NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
440126 |
2k7s   |
15928 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2k7s
save_distance_constraint_statistics_1
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 1
_Distance_constraint_stats_list.Constraint_count 487
_Distance_constraint_stats_list.Viol_count 1842
_Distance_constraint_stats_list.Viol_total 2727.776
_Distance_constraint_stats_list.Viol_max 0.623
_Distance_constraint_stats_list.Viol_rms 0.0384
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0140
_Distance_constraint_stats_list.Viol_average_violations_only 0.0740
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 3 MET 1.925 0.250 10 0 "[ . 1 . 2]"
1 5 ASN 0.066 0.066 3 0 "[ . 1 . 2]"
1 6 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 PRO 2.612 0.103 14 0 "[ . 1 . 2]"
1 10 THR 3.131 0.103 14 0 "[ . 1 . 2]"
1 11 GLU 9.183 0.258 13 0 "[ . 1 . 2]"
1 12 PHE 5.661 0.178 20 0 "[ . 1 . 2]"
1 13 ILE 2.493 0.091 16 0 "[ . 1 . 2]"
1 14 SER 5.063 0.204 18 0 "[ . 1 . 2]"
1 15 ARG 3.963 0.173 4 0 "[ . 1 . 2]"
1 16 HIS 10.007 0.258 13 0 "[ . 1 . 2]"
1 17 ASN 6.172 0.156 18 0 "[ . 1 . 2]"
1 18 ILE 5.647 0.156 18 0 "[ . 1 . 2]"
1 19 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 GLY 2.691 0.156 18 0 "[ . 1 . 2]"
1 21 ILE 12.550 0.258 13 0 "[ . 1 . 2]"
1 22 PHE 18.471 0.204 18 0 "[ . 1 . 2]"
1 23 THR 4.241 0.145 19 0 "[ . 1 . 2]"
1 24 PHE 3.804 0.125 3 0 "[ . 1 . 2]"
1 25 VAL 12.065 0.204 18 0 "[ . 1 . 2]"
1 26 ASP 4.405 0.125 3 0 "[ . 1 . 2]"
1 27 HIS 6.148 0.231 13 0 "[ . 1 . 2]"
1 28 ARG 2.411 0.117 6 0 "[ . 1 . 2]"
1 29 CYS 1.121 0.078 11 0 "[ . 1 . 2]"
1 30 VAL 1.912 0.105 3 0 "[ . 1 . 2]"
1 31 ALA 0.066 0.066 3 0 "[ . 1 . 2]"
1 32 THR 2.253 0.103 14 0 "[ . 1 . 2]"
1 33 VAL 1.131 0.090 15 0 "[ . 1 . 2]"
1 34 GLY 0.019 0.014 19 0 "[ . 1 . 2]"
1 35 TYR 1.059 0.090 15 0 "[ . 1 . 2]"
1 36 GLN 0.290 0.169 3 0 "[ . 1 . 2]"
1 37 PRO 9.032 0.250 10 0 "[ . 1 . 2]"
1 38 GLN 0.689 0.169 3 0 "[ . 1 . 2]"
1 39 GLU 0.530 0.117 6 0 "[ . 1 . 2]"
1 40 LEU 0.915 0.117 6 0 "[ . 1 . 2]"
1 41 LEU 0.130 0.065 11 0 "[ . 1 . 2]"
1 42 GLY 0.130 0.065 11 0 "[ . 1 . 2]"
1 43 LYS 3.164 0.147 16 0 "[ . 1 . 2]"
1 44 ASN 2.564 0.162 6 0 "[ . 1 . 2]"
1 45 ILE 7.403 0.167 17 0 "[ . 1 . 2]"
1 46 VAL 7.356 0.166 16 0 "[ . 1 . 2]"
1 47 GLU 1.448 0.085 5 0 "[ . 1 . 2]"
1 48 PHE 1.219 0.090 15 0 "[ . 1 . 2]"
1 49 CYS 5.050 0.162 6 0 "[ . 1 . 2]"
1 50 HIS 0.558 0.065 11 0 "[ . 1 . 2]"
1 51 PRO 1.868 0.073 11 0 "[ . 1 . 2]"
1 52 GLU 0.610 0.054 15 0 "[ . 1 . 2]"
1 53 ASP 1.144 0.054 15 0 "[ . 1 . 2]"
1 54 GLN 7.011 0.233 6 0 "[ . 1 . 2]"
1 55 GLN 1.497 0.064 11 0 "[ . 1 . 2]"
1 56 LEU 8.561 0.233 6 0 "[ . 1 . 2]"
1 57 LEU 5.344 0.131 12 0 "[ . 1 . 2]"
1 58 ARG 0.843 0.084 17 0 "[ . 1 . 2]"
1 59 ASP 4.010 0.131 12 0 "[ . 1 . 2]"
1 60 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 PHE 0.218 0.048 12 0 "[ . 1 . 2]"
1 62 GLN 2.228 0.085 5 0 "[ . 1 . 2]"
1 63 GLN 1.454 0.080 19 0 "[ . 1 . 2]"
1 64 VAL 4.278 0.111 1 0 "[ . 1 . 2]"
1 65 VAL 7.565 0.151 5 0 "[ . 1 . 2]"
1 66 LYS 7.754 0.151 5 0 "[ . 1 . 2]"
1 67 LEU 2.887 0.098 1 0 "[ . 1 . 2]"
1 68 LYS 4.187 0.151 5 0 "[ . 1 . 2]"
1 69 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 GLN 5.307 0.149 13 0 "[ . 1 . 2]"
1 71 VAL 4.190 0.130 10 0 "[ . 1 . 2]"
1 72 LEU 0.886 0.060 16 0 "[ . 1 . 2]"
1 73 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 VAL 5.242 0.233 6 0 "[ . 1 . 2]"
1 75 MET 2.509 0.438 11 0 "[ . 1 . 2]"
1 76 PHE 2.780 0.159 7 0 "[ . 1 . 2]"
1 77 ARG 0.847 0.438 11 0 "[ . 1 . 2]"
1 78 PHE 8.309 0.177 17 0 "[ . 1 . 2]"
1 79 ARG 7.456 0.134 18 0 "[ . 1 . 2]"
1 80 SER 1.825 0.134 18 0 "[ . 1 . 2]"
1 81 LYS 3.356 0.129 19 0 "[ . 1 . 2]"
1 82 ASN 0.059 0.014 19 0 "[ . 1 . 2]"
1 83 GLN 5.225 0.234 8 0 "[ . 1 . 2]"
1 84 GLU 2.433 0.234 8 0 "[ . 1 . 2]"
1 85 TRP 2.992 0.105 3 0 "[ . 1 . 2]"
1 86 LEU 6.737 0.234 8 0 "[ . 1 . 2]"
1 87 TRP 2.187 0.438 11 0 "[ . 1 . 2]"
1 88 MET 9.097 0.177 17 0 "[ . 1 . 2]"
1 89 ARG 5.159 0.180 16 0 "[ . 1 . 2]"
1 90 THR 5.676 0.180 16 0 "[ . 1 . 2]"
1 91 SER 3.669 0.178 20 0 "[ . 1 . 2]"
1 92 SER 0.807 0.071 19 0 "[ . 1 . 2]"
1 93 GLN 7.934 0.149 13 0 "[ . 1 . 2]"
1 94 THR 10.898 0.623 7 1 "[ . + 1 . 2]"
1 95 ALA 7.046 0.293 14 0 "[ . 1 . 2]"
1 96 GLN 2.723 0.218 19 0 "[ . 1 . 2]"
1 97 ASN 3.412 0.218 19 0 "[ . 1 . 2]"
1 98 PRO 0.441 0.103 1 0 "[ . 1 . 2]"
1 99 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 GLU 4.712 0.173 4 0 "[ . 1 . 2]"
1 103 ILE 11.428 0.623 7 1 "[ . + 1 . 2]"
1 104 GLU 3.343 0.623 7 1 "[ . + 1 . 2]"
1 105 THR 3.956 0.159 7 0 "[ . 1 . 2]"
1 106 ILE 9.219 0.258 13 0 "[ . 1 . 2]"
1 107 ILE 2.014 0.051 4 0 "[ . 1 . 2]"
1 108 CYS 2.100 0.093 1 0 "[ . 1 . 2]"
1 109 THR 4.009 0.146 20 0 "[ . 1 . 2]"
1 110 ASN 1.240 0.299 5 0 "[ . 1 . 2]"
1 111 THR 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 22 PHE QE 1 25 VAL MG1 2.516 . 3.307 3.372 3.345 3.384 0.077 8 0 "[ . 1 . 2]" 1
2 1 58 ARG HA 1 61 PHE QD 2.092 . 2.639 1.899 1.697 1.942 . 0 0 "[ . 1 . 2]" 1
3 1 45 ILE MG 1 61 PHE QD 2.557 . 3.374 2.918 2.879 2.961 . 0 0 "[ . 1 . 2]" 1
4 1 95 ALA HA 1 96 GLN QG 2.179 . 2.773 2.657 2.392 2.784 0.011 20 0 "[ . 1 . 2]" 1
5 1 11 GLU HG3 1 108 CYS HA 3.004 . 4.132 4.210 4.188 4.225 0.093 1 0 "[ . 1 . 2]" 1
6 1 12 PHE HB2 1 28 ARG HA 2.980 . 4.090 3.672 3.598 3.749 . 0 0 "[ . 1 . 2]" 1
7 1 47 GLU HA 1 49 CYS H 2.758 . 3.709 3.781 3.761 3.794 0.085 5 0 "[ . 1 . 2]" 1
8 1 16 HIS H 1 16 HIS HD2 2.708 . 3.625 3.623 3.494 3.678 0.053 15 0 "[ . 1 . 2]" 1
9 1 16 HIS HD2 1 22 PHE HA 2.977 . 4.085 4.075 4.017 4.117 0.032 10 0 "[ . 1 . 2]" 1
10 1 55 GLN QE 1 62 GLN HG3 3.048 . 4.209 4.039 3.877 4.105 . 0 0 "[ . 1 . 2]" 1
11 1 58 ARG QB 1 62 GLN HG2 2.748 . 3.692 3.606 3.451 3.699 0.007 19 0 "[ . 1 . 2]" 1
12 1 48 PHE HA 1 48 PHE QD 2.366 . 3.066 3.043 3.026 3.071 0.005 6 0 "[ . 1 . 2]" 1
13 1 36 GLN QG 1 37 PRO HD2 2.744 . 3.685 3.343 3.260 3.489 . 0 0 "[ . 1 . 2]" 1
14 1 30 VAL HA 1 36 GLN QG 2.695 . 3.603 3.074 3.008 3.143 . 0 0 "[ . 1 . 2]" 1
15 1 36 GLN QB 1 36 GLN QG 2.131 . 2.698 1.967 1.879 2.020 . 0 0 "[ . 1 . 2]" 1
16 1 35 TYR HA 1 39 GLU HB2 2.719 . 3.643 2.841 2.654 2.940 . 0 0 "[ . 1 . 2]" 1
17 1 55 GLN QE 1 59 ASP HA 2.988 . 4.104 3.649 3.321 3.889 . 0 0 "[ . 1 . 2]" 1
18 1 19 GLU H 1 19 GLU HA 2.248 . 2.880 2.625 2.613 2.637 . 0 0 "[ . 1 . 2]" 1
19 1 41 LEU HA 1 41 LEU QB 2.085 . 2.628 2.479 2.472 2.483 . 0 0 "[ . 1 . 2]" 1
20 1 41 LEU HA 1 42 GLY HA3 2.769 . 3.728 3.683 3.586 3.793 0.065 11 0 "[ . 1 . 2]" 1
21 1 33 VAL HB 1 78 PHE QE 2.883 . 3.922 2.472 2.425 2.518 . 0 0 "[ . 1 . 2]" 1
22 1 12 PHE HZ 1 33 VAL MG1 2.381 . 3.090 2.673 2.649 2.693 . 0 0 "[ . 1 . 2]" 1
23 1 12 PHE HZ 1 25 VAL MG1 2.600 . 3.445 3.123 3.091 3.147 . 0 0 "[ . 1 . 2]" 1
24 1 93 GLN H 1 93 GLN HB3 2.582 . 3.415 3.265 3.242 3.279 . 0 0 "[ . 1 . 2]" 1
25 1 14 SER HA 1 22 PHE QE 2.879 . 3.915 4.032 4.012 4.119 0.204 18 0 "[ . 1 . 2]" 1
26 1 14 SER HA 1 15 ARG QG 3.070 . 4.248 3.979 3.819 4.194 . 0 0 "[ . 1 . 2]" 1
27 1 71 VAL QG 1 73 SER HA 2.766 . 3.722 3.568 3.521 3.619 . 0 0 "[ . 1 . 2]" 1
28 1 22 PHE HZ 1 25 VAL MG1 2.778 . 3.742 3.885 3.867 3.909 0.167 17 0 "[ . 1 . 2]" 1
29 1 50 HIS HB3 1 77 ARG HB2 2.826 . 3.824 2.603 2.508 2.654 . 0 0 "[ . 1 . 2]" 1
30 1 83 GLN HA 1 83 GLN HB3 2.084 . 2.627 2.179 2.139 2.193 . 0 0 "[ . 1 . 2]" 1
31 1 50 HIS HB3 1 53 ASP H 2.572 . 3.399 2.688 2.634 2.780 . 0 0 "[ . 1 . 2]" 1
32 1 75 MET HG3 1 87 TRP HE3 3.051 . 4.214 4.272 4.209 4.513 0.299 5 0 "[ . 1 . 2]" 1
33 1 75 MET HG2 1 76 PHE H 2.896 . 3.945 3.905 3.793 3.945 . 7 0 "[ . 1 . 2]" 1
34 1 75 MET HG2 1 87 TRP HE3 2.855 . 3.874 3.418 3.290 3.953 0.079 5 0 "[ . 1 . 2]" 1
35 1 94 THR HA 1 104 GLU HB2 2.945 . 4.029 4.157 4.097 4.652 0.623 7 1 "[ . + 1 . 2]" 1
36 1 68 LYS HB2 1 68 LYS QG 2.098 . 2.648 2.219 2.101 2.365 . 0 0 "[ . 1 . 2]" 1
37 1 98 PRO HB3 1 99 TYR H 3.010 . 4.142 3.868 3.779 4.020 . 0 0 "[ . 1 . 2]" 1
38 1 45 ILE HG12 1 76 PHE HZ 3.023 . 4.165 3.516 3.477 3.569 . 0 0 "[ . 1 . 2]" 1
39 1 106 ILE MG 1 108 CYS HA 2.931 . 4.005 3.445 3.411 3.470 . 0 0 "[ . 1 . 2]" 1
40 1 64 VAL HB 1 72 LEU QD 2.661 . 3.546 2.289 2.236 2.356 . 0 0 "[ . 1 . 2]" 1
41 1 64 VAL HB 1 72 LEU HB2 2.870 . 3.900 3.337 3.240 3.630 . 0 0 "[ . 1 . 2]" 1
42 1 16 HIS HB2 1 20 GLY H 3.013 . 4.148 3.039 2.979 3.067 . 0 0 "[ . 1 . 2]" 1
43 1 37 PRO HB3 1 38 GLN H 2.410 . 3.136 3.104 2.897 3.180 0.044 4 0 "[ . 1 . 2]" 1
44 1 27 HIS HB3 1 37 PRO HB2 2.716 . 3.638 3.853 3.763 3.869 0.231 13 0 "[ . 1 . 2]" 1
45 1 25 VAL MG1 1 37 PRO HB2 3.020 . 4.160 4.282 4.248 4.304 0.144 18 0 "[ . 1 . 2]" 1
46 1 79 ARG HB2 1 85 TRP HA 2.791 . 3.765 3.776 3.724 3.808 0.043 8 0 "[ . 1 . 2]" 1
47 1 40 LEU HA 1 40 LEU HB2 2.190 . 2.789 2.654 2.651 2.657 . 0 0 "[ . 1 . 2]" 1
48 1 40 LEU H 1 40 LEU HA 2.324 . 2.999 2.704 2.677 2.731 . 0 0 "[ . 1 . 2]" 1
49 1 40 LEU HA 1 40 LEU HB3 2.119 . 2.680 2.282 2.270 2.308 . 0 0 "[ . 1 . 2]" 1
50 1 16 HIS H 1 16 HIS HB3 2.701 . 3.613 3.304 3.271 3.325 . 0 0 "[ . 1 . 2]" 1
51 1 46 VAL HB 1 46 VAL QG 1.849 . 2.277 1.876 1.872 1.880 . 0 0 "[ . 1 . 2]" 1
52 1 15 ARG HA 1 103 ILE HA 3.062 . 4.234 4.111 3.998 4.183 . 0 0 "[ . 1 . 2]" 1
53 1 96 GLN HA 1 97 ASN QB 2.859 . 3.881 4.007 3.832 4.099 0.218 19 0 "[ . 1 . 2]" 1
54 1 27 HIS HB2 1 30 VAL H 2.838 . 3.845 3.936 3.809 3.950 0.105 3 0 "[ . 1 . 2]" 1
55 1 50 HIS HB2 1 85 TRP HB3 3.013 . 4.148 3.720 3.476 3.835 . 0 0 "[ . 1 . 2]" 1
56 1 70 GLN H 1 70 GLN QB 2.402 . 3.123 2.193 2.151 2.217 . 0 0 "[ . 1 . 2]" 1
57 1 67 LEU MD1 1 70 GLN QB 2.441 . 3.186 2.166 2.028 2.310 . 0 0 "[ . 1 . 2]" 1
58 1 46 VAL QG 1 58 ARG QB 2.706 . 3.621 3.533 3.492 3.595 . 0 0 "[ . 1 . 2]" 1
59 1 19 GLU QB 1 21 ILE H 2.468 . 3.230 2.407 2.229 2.442 . 0 0 "[ . 1 . 2]" 1
60 1 19 GLU QB 1 21 ILE MD 2.905 . 3.960 2.831 2.805 2.877 . 0 0 "[ . 1 . 2]" 1
61 1 19 GLU HA 1 19 GLU HB3 2.114 . 2.673 2.322 2.280 2.351 . 0 0 "[ . 1 . 2]" 1
62 1 17 ASN HB2 1 19 GLU HB2 3.054 . 4.220 3.724 3.319 4.078 . 0 0 "[ . 1 . 2]" 1
63 1 19 GLU QB 1 21 ILE HG12 2.834 . 3.838 2.010 1.840 2.079 . 0 0 "[ . 1 . 2]" 1
64 1 67 LEU HB2 1 70 GLN QB 2.495 . 3.273 1.847 1.799 1.916 . 0 0 "[ . 1 . 2]" 1
65 1 28 ARG HB3 1 28 ARG QG 2.398 . 3.117 2.118 2.056 2.167 . 0 0 "[ . 1 . 2]" 1
66 1 15 ARG HD3 1 96 GLN HB2 3.098 . 4.298 3.952 3.617 4.341 0.043 9 0 "[ . 1 . 2]" 1
67 1 11 GLU HA 1 109 THR H 2.427 . 3.163 2.595 2.573 2.620 . 0 0 "[ . 1 . 2]" 1
68 1 11 GLU HA 1 12 PHE H 1.924 . 2.387 2.061 2.041 2.070 . 0 0 "[ . 1 . 2]" 1
69 1 11 GLU HA 1 106 ILE MG 2.607 . 3.457 3.684 3.658 3.715 0.258 13 0 "[ . 1 . 2]" 1
70 1 75 MET HB2 1 87 TRP HH2 3.034 . 4.185 3.920 3.731 4.623 0.438 11 0 "[ . 1 . 2]" 1
71 1 19 GLU HB2 1 44 ASN HD21 2.752 . 3.699 3.538 3.424 3.689 . 0 0 "[ . 1 . 2]" 1
72 1 48 PHE HB3 1 79 ARG HB2 2.852 . 3.869 3.731 3.684 3.858 . 0 0 "[ . 1 . 2]" 1
73 1 62 GLN HB2 1 66 LYS QD 2.882 . 3.920 3.795 3.511 3.940 0.020 10 0 "[ . 1 . 2]" 1
74 1 15 ARG HE 1 15 ARG QG 3.037 . 4.190 2.771 2.532 2.920 . 0 0 "[ . 1 . 2]" 1
75 1 81 LYS HD2 1 81 LYS HG3 2.169 . 2.757 2.280 2.248 2.376 . 0 0 "[ . 1 . 2]" 1
76 1 63 GLN HB3 1 67 LEU MD1 2.248 . 2.879 2.050 2.005 2.086 . 0 0 "[ . 1 . 2]" 1
77 1 47 GLU HA 1 47 GLU HB2 2.139 . 2.711 2.277 2.267 2.319 . 0 0 "[ . 1 . 2]" 1
78 1 63 GLN H 1 66 LYS QD 3.061 . 4.232 4.058 3.945 4.113 . 0 0 "[ . 1 . 2]" 1
79 1 15 ARG QG 1 105 THR H 2.986 . 4.100 3.596 3.482 3.648 . 0 0 "[ . 1 . 2]" 1
80 1 15 ARG HG2 1 16 HIS H 2.773 . 3.734 3.343 3.124 3.437 . 0 0 "[ . 1 . 2]" 1
81 1 15 ARG HG2 1 105 THR H 2.716 . 3.638 3.671 3.587 3.733 0.095 11 0 "[ . 1 . 2]" 1
82 1 18 ILE MD 1 18 ILE HG13 1.840 . 2.263 1.868 1.866 1.870 . 0 0 "[ . 1 . 2]" 1
83 1 15 ARG HG2 1 103 ILE HA 2.911 . 3.970 3.994 3.947 4.021 0.051 4 0 "[ . 1 . 2]" 1
84 1 18 ILE MD 1 18 ILE HG12 1.966 . 2.449 1.976 1.963 1.988 . 0 0 "[ . 1 . 2]" 1
85 1 22 PHE HZ 1 45 ILE HG12 2.797 . 3.775 3.280 3.263 3.303 . 0 0 "[ . 1 . 2]" 1
86 1 54 GLN H 1 54 GLN HB3 2.534 . 3.337 3.412 3.197 3.441 0.104 17 0 "[ . 1 . 2]" 1
87 1 58 ARG QD 1 58 ARG HG3 2.376 . 3.082 2.322 2.171 2.514 . 0 0 "[ . 1 . 2]" 1
88 1 58 ARG QD 1 58 ARG HG2 2.266 . 2.908 2.271 2.141 2.382 . 0 0 "[ . 1 . 2]" 1
89 1 77 ARG HB3 1 85 TRP HZ3 2.690 . 3.594 3.243 3.209 3.288 . 0 0 "[ . 1 . 2]" 1
90 1 79 ARG HB3 1 85 TRP HH2 2.853 . 3.871 3.879 3.857 3.924 0.053 19 0 "[ . 1 . 2]" 1
91 1 62 GLN QB 1 62 GLN HG2 2.224 . 2.842 2.522 2.514 2.526 . 0 0 "[ . 1 . 2]" 1
92 1 27 HIS HB2 1 37 PRO HG3 2.939 . 4.019 3.064 2.726 3.307 . 0 0 "[ . 1 . 2]" 1
93 1 64 VAL MG2 1 103 ILE HG13 2.400 . 3.120 3.199 3.183 3.219 0.099 6 0 "[ . 1 . 2]" 1
94 1 94 THR HA 1 103 ILE HG12 2.542 . 3.350 2.457 2.425 2.496 . 0 0 "[ . 1 . 2]" 1
95 1 3 MET ME 1 36 GLN QB 3.087 . 4.278 2.793 1.727 3.401 0.169 3 0 "[ . 1 . 2]" 1
96 1 9 PRO HB2 1 9 PRO QG 1.934 . 2.401 1.890 1.827 1.923 . 0 0 "[ . 1 . 2]" 1
97 1 55 GLN HB2 1 55 GLN QE 2.513 . 3.303 2.670 2.396 2.794 . 0 0 "[ . 1 . 2]" 1
98 1 9 PRO HB2 1 9 PRO QG 1.867 . 2.303 1.848 1.823 1.856 . 0 0 "[ . 1 . 2]" 1
99 1 17 ASN HD21 1 21 ILE HG13 2.280 . 2.930 2.972 2.839 3.015 0.085 7 0 "[ . 1 . 2]" 1
100 1 21 ILE MD 1 21 ILE HG13 2.068 . 2.602 2.031 2.021 2.035 . 0 0 "[ . 1 . 2]" 1
101 1 19 GLU HB2 1 21 ILE HG13 2.737 . 3.673 2.381 2.322 2.423 . 0 0 "[ . 1 . 2]" 1
102 1 56 LEU HG 1 57 LEU H 2.795 . 3.772 3.381 3.315 3.419 . 0 0 "[ . 1 . 2]" 1
103 1 41 LEU QD 1 41 LEU HG 2.059 . 2.589 1.890 1.886 1.894 . 0 0 "[ . 1 . 2]" 1
104 1 78 PHE H 1 86 LEU QD 2.818 . 3.810 3.442 3.394 3.482 . 0 0 "[ . 1 . 2]" 1
105 1 8 GLN HB3 1 9 PRO QD 1.962 . 2.443 1.828 1.784 1.958 . 0 0 "[ . 1 . 2]" 1
106 1 8 GLN HB2 1 9 PRO QD 2.518 . 3.311 2.785 2.343 2.899 . 0 0 "[ . 1 . 2]" 1
107 1 8 GLN QG 1 9 PRO QD 2.613 . 3.467 3.014 1.954 3.208 . 0 0 "[ . 1 . 2]" 1
108 1 33 VAL MG2 1 40 LEU HG 3.014 . 4.150 3.432 3.386 3.463 . 0 0 "[ . 1 . 2]" 1
109 1 3 MET ME 1 37 PRO HD3 2.803 . 3.785 3.484 3.030 3.655 . 0 0 "[ . 1 . 2]" 1
110 1 81 LYS H 1 81 LYS HG3 2.909 . 3.967 4.065 4.045 4.096 0.129 19 0 "[ . 1 . 2]" 1
111 1 81 LYS HB3 1 81 LYS HG3 2.074 . 2.612 2.291 2.251 2.383 . 0 0 "[ . 1 . 2]" 1
112 1 29 CYS HB2 1 40 LEU QD 2.085 . 2.628 1.771 1.748 1.795 . 0 0 "[ . 1 . 2]" 1
113 1 49 CYS H 1 57 LEU QD 2.387 . 3.099 2.573 2.531 2.709 . 0 0 "[ . 1 . 2]" 1
114 1 54 GLN HB3 1 57 LEU QD 2.917 . 3.981 3.955 3.940 3.996 0.015 16 0 "[ . 1 . 2]" 1
115 1 63 GLN H 1 66 LYS HG3 3.087 . 4.278 4.340 4.328 4.358 0.080 19 0 "[ . 1 . 2]" 1
116 1 66 LYS QB 1 66 LYS HG3 2.132 . 2.700 2.062 1.993 2.146 . 0 0 "[ . 1 . 2]" 1
117 1 12 PHE QD 1 40 LEU QD 2.536 . 3.340 3.001 2.951 3.036 . 0 0 "[ . 1 . 2]" 1
118 1 12 PHE HZ 1 40 LEU QD 2.400 . 3.120 2.616 2.592 2.645 . 0 0 "[ . 1 . 2]" 1
119 1 53 ASP HB2 1 56 LEU MD2 2.831 . 3.833 3.725 3.631 3.755 . 0 0 "[ . 1 . 2]" 1
120 1 56 LEU H 1 56 LEU MD2 2.733 . 3.667 3.658 3.633 3.677 0.010 19 0 "[ . 1 . 2]" 1
121 1 56 LEU MD2 1 57 LEU H 2.676 . 3.571 3.166 3.031 3.293 . 0 0 "[ . 1 . 2]" 1
122 1 56 LEU QD 1 74 VAL HA 3.006 . 4.136 2.854 2.793 2.941 . 0 0 "[ . 1 . 2]" 1
123 1 56 LEU QD 1 56 LEU HG 2.065 . 2.598 1.884 1.874 1.891 . 0 0 "[ . 1 . 2]" 1
124 1 64 VAL MG1 1 93 GLN H 2.552 . 3.366 3.451 3.428 3.477 0.111 1 0 "[ . 1 . 2]" 1
125 1 64 VAL MG1 1 71 VAL HA 2.569 . 3.394 3.419 3.377 3.454 0.060 16 0 "[ . 1 . 2]" 1
126 1 37 PRO HB3 1 41 LEU MD1 2.415 . 3.144 2.794 2.754 2.828 . 0 0 "[ . 1 . 2]" 1
127 1 41 LEU QB 1 41 LEU MD1 1.758 . 2.144 2.095 2.066 2.108 . 0 0 "[ . 1 . 2]" 1
128 1 78 PHE H 1 85 TRP HE3 2.638 . 3.508 2.918 2.857 2.984 . 0 0 "[ . 1 . 2]" 1
129 1 57 LEU HB2 1 57 LEU QD 2.075 . 2.613 2.089 2.064 2.340 . 0 0 "[ . 1 . 2]" 1
130 1 57 LEU QD 1 57 LEU HG 1.794 . 2.196 1.741 1.704 1.759 . 0 0 "[ . 1 . 2]" 1
131 1 50 HIS H 1 85 TRP HE3 2.987 . 4.102 3.742 3.682 3.792 . 0 0 "[ . 1 . 2]" 1
132 1 65 VAL HB 1 94 THR MG 2.647 . 3.523 3.542 3.511 3.592 0.069 1 0 "[ . 1 . 2]" 1
133 1 25 VAL H 1 41 LEU QD 2.262 . 2.902 2.682 2.591 2.734 . 0 0 "[ . 1 . 2]" 1
134 1 24 PHE QD 1 41 LEU QD 2.768 . 3.726 3.542 3.503 3.589 . 0 0 "[ . 1 . 2]" 1
135 1 24 PHE HB2 1 41 LEU MD2 3.052 . 4.217 3.411 3.370 3.468 . 0 0 "[ . 1 . 2]" 1
136 1 41 LEU HB2 1 41 LEU MD1 1.780 . 2.176 1.935 1.920 1.951 . 0 0 "[ . 1 . 2]" 1
137 1 25 VAL MG2 1 41 LEU QD 2.104 . 2.657 2.547 2.500 2.582 . 0 0 "[ . 1 . 2]" 1
138 1 22 PHE HZ 1 105 THR MG 2.784 . 3.753 3.873 3.847 3.912 0.159 7 0 "[ . 1 . 2]" 1
139 1 22 PHE QE 1 25 VAL MG1 2.600 . 3.445 3.514 3.497 3.527 0.082 13 0 "[ . 1 . 2]" 1
140 1 12 PHE HB2 1 25 VAL MG1 2.820 . 3.814 3.548 3.499 3.575 . 0 0 "[ . 1 . 2]" 1
141 1 25 VAL MG1 1 29 CYS HB2 2.094 . 2.642 2.118 2.071 2.202 . 0 0 "[ . 1 . 2]" 1
142 1 64 VAL MG2 1 94 THR HA 2.381 . 3.090 2.783 2.699 2.854 . 0 0 "[ . 1 . 2]" 1
143 1 6 VAL H 1 30 VAL QG 3.069 . 4.246 3.266 2.861 3.479 . 0 0 "[ . 1 . 2]" 1
144 1 30 VAL QG 1 35 TYR H 2.963 . 4.061 4.016 3.991 4.054 . 0 0 "[ . 1 . 2]" 1
145 1 30 VAL QG 1 37 PRO HD2 2.070 . 2.605 2.521 2.471 2.560 . 0 0 "[ . 1 . 2]" 1
146 1 30 VAL QG 1 40 LEU QD 2.896 . 3.944 2.418 2.283 2.490 . 0 0 "[ . 1 . 2]" 1
147 1 35 TYR QD 1 40 LEU QD 2.069 . 2.604 2.289 2.266 2.312 . 0 0 "[ . 1 . 2]" 1
148 1 33 VAL HB 1 35 TYR QE 2.479 . 3.247 3.298 3.220 3.337 0.090 15 0 "[ . 1 . 2]" 1
149 1 14 SER QB 1 107 ILE HB 2.724 . 3.651 3.645 3.625 3.688 0.037 15 0 "[ . 1 . 2]" 1
150 1 14 SER QB 1 22 PHE QE 2.613 . 3.467 2.219 2.138 2.256 . 0 0 "[ . 1 . 2]" 1
151 1 11 GLU HG2 1 109 THR MG 3.072 . 4.251 4.371 4.351 4.397 0.146 20 0 "[ . 1 . 2]" 1
152 1 9 PRO HB3 1 109 THR MG 2.932 . 4.007 4.010 3.204 4.094 0.087 11 0 "[ . 1 . 2]" 1
153 1 33 VAL H 1 34 GLY HA3 2.985 . 4.099 4.039 3.929 4.113 0.014 19 0 "[ . 1 . 2]" 1
154 1 9 PRO HB3 1 10 THR MG 2.839 . 3.847 3.550 3.026 3.600 . 0 0 "[ . 1 . 2]" 1
155 1 21 ILE HB 1 23 THR MG 2.516 . 3.307 2.693 2.170 3.208 . 0 0 "[ . 1 . 2]" 1
156 1 21 ILE MG 1 23 THR MG 2.301 . 2.963 2.902 2.832 2.971 0.008 16 0 "[ . 1 . 2]" 1
157 1 16 HIS H 1 23 THR MG 2.757 . 3.707 3.114 3.003 3.243 . 0 0 "[ . 1 . 2]" 1
158 1 10 THR MG 1 108 CYS HA 2.779 . 3.745 3.771 3.731 3.810 0.065 16 0 "[ . 1 . 2]" 1
159 1 23 THR MG 1 24 PHE H 2.581 . 3.414 3.158 3.108 3.189 . 0 0 "[ . 1 . 2]" 1
160 1 11 GLU H 1 32 THR MG 2.851 . 3.867 3.605 2.893 3.901 0.034 15 0 "[ . 1 . 2]" 1
161 1 9 PRO QG 1 32 THR MG 2.639 . 3.510 3.442 3.262 3.575 0.065 20 0 "[ . 1 . 2]" 1
162 1 9 PRO HB3 1 10 THR MG 2.676 . 3.571 3.618 3.047 3.674 0.103 14 0 "[ . 1 . 2]" 1
163 1 44 ASN HB3 1 46 VAL QG 2.645 . 3.519 3.393 3.320 3.463 . 0 0 "[ . 1 . 2]" 1
164 1 46 VAL QG 1 58 ARG QD 2.523 . 3.319 2.482 2.036 2.957 . 0 0 "[ . 1 . 2]" 1
165 1 23 THR HB 1 23 THR MG 1.639 . 1.975 1.902 1.899 1.903 . 0 0 "[ . 1 . 2]" 1
166 1 17 ASN HB3 1 23 THR MG 2.717 . 3.639 2.872 2.486 3.206 . 0 0 "[ . 1 . 2]" 1
167 1 46 VAL HB 1 46 VAL QG 1.639 . 1.975 1.679 1.677 1.681 . 0 0 "[ . 1 . 2]" 1
168 1 44 ASN HD21 1 46 VAL MG1 2.692 . 3.598 3.726 3.685 3.760 0.162 6 0 "[ . 1 . 2]" 1
169 1 46 VAL QG 1 47 GLU HA 2.324 . 2.999 2.742 2.726 2.774 . 0 0 "[ . 1 . 2]" 1
170 1 46 VAL QG 1 49 CYS HB3 2.543 . 3.351 3.153 2.985 3.206 . 0 0 "[ . 1 . 2]" 1
171 1 18 ILE HB 1 65 VAL MG1 2.385 . 3.096 3.141 3.123 3.166 0.070 13 0 "[ . 1 . 2]" 1
172 1 65 VAL MG2 1 66 LYS HA 2.669 . 3.560 3.654 3.599 3.711 0.151 5 0 "[ . 1 . 2]" 1
173 1 65 VAL MG2 1 66 LYS HG3 2.842 . 3.851 3.631 3.246 3.827 . 0 0 "[ . 1 . 2]" 1
174 1 60 SER H 1 74 VAL MG1 2.580 . 3.412 2.709 2.276 2.971 . 0 0 "[ . 1 . 2]" 1
175 1 14 SER QB 1 25 VAL MG2 2.586 . 3.422 3.257 2.936 3.310 . 0 0 "[ . 1 . 2]" 1
176 1 25 VAL HB 1 25 VAL MG2 1.883 . 2.326 1.689 1.669 1.738 . 0 0 "[ . 1 . 2]" 1
177 1 5 ASN HD21 1 30 VAL QG 2.261 . 2.900 1.848 1.556 2.342 0.066 3 0 "[ . 1 . 2]" 1
178 1 33 VAL HB 1 78 PHE HB3 2.627 . 3.490 3.454 3.401 3.485 . 0 0 "[ . 1 . 2]" 1
179 1 78 PHE HB2 1 86 LEU HB3 2.946 . 4.031 4.192 4.178 4.208 0.177 17 0 "[ . 1 . 2]" 1
180 1 78 PHE H 1 86 LEU HB2 3.058 . 4.227 3.099 3.041 3.147 . 0 0 "[ . 1 . 2]" 1
181 1 63 GLN HB2 1 72 LEU HB3 2.859 . 3.881 3.648 3.603 3.682 . 0 0 "[ . 1 . 2]" 1
182 1 12 PHE HZ 1 33 VAL MG2 2.372 . 3.075 2.639 2.604 2.681 . 0 0 "[ . 1 . 2]" 1
183 1 33 VAL MG1 1 33 VAL MG2 1.799 . 2.204 1.776 1.760 1.788 . 0 0 "[ . 1 . 2]" 1
184 1 20 GLY H 1 20 GLY HA3 2.209 . 2.819 2.719 2.704 2.726 . 0 0 "[ . 1 . 2]" 1
185 1 20 GLY HA3 1 44 ASN HD22 2.611 . 3.463 2.985 2.902 3.226 . 0 0 "[ . 1 . 2]" 1
186 1 56 LEU MD2 1 74 VAL MG2 2.052 . 2.578 2.675 2.631 2.702 0.124 10 0 "[ . 1 . 2]" 1
187 1 58 ARG QD 1 58 ARG HG3 1.943 . 2.415 1.985 1.866 2.077 . 0 0 "[ . 1 . 2]" 1
188 1 58 ARG H 1 58 ARG QD 3.057 . 4.225 3.662 3.361 3.968 . 0 0 "[ . 1 . 2]" 1
189 1 58 ARG QB 1 58 ARG HD3 2.041 . 2.562 2.156 1.964 2.416 . 0 0 "[ . 1 . 2]" 1
190 1 53 ASP HB3 1 57 LEU H 2.974 . 4.080 3.881 3.735 3.977 . 0 0 "[ . 1 . 2]" 1
191 1 53 ASP HB2 1 56 LEU MD2 3.032 . 4.181 4.184 3.975 4.231 0.050 6 0 "[ . 1 . 2]" 1
192 1 50 HIS HB3 1 77 ARG HD3 2.973 . 4.078 3.040 2.625 3.992 . 0 0 "[ . 1 . 2]" 1
193 1 51 PRO QG 1 85 TRP HZ2 2.864 . 3.890 3.923 3.902 3.963 0.073 11 0 "[ . 1 . 2]" 1
194 1 89 ARG H 1 89 ARG QD 2.956 . 4.048 4.211 4.191 4.228 0.180 16 0 "[ . 1 . 2]" 1
195 1 15 ARG HD2 1 15 ARG HG2 2.237 . 2.863 2.104 2.018 2.159 . 0 0 "[ . 1 . 2]" 1
196 1 53 ASP HB2 1 57 LEU H 3.061 . 4.232 4.036 3.991 4.091 . 0 0 "[ . 1 . 2]" 1
197 1 15 ARG HD3 1 15 ARG QG 2.408 . 3.133 2.169 2.164 2.175 . 0 0 "[ . 1 . 2]" 1
198 1 8 GLN QG 1 31 ALA MB 2.863 . 3.888 3.519 3.317 3.870 . 0 0 "[ . 1 . 2]" 1
199 1 95 ALA MB 1 97 ASN HA 2.884 . 3.923 3.899 3.753 4.037 0.114 19 0 "[ . 1 . 2]" 1
200 1 94 THR HA 1 95 ALA MB 2.290 . 2.945 3.156 3.083 3.238 0.293 14 0 "[ . 1 . 2]" 1
201 1 95 ALA MB 1 102 GLU QG 2.488 . 3.262 3.193 3.090 3.332 0.070 7 0 "[ . 1 . 2]" 1
202 1 15 ARG QB 1 95 ALA MB 2.194 . 2.796 2.878 2.569 2.969 0.173 4 0 "[ . 1 . 2]" 1
203 1 12 PHE QD 1 26 ASP HB2 2.973 . 4.078 4.119 4.103 4.139 0.061 9 0 "[ . 1 . 2]" 1
204 1 13 ILE HA 1 26 ASP HB2 2.971 . 4.074 4.145 4.122 4.165 0.091 16 0 "[ . 1 . 2]" 1
205 1 43 LYS QE 1 43 LYS HG3 2.109 . 2.665 2.103 2.000 2.469 . 0 0 "[ . 1 . 2]" 1
206 1 12 PHE HB2 1 28 ARG HA 2.607 . 3.456 3.475 3.407 3.573 0.117 6 0 "[ . 1 . 2]" 1
207 1 13 ILE HA 1 26 ASP HB3 2.637 . 3.506 2.517 1.754 3.076 0.014 10 0 "[ . 1 . 2]" 1
208 1 78 PHE QD 1 79 ARG HD3 2.877 . 3.912 3.859 3.114 3.937 0.025 9 0 "[ . 1 . 2]" 1
209 1 79 ARG H 1 79 ARG HD2 2.954 . 4.045 4.109 3.496 4.179 0.134 18 0 "[ . 1 . 2]" 1
210 1 48 PHE HA 1 79 ARG HD2 2.738 . 3.675 3.645 3.442 3.709 0.034 12 0 "[ . 1 . 2]" 1
211 1 51 PRO HA 1 54 GLN H 2.423 . 3.157 2.991 2.926 3.022 . 0 0 "[ . 1 . 2]" 1
