7 A GLN 14 1HE2
7 A GLN 14 2HE2
7 A ASN 21 1HD2
7 A ASN 21 2HD2
7 A GLN 65 1HE2
7 A GLN 65 2HE2
7 A GLN 76 1HE2
7 A GLN 76 2HE2
7 A GLN 83 1HE2
7 A GLN 83 2HE2
8 A GLN 14 1HE2
8 A GLN 14 2HE2
8 A ASN 21 1HD2
8 A ASN 21 2HD2
8 A GLN 65 1HE2
8 A GLN 65 2HE2
8 A GLN 76 1HE2
8 A GLN 76 2HE2
8 A GLN 83 1HE2
8 A GLN 83 2HE2
9 A GLN 14 1HE2
9 A GLN 14 2HE2
9 A ASN 21 1HD2
9 A ASN 21 2HD2
9 A GLN 65 1HE2
9 A GLN 65 2HE2
9 A GLN 76 1HE2
9 A GLN 76 2HE2
9 A GLN 83 1HE2
9 A GLN 83 2HE2
10 A GLN 14 1HE2
10 A GLN 14 2HE2
10 A ASN 21 1HD2
10 A ASN 21 2HD2
10 A GLN 65 1HE2
10 A GLN 65 2HE2
10 A GLN 76 1HE2
10 A GLN 76 2HE2
10 A GLN 83 1HE2
10 A GLN 83 2HE2
11 A GLN 14 1HE2
11 A GLN 14 2HE2
11 A ASN 21 1HD2
11 A ASN 21 2HD2
11 A GLN 65 1HE2
11 A GLN 65 2HE2
11 A GLN 76 1HE2
11 A GLN 76 2HE2
11 A GLN 83 1HE2
11 A GLN 83 2HE2
12 A GLN 14 1HE2
12 A GLN 14 2HE2
12 A ASN 21 1HD2
12 A ASN 21 2HD2
12 A GLN 65 1HE2
12 A GLN 65 2HE2
12 A GLN 76 1HE2
12 A GLN 76 2HE2
12 A GLN 83 1HE2
12 A GLN 83 2HE2
13 A GLN 14 1HE2
13 A GLN 14 2HE2
13 A ASN 21 1HD2
13 A ASN 21 2HD2
13 A GLN 65 1HE2
13 A GLN 65 2HE2
13 A GLN 76 1HE2
13 A GLN 76 2HE2
13 A GLN 83 1HE2
13 A GLN 83 2HE2
14 A GLN 14 1HE2
14 A GLN 14 2HE2
14 A ASN 21 1HD2
14 A ASN 21 2HD2
14 A GLN 65 1HE2
14 A GLN 65 2HE2
14 A GLN 76 1HE2
14 A GLN 76 2HE2
14 A GLN 83 1HE2
14 A GLN 83 2HE2
15 A GLN 14 1HE2
15 A GLN 14 2HE2
15 A ASN 21 1HD2
15 A ASN 21 2HD2
15 A GLN 65 1HE2
15 A GLN 65 2HE2
15 A GLN 76 1HE2
15 A GLN 76 2HE2
15 A GLN 83 1HE2
15 A GLN 83 2HE2
16 A GLN 14 1HE2
16 A GLN 14 2HE2
16 A ASN 21 1HD2
16 A ASN 21 2HD2
16 A GLN 65 1HE2
16 A GLN 65 2HE2
16 A GLN 76 1HE2
16 A GLN 76 2HE2
16 A GLN 83 1HE2
16 A GLN 83 2HE2
17 A GLN 14 1HE2
17 A GLN 14 2HE2
17 A ASN 21 1HD2
17 A ASN 21 2HD2
17 A GLN 65 1HE2
17 A GLN 65 2HE2
17 A GLN 76 1HE2
17 A GLN 76 2HE2
17 A GLN 83 1HE2
17 A GLN 83 2HE2
18 A GLN 14 1HE2
18 A GLN 14 2HE2
18 A ASN 21 1HD2
18 A ASN 21 2HD2
18 A GLN 65 1HE2
18 A GLN 65 2HE2
18 A GLN 76 1HE2
18 A GLN 76 2HE2
18 A GLN 83 1HE2
18 A GLN 83 2HE2
19 A GLN 14 1HE2
19 A GLN 14 2HE2
19 A ASN 21 1HD2
19 A ASN 21 2HD2
19 A GLN 65 1HE2
19 A GLN 65 2HE2
19 A GLN 76 1HE2
19 A GLN 76 2HE2
19 A GLN 83 1HE2
19 A GLN 83 2HE2
20 A GLN 14 1HE2
20 A GLN 14 2HE2
20 A ASN 21 1HD2
20 A ASN 21 2HD2
20 A GLN 65 1HE2
20 A GLN 65 2HE2
20 A GLN 76 1HE2
20 A GLN 76 2HE2
20 A GLN 83 1HE2
20 A GLN 83 2HE2
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
GLU( 1 A-197 )
ASP( 1 A-196 )
PRO( 1 A-195 )
GLU( 1 A-194 )
ASP( 1 A-193 )
PRO( 1 A-192 )
PHE( 1 A-191 )
THR( 1 A-190 )
ARG( 1 A-189 )
TYR( 1 A-188 )
ALA( 1 A-187 )
LEU( 1 A-186 )
ALA( 1 A-185 )
GLN( 1 A-184 )
GLU( 1 A-183 )
HIS( 1 A-182 )
LEU( 1 A-181 )
LYS( 1 A-180 )
HIS( 1 A-179 )
ASP( 1 A-178 )
ASN( 1 A-177 )
ALA( 1 A-176 )
SER( 1 A-175 )
ARG( 1 A-174 )
ALA( 1 A-173 )
LEU( 1 A-172 )
ALA( 1 A-171 )
LEU( 1 A-170 )
PHE( 1 A-169 )
GLU( 1 A-168 )
GLU( 1 A-167 )
LEU( 1 A-166 )
VAL( 1 A-165 )
GLU( 1 A-164 )
THR( 1 A-163 )
ASP( 1 A-162 )
PRO( 1 A-161 )
ASP( 1 A-160 )
TYR( 1 A-159 )
VAL( 1 A-158 )
GLY( 1 A-157 )
THR( 1 A-156 )
TYR( 1 A-155 )
TYR( 1 A-154 )
HIS( 1 A-153 )
LEU( 1 A-152 )
GLY( 1 A-151 )
LYS( 1 A-150 )
LEU( 1 A-149 )
TYR( 1 A-148 )
GLU( 1 A-147 )
ARG( 1 A-146 )
LEU( 1 A-145 )
ASP( 1 A-144 )
ARG( 1 A-143 )
THR( 1 A-142 )
ASP( 1 A-141 )
ASP( 1 A-140 )
ALA( 1 A-139 )
ILE( 1 A-138 )
ASP( 1 A-137 )
THR( 1 A-136 )
TYR( 1 A-135 )
ALA( 1 A-134 )
GLN( 1 A-133 )
GLY( 1 A-132 )
ILE( 1 A-131 )
GLU( 1 A-130 )
VAL( 1 A-129 )
ALA( 1 A-128 )
ARG( 1 A-127 )
GLU( 1 A-126 )
GLU( 1 A-125 )
GLY( 1 A-124 )
THR( 1 A-123 )
GLN( 1 A-122 )
LYS( 1 A-121 )
ASP( 1 A-120 )
LEU( 1 A-119 )
SER( 1 A-118 )
GLU( 1 A-117 )
LEU( 1 A-116 )
GLN( 1 A-115 )
ASP( 1 A-114 )
ALA( 1 A-113 )
LYS( 1 A-112 )
LEU( 1 A-111 )
LYS( 1 A-110 )
ALA( 1 A-109 )
GLU( 1 A-108 )
GLY( 1 A-107 )
LEU( 1 A-106 )
GLU( 1 A-105 )
HIS( 1 A-104 )
HIS( 1 A-103 )
HIS( 1 A-102 )
HIS( 1 A-101 )
HIS( 1 A-100 )
HIS( 1 A -99 )
GLU( 1 A -98 )
ASP( 1 A -97 )
PRO( 1 A -96 )
GLU( 1 A -95 )
ASP( 1 A -94 )
PRO( 1 A -93 )
PHE( 1 A -92 )
THR( 1 A -91 )
ARG( 1 A -90 )
TYR( 1 A -89 )
ALA( 1 A -88 )
LEU( 1 A -87 )
ALA( 1 A -86 )
GLN( 1 A -85 )
GLU( 1 A -84 )
HIS( 1 A -83 )
LEU( 1 A -82 )
LYS( 1 A -81 )
HIS( 1 A -80 )
ASP( 1 A -79 )
ASN( 1 A -78 )
ALA( 1 A -77 )
SER( 1 A -76 )
ARG( 1 A -75 )
ALA( 1 A -74 )
LEU( 1 A -73 )
ALA( 1 A -72 )
LEU( 1 A -71 )
PHE( 1 A -70 )
GLU( 1 A -69 )
GLU( 1 A -68 )
LEU( 1 A -67 )
VAL( 1 A -66 )
GLU( 1 A -65 )
THR( 1 A -64 )
ASP( 1 A -63 )
PRO( 1 A -62 )
ASP( 1 A -61 )
TYR( 1 A -60 )
VAL( 1 A -59 )
GLY( 1 A -58 )
THR( 1 A -57 )
TYR( 1 A -56 )
TYR( 1 A -55 )
HIS( 1 A -54 )
LEU( 1 A -53 )
GLY( 1 A -52 )
LYS( 1 A -51 )
LEU( 1 A -50 )
TYR( 1 A -49 )
GLU( 1 A -48 )
ARG( 1 A -47 )
LEU( 1 A -46 )
ASP( 1 A -45 )
ARG( 1 A -44 )
THR( 1 A -43 )
ASP( 1 A -42 )
ASP( 1 A -41 )
ALA( 1 A -40 )
ILE( 1 A -39 )
ASP( 1 A -38 )
THR( 1 A -37 )
TYR( 1 A -36 )
ALA( 1 A -35 )
GLN( 1 A -34 )
GLY( 1 A -33 )
ILE( 1 A -32 )
GLU( 1 A -31 )
VAL( 1 A -30 )
ALA( 1 A -29 )
ARG( 1 A -28 )
GLU( 1 A -27 )
GLU( 1 A -26 )
GLY( 1 A -25 )
THR( 1 A -24 )
GLN( 1 A -23 )
LYS( 1 A -22 )
ASP( 1 A -21 )
LEU( 1 A -20 )
SER( 1 A -19 )
GLU( 1 A -18 )
LEU( 1 A -17 )
GLN( 1 A -16 )
ASP( 1 A -15 )
ALA( 1 A -14 )
LYS( 1 A -13 )
LEU( 1 A -12 )
LYS( 1 A -11 )
ALA( 1 A -10 )
GLU( 1 A -9 )
GLY( 1 A -8 )
LEU( 1 A -7 )
GLU( 1 A -6 )
HIS( 1 A -5 )
HIS( 1 A -4 )
HIS( 1 A -3 )
HIS( 1 A -2 )
HIS( 1 A -1 )
HIS( 1 A 0 )
GLU( 2 A-197 )
ASP( 2 A-196 )
PRO( 2 A-195 )
GLU( 2 A-194 )
ASP( 2 A-193 )
PRO( 2 A-192 )
PHE( 2 A-191 )
THR( 2 A-190 )
ARG( 2 A-189 )
TYR( 2 A-188 )
ALA( 2 A-187 )
LEU( 2 A-186 )
ALA( 2 A-185 )
GLN( 2 A-184 )
GLU( 2 A-183 )
HIS( 2 A-182 )
LEU( 2 A-181 )
LYS( 2 A-180 )
HIS( 2 A-179 )
ASP( 2 A-178 )
ASN( 2 A-177 )
ALA( 2 A-176 )
SER( 2 A-175 )
ARG( 2 A-174 )
ALA( 2 A-173 )
LEU( 2 A-172 )
ALA( 2 A-171 )
LEU( 2 A-170 )
PHE( 2 A-169 )
GLU( 2 A-168 )
GLU( 2 A-167 )
LEU( 2 A-166 )
VAL( 2 A-165 )
GLU( 2 A-164 )
THR( 2 A-163 )
ASP( 2 A-162 )
PRO( 2 A-161 )
ASP( 2 A-160 )
TYR( 2 A-159 )
VAL( 2 A-158 )
GLY( 2 A-157 )
THR( 2 A-156 )
TYR( 2 A-155 )
TYR( 2 A-154 )
HIS( 2 A-153 )
LEU( 2 A-152 )
GLY( 2 A-151 )
LYS( 2 A-150 )
LEU( 2 A-149 )
TYR( 2 A-148 )
GLU( 2 A-147 )
ARG( 2 A-146 )
LEU( 2 A-145 )
ASP( 2 A-144 )
ARG( 2 A-143 )
THR( 2 A-142 )
ASP( 2 A-141 )
ASP( 2 A-140 )
ALA( 2 A-139 )
ILE( 2 A-138 )
ASP( 2 A-137 )
THR( 2 A-136 )
TYR( 2 A-135 )
ALA( 2 A-134 )
GLN( 2 A-133 )
GLY( 2 A-132 )
ILE( 2 A-131 )
GLU( 2 A-130 )
VAL( 2 A-129 )
ALA( 2 A-128 )
ARG( 2 A-127 )
GLU( 2 A-126 )
GLU( 2 A-125 )
GLY( 2 A-124 )
THR( 2 A-123 )
GLN( 2 A-122 )
LYS( 2 A-121 )
ASP( 2 A-120 )
LEU( 2 A-119 )
SER( 2 A-118 )
GLU( 2 A-117 )
LEU( 2 A-116 )
GLN( 2 A-115 )
ASP( 2 A-114 )
ALA( 2 A-113 )
LYS( 2 A-112 )
LEU( 2 A-111 )
LYS( 2 A-110 )
ALA( 2 A-109 )
GLU( 2 A-108 )
GLY( 2 A-107 )
LEU( 2 A-106 )
GLU( 2 A-105 )
HIS( 2 A-104 )
HIS( 2 A-103 )
HIS( 2 A-102 )
HIS( 2 A-101 )
HIS( 2 A-100 )
HIS( 2 A -99 )
GLU( 2 A -98 )
ASP( 2 A -97 )
PRO( 2 A -96 )
GLU( 2 A -95 )
ASP( 2 A -94 )
PRO( 2 A -93 )
PHE( 2 A -92 )
THR( 2 A -91 )
ARG( 2 A -90 )
TYR( 2 A -89 )
ALA( 2 A -88 )
LEU( 2 A -87 )
ALA( 2 A -86 )
GLN( 2 A -85 )
GLU( 2 A -84 )
HIS( 2 A -83 )
LEU( 2 A -82 )
LYS( 2 A -81 )
HIS( 2 A -80 )
ASP( 2 A -79 )
ASN( 2 A -78 )
ALA( 2 A -77 )
SER( 2 A -76 )
ARG( 2 A -75 )
ALA( 2 A -74 )
LEU( 2 A -73 )
ALA( 2 A -72 )
LEU( 2 A -71 )
PHE( 2 A -70 )
GLU( 2 A -69 )
GLU( 2 A -68 )
LEU( 2 A -67 )
VAL( 2 A -66 )
GLU( 2 A -65 )
THR( 2 A -64 )
ASP( 2 A -63 )
PRO( 2 A -62 )
ASP( 2 A -61 )
TYR( 2 A -60 )
VAL( 2 A -59 )
GLY( 2 A -58 )
THR( 2 A -57 )
TYR( 2 A -56 )
TYR( 2 A -55 )
HIS( 2 A -54 )
LEU( 2 A -53 )
GLY( 2 A -52 )
LYS( 2 A -51 )
LEU( 2 A -50 )
TYR( 2 A -49 )
GLU( 2 A -48 )
ARG( 2 A -47 )
LEU( 2 A -46 )
ASP( 2 A -45 )
ARG( 2 A -44 )
THR( 2 A -43 )
ASP( 2 A -42 )
ASP( 2 A -41 )
ALA( 2 A -40 )
ILE( 2 A -39 )
ASP( 2 A -38 )
THR( 2 A -37 )
TYR( 2 A -36 )
ALA( 2 A -35 )
GLN( 2 A -34 )
GLY( 2 A -33 )
ILE( 2 A -32 )
GLU( 2 A -31 )
VAL( 2 A -30 )
ALA( 2 A -29 )
ARG( 2 A -28 )
GLU( 2 A -27 )
GLU( 2 A -26 )
GLY( 2 A -25 )
THR( 2 A -24 )
GLN( 2 A -23 )
LYS( 2 A -22 )
ASP( 2 A -21 )
LEU( 2 A -20 )
SER( 2 A -19 )
GLU( 2 A -18 )
LEU( 2 A -17 )
GLN( 2 A -16 )
ASP( 2 A -15 )
ALA( 2 A -14 )
LYS( 2 A -13 )
LEU( 2 A -12 )
LYS( 2 A -11 )
ALA( 2 A -10 )
GLU( 2 A -9 )
GLY( 2 A -8 )
LEU( 2 A -7 )
GLU( 2 A -6 )
HIS( 2 A -5 )
HIS( 2 A -4 )
HIS( 2 A -3 )
HIS( 2 A -2 )
HIS( 2 A -1 )
HIS( 2 A 0 )
GLU( 3 A-197 )
ASP( 3 A-196 )
PRO( 3 A-195 )
GLU( 3 A-194 )
ASP( 3 A-193 )
PRO( 3 A-192 )
PHE( 3 A-191 )
THR( 3 A-190 )
ARG( 3 A-189 )
TYR( 3 A-188 )
ALA( 3 A-187 )
LEU( 3 A-186 )
ALA( 3 A-185 )
GLN( 3 A-184 )
GLU( 3 A-183 )
HIS( 3 A-182 )
LEU( 3 A-181 )
LYS( 3 A-180 )
HIS( 3 A-179 )
ASP( 3 A-178 )
ASN( 3 A-177 )
ALA( 3 A-176 )
SER( 3 A-175 )
ARG( 3 A-174 )
ALA( 3 A-173 )
LEU( 3 A-172 )
ALA( 3 A-171 )
LEU( 3 A-170 )
PHE( 3 A-169 )
GLU( 3 A-168 )
GLU( 3 A-167 )
LEU( 3 A-166 )
VAL( 3 A-165 )
GLU( 3 A-164 )
THR( 3 A-163 )
ASP( 3 A-162 )
PRO( 3 A-161 )
ASP( 3 A-160 )
TYR( 3 A-159 )
VAL( 3 A-158 )
GLY( 3 A-157 )
THR( 3 A-156 )
TYR( 3 A-155 )
TYR( 3 A-154 )
HIS( 3 A-153 )
LEU( 3 A-152 )
GLY( 3 A-151 )
LYS( 3 A-150 )
LEU( 3 A-149 )
TYR( 3 A-148 )
GLU( 3 A-147 )
ARG( 3 A-146 )
LEU( 3 A-145 )
ASP( 3 A-144 )
ARG( 3 A-143 )
THR( 3 A-142 )
ASP( 3 A-141 )
ASP( 3 A-140 )
ALA( 3 A-139 )
ILE( 3 A-138 )
ASP( 3 A-137 )
THR( 3 A-136 )
TYR( 3 A-135 )
ALA( 3 A-134 )
GLN( 3 A-133 )
GLY( 3 A-132 )
ILE( 3 A-131 )
GLU( 3 A-130 )
VAL( 3 A-129 )
ALA( 3 A-128 )
ARG( 3 A-127 )
GLU( 3 A-126 )
GLU( 3 A-125 )
GLY( 3 A-124 )
THR( 3 A-123 )
GLN( 3 A-122 )
LYS( 3 A-121 )
ASP( 3 A-120 )
LEU( 3 A-119 )
SER( 3 A-118 )
GLU( 3 A-117 )
LEU( 3 A-116 )
GLN( 3 A-115 )
ASP( 3 A-114 )
ALA( 3 A-113 )
LYS( 3 A-112 )
LEU( 3 A-111 )
LYS( 3 A-110 )
ALA( 3 A-109 )
GLU( 3 A-108 )
GLY( 3 A-107 )
LEU( 3 A-106 )
GLU( 3 A-105 )
HIS( 3 A-104 )
HIS( 3 A-103 )
HIS( 3 A-102 )
HIS( 3 A-101 )
HIS( 3 A-100 )
HIS( 3 A -99 )
GLU( 3 A -98 )
ASP( 3 A -97 )
PRO( 3 A -96 )
GLU( 3 A -95 )
ASP( 3 A -94 )
PRO( 3 A -93 )
PHE( 3 A -92 )
THR( 3 A -91 )
ARG( 3 A -90 )
TYR( 3 A -89 )
ALA( 3 A -88 )
LEU( 3 A -87 )
ALA( 3 A -86 )
GLN( 3 A -85 )
GLU( 3 A -84 )
HIS( 3 A -83 )
LEU( 3 A -82 )
LYS( 3 A -81 )
HIS( 3 A -80 )
ASP( 3 A -79 )
ASN( 3 A -78 )
ALA( 3 A -77 )
SER( 3 A -76 )
ARG( 3 A -75 )
ALA( 3 A -74 )
LEU( 3 A -73 )
ALA( 3 A -72 )
LEU( 3 A -71 )
PHE( 3 A -70 )
GLU( 3 A -69 )
GLU( 3 A -68 )
LEU( 3 A -67 )
VAL( 3 A -66 )
GLU( 3 A -65 )
THR( 3 A -64 )
ASP( 3 A -63 )
PRO( 3 A -62 )
ASP( 3 A -61 )
TYR( 3 A -60 )
VAL( 3 A -59 )
GLY( 3 A -58 )
THR( 3 A -57 )
TYR( 3 A -56 )
TYR( 3 A -55 )
HIS( 3 A -54 )
LEU( 3 A -53 )
GLY( 3 A -52 )
LYS( 3 A -51 )
LEU( 3 A -50 )
TYR( 3 A -49 )
GLU( 3 A -48 )
ARG( 3 A -47 )
LEU( 3 A -46 )
ASP( 3 A -45 )
ARG( 3 A -44 )
THR( 3 A -43 )
ASP( 3 A -42 )
ASP( 3 A -41 )
ALA( 3 A -40 )
ILE( 3 A -39 )
ASP( 3 A -38 )
THR( 3 A -37 )
TYR( 3 A -36 )
ALA( 3 A -35 )
GLN( 3 A -34 )
GLY( 3 A -33 )
ILE( 3 A -32 )
GLU( 3 A -31 )
VAL( 3 A -30 )
ALA( 3 A -29 )
ARG( 3 A -28 )
GLU( 3 A -27 )
GLU( 3 A -26 )
GLY( 3 A -25 )
THR( 3 A -24 )
GLN( 3 A -23 )
LYS( 3 A -22 )
ASP( 3 A -21 )
LEU( 3 A -20 )
SER( 3 A -19 )
GLU( 3 A -18 )
LEU( 3 A -17 )
GLN( 3 A -16 )
ASP( 3 A -15 )
ALA( 3 A -14 )
LYS( 3 A -13 )
LEU( 3 A -12 )
LYS( 3 A -11 )
ALA( 3 A -10 )
GLU( 3 A -9 )
GLY( 3 A -8 )
LEU( 3 A -7 )
GLU( 3 A -6 )
HIS( 3 A -5 )
HIS( 3 A -4 )
HIS( 3 A -3 )
HIS( 3 A -2 )
HIS( 3 A -1 )
HIS( 3 A 0 )
GLU( 4 A-197 )
ASP( 4 A-196 )
PRO( 4 A-195 )
GLU( 4 A-194 )
ASP( 4 A-193 )
PRO( 4 A-192 )
PHE( 4 A-191 )
THR( 4 A-190 )
ARG( 4 A-189 )
TYR( 4 A-188 )
ALA( 4 A-187 )
LEU( 4 A-186 )
ALA( 4 A-185 )
GLN( 4 A-184 )
GLU( 4 A-183 )
HIS( 4 A-182 )
LEU( 4 A-181 )
LYS( 4 A-180 )
HIS( 4 A-179 )
ASP( 4 A-178 )
ASN( 4 A-177 )
ALA( 4 A-176 )
SER( 4 A-175 )
ARG( 4 A-174 )
ALA( 4 A-173 )
LEU( 4 A-172 )
ALA( 4 A-171 )
LEU( 4 A-170 )
PHE( 4 A-169 )
GLU( 4 A-168 )
GLU( 4 A-167 )
LEU( 4 A-166 )
VAL( 4 A-165 )
GLU( 4 A-164 )
THR( 4 A-163 )
ASP( 4 A-162 )
PRO( 4 A-161 )
ASP( 4 A-160 )
TYR( 4 A-159 )
VAL( 4 A-158 )
GLY( 4 A-157 )
THR( 4 A-156 )
TYR( 4 A-155 )
TYR( 4 A-154 )
HIS( 4 A-153 )
LEU( 4 A-152 )
GLY( 4 A-151 )
LYS( 4 A-150 )
LEU( 4 A-149 )
TYR( 4 A-148 )
GLU( 4 A-147 )
ARG( 4 A-146 )
LEU( 4 A-145 )
ASP( 4 A-144 )
ARG( 4 A-143 )
THR( 4 A-142 )
ASP( 4 A-141 )
ASP( 4 A-140 )
ALA( 4 A-139 )
ILE( 4 A-138 )
ASP( 4 A-137 )
THR( 4 A-136 )
TYR( 4 A-135 )
ALA( 4 A-134 )
GLN( 4 A-133 )
GLY( 4 A-132 )
ILE( 4 A-131 )
GLU( 4 A-130 )
VAL( 4 A-129 )
ALA( 4 A-128 )
ARG( 4 A-127 )
GLU( 4 A-126 )
GLU( 4 A-125 )
GLY( 4 A-124 )
THR( 4 A-123 )
GLN( 4 A-122 )
LYS( 4 A-121 )
ASP( 4 A-120 )
LEU( 4 A-119 )
SER( 4 A-118 )
GLU( 4 A-117 )
LEU( 4 A-116 )
GLN( 4 A-115 )
ASP( 4 A-114 )
ALA( 4 A-113 )
LYS( 4 A-112 )
LEU( 4 A-111 )
LYS( 4 A-110 )
ALA( 4 A-109 )
GLU( 4 A-108 )
GLY( 4 A-107 )
LEU( 4 A-106 )
GLU( 4 A-105 )
HIS( 4 A-104 )
HIS( 4 A-103 )
HIS( 4 A-102 )
HIS( 4 A-101 )
HIS( 4 A-100 )
HIS( 4 A -99 )
GLU( 4 A -98 )
ASP( 4 A -97 )
PRO( 4 A -96 )
GLU( 4 A -95 )
ASP( 4 A -94 )
PRO( 4 A -93 )
PHE( 4 A -92 )
THR( 4 A -91 )
ARG( 4 A -90 )
TYR( 4 A -89 )
ALA( 4 A -88 )
LEU( 4 A -87 )
ALA( 4 A -86 )
GLN( 4 A -85 )
GLU( 4 A -84 )
HIS( 4 A -83 )
LEU( 4 A -82 )
LYS( 4 A -81 )
HIS( 4 A -80 )
ASP( 4 A -79 )
ASN( 4 A -78 )
ALA( 4 A -77 )
SER( 4 A -76 )
ARG( 4 A -75 )
ALA( 4 A -74 )
LEU( 4 A -73 )
ALA( 4 A -72 )
LEU( 4 A -71 )
PHE( 4 A -70 )
GLU( 4 A -69 )
GLU( 4 A -68 )
LEU( 4 A -67 )
VAL( 4 A -66 )
GLU( 4 A -65 )
THR( 4 A -64 )
ASP( 4 A -63 )
PRO( 4 A -62 )
ASP( 4 A -61 )
TYR( 4 A -60 )
VAL( 4 A -59 )
GLY( 4 A -58 )
THR( 4 A -57 )
TYR( 4 A -56 )
TYR( 4 A -55 )
HIS( 4 A -54 )
LEU( 4 A -53 )
GLY( 4 A -52 )
LYS( 4 A -51 )
LEU( 4 A -50 )
TYR( 4 A -49 )
GLU( 4 A -48 )
ARG( 4 A -47 )
LEU( 4 A -46 )
ASP( 4 A -45 )
ARG( 4 A -44 )
THR( 4 A -43 )
ASP( 4 A -42 )
ASP( 4 A -41 )
ALA( 4 A -40 )
ILE( 4 A -39 )
ASP( 4 A -38 )
THR( 4 A -37 )
TYR( 4 A -36 )
ALA( 4 A -35 )
GLN( 4 A -34 )
GLY( 4 A -33 )
ILE( 4 A -32 )
GLU( 4 A -31 )
VAL( 4 A -30 )
ALA( 4 A -29 )
ARG( 4 A -28 )
GLU( 4 A -27 )
GLU( 4 A -26 )
GLY( 4 A -25 )
THR( 4 A -24 )
GLN( 4 A -23 )
LYS( 4 A -22 )
ASP( 4 A -21 )
LEU( 4 A -20 )
SER( 4 A -19 )
GLU( 4 A -18 )
LEU( 4 A -17 )
GLN( 4 A -16 )
ASP( 4 A -15 )
ALA( 4 A -14 )
LYS( 4 A -13 )
LEU( 4 A -12 )
LYS( 4 A -11 )
ALA( 4 A -10 )
GLU( 4 A -9 )
GLY( 4 A -8 )
LEU( 4 A -7 )
GLU( 4 A -6 )
HIS( 4 A -5 )
HIS( 4 A -4 )
HIS( 4 A -3 )
HIS( 4 A -2 )
HIS( 4 A -1 )
HIS( 4 A 0 )
GLU( 5 A-197 )
ASP( 5 A-196 )
PRO( 5 A-195 )
GLU( 5 A-194 )
ASP( 5 A-193 )
PRO( 5 A-192 )
PHE( 5 A-191 )
THR( 5 A-190 )
ARG( 5 A-189 )
TYR( 5 A-188 )
ALA( 5 A-187 )
LEU( 5 A-186 )
ALA( 5 A-185 )
GLN( 5 A-184 )
GLU( 5 A-183 )
HIS( 5 A-182 )
LEU( 5 A-181 )
LYS( 5 A-180 )
HIS( 5 A-179 )
ASP( 5 A-178 )
ASN( 5 A-177 )
ALA( 5 A-176 )
SER( 5 A-175 )
ARG( 5 A-174 )
ALA( 5 A-173 )
LEU( 5 A-172 )
ALA( 5 A-171 )
LEU( 5 A-170 )
PHE( 5 A-169 )
GLU( 5 A-168 )
GLU( 5 A-167 )
LEU( 5 A-166 )
VAL( 5 A-165 )
GLU( 5 A-164 )
THR( 5 A-163 )
ASP( 5 A-162 )
PRO( 5 A-161 )
ASP( 5 A-160 )
TYR( 5 A-159 )
VAL( 5 A-158 )
GLY( 5 A-157 )
THR( 5 A-156 )
TYR( 5 A-155 )
TYR( 5 A-154 )
HIS( 5 A-153 )
LEU( 5 A-152 )
GLY( 5 A-151 )
LYS( 5 A-150 )
LEU( 5 A-149 )
TYR( 5 A-148 )
GLU( 5 A-147 )
ARG( 5 A-146 )
LEU( 5 A-145 )
ASP( 5 A-144 )
ARG( 5 A-143 )
THR( 5 A-142 )
ASP( 5 A-141 )
ASP( 5 A-140 )
ALA( 5 A-139 )
ILE( 5 A-138 )
ASP( 5 A-137 )
THR( 5 A-136 )
TYR( 5 A-135 )
ALA( 5 A-134 )
GLN( 5 A-133 )
GLY( 5 A-132 )
ILE( 5 A-131 )
GLU( 5 A-130 )
VAL( 5 A-129 )
ALA( 5 A-128 )
ARG( 5 A-127 )
GLU( 5 A-126 )
GLU( 5 A-125 )
GLY( 5 A-124 )
THR( 5 A-123 )
GLN( 5 A-122 )
LYS( 5 A-121 )
ASP( 5 A-120 )
LEU( 5 A-119 )
SER( 5 A-118 )
GLU( 5 A-117 )
LEU( 5 A-116 )
GLN( 5 A-115 )
ASP( 5 A-114 )
ALA( 5 A-113 )
LYS( 5 A-112 )
LEU( 5 A-111 )
LYS( 5 A-110 )
ALA( 5 A-109 )
GLU( 5 A-108 )
GLY( 5 A-107 )
LEU( 5 A-106 )
GLU( 5 A-105 )
HIS( 5 A-104 )
HIS( 5 A-103 )
HIS( 5 A-102 )
HIS( 5 A-101 )
HIS( 5 A-100 )
HIS( 5 A -99 )
GLU( 5 A -98 )
ASP( 5 A -97 )
PRO( 5 A -96 )
GLU( 5 A -95 )
ASP( 5 A -94 )
PRO( 5 A -93 )
PHE( 5 A -92 )
THR( 5 A -91 )
ARG( 5 A -90 )
TYR( 5 A -89 )
ALA( 5 A -88 )
LEU( 5 A -87 )
ALA( 5 A -86 )
GLN( 5 A -85 )
GLU( 5 A -84 )
HIS( 5 A -83 )
LEU( 5 A -82 )
LYS( 5 A -81 )
HIS( 5 A -80 )
ASP( 5 A -79 )
ASN( 5 A -78 )
ALA( 5 A -77 )
SER( 5 A -76 )
ARG( 5 A -75 )
ALA( 5 A -74 )
LEU( 5 A -73 )
ALA( 5 A -72 )
LEU( 5 A -71 )
PHE( 5 A -70 )
GLU( 5 A -69 )
GLU( 5 A -68 )
LEU( 5 A -67 )
VAL( 5 A -66 )
GLU( 5 A -65 )
THR( 5 A -64 )
ASP( 5 A -63 )
PRO( 5 A -62 )
ASP( 5 A -61 )
TYR( 5 A -60 )
VAL( 5 A -59 )
GLY( 5 A -58 )
THR( 5 A -57 )
TYR( 5 A -56 )
TYR( 5 A -55 )
HIS( 5 A -54 )
LEU( 5 A -53 )
GLY( 5 A -52 )
LYS( 5 A -51 )
LEU( 5 A -50 )
TYR( 5 A -49 )
GLU( 5 A -48 )
ARG( 5 A -47 )
LEU( 5 A -46 )
ASP( 5 A -45 )
ARG( 5 A -44 )
THR( 5 A -43 )
ASP( 5 A -42 )
ASP( 5 A -41 )
ALA( 5 A -40 )
ILE( 5 A -39 )
ASP( 5 A -38 )
THR( 5 A -37 )
TYR( 5 A -36 )
ALA( 5 A -35 )
GLN( 5 A -34 )
GLY( 5 A -33 )
ILE( 5 A -32 )
GLU( 5 A -31 )
VAL( 5 A -30 )
ALA( 5 A -29 )
ARG( 5 A -28 )
GLU( 5 A -27 )
GLU( 5 A -26 )
GLY( 5 A -25 )
THR( 5 A -24 )
GLN( 5 A -23 )
LYS( 5 A -22 )
ASP( 5 A -21 )
LEU( 5 A -20 )
SER( 5 A -19 )
GLU( 5 A -18 )
LEU( 5 A -17 )
GLN( 5 A -16 )
ASP( 5 A -15 )
ALA( 5 A -14 )
LYS( 5 A -13 )
LEU( 5 A -12 )
LYS( 5 A -11 )
ALA( 5 A -10 )
GLU( 5 A -9 )
GLY( 5 A -8 )
LEU( 5 A -7 )
GLU( 5 A -6 )
HIS( 5 A -5 )
HIS( 5 A -4 )
HIS( 5 A -3 )
HIS( 5 A -2 )
HIS( 5 A -1 )
HIS( 5 A 0 )
GLU( 6 A-197 )
ASP( 6 A-196 )
PRO( 6 A-195 )
GLU( 6 A-194 )
ASP( 6 A-193 )
PRO( 6 A-192 )
PHE( 6 A-191 )
THR( 6 A-190 )
ARG( 6 A-189 )
TYR( 6 A-188 )
ALA( 6 A-187 )
LEU( 6 A-186 )
ALA( 6 A-185 )
GLN( 6 A-184 )
GLU( 6 A-183 )
HIS( 6 A-182 )
LEU( 6 A-181 )
LYS( 6 A-180 )
HIS( 6 A-179 )
ASP( 6 A-178 )
ASN( 6 A-177 )
ALA( 6 A-176 )
SER( 6 A-175 )
ARG( 6 A-174 )
ALA( 6 A-173 )
LEU( 6 A-172 )
ALA( 6 A-171 )
LEU( 6 A-170 )
PHE( 6 A-169 )
GLU( 6 A-168 )
GLU( 6 A-167 )
LEU( 6 A-166 )
VAL( 6 A-165 )
GLU( 6 A-164 )
THR( 6 A-163 )
ASP( 6 A-162 )
PRO( 6 A-161 )
ASP( 6 A-160 )
TYR( 6 A-159 )
VAL( 6 A-158 )
GLY( 6 A-157 )
THR( 6 A-156 )
TYR( 6 A-155 )
TYR( 6 A-154 )
HIS( 6 A-153 )
LEU( 6 A-152 )
GLY( 6 A-151 )
LYS( 6 A-150 )
LEU( 6 A-149 )
TYR( 6 A-148 )
GLU( 6 A-147 )
ARG( 6 A-146 )
LEU( 6 A-145 )
ASP( 6 A-144 )
ARG( 6 A-143 )
THR( 6 A-142 )
ASP( 6 A-141 )
ASP( 6 A-140 )
ALA( 6 A-139 )
ILE( 6 A-138 )
ASP( 6 A-137 )
THR( 6 A-136 )
TYR( 6 A-135 )
ALA( 6 A-134 )
GLN( 6 A-133 )
GLY( 6 A-132 )
ILE( 6 A-131 )
GLU( 6 A-130 )
VAL( 6 A-129 )
ALA( 6 A-128 )
ARG( 6 A-127 )
GLU( 6 A-126 )
GLU( 6 A-125 )
GLY( 6 A-124 )
THR( 6 A-123 )
GLN( 6 A-122 )
LYS( 6 A-121 )
ASP( 6 A-120 )
LEU( 6 A-119 )
SER( 6 A-118 )
GLU( 6 A-117 )
LEU( 6 A-116 )
GLN( 6 A-115 )
ASP( 6 A-114 )
ALA( 6 A-113 )
LYS( 6 A-112 )
LEU( 6 A-111 )
LYS( 6 A-110 )
ALA( 6 A-109 )
GLU( 6 A-108 )
GLY( 6 A-107 )
LEU( 6 A-106 )
GLU( 6 A-105 )
HIS( 6 A-104 )
HIS( 6 A-103 )
HIS( 6 A-102 )
HIS( 6 A-101 )
HIS( 6 A-100 )
HIS( 6 A -99 )
GLU( 6 A -98 )
ASP( 6 A -97 )
PRO( 6 A -96 )
GLU( 6 A -95 )
ASP( 6 A -94 )