212 1 51 PRO HA 1 51 PRO HB2 1.997 . 2.495 2.534 2.512 2.542 0.047 9 0 "[ . 1 . 2]" 1
213 1 64 VAL HA 1 66 LYS H 3.056 . 4.224 3.901 3.796 3.997 . 0 0 "[ . 1 . 2]" 1
214 1 12 PHE HZ 1 107 ILE MG 2.574 . 3.402 3.321 3.279 3.359 . 0 0 "[ . 1 . 2]" 1
215 1 88 MET HA 1 107 ILE MG 2.635 . 3.503 3.428 3.402 3.444 . 0 0 "[ . 1 . 2]" 1
216 1 43 LYS QD 1 43 LYS QE 1.809 . 2.218 1.824 1.781 1.862 . 0 0 "[ . 1 . 2]" 1
217 1 12 PHE HB2 1 12 PHE QD 2.285 . 2.938 2.301 2.280 2.325 . 0 0 "[ . 1 . 2]" 1
218 1 12 PHE HB2 1 12 PHE QE 3.024 . 4.167 3.196 2.422 3.773 . 0 0 "[ . 1 . 2]" 1
219 1 12 PHE HA 1 12 PHE HB2 2.158 . 2.740 2.171 2.166 2.174 . 0 0 "[ . 1 . 2]" 1
220 1 26 ASP HB3 1 106 ILE MG 2.825 . 3.823 3.490 3.439 3.535 . 0 0 "[ . 1 . 2]" 1
221 1 15 ARG QB 1 24 PHE HB2 2.303 . 2.966 3.007 2.988 3.046 0.080 19 0 "[ . 1 . 2]" 1
222 1 38 GLN QB 1 41 LEU QB 2.899 . 3.949 3.550 3.503 3.624 . 0 0 "[ . 1 . 2]" 1
223 1 25 VAL MG2 1 41 LEU QB 2.806 . 3.791 3.352 3.292 3.387 . 0 0 "[ . 1 . 2]" 1
224 1 46 VAL HA 1 47 GLU HA 3.057 . 4.225 3.799 3.707 3.850 . 0 0 "[ . 1 . 2]" 1
225 1 46 VAL HA 1 46 VAL QG 1.951 . 2.427 2.567 2.529 2.593 0.166 16 0 "[ . 1 . 2]" 1
226 1 13 ILE HG13 1 13 ILE MG 2.270 . 2.914 2.750 2.695 2.818 . 0 0 "[ . 1 . 2]" 1
227 1 106 ILE MG 1 108 CYS H 2.935 . 4.012 2.926 2.877 2.942 . 0 0 "[ . 1 . 2]" 1
228 1 12 PHE H 1 106 ILE MG 2.397 . 3.115 3.114 3.078 3.135 0.020 16 0 "[ . 1 . 2]" 1
229 1 11 GLU HA 1 106 ILE MG 2.736 . 3.672 3.575 3.553 3.618 . 0 0 "[ . 1 . 2]" 1
230 1 88 MET HA 1 107 ILE MG 2.858 . 3.879 3.216 3.194 3.230 . 0 0 "[ . 1 . 2]" 1
231 1 11 GLU HB3 1 106 ILE MG 2.399 . 3.119 2.431 2.386 2.452 . 0 0 "[ . 1 . 2]" 1
232 1 17 ASN HD21 1 18 ILE MG 2.785 . 3.755 3.862 3.588 3.911 0.156 18 0 "[ . 1 . 2]" 1
233 1 17 ASN HB2 1 18 ILE MG 2.118 . 2.679 2.731 2.705 2.810 0.131 18 0 "[ . 1 . 2]" 1
234 1 64 VAL MG2 1 94 THR HA 2.311 . 2.978 2.221 1.954 2.353 . 0 0 "[ . 1 . 2]" 1
235 1 43 LYS HB2 1 45 ILE HA 2.801 . 3.782 3.763 3.731 3.788 0.006 3 0 "[ . 1 . 2]" 1
236 1 67 LEU HB3 1 67 LEU QD 2.070 . 2.606 2.122 2.113 2.133 . 0 0 "[ . 1 . 2]" 1
237 1 21 ILE MG 1 43 LYS HA 2.480 . 3.249 3.203 3.046 3.258 0.009 16 0 "[ . 1 . 2]" 1
238 1 16 HIS HB2 1 21 ILE MG 2.979 . 4.089 4.220 4.194 4.236 0.147 16 0 "[ . 1 . 2]" 1
239 1 35 TYR HB3 1 39 GLU HB2 2.601 . 3.447 2.933 2.829 2.978 . 0 0 "[ . 1 . 2]" 1
240 1 65 VAL HA 1 66 LYS H 2.522 . 3.317 3.006 2.935 3.090 . 0 0 "[ . 1 . 2]" 1
241 1 64 VAL MG2 1 65 VAL HA 1.855 . 2.285 2.074 2.060 2.126 . 0 0 "[ . 1 . 2]" 1
242 1 18 ILE HA 1 20 GLY H 2.850 . 3.865 3.697 3.669 3.720 . 0 0 "[ . 1 . 2]" 1
243 1 18 ILE HA 1 18 ILE MD 2.140 . 2.712 1.807 1.791 1.821 . 0 0 "[ . 1 . 2]" 1
244 1 75 MET ME 1 76 PHE H 2.637 . 3.507 3.285 2.579 3.380 . 0 0 "[ . 1 . 2]" 1
245 1 75 MET ME 1 87 TRP HE3 2.310 . 2.977 1.752 1.664 1.800 . 0 0 "[ . 1 . 2]" 1
246 1 75 MET ME 1 87 TRP HZ3 2.554 . 3.369 2.656 2.583 2.751 . 0 0 "[ . 1 . 2]" 1
247 1 21 ILE MD 1 44 ASN HB3 2.526 . 3.323 2.946 2.902 2.980 . 0 0 "[ . 1 . 2]" 1
248 1 22 PHE HB3 1 24 PHE H 2.659 . 3.543 2.302 2.273 2.330 . 0 0 "[ . 1 . 2]" 1
249 1 44 ASN HB3 1 46 VAL QG 2.874 . 3.906 3.144 3.096 3.196 . 0 0 "[ . 1 . 2]" 1
250 1 56 LEU HG 1 59 ASP HB3 2.791 . 3.765 3.804 3.781 3.849 0.084 17 0 "[ . 1 . 2]" 1
251 1 20 GLY H 1 45 ILE MG 2.798 . 3.777 3.786 3.757 3.805 0.028 6 0 "[ . 1 . 2]" 1
252 1 16 HIS HB2 1 45 ILE MG 2.952 . 4.041 3.812 3.737 3.875 . 0 0 "[ . 1 . 2]" 1
253 1 21 ILE MG 1 22 PHE HB2 2.732 . 3.665 3.125 3.106 3.140 . 0 0 "[ . 1 . 2]" 1
254 1 22 PHE HB3 1 25 VAL HB 3.036 . 4.188 4.070 4.051 4.085 . 0 0 "[ . 1 . 2]" 1
255 1 59 ASP H 1 59 ASP HB3 2.105 . 2.659 2.215 2.112 2.328 . 0 0 "[ . 1 . 2]" 1
256 1 13 ILE HA 1 106 ILE HB 2.902 . 3.955 3.576 3.513 3.657 . 0 0 "[ . 1 . 2]" 1
257 1 13 ILE HA 1 13 ILE MG 2.227 . 2.847 2.055 2.022 2.080 . 0 0 "[ . 1 . 2]" 1
258 1 17 ASN HB2 1 21 ILE HG12 2.996 . 4.118 4.200 4.126 4.249 0.131 16 0 "[ . 1 . 2]" 1
259 1 17 ASN HB3 1 21 ILE HB 3.024 . 4.167 3.726 3.504 4.028 . 0 0 "[ . 1 . 2]" 1
260 1 13 ILE HA 1 13 ILE HG13 2.876 . 3.910 2.547 2.490 2.610 . 0 0 "[ . 1 . 2]" 1
261 1 60 SER HA 1 63 GLN QG 2.604 . 3.452 3.046 2.946 3.133 . 0 0 "[ . 1 . 2]" 1
262 1 15 ARG QG 1 104 GLU HG3 2.730 . 3.661 1.898 1.827 2.512 . 0 0 "[ . 1 . 2]" 1
263 1 39 GLU QG 1 81 LYS HD2 2.817 . 3.809 3.165 2.897 3.414 . 0 0 "[ . 1 . 2]" 1
264 1 13 ILE HA 1 104 GLU HG2 2.968 . 4.069 4.086 4.005 4.135 0.066 5 0 "[ . 1 . 2]" 1
265 1 15 ARG QG 1 104 GLU HG2 2.866 . 3.892 3.251 3.164 3.856 . 0 0 "[ . 1 . 2]" 1
266 1 12 PHE QD 1 25 VAL HA 2.730 . 3.662 2.939 2.915 2.957 . 0 0 "[ . 1 . 2]" 1
267 1 97 ASN H 1 97 ASN QB 2.920 . 3.986 2.955 2.204 3.277 . 0 0 "[ . 1 . 2]" 1
268 1 97 ASN QB 1 98 PRO HA 2.397 . 3.115 2.604 2.011 3.218 0.103 1 0 "[ . 1 . 2]" 1
269 1 97 ASN HA 1 97 ASN QB 2.316 . 2.987 2.263 2.168 2.522 . 0 0 "[ . 1 . 2]" 1
270 1 91 SER HB3 1 105 THR HA 2.848 . 3.862 3.614 3.589 3.655 . 0 0 "[ . 1 . 2]" 1
271 1 10 THR HA 1 11 GLU HA 2.982 . 4.093 3.856 3.787 3.938 . 0 0 "[ . 1 . 2]" 1
272 1 107 ILE HA 1 107 ILE HG13 2.073 . 2.610 2.259 2.247 2.293 . 0 0 "[ . 1 . 2]" 1
273 1 89 ARG H 1 107 ILE HA 3.003 . 4.130 3.840 3.804 3.867 . 0 0 "[ . 1 . 2]" 1
274 1 22 PHE QE 1 107 ILE MD 2.101 . 2.653 2.564 2.511 2.594 . 0 0 "[ . 1 . 2]" 1
275 1 14 SER QB 1 107 ILE MD 2.415 . 3.144 2.836 2.825 2.866 . 0 0 "[ . 1 . 2]" 1
276 1 33 VAL MG1 1 107 ILE MD 2.624 . 3.485 3.476 3.448 3.502 0.017 17 0 "[ . 1 . 2]" 1
277 1 12 PHE H 1 107 ILE MD 2.799 . 3.778 3.797 3.763 3.812 0.034 10 0 "[ . 1 . 2]" 1
278 1 14 SER H 1 106 ILE MD 2.841 . 3.850 3.846 3.743 3.874 0.024 8 0 "[ . 1 . 2]" 1
279 1 13 ILE MD 1 13 ILE HG13 2.428 . 3.165 1.975 1.963 1.988 . 0 0 "[ . 1 . 2]" 1
280 1 12 PHE QD 1 33 VAL MG1 2.749 . 3.694 3.368 3.304 3.437 . 0 0 "[ . 1 . 2]" 1
281 1 33 VAL MG1 1 35 TYR QD 2.410 . 3.136 2.468 2.412 2.512 . 0 0 "[ . 1 . 2]" 1
282 1 82 ASN HB3 1 83 GLN H 3.062 . 4.234 3.660 3.512 3.841 . 0 0 "[ . 1 . 2]" 1
283 1 97 ASN HB2 1 99 TYR H 2.623 . 3.483 2.934 2.689 3.174 . 0 0 "[ . 1 . 2]" 1
284 1 99 TYR HB2 1 102 GLU HB3 2.861 . 3.884 2.945 2.531 3.315 . 0 0 "[ . 1 . 2]" 1
285 1 14 SER HA 1 22 PHE QD 2.679 . 3.576 3.700 3.667 3.721 0.145 9 0 "[ . 1 . 2]" 1
286 1 16 HIS HB2 1 22 PHE QD 2.488 . 3.262 2.806 2.781 2.840 . 0 0 "[ . 1 . 2]" 1
287 1 22 PHE QD 1 25 VAL HB 2.930 . 4.003 3.797 3.706 3.956 . 0 0 "[ . 1 . 2]" 1
288 1 12 PHE QD 1 28 ARG HB2 3.000 . 4.125 3.473 3.059 3.660 . 0 0 "[ . 1 . 2]" 1
289 1 15 ARG QB 1 99 TYR QD 2.886 . 3.927 3.353 2.872 3.549 . 0 0 "[ . 1 . 2]" 1
290 1 12 PHE QD 1 13 ILE HG13 2.884 . 3.924 2.670 2.335 3.206 . 0 0 "[ . 1 . 2]" 1
291 1 99 TYR HB3 1 102 GLU HB3 2.691 . 3.596 1.962 1.828 2.209 . 0 0 "[ . 1 . 2]" 1
292 1 21 ILE HA 1 22 PHE HA 3.068 . 4.245 3.979 3.951 4.020 . 0 0 "[ . 1 . 2]" 1
293 1 78 PHE QD 1 79 ARG H 2.506 . 3.291 3.127 3.079 3.176 . 0 0 "[ . 1 . 2]" 1
294 1 33 VAL HB 1 78 PHE QD 2.370 . 3.072 2.714 2.684 2.751 . 0 0 "[ . 1 . 2]" 1
295 1 78 PHE QD 1 79 ARG HB3 2.792 . 3.766 3.862 3.820 3.897 0.131 12 0 "[ . 1 . 2]" 1
296 1 45 ILE HG13 1 78 PHE QD 2.835 . 3.840 3.745 3.701 3.831 . 0 0 "[ . 1 . 2]" 1
297 1 61 PHE H 1 61 PHE QB 2.207 . 2.816 2.101 2.089 2.105 . 0 0 "[ . 1 . 2]" 1
298 1 61 PHE QB 1 61 PHE QE 3.080 . 4.266 3.777 3.767 3.784 . 0 0 "[ . 1 . 2]" 1
299 1 19 GLU QG 1 21 ILE HG12 2.858 . 3.879 2.742 2.183 3.297 . 0 0 "[ . 1 . 2]" 1
300 1 17 ASN HB3 1 102 GLU QG 2.802 . 3.783 1.970 1.831 2.223 . 0 0 "[ . 1 . 2]" 1
301 1 89 ARG HB2 1 90 THR HA 3.066 . 4.241 4.254 4.220 4.274 0.033 10 0 "[ . 1 . 2]" 1
302 1 74 VAL MG2 1 90 THR HA 2.623 . 3.483 3.489 3.471 3.511 0.028 16 0 "[ . 1 . 2]" 1
303 1 21 ILE HA 1 21 ILE HG12 2.364 . 3.063 2.681 2.667 2.699 . 0 0 "[ . 1 . 2]" 1
304 1 53 ASP HB3 1 54 GLN HA 3.033 . 4.183 4.086 3.895 4.215 0.032 14 0 "[ . 1 . 2]" 1
305 1 54 GLN HA 1 57 LEU HB3 2.535 . 3.338 2.497 2.402 3.014 . 0 0 "[ . 1 . 2]" 1
306 1 54 GLN HA 1 55 GLN H 2.909 . 3.967 2.772 2.765 2.779 . 0 0 "[ . 1 . 2]" 1
307 1 21 ILE HA 1 44 ASN HD21 2.721 . 3.646 2.993 2.925 3.095 . 0 0 "[ . 1 . 2]" 1
308 1 21 ILE HB 1 21 ILE HG12 2.301 . 2.963 2.335 2.076 2.507 . 0 0 "[ . 1 . 2]" 1
309 1 29 CYS HA 1 33 VAL MG1 2.798 . 3.777 3.499 3.460 3.558 . 0 0 "[ . 1 . 2]" 1
310 1 24 PHE HA 1 25 VAL HB 3.067 . 4.243 4.220 4.207 4.236 . 0 0 "[ . 1 . 2]" 1
311 1 24 PHE QD 1 26 ASP HB3 3.065 . 4.239 4.347 4.327 4.364 0.125 3 0 "[ . 1 . 2]" 1
312 1 13 ILE HB 1 24 PHE QD 2.966 . 4.066 3.992 3.865 4.047 . 0 0 "[ . 1 . 2]" 1
313 1 12 PHE QD 1 25 VAL HB 3.022 . 4.164 4.180 4.155 4.199 0.035 4 0 "[ . 1 . 2]" 1
314 1 27 HIS HA 1 27 HIS HB3 1.953 . 2.430 2.145 1.989 2.177 . 0 0 "[ . 1 . 2]" 1
315 1 81 LYS H 1 81 LYS HA 2.278 . 2.927 2.684 2.669 2.708 . 0 0 "[ . 1 . 2]" 1
316 1 81 LYS HA 1 81 LYS HB3 2.138 . 2.709 2.724 2.670 2.738 0.029 7 0 "[ . 1 . 2]" 1
317 1 54 GLN HG2 1 76 PHE QD 3.040 . 4.195 4.097 4.053 4.149 . 0 0 "[ . 1 . 2]" 1
318 1 54 GLN H 1 54 GLN HG2 2.490 . 3.265 2.883 2.841 3.131 . 0 0 "[ . 1 . 2]" 1
319 1 92 SER HA 1 93 GLN HB3 3.055 . 4.221 4.261 4.214 4.292 0.071 19 0 "[ . 1 . 2]" 1
320 1 52 GLU HA 1 53 ASP H 2.750 . 3.695 3.100 3.089 3.123 . 0 0 "[ . 1 . 2]" 1
321 1 12 PHE QE 1 22 PHE QE 2.881 . 3.919 3.658 3.623 3.729 . 0 0 "[ . 1 . 2]" 1
322 1 78 PHE H 1 85 TRP HA 2.645 . 3.519 3.434 3.389 3.479 . 0 0 "[ . 1 . 2]" 1
323 1 12 PHE H 1 106 ILE HA 2.781 . 3.748 3.907 3.892 3.926 0.178 20 0 "[ . 1 . 2]" 1
324 1 15 ARG QB 1 24 PHE HA 2.870 . 3.900 3.658 3.276 3.726 . 0 0 "[ . 1 . 2]" 1
325 1 3 MET ME 1 37 PRO HD2 2.686 . 3.588 3.205 1.815 3.838 0.250 10 0 "[ . 1 . 2]" 1
326 1 70 GLN QB 1 94 THR MG 2.997 . 4.120 4.220 4.186 4.269 0.149 13 0 "[ . 1 . 2]" 1
327 1 5 ASN HD22 1 30 VAL QG 2.465 . 3.225 2.003 1.844 2.261 . 0 0 "[ . 1 . 2]" 1
328 1 12 PHE HZ 1 33 VAL MG1 2.501 . 3.283 2.868 2.823 2.906 . 0 0 "[ . 1 . 2]" 1
329 1 76 PHE H 1 76 PHE QE 3.103 . 4.307 3.984 3.933 4.014 . 0 0 "[ . 1 . 2]" 1
330 1 76 PHE QE 1 89 ARG H 2.921 . 3.987 3.976 3.921 4.002 0.015 11 0 "[ . 1 . 2]" 1
331 1 49 CYS HB3 1 76 PHE QE 2.769 . 3.728 3.682 3.660 3.719 . 0 0 "[ . 1 . 2]" 1
332 1 45 ILE HG12 1 76 PHE QE 2.802 . 3.784 3.409 3.364 3.455 . 0 0 "[ . 1 . 2]" 1
333 1 18 ILE MD 1 61 PHE QD 2.831 . 3.833 3.059 3.037 3.094 . 0 0 "[ . 1 . 2]" 1
334 1 76 PHE HA 1 77 ARG H 2.085 . 2.628 2.285 2.260 2.309 . 0 0 "[ . 1 . 2]" 1
335 1 93 GLN H 1 93 GLN HA 2.048 . 2.572 2.168 2.140 2.219 . 0 0 "[ . 1 . 2]" 1
336 1 12 PHE HA 1 12 PHE HB2 1.915 . 2.373 1.969 1.952 1.992 . 0 0 "[ . 1 . 2]" 1
337 1 12 PHE HA 1 28 ARG HB2 2.628 . 3.491 2.158 2.036 2.422 . 0 0 "[ . 1 . 2]" 1
338 1 12 PHE HA 1 28 ARG HB3 2.593 . 3.433 3.434 3.276 3.531 0.098 11 0 "[ . 1 . 2]" 1
339 1 71 VAL QG 1 93 GLN HA 2.576 . 3.405 3.403 3.306 3.442 0.037 15 0 "[ . 1 . 2]" 1
340 1 46 VAL QG 1 49 CYS HB2 2.633 . 3.500 3.552 3.508 3.626 0.126 17 0 "[ . 1 . 2]" 1
341 1 22 PHE QE 1 40 LEU QD 2.422 . 3.155 1.782 1.766 1.804 . 0 0 "[ . 1 . 2]" 1
342 1 22 PHE QE 1 40 LEU HB3 2.672 . 3.565 2.857 2.824 2.899 . 0 0 "[ . 1 . 2]" 1
343 1 22 PHE QE 1 45 ILE HG12 2.896 . 3.944 4.094 4.070 4.111 0.167 6 0 "[ . 1 . 2]" 1
344 1 22 PHE QE 1 48 PHE QE 2.469 . 3.231 3.093 3.055 3.154 . 0 0 "[ . 1 . 2]" 1
345 1 22 PHE QE 1 45 ILE H 3.312 . 4.683 4.004 3.961 4.021 . 0 0 "[ . 1 . 2]" 1
346 1 44 ASN HD22 1 45 ILE H 3.567 . 5.158 4.414 4.370 4.538 . 0 0 "[ . 1 . 2]" 1
347 1 13 ILE MG 1 107 ILE H 2.949 . 4.036 4.065 4.047 4.077 0.041 11 0 "[ . 1 . 2]" 1
348 1 20 GLY H 1 44 ASN HD22 3.525 . 5.078 4.078 4.018 4.164 . 0 0 "[ . 1 . 2]" 1
349 1 18 ILE HG13 1 20 GLY H 3.663 . 5.340 4.501 4.473 4.565 . 0 0 "[ . 1 . 2]" 1
350 1 20 GLY H 1 45 ILE MG 3.267 . 4.601 3.964 3.949 3.978 . 0 0 "[ . 1 . 2]" 1
351 1 50 HIS H 1 78 PHE H 3.671 . 5.356 4.526 4.468 4.577 . 0 0 "[ . 1 . 2]" 1
352 1 78 PHE H 1 85 TRP HA 2.970 . 4.072 3.701 3.641 3.748 . 0 0 "[ . 1 . 2]" 1
353 1 33 VAL HB 1 80 SER H 2.892 . 3.937 3.472 3.427 3.514 . 0 0 "[ . 1 . 2]" 1
354 1 78 PHE H 1 86 LEU HB2 2.974 . 4.080 3.014 2.939 3.067 . 0 0 "[ . 1 . 2]" 1
355 1 77 ARG HB3 1 78 PHE H 2.732 . 3.665 3.385 3.357 3.408 . 0 0 "[ . 1 . 2]" 1
356 1 33 VAL MG1 1 78 PHE H 3.588 . 5.197 4.237 4.183 4.277 . 0 0 "[ . 1 . 2]" 1
357 1 93 GLN HG2 1 104 GLU H 3.576 . 5.174 4.547 4.422 4.693 . 0 0 "[ . 1 . 2]" 1
358 1 64 VAL MG1 1 104 GLU H 3.420 . 4.882 4.727 4.687 4.773 . 0 0 "[ . 1 . 2]" 1
359 1 16 HIS HB2 1 22 PHE H 3.375 . 4.798 3.594 3.543 3.644 . 0 0 "[ . 1 . 2]" 1
360 1 21 ILE HG12 1 22 PHE H 3.089 . 4.282 4.409 4.377 4.427 0.145 19 0 "[ . 1 . 2]" 1
361 1 15 ARG QB 1 25 VAL H 3.641 . 5.298 4.712 4.610 4.792 . 0 0 "[ . 1 . 2]" 1
362 1 12 PHE H 1 108 CYS H 3.387 . 4.821 4.236 4.188 4.277 . 0 0 "[ . 1 . 2]" 1
363 1 105 THR MG 1 108 CYS H 3.625 . 5.268 5.057 5.028 5.089 . 0 0 "[ . 1 . 2]" 1
364 1 75 MET ME 1 87 TRP H 3.408 . 4.860 4.833 4.524 4.881 0.021 20 0 "[ . 1 . 2]" 1
365 1 24 PHE H 1 25 VAL HB 3.398 . 4.841 4.123 4.054 4.186 . 0 0 "[ . 1 . 2]" 1
366 1 56 LEU MD2 1 74 VAL H 3.480 . 4.994 4.593 4.566 4.618 . 0 0 "[ . 1 . 2]" 1
367 1 28 ARG H 1 28 ARG QD 3.069 . 4.246 4.192 3.948 4.354 0.108 11 0 "[ . 1 . 2]" 1
368 1 12 PHE HB2 1 28 ARG H 3.216 . 4.509 3.056 3.019 3.152 . 0 0 "[ . 1 . 2]" 1
369 1 10 THR MG 1 28 ARG H 3.767 . 5.541 5.597 5.555 5.619 0.078 11 0 "[ . 1 . 2]" 1
370 1 61 PHE H 1 62 GLN HG2 3.276 . 4.618 4.603 4.468 4.666 0.048 12 0 "[ . 1 . 2]" 1
371 1 46 VAL QG 1 61 PHE H 3.345 . 4.744 4.150 4.113 4.180 . 0 0 "[ . 1 . 2]" 1
372 1 70 GLN QB 1 71 VAL H 2.504 . 3.288 3.401 3.366 3.418 0.130 10 0 "[ . 1 . 2]" 1
373 1 17 ASN HB2 1 103 ILE H 3.716 . 5.442 5.357 5.223 5.451 0.009 15 0 "[ . 1 . 2]" 1
374 1 13 ILE H 1 28 ARG HB2 3.090 . 4.284 3.356 3.313 3.432 . 0 0 "[ . 1 . 2]" 1
375 1 13 ILE HG13 1 14 SER H 3.336 . 4.727 4.460 4.413 4.545 . 0 0 "[ . 1 . 2]" 1
376 1 14 SER H 1 22 PHE QE 3.678 . 5.369 4.397 4.348 4.510 . 0 0 "[ . 1 . 2]" 1
377 1 14 SER H 1 106 ILE MG 3.272 . 4.611 3.840 3.696 3.877 . 0 0 "[ . 1 . 2]" 1
378 1 64 VAL MG2 1 67 LEU H 3.240 . 4.552 4.527 4.476 4.552 . 0 0 "[ . 1 . 2]" 1
379 1 19 GLU QG 1 21 ILE H 3.156 . 4.401 4.166 4.132 4.219 . 0 0 "[ . 1 . 2]" 1
380 1 19 GLU QB 1 21 ILE H 2.910 . 3.969 2.451 2.249 2.500 . 0 0 "[ . 1 . 2]" 1
381 1 22 PHE QE 1 43 LYS H 3.674 . 5.361 5.235 5.201 5.289 . 0 0 "[ . 1 . 2]" 1
382 1 6 VAL QG 1 31 ALA H 2.879 . 3.915 2.337 2.250 2.408 . 0 0 "[ . 1 . 2]" 1
383 1 76 PHE H 1 88 MET HB3 3.418 . 4.878 4.217 4.192 4.245 . 0 0 "[ . 1 . 2]" 1
384 1 74 VAL MG2 1 76 PHE H 3.309 . 4.678 4.152 4.112 4.167 . 0 0 "[ . 1 . 2]" 1
385 1 29 CYS H 1 32 THR HB 3.373 . 4.795 4.157 4.081 4.200 . 0 0 "[ . 1 . 2]" 1
386 1 27 HIS HB3 1 29 CYS H 3.294 . 4.650 4.128 4.097 4.159 . 0 0 "[ . 1 . 2]" 1
387 1 6 VAL QG 1 29 CYS H 3.284 . 4.632 3.619 3.534 3.720 . 0 0 "[ . 1 . 2]" 1
388 1 27 HIS HA 1 29 CYS H 2.667 . 3.556 3.112 3.013 3.126 . 0 0 "[ . 1 . 2]" 1
389 1 67 LEU HB3 1 70 GLN H 3.040 . 4.195 3.322 3.190 3.415 . 0 0 "[ . 1 . 2]" 1
390 1 53 ASP HB2 1 56 LEU H 3.546 . 5.117 4.559 4.525 4.619 . 0 0 "[ . 1 . 2]" 1
391 1 54 GLN HB2 1 57 LEU H 3.234 . 4.542 4.576 4.493 4.606 0.064 11 0 "[ . 1 . 2]" 1
392 1 102 GLU H 1 102 GLU HB3 2.440 . 3.184 2.623 2.472 2.822 . 0 0 "[ . 1 . 2]" 1
393 1 94 THR HA 1 102 GLU H 3.412 . 4.867 4.208 4.053 4.435 . 0 0 "[ . 1 . 2]" 1
394 1 54 GLN HG2 1 56 LEU H 3.642 . 5.300 5.459 5.426 5.533 0.233 6 0 "[ . 1 . 2]" 1
395 1 46 VAL QG 1 56 LEU H 3.613 . 5.245 5.066 5.020 5.122 . 0 0 "[ . 1 . 2]" 1
396 1 11 GLU H 1 106 ILE MG 3.656 . 5.327 4.990 4.956 5.049 . 0 0 "[ . 1 . 2]" 1
397 1 62 GLN HB3 1 66 LYS H 3.738 . 5.485 5.036 4.982 5.108 . 0 0 "[ . 1 . 2]" 1
398 1 67 LEU HB3 1 68 LYS H 2.710 . 3.628 2.911 2.505 3.314 . 0 0 "[ . 1 . 2]" 1
399 1 66 LYS H 1 67 LEU MD2 2.942 . 4.024 4.107 4.093 4.122 0.098 1 0 "[ . 1 . 2]" 1
400 1 62 GLN HA 1 66 LYS H 2.733 . 3.667 3.165 3.126 3.197 . 0 0 "[ . 1 . 2]" 1
401 1 66 LYS H 1 66 LYS HG2 2.807 . 3.792 3.278 3.225 3.348 . 0 0 "[ . 1 . 2]" 1
402 1 64 VAL MG1 1 66 LYS H 3.609 . 5.237 4.637 4.563 4.683 . 0 0 "[ . 1 . 2]" 1
403 1 64 VAL MG2 1 66 LYS H 2.605 . 3.453 3.477 3.463 3.500 0.047 16 0 "[ . 1 . 2]" 1
404 1 46 VAL QG 1 49 CYS H 3.001 . 4.127 3.807 3.752 3.829 . 0 0 "[ . 1 . 2]" 1
405 1 49 CYS H 1 54 GLN HG3 3.492 . 5.016 4.509 4.376 4.566 . 0 0 "[ . 1 . 2]" 1
406 1 44 ASN HD22 1 46 VAL H 3.513 . 5.055 3.678 3.568 3.775 . 0 0 "[ . 1 . 2]" 1
407 1 21 ILE HA 1 46 VAL H 3.506 . 5.042 4.631 4.592 4.660 . 0 0 "[ . 1 . 2]" 1
408 1 59 ASP H 1 74 VAL MG2 3.705 . 5.421 4.137 4.043 4.249 . 0 0 "[ . 1 . 2]" 1
409 1 9 PRO HB2 1 109 THR H 3.178 . 4.440 4.271 4.137 4.503 0.063 6 0 "[ . 1 . 2]" 1
410 1 56 LEU MD2 1 59 ASP H 3.385 . 4.817 4.921 4.735 4.948 0.131 12 0 "[ . 1 . 2]" 1
411 1 46 VAL QG 1 59 ASP H 3.569 . 5.161 5.209 5.170 5.242 0.081 14 0 "[ . 1 . 2]" 1
412 1 51 PRO HA 1 55 GLN H 3.481 . 4.995 4.549 4.397 4.608 . 0 0 "[ . 1 . 2]" 1
413 1 11 GLU HB2 1 109 THR H 2.762 . 3.716 3.746 3.682 3.766 0.050 16 0 "[ . 1 . 2]" 1
414 1 55 GLN H 1 56 LEU QD 3.738 . 5.484 4.846 4.558 4.900 . 0 0 "[ . 1 . 2]" 1
415 1 44 ASN HD21 1 46 VAL H 3.623 . 5.264 4.275 4.240 4.327 . 0 0 "[ . 1 . 2]" 1
416 1 46 VAL H 1 48 PHE HD1 3.742 . 5.493 4.609 4.570 4.663 . 0 0 "[ . 1 . 2]" 1
417 1 11 GLU HB2 1 109 THR H 3.013 . 4.148 3.496 3.451 3.540 . 0 0 "[ . 1 . 2]" 1
418 1 59 ASP H 1 74 VAL MG2 3.630 . 5.277 4.044 3.960 4.142 . 0 0 "[ . 1 . 2]" 1
419 1 46 VAL HA 1 54 GLN H 3.748 . 5.504 5.193 5.164 5.229 . 0 0 "[ . 1 . 2]" 1
420 1 54 GLN H 1 56 LEU MD2 3.762 . 5.531 4.761 4.478 4.807 . 0 0 "[ . 1 . 2]" 1
421 1 54 GLN HB2 1 58 ARG H 3.516 . 5.061 4.880 4.831 5.021 . 0 0 "[ . 1 . 2]" 1
422 1 38 GLN HG2 1 41 LEU H 3.637 . 5.290 4.425 4.345 4.491 . 0 0 "[ . 1 . 2]" 1
423 1 30 VAL HA 1 36 GLN H 3.421 . 4.884 3.957 3.904 3.998 . 0 0 "[ . 1 . 2]" 1
424 1 50 HIS HE1 1 53 ASP H 3.394 . 4.834 4.610 4.535 4.662 . 0 0 "[ . 1 . 2]" 1
425 1 52 GLU HB3 1 53 ASP H 2.817 . 3.809 3.831 3.675 3.863 0.054 15 0 "[ . 1 . 2]" 1
426 1 50 HIS HB2 1 53 ASP H 3.213 . 4.503 4.441 4.386 4.480 . 0 0 "[ . 1 . 2]" 1
427 1 27 HIS H 1 27 HIS HB2 2.663 . 3.549 3.211 3.077 3.326 . 0 0 "[ . 1 . 2]" 1
428 1 12 PHE HB2 1 27 HIS H 3.102 . 4.305 4.114 4.084 4.162 . 0 0 "[ . 1 . 2]" 1
429 1 45 ILE MG 1 47 GLU H 3.328 . 4.713 3.897 3.852 3.922 . 0 0 "[ . 1 . 2]" 1
430 1 48 PHE H 1 48 PHE QE 3.373 . 4.795 4.165 4.118 4.220 . 0 0 "[ . 1 . 2]" 1
431 1 40 LEU HB3 1 41 LEU H 3.077 . 4.261 2.965 2.927 2.992 . 0 0 "[ . 1 . 2]" 1
432 1 56 LEU HB3 1 60 SER H 3.255 . 4.579 4.490 4.434 4.532 . 0 0 "[ . 1 . 2]" 1
433 1 56 LEU MD2 1 60 SER H 3.494 . 5.020 4.924 4.896 4.947 . 0 0 "[ . 1 . 2]" 1
434 1 41 LEU H 1 41 LEU MD2 2.704 . 3.618 3.492 3.457 3.540 . 0 0 "[ . 1 . 2]" 1
435 1 79 ARG HB3 1 84 GLU H 3.581 . 5.184 4.742 4.404 4.908 . 0 0 "[ . 1 . 2]" 1
436 1 93 GLN H 1 94 THR HA 3.192 . 4.466 3.745 3.683 3.847 . 0 0 "[ . 1 . 2]" 1
437 1 16 HIS H 1 22 PHE HA 2.896 . 3.944 3.495 3.217 3.589 . 0 0 "[ . 1 . 2]" 1
438 1 32 THR H 1 35 TYR H 3.133 . 4.360 4.329 4.287 4.363 0.003 20 0 "[ . 1 . 2]" 1
439 1 35 TYR H 1 81 LYS HB3 3.278 . 4.621 3.781 3.608 3.859 . 0 0 "[ . 1 . 2]" 1
440 1 29 CYS HB2 1 35 TYR H 3.635 . 5.286 4.513 4.443 4.573 . 0 0 "[ . 1 . 2]" 1
441 1 33 VAL MG1 1 35 TYR H 2.953 . 4.043 3.370 3.349 3.387 . 0 0 "[ . 1 . 2]" 1
442 1 71 VAL QG 1 94 THR H 3.344 . 4.742 4.644 4.383 4.745 0.003 15 0 "[ . 1 . 2]" 1
443 1 37 PRO HB3 1 40 LEU H 3.389 . 4.825 4.332 4.299 4.362 . 0 0 "[ . 1 . 2]" 1
444 1 37 PRO HB2 1 40 LEU H 3.541 . 5.108 4.399 4.244 4.863 . 0 0 "[ . 1 . 2]" 1
445 1 17 ASN H 1 21 ILE MG 3.317 . 4.692 4.240 4.199 4.399 . 0 0 "[ . 1 . 2]" 1
446 1 16 HIS HD1 1 23 THR MG 3.662 . 5.339 4.014 3.914 4.104 . 0 0 "[ . 1 . 2]" 1
447 1 16 HIS H 1 16 HIS HD1 3.745 . 5.498 3.476 3.439 3.499 . 0 0 "[ . 1 . 2]" 1
448 1 56 LEU MD2 1 90 THR H 3.345 . 4.744 4.474 4.454 4.494 . 0 0 "[ . 1 . 2]" 1
449 1 62 GLN H 1 103 ILE MD 3.503 . 5.037 4.345 4.304 4.400 . 0 0 "[ . 1 . 2]" 1
450 1 71 VAL QG 1 91 SER H 3.300 . 4.661 3.743 3.717 3.766 . 0 0 "[ . 1 . 2]" 1
451 1 74 VAL MG2 1 91 SER H 3.179 . 4.442 3.754 3.723 3.775 . 0 0 "[ . 1 . 2]" 1
452 1 69 GLY H 1 70 GLN QB 3.653 . 5.321 4.133 4.056 4.190 . 0 0 "[ . 1 . 2]" 1
453 1 98 PRO HB3 1 100 SER H 3.741 . 5.491 4.322 4.204 4.719 . 0 0 "[ . 1 . 2]" 1
454 1 9 PRO QG 1 10 THR H 3.275 . 4.616 3.130 3.027 3.499 . 0 0 "[ . 1 . 2]" 1
455 1 80 SER QB 1 83 GLN H 3.462 . 4.960 3.799 3.637 4.207 . 0 0 "[ . 1 . 2]" 1
456 1 83 GLN H 1 84 GLU HB3 3.577 . 5.177 5.291 5.237 5.411 0.234 8 0 "[ . 1 . 2]" 1
457 1 79 ARG HB3 1 83 GLN H 3.357 . 4.765 4.815 4.801 4.838 0.073 12 0 "[ . 1 . 2]" 1
458 1 5 ASN HD22 1 36 GLN QB 3.333 . 4.721 3.580 3.115 4.022 . 0 0 "[ . 1 . 2]" 1
459 1 65 VAL H 1 66 LYS HA 3.235 . 4.543 4.477 4.380 4.577 0.034 10 0 "[ . 1 . 2]" 1
460 1 5 ASN HD22 1 30 VAL HA 3.503 . 5.037 4.120 3.327 4.693 . 0 0 "[ . 1 . 2]" 1
461 1 93 GLN H 1 93 GLN HE21 3.607 . 5.233 4.115 3.900 4.219 . 0 0 "[ . 1 . 2]" 1
462 1 93 GLN HB3 1 93 GLN HE21 2.693 . 3.600 2.435 2.380 2.562 . 0 0 "[ . 1 . 2]" 1
463 1 93 GLN HB3 1 93 GLN HE22 2.885 . 3.925 3.368 3.329 3.453 . 0 0 "[ . 1 . 2]" 1
464 1 82 ASN HD21 1 83 GLN QG 3.397 . 4.840 4.649 3.528 4.829 . 0 0 "[ . 1 . 2]" 1
465 1 63 GLN HE21 1 67 LEU QD 3.471 . 4.977 3.272 2.530 4.675 . 0 0 "[ . 1 . 2]" 1
466 1 44 ASN HD21 1 46 VAL QG 3.136 . 4.365 3.125 2.555 4.029 . 0 0 "[ . 1 . 2]" 1
467 1 20 GLY H 1 44 ASN HD22 3.461 . 4.958 3.496 3.420 3.553 . 0 0 "[ . 1 . 2]" 1
468 1 21 ILE HG13 1 44 ASN HD22 3.567 . 5.158 4.319 4.251 4.392 . 0 0 "[ . 1 . 2]" 1
469 1 63 GLN HE22 1 67 LEU MD1 3.223 . 4.521 3.671 3.288 4.354 . 0 0 "[ . 1 . 2]" 1
470 1 12 PHE H 1 13 ILE HG13 3.653 . 5.321 4.801 4.750 4.927 . 0 0 "[ . 1 . 2]" 1
471 1 12 PHE H 1 106 ILE MG 2.842 . 3.852 3.237 3.200 3.265 . 0 0 "[ . 1 . 2]" 1
472 1 47 GLU HA 1 54 GLN HE21 2.922 . 3.990 2.990 2.893 3.355 . 0 0 "[ . 1 . 2]" 1
473 1 46 VAL HA 1 54 GLN HE21 3.482 . 4.998 4.250 4.158 4.824 . 0 0 "[ . 1 . 2]" 1
474 1 21 ILE MG 1 42 GLY H 2.662 . 3.548 2.755 2.738 2.780 . 0 0 "[ . 1 . 2]" 1
475 1 17 ASN HD21 1 21 ILE HG12 3.234 . 4.542 3.522 2.821 3.701 . 0 0 "[ . 1 . 2]" 1
476 1 17 ASN HA 1 17 ASN HD22 3.634 . 5.285 5.073 4.679 5.111 . 0 0 "[ . 1 . 2]" 1
477 1 50 HIS H 1 51 PRO HD3 3.386 . 4.819 4.551 4.444 4.599 . 0 0 "[ . 1 . 2]" 1
478 1 50 HIS H 1 51 PRO HB2 3.519 . 5.067 5.088 5.062 5.105 0.038 19 0 "[ . 1 . 2]" 1
479 1 6 VAL QG 1 34 GLY H 3.468 . 4.971 4.096 4.074 4.119 . 0 0 "[ . 1 . 2]" 1
480 1 28 ARG QG 1 32 THR H 3.654 . 5.323 4.935 4.870 5.033 . 0 0 "[ . 1 . 2]" 1
481 1 6 VAL QG 1 32 THR H 3.604 . 5.228 3.732 3.580 3.860 . 0 0 "[ . 1 . 2]" 1