PRO( 6 A -93 )
PHE( 6 A -92 )
THR( 6 A -91 )
ARG( 6 A -90 )
TYR( 6 A -89 )
ALA( 6 A -88 )
LEU( 6 A -87 )
ALA( 6 A -86 )
GLN( 6 A -85 )
GLU( 6 A -84 )
HIS( 6 A -83 )
LEU( 6 A -82 )
LYS( 6 A -81 )
HIS( 6 A -80 )
ASP( 6 A -79 )
ASN( 6 A -78 )
ALA( 6 A -77 )
SER( 6 A -76 )
ARG( 6 A -75 )
ALA( 6 A -74 )
LEU( 6 A -73 )
ALA( 6 A -72 )
LEU( 6 A -71 )
PHE( 6 A -70 )
GLU( 6 A -69 )
GLU( 6 A -68 )
LEU( 6 A -67 )
VAL( 6 A -66 )
GLU( 6 A -65 )
THR( 6 A -64 )
ASP( 6 A -63 )
PRO( 6 A -62 )
ASP( 6 A -61 )
TYR( 6 A -60 )
VAL( 6 A -59 )
GLY( 6 A -58 )
THR( 6 A -57 )
TYR( 6 A -56 )
TYR( 6 A -55 )
HIS( 6 A -54 )
LEU( 6 A -53 )
GLY( 6 A -52 )
LYS( 6 A -51 )
LEU( 6 A -50 )
TYR( 6 A -49 )
GLU( 6 A -48 )
ARG( 6 A -47 )
LEU( 6 A -46 )
ASP( 6 A -45 )
ARG( 6 A -44 )
THR( 6 A -43 )
ASP( 6 A -42 )
ASP( 6 A -41 )
ALA( 6 A -40 )
ILE( 6 A -39 )
ASP( 6 A -38 )
THR( 6 A -37 )
TYR( 6 A -36 )
ALA( 6 A -35 )
GLN( 6 A -34 )
GLY( 6 A -33 )
ILE( 6 A -32 )
GLU( 6 A -31 )
VAL( 6 A -30 )
ALA( 6 A -29 )
ARG( 6 A -28 )
GLU( 6 A -27 )
GLU( 6 A -26 )
GLY( 6 A -25 )
THR( 6 A -24 )
GLN( 6 A -23 )
LYS( 6 A -22 )
ASP( 6 A -21 )
LEU( 6 A -20 )
SER( 6 A -19 )
GLU( 6 A -18 )
LEU( 6 A -17 )
GLN( 6 A -16 )
ASP( 6 A -15 )
ALA( 6 A -14 )
LYS( 6 A -13 )
LEU( 6 A -12 )
LYS( 6 A -11 )
ALA( 6 A -10 )
GLU( 6 A -9 )
GLY( 6 A -8 )
LEU( 6 A -7 )
GLU( 6 A -6 )
HIS( 6 A -5 )
HIS( 6 A -4 )
HIS( 6 A -3 )
HIS( 6 A -2 )
HIS( 6 A -1 )
HIS( 6 A 0 )
GLU( 7 A-197 )
ASP( 7 A-196 )
PRO( 7 A-195 )
GLU( 7 A-194 )
ASP( 7 A-193 )
PRO( 7 A-192 )
PHE( 7 A-191 )
THR( 7 A-190 )
ARG( 7 A-189 )
TYR( 7 A-188 )
ALA( 7 A-187 )
LEU( 7 A-186 )
ALA( 7 A-185 )
GLN( 7 A-184 )
GLU( 7 A-183 )
HIS( 7 A-182 )
LEU( 7 A-181 )
LYS( 7 A-180 )
HIS( 7 A-179 )
ASP( 7 A-178 )
ASN( 7 A-177 )
ALA( 7 A-176 )
SER( 7 A-175 )
ARG( 7 A-174 )
ALA( 7 A-173 )
LEU( 7 A-172 )
ALA( 7 A-171 )
LEU( 7 A-170 )
PHE( 7 A-169 )
GLU( 7 A-168 )
GLU( 7 A-167 )
LEU( 7 A-166 )
VAL( 7 A-165 )
GLU( 7 A-164 )
THR( 7 A-163 )
ASP( 7 A-162 )
PRO( 7 A-161 )
ASP( 7 A-160 )
TYR( 7 A-159 )
VAL( 7 A-158 )
GLY( 7 A-157 )
THR( 7 A-156 )
TYR( 7 A-155 )
TYR( 7 A-154 )
HIS( 7 A-153 )
LEU( 7 A-152 )
GLY( 7 A-151 )
LYS( 7 A-150 )
LEU( 7 A-149 )
TYR( 7 A-148 )
GLU( 7 A-147 )
ARG( 7 A-146 )
LEU( 7 A-145 )
ASP( 7 A-144 )
ARG( 7 A-143 )
THR( 7 A-142 )
ASP( 7 A-141 )
ASP( 7 A-140 )
ALA( 7 A-139 )
ILE( 7 A-138 )
ASP( 7 A-137 )
THR( 7 A-136 )
TYR( 7 A-135 )
ALA( 7 A-134 )
GLN( 7 A-133 )
GLY( 7 A-132 )
ILE( 7 A-131 )
GLU( 7 A-130 )
VAL( 7 A-129 )
ALA( 7 A-128 )
ARG( 7 A-127 )
GLU( 7 A-126 )
GLU( 7 A-125 )
GLY( 7 A-124 )
THR( 7 A-123 )
GLN( 7 A-122 )
LYS( 7 A-121 )
ASP( 7 A-120 )
LEU( 7 A-119 )
SER( 7 A-118 )
GLU( 7 A-117 )
LEU( 7 A-116 )
GLN( 7 A-115 )
ASP( 7 A-114 )
ALA( 7 A-113 )
LYS( 7 A-112 )
LEU( 7 A-111 )
LYS( 7 A-110 )
ALA( 7 A-109 )
GLU( 7 A-108 )
GLY( 7 A-107 )
LEU( 7 A-106 )
GLU( 7 A-105 )
HIS( 7 A-104 )
HIS( 7 A-103 )
HIS( 7 A-102 )
HIS( 7 A-101 )
HIS( 7 A-100 )
HIS( 7 A -99 )
GLU( 7 A -98 )
ASP( 7 A -97 )
PRO( 7 A -96 )
GLU( 7 A -95 )
ASP( 7 A -94 )
PRO( 7 A -93 )
PHE( 7 A -92 )
THR( 7 A -91 )
ARG( 7 A -90 )
TYR( 7 A -89 )
ALA( 7 A -88 )
LEU( 7 A -87 )
ALA( 7 A -86 )
GLN( 7 A -85 )
GLU( 7 A -84 )
HIS( 7 A -83 )
LEU( 7 A -82 )
LYS( 7 A -81 )
HIS( 7 A -80 )
ASP( 7 A -79 )
ASN( 7 A -78 )
ALA( 7 A -77 )
SER( 7 A -76 )
ARG( 7 A -75 )
ALA( 7 A -74 )
LEU( 7 A -73 )
ALA( 7 A -72 )
LEU( 7 A -71 )
PHE( 7 A -70 )
GLU( 7 A -69 )
GLU( 7 A -68 )
LEU( 7 A -67 )
VAL( 7 A -66 )
GLU( 7 A -65 )
THR( 7 A -64 )
ASP( 7 A -63 )
PRO( 7 A -62 )
ASP( 7 A -61 )
TYR( 7 A -60 )
VAL( 7 A -59 )
GLY( 7 A -58 )
THR( 7 A -57 )
TYR( 7 A -56 )
TYR( 7 A -55 )
HIS( 7 A -54 )
LEU( 7 A -53 )
GLY( 7 A -52 )
LYS( 7 A -51 )
LEU( 7 A -50 )
TYR( 7 A -49 )
GLU( 7 A -48 )
ARG( 7 A -47 )
LEU( 7 A -46 )
ASP( 7 A -45 )
ARG( 7 A -44 )
THR( 7 A -43 )
ASP( 7 A -42 )
ASP( 7 A -41 )
ALA( 7 A -40 )
ILE( 7 A -39 )
ASP( 7 A -38 )
THR( 7 A -37 )
TYR( 7 A -36 )
ALA( 7 A -35 )
GLN( 7 A -34 )
GLY( 7 A -33 )
ILE( 7 A -32 )
GLU( 7 A -31 )
VAL( 7 A -30 )
ALA( 7 A -29 )
ARG( 7 A -28 )
GLU( 7 A -27 )
GLU( 7 A -26 )
GLY( 7 A -25 )
THR( 7 A -24 )
GLN( 7 A -23 )
LYS( 7 A -22 )
ASP( 7 A -21 )
LEU( 7 A -20 )
SER( 7 A -19 )
GLU( 7 A -18 )
LEU( 7 A -17 )
GLN( 7 A -16 )
ASP( 7 A -15 )
ALA( 7 A -14 )
LYS( 7 A -13 )
LEU( 7 A -12 )
LYS( 7 A -11 )
ALA( 7 A -10 )
GLU( 7 A -9 )
GLY( 7 A -8 )
LEU( 7 A -7 )
GLU( 7 A -6 )
HIS( 7 A -5 )
HIS( 7 A -4 )
HIS( 7 A -3 )
HIS( 7 A -2 )
HIS( 7 A -1 )
HIS( 7 A 0 )
GLU( 8 A-197 )
ASP( 8 A-196 )
PRO( 8 A-195 )
GLU( 8 A-194 )
ASP( 8 A-193 )
PRO( 8 A-192 )
PHE( 8 A-191 )
THR( 8 A-190 )
ARG( 8 A-189 )
TYR( 8 A-188 )
ALA( 8 A-187 )
LEU( 8 A-186 )
ALA( 8 A-185 )
GLN( 8 A-184 )
GLU( 8 A-183 )
HIS( 8 A-182 )
LEU( 8 A-181 )
LYS( 8 A-180 )
HIS( 8 A-179 )
ASP( 8 A-178 )
ASN( 8 A-177 )
ALA( 8 A-176 )
SER( 8 A-175 )
ARG( 8 A-174 )
ALA( 8 A-173 )
LEU( 8 A-172 )
ALA( 8 A-171 )
LEU( 8 A-170 )
PHE( 8 A-169 )
GLU( 8 A-168 )
GLU( 8 A-167 )
LEU( 8 A-166 )
VAL( 8 A-165 )
GLU( 8 A-164 )
THR( 8 A-163 )
ASP( 8 A-162 )
PRO( 8 A-161 )
ASP( 8 A-160 )
TYR( 8 A-159 )
VAL( 8 A-158 )
GLY( 8 A-157 )
THR( 8 A-156 )
TYR( 8 A-155 )
TYR( 8 A-154 )
HIS( 8 A-153 )
LEU( 8 A-152 )
GLY( 8 A-151 )
LYS( 8 A-150 )
LEU( 8 A-149 )
TYR( 8 A-148 )
GLU( 8 A-147 )
ARG( 8 A-146 )
LEU( 8 A-145 )
ASP( 8 A-144 )
ARG( 8 A-143 )
THR( 8 A-142 )
ASP( 8 A-141 )
ASP( 8 A-140 )
ALA( 8 A-139 )
ILE( 8 A-138 )
ASP( 8 A-137 )
THR( 8 A-136 )
TYR( 8 A-135 )
ALA( 8 A-134 )
GLN( 8 A-133 )
GLY( 8 A-132 )
ILE( 8 A-131 )
GLU( 8 A-130 )
VAL( 8 A-129 )
ALA( 8 A-128 )
ARG( 8 A-127 )
GLU( 8 A-126 )
GLU( 8 A-125 )
GLY( 8 A-124 )
THR( 8 A-123 )
GLN( 8 A-122 )
LYS( 8 A-121 )
ASP( 8 A-120 )
LEU( 8 A-119 )
SER( 8 A-118 )
GLU( 8 A-117 )
LEU( 8 A-116 )
GLN( 8 A-115 )
ASP( 8 A-114 )
ALA( 8 A-113 )
LYS( 8 A-112 )
LEU( 8 A-111 )
LYS( 8 A-110 )
ALA( 8 A-109 )
GLU( 8 A-108 )
GLY( 8 A-107 )
LEU( 8 A-106 )
GLU( 8 A-105 )
HIS( 8 A-104 )
HIS( 8 A-103 )
HIS( 8 A-102 )
HIS( 8 A-101 )
HIS( 8 A-100 )
HIS( 8 A -99 )
GLU( 8 A -98 )
ASP( 8 A -97 )
PRO( 8 A -96 )
GLU( 8 A -95 )
ASP( 8 A -94 )
PRO( 8 A -93 )
PHE( 8 A -92 )
THR( 8 A -91 )
ARG( 8 A -90 )
TYR( 8 A -89 )
ALA( 8 A -88 )
LEU( 8 A -87 )
ALA( 8 A -86 )
GLN( 8 A -85 )
GLU( 8 A -84 )
HIS( 8 A -83 )
LEU( 8 A -82 )
LYS( 8 A -81 )
HIS( 8 A -80 )
ASP( 8 A -79 )
ASN( 8 A -78 )
ALA( 8 A -77 )
SER( 8 A -76 )
ARG( 8 A -75 )
ALA( 8 A -74 )
LEU( 8 A -73 )
ALA( 8 A -72 )
LEU( 8 A -71 )
PHE( 8 A -70 )
GLU( 8 A -69 )
GLU( 8 A -68 )
LEU( 8 A -67 )
VAL( 8 A -66 )
GLU( 8 A -65 )
THR( 8 A -64 )
ASP( 8 A -63 )
PRO( 8 A -62 )
ASP( 8 A -61 )
TYR( 8 A -60 )
VAL( 8 A -59 )
GLY( 8 A -58 )
THR( 8 A -57 )
TYR( 8 A -56 )
TYR( 8 A -55 )
HIS( 8 A -54 )
LEU( 8 A -53 )
GLY( 8 A -52 )
LYS( 8 A -51 )
LEU( 8 A -50 )
TYR( 8 A -49 )
GLU( 8 A -48 )
ARG( 8 A -47 )
LEU( 8 A -46 )
ASP( 8 A -45 )
ARG( 8 A -44 )
THR( 8 A -43 )
ASP( 8 A -42 )
ASP( 8 A -41 )
ALA( 8 A -40 )
ILE( 8 A -39 )
ASP( 8 A -38 )
THR( 8 A -37 )
TYR( 8 A -36 )
ALA( 8 A -35 )
GLN( 8 A -34 )
GLY( 8 A -33 )
ILE( 8 A -32 )
GLU( 8 A -31 )
VAL( 8 A -30 )
ALA( 8 A -29 )
ARG( 8 A -28 )
GLU( 8 A -27 )
GLU( 8 A -26 )
GLY( 8 A -25 )
THR( 8 A -24 )
GLN( 8 A -23 )
LYS( 8 A -22 )
ASP( 8 A -21 )
LEU( 8 A -20 )
SER( 8 A -19 )
GLU( 8 A -18 )
LEU( 8 A -17 )
GLN( 8 A -16 )
ASP( 8 A -15 )
ALA( 8 A -14 )
LYS( 8 A -13 )
LEU( 8 A -12 )
LYS( 8 A -11 )
ALA( 8 A -10 )
GLU( 8 A -9 )
GLY( 8 A -8 )
LEU( 8 A -7 )
GLU( 8 A -6 )
HIS( 8 A -5 )
HIS( 8 A -4 )
HIS( 8 A -3 )
HIS( 8 A -2 )
HIS( 8 A -1 )
HIS( 8 A 0 )
GLU( 9 A-197 )
ASP( 9 A-196 )
PRO( 9 A-195 )
GLU( 9 A-194 )
ASP( 9 A-193 )
PRO( 9 A-192 )
PHE( 9 A-191 )
THR( 9 A-190 )
ARG( 9 A-189 )
TYR( 9 A-188 )
ALA( 9 A-187 )
LEU( 9 A-186 )
ALA( 9 A-185 )
GLN( 9 A-184 )
GLU( 9 A-183 )
HIS( 9 A-182 )
LEU( 9 A-181 )
LYS( 9 A-180 )
HIS( 9 A-179 )
ASP( 9 A-178 )
ASN( 9 A-177 )
ALA( 9 A-176 )
SER( 9 A-175 )
ARG( 9 A-174 )
ALA( 9 A-173 )
LEU( 9 A-172 )
ALA( 9 A-171 )
LEU( 9 A-170 )
PHE( 9 A-169 )
GLU( 9 A-168 )
GLU( 9 A-167 )
LEU( 9 A-166 )
VAL( 9 A-165 )
GLU( 9 A-164 )
THR( 9 A-163 )
ASP( 9 A-162 )
PRO( 9 A-161 )
ASP( 9 A-160 )
TYR( 9 A-159 )
VAL( 9 A-158 )
GLY( 9 A-157 )
THR( 9 A-156 )
TYR( 9 A-155 )
TYR( 9 A-154 )
HIS( 9 A-153 )
LEU( 9 A-152 )
GLY( 9 A-151 )
LYS( 9 A-150 )
LEU( 9 A-149 )
TYR( 9 A-148 )
GLU( 9 A-147 )
ARG( 9 A-146 )
LEU( 9 A-145 )
ASP( 9 A-144 )
ARG( 9 A-143 )
THR( 9 A-142 )
ASP( 9 A-141 )
ASP( 9 A-140 )
ALA( 9 A-139 )
ILE( 9 A-138 )
ASP( 9 A-137 )
THR( 9 A-136 )
TYR( 9 A-135 )
ALA( 9 A-134 )
GLN( 9 A-133 )
GLY( 9 A-132 )
ILE( 9 A-131 )
GLU( 9 A-130 )
VAL( 9 A-129 )
ALA( 9 A-128 )
ARG( 9 A-127 )
GLU( 9 A-126 )
GLU( 9 A-125 )
GLY( 9 A-124 )
THR( 9 A-123 )
GLN( 9 A-122 )
LYS( 9 A-121 )
ASP( 9 A-120 )
LEU( 9 A-119 )
SER( 9 A-118 )
GLU( 9 A-117 )
LEU( 9 A-116 )
GLN( 9 A-115 )
ASP( 9 A-114 )
ALA( 9 A-113 )
LYS( 9 A-112 )
LEU( 9 A-111 )
LYS( 9 A-110 )
ALA( 9 A-109 )
GLU( 9 A-108 )
GLY( 9 A-107 )
LEU( 9 A-106 )
GLU( 9 A-105 )
HIS( 9 A-104 )
HIS( 9 A-103 )
HIS( 9 A-102 )
HIS( 9 A-101 )
HIS( 9 A-100 )
HIS( 9 A -99 )
GLU( 9 A -98 )
ASP( 9 A -97 )
PRO( 9 A -96 )
GLU( 9 A -95 )
ASP( 9 A -94 )
PRO( 9 A -93 )
PHE( 9 A -92 )
THR( 9 A -91 )
ARG( 9 A -90 )
TYR( 9 A -89 )
ALA( 9 A -88 )
LEU( 9 A -87 )
ALA( 9 A -86 )
GLN( 9 A -85 )
GLU( 9 A -84 )
HIS( 9 A -83 )
LEU( 9 A -82 )
LYS( 9 A -81 )
HIS( 9 A -80 )
ASP( 9 A -79 )
ASN( 9 A -78 )
ALA( 9 A -77 )
SER( 9 A -76 )
ARG( 9 A -75 )
ALA( 9 A -74 )
LEU( 9 A -73 )
ALA( 9 A -72 )
LEU( 9 A -71 )
PHE( 9 A -70 )
GLU( 9 A -69 )
GLU( 9 A -68 )
LEU( 9 A -67 )
VAL( 9 A -66 )
GLU( 9 A -65 )
THR( 9 A -64 )
ASP( 9 A -63 )
PRO( 9 A -62 )
ASP( 9 A -61 )
TYR( 9 A -60 )
VAL( 9 A -59 )
GLY( 9 A -58 )
THR( 9 A -57 )
TYR( 9 A -56 )
TYR( 9 A -55 )
HIS( 9 A -54 )
LEU( 9 A -53 )
GLY( 9 A -52 )
LYS( 9 A -51 )
LEU( 9 A -50 )
TYR( 9 A -49 )
GLU( 9 A -48 )
ARG( 9 A -47 )
LEU( 9 A -46 )
ASP( 9 A -45 )
ARG( 9 A -44 )
THR( 9 A -43 )
ASP( 9 A -42 )
ASP( 9 A -41 )
ALA( 9 A -40 )
ILE( 9 A -39 )
ASP( 9 A -38 )
THR( 9 A -37 )
TYR( 9 A -36 )
ALA( 9 A -35 )
GLN( 9 A -34 )
GLY( 9 A -33 )
ILE( 9 A -32 )
GLU( 9 A -31 )
VAL( 9 A -30 )
ALA( 9 A -29 )
ARG( 9 A -28 )
GLU( 9 A -27 )
GLU( 9 A -26 )
GLY( 9 A -25 )
THR( 9 A -24 )
GLN( 9 A -23 )
LYS( 9 A -22 )
ASP( 9 A -21 )
LEU( 9 A -20 )
SER( 9 A -19 )
GLU( 9 A -18 )
LEU( 9 A -17 )
GLN( 9 A -16 )
ASP( 9 A -15 )
ALA( 9 A -14 )
LYS( 9 A -13 )
LEU( 9 A -12 )
LYS( 9 A -11 )
ALA( 9 A -10 )
GLU( 9 A -9 )
GLY( 9 A -8 )
LEU( 9 A -7 )
GLU( 9 A -6 )
HIS( 9 A -5 )
HIS( 9 A -4 )
HIS( 9 A -3 )
HIS( 9 A -2 )
HIS( 9 A -1 )
HIS( 9 A 0 )
GLU( 10 A-197 )
ASP( 10 A-196 )
PRO( 10 A-195 )
GLU( 10 A-194 )
ASP( 10 A-193 )
PRO( 10 A-192 )
PHE( 10 A-191 )
THR( 10 A-190 )
ARG( 10 A-189 )
TYR( 10 A-188 )
ALA( 10 A-187 )
LEU( 10 A-186 )
ALA( 10 A-185 )
GLN( 10 A-184 )
GLU( 10 A-183 )
HIS( 10 A-182 )
LEU( 10 A-181 )
LYS( 10 A-180 )
HIS( 10 A-179 )
ASP( 10 A-178 )
ASN( 10 A-177 )
ALA( 10 A-176 )
SER( 10 A-175 )
ARG( 10 A-174 )
ALA( 10 A-173 )
LEU( 10 A-172 )
ALA( 10 A-171 )
LEU( 10 A-170 )
PHE( 10 A-169 )
GLU( 10 A-168 )
GLU( 10 A-167 )
LEU( 10 A-166 )
VAL( 10 A-165 )
GLU( 10 A-164 )
THR( 10 A-163 )
ASP( 10 A-162 )
PRO( 10 A-161 )
ASP( 10 A-160 )
TYR( 10 A-159 )
VAL( 10 A-158 )
GLY( 10 A-157 )
THR( 10 A-156 )
TYR( 10 A-155 )
TYR( 10 A-154 )
HIS( 10 A-153 )
LEU( 10 A-152 )
GLY( 10 A-151 )
LYS( 10 A-150 )
LEU( 10 A-149 )
TYR( 10 A-148 )
GLU( 10 A-147 )
ARG( 10 A-146 )
LEU( 10 A-145 )
ASP( 10 A-144 )
ARG( 10 A-143 )
THR( 10 A-142 )
ASP( 10 A-141 )
ASP( 10 A-140 )
ALA( 10 A-139 )
ILE( 10 A-138 )
ASP( 10 A-137 )
THR( 10 A-136 )
TYR( 10 A-135 )
ALA( 10 A-134 )
GLN( 10 A-133 )
GLY( 10 A-132 )
ILE( 10 A-131 )
GLU( 10 A-130 )
VAL( 10 A-129 )
ALA( 10 A-128 )
ARG( 10 A-127 )
GLU( 10 A-126 )
GLU( 10 A-125 )
GLY( 10 A-124 )
THR( 10 A-123 )
GLN( 10 A-122 )
LYS( 10 A-121 )
ASP( 10 A-120 )
LEU( 10 A-119 )
SER( 10 A-118 )
GLU( 10 A-117 )
LEU( 10 A-116 )
GLN( 10 A-115 )
ASP( 10 A-114 )
ALA( 10 A-113 )
LYS( 10 A-112 )
LEU( 10 A-111 )
LYS( 10 A-110 )
ALA( 10 A-109 )
GLU( 10 A-108 )
GLY( 10 A-107 )
LEU( 10 A-106 )
GLU( 10 A-105 )
HIS( 10 A-104 )
HIS( 10 A-103 )
HIS( 10 A-102 )
HIS( 10 A-101 )
HIS( 10 A-100 )
HIS( 10 A -99 )
GLU( 10 A -98 )
ASP( 10 A -97 )
PRO( 10 A -96 )
GLU( 10 A -95 )
ASP( 10 A -94 )
PRO( 10 A -93 )
PHE( 10 A -92 )
THR( 10 A -91 )
ARG( 10 A -90 )
TYR( 10 A -89 )
ALA( 10 A -88 )
LEU( 10 A -87 )
ALA( 10 A -86 )
GLN( 10 A -85 )
GLU( 10 A -84 )
HIS( 10 A -83 )
LEU( 10 A -82 )
LYS( 10 A -81 )
HIS( 10 A -80 )
ASP( 10 A -79 )
ASN( 10 A -78 )
ALA( 10 A -77 )
SER( 10 A -76 )
ARG( 10 A -75 )
ALA( 10 A -74 )
LEU( 10 A -73 )
ALA( 10 A -72 )
LEU( 10 A -71 )
PHE( 10 A -70 )
GLU( 10 A -69 )
GLU( 10 A -68 )
LEU( 10 A -67 )
VAL( 10 A -66 )
GLU( 10 A -65 )
THR( 10 A -64 )
ASP( 10 A -63 )
PRO( 10 A -62 )
ASP( 10 A -61 )
TYR( 10 A -60 )
VAL( 10 A -59 )
GLY( 10 A -58 )
THR( 10 A -57 )
TYR( 10 A -56 )
TYR( 10 A -55 )
HIS( 10 A -54 )
LEU( 10 A -53 )
GLY( 10 A -52 )
LYS( 10 A -51 )
LEU( 10 A -50 )
TYR( 10 A -49 )
GLU( 10 A -48 )
ARG( 10 A -47 )
LEU( 10 A -46 )
ASP( 10 A -45 )
ARG( 10 A -44 )
THR( 10 A -43 )
ASP( 10 A -42 )
ASP( 10 A -41 )
ALA( 10 A -40 )
ILE( 10 A -39 )
ASP( 10 A -38 )
THR( 10 A -37 )
TYR( 10 A -36 )
ALA( 10 A -35 )
GLN( 10 A -34 )
GLY( 10 A -33 )
ILE( 10 A -32 )
GLU( 10 A -31 )
VAL( 10 A -30 )
ALA( 10 A -29 )
ARG( 10 A -28 )
GLU( 10 A -27 )
GLU( 10 A -26 )
GLY( 10 A -25 )
THR( 10 A -24 )
GLN( 10 A -23 )
LYS( 10 A -22 )
ASP( 10 A -21 )
LEU( 10 A -20 )
SER( 10 A -19 )
GLU( 10 A -18 )
LEU( 10 A -17 )
GLN( 10 A -16 )
ASP( 10 A -15 )
ALA( 10 A -14 )
LYS( 10 A -13 )
LEU( 10 A -12 )
LYS( 10 A -11 )
ALA( 10 A -10 )
GLU( 10 A -9 )
GLY( 10 A -8 )
LEU( 10 A -7 )
GLU( 10 A -6 )
HIS( 10 A -5 )
HIS( 10 A -4 )
HIS( 10 A -3 )
HIS( 10 A -2 )
HIS( 10 A -1 )
HIS( 10 A 0 )
GLU( 11 A-197 )
ASP( 11 A-196 )
PRO( 11 A-195 )
GLU( 11 A-194 )
ASP( 11 A-193 )
PRO( 11 A-192 )
PHE( 11 A-191 )
THR( 11 A-190 )
ARG( 11 A-189 )
TYR( 11 A-188 )
ALA( 11 A-187 )
LEU( 11 A-186 )
ALA( 11 A-185 )
GLN( 11 A-184 )
GLU( 11 A-183 )
HIS( 11 A-182 )
LEU( 11 A-181 )
LYS( 11 A-180 )
HIS( 11 A-179 )
ASP( 11 A-178 )
ASN( 11 A-177 )
ALA( 11 A-176 )
SER( 11 A-175 )
ARG( 11 A-174 )
ALA( 11 A-173 )
LEU( 11 A-172 )
ALA( 11 A-171 )
LEU( 11 A-170 )
PHE( 11 A-169 )
GLU( 11 A-168 )
GLU( 11 A-167 )
LEU( 11 A-166 )
VAL( 11 A-165 )
GLU( 11 A-164 )
THR( 11 A-163 )
ASP( 11 A-162 )
PRO( 11 A-161 )
ASP( 11 A-160 )
TYR( 11 A-159 )
VAL( 11 A-158 )
GLY( 11 A-157 )
THR( 11 A-156 )
TYR( 11 A-155 )
TYR( 11 A-154 )
HIS( 11 A-153 )
LEU( 11 A-152 )
GLY( 11 A-151 )
LYS( 11 A-150 )
LEU( 11 A-149 )
TYR( 11 A-148 )
GLU( 11 A-147 )
ARG( 11 A-146 )
LEU( 11 A-145 )
ASP( 11 A-144 )
ARG( 11 A-143 )
THR( 11 A-142 )
ASP( 11 A-141 )
ASP( 11 A-140 )
ALA( 11 A-139 )
ILE( 11 A-138 )
ASP( 11 A-137 )
THR( 11 A-136 )
TYR( 11 A-135 )
ALA( 11 A-134 )
GLN( 11 A-133 )
GLY( 11 A-132 )
ILE( 11 A-131 )
GLU( 11 A-130 )
VAL( 11 A-129 )
ALA( 11 A-128 )
ARG( 11 A-127 )
GLU( 11 A-126 )
GLU( 11 A-125 )
GLY( 11 A-124 )
THR( 11 A-123 )
GLN( 11 A-122 )
LYS( 11 A-121 )
ASP( 11 A-120 )
LEU( 11 A-119 )
SER( 11 A-118 )
GLU( 11 A-117 )
LEU( 11 A-116 )
GLN( 11 A-115 )
ASP( 11 A-114 )
ALA( 11 A-113 )
LYS( 11 A-112 )
LEU( 11 A-111 )
LYS( 11 A-110 )
ALA( 11 A-109 )
GLU( 11 A-108 )
GLY( 11 A-107 )
LEU( 11 A-106 )
GLU( 11 A-105 )
HIS( 11 A-104 )
HIS( 11 A-103 )
HIS( 11 A-102 )
HIS( 11 A-101 )
HIS( 11 A-100 )
HIS( 11 A -99 )
GLU( 11 A -98 )
ASP( 11 A -97 )
PRO( 11 A -96 )
GLU( 11 A -95 )
ASP( 11 A -94 )
PRO( 11 A -93 )
PHE( 11 A -92 )
THR( 11 A -91 )
ARG( 11 A -90 )
TYR( 11 A -89 )
ALA( 11 A -88 )
LEU( 11 A -87 )
ALA( 11 A -86 )
GLN( 11 A -85 )
GLU( 11 A -84 )
HIS( 11 A -83 )
LEU( 11 A -82 )
LYS( 11 A -81 )
HIS( 11 A -80 )
ASP( 11 A -79 )
ASN( 11 A -78 )
ALA( 11 A -77 )
SER( 11 A -76 )
ARG( 11 A -75 )
ALA( 11 A -74 )
LEU( 11 A -73 )
ALA( 11 A -72 )
LEU( 11 A -71 )
PHE( 11 A -70 )
GLU( 11 A -69 )
GLU( 11 A -68 )
LEU( 11 A -67 )
VAL( 11 A -66 )
GLU( 11 A -65 )
THR( 11 A -64 )
ASP( 11 A -63 )
PRO( 11 A -62 )
ASP( 11 A -61 )
TYR( 11 A -60 )
VAL( 11 A -59 )
GLY( 11 A -58 )
THR( 11 A -57 )
TYR( 11 A -56 )
TYR( 11 A -55 )
HIS( 11 A -54 )
LEU( 11 A -53 )
GLY( 11 A -52 )
LYS( 11 A -51 )
LEU( 11 A -50 )
TYR( 11 A -49 )
GLU( 11 A -48 )
ARG( 11 A -47 )
LEU( 11 A -46 )
ASP( 11 A -45 )
ARG( 11 A -44 )
THR( 11 A -43 )
ASP( 11 A -42 )
ASP( 11 A -41 )
ALA( 11 A -40 )
ILE( 11 A -39 )
ASP( 11 A -38 )
THR( 11 A -37 )
TYR( 11 A -36 )
ALA( 11 A -35 )
GLN( 11 A -34 )
GLY( 11 A -33 )
ILE( 11 A -32 )
GLU( 11 A -31 )
VAL( 11 A -30 )
ALA( 11 A -29 )
ARG( 11 A -28 )
GLU( 11 A -27 )
GLU( 11 A -26 )
GLY( 11 A -25 )
THR( 11 A -24 )
GLN( 11 A -23 )
LYS( 11 A -22 )
ASP( 11 A -21 )
LEU( 11 A -20 )
SER( 11 A -19 )
GLU( 11 A -18 )
LEU( 11 A -17 )
GLN( 11 A -16 )
ASP( 11 A -15 )
ALA( 11 A -14 )
LYS( 11 A -13 )
LEU( 11 A -12 )
LYS( 11 A -11 )
ALA( 11 A -10 )
GLU( 11 A -9 )
GLY( 11 A -8 )
LEU( 11 A -7 )
GLU( 11 A -6 )
HIS( 11 A -5 )
HIS( 11 A -4 )
HIS( 11 A -3 )
HIS( 11 A -2 )
HIS( 11 A -1 )
HIS( 11 A 0 )
GLU( 12 A-197 )
ASP( 12 A-196 )
PRO( 12 A-195 )
GLU( 12 A-194 )
ASP( 12 A-193 )
PRO( 12 A-192 )
PHE( 12 A-191 )
THR( 12 A-190 )
ARG( 12 A-189 )
TYR( 12 A-188 )
ALA( 12 A-187 )
LEU( 12 A-186 )
ALA( 12 A-185 )
GLN( 12 A-184 )
GLU( 12 A-183 )
HIS( 12 A-182 )
LEU( 12 A-181 )
LYS( 12 A-180 )
HIS( 12 A-179 )
ASP( 12 A-178 )
ASN( 12 A-177 )
ALA( 12 A-176 )
SER( 12 A-175 )
ARG( 12 A-174 )
ALA( 12 A-173 )
LEU( 12 A-172 )
ALA( 12 A-171 )
LEU( 12 A-170 )
PHE( 12 A-169 )
GLU( 12 A-168 )
GLU( 12 A-167 )
LEU( 12 A-166 )
VAL( 12 A-165 )
GLU( 12 A-164 )
THR( 12 A-163 )
ASP( 12 A-162 )
PRO( 12 A-161 )
ASP( 12 A-160 )
TYR( 12 A-159 )
VAL( 12 A-158 )
GLY( 12 A-157 )
THR( 12 A-156 )
TYR( 12 A-155 )
TYR( 12 A-154 )
HIS( 12 A-153 )
LEU( 12 A-152 )
GLY( 12 A-151 )
LYS( 12 A-150 )
LEU( 12 A-149 )
TYR( 12 A-148 )
GLU( 12 A-147 )
ARG( 12 A-146 )
LEU( 12 A-145 )
ASP( 12 A-144 )
ARG( 12 A-143 )
THR( 12 A-142 )
ASP( 12 A-141 )
ASP( 12 A-140 )
ALA( 12 A-139 )
ILE( 12 A-138 )
ASP( 12 A-137 )
THR( 12 A-136 )
TYR( 12 A-135 )
ALA( 12 A-134 )
GLN( 12 A-133 )
GLY( 12 A-132 )
ILE( 12 A-131 )
GLU( 12 A-130 )
VAL( 12 A-129 )
ALA( 12 A-128 )
ARG( 12 A-127 )
GLU( 12 A-126 )
GLU( 12 A-125 )
GLY( 12 A-124 )
THR( 12 A-123 )
GLN( 12 A-122 )
LYS( 12 A-121 )
ASP( 12 A-120 )
LEU( 12 A-119 )
SER( 12 A-118 )
GLU( 12 A-117 )
LEU( 12 A-116 )
GLN( 12 A-115 )
ASP( 12 A-114 )
ALA( 12 A-113 )
LYS( 12 A-112 )
LEU( 12 A-111 )
LYS( 12 A-110 )
ALA( 12 A-109 )
GLU( 12 A-108 )
GLY( 12 A-107 )
LEU( 12 A-106 )
GLU( 12 A-105 )
HIS( 12 A-104 )
HIS( 12 A-103 )
HIS( 12 A-102 )
HIS( 12 A-101 )
HIS( 12 A-100 )
HIS( 12 A -99 )
GLU( 12 A -98 )
ASP( 12 A -97 )
PRO( 12 A -96 )
GLU( 12 A -95 )
ASP( 12 A -94 )
PRO( 12 A -93 )
PHE( 12 A -92 )
THR( 12 A -91 )
ARG( 12 A -90 )
TYR( 12 A -89 )
ALA( 12 A -88 )
LEU( 12 A -87 )
ALA( 12 A -86 )
GLN( 12 A -85 )
GLU( 12 A -84 )
HIS( 12 A -83 )
LEU( 12 A -82 )
LYS( 12 A -81 )
HIS( 12 A -80 )
ASP( 12 A -79 )
ASN( 12 A -78 )
ALA( 12 A -77 )
SER( 12 A -76 )
ARG( 12 A -75 )
ALA( 12 A -74 )
LEU( 12 A -73 )
ALA( 12 A -72 )
LEU( 12 A -71 )
PHE( 12 A -70 )
GLU( 12 A -69 )
GLU( 12 A -68 )
LEU( 12 A -67 )
VAL( 12 A -66 )
GLU( 12 A -65 )
THR( 12 A -64 )
ASP( 12 A -63 )