482 1 31 ALA MB 1 33 VAL H 3.466 . 4.968 4.860 4.789 4.888 . 0 0 "[ . 1 . 2]" 1
483 1 50 HIS HB2 1 77 ARG HE 2.979 . 4.088 2.414 1.954 2.560 . 0 0 "[ . 1 . 2]" 1
484 1 105 THR MG 1 106 ILE H 2.570 . 3.395 2.824 2.704 2.883 . 0 0 "[ . 1 . 2]" 1
485 1 106 ILE H 1 106 ILE MG 2.933 . 4.008 3.659 3.650 3.669 . 0 0 "[ . 1 . 2]" 1
486 1 103 ILE MG 1 106 ILE H 3.685 . 5.382 5.262 5.240 5.288 . 0 0 "[ . 1 . 2]" 1
487 1 67 LEU HB2 1 68 LYS H 2.686 . 3.588 3.163 2.774 3.489 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 2480
_Distance_constraint_stats_list.Viol_count 6995
_Distance_constraint_stats_list.Viol_total 8977.371
_Distance_constraint_stats_list.Viol_max 0.926
_Distance_constraint_stats_list.Viol_rms 0.0322
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0090
_Distance_constraint_stats_list.Viol_average_violations_only 0.0642
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 3 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 5 ASN 0.133 0.112 3 0 "[ . 1 . 2]"
1 6 VAL 0.433 0.278 13 0 "[ . 1 . 2]"
1 8 GLN 2.575 0.455 15 0 "[ . 1 . 2]"
1 9 PRO 8.496 0.926 20 1 "[ . 1 . +]"
1 10 THR 3.062 0.218 20 0 "[ . 1 . 2]"
1 11 GLU 6.543 0.382 20 0 "[ . 1 . 2]"
1 12 PHE 12.661 0.149 17 0 "[ . 1 . 2]"
1 13 ILE 6.422 0.100 18 0 "[ . 1 . 2]"
1 14 SER 5.751 0.119 12 0 "[ . 1 . 2]"
1 15 ARG 7.544 0.197 5 0 "[ . 1 . 2]"
1 16 HIS 4.930 0.104 17 0 "[ . 1 . 2]"
1 17 ASN 1.609 0.128 18 0 "[ . 1 . 2]"
1 18 ILE 7.568 0.209 17 0 "[ . 1 . 2]"
1 19 GLU 7.586 0.130 15 0 "[ . 1 . 2]"
1 20 GLY 0.018 0.006 20 0 "[ . 1 . 2]"
1 21 ILE 13.144 0.218 20 0 "[ . 1 . 2]"
1 22 PHE 16.128 0.218 20 0 "[ . 1 . 2]"
1 23 THR 1.528 0.089 18 0 "[ . 1 . 2]"
1 24 PHE 6.686 0.111 17 0 "[ . 1 . 2]"
1 25 VAL 21.170 0.173 15 0 "[ . 1 . 2]"
1 26 ASP 8.818 0.173 15 0 "[ . 1 . 2]"
1 27 HIS 5.702 0.632 16 1 "[ . 1 .+ 2]"
1 28 ARG 2.213 0.926 20 1 "[ . 1 . +]"
1 29 CYS 2.897 0.138 20 0 "[ . 1 . 2]"
1 30 VAL 5.441 0.112 3 0 "[ . 1 . 2]"
1 31 ALA 4.508 0.191 20 0 "[ . 1 . 2]"
1 32 THR 9.259 0.140 11 0 "[ . 1 . 2]"
1 33 VAL 9.489 0.149 4 0 "[ . 1 . 2]"
1 34 GLY 7.486 0.763 9 1 "[ . +1 . 2]"
1 35 TYR 15.106 0.196 15 0 "[ . 1 . 2]"
1 36 GLN 2.348 0.070 15 0 "[ . 1 . 2]"
1 37 PRO 12.380 0.325 16 0 "[ . 1 . 2]"
1 38 GLN 10.188 0.721 19 5 "[ . * 1 * .* -+2]"
1 39 GLU 1.674 0.130 6 0 "[ . 1 . 2]"
1 40 LEU 10.343 0.120 10 0 "[ . 1 . 2]"
1 41 LEU 10.453 0.146 16 0 "[ . 1 . 2]"
1 42 GLY 4.103 0.104 18 0 "[ . 1 . 2]"
1 43 LYS 8.412 0.120 14 0 "[ . 1 . 2]"
1 44 ASN 13.205 0.186 11 0 "[ . 1 . 2]"
1 45 ILE 11.241 0.124 6 0 "[ . 1 . 2]"
1 46 VAL 5.154 0.106 3 0 "[ . 1 . 2]"
1 47 GLU 4.924 0.096 16 0 "[ . 1 . 2]"
1 48 PHE 13.485 0.211 2 0 "[ . 1 . 2]"
1 49 CYS 5.196 0.211 2 0 "[ . 1 . 2]"
1 50 HIS 10.145 0.792 3 9 "[ *+ -** ** . * *2]"
1 51 PRO 8.022 0.167 11 0 "[ . 1 . 2]"
1 52 GLU 3.812 0.154 4 0 "[ . 1 . 2]"
1 53 ASP 1.874 0.075 11 0 "[ . 1 . 2]"
1 54 GLN 11.552 0.167 11 0 "[ . 1 . 2]"
1 55 GLN 5.389 0.616 6 2 "[ .+ 1 . - 2]"
1 56 LEU 9.266 0.169 18 0 "[ . 1 . 2]"
1 57 LEU 1.659 0.327 17 0 "[ . 1 . 2]"
1 58 ARG 0.834 0.292 17 0 "[ . 1 . 2]"
1 59 ASP 11.543 0.182 19 0 "[ . 1 . 2]"
1 60 SER 4.622 0.137 1 0 "[ . 1 . 2]"
1 61 PHE 9.693 0.327 17 0 "[ . 1 . 2]"
1 62 GLN 3.993 0.108 17 0 "[ . 1 . 2]"
1 63 GLN 6.404 0.182 19 0 "[ . 1 . 2]"
1 64 VAL 10.306 0.155 19 0 "[ . 1 . 2]"
1 65 VAL 10.917 0.194 16 0 "[ . 1 . 2]"
1 66 LYS 4.163 0.162 17 0 "[ . 1 . 2]"
1 67 LEU 8.554 0.162 17 0 "[ . 1 . 2]"
1 68 LYS 7.785 0.275 11 0 "[ . 1 . 2]"
1 69 GLY 4.844 0.178 16 0 "[ . 1 . 2]"
1 70 GLN 1.755 0.099 19 0 "[ . 1 . 2]"
1 71 VAL 4.431 0.114 5 0 "[ . 1 . 2]"
1 72 LEU 3.141 0.137 1 0 "[ . 1 . 2]"
1 73 SER 5.817 0.272 7 0 "[ . 1 . 2]"
1 74 VAL 10.006 0.181 7 0 "[ . 1 . 2]"
1 75 MET 10.020 0.136 5 0 "[ . 1 . 2]"
1 76 PHE 12.689 0.203 11 0 "[ . 1 . 2]"
1 77 ARG 11.733 0.792 3 11 "[ *+ *** **- * . * *2]"
1 78 PHE 3.286 0.080 14 0 "[ . 1 . 2]"
1 79 ARG 4.218 0.591 19 1 "[ . 1 . +2]"
1 80 SER 1.882 0.591 19 1 "[ . 1 . +2]"
1 81 LYS 15.343 0.196 15 0 "[ . 1 . 2]"
1 82 ASN 4.867 0.763 9 1 "[ . +1 . 2]"
1 83 GLN 2.820 0.224 5 0 "[ . 1 . 2]"
1 84 GLU 2.500 0.090 5 0 "[ . 1 . 2]"
1 85 TRP 7.733 0.150 4 0 "[ . 1 . 2]"
1 86 LEU 0.650 0.055 4 0 "[ . 1 . 2]"
1 87 TRP 11.928 0.676 13 2 "[ . 1- + . 2]"
1 88 MET 16.157 0.187 9 0 "[ . 1 . 2]"
1 89 ARG 8.542 0.203 11 0 "[ . 1 . 2]"
1 90 THR 6.862 0.110 16 0 "[ . 1 . 2]"
1 91 SER 1.083 0.065 12 0 "[ . 1 . 2]"
1 92 SER 6.175 0.202 17 0 "[ . 1 . 2]"
1 93 GLN 7.428 0.135 14 0 "[ . 1 . 2]"
1 94 THR 8.043 0.135 14 0 "[ . 1 . 2]"
1 95 ALA 8.809 0.197 5 0 "[ . 1 . 2]"
1 96 GLN 9.301 0.270 4 0 "[ . 1 . 2]"
1 97 ASN 2.603 0.699 9 1 "[ . +1 . 2]"
1 98 PRO 15.518 0.214 19 0 "[ . 1 . 2]"
1 99 TYR 11.153 0.734 4 2 "[ +. -1 . 2]"
1 100 SER 4.374 0.699 9 1 "[ . +1 . 2]"
1 101 ASP 0.386 0.266 9 0 "[ . 1 . 2]"
1 102 GLU 1.671 0.096 17 0 "[ . 1 . 2]"
1 103 ILE 12.419 0.194 16 0 "[ . 1 . 2]"
1 104 GLU 4.511 0.337 7 0 "[ . 1 . 2]"
1 105 THR 11.662 0.337 7 0 "[ . 1 . 2]"
1 106 ILE 3.921 0.100 18 0 "[ . 1 . 2]"
1 107 ILE 19.261 0.187 9 0 "[ . 1 . 2]"
1 108 CYS 1.139 0.034 14 0 "[ . 1 . 2]"
1 109 THR 6.280 0.140 11 0 "[ . 1 . 2]"
1 110 ASN 1.954 0.221 5 0 "[ . 1 . 2]"
1 111 THR 0.212 0.115 17 0 "[ . 1 . 2]"
1 119 GLU 0.721 0.088 14 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 14 SER QB 1 22 PHE QE 2.409 . 3.134 2.237 2.149 2.280 . 0 0 "[ . 1 . 2]" 2
2 1 22 PHE HE2 1 45 ILE HA 2.414 . 3.142 3.014 2.994 3.064 . 0 0 "[ . 1 . 2]" 2
3 1 22 PHE QE 1 40 LEU HB2 3.051 . 4.215 4.271 4.250 4.296 0.081 5 0 "[ . 1 . 2]" 2
4 1 22 PHE QE 1 107 ILE MD 2.338 . 3.021 2.963 2.909 2.996 . 0 0 "[ . 1 . 2]" 2
5 1 22 PHE QE 1 25 VAL MG2 2.946 . 4.031 3.819 3.778 3.846 . 0 0 "[ . 1 . 2]" 2
6 1 22 PHE QE 1 40 LEU QD . . 2.721 2.504 2.474 2.526 . 0 0 "[ . 1 . 2]" 2
7 1 22 PHE HE2 1 40 LEU QD 2.486 . 3.259 2.508 2.478 2.531 . 0 0 "[ . 1 . 2]" 2
8 1 61 PHE QD 1 64 VAL MG2 3.018 . 4.157 3.800 3.691 3.930 . 0 0 "[ . 1 . 2]" 2
9 1 96 GLN H 1 96 GLN QG 2.189 . 2.788 1.972 1.766 2.337 . 0 0 "[ . 1 . 2]" 2
10 1 96 GLN HB2 1 96 GLN QG 1.965 . 2.447 2.185 2.149 2.301 . 0 0 "[ . 1 . 2]" 2
11 1 59 ASP HA 1 63 GLN HG2 2.846 . 3.859 4.023 4.002 4.041 0.182 19 0 "[ . 1 . 2]" 2
12 1 88 MET HG2 1 109 THR HA 2.534 . 3.336 3.405 3.385 3.421 0.085 6 0 "[ . 1 . 2]" 2
13 1 43 LYS HB2 1 48 PHE QE 2.542 . 3.349 2.071 2.024 2.183 . 0 0 "[ . 1 . 2]" 2
14 1 43 LYS HA 1 43 LYS HB2 2.471 . 3.234 3.011 3.006 3.015 . 0 0 "[ . 1 . 2]" 2
15 1 43 LYS H 1 43 LYS HB2 2.471 . 3.234 2.629 2.547 2.674 . 0 0 "[ . 1 . 2]" 2
16 1 11 GLU HA 1 11 GLU HG2 2.851 . 3.867 3.738 3.719 3.756 . 0 0 "[ . 1 . 2]" 2
17 1 43 LYS HB3 1 44 ASN H 2.392 . 3.107 2.912 2.646 2.978 . 0 0 "[ . 1 . 2]" 2
18 1 43 LYS HB3 1 48 PHE QE 2.504 . 3.288 2.035 1.921 2.090 . 0 0 "[ . 1 . 2]" 2
19 1 43 LYS HA 1 43 LYS HB3 2.370 . 3.072 2.391 2.368 2.431 . 0 0 "[ . 1 . 2]" 2
20 1 43 LYS HB3 1 43 LYS QD 2.748 . 3.692 2.047 2.023 2.102 . 0 0 "[ . 1 . 2]" 2
21 1 11 GLU HG3 1 12 PHE H 3.008 . 4.139 4.208 4.189 4.233 0.094 17 0 "[ . 1 . 2]" 2
22 1 11 GLU H 1 11 GLU HG3 2.761 . 3.714 3.321 3.273 3.375 . 0 0 "[ . 1 . 2]" 2
23 1 11 GLU HA 1 11 GLU HG3 2.756 . 3.705 3.724 3.713 3.737 0.032 5 0 "[ . 1 . 2]" 2
24 1 11 GLU HG3 1 106 ILE MG 2.578 . 3.409 3.091 3.021 3.169 . 0 0 "[ . 1 . 2]" 2
25 1 65 VAL HA 1 68 LYS HA 2.862 . 3.886 2.839 2.631 3.040 . 0 0 "[ . 1 . 2]" 2
26 1 48 PHE H 1 48 PHE HA 2.444 . 3.191 2.910 2.897 2.919 . 0 0 "[ . 1 . 2]" 2
27 1 48 PHE HA 1 79 ARG HB3 2.719 . 3.643 3.134 3.005 3.336 . 0 0 "[ . 1 . 2]" 2
28 1 56 LEU H 1 56 LEU HA 2.137 . 2.708 2.855 2.821 2.860 0.152 20 0 "[ . 1 . 2]" 2
29 1 56 LEU HA 1 60 SER H 2.978 . 4.087 4.149 4.118 4.169 0.082 1 0 "[ . 1 . 2]" 2
30 1 47 GLU H 1 47 GLU HA 2.256 . 2.892 2.770 2.768 2.774 . 0 0 "[ . 1 . 2]" 2
31 1 47 GLU HA 1 48 PHE H 2.589 . 3.427 3.474 3.465 3.488 0.061 11 0 "[ . 1 . 2]" 2
32 1 47 GLU HA 1 54 GLN HE21 2.838 . 3.845 3.398 3.209 3.941 0.096 16 0 "[ . 1 . 2]" 2
33 1 47 GLU HA 1 54 GLN HE22 2.799 . 3.778 2.900 2.776 3.275 . 0 0 "[ . 1 . 2]" 2
34 1 47 GLU HA 1 47 GLU HB3 2.100 . 2.651 2.685 2.673 2.698 0.047 11 0 "[ . 1 . 2]" 2
35 1 40 LEU HA 1 48 PHE HZ 2.727 . 3.657 3.150 3.077 3.234 . 0 0 "[ . 1 . 2]" 2
36 1 43 LYS HB2 1 48 PHE HZ 2.814 . 3.804 3.276 3.207 3.379 . 0 0 "[ . 1 . 2]" 2
37 1 43 LYS HB3 1 48 PHE HZ 2.918 . 3.982 3.118 3.072 3.179 . 0 0 "[ . 1 . 2]" 2
38 1 43 LYS HG3 1 48 PHE HZ 2.883 . 3.922 3.595 3.041 3.803 . 0 0 "[ . 1 . 2]" 2
39 1 15 ARG HA 1 16 HIS HD2 2.990 . 4.108 4.145 4.120 4.159 0.051 3 0 "[ . 1 . 2]" 2
40 1 14 SER QB 1 16 HIS HD2 2.695 . 3.603 3.532 3.325 3.568 . 0 0 "[ . 1 . 2]" 2
41 1 16 HIS HD2 1 105 THR HB 2.225 . 2.844 2.554 2.474 2.637 . 0 0 "[ . 1 . 2]" 2
42 1 16 HIS HB3 1 16 HIS HD2 2.643 . 3.516 2.713 2.708 2.719 . 0 0 "[ . 1 . 2]" 2
43 1 16 HIS HD2 1 22 PHE QE 2.860 . 3.882 2.333 2.247 2.413 . 0 0 "[ . 1 . 2]" 2
44 1 16 HIS HD2 1 45 ILE MG 2.980 . 4.090 3.361 3.221 3.460 . 0 0 "[ . 1 . 2]" 2
45 1 62 GLN H 1 62 GLN HG3 2.305 . 2.969 2.917 2.653 3.018 0.049 16 0 "[ . 1 . 2]" 2
46 1 59 ASP HA 1 62 GLN HG3 2.640 . 3.511 2.310 2.164 2.384 . 0 0 "[ . 1 . 2]" 2
47 1 62 GLN HB2 1 62 GLN HG3 1.960 . 2.440 2.205 2.200 2.214 . 0 0 "[ . 1 . 2]" 2
48 1 18 ILE MD 1 62 GLN HG3 2.888 . 3.931 3.875 3.735 3.945 0.014 3 0 "[ . 1 . 2]" 2
49 1 38 GLN HG2 1 39 GLU H 2.545 . 3.355 2.827 2.113 3.236 . 0 0 "[ . 1 . 2]" 2
50 1 62 GLN H 1 62 GLN HG2 2.352 . 3.044 2.465 2.342 2.581 . 0 0 "[ . 1 . 2]" 2
51 1 96 GLN HE22 1 96 GLN QG 2.691 . 3.596 3.322 3.211 3.482 . 0 0 "[ . 1 . 2]" 2
52 1 62 GLN HA 1 62 GLN HG2 2.263 . 2.903 2.543 2.506 2.604 . 0 0 "[ . 1 . 2]" 2
53 1 88 MET H 1 88 MET HG2 2.714 . 3.635 2.970 2.950 2.993 . 0 0 "[ . 1 . 2]" 2
54 1 63 GLN HA 1 63 GLN HG2 2.303 . 2.966 3.000 2.946 3.039 0.073 14 0 "[ . 1 . 2]" 2
55 1 88 MET HB3 1 88 MET HG2 2.381 . 3.090 2.927 2.918 2.938 . 0 0 "[ . 1 . 2]" 2
56 1 88 MET HB2 1 88 MET HG2 2.435 . 3.176 2.658 2.641 2.677 . 0 0 "[ . 1 . 2]" 2
57 1 63 GLN HG2 1 72 LEU QD 2.394 . 3.110 3.053 3.038 3.096 . 0 0 "[ . 1 . 2]" 2
58 1 55 GLN QE 1 55 GLN QG 2.296 . 2.955 2.172 2.108 2.183 . 0 0 "[ . 1 . 2]" 2
59 1 78 PHE HB3 1 88 MET HG2 2.746 . 3.688 3.581 3.519 3.636 . 0 0 "[ . 1 . 2]" 2
60 1 38 GLN HG3 1 39 GLU H 2.948 . 4.035 2.459 2.012 3.291 . 0 0 "[ . 1 . 2]" 2
61 1 38 GLN HA 1 38 GLN HG3 2.546 . 3.356 3.742 3.583 4.077 0.721 19 5 "[ . * 1 * .* -+2]" 2
62 1 83 GLN H 1 83 GLN QG 2.728 . 3.656 2.467 2.243 2.547 . 0 0 "[ . 1 . 2]" 2
63 1 83 GLN HE21 1 83 GLN QG 2.934 . 3.420 2.168 2.150 2.193 . 0 0 "[ . 1 . 2]" 2
64 1 11 GLU H 1 11 GLU HB3 3.010 . 4.143 3.548 3.536 3.561 . 0 0 "[ . 1 . 2]" 2
65 1 11 GLU HB3 1 106 ILE MG 2.561 . 3.381 3.278 3.250 3.353 . 0 0 "[ . 1 . 2]" 2
66 1 88 MET H 1 88 MET HG3 2.861 . 3.884 3.895 3.855 3.919 0.035 10 0 "[ . 1 . 2]" 2
67 1 78 PHE H 1 88 MET HG3 2.832 . 3.835 3.598 3.539 3.668 . 0 0 "[ . 1 . 2]" 2
68 1 88 MET HB3 1 88 MET HG3 2.411 . 3.138 2.654 2.638 2.671 . 0 0 "[ . 1 . 2]" 2
69 1 88 MET HB2 1 88 MET HG3 2.427 . 3.163 2.220 2.213 2.230 . 0 0 "[ . 1 . 2]" 2
70 1 78 PHE QD 1 88 MET HG3 2.749 . 3.694 3.659 3.600 3.709 0.015 20 0 "[ . 1 . 2]" 2
71 1 82 ASN HA 1 83 GLN QG 2.879 . 3.915 3.478 3.249 3.859 . 0 0 "[ . 1 . 2]" 2
72 1 83 GLN HA 1 83 GLN QG 2.466 . 3.226 2.584 2.421 2.706 . 0 0 "[ . 1 . 2]" 2
73 1 11 GLU HB2 1 106 ILE MG 2.557 . 3.374 2.064 2.024 2.137 . 0 0 "[ . 1 . 2]" 2
74 1 39 GLU H 1 39 GLU HA 2.290 . 2.946 2.835 2.822 2.844 . 0 0 "[ . 1 . 2]" 2
75 1 39 GLU HA 1 40 LEU H 2.590 . 3.429 3.331 3.305 3.352 . 0 0 "[ . 1 . 2]" 2
76 1 39 GLU HA 1 39 GLU HB3 2.232 . 2.855 2.852 2.815 2.869 0.014 1 0 "[ . 1 . 2]" 2
77 1 48 PHE HA 1 79 ARG H 2.861 . 3.884 3.840 3.779 3.900 0.016 16 0 "[ . 1 . 2]" 2
78 1 56 LEU HA 1 59 ASP H 2.616 . 3.472 3.470 3.410 3.498 0.026 17 0 "[ . 1 . 2]" 2
79 1 56 LEU HA 1 59 ASP HB3 2.261 . 2.900 2.475 2.397 2.524 . 0 0 "[ . 1 . 2]" 2
80 1 56 LEU HA 1 56 LEU HB2 2.045 . 2.568 2.330 2.316 2.347 . 0 0 "[ . 1 . 2]" 2
81 1 62 GLN HA 1 65 VAL MG1 2.130 . 2.697 2.060 1.981 2.116 . 0 0 "[ . 1 . 2]" 2
82 1 57 LEU H 1 57 LEU HA 2.380 . 3.088 2.817 2.802 2.830 . 0 0 "[ . 1 . 2]" 2
83 1 57 LEU HA 1 60 SER QB 2.750 . 3.695 3.049 2.867 3.433 . 0 0 "[ . 1 . 2]" 2
84 1 57 LEU HA 1 58 ARG H 2.835 . 3.840 3.535 3.486 3.544 . 0 0 "[ . 1 . 2]" 2
85 1 57 LEU HA 1 60 SER H 2.774 . 3.736 3.569 3.511 3.657 . 0 0 "[ . 1 . 2]" 2
86 1 57 LEU HA 1 57 LEU HB3 2.418 . 3.149 3.012 2.873 3.024 . 0 0 "[ . 1 . 2]" 2
87 1 57 LEU HA 1 57 LEU HB2 2.228 . 2.849 2.527 2.493 2.837 . 0 0 "[ . 1 . 2]" 2
88 1 57 LEU HA 1 74 VAL MG1 2.533 . 3.335 3.353 3.312 3.427 0.092 19 0 "[ . 1 . 2]" 2
89 1 16 HIS HD2 1 22 PHE QD 2.977 . 4.085 2.900 2.812 2.976 . 0 0 "[ . 1 . 2]" 2
90 1 16 HIS HB2 1 16 HIS HD2 2.768 . 3.726 3.716 3.708 3.725 . 0 0 "[ . 1 . 2]" 2
91 1 36 GLN HA 1 36 GLN QG 2.378 . 3.085 2.530 2.469 2.633 . 0 0 "[ . 1 . 2]" 2
92 1 30 VAL QG 1 36 GLN QG 2.509 . 3.296 2.620 2.468 2.794 . 0 0 "[ . 1 . 2]" 2
93 1 38 GLN H 1 38 GLN HG2 2.736 . 3.672 1.950 1.737 2.249 0.063 5 0 "[ . 1 . 2]" 2
94 1 8 GLN HA 1 8 GLN HG2 2.305 . 2.969 2.671 2.492 3.141 0.172 20 0 "[ . 1 . 2]" 2
95 1 55 GLN QE 1 55 GLN HG3 2.265 . 2.906 2.314 2.167 3.275 0.369 6 0 "[ . 1 . 2]" 2
96 1 55 GLN HA 1 55 GLN HG3 2.373 . 3.077 3.122 3.010 3.693 0.616 6 2 "[ .+ 1 . - 2]" 2
97 1 71 VAL HA 1 93 GLN HB2 2.863 . 3.888 3.102 2.997 3.250 . 0 0 "[ . 1 . 2]" 2
98 1 71 VAL QG 1 93 GLN HB2 2.498 . 3.278 3.090 2.425 3.307 0.029 3 0 "[ . 1 . 2]" 2
99 1 71 VAL HA 1 93 GLN HB3 2.833 . 3.836 1.816 1.788 1.914 0.042 14 0 "[ . 1 . 2]" 2
100 1 66 LYS H 1 66 LYS QB 2.030 . 2.545 2.159 2.127 2.180 . 0 0 "[ . 1 . 2]" 2
101 1 65 VAL H 1 66 LYS QB 2.993 . 4.113 4.159 4.139 4.182 0.069 1 0 "[ . 1 . 2]" 2
102 1 66 LYS HA 1 66 LYS QB 2.021 . 2.531 2.489 2.481 2.507 . 0 0 "[ . 1 . 2]" 2
103 1 63 GLN HA 1 66 LYS QB 2.254 . 2.889 2.250 2.131 2.314 . 0 0 "[ . 1 . 2]" 2
104 1 66 LYS QB 1 67 LEU HG 2.062 . 2.593 2.740 2.716 2.755 0.162 17 0 "[ . 1 . 2]" 2
105 1 66 LYS QB 1 67 LEU H 2.352 . 3.044 2.550 2.498 2.594 . 0 0 "[ . 1 . 2]" 2
106 1 66 LYS QB 1 66 LYS QE 3.093 . 4.289 2.003 1.965 2.053 . 0 0 "[ . 1 . 2]" 2
107 1 65 VAL MG1 1 66 LYS QB 2.861 . 3.884 3.481 3.435 3.526 . 0 0 "[ . 1 . 2]" 2
108 1 35 TYR HA 1 36 GLN H 2.008 . 2.512 2.159 2.134 2.193 . 0 0 "[ . 1 . 2]" 2
109 1 35 TYR HA 1 35 TYR QE 3.003 . 4.130 4.284 4.253 4.306 0.176 12 0 "[ . 1 . 2]" 2
110 1 35 TYR HA 1 35 TYR QD 2.296 . 2.955 2.174 2.156 2.205 . 0 0 "[ . 1 . 2]" 2
111 1 35 TYR H 1 35 TYR HA 2.521 . 3.316 2.838 2.834 2.853 . 0 0 "[ . 1 . 2]" 2
112 1 35 TYR HA 1 35 TYR HB3 2.282 . 2.933 2.483 2.467 2.491 . 0 0 "[ . 1 . 2]" 2
113 1 35 TYR HA 1 39 GLU HB3 2.551 . 3.364 2.692 2.605 2.838 . 0 0 "[ . 1 . 2]" 2
114 1 35 TYR HA 1 35 TYR HB2 2.352 . 3.043 3.010 3.007 3.020 . 0 0 "[ . 1 . 2]" 2
115 1 35 TYR HA 1 81 LYS HD2 2.504 . 3.288 2.833 2.543 2.937 . 0 0 "[ . 1 . 2]" 2
116 1 33 VAL MG2 1 35 TYR HA 2.980 . 4.090 4.083 4.051 4.096 0.006 19 0 "[ . 1 . 2]" 2
117 1 59 ASP H 1 59 ASP HA 2.138 . 2.709 2.783 2.758 2.821 0.112 19 0 "[ . 1 . 2]" 2
118 1 59 ASP HA 1 60 SER H 2.655 . 3.536 3.522 3.472 3.528 . 0 0 "[ . 1 . 2]" 2
119 1 59 ASP HA 1 62 GLN H 2.481 . 3.250 3.341 3.332 3.358 0.108 17 0 "[ . 1 . 2]" 2
120 1 59 ASP HA 1 59 ASP HB2 2.004 . 2.506 2.457 2.433 2.482 . 0 0 "[ . 1 . 2]" 2
121 1 59 ASP HA 1 62 GLN HB2 2.179 . 2.773 2.639 2.580 2.702 . 0 0 "[ . 1 . 2]" 2
122 1 18 ILE MG 1 19 GLU HA 2.623 . 3.483 3.128 3.072 3.187 . 0 0 "[ . 1 . 2]" 2
123 1 22 PHE H 1 41 LEU HA 3.012 . 4.146 4.238 4.217 4.255 0.109 12 0 "[ . 1 . 2]" 2
124 1 41 LEU HA 1 42 GLY H 2.008 . 2.512 2.123 2.112 2.139 . 0 0 "[ . 1 . 2]" 2
125 1 41 LEU HA 1 43 LYS H 2.636 . 3.504 3.301 3.271 3.320 . 0 0 "[ . 1 . 2]" 2
126 1 41 LEU H 1 41 LEU HA 2.443 . 3.189 2.756 2.746 2.767 . 0 0 "[ . 1 . 2]" 2
127 1 22 PHE HB3 1 41 LEU HA 2.493 . 3.270 2.382 2.340 2.424 . 0 0 "[ . 1 . 2]" 2
128 1 25 VAL MG2 1 41 LEU HA 2.750 . 3.695 2.613 2.574 2.638 . 0 0 "[ . 1 . 2]" 2
129 1 50 HIS HA 1 85 TRP HH2 2.497 . 3.276 2.414 2.356 2.519 . 0 0 "[ . 1 . 2]" 2
130 1 50 HIS HA 1 51 PRO HD2 2.073 . 2.610 2.565 2.463 2.603 . 0 0 "[ . 1 . 2]" 2
131 1 50 HIS HA 1 50 HIS HB2 2.578 . 3.409 2.520 2.505 2.532 . 0 0 "[ . 1 . 2]" 2
132 1 12 PHE HZ 1 107 ILE MD 2.464 . 2.836 2.192 2.143 2.245 . 0 0 "[ . 1 . 2]" 2
133 1 71 VAL H 1 71 VAL HB 2.048 . 2.572 2.567 2.486 2.686 0.114 5 0 "[ . 1 . 2]" 2
134 1 71 VAL HA 1 71 VAL HB 2.417 . 3.147 2.645 2.502 3.006 . 0 0 "[ . 1 . 2]" 2
135 1 71 VAL HB 1 71 VAL QG 1.695 . 2.054 1.893 1.891 1.898 . 0 0 "[ . 1 . 2]" 2
136 1 71 VAL HB 1 72 LEU H 3.050 . 4.213 3.989 3.670 4.150 . 0 0 "[ . 1 . 2]" 2
137 1 14 SER HA 1 15 ARG H 2.197 . 2.800 2.108 2.094 2.123 . 0 0 "[ . 1 . 2]" 2
138 1 14 SER H 1 14 SER HA 2.716 . 3.638 2.951 2.938 2.957 . 0 0 "[ . 1 . 2]" 2
139 1 14 SER HA 1 26 ASP H 2.684 . 3.584 2.781 2.667 2.868 . 0 0 "[ . 1 . 2]" 2
140 1 14 SER HA 1 24 PHE QD 2.610 . 3.461 2.659 2.581 3.001 . 0 0 "[ . 1 . 2]" 2
141 1 14 SER HA 1 14 SER QB 2.371 . 2.958 2.456 2.169 2.495 . 0 0 "[ . 1 . 2]" 2
142 1 73 SER HA 1 90 THR H 2.930 . 4.003 4.031 4.008 4.046 0.043 7 0 "[ . 1 . 2]" 2
143 1 50 HIS HA 1 50 HIS HB3 2.642 . 3.515 3.029 3.026 3.030 . 0 0 "[ . 1 . 2]" 2
144 1 50 HIS HA 1 85 TRP HZ3 2.763 . 3.717 2.970 2.912 3.061 . 0 0 "[ . 1 . 2]" 2
145 1 50 HIS HA 1 51 PRO HD3 2.206 . 2.814 2.057 2.035 2.085 . 0 0 "[ . 1 . 2]" 2
146 1 85 TRP H 1 85 TRP HD1 2.636 . 3.505 3.519 3.463 3.549 0.044 8 0 "[ . 1 . 2]" 2
147 1 50 HIS HD2 1 85 TRP HD1 2.758 . 3.709 3.785 3.765 3.801 0.092 9 0 "[ . 1 . 2]" 2
148 1 85 TRP HB3 1 85 TRP HD1 2.603 . 3.450 3.510 3.496 3.530 0.080 3 0 "[ . 1 . 2]" 2
149 1 22 PHE HZ 1 78 PHE QE 2.969 . 4.071 2.540 2.449 2.624 . 0 0 "[ . 1 . 2]" 2
150 1 22 PHE HZ 1 40 LEU QD 3.092 . 4.287 4.078 4.051 4.101 . 0 0 "[ . 1 . 2]" 2
151 1 9 PRO HB2 1 11 GLU H 3.010 . 4.142 3.727 3.513 4.524 0.382 20 0 "[ . 1 . 2]" 2
152 1 9 PRO HA 1 9 PRO HB2 2.061 . 2.592 2.633 2.600 2.932 0.340 20 0 "[ . 1 . 2]" 2
153 1 9 PRO HB2 1 10 THR HA 3.042 . 4.199 3.797 3.471 3.860 . 0 0 "[ . 1 . 2]" 2
154 1 9 PRO HB2 1 31 ALA MB 2.825 . 3.822 3.675 3.405 4.013 0.191 20 0 "[ . 1 . 2]" 2
155 1 9 PRO HB2 1 10 THR MG 2.938 . 4.017 4.039 3.936 4.235 0.218 20 0 "[ . 1 . 2]" 2
156 1 98 PRO HB2 1 98 PRO HD3 2.753 . 3.701 3.879 3.844 3.915 0.214 19 0 "[ . 1 . 2]" 2
157 1 98 PRO HB2 1 98 PRO HG2 2.268 . 2.911 2.320 2.307 2.328 . 0 0 "[ . 1 . 2]" 2
158 1 6 VAL HB 1 6 VAL QG 1.897 . 2.347 1.895 1.878 1.897 . 0 0 "[ . 1 . 2]" 2
159 1 98 PRO HB2 1 98 PRO HG3 2.360 . 3.056 2.620 2.612 2.632 . 0 0 "[ . 1 . 2]" 2
160 1 9 PRO HB3 1 10 THR H 2.946 . 4.031 3.101 2.057 3.174 . 0 0 "[ . 1 . 2]" 2
161 1 9 PRO HA 1 9 PRO HB3 2.301 . 2.963 2.329 2.266 2.347 . 0 0 "[ . 1 . 2]" 2
162 1 9 PRO HB3 1 31 ALA MB 2.685 . 3.586 2.255 1.967 3.301 . 0 0 "[ . 1 . 2]" 2
163 1 51 PRO HB2 1 51 PRO HD2 2.682 . 3.581 2.891 2.874 2.906 . 0 0 "[ . 1 . 2]" 2
164 1 51 PRO HB2 1 52 GLU QG 2.579 . 3.410 2.905 2.843 3.065 . 0 0 "[ . 1 . 2]" 2
165 1 98 PRO HA 1 98 PRO HB3 2.318 . 2.990 2.332 2.321 2.345 . 0 0 "[ . 1 . 2]" 2
166 1 98 PRO HB3 1 98 PRO HG3 2.499 . 3.280 2.334 2.321 2.343 . 0 0 "[ . 1 . 2]" 2
167 1 77 ARG HB3 1 85 TRP HB3 2.737 . 3.674 1.817 1.778 1.891 0.022 20 0 "[ . 1 . 2]" 2
168 1 50 HIS HB2 1 77 ARG HB3 2.815 . 3.806 3.003 2.897 3.108 . 0 0 "[ . 1 . 2]" 2
169 1 46 VAL HA 1 49 CYS HA 3.006 . 4.136 4.192 4.158 4.216 0.080 9 0 "[ . 1 . 2]" 2
170 1 49 CYS HA 1 79 ARG H 2.909 . 3.967 3.562 3.426 3.764 . 0 0 "[ . 1 . 2]" 2
171 1 49 CYS HA 1 50 HIS H 2.171 . 2.760 2.260 2.235 2.291 . 0 0 "[ . 1 . 2]" 2
172 1 49 CYS H 1 49 CYS HA 2.378 . 3.085 2.791 2.776 2.801 . 0 0 "[ . 1 . 2]" 2
173 1 49 CYS HA 1 85 TRP HZ3 2.746 . 3.689 3.411 3.348 3.504 . 0 0 "[ . 1 . 2]" 2
174 1 49 CYS HA 1 76 PHE QE 2.674 . 3.568 2.602 2.425 2.690 . 0 0 "[ . 1 . 2]" 2
175 1 49 CYS HA 1 78 PHE HA 2.536 . 3.340 2.573 2.476 2.671 . 0 0 "[ . 1 . 2]" 2
176 1 49 CYS HA 1 49 CYS HB3 2.470 . 3.233 3.017 3.013 3.027 . 0 0 "[ . 1 . 2]" 2
177 1 49 CYS HA 1 49 CYS HB2 2.338 . 3.022 2.401 2.387 2.429 . 0 0 "[ . 1 . 2]" 2
178 1 73 SER HA 1 92 SER H 3.019 . 4.158 3.919 3.856 4.010 . 0 0 "[ . 1 . 2]" 2
179 1 73 SER HA 1 74 VAL H 2.045 . 2.568 2.105 2.093 2.171 . 0 0 "[ . 1 . 2]" 2
180 1 73 SER H 1 73 SER HA 2.585 . 3.420 2.936 2.911 2.940 . 0 0 "[ . 1 . 2]" 2
181 1 73 SER HA 1 73 SER HB2 2.343 . 3.029 2.600 2.587 2.691 . 0 0 "[ . 1 . 2]" 2
182 1 73 SER HA 1 73 SER HB3 2.427 . 3.163 2.960 2.273 3.001 . 0 0 "[ . 1 . 2]" 2
183 1 73 SER HA 1 74 VAL MG2 2.775 . 3.738 3.798 3.782 3.837 0.099 7 0 "[ . 1 . 2]" 2
184 1 72 LEU HB3 1 73 SER HA 3.028 . 4.174 4.178 4.144 4.252 0.078 7 0 "[ . 1 . 2]" 2
185 1 83 GLN H 1 83 GLN HA 2.006 . 2.509 2.262 2.234 2.272 . 0 0 "[ . 1 . 2]" 2
186 1 83 GLN HA 1 84 GLU H 2.405 . 3.128 2.771 2.595 2.870 . 0 0 "[ . 1 . 2]" 2
187 1 79 ARG HD3 1 83 GLN HA 2.835 . 3.840 2.582 1.732 2.702 0.098 19 0 "[ . 1 . 2]" 2
188 1 83 GLN HA 1 83 GLN HB2 2.332 . 3.012 3.005 2.991 3.013 0.001 11 0 "[ . 1 . 2]" 2
189 1 79 ARG HG3 1 83 GLN HA 2.572 . 3.399 3.431 3.323 3.474 0.075 1 0 "[ . 1 . 2]" 2
190 1 79 ARG HG2 1 83 GLN HA 2.559 . 3.378 2.326 2.101 2.500 . 0 0 "[ . 1 . 2]" 2
191 1 51 PRO HB3 1 52 GLU H 2.755 . 3.704 3.558 3.509 3.629 . 0 0 "[ . 1 . 2]" 2
192 1 85 TRP HB2 1 85 TRP HD1 2.344 . 3.031 2.558 2.554 2.562 . 0 0 "[ . 1 . 2]" 2
193 1 75 MET HA 1 75 MET HG3 2.569 . 3.394 3.201 3.168 3.319 . 0 0 "[ . 1 . 2]" 2
194 1 75 MET HG3 1 89 ARG HA 2.866 . 3.893 3.878 3.780 3.926 0.033 12 0 "[ . 1 . 2]" 2
195 1 75 MET HB3 1 75 MET HG3 2.296 . 2.955 2.977 2.922 2.984 0.029 10 0 "[ . 1 . 2]" 2
196 1 75 MET HB2 1 75 MET HG3 2.296 . 2.955 2.330 2.249 2.346 . 0 0 "[ . 1 . 2]" 2
197 1 75 MET HG3 1 89 ARG QG 3.014 . 4.150 3.302 3.213 3.397 . 0 0 "[ . 1 . 2]" 2
198 1 50 HIS H 1 50 HIS HB3 2.575 . 3.404 2.654 2.622 2.694 . 0 0 "[ . 1 . 2]" 2
199 1 50 HIS HB3 1 50 HIS HD2 3.034 . 4.184 3.685 3.582 3.751 . 0 0 "[ . 1 . 2]" 2
200 1 50 HIS HB3 1 77 ARG HB2 2.736 . 3.672 2.718 2.597 2.808 . 0 0 "[ . 1 . 2]" 2
201 1 75 MET HA 1 75 MET HG2 2.475 . 3.241 2.320 2.202 2.350 . 0 0 "[ . 1 . 2]" 2
202 1 75 MET HG2 1 89 ARG HA 2.792 . 3.767 2.570 2.385 2.623 . 0 0 "[ . 1 . 2]" 2
203 1 75 MET HG2 1 89 ARG QD 3.064 . 4.238 2.362 2.286 2.451 . 0 0 "[ . 1 . 2]" 2
204 1 75 MET HB2 1 75 MET HG2 2.363 . 3.061 2.979 2.931 2.986 . 0 0 "[ . 1 . 2]" 2
205 1 75 MET HG2 1 89 ARG HB3 2.713 . 3.633 3.252 3.178 3.339 . 0 0 "[ . 1 . 2]" 2
206 1 68 LYS HA 1 68 LYS HB3 2.284 . 2.936 2.784 2.595 2.950 0.014 15 0 "[ . 1 . 2]" 2
207 1 68 LYS HB3 1 68 LYS QG 2.199 . 2.803 2.277 2.146 2.430 . 0 0 "[ . 1 . 2]" 2