PRO( 12 A -62 )
ASP( 12 A -61 )
TYR( 12 A -60 )
VAL( 12 A -59 )
GLY( 12 A -58 )
THR( 12 A -57 )
TYR( 12 A -56 )
TYR( 12 A -55 )
HIS( 12 A -54 )
LEU( 12 A -53 )
GLY( 12 A -52 )
LYS( 12 A -51 )
LEU( 12 A -50 )
TYR( 12 A -49 )
GLU( 12 A -48 )
ARG( 12 A -47 )
LEU( 12 A -46 )
ASP( 12 A -45 )
ARG( 12 A -44 )
THR( 12 A -43 )
ASP( 12 A -42 )
ASP( 12 A -41 )
ALA( 12 A -40 )
ILE( 12 A -39 )
ASP( 12 A -38 )
THR( 12 A -37 )
TYR( 12 A -36 )
ALA( 12 A -35 )
GLN( 12 A -34 )
GLY( 12 A -33 )
ILE( 12 A -32 )
GLU( 12 A -31 )
VAL( 12 A -30 )
ALA( 12 A -29 )
ARG( 12 A -28 )
GLU( 12 A -27 )
GLU( 12 A -26 )
GLY( 12 A -25 )
THR( 12 A -24 )
GLN( 12 A -23 )
LYS( 12 A -22 )
ASP( 12 A -21 )
LEU( 12 A -20 )
SER( 12 A -19 )
GLU( 12 A -18 )
LEU( 12 A -17 )
GLN( 12 A -16 )
ASP( 12 A -15 )
ALA( 12 A -14 )
LYS( 12 A -13 )
LEU( 12 A -12 )
LYS( 12 A -11 )
ALA( 12 A -10 )
GLU( 12 A -9 )
GLY( 12 A -8 )
LEU( 12 A -7 )
GLU( 12 A -6 )
HIS( 12 A -5 )
HIS( 12 A -4 )
HIS( 12 A -3 )
HIS( 12 A -2 )
HIS( 12 A -1 )
HIS( 12 A 0 )
GLU( 13 A-197 )
ASP( 13 A-196 )
PRO( 13 A-195 )
GLU( 13 A-194 )
ASP( 13 A-193 )
PRO( 13 A-192 )
PHE( 13 A-191 )
THR( 13 A-190 )
ARG( 13 A-189 )
TYR( 13 A-188 )
ALA( 13 A-187 )
LEU( 13 A-186 )
ALA( 13 A-185 )
GLN( 13 A-184 )
GLU( 13 A-183 )
HIS( 13 A-182 )
LEU( 13 A-181 )
LYS( 13 A-180 )
HIS( 13 A-179 )
ASP( 13 A-178 )
ASN( 13 A-177 )
ALA( 13 A-176 )
SER( 13 A-175 )
ARG( 13 A-174 )
ALA( 13 A-173 )
LEU( 13 A-172 )
ALA( 13 A-171 )
LEU( 13 A-170 )
PHE( 13 A-169 )
GLU( 13 A-168 )
GLU( 13 A-167 )
LEU( 13 A-166 )
VAL( 13 A-165 )
GLU( 13 A-164 )
THR( 13 A-163 )
ASP( 13 A-162 )
PRO( 13 A-161 )
ASP( 13 A-160 )
TYR( 13 A-159 )
VAL( 13 A-158 )
GLY( 13 A-157 )
THR( 13 A-156 )
TYR( 13 A-155 )
TYR( 13 A-154 )
HIS( 13 A-153 )
LEU( 13 A-152 )
GLY( 13 A-151 )
LYS( 13 A-150 )
LEU( 13 A-149 )
TYR( 13 A-148 )
GLU( 13 A-147 )
ARG( 13 A-146 )
LEU( 13 A-145 )
ASP( 13 A-144 )
ARG( 13 A-143 )
THR( 13 A-142 )
ASP( 13 A-141 )
ASP( 13 A-140 )
ALA( 13 A-139 )
ILE( 13 A-138 )
ASP( 13 A-137 )
THR( 13 A-136 )
TYR( 13 A-135 )
ALA( 13 A-134 )
GLN( 13 A-133 )
GLY( 13 A-132 )
ILE( 13 A-131 )
GLU( 13 A-130 )
VAL( 13 A-129 )
ALA( 13 A-128 )
ARG( 13 A-127 )
GLU( 13 A-126 )
GLU( 13 A-125 )
GLY( 13 A-124 )
THR( 13 A-123 )
GLN( 13 A-122 )
LYS( 13 A-121 )
ASP( 13 A-120 )
LEU( 13 A-119 )
SER( 13 A-118 )
GLU( 13 A-117 )
LEU( 13 A-116 )
GLN( 13 A-115 )
ASP( 13 A-114 )
ALA( 13 A-113 )
LYS( 13 A-112 )
LEU( 13 A-111 )
LYS( 13 A-110 )
ALA( 13 A-109 )
GLU( 13 A-108 )
GLY( 13 A-107 )
LEU( 13 A-106 )
GLU( 13 A-105 )
HIS( 13 A-104 )
HIS( 13 A-103 )
HIS( 13 A-102 )
HIS( 13 A-101 )
HIS( 13 A-100 )
HIS( 13 A -99 )
GLU( 13 A -98 )
ASP( 13 A -97 )
PRO( 13 A -96 )
GLU( 13 A -95 )
ASP( 13 A -94 )
PRO( 13 A -93 )
PHE( 13 A -92 )
THR( 13 A -91 )
ARG( 13 A -90 )
TYR( 13 A -89 )
ALA( 13 A -88 )
LEU( 13 A -87 )
ALA( 13 A -86 )
GLN( 13 A -85 )
GLU( 13 A -84 )
HIS( 13 A -83 )
LEU( 13 A -82 )
LYS( 13 A -81 )
HIS( 13 A -80 )
ASP( 13 A -79 )
ASN( 13 A -78 )
ALA( 13 A -77 )
SER( 13 A -76 )
ARG( 13 A -75 )
ALA( 13 A -74 )
LEU( 13 A -73 )
ALA( 13 A -72 )
LEU( 13 A -71 )
PHE( 13 A -70 )
GLU( 13 A -69 )
GLU( 13 A -68 )
LEU( 13 A -67 )
VAL( 13 A -66 )
GLU( 13 A -65 )
THR( 13 A -64 )
ASP( 13 A -63 )
PRO( 13 A -62 )
ASP( 13 A -61 )
TYR( 13 A -60 )
VAL( 13 A -59 )
GLY( 13 A -58 )
THR( 13 A -57 )
TYR( 13 A -56 )
TYR( 13 A -55 )
HIS( 13 A -54 )
LEU( 13 A -53 )
GLY( 13 A -52 )
LYS( 13 A -51 )
LEU( 13 A -50 )
TYR( 13 A -49 )
GLU( 13 A -48 )
ARG( 13 A -47 )
LEU( 13 A -46 )
ASP( 13 A -45 )
ARG( 13 A -44 )
THR( 13 A -43 )
ASP( 13 A -42 )
ASP( 13 A -41 )
ALA( 13 A -40 )
ILE( 13 A -39 )
ASP( 13 A -38 )
THR( 13 A -37 )
TYR( 13 A -36 )
ALA( 13 A -35 )
GLN( 13 A -34 )
GLY( 13 A -33 )
ILE( 13 A -32 )
GLU( 13 A -31 )
VAL( 13 A -30 )
ALA( 13 A -29 )
ARG( 13 A -28 )
GLU( 13 A -27 )
GLU( 13 A -26 )
GLY( 13 A -25 )
THR( 13 A -24 )
GLN( 13 A -23 )
LYS( 13 A -22 )
ASP( 13 A -21 )
LEU( 13 A -20 )
SER( 13 A -19 )
GLU( 13 A -18 )
LEU( 13 A -17 )
GLN( 13 A -16 )
ASP( 13 A -15 )
ALA( 13 A -14 )
LYS( 13 A -13 )
LEU( 13 A -12 )
LYS( 13 A -11 )
ALA( 13 A -10 )
GLU( 13 A -9 )
GLY( 13 A -8 )
LEU( 13 A -7 )
GLU( 13 A -6 )
HIS( 13 A -5 )
HIS( 13 A -4 )
HIS( 13 A -3 )
HIS( 13 A -2 )
HIS( 13 A -1 )
HIS( 13 A 0 )
GLU( 14 A-197 )
ASP( 14 A-196 )
PRO( 14 A-195 )
GLU( 14 A-194 )
ASP( 14 A-193 )
PRO( 14 A-192 )
PHE( 14 A-191 )
THR( 14 A-190 )
ARG( 14 A-189 )
TYR( 14 A-188 )
ALA( 14 A-187 )
LEU( 14 A-186 )
ALA( 14 A-185 )
GLN( 14 A-184 )
GLU( 14 A-183 )
HIS( 14 A-182 )
LEU( 14 A-181 )
LYS( 14 A-180 )
HIS( 14 A-179 )
ASP( 14 A-178 )
ASN( 14 A-177 )
ALA( 14 A-176 )
SER( 14 A-175 )
ARG( 14 A-174 )
ALA( 14 A-173 )
LEU( 14 A-172 )
ALA( 14 A-171 )
LEU( 14 A-170 )
PHE( 14 A-169 )
GLU( 14 A-168 )
GLU( 14 A-167 )
LEU( 14 A-166 )
VAL( 14 A-165 )
GLU( 14 A-164 )
THR( 14 A-163 )
ASP( 14 A-162 )
PRO( 14 A-161 )
ASP( 14 A-160 )
TYR( 14 A-159 )
VAL( 14 A-158 )
GLY( 14 A-157 )
THR( 14 A-156 )
TYR( 14 A-155 )
TYR( 14 A-154 )
HIS( 14 A-153 )
LEU( 14 A-152 )
GLY( 14 A-151 )
LYS( 14 A-150 )
LEU( 14 A-149 )
TYR( 14 A-148 )
GLU( 14 A-147 )
ARG( 14 A-146 )
LEU( 14 A-145 )
ASP( 14 A-144 )
ARG( 14 A-143 )
THR( 14 A-142 )
ASP( 14 A-141 )
ASP( 14 A-140 )
ALA( 14 A-139 )
ILE( 14 A-138 )
ASP( 14 A-137 )
THR( 14 A-136 )
TYR( 14 A-135 )
ALA( 14 A-134 )
GLN( 14 A-133 )
GLY( 14 A-132 )
ILE( 14 A-131 )
GLU( 14 A-130 )
VAL( 14 A-129 )
ALA( 14 A-128 )
ARG( 14 A-127 )
GLU( 14 A-126 )
GLU( 14 A-125 )
GLY( 14 A-124 )
THR( 14 A-123 )
GLN( 14 A-122 )
LYS( 14 A-121 )
ASP( 14 A-120 )
LEU( 14 A-119 )
SER( 14 A-118 )
GLU( 14 A-117 )
LEU( 14 A-116 )
GLN( 14 A-115 )
ASP( 14 A-114 )
ALA( 14 A-113 )
LYS( 14 A-112 )
LEU( 14 A-111 )
LYS( 14 A-110 )
ALA( 14 A-109 )
GLU( 14 A-108 )
GLY( 14 A-107 )
LEU( 14 A-106 )
GLU( 14 A-105 )
HIS( 14 A-104 )
HIS( 14 A-103 )
HIS( 14 A-102 )
HIS( 14 A-101 )
HIS( 14 A-100 )
HIS( 14 A -99 )
GLU( 14 A -98 )
ASP( 14 A -97 )
PRO( 14 A -96 )
GLU( 14 A -95 )
ASP( 14 A -94 )
PRO( 14 A -93 )
PHE( 14 A -92 )
THR( 14 A -91 )
ARG( 14 A -90 )
TYR( 14 A -89 )
ALA( 14 A -88 )
LEU( 14 A -87 )
ALA( 14 A -86 )
GLN( 14 A -85 )
GLU( 14 A -84 )
HIS( 14 A -83 )
LEU( 14 A -82 )
LYS( 14 A -81 )
HIS( 14 A -80 )
ASP( 14 A -79 )
ASN( 14 A -78 )
ALA( 14 A -77 )
SER( 14 A -76 )
ARG( 14 A -75 )
ALA( 14 A -74 )
LEU( 14 A -73 )
ALA( 14 A -72 )
LEU( 14 A -71 )
PHE( 14 A -70 )
GLU( 14 A -69 )
GLU( 14 A -68 )
LEU( 14 A -67 )
VAL( 14 A -66 )
GLU( 14 A -65 )
THR( 14 A -64 )
ASP( 14 A -63 )
PRO( 14 A -62 )
ASP( 14 A -61 )
TYR( 14 A -60 )
VAL( 14 A -59 )
GLY( 14 A -58 )
THR( 14 A -57 )
TYR( 14 A -56 )
TYR( 14 A -55 )
HIS( 14 A -54 )
LEU( 14 A -53 )
GLY( 14 A -52 )
LYS( 14 A -51 )
LEU( 14 A -50 )
TYR( 14 A -49 )
GLU( 14 A -48 )
ARG( 14 A -47 )
LEU( 14 A -46 )
ASP( 14 A -45 )
ARG( 14 A -44 )
THR( 14 A -43 )
ASP( 14 A -42 )
ASP( 14 A -41 )
ALA( 14 A -40 )
ILE( 14 A -39 )
ASP( 14 A -38 )
THR( 14 A -37 )
TYR( 14 A -36 )
ALA( 14 A -35 )
GLN( 14 A -34 )
GLY( 14 A -33 )
ILE( 14 A -32 )
GLU( 14 A -31 )
VAL( 14 A -30 )
ALA( 14 A -29 )
ARG( 14 A -28 )
GLU( 14 A -27 )
GLU( 14 A -26 )
GLY( 14 A -25 )
THR( 14 A -24 )
GLN( 14 A -23 )
LYS( 14 A -22 )
ASP( 14 A -21 )
LEU( 14 A -20 )
SER( 14 A -19 )
GLU( 14 A -18 )
LEU( 14 A -17 )
GLN( 14 A -16 )
ASP( 14 A -15 )
ALA( 14 A -14 )
LYS( 14 A -13 )
LEU( 14 A -12 )
LYS( 14 A -11 )
ALA( 14 A -10 )
GLU( 14 A -9 )
GLY( 14 A -8 )
LEU( 14 A -7 )
GLU( 14 A -6 )
HIS( 14 A -5 )
HIS( 14 A -4 )
HIS( 14 A -3 )
HIS( 14 A -2 )
HIS( 14 A -1 )
HIS( 14 A 0 )
GLU( 15 A-197 )
ASP( 15 A-196 )
PRO( 15 A-195 )
GLU( 15 A-194 )
ASP( 15 A-193 )
PRO( 15 A-192 )
PHE( 15 A-191 )
THR( 15 A-190 )
ARG( 15 A-189 )
TYR( 15 A-188 )
ALA( 15 A-187 )
LEU( 15 A-186 )
ALA( 15 A-185 )
GLN( 15 A-184 )
GLU( 15 A-183 )
HIS( 15 A-182 )
LEU( 15 A-181 )
LYS( 15 A-180 )
HIS( 15 A-179 )
ASP( 15 A-178 )
ASN( 15 A-177 )
ALA( 15 A-176 )
SER( 15 A-175 )
ARG( 15 A-174 )
ALA( 15 A-173 )
LEU( 15 A-172 )
ALA( 15 A-171 )
LEU( 15 A-170 )
PHE( 15 A-169 )
GLU( 15 A-168 )
GLU( 15 A-167 )
LEU( 15 A-166 )
VAL( 15 A-165 )
GLU( 15 A-164 )
THR( 15 A-163 )
ASP( 15 A-162 )
PRO( 15 A-161 )
ASP( 15 A-160 )
TYR( 15 A-159 )
VAL( 15 A-158 )
GLY( 15 A-157 )
THR( 15 A-156 )
TYR( 15 A-155 )
TYR( 15 A-154 )
HIS( 15 A-153 )
LEU( 15 A-152 )
GLY( 15 A-151 )
LYS( 15 A-150 )
LEU( 15 A-149 )
TYR( 15 A-148 )
GLU( 15 A-147 )
ARG( 15 A-146 )
LEU( 15 A-145 )
ASP( 15 A-144 )
ARG( 15 A-143 )
THR( 15 A-142 )
ASP( 15 A-141 )
ASP( 15 A-140 )
ALA( 15 A-139 )
ILE( 15 A-138 )
ASP( 15 A-137 )
THR( 15 A-136 )
TYR( 15 A-135 )
ALA( 15 A-134 )
GLN( 15 A-133 )
GLY( 15 A-132 )
ILE( 15 A-131 )
GLU( 15 A-130 )
VAL( 15 A-129 )
ALA( 15 A-128 )
ARG( 15 A-127 )
GLU( 15 A-126 )
GLU( 15 A-125 )
GLY( 15 A-124 )
THR( 15 A-123 )
GLN( 15 A-122 )
LYS( 15 A-121 )
ASP( 15 A-120 )
LEU( 15 A-119 )
SER( 15 A-118 )
GLU( 15 A-117 )
LEU( 15 A-116 )
GLN( 15 A-115 )
ASP( 15 A-114 )
ALA( 15 A-113 )
LYS( 15 A-112 )
LEU( 15 A-111 )
LYS( 15 A-110 )
ALA( 15 A-109 )
GLU( 15 A-108 )
GLY( 15 A-107 )
LEU( 15 A-106 )
GLU( 15 A-105 )
HIS( 15 A-104 )
HIS( 15 A-103 )
HIS( 15 A-102 )
HIS( 15 A-101 )
HIS( 15 A-100 )
HIS( 15 A -99 )
GLU( 15 A -98 )
ASP( 15 A -97 )
PRO( 15 A -96 )
GLU( 15 A -95 )
ASP( 15 A -94 )
PRO( 15 A -93 )
PHE( 15 A -92 )
THR( 15 A -91 )
ARG( 15 A -90 )
TYR( 15 A -89 )
ALA( 15 A -88 )
LEU( 15 A -87 )
ALA( 15 A -86 )
GLN( 15 A -85 )
GLU( 15 A -84 )
HIS( 15 A -83 )
LEU( 15 A -82 )
LYS( 15 A -81 )
HIS( 15 A -80 )
ASP( 15 A -79 )
ASN( 15 A -78 )
ALA( 15 A -77 )
SER( 15 A -76 )
ARG( 15 A -75 )
ALA( 15 A -74 )
LEU( 15 A -73 )
ALA( 15 A -72 )
LEU( 15 A -71 )
PHE( 15 A -70 )
GLU( 15 A -69 )