208 1 68 LYS HA 1 68 LYS HB2 2.292 . 2.949 2.829 2.660 2.972 0.023 19 0 "[ . 1 . 2]" 2
209 1 68 LYS HB2 1 68 LYS QG 2.266 . 2.908 2.293 2.146 2.477 . 0 0 "[ . 1 . 2]" 2
210 1 104 GLU H 1 104 GLU HB3 2.678 . 3.575 2.682 2.210 2.743 . 0 0 "[ . 1 . 2]" 2
211 1 104 GLU HB3 1 104 GLU HG3 2.330 . 3.009 2.997 2.980 3.001 . 0 0 "[ . 1 . 2]" 2
212 1 32 THR MG 1 108 CYS HA 2.977 . 4.085 3.905 3.844 3.967 . 0 0 "[ . 1 . 2]" 2
213 1 76 PHE HZ 1 78 PHE QD 2.189 . 2.788 1.672 1.613 1.705 . 0 0 "[ . 1 . 2]" 2
214 1 76 PHE HZ 1 90 THR MG 2.673 . 3.566 3.604 3.571 3.621 0.055 19 0 "[ . 1 . 2]" 2
215 1 65 VAL H 1 65 VAL HB 2.141 . 2.714 2.472 2.440 2.513 . 0 0 "[ . 1 . 2]" 2
216 1 65 VAL HB 1 94 THR MG 2.868 . 3.896 3.958 3.901 4.001 0.105 20 0 "[ . 1 . 2]" 2
217 1 93 GLN HE22 1 93 GLN HG3 3.042 . 4.199 3.791 3.775 3.798 . 0 0 "[ . 1 . 2]" 2
218 1 102 GLU H 1 102 GLU HB2 2.813 . 3.802 2.418 2.315 2.545 . 0 0 "[ . 1 . 2]" 2
219 1 84 GLU HA 1 84 GLU HB2 2.276 . 2.923 3.006 3.000 3.013 0.090 5 0 "[ . 1 . 2]" 2
220 1 102 GLU H 1 102 GLU HB3 2.830 . 3.831 3.607 3.566 3.712 . 0 0 "[ . 1 . 2]" 2
221 1 102 GLU HA 1 102 GLU HB3 2.658 . 3.541 2.480 2.447 2.555 . 0 0 "[ . 1 . 2]" 2
222 1 99 TYR HB3 1 102 GLU HB3 2.951 . 4.040 3.621 2.829 3.979 . 0 0 "[ . 1 . 2]" 2
223 1 84 GLU HB3 1 85 TRP H 2.714 . 3.635 2.985 2.898 3.129 . 0 0 "[ . 1 . 2]" 2
224 1 84 GLU HB3 1 86 LEU QD 2.705 . 3.620 2.878 2.425 3.368 . 0 0 "[ . 1 . 2]" 2
225 1 81 LYS HA 1 81 LYS HB3 2.476 . 3.242 3.018 3.011 3.026 . 0 0 "[ . 1 . 2]" 2
226 1 81 LYS H 1 81 LYS HB3 2.380 . 3.088 2.706 2.637 2.759 . 0 0 "[ . 1 . 2]" 2
227 1 81 LYS HB3 1 81 LYS HG3 2.504 . 3.288 2.820 2.793 2.830 . 0 0 "[ . 1 . 2]" 2
228 1 77 ARG HB2 1 77 ARG HD2 2.774 . 3.736 3.433 2.798 3.602 . 0 0 "[ . 1 . 2]" 2
229 1 81 LYS H 1 81 LYS HB2 2.373 . 3.077 2.300 2.199 2.409 . 0 0 "[ . 1 . 2]" 2
230 1 81 LYS HB2 1 81 LYS HG2 2.418 . 3.149 2.816 2.782 2.827 . 0 0 "[ . 1 . 2]" 2
231 1 108 CYS H 1 108 CYS HA 2.632 . 3.498 2.940 2.934 2.943 . 0 0 "[ . 1 . 2]" 2
232 1 12 PHE H 1 108 CYS HA 2.772 . 3.733 3.477 3.437 3.511 . 0 0 "[ . 1 . 2]" 2
233 1 11 GLU HB3 1 108 CYS HA 2.447 . 3.195 2.292 2.247 2.347 . 0 0 "[ . 1 . 2]" 2
234 1 11 GLU HB2 1 108 CYS HA 2.439 . 3.182 2.868 2.817 2.927 . 0 0 "[ . 1 . 2]" 2
235 1 108 CYS HA 1 109 THR MG 2.958 . 4.052 3.756 3.657 3.821 . 0 0 "[ . 1 . 2]" 2
236 1 108 CYS HA 1 109 THR H 2.076 . 2.615 2.158 2.141 2.190 . 0 0 "[ . 1 . 2]" 2
237 1 85 TRP H 1 85 TRP HA 2.673 . 3.566 2.835 2.832 2.846 . 0 0 "[ . 1 . 2]" 2
238 1 77 ARG HB3 1 85 TRP HA 2.821 . 3.816 2.899 2.750 3.033 . 0 0 "[ . 1 . 2]" 2
239 1 85 TRP HA 1 86 LEU H 2.075 . 2.613 2.240 2.209 2.276 . 0 0 "[ . 1 . 2]" 2
240 1 85 TRP HA 1 85 TRP HE3 2.286 . 2.939 1.951 1.914 2.004 . 0 0 "[ . 1 . 2]" 2
241 1 85 TRP HA 1 85 TRP HB2 2.620 . 3.478 3.003 3.000 3.006 . 0 0 "[ . 1 . 2]" 2
242 1 85 TRP HA 1 85 TRP HB3 2.479 . 3.247 2.563 2.554 2.570 . 0 0 "[ . 1 . 2]" 2
243 1 16 HIS HB3 1 16 HIS HD1 3.038 . 4.192 3.799 3.795 3.804 . 0 0 "[ . 1 . 2]" 2
244 1 16 HIS HB3 1 23 THR H 2.952 . 4.041 2.970 2.892 3.060 . 0 0 "[ . 1 . 2]" 2
245 1 16 HIS HB3 1 17 ASN H 2.680 . 3.578 3.613 3.590 3.641 0.063 10 0 "[ . 1 . 2]" 2
246 1 93 GLN H 1 93 GLN HG2 2.459 . 3.215 2.806 2.715 2.933 . 0 0 "[ . 1 . 2]" 2
247 1 16 HIS HB2 1 23 THR H 2.980 . 4.090 3.602 3.529 3.669 . 0 0 "[ . 1 . 2]" 2
248 1 16 HIS HB2 1 16 HIS HD1 2.778 . 3.742 2.850 2.838 2.863 . 0 0 "[ . 1 . 2]" 2
249 1 16 HIS HB2 1 17 ASN H 2.543 . 3.351 2.174 2.119 2.236 . 0 0 "[ . 1 . 2]" 2
250 1 16 HIS HB2 1 22 PHE QD 2.834 . 3.838 3.637 3.565 3.689 . 0 0 "[ . 1 . 2]" 2
251 1 93 GLN HE21 1 93 GLN HG3 2.704 . 3.618 2.928 2.905 2.939 . 0 0 "[ . 1 . 2]" 2
252 1 37 PRO HB3 1 37 PRO HD3 2.742 . 3.682 3.742 3.719 3.762 0.080 6 0 "[ . 1 . 2]" 2
253 1 25 VAL HB 1 37 PRO HB3 2.410 . 3.136 2.207 2.169 2.244 . 0 0 "[ . 1 . 2]" 2
254 1 37 PRO HB3 1 41 LEU MD1 2.764 . 3.719 3.213 3.121 3.249 . 0 0 "[ . 1 . 2]" 2
255 1 25 VAL MG2 1 37 PRO HB3 2.784 . 3.753 3.765 3.736 3.788 0.035 16 0 "[ . 1 . 2]" 2
256 1 84 GLU H 1 84 GLU HB2 2.139 . 2.711 2.634 2.511 2.747 0.036 9 0 "[ . 1 . 2]" 2
257 1 37 PRO HB2 1 38 GLN H 2.607 . 3.457 2.659 2.549 2.718 . 0 0 "[ . 1 . 2]" 2
258 1 14 SER HA 1 15 ARG HA 3.086 . 4.276 4.339 4.330 4.358 0.082 18 0 "[ . 1 . 2]" 2
259 1 15 ARG HA 1 15 ARG HG3 2.423 . 3.157 2.836 2.653 2.927 . 0 0 "[ . 1 . 2]" 2
260 1 78 PHE HA 1 79 ARG H 2.042 . 2.563 2.225 2.207 2.235 . 0 0 "[ . 1 . 2]" 2
261 1 78 PHE HA 1 85 TRP HZ3 2.732 . 3.665 3.585 3.494 3.679 0.014 13 0 "[ . 1 . 2]" 2
262 1 76 PHE QE 1 78 PHE HA 2.548 . 3.360 2.409 2.279 2.525 . 0 0 "[ . 1 . 2]" 2
263 1 78 PHE HA 1 78 PHE HB2 2.496 . 3.275 2.577 2.570 2.587 . 0 0 "[ . 1 . 2]" 2
264 1 48 PHE HB3 1 78 PHE HA 2.818 . 3.811 3.517 3.430 3.609 . 0 0 "[ . 1 . 2]" 2
265 1 78 PHE HA 1 78 PHE QD 2.566 . 3.389 3.130 3.121 3.137 . 0 0 "[ . 1 . 2]" 2
266 1 78 PHE HA 1 78 PHE HB3 2.541 . 3.348 3.018 3.014 3.021 . 0 0 "[ . 1 . 2]" 2
267 1 79 ARG HA 1 86 LEU H 2.818 . 3.810 3.141 3.102 3.179 . 0 0 "[ . 1 . 2]" 2
268 1 79 ARG HA 1 80 SER H 1.984 . 2.476 2.160 2.148 2.169 . 0 0 "[ . 1 . 2]" 2
269 1 79 ARG HA 1 84 GLU H 2.889 . 3.932 3.565 3.182 3.750 . 0 0 "[ . 1 . 2]" 2
270 1 79 ARG HA 1 85 TRP HE3 2.639 . 3.510 3.268 3.204 3.315 . 0 0 "[ . 1 . 2]" 2
271 1 79 ARG HA 1 85 TRP HA 2.566 . 3.389 2.796 2.747 2.865 . 0 0 "[ . 1 . 2]" 2
272 1 79 ARG HA 1 79 ARG HD3 2.641 . 3.513 3.542 3.504 3.600 0.087 16 0 "[ . 1 . 2]" 2
273 1 40 LEU HA 1 43 LYS HB2 2.665 . 3.553 2.873 2.818 2.938 . 0 0 "[ . 1 . 2]" 2
274 1 79 ARG HA 1 79 ARG HB2 2.294 . 2.952 2.467 2.449 2.504 . 0 0 "[ . 1 . 2]" 2
275 1 40 LEU HA 1 41 LEU H 2.725 . 3.653 3.493 3.485 3.503 . 0 0 "[ . 1 . 2]" 2
276 1 40 LEU HA 1 43 LYS HG3 2.649 . 3.526 2.786 2.737 2.831 . 0 0 "[ . 1 . 2]" 2
277 1 40 LEU HA 1 40 LEU HG 2.447 . 3.196 3.306 3.295 3.316 0.120 10 0 "[ . 1 . 2]" 2
278 1 25 VAL MG2 1 40 LEU HA 2.957 . 4.050 3.966 3.932 4.006 . 0 0 "[ . 1 . 2]" 2
279 1 87 TRP H 1 87 TRP HD1 2.410 . 3.136 3.125 3.052 3.168 0.032 17 0 "[ . 1 . 2]" 2
280 1 87 TRP HB2 1 87 TRP HD1 2.344 . 3.031 2.592 2.584 2.602 . 0 0 "[ . 1 . 2]" 2
281 1 89 ARG H 1 108 CYS HB3 3.023 . 4.165 3.260 3.171 3.423 . 0 0 "[ . 1 . 2]" 2
282 1 108 CYS H 1 108 CYS HB3 2.383 . 3.093 2.423 2.404 2.455 . 0 0 "[ . 1 . 2]" 2
283 1 108 CYS HA 1 108 CYS HB3 2.315 . 2.985 3.013 3.006 3.016 0.031 16 0 "[ . 1 . 2]" 2
284 1 11 GLU HB3 1 108 CYS HB3 2.656 . 3.538 3.557 3.542 3.572 0.034 14 0 "[ . 1 . 2]" 2
285 1 89 ARG HB2 1 108 CYS HB3 2.485 . 3.257 2.615 2.555 2.720 . 0 0 "[ . 1 . 2]" 2
286 1 108 CYS H 1 108 CYS HB2 2.409 . 3.134 3.034 3.000 3.100 . 0 0 "[ . 1 . 2]" 2
287 1 108 CYS HA 1 108 CYS HB2 2.334 . 3.015 2.384 2.362 2.398 . 0 0 "[ . 1 . 2]" 2
288 1 11 GLU HB3 1 108 CYS HB2 2.638 . 3.508 1.954 1.891 1.994 . 0 0 "[ . 1 . 2]" 2
289 1 11 GLU HB2 1 108 CYS HB2 2.498 . 3.278 2.574 2.487 2.626 . 0 0 "[ . 1 . 2]" 2
290 1 106 ILE MG 1 108 CYS HB2 2.636 . 3.505 2.968 2.869 3.058 . 0 0 "[ . 1 . 2]" 2
291 1 36 GLN H 1 39 GLU HB3 2.923 . 3.991 2.938 2.796 3.120 . 0 0 "[ . 1 . 2]" 2
292 1 39 GLU HB3 1 40 LEU H 2.873 . 3.905 3.594 3.549 3.645 . 0 0 "[ . 1 . 2]" 2
293 1 39 GLU HA 1 39 GLU HB2 2.281 . 2.931 2.836 2.800 2.887 . 0 0 "[ . 1 . 2]" 2
294 1 35 TYR HB3 1 39 GLU HB2 2.724 . 3.652 3.177 2.963 3.234 . 0 0 "[ . 1 . 2]" 2
295 1 45 ILE MG 1 46 VAL HB 2.799 . 3.778 3.839 3.797 3.865 0.087 17 0 "[ . 1 . 2]" 2
296 1 15 ARG H 1 15 ARG HA 2.730 . 3.662 2.909 2.905 2.919 . 0 0 "[ . 1 . 2]" 2
297 1 15 ARG HA 1 16 HIS H 2.075 . 2.613 2.361 2.307 2.397 . 0 0 "[ . 1 . 2]" 2
298 1 15 ARG HA 1 104 GLU HA 2.285 . 2.938 2.203 1.952 2.314 . 0 0 "[ . 1 . 2]" 2
299 1 15 ARG HA 1 104 GLU HG3 3.033 . 4.183 3.672 3.586 3.774 . 0 0 "[ . 1 . 2]" 2
300 1 15 ARG HA 1 15 ARG HB2 2.285 . 2.938 2.989 2.949 3.003 0.065 4 0 "[ . 1 . 2]" 2
301 1 84 GLU HA 1 85 TRP H 2.015 . 2.522 2.231 2.215 2.245 . 0 0 "[ . 1 . 2]" 2
302 1 84 GLU H 1 84 GLU HA 2.345 . 3.032 2.940 2.923 2.945 . 0 0 "[ . 1 . 2]" 2
303 1 84 GLU HA 1 84 GLU QG 2.100 . 2.651 2.605 2.434 2.736 0.085 12 0 "[ . 1 . 2]" 2
304 1 84 GLU HA 1 84 GLU HB3 2.270 . 2.914 2.474 2.362 2.548 . 0 0 "[ . 1 . 2]" 2
305 1 96 GLN HA 1 97 ASN H 2.549 . 3.361 3.173 2.143 3.487 0.126 11 0 "[ . 1 . 2]" 2
306 1 96 GLN H 1 96 GLN HA 2.350 . 3.040 2.853 2.804 2.929 . 0 0 "[ . 1 . 2]" 2
307 1 96 GLN HA 1 96 GLN QG 2.220 . 2.836 2.799 2.506 2.957 0.121 10 0 "[ . 1 . 2]" 2
308 1 96 GLN HA 1 96 GLN HB3 2.157 . 2.739 2.361 2.331 2.380 . 0 0 "[ . 1 . 2]" 2
309 1 96 GLN HA 1 96 GLN HB2 2.259 . 2.897 2.989 2.982 2.996 0.099 10 0 "[ . 1 . 2]" 2
310 1 27 HIS H 1 27 HIS HB3 2.488 . 3.262 2.389 2.289 2.794 . 0 0 "[ . 1 . 2]" 2
311 1 27 HIS HA 1 27 HIS HB3 2.138 . 2.709 2.472 2.263 2.520 . 0 0 "[ . 1 . 2]" 2
312 1 27 HIS HB3 1 37 PRO HG2 3.013 . 4.148 3.522 2.786 3.707 . 0 0 "[ . 1 . 2]" 2
313 1 27 HIS HB3 1 37 PRO HG3 2.627 . 3.489 3.019 2.429 3.184 . 0 0 "[ . 1 . 2]" 2
314 1 27 HIS HB2 1 37 PRO HG2 2.876 . 3.910 3.987 3.953 4.235 0.325 16 0 "[ . 1 . 2]" 2
315 1 27 HIS HB2 1 37 PRO HG3 2.760 . 3.712 3.468 3.417 3.569 . 0 0 "[ . 1 . 2]" 2
316 1 85 TRP HB3 1 86 LEU H 3.062 . 4.234 4.047 3.972 4.107 . 0 0 "[ . 1 . 2]" 2
317 1 85 TRP H 1 85 TRP HB3 2.638 . 3.508 3.556 3.552 3.561 0.053 12 0 "[ . 1 . 2]" 2
318 1 70 GLN HA 1 70 GLN HB2 2.301 . 2.963 2.537 2.491 2.598 . 0 0 "[ . 1 . 2]" 2
319 1 70 GLN HA 1 70 GLN HB3 2.326 . 3.002 3.012 3.001 3.018 0.016 16 0 "[ . 1 . 2]" 2
320 1 58 ARG QB 1 59 ASP H 2.338 . 3.021 2.578 2.427 2.709 . 0 0 "[ . 1 . 2]" 2
321 1 58 ARG H 1 58 ARG QB 2.167 . 2.754 2.530 2.495 2.584 . 0 0 "[ . 1 . 2]" 2
322 1 55 GLN HA 1 58 ARG QB 2.424 . 3.158 3.025 2.801 3.153 . 0 0 "[ . 1 . 2]" 2
323 1 58 ARG QB 1 58 ARG QD 2.277 . 2.925 2.208 2.074 2.357 . 0 0 "[ . 1 . 2]" 2
324 1 58 ARG QB 1 58 ARG HG2 2.081 . 2.622 2.294 2.252 2.323 . 0 0 "[ . 1 . 2]" 2
325 1 75 MET H 1 75 MET HA 2.556 . 3.372 2.926 2.924 2.929 . 0 0 "[ . 1 . 2]" 2
326 1 75 MET HA 1 89 ARG HA 2.244 . 2.874 2.303 2.280 2.328 . 0 0 "[ . 1 . 2]" 2
327 1 75 MET HA 1 89 ARG QG 3.029 . 4.176 3.369 3.315 3.465 . 0 0 "[ . 1 . 2]" 2
328 1 76 PHE QD 1 89 ARG HA 3.042 . 4.199 4.117 4.042 4.187 . 0 0 "[ . 1 . 2]" 2
329 1 89 ARG HA 1 89 ARG HD2 2.922 . 3.990 3.600 3.514 3.749 . 0 0 "[ . 1 . 2]" 2
330 1 75 MET HB3 1 89 ARG HA 3.073 . 4.253 4.299 4.279 4.362 0.109 5 0 "[ . 1 . 2]" 2
331 1 76 PHE H 1 89 ARG HA 2.629 . 3.493 3.674 3.665 3.696 0.203 11 0 "[ . 1 . 2]" 2
332 1 74 VAL H 1 89 ARG HA 3.084 . 4.273 4.127 4.101 4.171 . 0 0 "[ . 1 . 2]" 2
333 1 89 ARG HA 1 89 ARG HB2 2.490 . 3.265 3.031 3.028 3.033 . 0 0 "[ . 1 . 2]" 2
334 1 89 ARG HA 1 89 ARG HB3 2.221 . 2.838 2.426 2.407 2.446 . 0 0 "[ . 1 . 2]" 2
335 1 89 ARG HA 1 89 ARG HG2 2.404 . 3.126 2.540 2.507 2.589 . 0 0 "[ . 1 . 2]" 2
336 1 89 ARG HA 1 90 THR MG 2.672 . 3.565 3.469 3.430 3.496 . 0 0 "[ . 1 . 2]" 2
337 1 16 HIS HA 1 22 PHE QD 2.985 . 4.099 3.927 3.890 3.960 . 0 0 "[ . 1 . 2]" 2
338 1 16 HIS HA 1 22 PHE HA 2.404 . 3.126 2.698 2.662 2.728 . 0 0 "[ . 1 . 2]" 2
339 1 16 HIS HA 1 16 HIS HB2 2.349 . 3.039 2.473 2.464 2.480 . 0 0 "[ . 1 . 2]" 2
340 1 77 ARG HA 1 88 MET H 2.692 . 3.598 3.559 3.504 3.592 . 0 0 "[ . 1 . 2]" 2
341 1 77 ARG HA 1 78 PHE H 2.103 . 2.656 2.148 2.131 2.163 . 0 0 "[ . 1 . 2]" 2
342 1 77 ARG H 1 77 ARG HA 2.778 . 3.743 2.922 2.915 2.927 . 0 0 "[ . 1 . 2]" 2
343 1 77 ARG HA 1 77 ARG HB3 2.667 . 3.556 2.520 2.443 2.584 . 0 0 "[ . 1 . 2]" 2
344 1 77 ARG HA 1 77 ARG HG3 2.670 . 3.561 2.634 2.414 2.956 . 0 0 "[ . 1 . 2]" 2
345 1 87 TRP HB2 1 88 MET H 3.036 . 4.188 4.331 4.317 4.344 0.156 17 0 "[ . 1 . 2]" 2
346 1 77 ARG HB3 1 85 TRP HB2 2.864 . 3.889 3.521 3.480 3.585 . 0 0 "[ . 1 . 2]" 2
347 1 85 TRP H 1 85 TRP HB2 2.555 . 3.371 2.323 2.311 2.335 . 0 0 "[ . 1 . 2]" 2
348 1 87 TRP HB3 1 110 ASN HB3 2.862 . 3.886 2.611 2.431 2.873 . 0 0 "[ . 1 . 2]" 2
349 1 87 TRP HB3 1 88 MET H 2.957 . 4.050 3.317 3.280 3.352 . 0 0 "[ . 1 . 2]" 2
350 1 50 HIS HD2 1 85 TRP HB3 3.022 . 4.163 4.045 3.922 4.136 . 0 0 "[ . 1 . 2]" 2
351 1 12 PHE HB2 1 28 ARG HB2 2.986 . 4.100 2.454 2.283 2.662 . 0 0 "[ . 1 . 2]" 2
352 1 96 GLN HB3 1 96 GLN QG 2.096 . 2.645 2.414 2.379 2.505 . 0 0 "[ . 1 . 2]" 2
353 1 17 ASN HD22 1 19 GLU HB2 2.992 . 4.111 2.771 2.301 2.961 . 0 0 "[ . 1 . 2]" 2
354 1 19 GLU HB3 1 44 ASN HD21 3.028 . 4.174 2.343 2.292 2.460 . 0 0 "[ . 1 . 2]" 2
355 1 12 PHE HB2 1 28 ARG HB3 3.001 . 4.127 3.504 3.386 3.562 . 0 0 "[ . 1 . 2]" 2
356 1 96 GLN H 1 96 GLN HB2 2.294 . 2.952 2.623 2.530 2.741 . 0 0 "[ . 1 . 2]" 2
357 1 95 ALA MB 1 96 GLN HB2 3.041 . 4.197 4.211 4.130 4.334 0.137 4 0 "[ . 1 . 2]" 2
358 1 75 MET HA 1 76 PHE H 2.014 . 2.521 2.105 2.091 2.112 . 0 0 "[ . 1 . 2]" 2
359 1 75 MET HA 1 90 THR H 2.608 . 3.458 3.480 3.458 3.491 0.033 2 0 "[ . 1 . 2]" 2
360 1 75 MET HA 1 76 PHE QD 2.714 . 3.635 3.429 3.373 3.460 . 0 0 "[ . 1 . 2]" 2
361 1 75 MET HA 1 75 MET HB3 2.280 . 2.930 2.523 2.506 2.569 . 0 0 "[ . 1 . 2]" 2
362 1 75 MET HA 1 75 MET HB2 2.423 . 3.157 3.006 2.991 3.015 . 0 0 "[ . 1 . 2]" 2
363 1 75 MET HA 1 90 THR MG 3.070 . 4.248 3.845 3.783 3.941 . 0 0 "[ . 1 . 2]" 2
364 1 11 GLU H 1 11 GLU HA 2.488 . 3.262 2.832 2.828 2.835 . 0 0 "[ . 1 . 2]" 2
365 1 11 GLU HA 1 108 CYS HA 2.131 . 2.699 1.830 1.781 1.886 . 0 0 "[ . 1 . 2]" 2
366 1 16 HIS HA 1 16 HIS HB3 2.277 . 2.925 2.434 2.429 2.443 . 0 0 "[ . 1 . 2]" 2
367 1 11 GLU HA 1 11 GLU HB3 2.218 . 2.833 2.421 2.418 2.425 . 0 0 "[ . 1 . 2]" 2
368 1 11 GLU HA 1 11 GLU HB2 2.200 . 2.805 2.456 2.449 2.463 . 0 0 "[ . 1 . 2]" 2
369 1 11 GLU HA 1 109 THR MG 3.027 . 4.173 3.790 3.646 3.898 . 0 0 "[ . 1 . 2]" 2
370 1 16 HIS HA 1 23 THR MG 2.254 . 2.889 1.982 1.867 2.195 . 0 0 "[ . 1 . 2]" 2
371 1 30 VAL QG 1 36 GLN HA . . 2.307 1.827 1.784 1.898 0.050 3 0 "[ . 1 . 2]" 2
372 1 36 GLN H 1 36 GLN HA 2.600 . 3.445 2.788 2.775 2.795 . 0 0 "[ . 1 . 2]" 2
373 1 36 GLN HA 1 37 PRO HD2 2.209 . 2.819 2.668 2.628 2.713 . 0 0 "[ . 1 . 2]" 2
374 1 36 GLN HA 1 37 PRO HD3 2.079 . 2.619 2.378 2.335 2.401 . 0 0 "[ . 1 . 2]" 2
375 1 36 GLN HA 1 36 GLN QB 2.233 . 2.856 2.332 2.284 2.354 . 0 0 "[ . 1 . 2]" 2
376 1 30 VAL HB 1 36 GLN HA 2.591 . 3.430 2.627 2.567 2.700 . 0 0 "[ . 1 . 2]" 2
377 1 36 GLN HA 1 39 GLU HB2 2.975 . 4.082 3.913 3.809 4.110 0.028 19 0 "[ . 1 . 2]" 2
378 1 31 ALA HA 1 32 THR H 2.590 . 3.429 3.424 3.415 3.451 0.022 20 0 "[ . 1 . 2]" 2
379 1 87 TRP HH2 1 87 TRP HZ3 2.060 . 2.591 2.437 2.434 2.440 . 0 0 "[ . 1 . 2]" 2
380 1 52 GLU HA 1 52 GLU HB2 2.397 . 3.115 3.018 3.011 3.021 . 0 0 "[ . 1 . 2]" 2
381 1 79 ARG H 1 79 ARG HB2 2.467 . 3.228 2.596 2.483 2.623 . 0 0 "[ . 1 . 2]" 2
382 1 13 ILE H 1 13 ILE HG13 2.599 . 3.443 2.147 2.020 2.221 . 0 0 "[ . 1 . 2]" 2
383 1 13 ILE HA 1 13 ILE HG13 2.639 . 3.509 2.777 2.705 2.874 . 0 0 "[ . 1 . 2]" 2
384 1 81 LYS HA 1 81 LYS HD2 2.752 . 3.699 3.103 2.983 3.136 . 0 0 "[ . 1 . 2]" 2
385 1 81 LYS HB2 1 81 LYS HD2 2.658 . 3.541 2.395 2.117 2.545 . 0 0 "[ . 1 . 2]" 2
386 1 35 TYR QE 1 81 LYS HD3 2.966 . 4.066 4.170 4.098 4.262 0.196 15 0 "[ . 1 . 2]" 2
387 1 35 TYR QD 1 81 LYS HD3 2.798 . 3.777 3.228 2.980 3.455 . 0 0 "[ . 1 . 2]" 2
388 1 81 LYS HD3 1 81 LYS QE 2.214 . 2.827 2.326 2.141 2.386 . 0 0 "[ . 1 . 2]" 2
389 1 81 LYS HD3 1 81 LYS HG3 2.331 . 3.010 2.998 2.972 3.008 . 0 0 "[ . 1 . 2]" 2
390 1 81 LYS HB2 1 81 LYS HD3 2.610 . 3.461 2.384 2.227 2.677 . 0 0 "[ . 1 . 2]" 2
391 1 35 TYR HA 1 81 LYS HD3 2.809 . 3.795 2.727 2.294 3.022 . 0 0 "[ . 1 . 2]" 2
392 1 79 ARG H 1 79 ARG HB3 2.528 . 3.327 2.523 2.480 2.548 . 0 0 "[ . 1 . 2]" 2
393 1 79 ARG HB3 1 85 TRP HZ3 2.753 . 3.700 3.373 3.315 3.460 . 0 0 "[ . 1 . 2]" 2
394 1 79 ARG HA 1 79 ARG HB3 2.552 . 3.366 3.030 3.027 3.032 . 0 0 "[ . 1 . 2]" 2
395 1 79 ARG HB3 1 79 ARG HD3 2.967 . 4.067 3.058 2.960 3.493 . 0 0 "[ . 1 . 2]" 2
396 1 79 ARG HB3 1 79 ARG HD2 2.800 . 3.780 2.166 2.129 2.233 . 0 0 "[ . 1 . 2]" 2
397 1 79 ARG HB3 1 79 ARG HG2 2.511 . 3.299 2.985 2.980 2.998 . 0 0 "[ . 1 . 2]" 2
398 1 13 ILE H 1 13 ILE HG12 2.888 . 3.930 3.652 3.519 3.722 . 0 0 "[ . 1 . 2]" 2
399 1 13 ILE HG12 1 106 ILE HA 3.022 . 4.164 3.901 3.846 4.002 . 0 0 "[ . 1 . 2]" 2
400 1 13 ILE HA 1 13 ILE HG12 2.626 . 3.488 2.898 2.831 2.951 . 0 0 "[ . 1 . 2]" 2
401 1 13 ILE HB 1 13 ILE HG12 2.660 . 3.545 2.979 2.962 3.000 . 0 0 "[ . 1 . 2]" 2
402 1 13 ILE MD 1 13 ILE HG12 1.912 . 2.369 2.118 2.117 2.119 . 0 0 "[ . 1 . 2]" 2
403 1 2 ALA HA 1 2 ALA MB 2.755 . 3.703 2.128 2.127 2.129 . 0 0 "[ . 1 . 2]" 2
404 1 79 ARG HB2 1 85 TRP HZ3 2.657 . 3.539 2.526 2.435 2.628 . 0 0 "[ . 1 . 2]" 2
405 1 63 GLN HA 1 66 LYS QD 2.501 . 3.283 2.623 2.481 2.718 . 0 0 "[ . 1 . 2]" 2
406 1 15 ARG HG3 1 104 GLU HG3 2.930 . 4.003 2.114 1.935 2.590 . 0 0 "[ . 1 . 2]" 2
407 1 15 ARG HG3 1 104 GLU HB2 2.996 . 4.118 3.910 2.552 4.129 0.011 5 0 "[ . 1 . 2]" 2
408 1 15 ARG HD3 1 15 ARG HG2 2.689 . 3.593 2.386 2.334 2.457 . 0 0 "[ . 1 . 2]" 2
409 1 107 ILE H 1 107 ILE HG12 2.665 . 3.553 3.620 3.602 3.632 0.079 18 0 "[ . 1 . 2]" 2
410 1 107 ILE HA 1 107 ILE HG13 2.569 . 3.394 2.870 2.856 2.895 . 0 0 "[ . 1 . 2]" 2
411 1 90 THR MG 1 107 ILE HG13 2.843 . 3.853 3.901 3.888 3.925 0.072 17 0 "[ . 1 . 2]" 2
412 1 107 ILE MD 1 107 ILE HG13 2.276 . 2.923 2.080 2.077 2.082 . 0 0 "[ . 1 . 2]" 2
413 1 97 ASN HA 1 99 TYR H 2.167 . 2.754 2.364 1.973 2.769 0.015 4 0 "[ . 1 . 2]" 2
414 1 97 ASN HA 1 100 SER H 2.592 . 3.432 2.251 1.995 2.444 . 0 0 "[ . 1 . 2]" 2
415 1 97 ASN HA 1 97 ASN HB2 2.150 . 2.728 2.426 2.240 3.001 0.273 16 0 "[ . 1 . 2]" 2
416 1 52 GLU H 1 52 GLU HB2 2.491 . 3.267 2.494 2.425 2.543 . 0 0 "[ . 1 . 2]" 2
417 1 49 CYS H 1 49 CYS HB3 2.373 . 3.077 2.423 2.397 2.484 . 0 0 "[ . 1 . 2]" 2
418 1 49 CYS HB3 1 54 GLN HE21 3.069 . 4.246 3.449 3.267 4.321 0.075 11 0 "[ . 1 . 2]" 2
419 1 49 CYS HB3 1 54 GLN HG2 2.656 . 3.537 2.190 1.773 2.268 0.002 16 0 "[ . 1 . 2]" 2
420 1 49 CYS H 1 49 CYS HB2 2.379 . 3.086 2.632 2.570 2.659 . 0 0 "[ . 1 . 2]" 2
421 1 63 GLN HB2 1 64 VAL H 2.671 . 3.563 2.606 2.544 2.649 . 0 0 "[ . 1 . 2]" 2
422 1 63 GLN H 1 63 GLN HB2 2.368 . 3.069 2.365 2.348 2.406 . 0 0 "[ . 1 . 2]" 2
423 1 63 GLN HB2 1 72 LEU QD 2.299 . 2.960 1.793 1.772 1.876 . 0 0 "[ . 1 . 2]" 2
424 1 8 GLN HB3 1 9 PRO QD 2.726 . 3.189 2.257 2.056 3.644 0.455 15 0 "[ . 1 . 2]" 2
425 1 63 GLN HB3 1 64 VAL H 2.632 . 3.498 3.604 3.582 3.620 0.122 15 0 "[ . 1 . 2]" 2
426 1 47 GLU HB3 1 48 PHE H 2.970 . 4.073 3.483 3.401 3.537 . 0 0 "[ . 1 . 2]" 2
427 1 47 GLU HB3 1 48 PHE HD1 3.018 . 4.156 4.198 4.183 4.228 0.072 16 0 "[ . 1 . 2]" 2
428 1 8 GLN HB2 1 9 PRO QD 2.741 . 3.680 3.449 2.470 3.556 . 0 0 "[ . 1 . 2]" 2
429 1 43 LYS QD 1 48 PHE HZ 2.533 . 3.335 1.702 1.669 1.732 0.090 14 0 "[ . 1 . 2]" 2
430 1 43 LYS QD 1 43 LYS HE2 2.211 . 2.822 2.315 2.172 2.382 . 0 0 "[ . 1 . 2]" 2
431 1 43 LYS HB2 1 43 LYS QD 2.429 . 3.166 2.746 2.687 2.877 . 0 0 "[ . 1 . 2]" 2
432 1 47 GLU H 1 47 GLU HB2 2.397 . 3.115 2.242 2.225 2.261 . 0 0 "[ . 1 . 2]" 2
433 1 44 ASN HB3 1 47 GLU HB2 3.076 . 4.258 2.301 2.207 2.350 . 0 0 "[ . 1 . 2]" 2
434 1 47 GLU HB2 1 48 PHE H 2.953 . 4.043 3.038 2.978 3.081 . 0 0 "[ . 1 . 2]" 2
435 1 46 VAL QG 1 58 ARG HG3 2.559 . 3.377 2.097 1.914 2.283 . 0 0 "[ . 1 . 2]" 2
436 1 45 ILE H 1 45 ILE HG13 3.069 . 4.246 4.348 4.339 4.358 0.112 11 0 "[ . 1 . 2]" 2
437 1 22 PHE QE 1 45 ILE HG13 2.596 . 3.438 2.988 2.960 3.007 . 0 0 "[ . 1 . 2]" 2
438 1 22 PHE HZ 1 45 ILE HG13 2.554 . 3.369 1.775 1.764 1.798 . 0 0 "[ . 1 . 2]" 2
439 1 15 ARG HA 1 15 ARG HG2 2.706 . 3.622 2.440 2.338 2.523 . 0 0 "[ . 1 . 2]" 2
440 1 18 ILE HG12 1 61 PHE QB 3.041 . 4.197 4.380 4.366 4.406 0.209 17 0 "[ . 1 . 2]" 2
441 1 13 ILE HA 1 106 ILE QG 2.862 . 3.886 2.346 2.278 2.419 . 0 0 "[ . 1 . 2]" 2
442 1 106 ILE H 1 106 ILE QG 2.787 . 3.758 3.378 3.350 3.437 . 0 0 "[ . 1 . 2]" 2
443 1 106 ILE QG 1 106 ILE MG 2.229 . 2.850 2.098 2.056 2.113 . 0 0 "[ . 1 . 2]" 2
444 1 45 ILE HA 1 45 ILE HG12 2.563 . 3.384 3.078 3.056 3.112 . 0 0 "[ . 1 . 2]" 2
445 1 45 ILE MD 1 45 ILE HG12 2.222 . 2.839 2.117 2.115 2.119 . 0 0 "[ . 1 . 2]" 2
446 1 45 ILE HG12 1 45 ILE MG 2.399 . 3.118 2.340 2.290 2.361 . 0 0 "[ . 1 . 2]" 2
447 1 88 MET HA 1 89 ARG H 2.128 . 2.694 2.286 2.255 2.329 . 0 0 "[ . 1 . 2]" 2
448 1 88 MET HA 1 88 MET HB2 2.505 . 3.289 3.021 3.020 3.024 . 0 0 "[ . 1 . 2]" 2
449 1 88 MET HA 1 107 ILE MG 2.892 . 3.937 3.854 3.821 3.890 . 0 0 "[ . 1 . 2]" 2
450 1 88 MET H 1 88 MET HA 2.682 . 3.581 2.929 2.925 2.933 . 0 0 "[ . 1 . 2]" 2
451 1 54 GLN HB3 1 55 GLN H 2.968 . 4.069 3.911 3.828 3.949 . 0 0 "[ . 1 . 2]" 2
452 1 55 GLN HA 1 58 ARG HG3 2.966 . 4.066 3.988 3.853 4.082 0.016 2 0 "[ . 1 . 2]" 2
453 1 58 ARG HG3 1 59 ASP H 3.045 . 4.204 4.175 4.080 4.233 0.029 16 0 "[ . 1 . 2]" 2
454 1 58 ARG HA 1 58 ARG HG3 2.529 . 3.329 3.029 2.939 3.134 . 0 0 "[ . 1 . 2]" 2
455 1 58 ARG H 1 58 ARG HG2 2.580 . 3.412 3.328 3.192 3.422 0.010 18 0 "[ . 1 . 2]" 2
456 1 88 MET HA 1 110 ASN H 2.577 . 3.407 3.001 2.790 3.056 . 0 0 "[ . 1 . 2]" 2
457 1 88 MET HA 1 88 MET HG2 2.695 . 3.603 2.768 2.745 2.783 . 0 0 "[ . 1 . 2]" 2
458 1 88 MET HA 1 88 MET HG3 2.851 . 3.867 3.821 3.810 3.835 . 0 0 "[ . 1 . 2]" 2
459 1 88 MET HA 1 88 MET HB3 2.388 . 3.101 2.426 2.421 2.433 . 0 0 "[ . 1 . 2]" 2
460 1 51 PRO HD3 1 85 TRP HH2 2.983 . 4.095 2.553 2.480 2.627 . 0 0 "[ . 1 . 2]" 2
461 1 79 ARG HB2 1 85 TRP HH2 2.895 . 3.943 3.258 3.227 3.288 . 0 0 "[ . 1 . 2]" 2
462 1 103 ILE H 1 103 ILE HG13 2.756 . 3.706 3.145 3.077 3.178 . 0 0 "[ . 1 . 2]" 2
463 1 103 ILE HA 1 103 ILE HG13 2.430 . 3.168 2.959 2.938 2.988 . 0 0 "[ . 1 . 2]" 2
464 1 103 ILE HB 1 103 ILE HG13 2.350 . 3.040 2.490 2.480 2.500 . 0 0 "[ . 1 . 2]" 2
465 1 103 ILE H 1 103 ILE HG12 3.012 . 4.146 4.230 4.211 4.246 0.100 13 0 "[ . 1 . 2]" 2
466 1 64 VAL MG2 1 103 ILE HG12 2.430 . 3.168 2.083 2.034 2.126 . 0 0 "[ . 1 . 2]" 2
467 1 103 ILE HB 1 103 ILE HG12 2.503 . 3.286 3.019 3.017 3.022 . 0 0 "[ . 1 . 2]" 2
468 1 95 ALA HA 1 104 GLU H 3.049 . 4.211 2.753 2.629 2.850 . 0 0 "[ . 1 . 2]" 2
469 1 95 ALA HA 1 96 GLN H 1.992 . 2.488 2.480 2.422 2.520 0.032 19 0 "[ . 1 . 2]" 2
470 1 95 ALA HA 1 96 GLN QG 2.751 . 3.697 3.362 3.025 3.563 . 0 0 "[ . 1 . 2]" 2
471 1 95 ALA HA 1 104 GLU HB2 2.490 . 3.265 1.805 1.689 2.390 0.026 14 0 "[ . 1 . 2]" 2
472 1 95 ALA HA 1 104 GLU HB3 2.481 . 3.250 2.975 2.100 3.168 . 0 0 "[ . 1 . 2]" 2
473 1 15 ARG HG2 1 95 ALA HA 2.919 . 3.984 3.934 3.703 4.015 0.031 18 0 "[ . 1 . 2]" 2
474 1 36 GLN H 1 36 GLN QB 2.649 . 3.229 2.559 2.497 2.688 . 0 0 "[ . 1 . 2]" 2
475 1 37 PRO HD2 1 37 PRO HG2 2.249 . 2.881 2.255 2.244 2.260 . 0 0 "[ . 1 . 2]" 2
476 1 37 PRO HD3 1 37 PRO HG2 2.299 . 2.960 2.814 2.791 2.827 . 0 0 "[ . 1 . 2]" 2
477 1 37 PRO HG2 1 41 LEU MD1 3.085 . 4.274 4.409 4.398 4.420 0.146 16 0 "[ . 1 . 2]" 2
478 1 37 PRO HG2 1 38 GLN H 2.891 . 3.936 3.604 3.546 3.686 . 0 0 "[ . 1 . 2]" 2
479 1 51 PRO QG 1 54 GLN HE22 2.881 . 3.919 3.673 3.582 3.971 0.052 11 0 "[ . 1 . 2]" 2
480 1 51 PRO HA 1 51 PRO QG 2.282 . 2.933 2.738 2.697 2.752 . 0 0 "[ . 1 . 2]" 2
481 1 51 PRO HB3 1 51 PRO QG 1.956 . 2.434 2.184 2.182 2.185 . 0 0 "[ . 1 . 2]" 2
482 1 25 VAL MG1 1 37 PRO HG3 3.022 . 4.163 4.127 4.068 4.162 . 0 0 "[ . 1 . 2]" 2
483 1 36 GLN QB 1 39 GLU HB2 2.501 . 3.283 2.339 2.157 2.594 . 0 0 "[ . 1 . 2]" 2
484 1 89 ARG H 1 89 ARG QG 2.665 . 3.553 2.764 2.717 2.815 . 0 0 "[ . 1 . 2]" 2
485 1 89 ARG HA 1 89 ARG QG 2.604 . 3.452 2.495 2.465 2.541 . 0 0 "[ . 1 . 2]" 2
486 1 102 GLU HA 1 103 ILE HG13 2.785 . 3.754 3.210 3.128 3.246 . 0 0 "[ . 1 . 2]" 2
487 1 30 VAL QG 1 36 GLN QB 3.061 . 4.232 3.056 2.917 3.180 . 0 0 "[ . 1 . 2]" 2
488 1 38 GLN H 1 38 GLN HB3 2.165 . 2.751 2.712 2.582 2.774 0.023 5 0 "[ . 1 . 2]" 2
489 1 38 GLN HA 1 38 GLN HB3 1.891 . 2.338 2.389 2.359 2.439 0.101 4 0 "[ . 1 . 2]" 2
490 1 38 GLN QB 1 38 GLN HG2 2.015 . 2.522 2.326 2.212 2.511 . 0 0 "[ . 1 . 2]" 2
491 1 38 GLN QB 1 41 LEU MD1 2.775 . 3.738 3.071 2.993 3.139 . 0 0 "[ . 1 . 2]" 2
492 1 55 GLN H 1 55 GLN HB2 2.423 . 3.157 2.455 2.210 2.516 . 0 0 "[ . 1 . 2]" 2
493 1 9 PRO HA 1 9 PRO QG 2.532 . 3.333 3.454 2.928 3.487 0.154 13 0 "[ . 1 . 2]" 2
494 1 9 PRO QG 1 32 THR HA 2.863 . 3.888 2.159 1.832 2.485 0.006 14 0 "[ . 1 . 2]" 2
495 1 9 PRO QD 1 9 PRO QG 1.950 . 2.400 1.960 1.956 1.973 . 0 0 "[ . 1 . 2]" 2
496 1 9 PRO QG 1 32 THR MG 2.736 . 3.672 3.560 3.333 3.752 0.080 13 0 "[ . 1 . 2]" 2
497 1 55 GLN HA 1 55 GLN HB3 2.312 . 2.980 3.014 2.994 3.019 0.039 17 0 "[ . 1 . 2]" 2
498 1 55 GLN HB3 1 55 GLN QG 2.123 . 2.686 2.173 2.163 2.267 . 0 0 "[ . 1 . 2]" 2
499 1 28 ARG H 1 28 ARG QG 2.771 . 3.626 2.798 2.594 2.918 . 0 0 "[ . 1 . 2]" 2
500 1 28 ARG HA 1 28 ARG QG 2.519 . 3.312 2.241 2.105 2.551 . 0 0 "[ . 1 . 2]" 2
501 1 28 ARG QD 1 28 ARG QG 2.350 . 3.040 2.079 2.018 2.092 . 0 0 "[ . 1 . 2]" 2
502 1 21 ILE HG13 1 44 ASN HD21 2.974 . 4.080 3.769 3.723 3.819 . 0 0 "[ . 1 . 2]" 2
503 1 17 ASN HD22 1 21 ILE HG13 2.814 . 3.804 1.875 1.810 2.207 0.014 13 0 "[ . 1 . 2]" 2
504 1 21 ILE HB 1 21 ILE HG13 2.239 . 2.866 2.390 2.374 2.409 . 0 0 "[ . 1 . 2]" 2
505 1 19 GLU HB3 1 21 ILE HG13 2.706 . 3.622 3.544 3.403 3.638 0.016 11 0 "[ . 1 . 2]" 2
506 1 17 ASN HD22 1 21 ILE HG12 2.901 . 3.953 2.520 2.221 2.675 . 0 0 "[ . 1 . 2]" 2
507 1 21 ILE HG12 1 44 ASN HB2 3.081 . 4.267 4.131 4.044 4.225 . 0 0 "[ . 1 . 2]" 2
508 1 19 GLU QG 1 21 ILE HG12 2.893 . 3.939 3.482 3.391 3.538 . 0 0 "[ . 1 . 2]" 2
509 1 19 GLU HB3 1 21 ILE HG12 2.753 . 3.700 2.423 2.266 2.541 . 0 0 "[ . 1 . 2]" 2
510 1 21 ILE H 1 21 ILE HG12 2.270 . 2.914 1.652 1.623 1.730 0.003 18 0 "[ . 1 . 2]" 2
511 1 21 ILE HG12 1 44 ASN HD21 2.934 . 4.010 2.711 2.658 2.792 . 0 0 "[ . 1 . 2]" 2
512 1 21 ILE HG12 1 44 ASN HD22 3.044 . 4.202 3.553 3.437 3.625 . 0 0 "[ . 1 . 2]" 2
513 1 21 ILE HG12 1 44 ASN HA 2.963 . 4.060 3.615 3.550 3.669 . 0 0 "[ . 1 . 2]" 2
514 1 21 ILE HB 1 21 ILE HG12 2.323 . 2.998 2.527 2.503 2.551 . 0 0 "[ . 1 . 2]" 2
515 1 51 PRO HD2 1 52 GLU H 2.977 . 4.084 3.147 3.096 3.236 . 0 0 "[ . 1 . 2]" 2
516 1 28 ARG HB3 1 28 ARG QG 2.599 . 3.443 2.482 2.416 2.524 . 0 0 "[ . 1 . 2]" 2
517 1 51 PRO HD2 1 85 TRP HH2 2.788 . 3.760 3.622 3.387 3.769 0.009 19 0 "[ . 1 . 2]" 2
518 1 51 PRO HB3 1 51 PRO HD2 2.778 . 3.743 3.872 3.863 3.882 0.139 11 0 "[ . 1 . 2]" 2
519 1 51 PRO HD2 1 51 PRO QG 2.033 . 2.549 2.227 2.223 2.230 . 0 0 "[ . 1 . 2]" 2
520 1 50 HIS HB2 1 51 PRO HD2 3.018 . 4.157 4.186 4.169 4.233 0.076 11 0 "[ . 1 . 2]" 2
521 1 86 LEU HA 1 86 LEU HG 2.871 . 3.902 3.422 3.396 3.445 . 0 0 "[ . 1 . 2]" 2
522 1 56 LEU HA 1 56 LEU HG 2.578 . 3.409 2.939 2.911 2.964 . 0 0 "[ . 1 . 2]" 2
523 1 56 LEU HG 1 74 VAL MG1 2.574 . 3.402 2.258 2.062 2.385 . 0 0 "[ . 1 . 2]" 2
524 1 67 LEU H 1 67 LEU HG 2.373 . 3.077 2.216 2.167 2.253 . 0 0 "[ . 1 . 2]" 2
525 1 67 LEU HA 1 67 LEU HG 2.562 . 3.382 3.238 3.212 3.269 . 0 0 "[ . 1 . 2]" 2
526 1 41 LEU H 1 41 LEU HG 2.236 . 2.861 2.809 2.765 2.843 . 0 0 "[ . 1 . 2]" 2
527 1 38 GLN HA 1 41 LEU HG 2.795 . 3.771 3.777 3.729 3.808 0.037 12 0 "[ . 1 . 2]" 2
528 1 41 LEU HA 1 41 LEU HG 2.608 . 3.458 2.438 2.418 2.457 . 0 0 "[ . 1 . 2]" 2
529 1 25 VAL MG2 1 41 LEU HG 2.740 . 3.679 1.780 1.748 1.860 0.053 11 0 "[ . 1 . 2]" 2
530 1 79 ARG HB2 1 79 ARG HG3 2.240 . 2.867 2.298 2.291 2.337 . 0 0 "[ . 1 . 2]" 2
531 1 86 LEU HA 1 86 LEU QD . . 2.375 1.797 1.712 1.843 0.055 4 0 "[ . 1 . 2]" 2
532 1 80 SER QB 1 86 LEU QD 2.428 . 2.980 2.286 1.978 2.436 . 0 0 "[ . 1 . 2]" 2
533 1 86 LEU HB2 1 86 LEU QD 2.115 . 2.674 2.479 2.459 2.491 . 0 0 "[ . 1 . 2]" 2
534 1 86 LEU QD 1 86 LEU HG 1.911 . 2.239 1.887 1.883 1.892 . 0 0 "[ . 1 . 2]" 2
535 1 86 LEU QD 1 109 THR MG 2.722 . 3.648 3.178 2.956 3.390 . 0 0 "[ . 1 . 2]" 2
536 1 40 LEU HB3 1 40 LEU HG 2.370 . 3.072 2.214 2.212 2.217 . 0 0 "[ . 1 . 2]" 2
537 1 79 ARG HG2 1 80 SER H 2.625 . 3.486 3.469 3.377 3.504 0.018 2 0 "[ . 1 . 2]" 2
538 1 79 ARG HG2 1 83 GLN H 3.071 . 4.250 4.059 3.999 4.241 . 0 0 "[ . 1 . 2]" 2
539 1 79 ARG HA 1 79 ARG HG2 2.434 . 3.175 2.454 2.438 2.494 . 0 0 "[ . 1 . 2]" 2
540 1 79 ARG HB2 1 79 ARG HG2 2.382 . 3.091 2.601 2.533 2.617 . 0 0 "[ . 1 . 2]" 2
541 1 9 PRO HB3 1 9 PRO QD 2.365 . 3.064 2.970 2.910 3.505 0.441 20 0 "[ . 1 . 2]" 2
542 1 75 MET HB3 1 87 TRP HZ3 2.571 . 3.398 2.188 2.068 2.324 . 0 0 "[ . 1 . 2]" 2
543 1 75 MET HB2 1 87 TRP HZ3 2.671 . 3.563 2.601 2.523 2.817 . 0 0 "[ . 1 . 2]" 2
544 1 78 PHE QD 1 86 LEU QD 2.956 . 4.048 3.996 3.971 4.010 . 0 0 "[ . 1 . 2]" 2
545 1 32 THR HA 1 86 LEU QD 3.006 . 4.136 4.141 4.120 4.168 0.032 11 0 "[ . 1 . 2]" 2
546 1 78 PHE HB3 1 86 LEU QD 3.099 . 4.299 3.744 3.650 3.802 . 0 0 "[ . 1 . 2]" 2
547 1 33 VAL HB 1 86 LEU QD 2.743 . 3.684 3.668 3.570 3.701 0.017 20 0 "[ . 1 . 2]" 2
548 1 86 LEU HB3 1 86 LEU QD 2.135 . 2.616 2.075 2.052 2.093 . 0 0 "[ . 1 . 2]" 2
549 1 76 PHE H 1 87 TRP HZ3 2.940 . 4.021 3.668 3.627 3.779 . 0 0 "[ . 1 . 2]" 2
550 1 43 LYS H 1 43 LYS HG3 2.613 . 3.466 2.699 2.551 3.158 . 0 0 "[ . 1 . 2]" 2
551 1 43 LYS HG3 1 48 PHE QE 2.934 . 4.010 3.805 3.545 3.864 . 0 0 "[ . 1 . 2]" 2
552 1 43 LYS QE 1 43 LYS HG3 2.437 . 3.180 2.793 2.474 3.180 0.000 2 0 "[ . 1 . 2]" 2
553 1 43 LYS HB2 1 43 LYS HG3 2.399 . 3.118 2.247 2.189 2.266 . 0 0 "[ . 1 . 2]" 2
554 1 43 LYS HB3 1 43 LYS HG3 2.436 . 3.178 2.933 2.827 2.953 . 0 0 "[ . 1 . 2]" 2
555 1 43 LYS QD 1 43 LYS HG3 2.452 . 3.204 2.223 2.201 2.284 . 0 0 "[ . 1 . 2]" 2
556 1 43 LYS H 1 43 LYS HG2 2.584 . 3.419 3.064 2.944 3.122 . 0 0 "[ . 1 . 2]" 2
557 1 43 LYS HG2 1 48 PHE QE 3.042 . 4.199 4.292 4.282 4.302 0.103 20 0 "[ . 1 . 2]" 2
558 1 43 LYS HA 1 43 LYS HG2 2.378 . 3.085 2.524 2.493 2.563 . 0 0 "[ . 1 . 2]" 2
559 1 43 LYS HB2 1 43 LYS HG2 2.446 . 3.194 2.935 2.829 2.956 . 0 0 "[ . 1 . 2]" 2
560 1 43 LYS HB3 1 43 LYS HG2 2.421 . 3.154 2.650 2.609 2.791 . 0 0 "[ . 1 . 2]" 2
561 1 43 LYS QD 1 43 LYS HG2 2.568 . 2.780 2.449 2.336 2.477 . 0 0 "[ . 1 . 2]" 2
562 1 57 LEU HG 1 61 PHE HZ 2.885 . 3.926 2.706 2.553 4.253 0.327 17 0 "[ . 1 . 2]" 2
563 1 57 LEU HA 1 57 LEU HG 2.803 . 3.785 3.118 2.967 3.143 . 0 0 "[ . 1 . 2]" 2
564 1 57 LEU HB2 1 57 LEU HG 2.569 . 3.394 2.977 2.248 3.017 . 0 0 "[ . 1 . 2]" 2
565 1 36 GLN QB 1 37 PRO HD2 2.409 . 3.134 2.039 1.977 2.075 . 0 0 "[ . 1 . 2]" 2
566 1 98 PRO HB3 1 98 PRO HD3 2.659 . 3.542 2.916 2.849 2.988 . 0 0 "[ . 1 . 2]" 2
567 1 98 PRO HD3 1 98 PRO HG2 2.309 . 2.975 2.962 2.946 2.976 0.001 3 0 "[ . 1 . 2]" 2
568 1 98 PRO HD3 1 98 PRO HG3 2.398 . 3.117 2.281 2.266 2.296 . 0 0 "[ . 1 . 2]" 2
569 1 98 PRO HD2 1 99 TYR H 3.073 . 4.254 2.957 2.562 3.326 . 0 0 "[ . 1 . 2]" 2
570 1 98 PRO HB2 1 98 PRO HD2 2.859 . 3.881 4.007 3.981 4.029 0.148 3 0 "[ . 1 . 2]" 2
571 1 98 PRO HB3 1 98 PRO HD2 2.761 . 3.714 3.796 3.782 3.816 0.102 14 0 "[ . 1 . 2]" 2
572 1 98 PRO HD2 1 98 PRO HG2 2.337 . 3.019 2.285 2.274 2.298 . 0 0 "[ . 1 . 2]" 2
573 1 98 PRO HD2 1 98 PRO HG3 2.378 . 3.085 2.702 2.673 2.734 . 0 0 "[ . 1 . 2]" 2
574 1 81 LYS HB3 1 81 LYS HG2 1.972 . 2.458 2.213 2.210 2.215 . 0 0 "[ . 1 . 2]" 2
575 1 56 LEU MD1 1 75 MET H 2.606 . 3.455 3.493 3.468 3.527 0.072 11 0 "[ . 1 . 2]" 2
576 1 56 LEU MD1 1 74 VAL HA 2.920 . 3.986 3.234 3.133 3.286 . 0 0 "[ . 1 . 2]" 2
577 1 56 LEU HA 1 56 LEU MD1 2.286 . 2.939 2.945 2.858 2.970 0.031 11 0 "[ . 1 . 2]" 2
578 1 56 LEU MD1 1 59 ASP HB3 2.918 . 3.982 4.011 3.989 4.024 0.042 14 0 "[ . 1 . 2]" 2
579 1 56 LEU MD1 1 74 VAL HB 2.358 . 3.053 2.717 2.652 2.791 . 0 0 "[ . 1 . 2]" 2
580 1 67 LEU H 1 67 LEU MD1 2.725 . 3.654 3.633 3.606 3.657 0.003 6 0 "[ . 1 . 2]" 2
581 1 63 GLN HA 1 67 LEU MD1 3.034 . 4.185 3.953 3.796 4.103 . 0 0 "[ . 1 . 2]" 2
582 1 67 LEU MD1 1 70 GLN HB3 2.295 . 2.953 2.240 2.080 2.407 . 0 0 "[ . 1 . 2]" 2
583 1 67 LEU HB2 1 67 LEU MD1 2.045 . 2.568 2.342 2.313 2.362 . 0 0 "[ . 1 . 2]" 2
584 1 67 LEU HB3 1 67 LEU MD1 2.065 . 2.598 2.392 2.367 2.420 . 0 0 "[ . 1 . 2]" 2
585 1 64 VAL HA 1 67 LEU MD1 2.961 . 4.057 3.835 3.745 3.986 . 0 0 "[ . 1 . 2]" 2
586 1 67 LEU MD1 1 67 LEU HG 2.037 . 2.556 2.130 2.127 2.131 . 0 0 "[ . 1 . 2]" 2
587 1 35 TYR H 1 40 LEU QD 3.008 . 4.139 3.487 3.462 3.507 . 0 0 "[ . 1 . 2]" 2
588 1 40 LEU HA 1 40 LEU QD . . 2.265 1.685 1.655 1.744 0.081 12 0 "[ . 1 . 2]" 2
589 1 35 TYR HB3 1 40 LEU QD 2.497 . 3.270 1.897 1.876 1.921 . 0 0 "[ . 1 . 2]" 2
590 1 39 GLU HB3 1 40 LEU QD 3.016 . 3.884 2.848 2.806 2.877 . 0 0 "[ . 1 . 2]" 2
591 1 33 VAL HB 1 40 LEU QD 2.961 . 4.057 3.763 3.730 3.782 . 0 0 "[ . 1 . 2]" 2
592 1 39 GLU HB2 1 40 LEU QD 2.938 . 4.017 3.736 3.572 3.765 . 0 0 "[ . 1 . 2]" 2
593 1 35 TYR HB2 1 40 LEU QD 2.373 . 3.032 1.871 1.855 1.894 . 0 0 "[ . 1 . 2]" 2
594 1 40 LEU QD 1 40 LEU HG 2.121 . 2.444 1.886 1.884 1.887 . 0 0 "[ . 1 . 2]" 2
595 1 25 VAL MG1 1 40 LEU QD 1.983 . 2.475 1.816 1.752 1.902 . 0 0 "[ . 1 . 2]" 2
596 1 57 LEU QD 1 58 ARG H 2.951 . 4.040 3.681 3.544 3.712 . 0 0 "[ . 1 . 2]" 2
597 1 57 LEU QD 1 76 PHE QE 2.598 . 3.209 2.870 2.828 2.932 . 0 0 "[ . 1 . 2]" 2
598 1 57 LEU QD 1 61 PHE QE 2.667 . 3.072 2.692 2.245 2.740 . 0 0 "[ . 1 . 2]" 2
599 1 57 LEU QD 1 61 PHE HZ 2.548 . 3.084 2.206 1.836 2.266 . 0 0 "[ . 1 . 2]" 2
600 1 54 GLN HA 1 57 LEU QD 2.795 . 3.771 3.261 3.212 3.293 . 0 0 "[ . 1 . 2]" 2
601 1 49 CYS HB3 1 57 LEU QD 2.616 . 3.471 2.712 2.602 2.762 . 0 0 "[ . 1 . 2]" 2
602 1 57 LEU QD 1 76 PHE HB3 3.077 . 3.902 3.124 3.042 3.357 . 0 0 "[ . 1 . 2]" 2
603 1 49 CYS HB2 1 57 LEU QD 2.499 . 3.280 2.013 1.969 2.067 . 0 0 "[ . 1 . 2]" 2
604 1 54 GLN HG2 1 57 LEU QD 3.025 . 4.169 4.040 3.867 4.108 . 0 0 "[ . 1 . 2]" 2
605 1 57 LEU QD 1 58 ARG HG3 2.977 . 4.085 3.993 3.939 4.028 . 0 0 "[ . 1 . 2]" 2
606 1 45 ILE HG13 1 57 LEU QD 2.672 . 3.564 3.431 3.384 3.485 . 0 0 "[ . 1 . 2]" 2
607 1 57 LEU HB3 1 57 LEU QD 2.174 . 2.765 2.307 2.107 2.330 . 0 0 "[ . 1 . 2]" 2
608 1 57 LEU QD 1 90 THR MG 2.556 . 2.632 1.790 1.736 1.839 0.003 17 0 "[ . 1 . 2]" 2
609 1 45 ILE HG12 1 57 LEU QD 2.114 . 2.673 1.959 1.888 2.103 . 0 0 "[ . 1 . 2]" 2
610 1 46 VAL QG 1 57 LEU QD 2.153 . 2.732 1.996 1.886 2.202 . 0 0 "[ . 1 . 2]" 2
611 1 57 LEU QD 1 57 LEU HG 1.829 . 2.247 1.892 1.858 1.895 . 0 0 "[ . 1 . 2]" 2
612 1 30 VAL QG 1 37 PRO HD2 2.418 . 3.149 2.797 2.687 2.873 . 0 0 "[ . 1 . 2]" 2
613 1 37 PRO HD2 1 38 GLN H 2.926 . 3.996 3.051 3.006 3.102 . 0 0 "[ . 1 . 2]" 2
614 1 37 PRO HD2 1 37 PRO HG3 2.348 . 3.037 2.886 2.876 2.894 . 0 0 "[ . 1 . 2]" 2
615 1 36 GLN QB 1 37 PRO HD3 2.534 . 3.337 3.243 3.176 3.271 . 0 0 "[ . 1 . 2]" 2
616 1 37 PRO HD3 1 37 PRO HG3 2.356 . 3.050 2.232 2.226 2.233 . 0 0 "[ . 1 . 2]" 2
617 1 83 GLN H 1 83 GLN HB2 2.889 . 3.932 3.714 3.586 3.824 . 0 0 "[ . 1 . 2]" 2
618 1 83 GLN HA 1 83 GLN HB3 2.389 . 3.103 2.352 2.314 2.382 . 0 0 "[ . 1 . 2]" 2
619 1 83 GLN H 1 83 GLN HB3 2.890 . 3.934 3.958 3.896 3.990 0.056 7 0 "[ . 1 . 2]" 2
620 1 12 PHE QE 1 29 CYS HB3 3.035 . 4.186 3.259 3.201 3.320 . 0 0 "[ . 1 . 2]" 2
621 1 29 CYS H 1 29 CYS HB3 2.556 . 3.373 2.384 2.350 2.420 . 0 0 "[ . 1 . 2]" 2
622 1 63 GLN HA 1 66 LYS HG3 2.868 . 3.896 3.898 3.840 3.926 0.030 5 0 "[ . 1 . 2]" 2
623 1 66 LYS QE 1 66 LYS HG3 2.635 . 3.503 3.398 3.309 3.511 0.008 16 0 "[ . 1 . 2]" 2
624 1 66 LYS H 1 66 LYS HG3 2.497 . 3.276 2.912 2.851 3.059 . 0 0 "[ . 1 . 2]" 2
625 1 66 LYS HA 1 66 LYS HG3 2.437 . 3.180 2.708 2.660 2.748 . 0 0 "[ . 1 . 2]" 2
626 1 66 LYS HA 1 66 LYS HG2 2.317 . 2.988 2.503 2.465 2.561 . 0 0 "[ . 1 . 2]" 2
627 1 66 LYS QB 1 66 LYS HG2 2.193 . 2.794 2.319 2.298 2.332 . 0 0 "[ . 1 . 2]" 2
628 1 12 PHE QE 1 29 CYS HB2 3.046 . 4.206 3.587 3.523 3.667 . 0 0 "[ . 1 . 2]" 2
629 1 12 PHE QD 1 29 CYS HB2 2.820 . 3.814 3.786 3.696 3.833 0.019 13 0 "[ . 1 . 2]" 2
630 1 25 VAL MG1 1 29 CYS HB2 2.531 . 3.332 2.764 2.702 2.803 . 0 0 "[ . 1 . 2]" 2
631 1 29 CYS HB2 1 40 LEU QD 2.759 . 3.710 1.963 1.915 2.011 . 0 0 "[ . 1 . 2]" 2
632 1 35 TYR QD 1 81 LYS HG3 3.019 . 4.158 4.251 4.211 4.292 0.134 5 0 "[ . 1 . 2]" 2
633 1 81 LYS HB2 1 81 LYS HG3 2.439 . 3.182 2.810 2.799 2.849 . 0 0 "[ . 1 . 2]" 2
634 1 35 TYR QD 1 40 LEU QD 2.436 . 3.177 2.500 2.438 2.551 . 0 0 "[ . 1 . 2]" 2
635 1 29 CYS HA 1 40 LEU QD 3.016 . 4.153 3.843 3.787 3.890 . 0 0 "[ . 1 . 2]" 2
636 1 29 CYS HB3 1 40 LEU QD 2.444 . 3.191 2.903 2.845 2.970 . 0 0 "[ . 1 . 2]" 2
637 1 25 VAL HB 1 40 LEU QD 2.697 . 3.606 3.689 3.668 3.702 0.096 14 0 "[ . 1 . 2]" 2
638 1 33 VAL MG2 1 40 LEU QD 2.153 . 2.733 1.934 1.901 1.966 . 0 0 "[ . 1 . 2]" 2
639 1 68 LYS HE2 1 68 LYS QG 2.637 . 3.417 2.551 2.277 3.304 . 0 0 "[ . 1 . 2]" 2
640 1 56 LEU MD2 1 75 MET H 2.699 . 3.609 2.515 2.472 2.591 . 0 0 "[ . 1 . 2]" 2
641 1 53 ASP HA 1 56 LEU MD2 2.610 . 3.461 3.441 3.354 3.480 0.019 6 0 "[ . 1 . 2]" 2
642 1 56 LEU MD2 1 57 LEU HA 2.855 . 3.874 3.453 3.393 3.588 . 0 0 "[ . 1 . 2]" 2
643 1 72 LEU QD 1 73 SER H 2.411 . 3.138 2.908 2.821 3.034 . 0 0 "[ . 1 . 2]" 2
644 1 63 GLN H 1 72 LEU QD 2.687 . 3.590 3.486 3.460 3.504 . 0 0 "[ . 1 . 2]" 2
645 1 72 LEU HA 1 72 LEU QD 2.106 . 2.427 2.025 1.994 2.044 . 0 0 "[ . 1 . 2]" 2
646 1 60 SER HA 1 72 LEU QD 2.273 . 2.919 2.158 1.774 2.240 . 0 0 "[ . 1 . 2]" 2
647 1 60 SER QB 1 72 LEU QD 2.181 . 2.775 2.717 2.678 2.749 . 0 0 "[ . 1 . 2]" 2
648 1 63 GLN HG3 1 72 LEU QD 2.204 . 2.811 2.064 1.957 2.197 . 0 0 "[ . 1 . 2]" 2
649 1 72 LEU HB3 1 72 LEU QD 1.957 . 2.436 2.059 2.033 2.208 . 0 0 "[ . 1 . 2]" 2
650 1 63 GLN HB3 1 72 LEU QD 1.971 . 2.456 2.084 2.045 2.118 . 0 0 "[ . 1 . 2]" 2
651 1 87 TRP HE3 1 88 MET H 2.337 . 3.020 2.926 2.861 3.037 0.017 11 0 "[ . 1 . 2]" 2
652 1 75 MET HA 1 87 TRP HE3 3.091 . 4.285 3.767 3.730 3.836 . 0 0 "[ . 1 . 2]" 2
653 1 76 PHE HA 1 87 TRP HE3 3.058 . 4.227 3.904 3.852 4.066 . 0 0 "[ . 1 . 2]" 2
654 1 87 TRP HA 1 87 TRP HE3 2.426 . 3.162 3.047 2.994 3.110 . 0 0 "[ . 1 . 2]" 2
655 1 87 TRP HB3 1 87 TRP HE3 2.439 . 3.183 2.742 2.715 2.761 . 0 0 "[ . 1 . 2]" 2
656 1 75 MET HG2 1 87 TRP HE3 2.931 . 4.005 4.101 4.065 4.129 0.124 13 0 "[ . 1 . 2]" 2
657 1 75 MET HB3 1 87 TRP HE3 2.487 . 3.260 2.100 2.014 2.123 . 0 0 "[ . 1 . 2]" 2
658 1 75 MET HB2 1 87 TRP HE3 2.727 . 3.657 3.725 3.698 3.750 0.093 11 0 "[ . 1 . 2]" 2
659 1 75 MET ME 1 87 TRP HE3 2.748 . 3.692 1.901 1.771 1.978 0.033 5 0 "[ . 1 . 2]" 2
660 1 64 VAL MG1 1 92 SER H 3.000 . 4.125 3.963 3.911 4.036 . 0 0 "[ . 1 . 2]" 2
661 1 64 VAL MG1 1 72 LEU H 2.597 . 3.440 2.988 2.897 3.137 . 0 0 "[ . 1 . 2]" 2
662 1 64 VAL H 1 64 VAL MG1 2.021 . 2.531 1.780 1.699 1.824 . 0 0 "[ . 1 . 2]" 2
663 1 63 GLN H 1 64 VAL MG1 2.819 . 3.812 3.446 3.413 3.475 . 0 0 "[ . 1 . 2]" 2
664 1 61 PHE QD 1 64 VAL MG1 2.546 . 3.356 2.867 2.816 2.974 . 0 0 "[ . 1 . 2]" 2
665 1 64 VAL MG1 1 65 VAL H 2.391 . 3.106 3.087 2.986 3.122 0.016 5 0 "[ . 1 . 2]" 2
666 1 64 VAL MG1 1 92 SER HA 2.902 . 3.955 3.665 3.618 3.736 . 0 0 "[ . 1 . 2]" 2
667 1 61 PHE HA 1 64 VAL MG1 2.291 . 2.947 1.843 1.769 1.888 . 0 0 "[ . 1 . 2]" 2
668 1 60 SER HA 1 64 VAL MG1 2.795 . 3.772 3.658 3.609 3.758 . 0 0 "[ . 1 . 2]" 2
669 1 64 VAL MG1 1 92 SER HB3 2.158 . 2.740 2.643 2.576 2.746 0.006 8 0 "[ . 1 . 2]" 2
670 1 64 VAL MG1 1 92 SER HB2 2.210 . 2.821 1.811 1.761 1.881 . 0 0 "[ . 1 . 2]" 2
671 1 61 PHE QB 1 64 VAL MG1 2.721 . 3.647 3.702 3.659 3.724 0.077 18 0 "[ . 1 . 2]" 2
672 1 64 VAL HB 1 64 VAL MG1 1.934 . 2.402 2.108 2.091 2.116 . 0 0 "[ . 1 . 2]" 2
673 1 64 VAL MG1 1 72 LEU HB2 2.302 . 2.965 2.106 2.054 2.237 . 0 0 "[ . 1 . 2]" 2
674 1 64 VAL MG1 1 103 ILE MG 2.145 . 2.720 2.587 2.480 2.628 . 0 0 "[ . 1 . 2]" 2
675 1 38 GLN H 1 41 LEU MD1 3.048 . 4.209 3.234 3.140 3.299 . 0 0 "[ . 1 . 2]" 2
676 1 38 GLN HA 1 41 LEU MD1 2.217 . 2.831 2.050 1.900 2.186 . 0 0 "[ . 1 . 2]" 2
677 1 37 PRO HB2 1 41 LEU MD1 2.618 . 3.474 2.533 2.466 2.573 . 0 0 "[ . 1 . 2]" 2
678 1 25 VAL MG2 1 41 LEU MD1 2.278 . 2.927 2.996 2.963 3.027 0.100 19 0 "[ . 1 . 2]" 2
679 1 25 VAL H 1 41 LEU MD1 2.655 . 3.536 3.060 2.947 3.157 . 0 0 "[ . 1 . 2]" 2
680 1 85 TRP HB2 1 85 TRP HE3 2.918 . 3.983 4.128 4.116 4.133 0.150 4 0 "[ . 1 . 2]" 2
681 1 85 TRP HB3 1 85 TRP HE3 2.616 . 3.471 3.031 2.995 3.060 . 0 0 "[ . 1 . 2]" 2
682 1 50 HIS HB2 1 85 TRP HE3 2.818 . 3.811 3.444 3.291 3.552 . 0 0 "[ . 1 . 2]" 2
683 1 77 ARG HB3 1 85 TRP HE3 2.448 . 3.197 2.219 2.090 2.409 . 0 0 "[ . 1 . 2]" 2
684 1 90 THR H 1 90 THR MG 2.181 . 2.775 2.205 2.150 2.268 . 0 0 "[ . 1 . 2]" 2
685 1 76 PHE HD1 1 90 THR MG 2.219 . 2.835 2.133 2.101 2.196 . 0 0 "[ . 1 . 2]" 2
686 1 76 PHE HE1 1 90 THR MG 2.018 . 2.527 1.676 1.647 1.760 . 0 0 "[ . 1 . 2]" 2
687 1 90 THR HA 1 90 THR MG 2.099 . 2.650 2.507 2.484 2.534 . 0 0 "[ . 1 . 2]" 2
688 1 90 THR MG 1 107 ILE HA 2.674 . 3.568 3.264 3.223 3.377 . 0 0 "[ . 1 . 2]" 2
689 1 72 LEU H 1 72 LEU QD 2.531 . 3.332 2.670 2.598 2.782 . 0 0 "[ . 1 . 2]" 2
690 1 64 VAL H 1 72 LEU QD 2.479 . 3.247 2.753 2.694 2.799 . 0 0 "[ . 1 . 2]" 2
691 1 64 VAL HA 1 72 LEU QD 2.157 . 2.738 2.483 2.423 2.518 . 0 0 "[ . 1 . 2]" 2
692 1 70 GLN QG 1 72 LEU QD 2.460 . 3.217 2.867 2.653 3.084 . 0 0 "[ . 1 . 2]" 2
693 1 72 LEU HB2 1 72 LEU QD 1.990 . 2.485 2.425 2.412 2.439 . 0 0 "[ . 1 . 2]" 2
694 1 57 LEU QD 1 76 PHE QD 2.293 . 2.950 2.624 2.573 2.800 . 0 0 "[ . 1 . 2]" 2
695 1 57 LEU QD 1 60 SER QB 2.753 . 3.701 3.292 3.051 3.538 . 0 0 "[ . 1 . 2]" 2
696 1 57 LEU HA 1 57 LEU QD 1.988 . 2.482 1.863 1.801 1.928 . 0 0 "[ . 1 . 2]" 2
697 1 57 LEU QD 1 74 VAL HB 2.911 . 3.970 3.991 3.943 4.012 0.042 12 0 "[ . 1 . 2]" 2
698 1 85 TRP HE3 1 86 LEU H 2.742 . 3.681 3.495 3.393 3.597 . 0 0 "[ . 1 . 2]" 2
699 1 27 HIS HB3 1 27 HIS HD2 2.538 . 3.343 3.181 2.955 3.975 0.632 16 1 "[ . 1 .+ 2]" 2
700 1 27 HIS HD2 1 28 ARG QG 3.100 . 4.302 3.750 2.660 4.204 . 0 0 "[ . 1 . 2]" 2
701 1 98 PRO HA 1 98 PRO HG2 2.980 . 4.090 3.801 3.788 3.824 . 0 0 "[ . 1 . 2]" 2
702 1 98 PRO HB3 1 98 PRO HG2 2.369 . 3.070 2.993 2.986 2.999 . 0 0 "[ . 1 . 2]" 2
703 1 94 THR H 1 94 THR MG 2.123 . 2.686 1.665 1.601 1.762 0.099 11 0 "[ . 1 . 2]" 2
704 1 68 LYS HB3 1 94 THR MG 2.724 . 3.652 3.434 3.083 3.589 . 0 0 "[ . 1 . 2]" 2
705 1 68 LYS QD 1 94 THR MG 2.471 . 3.234 2.763 1.733 3.246 0.012 8 0 "[ . 1 . 2]" 2
706 1 65 VAL H 1 94 THR MG 3.086 . 4.277 4.193 4.076 4.273 . 0 0 "[ . 1 . 2]" 2
707 1 94 THR HB 1 94 THR MG 1.861 . 2.294 2.135 2.128 2.138 . 0 0 "[ . 1 . 2]" 2
708 1 68 LYS HA 1 94 THR MG 2.246 . 2.877 1.816 1.708 1.882 . 0 0 "[ . 1 . 2]" 2
709 1 94 THR HA 1 94 THR MG 1.974 . 2.461 2.453 2.406 2.484 0.023 11 0 "[ . 1 . 2]" 2
710 1 65 VAL HA 1 94 THR MG 1.989 . 2.483 2.490 2.400 2.553 0.070 4 0 "[ . 1 . 2]" 2
711 1 68 LYS QE 1 94 THR MG 2.934 . 4.010 2.144 1.834 2.422 0.024 19 0 "[ . 1 . 2]" 2
712 1 64 VAL HB 1 94 THR MG 2.929 . 4.001 3.645 3.532 3.746 . 0 0 "[ . 1 . 2]" 2
713 1 64 VAL MG2 1 94 THR MG 1.945 . 2.418 2.113 1.907 2.235 . 0 0 "[ . 1 . 2]" 2
714 1 94 THR MG 1 103 ILE HG12 2.607 . 3.456 3.290 3.077 3.404 . 0 0 "[ . 1 . 2]" 2
715 1 14 SER H 1 105 THR MG 3.040 . 4.195 4.134 4.033 4.219 0.024 2 0 "[ . 1 . 2]" 2
716 1 22 PHE QE 1 105 THR MG 3.093 . 4.289 3.853 3.638 3.929 . 0 0 "[ . 1 . 2]" 2
717 1 41 LEU MD2 1 42 GLY H 2.448 . 3.197 3.211 3.128 3.233 0.036 4 0 "[ . 1 . 2]" 2
718 1 24 PHE H 1 41 LEU MD2 2.649 . 3.526 2.818 2.757 2.859 . 0 0 "[ . 1 . 2]" 2
719 1 41 LEU H 1 41 LEU MD1 2.536 . 3.340 3.124 3.066 3.187 . 0 0 "[ . 1 . 2]" 2
720 1 24 PHE HA 1 41 LEU MD2 2.098 . 2.648 1.655 1.636 1.675 . 0 0 "[ . 1 . 2]" 2
721 1 41 LEU HA 1 41 LEU MD2 2.046 . 2.569 2.475 2.427 2.512 . 0 0 "[ . 1 . 2]" 2
722 1 24 PHE HB3 1 41 LEU MD2 2.985 . 4.099 4.202 4.191 4.210 0.111 17 0 "[ . 1 . 2]" 2
723 1 22 PHE HB3 1 41 LEU MD2 2.463 . 3.221 3.207 3.136 3.234 0.013 7 0 "[ . 1 . 2]" 2
724 1 77 ARG H 1 77 ARG HG3 3.054 . 4.220 2.791 2.408 3.109 . 0 0 "[ . 1 . 2]" 2
725 1 77 ARG HE 1 77 ARG HG3 2.887 . 3.929 3.588 2.912 3.825 . 0 0 "[ . 1 . 2]" 2
726 1 77 ARG HG3 1 85 TRP HB3 3.028 . 4.174 3.817 3.511 4.228 0.054 14 0 "[ . 1 . 2]" 2
727 1 77 ARG HB3 1 77 ARG HG3 2.846 . 3.858 2.962 2.931 2.998 . 0 0 "[ . 1 . 2]" 2
728 1 77 ARG HE 1 77 ARG HG2 2.814 . 3.804 2.891 2.610 3.685 . 0 0 "[ . 1 . 2]" 2
729 1 77 ARG HB3 1 77 ARG HG2 2.965 . 4.064 2.281 2.241 2.348 . 0 0 "[ . 1 . 2]" 2
730 1 16 HIS HE2 1 105 THR MG 2.346 . 3.034 2.813 2.743 2.890 . 0 0 "[ . 1 . 2]" 2
731 1 105 THR MG 1 106 ILE H 2.403 . 3.125 3.031 2.843 3.132 0.007 15 0 "[ . 1 . 2]" 2
732 1 105 THR H 1 105 THR MG 2.714 . 3.634 3.737 3.722 3.745 0.111 5 0 "[ . 1 . 2]" 2
733 1 105 THR MG 1 107 ILE H 2.974 . 4.079 3.348 3.259 3.482 . 0 0 "[ . 1 . 2]" 2
734 1 91 SER H 1 105 THR MG 2.355 . 3.048 2.879 2.731 2.931 . 0 0 "[ . 1 . 2]" 2
735 1 61 PHE QE 1 105 THR MG 2.193 . 2.794 2.502 2.340 2.610 . 0 0 "[ . 1 . 2]" 2
736 1 16 HIS HD2 1 105 THR MG 2.637 . 3.506 3.578 3.554 3.589 0.083 5 0 "[ . 1 . 2]" 2
737 1 92 SER HA 1 105 THR MG 2.664 . 3.551 3.377 3.299 3.516 . 0 0 "[ . 1 . 2]" 2
738 1 90 THR HA 1 105 THR MG 2.411 . 3.138 3.013 2.912 3.053 . 0 0 "[ . 1 . 2]" 2
739 1 105 THR HA 1 105 THR MG 2.180 . 2.774 2.580 2.547 2.612 . 0 0 "[ . 1 . 2]" 2
740 1 90 THR HB 1 105 THR MG 2.048 . 2.573 1.665 1.619 1.781 . 0 0 "[ . 1 . 2]" 2
741 1 105 THR MG 1 107 ILE HA 2.623 . 3.483 3.589 3.569 3.611 0.128 19 0 "[ . 1 . 2]" 2
742 1 105 THR HB 1 105 THR MG 2.005 . 2.508 2.126 2.086 2.133 . 0 0 "[ . 1 . 2]" 2
743 1 92 SER HB3 1 105 THR MG 2.667 . 3.556 3.653 3.639 3.676 0.120 7 0 "[ . 1 . 2]" 2
744 1 105 THR MG 1 107 ILE HG12 2.162 . 2.746 2.776 2.748 2.802 0.056 17 0 "[ . 1 . 2]" 2