GLU( 15 A -68 )
LEU( 15 A -67 )
VAL( 15 A -66 )
GLU( 15 A -65 )
THR( 15 A -64 )
ASP( 15 A -63 )
PRO( 15 A -62 )
ASP( 15 A -61 )
TYR( 15 A -60 )
VAL( 15 A -59 )
GLY( 15 A -58 )
THR( 15 A -57 )
TYR( 15 A -56 )
TYR( 15 A -55 )
HIS( 15 A -54 )
LEU( 15 A -53 )
GLY( 15 A -52 )
LYS( 15 A -51 )
LEU( 15 A -50 )
TYR( 15 A -49 )
GLU( 15 A -48 )
ARG( 15 A -47 )
LEU( 15 A -46 )
ASP( 15 A -45 )
ARG( 15 A -44 )
THR( 15 A -43 )
ASP( 15 A -42 )
ASP( 15 A -41 )
ALA( 15 A -40 )
ILE( 15 A -39 )
ASP( 15 A -38 )
THR( 15 A -37 )
TYR( 15 A -36 )
ALA( 15 A -35 )
GLN( 15 A -34 )
GLY( 15 A -33 )
ILE( 15 A -32 )
GLU( 15 A -31 )
VAL( 15 A -30 )
ALA( 15 A -29 )
ARG( 15 A -28 )
GLU( 15 A -27 )
GLU( 15 A -26 )
GLY( 15 A -25 )
THR( 15 A -24 )
GLN( 15 A -23 )
LYS( 15 A -22 )
ASP( 15 A -21 )
LEU( 15 A -20 )
SER( 15 A -19 )
GLU( 15 A -18 )
LEU( 15 A -17 )
GLN( 15 A -16 )
ASP( 15 A -15 )
ALA( 15 A -14 )
LYS( 15 A -13 )
LEU( 15 A -12 )
LYS( 15 A -11 )
ALA( 15 A -10 )
GLU( 15 A -9 )
GLY( 15 A -8 )
LEU( 15 A -7 )
GLU( 15 A -6 )
HIS( 15 A -5 )
HIS( 15 A -4 )
HIS( 15 A -3 )
HIS( 15 A -2 )
HIS( 15 A -1 )
HIS( 15 A 0 )
GLU( 16 A-197 )
ASP( 16 A-196 )
PRO( 16 A-195 )
GLU( 16 A-194 )
ASP( 16 A-193 )
PRO( 16 A-192 )
PHE( 16 A-191 )
THR( 16 A-190 )
ARG( 16 A-189 )
TYR( 16 A-188 )
ALA( 16 A-187 )
LEU( 16 A-186 )
ALA( 16 A-185 )
GLN( 16 A-184 )
GLU( 16 A-183 )
HIS( 16 A-182 )
LEU( 16 A-181 )
LYS( 16 A-180 )
HIS( 16 A-179 )
ASP( 16 A-178 )
ASN( 16 A-177 )
ALA( 16 A-176 )
SER( 16 A-175 )
ARG( 16 A-174 )
ALA( 16 A-173 )
LEU( 16 A-172 )
ALA( 16 A-171 )
LEU( 16 A-170 )
PHE( 16 A-169 )
GLU( 16 A-168 )
GLU( 16 A-167 )
LEU( 16 A-166 )
VAL( 16 A-165 )
GLU( 16 A-164 )
THR( 16 A-163 )
ASP( 16 A-162 )
PRO( 16 A-161 )
ASP( 16 A-160 )
TYR( 16 A-159 )
VAL( 16 A-158 )
GLY( 16 A-157 )
THR( 16 A-156 )
TYR( 16 A-155 )
TYR( 16 A-154 )
HIS( 16 A-153 )
LEU( 16 A-152 )
GLY( 16 A-151 )
LYS( 16 A-150 )
LEU( 16 A-149 )
TYR( 16 A-148 )
GLU( 16 A-147 )
ARG( 16 A-146 )
LEU( 16 A-145 )
ASP( 16 A-144 )
ARG( 16 A-143 )
THR( 16 A-142 )
ASP( 16 A-141 )
ASP( 16 A-140 )
ALA( 16 A-139 )
ILE( 16 A-138 )
ASP( 16 A-137 )
THR( 16 A-136 )
TYR( 16 A-135 )
ALA( 16 A-134 )
GLN( 16 A-133 )
GLY( 16 A-132 )
ILE( 16 A-131 )
GLU( 16 A-130 )
VAL( 16 A-129 )
ALA( 16 A-128 )
ARG( 16 A-127 )
GLU( 16 A-126 )
GLU( 16 A-125 )
GLY( 16 A-124 )
THR( 16 A-123 )
GLN( 16 A-122 )
LYS( 16 A-121 )
ASP( 16 A-120 )
LEU( 16 A-119 )
SER( 16 A-118 )
GLU( 16 A-117 )
LEU( 16 A-116 )
GLN( 16 A-115 )
ASP( 16 A-114 )
ALA( 16 A-113 )
LYS( 16 A-112 )
LEU( 16 A-111 )
LYS( 16 A-110 )
ALA( 16 A-109 )
GLU( 16 A-108 )
GLY( 16 A-107 )
LEU( 16 A-106 )
GLU( 16 A-105 )
HIS( 16 A-104 )
HIS( 16 A-103 )
HIS( 16 A-102 )
HIS( 16 A-101 )
HIS( 16 A-100 )
HIS( 16 A -99 )
GLU( 16 A -98 )
ASP( 16 A -97 )
PRO( 16 A -96 )
GLU( 16 A -95 )
ASP( 16 A -94 )
PRO( 16 A -93 )
PHE( 16 A -92 )
THR( 16 A -91 )
ARG( 16 A -90 )
TYR( 16 A -89 )
ALA( 16 A -88 )
LEU( 16 A -87 )
ALA( 16 A -86 )
GLN( 16 A -85 )
GLU( 16 A -84 )
HIS( 16 A -83 )
LEU( 16 A -82 )
LYS( 16 A -81 )
HIS( 16 A -80 )
ASP( 16 A -79 )
ASN( 16 A -78 )
ALA( 16 A -77 )
SER( 16 A -76 )
ARG( 16 A -75 )
ALA( 16 A -74 )
LEU( 16 A -73 )
ALA( 16 A -72 )
LEU( 16 A -71 )
PHE( 16 A -70 )
GLU( 16 A -69 )
GLU( 16 A -68 )
LEU( 16 A -67 )
VAL( 16 A -66 )
GLU( 16 A -65 )
THR( 16 A -64 )
ASP( 16 A -63 )
PRO( 16 A -62 )
ASP( 16 A -61 )
TYR( 16 A -60 )
VAL( 16 A -59 )
GLY( 16 A -58 )
THR( 16 A -57 )
TYR( 16 A -56 )
TYR( 16 A -55 )
HIS( 16 A -54 )
LEU( 16 A -53 )
GLY( 16 A -52 )
LYS( 16 A -51 )
LEU( 16 A -50 )
TYR( 16 A -49 )
GLU( 16 A -48 )
ARG( 16 A -47 )
LEU( 16 A -46 )
ASP( 16 A -45 )
ARG( 16 A -44 )
THR( 16 A -43 )
ASP( 16 A -42 )
ASP( 16 A -41 )
ALA( 16 A -40 )
ILE( 16 A -39 )
ASP( 16 A -38 )
THR( 16 A -37 )
TYR( 16 A -36 )
ALA( 16 A -35 )
GLN( 16 A -34 )
GLY( 16 A -33 )
ILE( 16 A -32 )
GLU( 16 A -31 )
VAL( 16 A -30 )
ALA( 16 A -29 )
ARG( 16 A -28 )
GLU( 16 A -27 )
GLU( 16 A -26 )
GLY( 16 A -25 )
THR( 16 A -24 )
GLN( 16 A -23 )
LYS( 16 A -22 )
ASP( 16 A -21 )
LEU( 16 A -20 )
SER( 16 A -19 )
GLU( 16 A -18 )
LEU( 16 A -17 )
GLN( 16 A -16 )
ASP( 16 A -15 )
ALA( 16 A -14 )
LYS( 16 A -13 )
LEU( 16 A -12 )
LYS( 16 A -11 )
ALA( 16 A -10 )
GLU( 16 A -9 )
GLY( 16 A -8 )
LEU( 16 A -7 )
GLU( 16 A -6 )
HIS( 16 A -5 )
HIS( 16 A -4 )
HIS( 16 A -3 )
HIS( 16 A -2 )
HIS( 16 A -1 )
HIS( 16 A 0 )
GLU( 17 A-197 )
ASP( 17 A-196 )
PRO( 17 A-195 )
GLU( 17 A-194 )
ASP( 17 A-193 )
PRO( 17 A-192 )
PHE( 17 A-191 )
THR( 17 A-190 )
ARG( 17 A-189 )
TYR( 17 A-188 )
ALA( 17 A-187 )
LEU( 17 A-186 )
ALA( 17 A-185 )
GLN( 17 A-184 )
GLU( 17 A-183 )
HIS( 17 A-182 )
LEU( 17 A-181 )
LYS( 17 A-180 )
HIS( 17 A-179 )
ASP( 17 A-178 )
ASN( 17 A-177 )
ALA( 17 A-176 )
SER( 17 A-175 )
ARG( 17 A-174 )
ALA( 17 A-173 )
LEU( 17 A-172 )
ALA( 17 A-171 )
LEU( 17 A-170 )
PHE( 17 A-169 )
GLU( 17 A-168 )
GLU( 17 A-167 )
LEU( 17 A-166 )
VAL( 17 A-165 )
GLU( 17 A-164 )
THR( 17 A-163 )
ASP( 17 A-162 )
PRO( 17 A-161 )
ASP( 17 A-160 )
TYR( 17 A-159 )
VAL( 17 A-158 )
GLY( 17 A-157 )
THR( 17 A-156 )
TYR( 17 A-155 )
TYR( 17 A-154 )
HIS( 17 A-153 )
LEU( 17 A-152 )
GLY( 17 A-151 )
LYS( 17 A-150 )
LEU( 17 A-149 )
TYR( 17 A-148 )
GLU( 17 A-147 )
ARG( 17 A-146 )
LEU( 17 A-145 )
ASP( 17 A-144 )
ARG( 17 A-143 )
THR( 17 A-142 )
ASP( 17 A-141 )
ASP( 17 A-140 )
ALA( 17 A-139 )
ILE( 17 A-138 )
ASP( 17 A-137 )
THR( 17 A-136 )
TYR( 17 A-135 )
ALA( 17 A-134 )
GLN( 17 A-133 )
GLY( 17 A-132 )
ILE( 17 A-131 )
GLU( 17 A-130 )
VAL( 17 A-129 )
ALA( 17 A-128 )
ARG( 17 A-127 )
GLU( 17 A-126 )
GLU( 17 A-125 )
GLY( 17 A-124 )
THR( 17 A-123 )
GLN( 17 A-122 )
LYS( 17 A-121 )
ASP( 17 A-120 )
LEU( 17 A-119 )
SER( 17 A-118 )
GLU( 17 A-117 )
LEU( 17 A-116 )
GLN( 17 A-115 )
ASP( 17 A-114 )
ALA( 17 A-113 )
LYS( 17 A-112 )
LEU( 17 A-111 )
LYS( 17 A-110 )
ALA( 17 A-109 )
GLU( 17 A-108 )
GLY( 17 A-107 )
LEU( 17 A-106 )
GLU( 17 A-105 )
HIS( 17 A-104 )
HIS( 17 A-103 )
HIS( 17 A-102 )
HIS( 17 A-101 )
HIS( 17 A-100 )
HIS( 17 A -99 )
GLU( 17 A -98 )
ASP( 17 A -97 )
PRO( 17 A -96 )
GLU( 17 A -95 )
ASP( 17 A -94 )
PRO( 17 A -93 )
PHE( 17 A -92 )
THR( 17 A -91 )
ARG( 17 A -90 )
TYR( 17 A -89 )
ALA( 17 A -88 )
LEU( 17 A -87 )
ALA( 17 A -86 )
GLN( 17 A -85 )
GLU( 17 A -84 )
HIS( 17 A -83 )
LEU( 17 A -82 )
LYS( 17 A -81 )
HIS( 17 A -80 )
ASP( 17 A -79 )
ASN( 17 A -78 )
ALA( 17 A -77 )
SER( 17 A -76 )
ARG( 17 A -75 )
ALA( 17 A -74 )
LEU( 17 A -73 )
ALA( 17 A -72 )
LEU( 17 A -71 )
PHE( 17 A -70 )
GLU( 17 A -69 )
GLU( 17 A -68 )
LEU( 17 A -67 )
VAL( 17 A -66 )
GLU( 17 A -65 )
THR( 17 A -64 )
ASP( 17 A -63 )
PRO( 17 A -62 )
ASP( 17 A -61 )
TYR( 17 A -60 )
VAL( 17 A -59 )
GLY( 17 A -58 )
THR( 17 A -57 )
TYR( 17 A -56 )
TYR( 17 A -55 )
HIS( 17 A -54 )
LEU( 17 A -53 )
GLY( 17 A -52 )
LYS( 17 A -51 )
LEU( 17 A -50 )
TYR( 17 A -49 )
GLU( 17 A -48 )
ARG( 17 A -47 )
LEU( 17 A -46 )
ASP( 17 A -45 )
ARG( 17 A -44 )
THR( 17 A -43 )
ASP( 17 A -42 )
ASP( 17 A -41 )
ALA( 17 A -40 )
ILE( 17 A -39 )
ASP( 17 A -38 )
THR( 17 A -37 )
TYR( 17 A -36 )
ALA( 17 A -35 )
GLN( 17 A -34 )
GLY( 17 A -33 )
ILE( 17 A -32 )
GLU( 17 A -31 )
VAL( 17 A -30 )
ALA( 17 A -29 )
ARG( 17 A -28 )
GLU( 17 A -27 )
GLU( 17 A -26 )
GLY( 17 A -25 )
THR( 17 A -24 )
GLN( 17 A -23 )
LYS( 17 A -22 )
ASP( 17 A -21 )
LEU( 17 A -20 )
SER( 17 A -19 )
GLU( 17 A -18 )
LEU( 17 A -17 )
GLN( 17 A -16 )
ASP( 17 A -15 )
ALA( 17 A -14 )
LYS( 17 A -13 )
LEU( 17 A -12 )
LYS( 17 A -11 )
ALA( 17 A -10 )
GLU( 17 A -9 )
GLY( 17 A -8 )
LEU( 17 A -7 )
GLU( 17 A -6 )
HIS( 17 A -5 )
HIS( 17 A -4 )
HIS( 17 A -3 )
HIS( 17 A -2 )
HIS( 17 A -1 )
HIS( 17 A 0 )
GLU( 18 A-197 )
ASP( 18 A-196 )
PRO( 18 A-195 )
GLU( 18 A-194 )
ASP( 18 A-193 )
PRO( 18 A-192 )
PHE( 18 A-191 )
THR( 18 A-190 )
ARG( 18 A-189 )
TYR( 18 A-188 )
ALA( 18 A-187 )
LEU( 18 A-186 )
ALA( 18 A-185 )
GLN( 18 A-184 )
GLU( 18 A-183 )
HIS( 18 A-182 )
LEU( 18 A-181 )
LYS( 18 A-180 )
HIS( 18 A-179 )
ASP( 18 A-178 )
ASN( 18 A-177 )
ALA( 18 A-176 )
SER( 18 A-175 )
ARG( 18 A-174 )
ALA( 18 A-173 )
LEU( 18 A-172 )
ALA( 18 A-171 )
LEU( 18 A-170 )
PHE( 18 A-169 )
GLU( 18 A-168 )
GLU( 18 A-167 )
LEU( 18 A-166 )
VAL( 18 A-165 )
GLU( 18 A-164 )
THR( 18 A-163 )
ASP( 18 A-162 )
PRO( 18 A-161 )
ASP( 18 A-160 )
TYR( 18 A-159 )
VAL( 18 A-158 )
GLY( 18 A-157 )
THR( 18 A-156 )
TYR( 18 A-155 )
TYR( 18 A-154 )
HIS( 18 A-153 )
LEU( 18 A-152 )
GLY( 18 A-151 )
LYS( 18 A-150 )
LEU( 18 A-149 )
TYR( 18 A-148 )
GLU( 18 A-147 )
ARG( 18 A-146 )
LEU( 18 A-145 )
ASP( 18 A-144 )
ARG( 18 A-143 )
THR( 18 A-142 )
ASP( 18 A-141 )
ASP( 18 A-140 )
ALA( 18 A-139 )
ILE( 18 A-138 )
ASP( 18 A-137 )
THR( 18 A-136 )
TYR( 18 A-135 )
ALA( 18 A-134 )
GLN( 18 A-133 )
GLY( 18 A-132 )
ILE( 18 A-131 )
GLU( 18 A-130 )
VAL( 18 A-129 )
ALA( 18 A-128 )
ARG( 18 A-127 )
GLU( 18 A-126 )
GLU( 18 A-125 )
GLY( 18 A-124 )
THR( 18 A-123 )
GLN( 18 A-122 )
LYS( 18 A-121 )
ASP( 18 A-120 )
LEU( 18 A-119 )
SER( 18 A-118 )
GLU( 18 A-117 )
LEU( 18 A-116 )
GLN( 18 A-115 )
ASP( 18 A-114 )
ALA( 18 A-113 )
LYS( 18 A-112 )
LEU( 18 A-111 )
LYS( 18 A-110 )
ALA( 18 A-109 )
GLU( 18 A-108 )
GLY( 18 A-107 )
LEU( 18 A-106 )
GLU( 18 A-105 )
HIS( 18 A-104 )
HIS( 18 A-103 )
HIS( 18 A-102 )
HIS( 18 A-101 )
HIS( 18 A-100 )
HIS( 18 A -99 )
GLU( 18 A -98 )
ASP( 18 A -97 )
PRO( 18 A -96 )
GLU( 18 A -95 )
ASP( 18 A -94 )
PRO( 18 A -93 )
PHE( 18 A -92 )
THR( 18 A -91 )
ARG( 18 A -90 )
TYR( 18 A -89 )
ALA( 18 A -88 )
LEU( 18 A -87 )
ALA( 18 A -86 )
GLN( 18 A -85 )
GLU( 18 A -84 )
HIS( 18 A -83 )
LEU( 18 A -82 )
LYS( 18 A -81 )
HIS( 18 A -80 )
ASP( 18 A -79 )
ASN( 18 A -78 )
ALA( 18 A -77 )
SER( 18 A -76 )
ARG( 18 A -75 )
ALA( 18 A -74 )
LEU( 18 A -73 )
ALA( 18 A -72 )
LEU( 18 A -71 )
PHE( 18 A -70 )
GLU( 18 A -69 )
GLU( 18 A -68 )
LEU( 18 A -67 )
VAL( 18 A -66 )
GLU( 18 A -65 )
THR( 18 A -64 )
ASP( 18 A -63 )
PRO( 18 A -62 )
ASP( 18 A -61 )
TYR( 18 A -60 )
VAL( 18 A -59 )
GLY( 18 A -58 )
THR( 18 A -57 )
TYR( 18 A -56 )
TYR( 18 A -55 )
HIS( 18 A -54 )
LEU( 18 A -53 )
GLY( 18 A -52 )
LYS( 18 A -51 )
LEU( 18 A -50 )
TYR( 18 A -49 )
GLU( 18 A -48 )
ARG( 18 A -47 )
LEU( 18 A -46 )
ASP( 18 A -45 )
ARG( 18 A -44 )
THR( 18 A -43 )
ASP( 18 A -42 )
ASP( 18 A -41 )
ALA( 18 A -40 )
ILE( 18 A -39 )
ASP( 18 A -38 )
THR( 18 A -37 )
TYR( 18 A -36 )
ALA( 18 A -35 )
GLN( 18 A -34 )
GLY( 18 A -33 )
ILE( 18 A -32 )
GLU( 18 A -31 )
VAL( 18 A -30 )
ALA( 18 A -29 )
ARG( 18 A -28 )
GLU( 18 A -27 )
GLU( 18 A -26 )
GLY( 18 A -25 )
THR( 18 A -24 )
GLN( 18 A -23 )
LYS( 18 A -22 )
ASP( 18 A -21 )
LEU( 18 A -20 )
SER( 18 A -19 )
GLU( 18 A -18 )
LEU( 18 A -17 )
GLN( 18 A -16 )
ASP( 18 A -15 )
ALA( 18 A -14 )
LYS( 18 A -13 )
LEU( 18 A -12 )
LYS( 18 A -11 )
ALA( 18 A -10 )
GLU( 18 A -9 )
GLY( 18 A -8 )
LEU( 18 A -7 )
GLU( 18 A -6 )
HIS( 18 A -5 )
HIS( 18 A -4 )
HIS( 18 A -3 )
HIS( 18 A -2 )
HIS( 18 A -1 )
HIS( 18 A 0 )
GLU( 19 A-197 )
ASP( 19 A-196 )
PRO( 19 A-195 )
GLU( 19 A-194 )
ASP( 19 A-193 )
PRO( 19 A-192 )
PHE( 19 A-191 )
THR( 19 A-190 )
ARG( 19 A-189 )
TYR( 19 A-188 )
ALA( 19 A-187 )
LEU( 19 A-186 )
ALA( 19 A-185 )
GLN( 19 A-184 )
GLU( 19 A-183 )
HIS( 19 A-182 )
LEU( 19 A-181 )
LYS( 19 A-180 )
HIS( 19 A-179 )
ASP( 19 A-178 )
ASN( 19 A-177 )
ALA( 19 A-176 )
SER( 19 A-175 )
ARG( 19 A-174 )
ALA( 19 A-173 )
LEU( 19 A-172 )
ALA( 19 A-171 )
LEU( 19 A-170 )
PHE( 19 A-169 )
GLU( 19 A-168 )
GLU( 19 A-167 )
LEU( 19 A-166 )
VAL( 19 A-165 )
GLU( 19 A-164 )
THR( 19 A-163 )
ASP( 19 A-162 )
PRO( 19 A-161 )
ASP( 19 A-160 )
TYR( 19 A-159 )
VAL( 19 A-158 )
GLY( 19 A-157 )
THR( 19 A-156 )
TYR( 19 A-155 )
TYR( 19 A-154 )
HIS( 19 A-153 )
LEU( 19 A-152 )
GLY( 19 A-151 )
LYS( 19 A-150 )
LEU( 19 A-149 )
TYR( 19 A-148 )
GLU( 19 A-147 )
ARG( 19 A-146 )
LEU( 19 A-145 )
ASP( 19 A-144 )
ARG( 19 A-143 )
THR( 19 A-142 )
ASP( 19 A-141 )
ASP( 19 A-140 )
ALA( 19 A-139 )
ILE( 19 A-138 )
ASP( 19 A-137 )
THR( 19 A-136 )
TYR( 19 A-135 )
ALA( 19 A-134 )
GLN( 19 A-133 )
GLY( 19 A-132 )
ILE( 19 A-131 )
GLU( 19 A-130 )
VAL( 19 A-129 )
ALA( 19 A-128 )
ARG( 19 A-127 )
GLU( 19 A-126 )
GLU( 19 A-125 )
GLY( 19 A-124 )
THR( 19 A-123 )
GLN( 19 A-122 )
LYS( 19 A-121 )
ASP( 19 A-120 )
LEU( 19 A-119 )
SER( 19 A-118 )
GLU( 19 A-117 )
LEU( 19 A-116 )
GLN( 19 A-115 )
ASP( 19 A-114 )
ALA( 19 A-113 )
LYS( 19 A-112 )
LEU( 19 A-111 )
LYS( 19 A-110 )
ALA( 19 A-109 )
GLU( 19 A-108 )
GLY( 19 A-107 )
LEU( 19 A-106 )
GLU( 19 A-105 )
HIS( 19 A-104 )
HIS( 19 A-103 )
HIS( 19 A-102 )
HIS( 19 A-101 )
HIS( 19 A-100 )
HIS( 19 A -99 )
GLU( 19 A -98 )
ASP( 19 A -97 )
PRO( 19 A -96 )
GLU( 19 A -95 )
ASP( 19 A -94 )
PRO( 19 A -93 )
PHE( 19 A -92 )
THR( 19 A -91 )
ARG( 19 A -90 )
TYR( 19 A -89 )
ALA( 19 A -88 )
LEU( 19 A -87 )
ALA( 19 A -86 )
GLN( 19 A -85 )
GLU( 19 A -84 )
HIS( 19 A -83 )
LEU( 19 A -82 )
LYS( 19 A -81 )
HIS( 19 A -80 )
ASP( 19 A -79 )
ASN( 19 A -78 )
ALA( 19 A -77 )
SER( 19 A -76 )
ARG( 19 A -75 )
ALA( 19 A -74 )
LEU( 19 A -73 )
ALA( 19 A -72 )
LEU( 19 A -71 )
PHE( 19 A -70 )
GLU( 19 A -69 )
GLU( 19 A -68 )
LEU( 19 A -67 )
VAL( 19 A -66 )
GLU( 19 A -65 )
THR( 19 A -64 )
ASP( 19 A -63 )
PRO( 19 A -62 )
ASP( 19 A -61 )
TYR( 19 A -60 )
VAL( 19 A -59 )
GLY( 19 A -58 )
THR( 19 A -57 )
TYR( 19 A -56 )
TYR( 19 A -55 )
HIS( 19 A -54 )
LEU( 19 A -53 )
GLY( 19 A -52 )
LYS( 19 A -51 )
LEU( 19 A -50 )
TYR( 19 A -49 )
GLU( 19 A -48 )
ARG( 19 A -47 )
LEU( 19 A -46 )
ASP( 19 A -45 )
ARG( 19 A -44 )
THR( 19 A -43 )
ASP( 19 A -42 )
ASP( 19 A -41 )
ALA( 19 A -40 )
ILE( 19 A -39 )
ASP( 19 A -38 )
THR( 19 A -37 )
TYR( 19 A -36 )
ALA( 19 A -35 )
GLN( 19 A -34 )
GLY( 19 A -33 )
ILE( 19 A -32 )
GLU( 19 A -31 )
VAL( 19 A -30 )
ALA( 19 A -29 )
ARG( 19 A -28 )
GLU( 19 A -27 )
GLU( 19 A -26 )
GLY( 19 A -25 )
THR( 19 A -24 )
GLN( 19 A -23 )
LYS( 19 A -22 )
ASP( 19 A -21 )
LEU( 19 A -20 )
SER( 19 A -19 )
GLU( 19 A -18 )
LEU( 19 A -17 )
GLN( 19 A -16 )
ASP( 19 A -15 )
ALA( 19 A -14 )
LYS( 19 A -13 )
LEU( 19 A -12 )
LYS( 19 A -11 )
ALA( 19 A -10 )
GLU( 19 A -9 )
GLY( 19 A -8 )
LEU( 19 A -7 )
GLU( 19 A -6 )
HIS( 19 A -5 )
HIS( 19 A -4 )
HIS( 19 A -3 )
HIS( 19 A -2 )
HIS( 19 A -1 )
HIS( 19 A 0 )
GLU( 20 A-197 )
ASP( 20 A-196 )
PRO( 20 A-195 )
GLU( 20 A-194 )
ASP( 20 A-193 )
PRO( 20 A-192 )
PHE( 20 A-191 )
THR( 20 A-190 )
ARG( 20 A-189 )
TYR( 20 A-188 )
ALA( 20 A-187 )
LEU( 20 A-186 )
ALA( 20 A-185 )
GLN( 20 A-184 )
GLU( 20 A-183 )
HIS( 20 A-182 )
LEU( 20 A-181 )
LYS( 20 A-180 )
HIS( 20 A-179 )
ASP( 20 A-178 )
ASN( 20 A-177 )
ALA( 20 A-176 )
SER( 20 A-175 )
ARG( 20 A-174 )
ALA( 20 A-173 )
LEU( 20 A-172 )
ALA( 20 A-171 )
LEU( 20 A-170 )
PHE( 20 A-169 )
GLU( 20 A-168 )
GLU( 20 A-167 )
LEU( 20 A-166 )
VAL( 20 A-165 )
GLU( 20 A-164 )
THR( 20 A-163 )
ASP( 20 A-162 )
PRO( 20 A-161 )
ASP( 20 A-160 )
TYR( 20 A-159 )
VAL( 20 A-158 )
GLY( 20 A-157 )
THR( 20 A-156 )
TYR( 20 A-155 )
TYR( 20 A-154 )
HIS( 20 A-153 )
LEU( 20 A-152 )
GLY( 20 A-151 )
LYS( 20 A-150 )
LEU( 20 A-149 )
TYR( 20 A-148 )
GLU( 20 A-147 )
ARG( 20 A-146 )
LEU( 20 A-145 )
ASP( 20 A-144 )
ARG( 20 A-143 )
THR( 20 A-142 )
ASP( 20 A-141 )
ASP( 20 A-140 )
ALA( 20 A-139 )
ILE( 20 A-138 )
ASP( 20 A-137 )
THR( 20 A-136 )
TYR( 20 A-135 )
ALA( 20 A-134 )
GLN( 20 A-133 )
GLY( 20 A-132 )
ILE( 20 A-131 )
GLU( 20 A-130 )
VAL( 20 A-129 )
ALA( 20 A-128 )
ARG( 20 A-127 )
GLU( 20 A-126 )
GLU( 20 A-125 )
GLY( 20 A-124 )
THR( 20 A-123 )
GLN( 20 A-122 )
LYS( 20 A-121 )
ASP( 20 A-120 )
LEU( 20 A-119 )
SER( 20 A-118 )
GLU( 20 A-117 )
LEU( 20 A-116 )
GLN( 20 A-115 )
ASP( 20 A-114 )
ALA( 20 A-113 )
LYS( 20 A-112 )
LEU( 20 A-111 )
LYS( 20 A-110 )
ALA( 20 A-109 )
GLU( 20 A-108 )
GLY( 20 A-107 )
LEU( 20 A-106 )
GLU( 20 A-105 )
HIS( 20 A-104 )
HIS( 20 A-103 )
HIS( 20 A-102 )
HIS( 20 A-101 )
HIS( 20 A-100 )
HIS( 20 A -99 )
GLU( 20 A -98 )
ASP( 20 A -97 )
PRO( 20 A -96 )
GLU( 20 A -95 )
ASP( 20 A -94 )
PRO( 20 A -93 )
PHE( 20 A -92 )
THR( 20 A -91 )
ARG( 20 A -90 )
TYR( 20 A -89 )
ALA( 20 A -88 )
LEU( 20 A -87 )
ALA( 20 A -86 )
GLN( 20 A -85 )
GLU( 20 A -84 )
HIS( 20 A -83 )
LEU( 20 A -82 )
LYS( 20 A -81 )
HIS( 20 A -80 )
ASP( 20 A -79 )
ASN( 20 A -78 )
ALA( 20 A -77 )
SER( 20 A -76 )
ARG( 20 A -75 )
ALA( 20 A -74 )
LEU( 20 A -73 )
ALA( 20 A -72 )
LEU( 20 A -71 )
PHE( 20 A -70 )
GLU( 20 A -69 )
GLU( 20 A -68 )
LEU( 20 A -67 )
VAL( 20 A -66 )
GLU( 20 A -65 )
THR( 20 A -64 )
ASP( 20 A -63 )
PRO( 20 A -62 )
ASP( 20 A -61 )
TYR( 20 A -60 )
VAL( 20 A -59 )
GLY( 20 A -58 )
THR( 20 A -57 )
TYR( 20 A -56 )
TYR( 20 A -55 )
HIS( 20 A -54 )
LEU( 20 A -53 )
GLY( 20 A -52 )
LYS( 20 A -51 )
LEU( 20 A -50 )
TYR( 20 A -49 )
GLU( 20 A -48 )
ARG( 20 A -47 )
LEU( 20 A -46 )
ASP( 20 A -45 )
ARG( 20 A -44 )
THR( 20 A -43 )
ASP( 20 A -42 )
ASP( 20 A -41 )
ALA( 20 A -40 )
ILE( 20 A -39 )
ASP( 20 A -38 )
THR( 20 A -37 )
TYR( 20 A -36 )
ALA( 20 A -35 )
GLN( 20 A -34 )
GLY( 20 A -33 )
ILE( 20 A -32 )
GLU( 20 A -31 )
VAL( 20 A -30 )
ALA( 20 A -29 )
ARG( 20 A -28 )
GLU( 20 A -27 )
GLU( 20 A -26 )
GLY( 20 A -25 )
THR( 20 A -24 )
GLN( 20 A -23 )
LYS( 20 A -22 )
ASP( 20 A -21 )
LEU( 20 A -20 )
SER( 20 A -19 )
GLU( 20 A -18 )
LEU( 20 A -17 )
GLN( 20 A -16 )
ASP( 20 A -15 )
ALA( 20 A -14 )
LYS( 20 A -13 )
LEU( 20 A -12 )
LYS( 20 A -11 )
ALA( 20 A -10 )
GLU( 20 A -9 )
GLY( 20 A -8 )
LEU( 20 A -7 )
GLU( 20 A -6 )
HIS( 20 A -5 )
HIS( 20 A -4 )
HIS( 20 A -3 )
HIS( 20 A -2 )
HIS( 20 A -1 )
HIS( 20 A 0 )
PDB Chain_ID: A
1 15
SEQRES: GLU ASP PRO GLU ASP PRO PHE THR ARG TYR ALA LEU ALA GLN GLU
COORDS: ... ... ... ... ... ... ... ... ... ... ... ... ... ... ...
16 30
SEQRES: HIS LEU LYS HIS ASP ASN ALA SER ARG ALA LEU ALA LEU PHE GLU
COORDS: ... ... ... ... ... ... ... ... ... ... ... ... ... ... ...
31 45
SEQRES: GLU LEU VAL GLU THR ASP PRO ASP TYR VAL GLY THR TYR TYR HIS
COORDS: ... ... ... ... ... ... ... ... ... ... ... ... ... ... ...
46 60
SEQRES: LEU GLY LYS LEU TYR GLU ARG LEU ASP ARG THR ASP ASP ALA ILE
COORDS: ... ... ... ... ... ... ... ... ... ... ... ... ... ... ...
61 75
SEQRES: ASP THR TYR ALA GLN GLY ILE GLU VAL ALA ARG GLU GLU GLY THR
COORDS: ... ... ... ... ... ... ... ... ... ... ... ... ... ... ...
76 90
SEQRES: GLN LYS ASP LEU SER GLU LEU GLN ASP ALA LYS LEU LYS ALA GLU
COORDS: ... ... ... ... ... ... ... ... ... ... ... ... ... ... ...
91 105
SEQRES: GLY LEU GLU HIS HIS HIS HIS HIS HIS GLU ASP PRO GLU ASP PRO
COORDS: ... ... ... ... ... ... ... ... ... ... ... ... ... ... ...
106 120
SEQRES: PHE THR ARG TYR ALA LEU ALA GLN GLU HIS LEU LYS HIS ASP ASN
COORDS: ... ... ... ... ... ... ... ... ... ... ... ... ... ... ...
121 135
SEQRES: ALA SER ARG ALA LEU ALA LEU PHE GLU GLU LEU VAL GLU THR ASP
COORDS: ... ... ... ... ... ... ... ... ... ... ... ... ... ... ...
136 150
SEQRES: PRO ASP TYR VAL GLY THR TYR TYR HIS LEU GLY LYS LEU TYR GLU
COORDS: ... ... ... ... ... ... ... ... ... ... ... ... ... ... ...
151 165
SEQRES: ARG LEU ASP ARG THR ASP ASP ALA ILE ASP THR TYR ALA GLN GLY
COORDS: ... ... ... ... ... ... ... ... ... ... ... ... ... ... ...
166 180
SEQRES: ILE GLU VAL ALA ARG GLU GLU GLY THR GLN LYS ASP LEU SER GLU
COORDS: ... ... ... ... ... ... ... ... ... ... ... ... ... ... ...
181 195
SEQRES: LEU GLN ASP ALA LYS LEU LYS ALA GLU GLY LEU GLU HIS HIS HIS
COORDS: ... ... ... ... ... ... ... ... ... ... ... ... ... ... ...