745 1 105 THR MG 1 107 ILE HG13 2.057 . 2.586 2.200 2.152 2.315 . 0 0 "[ . 1 . 2]" 2
746 1 57 LEU QD 1 105 THR MG 2.843 . 3.853 3.030 2.964 3.107 . 0 0 "[ . 1 . 2]" 2
747 1 84 GLU H 1 86 LEU QD 3.005 . 4.134 3.921 3.836 3.979 . 0 0 "[ . 1 . 2]" 2
748 1 85 TRP HA 1 86 LEU QD 3.091 . 4.285 4.205 4.161 4.229 . 0 0 "[ . 1 . 2]" 2
749 1 25 VAL MG1 1 29 CYS H 2.736 . 3.672 3.681 3.652 3.712 0.040 11 0 "[ . 1 . 2]" 2
750 1 25 VAL MG1 1 26 ASP H 2.322 . 2.996 2.692 2.637 2.721 . 0 0 "[ . 1 . 2]" 2
751 1 22 PHE QD 1 25 VAL MG1 2.764 . 3.719 3.818 3.784 3.848 0.129 8 0 "[ . 1 . 2]" 2
752 1 12 PHE QD 1 25 VAL MG1 2.183 . 2.779 2.408 2.323 2.483 . 0 0 "[ . 1 . 2]" 2
753 1 12 PHE QE 1 25 VAL MG1 2.177 . 2.770 2.013 1.960 2.057 . 0 0 "[ . 1 . 2]" 2
754 1 14 SER HA 1 25 VAL MG1 2.678 . 3.574 3.233 3.085 3.298 . 0 0 "[ . 1 . 2]" 2
755 1 14 SER QB 1 25 VAL MG1 2.610 . 3.297 2.292 2.047 2.353 . 0 0 "[ . 1 . 2]" 2
756 1 25 VAL HA 1 25 VAL MG1 2.173 . 2.764 2.146 2.097 2.171 . 0 0 "[ . 1 . 2]" 2
757 1 25 VAL MG1 1 37 PRO HA 2.204 . 2.811 2.366 2.317 2.396 . 0 0 "[ . 1 . 2]" 2
758 1 25 VAL MG1 1 37 PRO HB3 2.452 . 3.203 3.324 3.302 3.350 0.147 4 0 "[ . 1 . 2]" 2
759 1 25 VAL MG1 1 29 CYS HB3 2.421 . 3.154 2.135 2.096 2.186 . 0 0 "[ . 1 . 2]" 2
760 1 25 VAL HB 1 25 VAL MG1 2.027 . 2.540 2.095 2.075 2.104 . 0 0 "[ . 1 . 2]" 2
761 1 25 VAL MG1 1 25 VAL MG2 1.849 . 2.276 2.062 2.040 2.077 . 0 0 "[ . 1 . 2]" 2
762 1 64 VAL MG2 1 94 THR H 2.280 . 2.930 2.167 2.021 2.338 . 0 0 "[ . 1 . 2]" 2
763 1 61 PHE HA 1 64 VAL MG2 2.631 . 3.496 2.938 2.838 3.074 . 0 0 "[ . 1 . 2]" 2
764 1 64 VAL MG2 1 65 VAL H 2.378 . 3.085 2.305 2.252 2.419 . 0 0 "[ . 1 . 2]" 2
765 1 64 VAL HB 1 64 VAL MG2 1.922 . 2.384 2.125 2.122 2.128 . 0 0 "[ . 1 . 2]" 2
766 1 64 VAL MG2 1 65 VAL HB 2.591 . 3.430 2.713 2.655 2.791 . 0 0 "[ . 1 . 2]" 2
767 1 3 MET ME 1 30 VAL QG 2.420 . 3.152 2.524 1.737 3.121 . 0 0 "[ . 1 . 2]" 2
768 1 30 VAL QG 1 36 GLN H 2.943 . 4.026 3.863 3.821 3.894 . 0 0 "[ . 1 . 2]" 2
769 1 29 CYS H 1 30 VAL QG 2.830 . 3.831 3.719 3.673 3.742 . 0 0 "[ . 1 . 2]" 2
770 1 5 ASN HD21 1 30 VAL QG 2.419 . 3.150 1.976 1.576 3.079 0.112 3 0 "[ . 1 . 2]" 2
771 1 30 VAL H 1 30 VAL QG 1.868 . 2.304 1.799 1.783 1.814 . 0 0 "[ . 1 . 2]" 2
772 1 30 VAL QG 1 37 PRO HD3 1.779 . 2.174 1.951 1.875 2.026 . 0 0 "[ . 1 . 2]" 2
773 1 27 HIS HB2 1 30 VAL QG 2.653 . 3.533 3.353 2.971 3.420 . 0 0 "[ . 1 . 2]" 2
774 1 64 VAL MG2 1 68 LYS QE 2.938 . 4.017 4.071 3.991 4.172 0.155 19 0 "[ . 1 . 2]" 2
775 1 30 VAL HB 1 30 VAL QG 1.810 . 2.075 1.884 1.881 1.887 . 0 0 "[ . 1 . 2]" 2
776 1 86 LEU H 1 86 LEU QD 2.606 . 3.455 2.921 2.852 2.987 . 0 0 "[ . 1 . 2]" 2
777 1 84 GLU HB2 1 86 LEU QD 2.112 . 2.670 2.459 2.164 2.656 . 0 0 "[ . 1 . 2]" 2
778 1 67 LEU H 1 67 LEU MD2 2.447 . 3.196 3.202 3.160 3.225 0.029 20 0 "[ . 1 . 2]" 2
779 1 67 LEU HA 1 67 LEU MD2 1.758 . 2.144 2.114 2.071 2.155 0.011 4 0 "[ . 1 . 2]" 2
780 1 66 LYS QE 1 67 LEU MD2 3.003 . 4.130 3.359 3.265 3.492 . 0 0 "[ . 1 . 2]" 2
781 1 67 LEU MD2 1 67 LEU HG 1.810 . 2.219 2.124 2.122 2.125 . 0 0 "[ . 1 . 2]" 2
782 1 67 LEU HB3 1 67 LEU MD2 1.938 . 2.407 2.372 2.354 2.382 . 0 0 "[ . 1 . 2]" 2
783 1 22 PHE QD 1 40 LEU QD 2.622 . 3.481 3.024 2.974 3.058 . 0 0 "[ . 1 . 2]" 2
784 1 40 LEU QD 1 78 PHE QE 2.173 . 2.763 2.779 2.741 2.807 0.044 12 0 "[ . 1 . 2]" 2
785 1 35 TYR HA 1 40 LEU QD 3.047 . 4.207 3.614 3.597 3.633 . 0 0 "[ . 1 . 2]" 2
786 1 40 LEU QD 1 43 LYS HB2 2.553 . 3.368 3.176 3.137 3.332 . 0 0 "[ . 1 . 2]" 2
787 1 40 LEU QD 1 43 LYS QD 2.965 . 4.064 3.102 2.880 3.773 . 0 0 "[ . 1 . 2]" 2
788 1 40 LEU QD 1 43 LYS HG3 2.766 . 3.722 3.763 3.730 3.777 0.055 9 0 "[ . 1 . 2]" 2
789 1 40 LEU HB2 1 40 LEU QD 2.222 . 2.839 2.016 2.000 2.037 . 0 0 "[ . 1 . 2]" 2
790 1 40 LEU MD1 1 40 LEU MD2 1.816 . 2.228 2.073 2.066 2.082 . 0 0 "[ . 1 . 2]" 2
791 1 34 GLY H 1 34 GLY HA3 2.276 . 2.924 2.886 2.879 2.895 . 0 0 "[ . 1 . 2]" 2
792 1 34 GLY HA3 1 35 TYR H 2.763 . 3.718 2.923 2.904 2.962 . 0 0 "[ . 1 . 2]" 2
793 1 30 VAL HA 1 34 GLY HA3 2.947 . 4.032 4.065 4.049 4.092 0.060 18 0 "[ . 1 . 2]" 2
794 1 34 GLY HA3 1 81 LYS HB3 2.536 . 3.340 2.122 2.088 2.202 . 0 0 "[ . 1 . 2]" 2
795 1 34 GLY H 1 34 GLY HA2 2.193 . 2.794 2.342 2.336 2.350 . 0 0 "[ . 1 . 2]" 2
796 1 34 GLY HA2 1 81 LYS HB2 2.899 . 3.950 3.808 3.700 3.899 . 0 0 "[ . 1 . 2]" 2
797 1 35 TYR QE 1 81 LYS H 2.625 . 3.487 3.409 3.342 3.516 0.029 5 0 "[ . 1 . 2]" 2
798 1 35 TYR QE 1 78 PHE QE 2.783 . 3.751 2.356 2.280 2.445 . 0 0 "[ . 1 . 2]" 2
799 1 35 TYR QE 1 80 SER HA 2.074 . 2.612 1.963 1.875 2.112 . 0 0 "[ . 1 . 2]" 2
800 1 35 TYR QE 1 81 LYS QE 2.823 . 3.820 3.608 3.554 3.824 0.004 12 0 "[ . 1 . 2]" 2
801 1 35 TYR QE 1 39 GLU QG 2.823 . 3.820 3.786 3.779 3.802 . 0 0 "[ . 1 . 2]" 2
802 1 35 TYR QE 1 81 LYS HD2 2.589 . 3.427 2.508 2.448 2.655 . 0 0 "[ . 1 . 2]" 2
803 1 35 TYR QE 1 81 LYS HG3 2.616 . 3.472 3.344 3.270 3.475 0.003 12 0 "[ . 1 . 2]" 2
804 1 35 TYR QE 1 81 LYS HB2 2.753 . 3.700 3.665 3.627 3.785 0.085 12 0 "[ . 1 . 2]" 2
805 1 98 PRO HD3 1 99 TYR QE 2.798 . 3.776 3.907 3.830 3.966 0.190 14 0 "[ . 1 . 2]" 2
806 1 98 PRO HD2 1 99 TYR QE 2.587 . 3.424 2.561 2.225 2.852 . 0 0 "[ . 1 . 2]" 2
807 1 98 PRO HG2 1 99 TYR QE 2.809 . 3.795 2.739 2.489 3.072 . 0 0 "[ . 1 . 2]" 2
808 1 98 PRO HG3 1 99 TYR QE 2.695 . 3.603 3.642 3.396 3.813 0.210 3 0 "[ . 1 . 2]" 2
809 1 16 HIS HE2 1 105 THR HB 2.326 . 3.002 2.309 2.239 2.342 . 0 0 "[ . 1 . 2]" 2
810 1 105 THR H 1 105 THR HB 2.503 . 3.286 2.449 2.424 2.468 . 0 0 "[ . 1 . 2]" 2
811 1 61 PHE QE 1 105 THR HB 2.631 . 3.496 3.551 3.539 3.564 0.068 1 0 "[ . 1 . 2]" 2
812 1 105 THR HA 1 105 THR HB 2.781 . 3.748 3.006 3.002 3.009 . 0 0 "[ . 1 . 2]" 2
813 1 14 SER H 1 14 SER QB 2.762 . 3.245 2.549 2.463 3.020 . 0 0 "[ . 1 . 2]" 2
814 1 14 SER QB 1 25 VAL MG2 2.962 . 4.059 3.379 2.988 3.454 . 0 0 "[ . 1 . 2]" 2
815 1 12 PHE QD 1 14 SER QB 2.892 . 3.937 2.514 2.419 2.915 . 0 0 "[ . 1 . 2]" 2
816 1 109 THR H 1 109 THR MG 2.150 . 2.728 2.203 2.130 2.288 . 0 0 "[ . 1 . 2]" 2
817 1 109 THR HA 1 109 THR MG 2.058 . 2.587 2.329 2.297 2.377 . 0 0 "[ . 1 . 2]" 2
818 1 32 THR HA 1 109 THR MG 2.631 . 3.496 2.819 2.760 2.878 . 0 0 "[ . 1 . 2]" 2
819 1 107 ILE MG 1 109 THR MG 2.999 . 4.123 3.894 3.833 3.961 . 0 0 "[ . 1 . 2]" 2
820 1 33 VAL MG1 1 109 THR MG 2.818 . 3.811 3.718 3.676 3.782 . 0 0 "[ . 1 . 2]" 2
821 1 88 MET HG2 1 109 THR MG 3.085 . 4.275 4.010 3.938 4.146 . 0 0 "[ . 1 . 2]" 2
822 1 33 VAL H 1 33 VAL MG1 2.433 . 3.173 2.754 2.715 2.795 . 0 0 "[ . 1 . 2]" 2
823 1 33 VAL MG1 1 78 PHE QD 2.292 . 2.949 2.597 2.562 2.623 . 0 0 "[ . 1 . 2]" 2
824 1 12 PHE QD 1 33 VAL MG1 2.747 . 3.690 3.580 3.484 3.676 . 0 0 "[ . 1 . 2]" 2
825 1 12 PHE QE 1 33 VAL MG1 2.190 . 2.790 2.190 2.114 2.279 . 0 0 "[ . 1 . 2]" 2
826 1 33 VAL MG1 1 80 SER HA 2.858 . 3.879 3.610 3.430 3.689 . 0 0 "[ . 1 . 2]" 2
827 1 33 VAL HA 1 33 VAL MG1 1.934 . 2.402 2.345 2.329 2.357 . 0 0 "[ . 1 . 2]" 2
828 1 33 VAL MG1 1 80 SER QB 2.989 . 4.106 3.272 2.636 3.480 . 0 0 "[ . 1 . 2]" 2
829 1 32 THR HB 1 33 VAL MG1 2.556 . 3.373 2.818 2.765 2.846 . 0 0 "[ . 1 . 2]" 2
830 1 33 VAL MG1 1 78 PHE HB3 2.847 . 3.860 2.697 2.582 2.764 . 0 0 "[ . 1 . 2]" 2
831 1 29 CYS HA 1 33 VAL MG1 3.042 . 4.199 4.028 3.946 4.136 . 0 0 "[ . 1 . 2]" 2
832 1 33 VAL MG1 1 78 PHE HB2 2.748 . 3.692 3.653 3.562 3.709 0.017 2 0 "[ . 1 . 2]" 2
833 1 33 VAL HB 1 33 VAL MG1 1.951 . 2.427 2.124 2.122 2.127 . 0 0 "[ . 1 . 2]" 2
834 1 33 VAL MG1 1 88 MET HG3 2.935 . 4.012 3.541 3.482 3.603 . 0 0 "[ . 1 . 2]" 2
835 1 33 VAL MG1 1 86 LEU HB2 2.893 . 3.939 3.147 3.094 3.197 . 0 0 "[ . 1 . 2]" 2
836 1 33 VAL MG1 1 86 LEU QD 2.193 . 2.794 2.433 2.292 2.508 . 0 0 "[ . 1 . 2]" 2
837 1 33 VAL MG1 1 33 VAL MG2 1.867 . 2.303 2.069 2.054 2.078 . 0 0 "[ . 1 . 2]" 2
838 1 34 GLY HA3 1 81 LYS HB2 2.735 . 3.670 2.272 2.145 2.376 . 0 0 "[ . 1 . 2]" 2
839 1 34 GLY HA3 1 81 LYS H 3.029 . 4.176 3.054 2.962 3.138 . 0 0 "[ . 1 . 2]" 2
840 1 34 GLY HA2 1 35 TYR H 2.752 . 3.699 3.478 3.471 3.485 . 0 0 "[ . 1 . 2]" 2
841 1 34 GLY HA2 1 81 LYS HB3 2.688 . 3.591 3.699 3.672 3.734 0.143 8 0 "[ . 1 . 2]" 2
842 1 109 THR HB 1 109 THR MG 1.852 . 2.281 2.128 2.119 2.133 . 0 0 "[ . 1 . 2]" 2
843 1 10 THR H 1 10 THR MG 2.551 . 3.365 2.724 2.642 2.773 . 0 0 "[ . 1 . 2]" 2
844 1 10 THR MG 1 11 GLU HG2 2.680 . 3.578 1.950 1.837 2.131 . 0 0 "[ . 1 . 2]" 2
845 1 10 THR MG 1 11 GLU H 2.492 . 3.268 1.880 1.793 1.948 . 0 0 "[ . 1 . 2]" 2
846 1 32 THR H 1 32 THR MG 3.043 . 4.201 3.734 3.716 3.740 . 0 0 "[ . 1 . 2]" 2
847 1 10 THR HB 1 10 THR MG 1.657 . 2.000 2.121 2.114 2.123 0.123 3 0 "[ . 1 . 2]" 2
848 1 23 THR H 1 23 THR MG 2.375 . 3.080 2.320 2.269 2.394 . 0 0 "[ . 1 . 2]" 2
849 1 17 ASN H 1 23 THR MG 2.484 . 3.255 2.661 2.581 2.811 . 0 0 "[ . 1 . 2]" 2
850 1 17 ASN HB3 1 23 THR MG 2.592 . 3.432 3.078 2.887 3.481 0.049 19 0 "[ . 1 . 2]" 2
851 1 29 CYS HA 1 32 THR MG 2.716 . 3.638 3.570 3.515 3.631 . 0 0 "[ . 1 . 2]" 2
852 1 32 THR MG 1 33 VAL MG2 2.579 . 3.410 3.483 3.428 3.547 0.137 13 0 "[ . 1 . 2]" 2
853 1 12 PHE QD 1 32 THR MG 2.079 . 2.619 1.912 1.691 2.090 . 0 0 "[ . 1 . 2]" 2
854 1 12 PHE QE 1 32 THR MG 2.267 . 2.910 2.458 2.356 2.818 . 0 0 "[ . 1 . 2]" 2
855 1 32 THR MG 1 109 THR HA 2.930 . 4.003 3.878 3.809 3.959 . 0 0 "[ . 1 . 2]" 2
856 1 32 THR HA 1 32 THR MG 1.825 . 2.241 2.288 2.252 2.313 0.072 7 0 "[ . 1 . 2]" 2
857 1 32 THR HB 1 32 THR MG 1.953 . 2.430 2.088 2.080 2.119 . 0 0 "[ . 1 . 2]" 2
858 1 12 PHE HB3 1 32 THR MG 3.007 . 4.138 3.605 3.353 3.737 . 0 0 "[ . 1 . 2]" 2
859 1 9 PRO HB2 1 32 THR MG 2.850 . 3.865 2.924 2.780 3.760 . 0 0 "[ . 1 . 2]" 2
860 1 32 THR MG 1 33 VAL MG1 2.051 . 2.577 2.261 2.079 2.357 . 0 0 "[ . 1 . 2]" 2
861 1 46 VAL QG 1 58 ARG H 2.802 . 3.783 3.248 3.046 3.352 . 0 0 "[ . 1 . 2]" 2
862 1 20 GLY HA3 1 46 VAL QG 2.747 . 3.690 2.817 2.728 2.942 . 0 0 "[ . 1 . 2]" 2
863 1 46 VAL H 1 46 VAL QG 1.888 . 2.333 1.683 1.521 1.843 0.090 16 0 "[ . 1 . 2]" 2
864 1 45 ILE H 1 46 VAL QG 2.842 . 3.851 3.688 3.612 3.757 . 0 0 "[ . 1 . 2]" 2
865 1 46 VAL QG 1 47 GLU H 2.476 . 3.242 2.410 2.367 2.530 . 0 0 "[ . 1 . 2]" 2
866 1 46 VAL QG 1 61 PHE QE 2.320 . 2.993 2.261 2.072 2.366 . 0 0 "[ . 1 . 2]" 2
867 1 46 VAL QG 1 61 PHE HZ 2.946 . 4.031 3.925 3.784 3.998 . 0 0 "[ . 1 . 2]" 2
868 1 46 VAL QG 1 58 ARG HG2 2.370 . 3.072 1.975 1.790 2.170 . 0 0 "[ . 1 . 2]" 2
869 1 109 THR HB 1 110 ASN H 2.536 . 3.340 2.990 2.894 3.179 . 0 0 "[ . 1 . 2]" 2
870 1 88 MET ME 1 109 THR HB 2.764 . 3.719 3.630 3.486 3.754 0.035 11 0 "[ . 1 . 2]" 2
871 1 87 TRP HB2 1 111 THR MG 2.792 . 3.767 2.704 1.802 3.710 0.015 18 0 "[ . 1 . 2]" 2
872 1 110 ASN HB3 1 111 THR MG 2.922 . 3.990 3.410 2.341 4.105 0.115 17 0 "[ . 1 . 2]" 2
873 1 10 THR MG 1 11 GLU HG3 2.728 . 3.658 3.002 2.944 3.068 . 0 0 "[ . 1 . 2]" 2
874 1 71 VAL QG 1 93 GLN H 2.734 . 3.669 3.714 3.687 3.767 0.098 1 0 "[ . 1 . 2]" 2
875 1 71 VAL QG 1 92 SER H 2.426 . 3.162 3.213 3.196 3.231 0.069 16 0 "[ . 1 . 2]" 2
876 1 71 VAL HA 1 71 VAL QG 1.856 . 2.286 2.175 2.087 2.233 . 0 0 "[ . 1 . 2]" 2
877 1 71 VAL QG 1 91 SER HB3 2.290 . 2.945 2.850 2.745 2.945 0.000 16 0 "[ . 1 . 2]" 2
878 1 46 VAL QG 1 54 GLN HE21 2.550 . 3.363 2.948 1.644 3.133 0.093 11 0 "[ . 1 . 2]" 2
879 1 46 VAL QG 1 54 GLN HE22 2.439 . 3.182 3.132 2.761 3.188 0.006 9 0 "[ . 1 . 2]" 2
880 1 46 VAL QG 1 54 GLN HG2 2.236 . 2.861 2.580 2.515 2.616 . 0 0 "[ . 1 . 2]" 2
881 1 46 VAL QG 1 54 GLN HB2 2.311 . 2.979 3.060 3.044 3.085 0.106 3 0 "[ . 1 . 2]" 2
882 1 46 VAL QG 1 54 GLN HB3 2.129 . 2.695 1.841 1.760 1.920 . 0 0 "[ . 1 . 2]" 2
883 1 42 GLY HA3 1 43 LYS H 2.672 . 3.565 3.211 3.182 3.247 . 0 0 "[ . 1 . 2]" 2
884 1 42 GLY H 1 42 GLY HA3 2.223 . 2.841 2.885 2.874 2.891 0.050 10 0 "[ . 1 . 2]" 2
885 1 42 GLY H 1 42 GLY HA2 2.204 . 2.811 2.324 2.314 2.330 . 0 0 "[ . 1 . 2]" 2
886 1 42 GLY HA2 1 43 LYS H 2.673 . 3.566 3.313 3.284 3.341 . 0 0 "[ . 1 . 2]" 2
887 1 32 THR HB 1 33 VAL H 2.373 . 3.077 2.068 2.028 2.086 . 0 0 "[ . 1 . 2]" 2
888 1 32 THR HB 1 34 GLY H 2.923 . 3.991 4.113 4.094 4.129 0.138 20 0 "[ . 1 . 2]" 2
889 1 32 THR H 1 32 THR HB 2.321 . 2.994 2.568 2.530 2.601 . 0 0 "[ . 1 . 2]" 2
890 1 12 PHE QD 1 32 THR HB 2.314 . 2.983 2.463 2.414 2.507 . 0 0 "[ . 1 . 2]" 2
891 1 12 PHE QE 1 32 THR HB 2.621 . 3.480 3.340 3.239 3.439 . 0 0 "[ . 1 . 2]" 2
892 1 32 THR HB 1 88 MET ME 2.805 . 3.788 3.609 3.496 3.765 . 0 0 "[ . 1 . 2]" 2
893 1 32 THR HB 1 109 THR MG 2.911 . 3.970 4.078 4.054 4.110 0.140 11 0 "[ . 1 . 2]" 2
894 1 64 VAL H 1 65 VAL MG1 2.790 . 3.763 3.866 3.851 3.876 0.113 18 0 "[ . 1 . 2]" 2
895 1 65 VAL MG1 1 66 LYS H 2.312 . 2.980 2.235 2.186 2.323 . 0 0 "[ . 1 . 2]" 2
896 1 65 VAL H 1 65 VAL MG1 1.866 . 2.301 2.113 2.079 2.145 . 0 0 "[ . 1 . 2]" 2
897 1 65 VAL MG1 1 66 LYS HA 2.681 . 3.579 3.140 3.106 3.192 . 0 0 "[ . 1 . 2]" 2
898 1 61 PHE QB 1 65 VAL MG1 3.032 . 4.181 4.023 3.976 4.065 . 0 0 "[ . 1 . 2]" 2
899 1 65 VAL HB 1 65 VAL MG1 1.777 . 2.172 2.125 2.122 2.126 . 0 0 "[ . 1 . 2]" 2
900 1 65 VAL MG1 1 66 LYS HG3 2.571 . 3.397 2.703 2.592 2.863 . 0 0 "[ . 1 . 2]" 2
901 1 65 VAL HA 1 65 VAL MG2 1.919 . 2.379 2.128 2.112 2.193 . 0 0 "[ . 1 . 2]" 2
902 1 65 VAL HB 1 65 VAL MG2 1.753 . 2.137 2.082 2.070 2.088 . 0 0 "[ . 1 . 2]" 2
903 1 18 ILE HB 1 65 VAL MG2 2.540 . 3.346 3.282 3.128 3.358 0.012 6 0 "[ . 1 . 2]" 2
904 1 65 VAL MG2 1 68 LYS QD 2.918 . 3.982 3.242 2.155 3.983 0.001 2 0 "[ . 1 . 2]" 2
905 1 71 VAL H 1 71 VAL QG 1.949 . 2.424 2.151 1.921 2.269 . 0 0 "[ . 1 . 2]" 2
906 1 71 VAL QG 1 93 GLN HE22 2.501 . 3.283 3.192 2.619 3.387 0.104 14 0 "[ . 1 . 2]" 2
907 1 71 VAL QG 1 93 GLN HG2 2.515 . 3.306 2.423 2.340 2.503 . 0 0 "[ . 1 . 2]" 2
908 1 71 VAL QG 1 93 GLN HB3 2.035 . 2.553 1.810 1.766 1.829 . 0 0 "[ . 1 . 2]" 2
909 1 69 GLY H 1 69 GLY HA2 2.633 . 3.499 2.489 2.447 2.553 . 0 0 "[ . 1 . 2]" 2
910 1 69 GLY HA2 1 70 GLN H 2.723 . 3.650 3.537 3.515 3.556 . 0 0 "[ . 1 . 2]" 2
911 1 69 GLY H 1 69 GLY HA3 2.494 . 3.271 2.954 2.949 2.956 . 0 0 "[ . 1 . 2]" 2
912 1 69 GLY HA3 1 70 GLN H 2.763 . 3.718 2.808 2.762 2.873 . 0 0 "[ . 1 . 2]" 2
913 1 69 GLY HA2 1 94 THR H 2.289 . 2.944 3.038 3.010 3.059 0.115 19 0 "[ . 1 . 2]" 2
914 1 5 ASN HD22 1 30 VAL QG 2.580 . 3.412 2.244 1.945 3.109 . 0 0 "[ . 1 . 2]" 2
915 1 30 VAL QG 1 34 GLY HA2 2.540 . 3.346 3.412 3.390 3.452 0.106 16 0 "[ . 1 . 2]" 2
916 1 15 ARG H 1 25 VAL MG2 3.011 . 4.145 4.031 3.943 4.063 . 0 0 "[ . 1 . 2]" 2
917 1 25 VAL MG2 1 42 GLY H 3.028 . 4.174 4.232 4.216 4.248 0.074 15 0 "[ . 1 . 2]" 2
918 1 24 PHE H 1 25 VAL MG2 2.491 . 3.266 3.218 3.145 3.249 . 0 0 "[ . 1 . 2]" 2
919 1 22 PHE QD 1 25 VAL MG2 2.331 . 3.010 2.831 2.783 2.851 . 0 0 "[ . 1 . 2]" 2
920 1 25 VAL H 1 25 VAL MG2 2.348 . 3.037 2.694 2.640 2.727 . 0 0 "[ . 1 . 2]" 2
921 1 25 VAL MG2 1 40 LEU H 2.471 . 3.234 3.292 3.269 3.311 0.077 2 0 "[ . 1 . 2]" 2
922 1 12 PHE QE 1 25 VAL MG2 2.719 . 3.643 3.691 3.679 3.704 0.061 18 0 "[ . 1 . 2]" 2
923 1 14 SER HA 1 25 VAL MG2 2.714 . 3.635 3.715 3.675 3.754 0.119 12 0 "[ . 1 . 2]" 2
924 1 22 PHE HA 1 25 VAL MG2 2.972 . 4.076 3.909 3.881 3.962 . 0 0 "[ . 1 . 2]" 2
925 1 24 PHE HA 1 25 VAL MG2 2.673 . 3.566 3.168 3.139 3.209 . 0 0 "[ . 1 . 2]" 2
926 1 25 VAL HA 1 25 VAL MG2 2.209 . 2.819 2.645 2.635 2.668 . 0 0 "[ . 1 . 2]" 2
927 1 25 VAL MG2 1 37 PRO HA 2.323 . 2.998 3.042 3.028 3.060 0.062 6 0 "[ . 1 . 2]" 2
928 1 22 PHE HB2 1 25 VAL MG2 2.495 . 3.273 3.026 3.001 3.078 . 0 0 "[ . 1 . 2]" 2
929 1 22 PHE HB3 1 25 VAL MG2 2.268 . 2.911 2.031 2.003 2.071 . 0 0 "[ . 1 . 2]" 2
930 1 25 VAL MG2 1 40 LEU HB2 2.162 . 2.746 2.266 2.194 2.382 . 0 0 "[ . 1 . 2]" 2
931 1 72 LEU HB3 1 73 SER H 2.341 . 3.026 2.890 2.783 3.082 0.056 7 0 "[ . 1 . 2]" 2
932 1 72 LEU HA 1 72 LEU HB3 2.074 . 2.612 2.639 2.627 2.648 0.036 13 0 "[ . 1 . 2]" 2
933 1 60 SER QB 1 72 LEU HB3 2.945 . 3.438 1.983 1.724 2.292 0.137 1 0 "[ . 1 . 2]" 2
934 1 72 LEU HB3 1 92 SER HB2 2.756 . 3.706 3.662 3.556 3.718 0.012 6 0 "[ . 1 . 2]" 2
935 1 6 VAL QG 1 9 PRO HA 3.009 . 4.141 3.517 3.040 4.419 0.278 13 0 "[ . 1 . 2]" 2
936 1 6 VAL H 1 30 VAL QG 2.759 . 3.711 3.327 2.883 3.575 . 0 0 "[ . 1 . 2]" 2
937 1 30 VAL QG 1 31 ALA HA 2.349 . 3.039 3.022 3.009 3.031 . 0 0 "[ . 1 . 2]" 2
938 1 30 VAL QG 1 31 ALA MB 2.504 . 3.288 2.956 2.908 3.012 . 0 0 "[ . 1 . 2]" 2
939 1 78 PHE H 1 78 PHE HB3 2.429 . 3.167 2.663 2.646 2.689 . 0 0 "[ . 1 . 2]" 2
940 1 78 PHE HB3 1 78 PHE QD 2.410 . 3.136 2.544 2.530 2.584 . 0 0 "[ . 1 . 2]" 2
941 1 76 PHE QE 1 78 PHE HB3 2.913 . 3.974 3.985 3.955 4.007 0.033 17 0 "[ . 1 . 2]" 2
942 1 78 PHE HB3 1 88 MET HG3 2.704 . 3.618 2.767 2.720 2.820 . 0 0 "[ . 1 . 2]" 2
943 1 78 PHE HB3 1 86 LEU HB2 2.873 . 3.905 2.262 2.223 2.298 . 0 0 "[ . 1 . 2]" 2
944 1 78 PHE HB3 1 86 LEU HB3 3.007 . 4.137 3.512 3.442 3.571 . 0 0 "[ . 1 . 2]" 2
945 1 76 PHE QE 1 78 PHE HB2 2.769 . 3.727 2.545 2.511 2.585 . 0 0 "[ . 1 . 2]" 2
946 1 78 PHE HB2 1 88 MET ME 2.822 . 3.818 3.504 3.405 3.615 . 0 0 "[ . 1 . 2]" 2
947 1 78 PHE H 1 78 PHE HB2 2.444 . 3.190 2.560 2.520 2.586 . 0 0 "[ . 1 . 2]" 2
948 1 78 PHE HB2 1 88 MET HG3 2.672 . 3.564 2.345 2.304 2.382 . 0 0 "[ . 1 . 2]" 2
949 1 78 PHE HB2 1 88 MET HB2 3.039 . 4.193 3.450 3.406 3.523 . 0 0 "[ . 1 . 2]" 2
950 1 78 PHE HB2 1 86 LEU HB2 2.989 . 4.106 3.831 3.760 3.887 . 0 0 "[ . 1 . 2]" 2
951 1 86 LEU H 1 86 LEU HB2 2.591 . 3.430 2.362 2.339 2.391 . 0 0 "[ . 1 . 2]" 2
952 1 86 LEU HA 1 86 LEU HB2 2.561 . 3.381 3.012 3.010 3.015 . 0 0 "[ . 1 . 2]" 2
953 1 86 LEU HB2 1 86 LEU HG 2.310 . 2.977 2.298 2.288 2.308 . 0 0 "[ . 1 . 2]" 2
954 1 86 LEU H 1 86 LEU HB3 2.668 . 3.558 3.572 3.561 3.582 0.024 4 0 "[ . 1 . 2]" 2
955 1 50 HIS HD2 1 77 ARG HB3 2.815 . 3.805 3.815 3.768 3.833 0.028 12 0 "[ . 1 . 2]" 2
956 1 33 VAL H 1 33 VAL MG2 2.051 . 2.577 2.054 1.947 2.113 . 0 0 "[ . 1 . 2]" 2
957 1 33 VAL MG2 1 34 GLY H 2.450 . 3.200 3.185 3.167 3.208 0.008 19 0 "[ . 1 . 2]" 2
958 1 33 VAL MG2 1 35 TYR QD 2.060 . 2.590 2.361 2.331 2.394 . 0 0 "[ . 1 . 2]" 2
959 1 12 PHE QE 1 33 VAL MG2 2.335 . 3.016 2.845 2.813 2.899 . 0 0 "[ . 1 . 2]" 2
960 1 33 VAL MG2 1 35 TYR H 2.228 . 2.848 1.966 1.923 2.004 . 0 0 "[ . 1 . 2]" 2
961 1 32 THR HB 1 33 VAL MG2 2.578 . 3.409 2.767 2.685 2.866 . 0 0 "[ . 1 . 2]" 2
962 1 33 VAL MG2 1 35 TYR HB3 2.648 . 3.524 3.582 3.564 3.599 0.075 19 0 "[ . 1 . 2]" 2
963 1 33 VAL HB 1 33 VAL MG2 2.034 . 2.551 2.127 2.125 2.130 . 0 0 "[ . 1 . 2]" 2
964 1 33 VAL MG2 1 35 TYR HB2 2.461 . 3.218 2.059 2.019 2.080 . 0 0 "[ . 1 . 2]" 2
965 1 29 CYS HB2 1 33 VAL MG2 2.467 . 3.228 2.545 2.501 2.604 . 0 0 "[ . 1 . 2]" 2
966 1 16 HIS HB2 1 20 GLY HA3 2.983 . 4.095 4.087 4.035 4.101 0.006 20 0 "[ . 1 . 2]" 2
967 1 50 HIS HD2 1 77 ARG HD2 2.808 . 3.794 3.996 2.482 4.586 0.792 3 9 "[ *+ -** ** . * *2]" 2
968 1 50 HIS HB2 1 50 HIS HD2 2.421 . 3.154 2.690 2.680 2.697 . 0 0 "[ . 1 . 2]" 2
969 1 33 VAL H 1 88 MET ME 2.981 . 4.092 4.083 4.027 4.197 0.105 11 0 "[ . 1 . 2]" 2
970 1 12 PHE QE 1 88 MET ME 2.418 . 3.149 3.209 3.185 3.229 0.080 6 0 "[ . 1 . 2]" 2
971 1 88 MET ME 1 109 THR HA 2.321 . 2.994 3.084 3.041 3.120 0.126 11 0 "[ . 1 . 2]" 2
972 1 78 PHE HB3 1 88 MET ME 2.294 . 2.952 2.623 2.536 2.872 . 0 0 "[ . 1 . 2]" 2
973 1 88 MET ME 1 88 MET HG2 1.994 . 2.491 2.438 2.404 2.463 . 0 0 "[ . 1 . 2]" 2
974 1 88 MET ME 1 88 MET HG3 2.082 . 2.624 2.328 2.300 2.454 . 0 0 "[ . 1 . 2]" 2
975 1 86 LEU HB2 1 88 MET ME 2.020 . 2.530 2.480 2.377 2.556 0.026 11 0 "[ . 1 . 2]" 2
976 1 88 MET ME 1 109 THR MG 1.886 . 2.331 1.712 1.649 1.853 . 0 0 "[ . 1 . 2]" 2
977 1 32 THR MG 1 88 MET ME 1.908 . 2.363 1.795 1.722 1.838 . 0 0 "[ . 1 . 2]" 2
978 1 86 LEU QD 1 88 MET ME 1.918 . 2.378 2.231 2.162 2.284 . 0 0 "[ . 1 . 2]" 2
979 1 33 VAL MG1 1 88 MET ME 1.710 . 2.076 1.771 1.741 1.820 . 0 0 "[ . 1 . 2]" 2
980 1 72 LEU HB3 1 74 VAL MG2 2.904 . 3.958 3.986 3.934 4.020 0.062 2 0 "[ . 1 . 2]" 2
981 1 74 VAL MG2 1 76 PHE H 3.075 . 4.257 4.341 4.303 4.356 0.099 10 0 "[ . 1 . 2]" 2
982 1 74 VAL MG2 1 90 THR H 2.731 . 3.663 2.987 2.958 3.027 . 0 0 "[ . 1 . 2]" 2
983 1 74 VAL H 1 74 VAL MG2 2.173 . 2.763 2.322 2.167 2.374 . 0 0 "[ . 1 . 2]" 2
984 1 74 VAL MG2 1 76 PHE QD 2.272 . 2.917 2.947 2.919 2.974 0.057 2 0 "[ . 1 . 2]" 2
985 1 74 VAL MG2 1 75 MET HA 2.966 . 4.065 3.930 3.889 3.957 . 0 0 "[ . 1 . 2]" 2
986 1 74 VAL MG2 1 90 THR HB 2.773 . 3.734 3.592 3.570 3.610 . 0 0 "[ . 1 . 2]" 2
987 1 60 SER QB 1 74 VAL MG2 2.318 . 2.990 2.385 2.280 2.732 . 0 0 "[ . 1 . 2]" 2
988 1 57 LEU HA 1 74 VAL MG2 2.055 . 2.583 1.875 1.787 1.980 . 0 0 "[ . 1 . 2]" 2
989 1 74 VAL MG2 1 76 PHE HB3 2.700 . 3.611 3.521 3.469 3.572 . 0 0 "[ . 1 . 2]" 2
990 1 74 VAL HB 1 74 VAL MG2 1.884 . 2.328 2.119 2.116 2.122 . 0 0 "[ . 1 . 2]" 2
991 1 56 LEU HG 1 74 VAL MG2 2.424 . 3.158 3.061 3.015 3.153 . 0 0 "[ . 1 . 2]" 2
992 1 74 VAL MG2 1 90 THR MG 2.139 . 2.711 1.896 1.839 1.950 . 0 0 "[ . 1 . 2]" 2
993 1 57 LEU QD 1 74 VAL MG2 1.955 . 2.433 2.035 1.982 2.090 . 0 0 "[ . 1 . 2]" 2
994 1 12 PHE QD 1 33 VAL MG2 2.738 . 3.675 3.742 3.710 3.774 0.099 20 0 "[ . 1 . 2]" 2
995 1 33 VAL MG2 1 80 SER HA 2.982 . 4.094 3.945 3.905 4.000 . 0 0 "[ . 1 . 2]" 2
996 1 89 ARG QD 1 89 ARG QG 2.095 . 2.644 2.010 2.002 2.026 . 0 0 "[ . 1 . 2]" 2
997 1 89 ARG HA 1 89 ARG QD 2.972 . 4.076 3.460 3.392 3.500 . 0 0 "[ . 1 . 2]" 2
998 1 53 ASP H 1 53 ASP HB3 2.698 . 3.608 3.654 3.610 3.681 0.073 17 0 "[ . 1 . 2]" 2
999 1 53 ASP HB3 1 76 PHE HA 2.818 . 3.811 2.853 2.746 2.959 . 0 0 "[ . 1 . 2]" 2
1000 1 53 ASP HA 1 53 ASP HB3 2.387 . 3.099 2.508 2.458 2.599 . 0 0 "[ . 1 . 2]" 2
1001 1 53 ASP HB3 1 56 LEU MD2 2.913 . 3.974 2.941 2.666 3.046 . 0 0 "[ . 1 . 2]" 2
1002 1 53 ASP HB2 1 76 PHE HB2 2.622 . 3.482 2.869 2.708 2.951 . 0 0 "[ . 1 . 2]" 2
1003 1 53 ASP H 1 53 ASP HB2 2.665 . 3.553 2.455 2.381 2.520 . 0 0 "[ . 1 . 2]" 2
1004 1 53 ASP HB2 1 76 PHE HA 2.933 . 4.008 3.736 3.437 3.835 . 0 0 "[ . 1 . 2]" 2
1005 1 53 ASP HA 1 53 ASP HB2 2.541 . 3.348 3.016 2.997 3.023 . 0 0 "[ . 1 . 2]" 2
1006 1 77 ARG HD2 1 77 ARG HE 2.786 . 3.756 2.864 2.543 2.945 . 0 0 "[ . 1 . 2]" 2
1007 1 77 ARG HB3 1 77 ARG HD2 2.926 . 3.996 3.764 2.746 3.988 . 0 0 "[ . 1 . 2]" 2
1008 1 77 ARG HD2 1 77 ARG HG3 2.585 . 3.420 2.468 2.339 3.013 . 0 0 "[ . 1 . 2]" 2
1009 1 77 ARG HD2 1 77 ARG HG2 2.684 . 3.584 2.495 2.371 2.552 . 0 0 "[ . 1 . 2]" 2
1010 1 77 ARG HD3 1 77 ARG HE 2.905 . 3.960 2.635 2.420 2.933 . 0 0 "[ . 1 . 2]" 2
1011 1 77 ARG HD3 1 77 ARG HG3 2.676 . 3.571 2.495 2.370 2.552 . 0 0 "[ . 1 . 2]" 2
1012 1 77 ARG HD3 1 77 ARG HG2 2.768 . 3.726 2.925 2.433 3.014 . 0 0 "[ . 1 . 2]" 2
1013 1 50 HIS HD2 1 85 TRP HZ2 3.038 . 4.192 3.769 3.571 4.003 . 0 0 "[ . 1 . 2]" 2
1014 1 50 HIS HA 1 85 TRP HZ2 2.743 . 3.683 3.697 3.631 3.725 0.042 17 0 "[ . 1 . 2]" 2
1015 1 51 PRO HD2 1 85 TRP HZ2 2.760 . 3.712 3.547 3.469 3.651 . 0 0 "[ . 1 . 2]" 2
1016 1 51 PRO HD3 1 85 TRP HZ2 2.878 . 3.914 3.574 3.495 3.814 . 0 0 "[ . 1 . 2]" 2
1017 1 6 VAL H 1 31 ALA MB 3.023 . 4.165 3.648 3.345 4.246 0.081 13 0 "[ . 1 . 2]" 2
1018 1 8 GLN HA 1 31 ALA MB 3.062 . 4.234 2.713 2.525 3.009 . 0 0 "[ . 1 . 2]" 2
1019 1 9 PRO QD 1 31 ALA MB 2.562 . 3.130 1.887 1.815 2.065 . 0 0 "[ . 1 . 2]" 2
1020 1 28 ARG HA 1 28 ARG QD 2.939 . 4.019 3.179 2.218 3.631 . 0 0 "[ . 1 . 2]" 2
1021 1 9 PRO HB2 1 28 ARG QD 2.866 . 3.893 3.986 3.922 4.819 0.926 20 1 "[ . 1 . +]" 2
1022 1 28 ARG HB3 1 28 ARG QD 2.551 . 3.364 2.159 2.062 2.249 . 0 0 "[ . 1 . 2]" 2
1023 1 28 ARG HB2 1 28 ARG QD 2.756 . 3.705 2.964 2.726 3.265 . 0 0 "[ . 1 . 2]" 2
1024 1 15 ARG HD2 1 15 ARG HE 2.510 . 3.297 2.561 2.423 2.945 . 0 0 "[ . 1 . 2]" 2
1025 1 15 ARG HD2 1 95 ALA MB 2.552 . 3.366 2.426 2.247 2.730 . 0 0 "[ . 1 . 2]" 2
1026 1 53 ASP HB3 1 77 ARG H 2.938 . 4.017 3.458 3.372 3.775 . 0 0 "[ . 1 . 2]" 2
1027 1 15 ARG HD3 1 15 ARG HE 2.514 . 3.304 2.888 2.396 2.950 . 0 0 "[ . 1 . 2]" 2
1028 1 15 ARG QB 1 15 ARG HD3 2.483 . 3.254 3.289 3.266 3.299 0.045 11 0 "[ . 1 . 2]" 2
1029 1 40 LEU HB2 1 41 LEU H 2.690 . 3.595 2.850 2.786 2.904 . 0 0 "[ . 1 . 2]" 2
1030 1 40 LEU H 1 40 LEU HB2 2.549 . 3.361 2.313 2.288 2.352 . 0 0 "[ . 1 . 2]" 2
1031 1 40 LEU H 1 40 LEU HB3 2.650 . 3.527 3.447 3.427 3.462 . 0 0 "[ . 1 . 2]" 2
1032 1 40 LEU HA 1 40 LEU HB3 2.491 . 3.266 2.715 2.704 2.723 . 0 0 "[ . 1 . 2]" 2
1033 1 25 VAL MG2 1 40 LEU HB3 2.519 . 3.312 1.999 1.970 2.027 . 0 0 "[ . 1 . 2]" 2
1034 1 40 LEU HB3 1 40 LEU QD 2.392 . 3.107 2.585 2.581 2.591 . 0 0 "[ . 1 . 2]" 2
1035 1 31 ALA H 1 31 ALA MB 1.783 . 2.180 2.205 2.187 2.229 0.049 13 0 "[ . 1 . 2]" 2
1036 1 31 ALA MB 1 32 THR H 2.182 . 2.777 2.788 2.662 2.814 0.037 2 0 "[ . 1 . 2]" 2
1037 1 31 ALA HA 1 31 ALA MB 1.658 . 2.002 2.119 2.113 2.125 0.123 13 0 "[ . 1 . 2]" 2
1038 1 28 ARG QD 1 31 ALA MB 2.919 . 3.984 3.753 3.041 4.032 0.048 3 0 "[ . 1 . 2]" 2
1039 1 9 PRO QG 1 31 ALA MB 2.208 . 2.818 2.785 1.618 2.884 0.066 9 0 "[ . 1 . 2]" 2
1040 1 6 VAL QG 1 31 ALA MB 2.706 . 3.621 2.157 1.740 3.252 0.051 13 0 "[ . 1 . 2]" 2
1041 1 95 ALA MB 1 104 GLU H 2.638 . 3.508 2.850 2.535 3.033 . 0 0 "[ . 1 . 2]" 2
1042 1 95 ALA MB 1 99 TYR H 2.760 . 3.712 3.768 3.537 3.871 0.159 19 0 "[ . 1 . 2]" 2
1043 1 95 ALA MB 1 96 GLN H 2.065 . 2.598 2.308 2.174 2.423 . 0 0 "[ . 1 . 2]" 2
1044 1 95 ALA H 1 95 ALA MB 1.977 . 2.466 2.048 2.001 2.090 . 0 0 "[ . 1 . 2]" 2
1045 1 95 ALA MB 1 99 TYR QD 2.512 . 3.301 2.788 2.419 3.207 . 0 0 "[ . 1 . 2]" 2
1046 1 95 ALA MB 1 104 GLU HA 2.908 . 3.965 3.543 3.298 3.773 . 0 0 "[ . 1 . 2]" 2
1047 1 95 ALA HA 1 95 ALA MB 1.867 . 2.303 2.091 2.081 2.098 . 0 0 "[ . 1 . 2]" 2
1048 1 15 ARG HD3 1 95 ALA MB 2.095 . 2.644 2.382 1.939 2.841 0.197 5 0 "[ . 1 . 2]" 2
1049 1 95 ALA MB 1 96 GLN QG 2.664 . 3.551 3.640 3.600 3.698 0.147 4 0 "[ . 1 . 2]" 2
1050 1 95 ALA MB 1 104 GLU HB2 2.456 . 3.210 2.509 1.922 2.768 . 0 0 "[ . 1 . 2]" 2
1051 1 40 LEU HA 1 40 LEU HB2 2.578 . 3.409 2.933 2.928 2.940 . 0 0 "[ . 1 . 2]" 2
1052 1 77 ARG HD2 1 87 TRP HZ2 2.636 . 3.504 2.710 2.396 4.180 0.676 13 2 "[ . 1- + . 2]" 2
1053 1 77 ARG HD3 1 87 TRP HZ2 2.970 . 4.072 3.573 2.052 4.132 0.060 14 0 "[ . 1 . 2]" 2
1054 1 92 SER HB3 1 93 GLN H 2.821 . 3.816 3.413 3.348 3.480 . 0 0 "[ . 1 . 2]" 2
1055 1 61 PHE QE 1 92 SER HB3 2.596 . 3.439 2.416 2.355 2.579 . 0 0 "[ . 1 . 2]" 2
1056 1 92 SER HB3 1 105 THR HA 3.014 . 4.150 3.806 3.779 3.870 . 0 0 "[ . 1 . 2]" 2
1057 1 64 VAL MG2 1 92 SER HB3 2.827 . 3.826 3.618 3.549 3.738 . 0 0 "[ . 1 . 2]" 2
1058 1 92 SER HB3 1 103 ILE MG 2.485 . 2.902 2.136 2.094 2.174 . 0 0 "[ . 1 . 2]" 2
1059 1 16 HIS HE2 1 92 SER HB3 3.088 . 4.280 3.503 3.368 3.603 . 0 0 "[ . 1 . 2]" 2
1060 1 37 PRO HA 1 38 GLN H 2.832 . 3.835 3.553 3.543 3.569 . 0 0 "[ . 1 . 2]" 2
1061 1 37 PRO HA 1 40 LEU H 2.791 . 3.764 3.748 3.722 3.774 0.010 5 0 "[ . 1 . 2]" 2
1062 1 37 PRO HA 1 37 PRO HB3 2.044 . 2.566 2.241 2.236 2.246 . 0 0 "[ . 1 . 2]" 2
1063 1 25 VAL HB 1 37 PRO HA 2.339 . 3.023 1.850 1.826 1.868 . 0 0 "[ . 1 . 2]" 2
1064 1 37 PRO HA 1 40 LEU HB2 2.632 . 3.498 2.958 2.924 2.981 . 0 0 "[ . 1 . 2]" 2
1065 1 37 PRO HA 1 40 LEU QD 2.546 . 3.356 3.085 3.032 3.150 . 0 0 "[ . 1 . 2]" 2
1066 1 73 SER HB3 1 74 VAL H 2.931 . 4.005 4.137 4.120 4.186 0.181 7 0 "[ . 1 . 2]" 2
1067 1 64 VAL MG2 1 92 SER HB2 2.900 . 3.951 3.738 3.693 3.842 . 0 0 "[ . 1 . 2]" 2
1068 1 92 SER H 1 92 SER HB2 2.606 . 3.455 2.827 2.806 2.850 . 0 0 "[ . 1 . 2]" 2
1069 1 92 SER HB2 1 93 GLN H 2.936 . 4.013 3.959 3.897 4.014 0.001 17 0 "[ . 1 . 2]" 2
1070 1 61 PHE QE 1 92 SER HB2 2.709 . 3.626 3.530 3.490 3.649 0.023 17 0 "[ . 1 . 2]" 2
1071 1 92 SER HB2 1 103 ILE MG 2.654 . 3.534 3.173 3.138 3.225 . 0 0 "[ . 1 . 2]" 2
1072 1 26 ASP H 1 26 ASP HB2 2.458 . 3.213 2.827 2.769 2.873 . 0 0 "[ . 1 . 2]" 2
1073 1 26 ASP HA 1 26 ASP HB2 2.149 . 2.726 2.322 2.307 2.344 . 0 0 "[ . 1 . 2]" 2
1074 1 13 ILE HB 1 26 ASP HB2 2.762 . 3.715 2.417 2.324 2.469 . 0 0 "[ . 1 . 2]" 2
1075 1 68 LYS QE 1 101 ASP HA 2.855 . 3.874 3.213 2.405 3.908 0.034 2 0 "[ . 1 . 2]" 2
1076 1 43 LYS QE 1 43 LYS HG2 2.129 . 2.696 2.450 2.187 2.751 0.055 6 0 "[ . 1 . 2]" 2
1077 1 43 LYS QD 1 43 LYS QE 2.061 . 2.592 2.035 1.987 2.091 . 0 0 "[ . 1 . 2]" 2
1078 1 12 PHE HB2 1 29 CYS H 2.591 . 3.430 2.478 2.444 2.509 . 0 0 "[ . 1 . 2]" 2
1079 1 26 ASP H 1 26 ASP HB3 2.314 . 2.984 2.172 2.153 2.214 . 0 0 "[ . 1 . 2]" 2
1080 1 26 ASP HA 1 26 ASP HB3 2.265 . 2.906 2.978 2.971 2.987 0.081 1 0 "[ . 1 . 2]" 2
1081 1 13 ILE HB 1 26 ASP HB3 2.567 . 3.391 3.122 3.059 3.187 . 0 0 "[ . 1 . 2]" 2
1082 1 79 ARG HD3 1 80 SER H 2.847 . 3.860 3.522 3.420 3.575 . 0 0 "[ . 1 . 2]" 2
1083 1 79 ARG HD3 1 80 SER HA 2.753 . 3.700 3.790 3.747 4.291 0.591 19 1 "[ . 1 . +2]" 2
1084 1 79 ARG HD3 1 79 ARG HG3 2.286 . 2.939 2.977 2.833 2.994 0.055 18 0 "[ . 1 . 2]" 2
1085 1 79 ARG HD3 1 79 ARG HG2 2.293 . 2.950 2.309 2.198 2.345 . 0 0 "[ . 1 . 2]" 2
1086 1 79 ARG HD2 1 79 ARG HG3 2.334 . 3.015 2.595 2.540 2.831 . 0 0 "[ . 1 . 2]" 2
1087 1 79 ARG HD2 1 79 ARG HG2 2.460 . 3.217 2.978 2.840 2.997 . 0 0 "[ . 1 . 2]" 2
1088 1 50 HIS HE1 1 52 GLU H 2.354 . 3.047 2.855 2.757 2.920 . 0 0 "[ . 1 . 2]" 2
1089 1 51 PRO HA 1 53 ASP H 3.073 . 4.253 3.899 3.846 3.979 . 0 0 "[ . 1 . 2]" 2
1090 1 51 PRO HA 1 54 GLN HE21 2.655 . 3.536 3.321 3.235 3.633 0.097 16 0 "[ . 1 . 2]" 2
1091 1 51 PRO HA 1 51 PRO HD2 2.807 . 3.792 3.882 3.874 3.885 0.093 9 0 "[ . 1 . 2]" 2
1092 1 51 PRO HA 1 51 PRO HB3 2.029 . 2.544 2.317 2.313 2.326 . 0 0 "[ . 1 . 2]" 2
1093 1 51 PRO HA 1 54 GLN HG2 2.529 . 3.328 3.412 3.386 3.495 0.167 11 0 "[ . 1 . 2]" 2
1094 1 51 PRO HA 1 54 GLN HB2 2.556 . 3.372 3.372 2.799 3.445 0.073 19 0 "[ . 1 . 2]" 2
1095 1 73 SER H 1 73 SER HB2 2.411 . 3.137 2.975 2.895 3.409 0.272 7 0 "[ . 1 . 2]" 2
1096 1 64 VAL H 1 64 VAL HA 2.193 . 2.794 2.825 2.822 2.830 0.036 17 0 "[ . 1 . 2]" 2
1097 1 64 VAL HA 1 67 LEU H 2.683 . 3.583 3.675 3.640 3.720 0.137 18 0 "[ . 1 . 2]" 2
1098 1 64 VAL HA 1 65 VAL H 2.589 . 3.427 3.461 3.451 3.469 0.042 19 0 "[ . 1 . 2]" 2
1099 1 64 VAL HA 1 64 VAL HB 2.217 . 2.831 2.252 2.246 2.259 . 0 0 "[ . 1 . 2]" 2
1100 1 64 VAL HA 1 70 GLN HB3 2.748 . 3.692 3.041 2.909 3.162 . 0 0 "[ . 1 . 2]" 2
1101 1 64 VAL HA 1 67 LEU HB2 2.590 . 3.428 3.323 3.237 3.430 0.002 4 0 "[ . 1 . 2]" 2
1102 1 73 SER H 1 73 SER HB3 2.370 . 3.072 2.928 2.886 3.333 0.261 7 0 "[ . 1 . 2]" 2
1103 1 89 ARG H 1 107 ILE MG 2.683 . 3.583 3.591 3.557 3.615 0.032 11 0 "[ . 1 . 2]" 2
1104 1 107 ILE MG 1 108 CYS H 2.362 . 3.059 3.061 3.007 3.088 0.029 9 0 "[ . 1 . 2]" 2
1105 1 12 PHE H 1 107 ILE MG 2.862 . 3.886 3.975 3.953 4.030 0.144 16 0 "[ . 1 . 2]" 2
1106 1 78 PHE QD 1 107 ILE MG 2.387 . 3.099 3.069 2.946 3.122 0.023 16 0 "[ . 1 . 2]" 2
1107 1 76 PHE HZ 1 107 ILE MG 2.388 . 3.101 2.705 2.610 2.801 . 0 0 "[ . 1 . 2]" 2
1108 1 76 PHE QE 1 107 ILE MG 2.392 . 3.107 2.703 2.563 2.789 . 0 0 "[ . 1 . 2]" 2
1109 1 12 PHE QE 1 107 ILE MG 2.318 . 2.990 2.660 2.570 2.703 . 0 0 "[ . 1 . 2]" 2
1110 1 90 THR HA 1 107 ILE MG 2.916 . 3.979 4.075 4.064 4.089 0.110 16 0 "[ . 1 . 2]" 2
1111 1 107 ILE HA 1 107 ILE MG 2.125 . 2.689 2.364 2.351 2.404 . 0 0 "[ . 1 . 2]" 2
1112 1 78 PHE HB2 1 107 ILE MG 2.943 . 4.026 3.495 3.441 3.543 . 0 0 "[ . 1 . 2]" 2
1113 1 88 MET HG2 1 107 ILE MG 2.552 . 3.366 3.539 3.512 3.553 0.187 9 0 "[ . 1 . 2]" 2
1114 1 88 MET HG3 1 107 ILE MG 2.332 . 3.012 2.506 2.452 2.530 . 0 0 "[ . 1 . 2]" 2
1115 1 88 MET HB3 1 107 ILE MG 2.190 . 2.789 1.819 1.775 1.907 . 0 0 "[ . 1 . 2]" 2
1116 1 107 ILE HG12 1 107 ILE MG 2.218 . 2.833 2.346 2.227 2.365 . 0 0 "[ . 1 . 2]" 2
1117 1 88 MET HB2 1 107 ILE MG 2.215 . 2.828 2.420 2.370 2.473 . 0 0 "[ . 1 . 2]" 2
1118 1 33 VAL MG1 1 107 ILE MG 2.532 . 3.333 3.239 3.186 3.311 . 0 0 "[ . 1 . 2]" 2
1119 1 50 HIS HE1 1 52 GLU QG 1.932 . 2.398 2.299 2.077 2.413 0.015 14 0 "[ . 1 . 2]" 2
1120 1 50 HIS HE1 1 52 GLU HB2 2.490 . 3.265 3.139 2.936 3.281 0.016 11 0 "[ . 1 . 2]" 2
1121 1 51 PRO HA 1 52 GLU H 2.844 . 3.855 3.574 3.570 3.583 . 0 0 "[ . 1 . 2]" 2
1122 1 15 ARG H 1 24 PHE HB3 2.950 . 4.038 2.668 2.614 2.937 . 0 0 "[ . 1 . 2]" 2
1123 1 24 PHE H 1 24 PHE HB3 2.889 . 3.932 3.067 3.055 3.088 . 0 0 "[ . 1 . 2]" 2
1124 1 24 PHE HB3 1 24 PHE QD 2.349 . 3.039 2.394 2.382 2.406 . 0 0 "[ . 1 . 2]" 2
1125 1 15 ARG HG3 1 24 PHE HB3 3.066 . 4.241 3.526 3.318 3.896 . 0 0 "[ . 1 . 2]" 2
1126 1 76 PHE HB2 1 76 PHE QD 2.438 . 3.181 2.305 2.298 2.312 . 0 0 "[ . 1 . 2]" 2
1127 1 65 VAL MG2 1 68 LYS QE 2.786 . 3.756 2.085 1.795 3.047 0.021 4 0 "[ . 1 . 2]" 2
1128 1 76 PHE HB3 1 76 PHE QD 2.283 . 2.935 2.479 2.471 2.489 . 0 0 "[ . 1 . 2]" 2
1129 1 63 GLN HA 1 66 LYS QE 2.793 . 3.768 3.730 3.602 3.782 0.014 1 0 "[ . 1 . 2]" 2
1130 1 66 LYS QE 1 66 LYS HG2 2.290 . 2.945 2.613 2.367 2.933 . 0 0 "[ . 1 . 2]" 2
1131 1 35 TYR QD 1 81 LYS QE 2.723 . 3.650 3.335 3.176 3.689 0.039 12 0 "[ . 1 . 2]" 2
1132 1 35 TYR HA 1 81 LYS QE 2.791 . 3.765 3.726 3.650 3.906 0.141 12 0 "[ . 1 . 2]" 2
1133 1 36 GLN QG 1 81 LYS QE 3.020 . 4.160 4.188 4.147 4.218 0.058 15 0 "[ . 1 . 2]" 2
1134 1 81 LYS HD2 1 81 LYS QE 2.054 . 2.581 2.219 2.152 2.455 . 0 0 "[ . 1 . 2]" 2
1135 1 81 LYS QE 1 81 LYS HG3 2.144 . 2.719 2.431 2.396 2.482 . 0 0 "[ . 1 . 2]" 2
1136 1 81 LYS HB2 1 81 LYS QE 2.814 . 3.804 3.915 3.832 3.926 0.122 5 0 "[ . 1 . 2]" 2
1137 1 81 LYS QE 1 81 LYS HG2 2.159 . 2.742 2.717 2.346 2.804 0.062 16 0 "[ . 1 . 2]" 2
1138 1 12 PHE HB3 1 29 CYS H 3.065 . 4.240 3.113 2.973 3.238 . 0 0 "[ . 1 . 2]" 2
1139 1 12 PHE HB3 1 28 ARG HB2 2.796 . 3.773 2.549 2.343 2.885 . 0 0 "[ . 1 . 2]" 2
1140 1 12 PHE HB3 1 28 ARG HB3 2.741 . 3.680 2.616 2.498 2.772 . 0 0 "[ . 1 . 2]" 2
1141 1 24 PHE HB2 1 24 PHE QD 2.431 . 3.170 2.405 2.394 2.414 . 0 0 "[ . 1 . 2]" 2
1142 1 24 PHE H 1 24 PHE HB2 2.891 . 3.935 3.686 3.674 3.696 . 0 0 "[ . 1 . 2]" 2
1143 1 41 LEU HB3 1 42 GLY H 2.546 . 3.356 3.306 3.231 3.358 0.002 10 0 "[ . 1 . 2]" 2
1144 1 41 LEU H 1 41 LEU HB2 2.002 . 2.503 2.219 2.202 2.238 . 0 0 "[ . 1 . 2]" 2
1145 1 40 LEU H 1 41 LEU HB2 2.718 . 3.641 3.687 3.665 3.702 0.061 7 0 "[ . 1 . 2]" 2
1146 1 38 GLN HA 1 41 LEU HB2 2.284 . 2.936 1.964 1.905 2.026 . 0 0 "[ . 1 . 2]" 2
1147 1 46 VAL HA 1 47 GLU H 2.993 . 4.112 3.498 3.490 3.509 . 0 0 "[ . 1 . 2]" 2
1148 1 46 VAL H 1 46 VAL HA 2.438 . 3.181 2.830 2.814 2.838 . 0 0 "[ . 1 . 2]" 2
1149 1 46 VAL HA 1 48 PHE H 2.981 . 4.092 3.657 3.576 3.772 . 0 0 "[ . 1 . 2]" 2
1150 1 46 VAL HA 1 49 CYS H 2.541 . 3.348 2.580 2.531 2.632 . 0 0 "[ . 1 . 2]" 2
1151 1 46 VAL HA 1 49 CYS HB3 2.290 . 2.946 1.793 1.744 1.958 . 0 0 "[ . 1 . 2]" 2
1152 1 46 VAL HA 1 49 CYS HB2 2.307 . 2.972 2.284 2.128 2.345 . 0 0 "[ . 1 . 2]" 2
1153 1 46 VAL HA 1 54 GLN HG2 2.802 . 3.783 3.482 3.344 3.537 . 0 0 "[ . 1 . 2]" 2
1154 1 46 VAL HA 1 46 VAL HB 2.278 . 2.926 2.205 2.195 2.210 . 0 0 "[ . 1 . 2]" 2
1155 1 45 ILE MG 1 46 VAL HA 2.752 . 3.699 3.212 3.178 3.253 . 0 0 "[ . 1 . 2]" 2
1156 1 46 VAL HA 1 57 LEU QD 2.472 . 3.236 1.940 1.807 2.008 . 0 0 "[ . 1 . 2]" 2
1157 1 30 VAL HA 1 33 VAL H 3.007 . 4.138 3.810 3.769 3.881 . 0 0 "[ . 1 . 2]" 2
1158 1 30 VAL HA 1 34 GLY H 2.325 . 3.001 2.965 2.909 3.017 0.016 13 0 "[ . 1 . 2]" 2
1159 1 30 VAL H 1 30 VAL HA 2.278 . 2.926 2.882 2.879 2.884 . 0 0 "[ . 1 . 2]" 2
1160 1 30 VAL HA 1 35 TYR H 2.452 . 3.204 3.262 3.233 3.283 0.079 3 0 "[ . 1 . 2]" 2
1161 1 30 VAL HA 1 36 GLN HA 3.004 . 4.132 3.482 3.423 3.561 . 0 0 "[ . 1 . 2]" 2
1162 1 30 VAL HA 1 34 GLY HA2 2.555 . 3.371 2.964 2.926 3.007 . 0 0 "[ . 1 . 2]" 2
1163 1 30 VAL HA 1 30 VAL HB 2.242 . 2.871 2.217 2.213 2.223 . 0 0 "[ . 1 . 2]" 2
1164 1 30 VAL HA 1 33 VAL MG2 2.803 . 3.785 3.623 3.589 3.666 . 0 0 "[ . 1 . 2]" 2
1165 1 13 ILE MG 1 15 ARG H 3.098 . 4.297 4.128 4.058 4.153 . 0 0 "[ . 1 . 2]" 2
1166 1 13 ILE MG 1 105 THR H 3.047 . 4.208 4.039 3.975 4.084 . 0 0 "[ . 1 . 2]" 2
1167 1 13 ILE MG 1 24 PHE QE 2.217 . 2.832 2.829 2.780 2.853 0.021 12 0 "[ . 1 . 2]" 2
1168 1 13 ILE MG 1 14 SER HA 2.765 . 3.721 3.750 3.729 3.810 0.089 15 0 "[ . 1 . 2]" 2
1169 1 13 ILE MG 1 104 GLU HA 2.950 . 4.038 4.047 3.994 4.122 0.084 7 0 "[ . 1 . 2]" 2
1170 1 13 ILE MG 1 106 ILE HA 2.529 . 3.328 3.411 3.399 3.428 0.100 18 0 "[ . 1 . 2]" 2
1171 1 13 ILE HA 1 13 ILE MG 2.093 . 2.641 2.272 2.256 2.284 . 0 0 "[ . 1 . 2]" 2
1172 1 13 ILE MG 1 26 ASP HB2 2.819 . 3.812 3.881 3.855 3.900 0.088 20 0 "[ . 1 . 2]" 2
1173 1 13 ILE MG 1 104 GLU HG3 2.195 . 2.797 2.720 2.242 2.811 0.014 12 0 "[ . 1 . 2]" 2
1174 1 13 ILE HB 1 13 ILE MG 1.926 . 2.390 2.121 2.117 2.125 . 0 0 "[ . 1 . 2]" 2
1175 1 106 ILE HA 1 106 ILE MG 2.067 . 2.601 2.439 2.391 2.461 . 0 0 "[ . 1 . 2]" 2
1176 1 13 ILE HA 1 106 ILE MG 2.502 . 3.285 3.188 3.126 3.265 . 0 0 "[ . 1 . 2]" 2
1177 1 91 SER HB2 1 106 ILE MG 2.731 . 3.663 3.218 3.145 3.260 . 0 0 "[ . 1 . 2]" 2
1178 1 106 ILE HB 1 106 ILE MG 1.834 . 2.255 2.135 2.120 2.138 . 0 0 "[ . 1 . 2]" 2
1179 1 61 PHE QD 1 103 ILE MG 2.721 . 3.647 2.146 2.093 2.177 . 0 0 "[ . 1 . 2]" 2
1180 1 92 SER HA 1 103 ILE MG 2.625 . 3.487 2.829 2.786 2.898 . 0 0 "[ . 1 . 2]" 2
1181 1 103 ILE HA 1 103 ILE MG 2.045 . 2.568 2.432 2.415 2.445 . 0 0 "[ . 1 . 2]" 2
1182 1 64 VAL HB 1 103 ILE MG 2.799 . 3.778 3.654 3.633 3.664 . 0 0 "[ . 1 . 2]" 2
1183 1 64 VAL MG2 1 103 ILE MG 2.086 . 2.630 1.673 1.652 1.708 . 0 0 "[ . 1 . 2]" 2
1184 1 54 GLN HA 1 57 LEU HB3 2.719 . 3.643 2.585 2.463 3.378 . 0 0 "[ . 1 . 2]" 2
1185 1 57 LEU HB3 1 58 ARG H 2.440 . 3.184 2.126 2.087 2.164 . 0 0 "[ . 1 . 2]" 2
1186 1 57 LEU H 1 57 LEU HB3 2.285 . 2.937 2.614 2.566 3.122 0.185 17 0 "[ . 1 . 2]" 2
1187 1 57 LEU HB3 1 57 LEU HG 2.433 . 3.173 2.445 2.410 2.932 . 0 0 "[ . 1 . 2]" 2
1188 1 57 LEU H 1 57 LEU HB2 2.262 . 2.902 2.373 1.962 2.426 . 0 0 "[ . 1 . 2]" 2
1189 1 57 LEU HB2 1 57 LEU QD 2.323 . 2.997 2.129 2.102 2.435 . 0 0 "[ . 1 . 2]" 2
1190 1 18 ILE MG 1 19 GLU H 2.207 . 2.816 2.040 1.965 2.128 . 0 0 "[ . 1 . 2]" 2
1191 1 18 ILE HB 1 18 ILE MG 1.898 . 2.348 2.122 2.119 2.124 . 0 0 "[ . 1 . 2]" 2
1192 1 18 ILE HG13 1 18 ILE MG 2.310 . 2.977 2.395 2.333 2.448 . 0 0 "[ . 1 . 2]" 2
1193 1 18 ILE HG12 1 18 ILE MG 2.075 . 2.613 2.383 2.335 2.431 . 0 0 "[ . 1 . 2]" 2
1194 1 16 HIS HE1 1 61 PHE QB 2.769 . 3.727 2.994 2.830 3.093 . 0 0 "[ . 1 . 2]" 2
1195 1 56 LEU H 1 56 LEU HB2 2.229 . 2.850 2.875 2.824 2.899 0.049 11 0 "[ . 1 . 2]" 2
1196 1 56 LEU HB2 1 56 LEU MD1 2.188 . 2.786 2.124 2.110 2.134 . 0 0 "[ . 1 . 2]" 2
1197 1 56 LEU H 1 56 LEU HB3 2.221 . 2.837 2.185 2.159 2.234 . 0 0 "[ . 1 . 2]" 2
1198 1 56 LEU HB3 1 57 LEU H 2.483 . 3.253 2.739 2.692 2.787 . 0 0 "[ . 1 . 2]" 2
1199 1 56 LEU HB3 1 56 LEU MD2 2.165 . 2.751 2.044 1.921 2.106 . 0 0 "[ . 1 . 2]" 2
1200 1 56 LEU HB3 1 74 VAL HB 3.060 . 4.230 4.266 4.244 4.298 0.068 12 0 "[ . 1 . 2]" 2
1201 1 80 SER H 1 80 SER QB 2.592 . 3.154 2.301 2.173 2.379 . 0 0 "[ . 1 . 2]" 2
1202 1 80 SER QB 1 81 LYS H 2.385 . 3.096 1.965 1.860 2.909 . 0 0 "[ . 1 . 2]" 2
1203 1 35 TYR QE 1 80 SER QB 2.968 . 4.069 3.891 3.872 3.929 . 0 0 "[ . 1 . 2]" 2
1204 1 80 SER HA 1 80 SER QB 2.151 . 2.729 2.322 2.154 2.396 . 0 0 "[ . 1 . 2]" 2
1205 1 33 VAL HB 1 80 SER QB 3.047 . 4.207 2.814 2.538 2.939 . 0 0 "[ . 1 . 2]" 2
1206 1 80 SER QB 1 86 LEU HG 2.613 . 3.211 2.077 1.822 2.215 . 0 0 "[ . 1 . 2]" 2
1207 1 80 SER QB 1 82 ASN H 3.048 . 4.209 2.715 2.505 3.115 . 0 0 "[ . 1 . 2]" 2
1208 1 80 SER QB 1 84 GLU H 2.892 . 3.937 3.440 3.250 3.790 . 0 0 "[ . 1 . 2]" 2
1209 1 80 SER QB 1 84 GLU HB2 3.063 . 4.235 3.933 3.648 4.111 . 0 0 "[ . 1 . 2]" 2
1210 1 45 ILE HA 1 46 VAL H 2.934 . 4.010 3.547 3.539 3.559 . 0 0 "[ . 1 . 2]" 2
1211 1 45 ILE H 1 45 ILE HA 2.420 . 3.152 2.721 2.716 2.726 . 0 0 "[ . 1 . 2]" 2
1212 1 45 ILE HA 1 48 PHE H 3.067 . 4.243 3.904 3.888 3.926 . 0 0 "[ . 1 . 2]" 2
1213 1 22 PHE QD 1 45 ILE HA 3.011 . 4.144 4.175 4.159 4.197 0.053 18 0 "[ . 1 . 2]" 2
1214 1 45 ILE HA 1 48 PHE HD1 2.088 . 2.633 2.694 2.684 2.717 0.084 18 0 "[ . 1 . 2]" 2
1215 1 22 PHE HZ 1 45 ILE HA 2.607 . 3.457 3.004 2.917 3.078 . 0 0 "[ . 1 . 2]" 2
1216 1 45 ILE HA 1 48 PHE QE 2.855 . 3.874 3.872 3.848 3.904 0.030 18 0 "[ . 1 . 2]" 2
1217 1 45 ILE HA 1 45 ILE HG13 2.219 . 2.835 2.477 2.445 2.503 . 0 0 "[ . 1 . 2]" 2
1218 1 45 ILE HA 1 45 ILE HB 2.177 . 2.769 2.441 2.432 2.450 . 0 0 "[ . 1 . 2]" 2
1219 1 45 ILE HA 1 45 ILE MG 2.357 . 3.051 3.172 3.167 3.175 0.124 6 0 "[ . 1 . 2]" 2
1220 1 16 HIS HE1 1 61 PHE QD 2.709 . 3.626 2.813 2.642 2.845 . 0 0 "[ . 1 . 2]" 2
1221 1 16 HIS HE1 1 61 PHE QE 2.631 . 3.497 3.433 3.373 3.520 0.023 17 0 "[ . 1 . 2]" 2
1222 1 16 HIS HE1 1 18 ILE HA 3.052 . 4.216 3.986 3.945 4.050 . 0 0 "[ . 1 . 2]" 2
1223 1 16 HIS HE1 1 103 ILE HG13 3.012 . 4.146 4.222 4.208 4.250 0.104 17 0 "[ . 1 . 2]" 2
1224 1 16 HIS HE1 1 103 ILE MD 2.161 . 2.711 2.598 2.575 2.613 . 0 0 "[ . 1 . 2]" 2
1225 1 16 HIS HE1 1 103 ILE MG 2.231 . 2.853 2.211 2.153 2.275 . 0 0 "[ . 1 . 2]" 2
1226 1 16 HIS HE1 1 103 ILE HB 2.479 . 3.247 2.137 2.092 2.190 . 0 0 "[ . 1 . 2]" 2
1227 1 67 LEU H 1 67 LEU HB2 2.280 . 2.930 2.552 2.518 2.594 . 0 0 "[ . 1 . 2]" 2
1228 1 67 LEU HB2 1 68 LYS H 3.015 . 4.151 3.549 3.428 3.675 . 0 0 "[ . 1 . 2]" 2
1229 1 67 LEU HA 1 67 LEU HB2 2.308 . 2.974 3.009 3.007 3.012 0.038 15 0 "[ . 1 . 2]" 2
1230 1 67 LEU HB3 1 68 LYS H 3.091 . 4.286 4.352 4.318 4.386 0.100 9 0 "[ . 1 . 2]" 2
1231 1 67 LEU HA 1 67 LEU HB3 2.183 . 2.779 2.397 2.383 2.406 . 0 0 "[ . 1 . 2]" 2
1232 1 32 THR H 1 32 THR HA 2.299 . 2.960 2.883 2.865 2.896 . 0 0 "[ . 1 . 2]" 2
1233 1 32 THR HA 1 33 VAL MG1 2.980 . 4.090 4.107 4.092 4.122 0.032 8 0 "[ . 1 . 2]" 2
1234 1 94 THR H 1 94 THR HA 2.450 . 3.200 2.702 2.688 2.736 . 0 0 "[ . 1 . 2]" 2
1235 1 94 THR HA 1 103 ILE HG13 2.831 . 3.833 3.859 3.833 3.883 0.050 9 0 "[ . 1 . 2]" 2
1236 1 21 ILE MG 1 22 PHE H 2.131 . 2.699 2.643 2.594 2.682 . 0 0 "[ . 1 . 2]" 2
1237 1 21 ILE MG 1 42 GLY H 2.343 . 3.029 2.999 2.964 3.051 0.022 18 0 "[ . 1 . 2]" 2
1238 1 21 ILE MG 1 43 LYS H 2.626 . 3.488 3.368 3.292 3.442 . 0 0 "[ . 1 . 2]" 2
1239 1 17 ASN HD22 1 21 ILE MG 2.719 . 3.643 3.207 2.961 3.480 . 0 0 "[ . 1 . 2]" 2
1240 1 21 ILE HA 1 21 ILE MG 2.100 . 2.651 2.300 2.282 2.320 . 0 0 "[ . 1 . 2]" 2
1241 1 21 ILE MG 1 42 GLY HA2 2.062 . 2.594 2.248 2.187 2.329 . 0 0 "[ . 1 . 2]" 2
1242 1 21 ILE MG 1 22 PHE HB2 2.739 . 3.677 3.884 3.864 3.895 0.218 20 0 "[ . 1 . 2]" 2
1243 1 21 ILE HB 1 21 ILE MG 1.858 . 2.290 2.111 2.103 2.119 . 0 0 "[ . 1 . 2]" 2
1244 1 21 ILE HG13 1 21 ILE MG 2.079 . 2.619 2.598 2.549 2.624 0.005 18 0 "[ . 1 . 2]" 2
1245 1 35 TYR HB3 1 36 GLN H 2.665 . 3.553 3.530 3.466 3.569 0.016 19 0 "[ . 1 . 2]" 2
1246 1 35 TYR H 1 35 TYR HB3 2.683 . 3.583 3.551 3.545 3.558 . 0 0 "[ . 1 . 2]" 2
1247 1 35 TYR HB3 1 39 GLU HB3 2.590 . 3.429 1.771 1.744 1.813 0.007 1 0 "[ . 1 . 2]" 2
1248 1 35 TYR HB2 1 35 TYR QD 2.334 . 3.015 2.256 2.246 2.266 . 0 0 "[ . 1 . 2]" 2
1249 1 35 TYR HB2 1 39 GLU HB3 2.723 . 3.650 3.485 3.448 3.545 . 0 0 "[ . 1 . 2]" 2
1250 1 16 HIS HD1 1 103 ILE HB 3.085 . 4.274 2.594 2.559 2.641 . 0 0 "[ . 1 . 2]" 2
1251 1 103 ILE H 1 103 ILE HB 2.511 . 3.299 2.889 2.869 2.924 . 0 0 "[ . 1 . 2]" 2
1252 1 103 ILE HA 1 103 ILE HB 2.640 . 3.511 3.021 3.019 3.023 . 0 0 "[ . 1 . 2]" 2
1253 1 94 THR HA 1 104 GLU H 2.558 . 3.376 3.359 3.265 3.436 0.060 7 0 "[ . 1 . 2]" 2
1254 1 94 THR HA 1 95 ALA H 1.935 . 2.403 2.079 2.063 2.089 . 0 0 "[ . 1 . 2]" 2
1255 1 91 SER HB3 1 106 ILE H 2.882 . 3.920 3.221 3.169 3.273 . 0 0 "[ . 1 . 2]" 2
1256 1 91 SER HA 1 91 SER HB3 2.430 . 3.168 2.731 2.716 2.747 . 0 0 "[ . 1 . 2]" 2
1257 1 91 SER HB3 1 106 ILE HB 2.191 . 2.791 2.845 2.835 2.856 0.065 12 0 "[ . 1 . 2]" 2
1258 1 65 VAL H 1 65 VAL HA 2.177 . 2.769 2.862 2.853 2.871 0.102 16 0 "[ . 1 . 2]" 2
1259 1 65 VAL HA 1 65 VAL HB 2.042 . 2.563 2.513 2.504 2.522 . 0 0 "[ . 1 . 2]" 2
1260 1 65 VAL HA 1 68 LYS QG 2.905 . 3.960 3.753 3.427 3.881 . 0 0 "[ . 1 . 2]" 2
1261 1 16 HIS HD1 1 18 ILE HA 2.961 . 4.057 3.823 3.776 3.924 . 0 0 "[ . 1 . 2]" 2
1262 1 18 ILE HA 1 19 GLU H 2.711 . 3.629 3.518 3.500 3.538 . 0 0 "[ . 1 . 2]" 2
1263 1 18 ILE HA 1 61 PHE QB 2.507 . 3.292 2.630 2.551 2.678 . 0 0 "[ . 1 . 2]" 2
1264 1 18 ILE HA 1 18 ILE HG13 2.355 . 3.048 3.002 2.951 3.048 . 16 0 "[ . 1 . 2]" 2
1265 1 18 ILE HA 1 103 ILE HG13 2.783 . 3.751 3.820 3.801 3.835 0.084 11 0 "[ . 1 . 2]" 2
1266 1 75 MET ME 1 89 ARG H 3.020 . 4.160 4.174 3.567 4.217 0.057 8 0 "[ . 1 . 2]" 2
1267 1 75 MET HA 1 75 MET ME 2.621 . 3.480 3.461 2.944 3.499 0.019 14 0 "[ . 1 . 2]" 2
1268 1 75 MET ME 1 89 ARG HA 3.016 . 4.153 3.891 3.464 3.964 . 0 0 "[ . 1 . 2]" 2
1269 1 75 MET ME 1 87 TRP HA 3.091 . 4.285 3.994 3.406 4.119 . 0 0 "[ . 1 . 2]" 2
1270 1 75 MET ME 1 89 ARG QD 2.328 . 3.006 2.831 2.691 3.019 0.013 5 0 "[ . 1 . 2]" 2
1271 1 75 MET ME 1 110 ASN HB3 2.675 . 3.569 2.487 2.241 2.904 . 0 0 "[ . 1 . 2]" 2
1272 1 75 MET ME 1 75 MET HG3 2.539 . 3.345 3.377 3.358 3.384 0.039 18 0 "[ . 1 . 2]" 2
1273 1 75 MET ME 1 75 MET HG2 2.686 . 3.588 2.416 2.395 2.456 . 0 0 "[ . 1 . 2]" 2
1274 1 75 MET ME 1 110 ASN HB2 2.823 . 3.819 2.379 1.899 2.616 . 0 0 "[ . 1 . 2]" 2
1275 1 44 ASN H 1 44 ASN HB3 2.255 . 2.891 2.716 2.670 2.773 . 0 0 "[ . 1 . 2]" 2
1276 1 44 ASN HB3 1 46 VAL H 3.093 . 4.289 3.934 3.840 4.089 . 0 0 "[ . 1 . 2]" 2