196 210
SEQRES: HIS HIS HIS GLU ASP PRO GLU ASP PRO PHE THR ARG TYR ALA LEU
COORDS: ... ... ... GLU ASP PRO GLU ASP PRO PHE THR ARG TYR ALA LEU
1 12
211 225
SEQRES: ALA GLN GLU HIS LEU LYS HIS ASP ASN ALA SER ARG ALA LEU ALA
COORDS: ALA GLN GLU HIS LEU LYS HIS ASP ASN ALA SER ARG ALA LEU ALA
13 27
226 240
SEQRES: LEU PHE GLU GLU LEU VAL GLU THR ASP PRO ASP TYR VAL GLY THR
COORDS: LEU PHE GLU GLU LEU VAL GLU THR ASP PRO ASP TYR VAL GLY THR
28 42
241 255
SEQRES: TYR TYR HIS LEU GLY LYS LEU TYR GLU ARG LEU ASP ARG THR ASP
COORDS: TYR TYR HIS LEU GLY LYS LEU TYR GLU ARG LEU ASP ARG THR ASP
43 57
256 270
SEQRES: ASP ALA ILE ASP THR TYR ALA GLN GLY ILE GLU VAL ALA ARG GLU
COORDS: ASP ALA ILE ASP THR TYR ALA GLN GLY ILE GLU VAL ALA ARG GLU
58 72
271 285
SEQRES: GLU GLY THR GLN LYS ASP LEU SER GLU LEU GLN ASP ALA LYS LEU
COORDS: GLU GLY THR GLN LYS ASP LEU SER GLU LEU GLN ASP ALA LYS LEU
73 87
286 297
SEQRES: LYS ALA GLU GLY LEU GLU HIS HIS HIS HIS HIS HIS
COORDS: LYS ALA GLU GLY LEU GLU HIS HIS HIS HIS HIS HIS
88 99
==> The following residues have missing atoms:
RES MOD#C SEQ ATOMS
GLU( 1 A 1) HE2
ASP( 1 A 2) HD2
GLU( 1 A 4) HE2
ASP( 1 A 5) HD2
GLU( 1 A 15) HE2
ASP( 1 A 20) HD2
GLU( 1 A 30) HE2
GLU( 1 A 31) HE2
GLU( 1 A 34) HE2
ASP( 1 A 36) HD2
ASP( 1 A 38) HD2
GLU( 1 A 51) HE2
ASP( 1 A 54) HD2
ASP( 1 A 57) HD2
ASP( 1 A 58) HD2
ASP( 1 A 61) HD2
GLU( 1 A 68) HE2
GLU( 1 A 72) HE2
GLU( 1 A 73) HE2
ASP( 1 A 78) HD2
GLU( 1 A 81) HE2
ASP( 1 A 84) HD2
GLU( 1 A 90) HE2
GLU( 1 A 93) HE2
GLU( 2 A 1) HE2
ASP( 2 A 2) HD2
GLU( 2 A 4) HE2
ASP( 2 A 5) HD2
GLU( 2 A 15) HE2
ASP( 2 A 20) HD2
GLU( 2 A 30) HE2
GLU( 2 A 31) HE2
GLU( 2 A 34) HE2
ASP( 2 A 36) HD2
ASP( 2 A 38) HD2
GLU( 2 A 51) HE2
ASP( 2 A 54) HD2
ASP( 2 A 57) HD2
ASP( 2 A 58) HD2
ASP( 2 A 61) HD2
GLU( 2 A 68) HE2
GLU( 2 A 72) HE2
GLU( 2 A 73) HE2
ASP( 2 A 78) HD2
GLU( 2 A 81) HE2
ASP( 2 A 84) HD2
GLU( 2 A 90) HE2
GLU( 2 A 93) HE2
GLU( 3 A 1) HE2
ASP( 3 A 2) HD2
GLU( 3 A 4) HE2
ASP( 3 A 5) HD2
GLU( 3 A 15) HE2
ASP( 3 A 20) HD2
GLU( 3 A 30) HE2
GLU( 3 A 31) HE2
GLU( 3 A 34) HE2
ASP( 3 A 36) HD2
ASP( 3 A 38) HD2
GLU( 3 A 51) HE2
ASP( 3 A 54) HD2
ASP( 3 A 57) HD2
ASP( 3 A 58) HD2
ASP( 3 A 61) HD2
GLU( 3 A 68) HE2
GLU( 3 A 72) HE2
GLU( 3 A 73) HE2
ASP( 3 A 78) HD2
GLU( 3 A 81) HE2
ASP( 3 A 84) HD2
GLU( 3 A 90) HE2
GLU( 3 A 93) HE2
GLU( 4 A 1) HE2
ASP( 4 A 2) HD2
GLU( 4 A 4) HE2
ASP( 4 A 5) HD2
GLU( 4 A 15) HE2
ASP( 4 A 20) HD2
GLU( 4 A 30) HE2
GLU( 4 A 31) HE2
GLU( 4 A 34) HE2
ASP( 4 A 36) HD2
ASP( 4 A 38) HD2
GLU( 4 A 51) HE2
ASP( 4 A 54) HD2
ASP( 4 A 57) HD2
ASP( 4 A 58) HD2
ASP( 4 A 61) HD2
GLU( 4 A 68) HE2
GLU( 4 A 72) HE2
GLU( 4 A 73) HE2
ASP( 4 A 78) HD2
GLU( 4 A 81) HE2
ASP( 4 A 84) HD2
GLU( 4 A 90) HE2
GLU( 4 A 93) HE2
GLU( 5 A 1) HE2
ASP( 5 A 2) HD2
GLU( 5 A 4) HE2
ASP( 5 A 5) HD2
GLU( 5 A 15) HE2
ASP( 5 A 20) HD2
GLU( 5 A 30) HE2
GLU( 5 A 31) HE2
GLU( 5 A 34) HE2
ASP( 5 A 36) HD2
ASP( 5 A 38) HD2
GLU( 5 A 51) HE2
ASP( 5 A 54) HD2
ASP( 5 A 57) HD2
ASP( 5 A 58) HD2
ASP( 5 A 61) HD2
GLU( 5 A 68) HE2
GLU( 5 A 72) HE2
GLU( 5 A 73) HE2
ASP( 5 A 78) HD2
GLU( 5 A 81) HE2
ASP( 5 A 84) HD2
GLU( 5 A 90) HE2
GLU( 5 A 93) HE2
GLU( 6 A 1) HE2
ASP( 6 A 2) HD2
GLU( 6 A 4) HE2
ASP( 6 A 5) HD2
GLU( 6 A 15) HE2
ASP( 6 A 20) HD2
GLU( 6 A 30) HE2
GLU( 6 A 31) HE2
GLU( 6 A 34) HE2
ASP( 6 A 36) HD2
ASP( 6 A 38) HD2
GLU( 6 A 51) HE2
ASP( 6 A 54) HD2
ASP( 6 A 57) HD2
ASP( 6 A 58) HD2
ASP( 6 A 61) HD2
GLU( 6 A 68) HE2
GLU( 6 A 72) HE2
GLU( 6 A 73) HE2
ASP( 6 A 78) HD2
GLU( 6 A 81) HE2
ASP( 6 A 84) HD2
GLU( 6 A 90) HE2
GLU( 6 A 93) HE2
GLU( 7 A 1) HE2
ASP( 7 A 2) HD2
GLU( 7 A 4) HE2
ASP( 7 A 5) HD2
GLU( 7 A 15) HE2
ASP( 7 A 20) HD2
GLU( 7 A 30) HE2
GLU( 7 A 31) HE2
GLU( 7 A 34) HE2
ASP( 7 A 36) HD2
ASP( 7 A 38) HD2
GLU( 7 A 51) HE2
ASP( 7 A 54) HD2
ASP( 7 A 57) HD2
ASP( 7 A 58) HD2
ASP( 7 A 61) HD2
GLU( 7 A 68) HE2
GLU( 7 A 72) HE2
GLU( 7 A 73) HE2
ASP( 7 A 78) HD2
GLU( 7 A 81) HE2
ASP( 7 A 84) HD2
GLU( 7 A 90) HE2
GLU( 7 A 93) HE2
GLU( 8 A 1) HE2
ASP( 8 A 2) HD2
GLU( 8 A 4) HE2
ASP( 8 A 5) HD2
GLU( 8 A 15) HE2
ASP( 8 A 20) HD2
GLU( 8 A 30) HE2
GLU( 8 A 31) HE2
GLU( 8 A 34) HE2
ASP( 8 A 36) HD2
ASP( 8 A 38) HD2
GLU( 8 A 51) HE2
ASP( 8 A 54) HD2
ASP( 8 A 57) HD2
ASP( 8 A 58) HD2
ASP( 8 A 61) HD2
GLU( 8 A 68) HE2
GLU( 8 A 72) HE2
GLU( 8 A 73) HE2
ASP( 8 A 78) HD2
GLU( 8 A 81) HE2
ASP( 8 A 84) HD2
GLU( 8 A 90) HE2
GLU( 8 A 93) HE2
GLU( 9 A 1) HE2
ASP( 9 A 2) HD2
GLU( 9 A 4) HE2
ASP( 9 A 5) HD2
GLU( 9 A 15) HE2
ASP( 9 A 20) HD2
GLU( 9 A 30) HE2
GLU( 9 A 31) HE2
GLU( 9 A 34) HE2
ASP( 9 A 36) HD2
ASP( 9 A 38) HD2
GLU( 9 A 51) HE2
ASP( 9 A 54) HD2
ASP( 9 A 57) HD2
ASP( 9 A 58) HD2
ASP( 9 A 61) HD2
GLU( 9 A 68) HE2
GLU( 9 A 72) HE2
GLU( 9 A 73) HE2
ASP( 9 A 78) HD2
GLU( 9 A 81) HE2
ASP( 9 A 84) HD2
GLU( 9 A 90) HE2
GLU( 9 A 93) HE2
GLU( 10 A 1) HE2
ASP( 10 A 2) HD2
GLU( 10 A 4) HE2
ASP( 10 A 5) HD2
GLU( 10 A 15) HE2
ASP( 10 A 20) HD2
GLU( 10 A 30) HE2
GLU( 10 A 31) HE2
GLU( 10 A 34) HE2
ASP( 10 A 36) HD2
ASP( 10 A 38) HD2
GLU( 10 A 51) HE2
ASP( 10 A 54) HD2
ASP( 10 A 57) HD2
ASP( 10 A 58) HD2
ASP( 10 A 61) HD2
GLU( 10 A 68) HE2
GLU( 10 A 72) HE2
GLU( 10 A 73) HE2
ASP( 10 A 78) HD2
GLU( 10 A 81) HE2
ASP( 10 A 84) HD2
GLU( 10 A 90) HE2
GLU( 10 A 93) HE2
GLU( 11 A 1) HE2
ASP( 11 A 2) HD2
GLU( 11 A 4) HE2
ASP( 11 A 5) HD2
GLU( 11 A 15) HE2
ASP( 11 A 20) HD2
GLU( 11 A 30) HE2
GLU( 11 A 31) HE2
GLU( 11 A 34) HE2
ASP( 11 A 36) HD2
ASP( 11 A 38) HD2
GLU( 11 A 51) HE2
ASP( 11 A 54) HD2
ASP( 11 A 57) HD2
ASP( 11 A 58) HD2
ASP( 11 A 61) HD2
GLU( 11 A 68) HE2
GLU( 11 A 72) HE2
GLU( 11 A 73) HE2
ASP( 11 A 78) HD2
GLU( 11 A 81) HE2
ASP( 11 A 84) HD2
GLU( 11 A 90) HE2
GLU( 11 A 93) HE2
GLU( 12 A 1) HE2
ASP( 12 A 2) HD2
GLU( 12 A 4) HE2
ASP( 12 A 5) HD2
GLU( 12 A 15) HE2
ASP( 12 A 20) HD2
GLU( 12 A 30) HE2
GLU( 12 A 31) HE2
GLU( 12 A 34) HE2
ASP( 12 A 36) HD2
ASP( 12 A 38) HD2
GLU( 12 A 51) HE2
ASP( 12 A 54) HD2
ASP( 12 A 57) HD2
ASP( 12 A 58) HD2
ASP( 12 A 61) HD2
GLU( 12 A 68) HE2
GLU( 12 A 72) HE2
GLU( 12 A 73) HE2
ASP( 12 A 78) HD2
GLU( 12 A 81) HE2
ASP( 12 A 84) HD2
GLU( 12 A 90) HE2
GLU( 12 A 93) HE2
GLU( 13 A 1) HE2
ASP( 13 A 2) HD2
GLU( 13 A 4) HE2
ASP( 13 A 5) HD2
GLU( 13 A 15) HE2
ASP( 13 A 20) HD2
GLU( 13 A 30) HE2
GLU( 13 A 31) HE2
GLU( 13 A 34) HE2
ASP( 13 A 36) HD2
ASP( 13 A 38) HD2
GLU( 13 A 51) HE2
ASP( 13 A 54) HD2
ASP( 13 A 57) HD2
ASP( 13 A 58) HD2
ASP( 13 A 61) HD2
GLU( 13 A 68) HE2
GLU( 13 A 72) HE2
GLU( 13 A 73) HE2
ASP( 13 A 78) HD2
GLU( 13 A 81) HE2
ASP( 13 A 84) HD2
GLU( 13 A 90) HE2
GLU( 13 A 93) HE2
GLU( 14 A 1) HE2
ASP( 14 A 2) HD2
GLU( 14 A 4) HE2
ASP( 14 A 5) HD2
GLU( 14 A 15) HE2
ASP( 14 A 20) HD2
GLU( 14 A 30) HE2
GLU( 14 A 31) HE2
GLU( 14 A 34) HE2
ASP( 14 A 36) HD2
ASP( 14 A 38) HD2
GLU( 14 A 51) HE2
ASP( 14 A 54) HD2
ASP( 14 A 57) HD2
ASP( 14 A 58) HD2
ASP( 14 A 61) HD2
GLU( 14 A 68) HE2
GLU( 14 A 72) HE2
GLU( 14 A 73) HE2
ASP( 14 A 78) HD2
GLU( 14 A 81) HE2
ASP( 14 A 84) HD2
GLU( 14 A 90) HE2
GLU( 14 A 93) HE2
GLU( 15 A 1) HE2
ASP( 15 A 2) HD2
GLU( 15 A 4) HE2
ASP( 15 A 5) HD2
GLU( 15 A 15) HE2
ASP( 15 A 20) HD2
GLU( 15 A 30) HE2
GLU( 15 A 31) HE2
GLU( 15 A 34) HE2
ASP( 15 A 36) HD2
ASP( 15 A 38) HD2
GLU( 15 A 51) HE2
ASP( 15 A 54) HD2
ASP( 15 A 57) HD2
ASP( 15 A 58) HD2
ASP( 15 A 61) HD2
GLU( 15 A 68) HE2
GLU( 15 A 72) HE2
GLU( 15 A 73) HE2
ASP( 15 A 78) HD2
GLU( 15 A 81) HE2
ASP( 15 A 84) HD2
GLU( 15 A 90) HE2
GLU( 15 A 93) HE2
GLU( 16 A 1) HE2
ASP( 16 A 2) HD2
GLU( 16 A 4) HE2
ASP( 16 A 5) HD2
GLU( 16 A 15) HE2
ASP( 16 A 20) HD2
GLU( 16 A 30) HE2
GLU( 16 A 31) HE2
GLU( 16 A 34) HE2
ASP( 16 A 36) HD2
ASP( 16 A 38) HD2
GLU( 16 A 51) HE2
ASP( 16 A 54) HD2
ASP( 16 A 57) HD2
ASP( 16 A 58) HD2
ASP( 16 A 61) HD2
GLU( 16 A 68) HE2
GLU( 16 A 72) HE2
GLU( 16 A 73) HE2
ASP( 16 A 78) HD2
GLU( 16 A 81) HE2
ASP( 16 A 84) HD2
GLU( 16 A 90) HE2
GLU( 16 A 93) HE2
GLU( 17 A 1) HE2
ASP( 17 A 2) HD2
GLU( 17 A 4) HE2
ASP( 17 A 5) HD2
GLU( 17 A 15) HE2
ASP( 17 A 20) HD2
GLU( 17 A 30) HE2
GLU( 17 A 31) HE2
GLU( 17 A 34) HE2
ASP( 17 A 36) HD2
ASP( 17 A 38) HD2
GLU( 17 A 51) HE2
ASP( 17 A 54) HD2
ASP( 17 A 57) HD2
ASP( 17 A 58) HD2
ASP( 17 A 61) HD2
GLU( 17 A 68) HE2
GLU( 17 A 72) HE2
GLU( 17 A 73) HE2
ASP( 17 A 78) HD2
GLU( 17 A 81) HE2
ASP( 17 A 84) HD2
GLU( 17 A 90) HE2
GLU( 17 A 93) HE2
GLU( 18 A 1) HE2
ASP( 18 A 2) HD2
GLU( 18 A 4) HE2
ASP( 18 A 5) HD2
GLU( 18 A 15) HE2
ASP( 18 A 20) HD2
GLU( 18 A 30) HE2
GLU( 18 A 31) HE2
GLU( 18 A 34) HE2
ASP( 18 A 36) HD2
ASP( 18 A 38) HD2
GLU( 18 A 51) HE2
ASP( 18 A 54) HD2
ASP( 18 A 57) HD2
ASP( 18 A 58) HD2
ASP( 18 A 61) HD2
GLU( 18 A 68) HE2
GLU( 18 A 72) HE2
GLU( 18 A 73) HE2
ASP( 18 A 78) HD2
GLU( 18 A 81) HE2
ASP( 18 A 84) HD2
GLU( 18 A 90) HE2
GLU( 18 A 93) HE2
GLU( 19 A 1) HE2
ASP( 19 A 2) HD2
GLU( 19 A 4) HE2
ASP( 19 A 5) HD2
GLU( 19 A 15) HE2
ASP( 19 A 20) HD2
GLU( 19 A 30) HE2
GLU( 19 A 31) HE2
GLU( 19 A 34) HE2
ASP( 19 A 36) HD2
ASP( 19 A 38) HD2
GLU( 19 A 51) HE2
ASP( 19 A 54) HD2
ASP( 19 A 57) HD2
ASP( 19 A 58) HD2
ASP( 19 A 61) HD2
GLU( 19 A 68) HE2
GLU( 19 A 72) HE2
GLU( 19 A 73) HE2
ASP( 19 A 78) HD2
GLU( 19 A 81) HE2
ASP( 19 A 84) HD2
GLU( 19 A 90) HE2
GLU( 19 A 93) HE2
GLU( 20 A 1) HE2
ASP( 20 A 2) HD2
GLU( 20 A 4) HE2
ASP( 20 A 5) HD2
GLU( 20 A 15) HE2
ASP( 20 A 20) HD2
GLU( 20 A 30) HE2
GLU( 20 A 31) HE2
GLU( 20 A 34) HE2
ASP( 20 A 36) HD2
ASP( 20 A 38) HD2
GLU( 20 A 51) HE2
ASP( 20 A 54) HD2
ASP( 20 A 57) HD2
ASP( 20 A 58) HD2
ASP( 20 A 61) HD2
GLU( 20 A 68) HE2
GLU( 20 A 72) HE2
GLU( 20 A 73) HE2
ASP( 20 A 78) HD2
GLU( 20 A 81) HE2
ASP( 20 A 84) HD2
GLU( 20 A 90) HE2
GLU( 20 A 93) HE2
==> The following residues have extra atoms:
RES MOD#C SEQ ATOMS
HIS( 1 A 99) O2
HIS( 2 A 99) O2
HIS( 3 A 99) O2
HIS( 4 A 99) O2
HIS( 5 A 99) O2
HIS( 6 A 99) O2
HIS( 7 A 99) O2
HIS( 8 A 99) O2
HIS( 9 A 99) O2
HIS( 10 A 99) O2
HIS( 11 A 99) O2
HIS( 12 A 99) O2
HIS( 13 A 99) O2
HIS( 14 A 99) O2
HIS( 15 A 99) O2
HIS( 16 A 99) O2
HIS( 17 A 99) O2
HIS( 18 A 99) O2
HIS( 19 A 99) O2
HIS( 20 A 99) O2
CHECK TERMINAL ATOMS
--------------------
Terminal atom(s) showed in middle of sequence will be deleted:
1H GLU 1 A
2H GLU 1 A
3H GLU 1 A
1H GLU 1 A
2H GLU 1 A
3H GLU 1 A
1H GLU 1 A
2H GLU 1 A
3H GLU 1 A
1H GLU 1 A
2H GLU 1 A
3H GLU 1 A
1H GLU 1 A
2H GLU 1 A
3H GLU 1 A
1H GLU 1 A
2H GLU 1 A
3H GLU 1 A
1H GLU 1 A
2H GLU 1 A
3H GLU 1 A
1H GLU 1 A
2H GLU 1 A
3H GLU 1 A
1H GLU 1 A
2H GLU 1 A
3H GLU 1 A
1H GLU 1 A
2H GLU 1 A
3H GLU 1 A
1H GLU 1 A
2H GLU 1 A
3H GLU 1 A
1H GLU 1 A
2H GLU 1 A
3H GLU 1 A
1H GLU 1 A
2H GLU 1 A
3H GLU 1 A
1H GLU 1 A
2H GLU 1 A
3H GLU 1 A
1H GLU 1 A
2H GLU 1 A
3H GLU 1 A
1H GLU 1 A
2H GLU 1 A
3H GLU 1 A
1H GLU 1 A
2H GLU 1 A
3H GLU 1 A
1H GLU 1 A
2H GLU 1 A
3H GLU 1 A
1H GLU 1 A
2H GLU 1 A
3H GLU 1 A
1H GLU 1 A
2H GLU 1 A
3H GLU 1 A