1277 1 44 ASN HB3 1 44 ASN HD21 2.456 . 3.210 3.382 3.362 3.396 0.186 11 0 "[ . 1 . 2]" 2
1278 1 44 ASN HB3 1 47 GLU HB3 2.812 . 3.800 3.760 3.691 3.801 0.001 3 0 "[ . 1 . 2]" 2
1279 1 59 ASP HA 1 59 ASP HB3 2.239 . 2.866 3.012 3.009 3.014 0.148 19 0 "[ . 1 . 2]" 2
1280 1 59 ASP H 1 59 ASP HB2 2.220 . 2.836 2.513 2.466 2.585 . 0 0 "[ . 1 . 2]" 2
1281 1 56 LEU HA 1 59 ASP HB2 2.427 . 3.163 2.931 2.832 3.079 . 0 0 "[ . 1 . 2]" 2
1282 1 44 ASN H 1 44 ASN HB2 2.330 . 3.009 2.383 2.322 2.470 . 0 0 "[ . 1 . 2]" 2
1283 1 44 ASN HB2 1 44 ASN HD21 2.426 . 3.162 2.151 2.138 2.166 . 0 0 "[ . 1 . 2]" 2
1284 1 44 ASN HB2 1 44 ASN HD22 2.607 . 3.457 3.439 3.435 3.445 . 0 0 "[ . 1 . 2]" 2
1285 1 44 ASN HA 1 44 ASN HB2 2.554 . 3.370 2.586 2.565 2.619 . 0 0 "[ . 1 . 2]" 2
1286 1 44 ASN HB2 1 47 GLU H 2.947 . 4.033 4.108 4.090 4.119 0.086 7 0 "[ . 1 . 2]" 2
1287 1 45 ILE MG 1 46 VAL H 2.219 . 2.835 1.929 1.813 1.972 . 0 0 "[ . 1 . 2]" 2
1288 1 45 ILE H 1 45 ILE MG 2.080 . 2.621 2.052 2.028 2.070 . 0 0 "[ . 1 . 2]" 2
1289 1 45 ILE MG 1 61 PHE QE 2.152 . 2.731 2.086 2.048 2.303 . 0 0 "[ . 1 . 2]" 2
1290 1 45 ILE MG 1 61 PHE HZ 2.241 . 2.869 2.314 2.230 2.508 . 0 0 "[ . 1 . 2]" 2
1291 1 20 GLY HA2 1 45 ILE MG 2.305 . 2.969 2.476 2.434 2.558 . 0 0 "[ . 1 . 2]" 2
1292 1 44 ASN HA 1 45 ILE MG 2.627 . 3.490 3.558 3.536 3.589 0.099 17 0 "[ . 1 . 2]" 2
1293 1 20 GLY HA3 1 45 ILE MG 2.298 . 2.958 1.771 1.749 1.798 . 0 0 "[ . 1 . 2]" 2
1294 1 45 ILE HG13 1 45 ILE MG 2.376 . 3.082 3.179 3.175 3.181 0.099 2 0 "[ . 1 . 2]" 2
1295 1 45 ILE MG 1 57 LEU QD 2.231 . 2.853 2.078 1.878 2.154 . 0 0 "[ . 1 . 2]" 2
1296 1 22 PHE QE 1 45 ILE MG 2.758 . 3.709 3.700 3.649 3.723 0.014 12 0 "[ . 1 . 2]" 2
1297 1 22 PHE HB2 1 42 GLY H 2.675 . 3.569 2.556 2.495 2.635 . 0 0 "[ . 1 . 2]" 2
1298 1 110 ASN H 1 110 ASN HB3 2.403 . 3.125 2.797 2.555 2.959 . 0 0 "[ . 1 . 2]" 2
1299 1 110 ASN HB3 1 110 ASN HD21 2.602 . 3.449 3.080 2.285 3.459 0.010 6 0 "[ . 1 . 2]" 2
1300 1 110 ASN HB3 1 110 ASN HD22 2.934 . 4.010 3.860 3.493 4.045 0.035 6 0 "[ . 1 . 2]" 2
1301 1 87 TRP HB2 1 110 ASN HB3 2.802 . 3.783 3.372 2.970 3.518 . 0 0 "[ . 1 . 2]" 2
1302 1 22 PHE HB3 1 23 THR H 2.992 . 4.111 3.734 3.679 3.804 . 0 0 "[ . 1 . 2]" 2
1303 1 101 ASP QB 1 102 GLU H 2.954 . 4.045 3.441 3.115 3.967 . 0 0 "[ . 1 . 2]" 2
1304 1 13 ILE HB 1 13 ILE HG13 2.482 . 3.252 2.670 2.625 2.702 . 0 0 "[ . 1 . 2]" 2
1305 1 13 ILE H 1 13 ILE HB 2.317 . 2.988 2.578 2.559 2.615 . 0 0 "[ . 1 . 2]" 2
1306 1 13 ILE HA 1 13 ILE HB 2.642 . 3.515 3.014 3.012 3.017 . 0 0 "[ . 1 . 2]" 2
1307 1 110 ASN HA 1 110 ASN HB3 2.421 . 3.154 3.012 2.984 3.023 . 0 0 "[ . 1 . 2]" 2
1308 1 110 ASN H 1 110 ASN HB2 2.434 . 3.175 2.857 2.434 3.051 . 0 0 "[ . 1 . 2]" 2
1309 1 110 ASN HB2 1 110 ASN HD21 2.708 . 3.625 2.222 2.120 2.803 . 0 0 "[ . 1 . 2]" 2
1310 1 88 MET HA 1 110 ASN HB2 2.992 . 4.111 3.211 3.055 3.363 . 0 0 "[ . 1 . 2]" 2
1311 1 110 ASN HA 1 110 ASN HB2 2.346 . 3.034 2.559 2.469 2.656 . 0 0 "[ . 1 . 2]" 2
1312 1 87 TRP HB3 1 110 ASN HB2 2.904 . 3.958 3.683 2.771 3.998 0.040 4 0 "[ . 1 . 2]" 2
1313 1 100 SER H 1 100 SER HB3 2.488 . 3.262 2.565 2.489 2.837 . 0 0 "[ . 1 . 2]" 2
1314 1 100 SER HB3 1 101 ASP H 2.871 . 3.901 2.836 2.581 4.167 0.266 9 0 "[ . 1 . 2]" 2
1315 1 60 SER QB 1 61 PHE H 3.005 . 4.134 2.824 2.252 3.182 . 0 0 "[ . 1 . 2]" 2
1316 1 60 SER QB 1 74 VAL MG1 2.357 . 3.052 1.891 1.838 2.173 . 0 0 "[ . 1 . 2]" 2
1317 1 100 SER H 1 100 SER HB2 2.377 . 3.083 2.589 2.496 3.480 0.397 9 0 "[ . 1 . 2]" 2
1318 1 100 SER HA 1 100 SER HB2 2.095 . 2.643 2.464 2.428 2.642 . 0 0 "[ . 1 . 2]" 2
1319 1 97 ASN HA 1 100 SER HB2 2.804 . 3.787 3.047 2.562 4.486 0.699 9 1 "[ . +1 . 2]" 2
1320 1 48 PHE HB3 1 48 PHE HD2 2.440 . 3.184 2.356 2.348 2.362 . 0 0 "[ . 1 . 2]" 2
1321 1 48 PHE HA 1 48 PHE HB3 2.550 . 3.363 2.481 2.476 2.487 . 0 0 "[ . 1 . 2]" 2
1322 1 48 PHE H 1 48 PHE HB2 2.665 . 3.553 2.469 2.454 2.486 . 0 0 "[ . 1 . 2]" 2
1323 1 16 HIS HD1 1 103 ILE MD 2.566 . 3.389 3.281 3.212 3.322 . 0 0 "[ . 1 . 2]" 2
1324 1 18 ILE H 1 103 ILE MD 2.926 . 3.996 3.644 3.564 3.672 . 0 0 "[ . 1 . 2]" 2
1325 1 18 ILE HA 1 103 ILE MD 2.032 . 2.548 1.904 1.867 1.930 . 0 0 "[ . 1 . 2]" 2
1326 1 61 PHE QB 1 103 ILE MD 2.077 . 2.616 1.898 1.859 1.935 . 0 0 "[ . 1 . 2]" 2
1327 1 65 VAL HB 1 103 ILE MD 2.879 . 3.915 2.053 2.014 2.094 . 0 0 "[ . 1 . 2]" 2
1328 1 103 ILE HB 1 103 ILE MD 2.036 . 2.554 2.374 2.341 2.404 . 0 0 "[ . 1 . 2]" 2
1329 1 39 GLU HA 1 39 GLU QG 2.299 . 2.960 2.299 2.090 2.815 . 0 0 "[ . 1 . 2]" 2
1330 1 36 GLN QB 1 39 GLU QG 2.854 . 3.872 3.685 3.583 3.730 . 0 0 "[ . 1 . 2]" 2
1331 1 35 TYR QD 1 39 GLU QG 2.854 . 2.998 2.231 2.092 2.331 . 0 0 "[ . 1 . 2]" 2
1332 1 36 GLN H 1 39 GLU QG 2.986 . 4.101 3.362 3.100 3.525 . 0 0 "[ . 1 . 2]" 2
1333 1 13 ILE H 1 13 ILE HA 2.796 . 3.773 2.871 2.855 2.877 . 0 0 "[ . 1 . 2]" 2
1334 1 13 ILE HA 1 14 SER H 2.089 . 2.635 2.160 2.148 2.173 . 0 0 "[ . 1 . 2]" 2
1335 1 13 ILE HA 1 107 ILE H 2.598 . 3.442 3.498 3.482 3.510 0.068 6 0 "[ . 1 . 2]" 2
1336 1 6 VAL HA 1 6 VAL HB 2.317 . 2.988 2.503 2.327 3.004 0.016 11 0 "[ . 1 . 2]" 2
1337 1 6 VAL HA 1 6 VAL QG 1.992 . 2.488 2.262 2.122 2.398 . 0 0 "[ . 1 . 2]" 2
1338 1 18 ILE MD 1 62 GLN H 2.869 . 3.898 3.077 3.023 3.121 . 0 0 "[ . 1 . 2]" 2
1339 1 18 ILE MD 1 61 PHE QD 3.018 . 4.157 3.663 3.589 3.701 . 0 0 "[ . 1 . 2]" 2
1340 1 18 ILE MD 1 62 GLN HA 2.108 . 2.663 1.995 1.964 2.021 . 0 0 "[ . 1 . 2]" 2
1341 1 18 ILE HA 1 18 ILE MD 2.311 . 2.979 1.955 1.929 1.983 . 0 0 "[ . 1 . 2]" 2
1342 1 18 ILE MD 1 61 PHE QB 2.532 . 3.334 1.832 1.803 1.882 . 0 0 "[ . 1 . 2]" 2
1343 1 18 ILE MD 1 62 GLN HG2 2.722 . 3.648 2.282 2.158 2.347 . 0 0 "[ . 1 . 2]" 2
1344 1 18 ILE MD 1 65 VAL HB 2.339 . 3.023 2.591 2.460 2.723 . 0 0 "[ . 1 . 2]" 2
1345 1 18 ILE HB 1 18 ILE MD 2.126 . 2.691 2.414 2.396 2.436 . 0 0 "[ . 1 . 2]" 2
1346 1 18 ILE MD 1 18 ILE HG13 1.837 . 2.259 2.116 2.115 2.117 . 0 0 "[ . 1 . 2]" 2
1347 1 18 ILE MD 1 18 ILE HG12 1.879 . 2.320 2.111 2.109 2.112 . 0 0 "[ . 1 . 2]" 2
1348 1 17 ASN HB2 1 17 ASN HD22 2.864 . 3.889 3.698 3.414 4.017 0.128 18 0 "[ . 1 . 2]" 2
1349 1 17 ASN HB2 1 18 ILE H 2.416 . 3.146 2.205 2.171 2.269 . 0 0 "[ . 1 . 2]" 2
1350 1 17 ASN H 1 17 ASN HB2 2.863 . 3.887 3.612 3.423 3.703 . 0 0 "[ . 1 . 2]" 2
1351 1 17 ASN HB2 1 17 ASN HD21 2.572 . 3.399 2.747 2.100 3.447 0.048 18 0 "[ . 1 . 2]" 2
1352 1 17 ASN HA 1 17 ASN HB2 2.332 . 3.012 2.529 2.380 2.760 . 0 0 "[ . 1 . 2]" 2
1353 1 17 ASN HB2 1 18 ILE MG 2.900 . 3.951 2.968 2.921 3.132 . 0 0 "[ . 1 . 2]" 2
1354 1 17 ASN H 1 17 ASN HB3 2.682 . 3.581 2.919 2.715 3.352 . 0 0 "[ . 1 . 2]" 2
1355 1 17 ASN HB3 1 17 ASN HD21 2.536 . 3.340 2.400 2.240 3.145 . 0 0 "[ . 1 . 2]" 2
1356 1 17 ASN HA 1 17 ASN HB3 2.317 . 2.988 2.405 2.257 2.543 . 0 0 "[ . 1 . 2]" 2
1357 1 17 ASN HB3 1 17 ASN HD22 2.789 . 3.761 3.548 3.466 3.876 0.115 15 0 "[ . 1 . 2]" 2
1358 1 35 TYR HB3 1 39 GLU QG 3.031 . 4.179 3.452 3.300 3.581 . 0 0 "[ . 1 . 2]" 2
1359 1 106 ILE H 1 106 ILE HB 2.337 . 3.020 2.487 2.468 2.501 . 0 0 "[ . 1 . 2]" 2
1360 1 91 SER H 1 106 ILE HB 2.704 . 3.618 3.170 3.142 3.204 . 0 0 "[ . 1 . 2]" 2
1361 1 106 ILE HA 1 106 ILE HB 2.699 . 3.610 3.021 3.018 3.023 . 0 0 "[ . 1 . 2]" 2
1362 1 91 SER HB2 1 106 ILE HB 2.345 . 3.032 1.711 1.677 1.758 . 0 0 "[ . 1 . 2]" 2
1363 1 106 ILE HB 1 106 ILE HG12 2.464 . 3.223 2.566 2.557 2.576 . 0 0 "[ . 1 . 2]" 2
1364 1 106 ILE HB 1 106 ILE MD 2.250 . 2.883 2.322 2.306 2.343 . 0 0 "[ . 1 . 2]" 2
1365 1 60 SER HA 1 63 GLN H 2.635 . 3.503 3.362 3.338 3.389 . 0 0 "[ . 1 . 2]" 2
1366 1 60 SER HA 1 63 GLN HB2 2.313 . 2.982 2.770 2.694 2.829 . 0 0 "[ . 1 . 2]" 2
1367 1 60 SER H 1 60 SER HA 2.366 . 3.065 2.759 2.753 2.770 . 0 0 "[ . 1 . 2]" 2
1368 1 60 SER HA 1 62 GLN H 2.999 . 4.123 4.192 4.174 4.206 0.083 19 0 "[ . 1 . 2]" 2
1369 1 60 SER HA 1 61 PHE H 2.837 . 3.843 3.564 3.560 3.568 . 0 0 "[ . 1 . 2]" 2
1370 1 104 GLU H 1 104 GLU HG3 3.042 . 4.199 4.292 4.264 4.433 0.234 7 0 "[ . 1 . 2]" 2
1371 1 104 GLU HG3 1 105 THR H 2.848 . 3.862 3.825 3.316 3.893 0.031 1 0 "[ . 1 . 2]" 2
1372 1 104 GLU HA 1 104 GLU HG3 2.541 . 3.348 2.422 2.365 2.639 . 0 0 "[ . 1 . 2]" 2
1373 1 104 GLU HG3 1 106 ILE MD 2.929 . 4.001 3.910 3.077 4.015 0.014 10 0 "[ . 1 . 2]" 2
1374 1 104 GLU HG2 1 105 THR H 2.879 . 3.915 3.584 3.393 3.924 0.009 7 0 "[ . 1 . 2]" 2
1375 1 104 GLU HA 1 104 GLU HG2 2.562 . 3.382 2.931 2.851 3.427 0.045 7 0 "[ . 1 . 2]" 2
1376 1 104 GLU HB3 1 104 GLU HG2 2.231 . 2.853 2.414 2.352 2.484 . 0 0 "[ . 1 . 2]" 2
1377 1 13 ILE MG 1 104 GLU HG2 2.434 . 3.175 2.306 2.230 2.942 . 0 0 "[ . 1 . 2]" 2
1378 1 104 GLU HG2 1 106 ILE MD 2.774 . 3.736 2.470 2.213 2.538 . 0 0 "[ . 1 . 2]" 2
1379 1 18 ILE H 1 18 ILE HB 2.151 . 2.729 2.509 2.492 2.532 . 0 0 "[ . 1 . 2]" 2
1380 1 18 ILE HA 1 18 ILE HB 2.032 . 2.548 2.451 2.439 2.463 . 0 0 "[ . 1 . 2]" 2
1381 1 18 ILE HB 1 18 ILE HG13 2.289 . 2.944 3.018 3.016 3.021 0.077 14 0 "[ . 1 . 2]" 2
1382 1 18 ILE HB 1 18 ILE HG12 2.472 . 3.236 2.477 2.458 2.493 . 0 0 "[ . 1 . 2]" 2
1383 1 18 ILE HB 1 103 ILE MD 2.606 . 3.455 3.132 3.076 3.196 . 0 0 "[ . 1 . 2]" 2
1384 1 16 HIS HE2 1 105 THR HA 3.084 . 4.273 4.296 4.284 4.303 0.030 17 0 "[ . 1 . 2]" 2
1385 1 91 SER H 1 105 THR HA 2.984 . 4.097 3.601 3.543 3.726 . 0 0 "[ . 1 . 2]" 2
1386 1 23 THR HA 1 24 PHE H 2.688 . 3.591 3.241 3.205 3.264 . 0 0 "[ . 1 . 2]" 2
1387 1 23 THR HA 1 41 LEU MD2 2.390 . 3.104 3.085 3.003 3.142 0.038 18 0 "[ . 1 . 2]" 2
1388 1 23 THR H 1 23 THR HA 2.649 . 3.526 2.903 2.892 2.909 . 0 0 "[ . 1 . 2]" 2
1389 1 15 ARG H 1 25 VAL HA 2.845 . 3.857 3.307 3.140 3.394 . 0 0 "[ . 1 . 2]" 2
1390 1 25 VAL HA 1 26 ASP HB3 2.982 . 4.093 4.225 4.199 4.266 0.173 15 0 "[ . 1 . 2]" 2
1391 1 25 VAL HA 1 26 ASP H 2.031 . 2.547 2.087 2.080 2.095 . 0 0 "[ . 1 . 2]" 2
1392 1 25 VAL H 1 25 VAL HA 2.580 . 3.412 2.905 2.900 2.913 . 0 0 "[ . 1 . 2]" 2
1393 1 14 SER HA 1 25 VAL HA 2.296 . 2.955 1.967 1.888 2.008 . 0 0 "[ . 1 . 2]" 2
1394 1 25 VAL HA 1 25 VAL HB 2.543 . 3.351 3.007 3.003 3.011 . 0 0 "[ . 1 . 2]" 2
1395 1 13 ILE H 1 13 ILE MD 2.606 . 3.455 3.059 2.952 3.185 . 0 0 "[ . 1 . 2]" 2
1396 1 13 ILE MD 1 26 ASP HB2 3.049 . 4.211 3.360 3.234 3.435 . 0 0 "[ . 1 . 2]" 2
1397 1 13 ILE MD 1 26 ASP HB3 2.961 . 4.057 4.101 4.085 4.111 0.054 15 0 "[ . 1 . 2]" 2
1398 1 13 ILE MD 1 13 ILE HG13 1.830 . 2.249 2.118 2.117 2.119 . 0 0 "[ . 1 . 2]" 2
1399 1 93 GLN H 1 105 THR HA 2.689 . 3.593 3.495 3.412 3.543 . 0 0 "[ . 1 . 2]" 2
1400 1 105 THR HA 1 106 ILE H 2.089 . 2.634 2.137 2.127 2.157 . 0 0 "[ . 1 . 2]" 2
1401 1 92 SER HA 1 105 THR HA 2.226 . 2.846 2.044 2.016 2.104 . 0 0 "[ . 1 . 2]" 2
1402 1 103 ILE MG 1 105 THR HA 2.973 . 4.078 3.769 3.737 3.805 . 0 0 "[ . 1 . 2]" 2
1403 1 10 THR HA 1 109 THR H 2.988 . 4.104 3.749 3.609 3.986 . 0 0 "[ . 1 . 2]" 2
1404 1 10 THR H 1 10 THR HA 2.530 . 3.330 2.746 2.674 2.786 . 0 0 "[ . 1 . 2]" 2
1405 1 10 THR HA 1 109 THR MG 2.770 . 3.729 3.678 3.525 3.757 0.028 20 0 "[ . 1 . 2]" 2
1406 1 23 THR HA 1 23 THR MG 1.859 . 2.291 2.359 2.321 2.380 0.089 18 0 "[ . 1 . 2]" 2
1407 1 107 ILE HA 1 108 CYS H 2.030 . 2.545 2.174 2.164 2.187 . 0 0 "[ . 1 . 2]" 2
1408 1 107 ILE HA 1 107 ILE HG12 2.579 . 3.410 2.539 2.520 2.562 . 0 0 "[ . 1 . 2]" 2
1409 1 107 ILE HA 1 107 ILE MD 2.750 . 3.695 3.816 3.807 3.828 0.133 18 0 "[ . 1 . 2]" 2
1410 1 52 GLU H 1 52 GLU QG 2.185 . 2.782 2.104 2.028 2.217 . 0 0 "[ . 1 . 2]" 2
1411 1 22 PHE HZ 1 107 ILE MD 2.272 . 2.917 2.391 2.331 2.441 . 0 0 "[ . 1 . 2]" 2
1412 1 12 PHE QE 1 107 ILE MD 2.219 . 2.835 2.680 2.660 2.717 . 0 0 "[ . 1 . 2]" 2
1413 1 14 SER QB 1 107 ILE MD 2.412 . 3.139 2.874 2.860 2.912 . 0 0 "[ . 1 . 2]" 2
1414 1 57 LEU QD 1 107 ILE MD 2.807 . 3.792 3.593 3.559 3.618 . 0 0 "[ . 1 . 2]" 2
1415 1 107 ILE H 1 107 ILE MD 2.592 . 3.432 3.527 3.506 3.550 0.118 13 0 "[ . 1 . 2]" 2
1416 1 105 THR HA 1 106 ILE MD 2.883 . 3.922 2.964 2.851 3.065 . 0 0 "[ . 1 . 2]" 2
1417 1 106 ILE H 1 106 ILE MD 2.450 . 3.200 2.019 1.923 2.091 . 0 0 "[ . 1 . 2]" 2
1418 1 106 ILE HA 1 106 ILE MD 2.325 . 3.001 3.014 2.980 3.029 0.028 18 0 "[ . 1 . 2]" 2
1419 1 91 SER HB3 1 106 ILE MD 2.394 . 3.110 2.419 2.348 2.507 . 0 0 "[ . 1 . 2]" 2
1420 1 91 SER HB2 1 106 ILE MD 2.451 . 3.202 2.856 2.801 2.903 . 0 0 "[ . 1 . 2]" 2
1421 1 45 ILE MD 1 90 THR MG 2.675 . 3.570 2.998 2.862 3.093 . 0 0 "[ . 1 . 2]" 2
1422 1 22 PHE QD 1 45 ILE MD 2.970 . 4.073 4.051 3.966 4.083 0.010 6 0 "[ . 1 . 2]" 2
1423 1 22 PHE QE 1 45 ILE MD 2.140 . 2.713 2.011 1.907 2.052 . 0 0 "[ . 1 . 2]" 2
1424 1 22 PHE HZ 1 45 ILE MD 2.130 . 2.697 2.709 2.698 2.718 0.021 17 0 "[ . 1 . 2]" 2
1425 1 45 ILE MD 1 61 PHE QE 2.534 . 3.336 3.037 3.008 3.083 . 0 0 "[ . 1 . 2]" 2
1426 1 45 ILE MD 1 78 PHE QE 3.037 . 4.190 3.785 3.736 3.848 . 0 0 "[ . 1 . 2]" 2
1427 1 16 HIS HD2 1 45 ILE MD 2.773 . 3.734 2.677 2.564 2.725 . 0 0 "[ . 1 . 2]" 2
1428 1 45 ILE MD 1 61 PHE HZ 2.274 . 2.920 1.734 1.680 1.982 . 0 0 "[ . 1 . 2]" 2
1429 1 45 ILE MD 1 105 THR HB 2.846 . 3.859 3.093 3.009 3.154 . 0 0 "[ . 1 . 2]" 2
1430 1 45 ILE MD 1 45 ILE HG13 2.008 . 2.512 2.118 2.116 2.119 . 0 0 "[ . 1 . 2]" 2
1431 1 45 ILE MD 1 107 ILE HG12 2.785 . 3.754 2.723 2.671 2.770 . 0 0 "[ . 1 . 2]" 2
1432 1 45 ILE MD 1 57 LEU QD 2.218 . 2.833 2.247 2.184 2.319 . 0 0 "[ . 1 . 2]" 2
1433 1 76 PHE H 1 76 PHE HD1 2.276 . 2.924 2.475 2.426 2.514 . 0 0 "[ . 1 . 2]" 2
1434 1 76 PHE QD 1 90 THR H 2.740 . 3.679 3.731 3.718 3.744 0.065 20 0 "[ . 1 . 2]" 2
1435 1 76 PHE QD 1 77 ARG H 2.671 . 3.563 2.982 2.843 3.089 . 0 0 "[ . 1 . 2]" 2
1436 1 76 PHE HB3 1 76 PHE HD1 2.235 . 2.859 2.529 2.518 2.541 . 0 0 "[ . 1 . 2]" 2
1437 1 53 ASP HB2 1 76 PHE QD 3.014 . 4.150 4.167 4.114 4.225 0.075 11 0 "[ . 1 . 2]" 2
1438 1 49 CYS HB2 1 76 PHE QD 2.861 . 3.884 2.558 2.411 2.768 . 0 0 "[ . 1 . 2]" 2
1439 1 76 PHE QD 1 90 THR MG 2.201 . 2.806 2.131 2.099 2.194 . 0 0 "[ . 1 . 2]" 2
1440 1 50 HIS H 1 76 PHE QD 2.897 . 3.946 2.738 2.569 2.830 . 0 0 "[ . 1 . 2]" 2
1441 1 49 CYS HA 1 76 PHE QD 2.479 . 3.247 2.036 1.919 2.128 . 0 0 "[ . 1 . 2]" 2
1442 1 76 PHE QD 1 78 PHE HA 2.990 . 4.107 3.309 3.266 3.352 . 0 0 "[ . 1 . 2]" 2
1443 1 12 PHE H 1 12 PHE QD 2.632 . 3.498 2.852 2.806 2.892 . 0 0 "[ . 1 . 2]" 2
1444 1 12 PHE QD 1 26 ASP H 2.640 . 3.511 2.685 2.641 2.749 . 0 0 "[ . 1 . 2]" 2
1445 1 12 PHE HB3 1 12 PHE QD 2.325 . 3.001 2.366 2.356 2.374 . 0 0 "[ . 1 . 2]" 2
1446 1 12 PHE QD 1 29 CYS HB3 2.789 . 3.762 2.557 2.493 2.582 . 0 0 "[ . 1 . 2]" 2
1447 1 11 GLU HA 1 12 PHE QD 2.889 . 3.932 3.937 3.903 3.973 0.041 20 0 "[ . 1 . 2]" 2
1448 1 35 TYR QD 1 78 PHE QE 2.747 . 3.691 1.879 1.828 1.945 . 0 0 "[ . 1 . 2]" 2
1449 1 82 ASN HB2 1 83 GLN H 3.064 . 4.237 3.680 3.508 4.120 . 0 0 "[ . 1 . 2]" 2
1450 1 82 ASN H 1 82 ASN HB2 2.833 . 3.836 2.600 2.342 3.546 . 0 0 "[ . 1 . 2]" 2
1451 1 82 ASN HB2 1 82 ASN HD21 3.022 . 4.164 2.768 2.157 3.487 . 0 0 "[ . 1 . 2]" 2
1452 1 82 ASN HB2 1 82 ASN HD22 3.079 . 4.264 3.725 3.451 4.060 . 0 0 "[ . 1 . 2]" 2
1453 1 82 ASN HA 1 82 ASN HB2 2.191 . 2.791 2.963 2.617 3.029 0.238 16 0 "[ . 1 . 2]" 2
1454 1 82 ASN HB2 1 84 GLU QG 2.883 . 3.922 2.905 1.970 3.414 . 0 0 "[ . 1 . 2]" 2
1455 1 82 ASN H 1 82 ASN HB3 2.883 . 3.922 3.530 3.006 3.649 . 0 0 "[ . 1 . 2]" 2
1456 1 82 ASN HB3 1 84 GLU QG 2.892 . 3.937 3.004 2.258 3.959 0.022 4 0 "[ . 1 . 2]" 2
1457 1 99 TYR HB2 1 99 TYR QD 2.316 . 2.986 2.294 2.278 2.356 . 0 0 "[ . 1 . 2]" 2
1458 1 52 GLU QG 1 53 ASP H 3.044 . 4.202 4.219 4.156 4.262 0.060 17 0 "[ . 1 . 2]" 2
1459 1 52 GLU HA 1 52 GLU QG 2.001 . 2.502 2.467 2.403 2.605 0.103 14 0 "[ . 1 . 2]" 2
1460 1 52 GLU HB3 1 52 GLU QG 2.064 . 2.597 2.374 2.335 2.471 . 0 0 "[ . 1 . 2]" 2
1461 1 47 GLU HA 1 47 GLU HG2 2.384 . 3.094 2.365 2.351 2.388 . 0 0 "[ . 1 . 2]" 2
1462 1 44 ASN HB3 1 47 GLU HG2 2.632 . 3.498 3.506 3.495 3.518 0.020 11 0 "[ . 1 . 2]" 2
1463 1 46 VAL QG 1 47 GLU HG2 3.049 . 4.211 4.071 4.042 4.124 . 0 0 "[ . 1 . 2]" 2
1464 1 44 ASN H 1 47 GLU HG3 3.062 . 4.234 3.957 3.894 4.061 . 0 0 "[ . 1 . 2]" 2
1465 1 44 ASN HB3 1 47 GLU HG3 2.644 . 3.518 1.840 1.824 1.876 . 0 0 "[ . 1 . 2]" 2
1466 1 47 GLU H 1 47 GLU HG3 2.537 . 3.342 2.880 2.825 2.926 . 0 0 "[ . 1 . 2]" 2
1467 1 47 GLU HA 1 47 GLU HG3 2.385 . 3.096 2.790 2.778 2.804 . 0 0 "[ . 1 . 2]" 2
1468 1 107 ILE H 1 107 ILE HB 2.424 . 3.159 2.457 2.449 2.487 . 0 0 "[ . 1 . 2]" 2
1469 1 12 PHE H 1 107 ILE HB 3.049 . 4.211 3.351 3.317 3.411 . 0 0 "[ . 1 . 2]" 2
1470 1 12 PHE QD 1 107 ILE HB 3.013 . 4.148 3.355 3.285 3.382 . 0 0 "[ . 1 . 2]" 2
1471 1 12 PHE QE 1 107 ILE HB 2.875 . 3.908 2.958 2.883 2.986 . 0 0 "[ . 1 . 2]" 2
1472 1 107 ILE HB 1 107 ILE HG12 2.444 . 3.191 3.021 3.019 3.022 . 0 0 "[ . 1 . 2]" 2
1473 1 15 ARG H 1 22 PHE QD 2.950 . 4.038 4.088 4.028 4.110 0.072 7 0 "[ . 1 . 2]" 2
1474 1 22 PHE H 1 22 PHE QD 2.456 . 3.210 3.297 3.289 3.308 0.098 16 0 "[ . 1 . 2]" 2
1475 1 22 PHE QD 1 43 LYS H 2.786 . 3.756 3.430 3.383 3.494 . 0 0 "[ . 1 . 2]" 2
1476 1 22 PHE QD 1 24 PHE H 2.932 . 4.007 3.836 3.789 3.867 . 0 0 "[ . 1 . 2]" 2
1477 1 22 PHE QD 1 48 PHE QE 2.939 . 4.019 3.908 3.830 3.989 . 0 0 "[ . 1 . 2]" 2
1478 1 22 PHE HA 1 22 PHE QD 2.259 . 2.897 1.910 1.859 1.931 . 0 0 "[ . 1 . 2]" 2
1479 1 14 SER QB 1 22 PHE QD 2.352 . 3.043 3.010 2.765 3.050 0.007 3 0 "[ . 1 . 2]" 2
1480 1 22 PHE QD 1 40 LEU HA 2.820 . 3.814 2.891 2.841 2.942 . 0 0 "[ . 1 . 2]" 2
1481 1 22 PHE QD 1 41 LEU HA 2.800 . 3.780 3.669 3.622 3.724 . 0 0 "[ . 1 . 2]" 2
1482 1 22 PHE HB2 1 22 PHE QD 2.215 . 2.828 2.301 2.291 2.319 . 0 0 "[ . 1 . 2]" 2
1483 1 16 HIS HB3 1 22 PHE QD 2.539 . 3.345 2.001 1.935 2.056 . 0 0 "[ . 1 . 2]" 2
1484 1 22 PHE HB3 1 22 PHE QD 2.230 . 2.851 2.755 2.753 2.759 . 0 0 "[ . 1 . 2]" 2
1485 1 22 PHE QD 1 40 LEU HB2 2.748 . 3.692 3.602 3.580 3.629 . 0 0 "[ . 1 . 2]" 2
1486 1 22 PHE QD 1 40 LEU HB3 2.373 . 3.077 1.989 1.971 2.014 . 0 0 "[ . 1 . 2]" 2
1487 1 99 TYR HB3 1 99 TYR HD1 2.124 . 2.688 2.708 2.505 2.772 0.084 20 0 "[ . 1 . 2]" 2
1488 1 99 TYR H 1 99 TYR HD1 2.477 . 3.244 3.211 2.932 3.978 0.734 4 1 "[ +. 1 . 2]" 2
1489 1 98 PRO HD2 1 99 TYR QD 2.609 . 3.460 3.266 2.712 3.376 . 0 0 "[ . 1 . 2]" 2
1490 1 35 TYR H 1 35 TYR HD2 2.344 . 3.031 3.087 3.060 3.115 0.084 13 0 "[ . 1 . 2]" 2
1491 1 35 TYR QD 1 80 SER HA 2.738 . 3.675 3.036 2.954 3.152 . 0 0 "[ . 1 . 2]" 2
1492 1 33 VAL HB 1 35 TYR HD2 2.382 . 3.091 2.504 2.442 2.542 . 0 0 "[ . 1 . 2]" 2
1493 1 35 TYR HB2 1 35 TYR HD2 2.191 . 2.791 2.275 2.264 2.286 . 0 0 "[ . 1 . 2]" 2
1494 1 35 TYR QD 1 81 LYS HD2 2.586 . 3.422 2.060 1.973 2.106 . 0 0 "[ . 1 . 2]" 2
1495 1 35 TYR QD 1 81 LYS HB2 2.737 . 3.673 3.430 3.370 3.541 . 0 0 "[ . 1 . 2]" 2
1496 1 35 TYR HD2 1 40 LEU QD 2.550 . 3.363 2.535 2.467 2.593 . 0 0 "[ . 1 . 2]" 2
1497 1 95 ALA MB 1 99 TYR HB3 2.553 . 3.368 3.297 3.193 3.420 0.052 3 0 "[ . 1 . 2]" 2
1498 1 99 TYR H 1 99 TYR HB3 2.720 . 3.645 3.551 3.480 3.638 . 0 0 "[ . 1 . 2]" 2
1499 1 99 TYR HB3 1 99 TYR QD 2.297 . 2.956 2.613 2.460 2.657 . 0 0 "[ . 1 . 2]" 2
1500 1 99 TYR HA 1 99 TYR HB3 2.420 . 3.152 2.256 2.215 2.316 . 0 0 "[ . 1 . 2]" 2
1501 1 99 TYR HB3 1 102 GLU QG 3.021 . 4.161 1.974 1.833 2.237 0.048 16 0 "[ . 1 . 2]" 2
1502 1 95 ALA MB 1 99 TYR HB2 2.522 . 3.317 1.992 1.917 2.103 . 0 0 "[ . 1 . 2]" 2
1503 1 100 SER HA 1 102 GLU H 2.644 . 3.518 3.529 3.350 3.573 0.055 2 0 "[ . 1 . 2]" 2
1504 1 100 SER H 1 100 SER HA 2.282 . 2.933 2.785 2.768 2.793 . 0 0 "[ . 1 . 2]" 2
1505 1 95 ALA MB 1 100 SER HA 2.291 . 2.947 3.038 2.985 3.092 0.145 9 0 "[ . 1 . 2]" 2
1506 1 95 ALA H 1 103 ILE HA 2.409 . 3.134 2.311 2.281 2.387 . 0 0 "[ . 1 . 2]" 2
1507 1 76 PHE QE 1 78 PHE QD 2.150 . 2.728 2.115 2.063 2.234 . 0 0 "[ . 1 . 2]" 2
1508 1 78 PHE QD 1 80 SER HA 2.731 . 3.663 2.556 2.495 2.701 . 0 0 "[ . 1 . 2]" 2
1509 1 78 PHE HB2 1 78 PHE QD 2.342 . 3.028 2.292 2.282 2.301 . 0 0 "[ . 1 . 2]" 2
1510 1 78 PHE QD 1 107 ILE MD 2.611 . 3.463 2.809 2.696 2.906 . 0 0 "[ . 1 . 2]" 2
1511 1 78 PHE QD 1 88 MET ME 2.839 . 3.846 3.879 3.858 3.921 0.075 20 0 "[ . 1 . 2]" 2
1512 1 40 LEU QD 1 48 PHE HD1 2.801 . 3.781 3.807 3.776 3.831 0.050 11 0 "[ . 1 . 2]" 2
1513 1 61 PHE QB 1 62 GLN H 2.583 . 3.417 2.707 2.689 2.755 . 0 0 "[ . 1 . 2]" 2
1514 1 61 PHE HA 1 61 PHE QB 2.351 . 3.042 2.322 2.307 2.329 . 0 0 "[ . 1 . 2]" 2
1515 1 61 PHE QB 1 62 GLN HG2 3.091 . 4.285 3.250 3.162 3.322 . 0 0 "[ . 1 . 2]" 2
1516 1 19 GLU QG 1 44 ASN HD21 2.869 . 3.898 3.973 3.949 4.000 0.102 15 0 "[ . 1 . 2]" 2
1517 1 19 GLU H 1 19 GLU QG 2.151 . 2.730 2.595 2.479 2.860 0.130 15 0 "[ . 1 . 2]" 2
1518 1 17 ASN HD22 1 19 GLU QG 2.839 . 3.846 3.648 3.432 3.952 0.106 15 0 "[ . 1 . 2]" 2
1519 1 19 GLU QG 1 21 ILE HG13 2.636 . 3.504 3.581 3.556 3.599 0.095 4 0 "[ . 1 . 2]" 2
1520 1 18 ILE MG 1 19 GLU QG 2.164 . 2.750 2.734 2.641 2.814 0.064 15 0 "[ . 1 . 2]" 2
1521 1 19 GLU QG 1 21 ILE MD 2.686 . 3.588 3.658 3.635 3.693 0.105 15 0 "[ . 1 . 2]" 2
1522 1 102 GLU QG 1 103 ILE H 3.043 . 3.910 3.642 3.559 3.719 . 0 0 "[ . 1 . 2]" 2
1523 1 102 GLU H 1 102 GLU QG 2.645 . 3.519 2.696 2.515 2.925 . 0 0 "[ . 1 . 2]" 2
1524 1 102 GLU HA 1 102 GLU QG 2.572 . 3.236 2.757 2.259 3.067 . 0 0 "[ . 1 . 2]" 2
1525 1 17 ASN HA 1 102 GLU QG 2.946 . 4.031 3.781 3.157 3.937 . 0 0 "[ . 1 . 2]" 2
1526 1 99 TYR HB2 1 102 GLU QG 2.914 . 3.975 3.046 2.572 3.619 . 0 0 "[ . 1 . 2]" 2
1527 1 45 ILE H 1 45 ILE HB 2.436 . 3.178 2.422 2.410 2.436 . 0 0 "[ . 1 . 2]" 2
1528 1 22 PHE QE 1 45 ILE HB 2.770 . 3.729 2.606 2.538 2.649 . 0 0 "[ . 1 . 2]" 2
1529 1 22 PHE HZ 1 45 ILE HB 2.856 . 3.876 2.928 2.879 3.001 . 0 0 "[ . 1 . 2]" 2
1530 1 45 ILE HB 1 45 ILE HG13 2.486 . 3.258 2.451 2.432 2.476 . 0 0 "[ . 1 . 2]" 2
1531 1 90 THR H 1 90 THR HA 2.603 . 3.450 2.922 2.918 2.926 . 0 0 "[ . 1 . 2]" 2
1532 1 90 THR HA 1 108 CYS H 2.825 . 3.823 3.501 3.463 3.556 . 0 0 "[ . 1 . 2]" 2
1533 1 90 THR HA 1 91 SER H 1.998 . 2.497 2.117 2.107 2.128 . 0 0 "[ . 1 . 2]" 2
1534 1 90 THR HA 1 107 ILE HA 2.408 . 3.133 2.523 2.491 2.552 . 0 0 "[ . 1 . 2]" 2
1535 1 64 VAL MG2 1 103 ILE HA 2.829 . 3.830 3.203 3.149 3.264 . 0 0 "[ . 1 . 2]" 2
1536 1 21 ILE HA 1 22 PHE H 1.997 . 2.496 2.108 2.099 2.122 . 0 0 "[ . 1 . 2]" 2
1537 1 21 ILE HA 1 45 ILE H 2.624 . 3.485 3.260 3.188 3.351 . 0 0 "[ . 1 . 2]" 2
1538 1 21 ILE H 1 21 ILE HA 2.714 . 3.635 2.764 2.760 2.768 . 0 0 "[ . 1 . 2]" 2
1539 1 21 ILE HA 1 44 ASN HA 2.188 . 2.786 2.110 2.038 2.167 . 0 0 "[ . 1 . 2]" 2
1540 1 21 ILE HA 1 44 ASN HB2 3.002 . 4.128 4.024 3.967 4.065 . 0 0 "[ . 1 . 2]" 2
1541 1 49 CYS HB3 1 54 GLN HA 2.897 . 3.946 3.226 3.037 3.311 . 0 0 "[ . 1 . 2]" 2
1542 1 54 GLN H 1 54 GLN HA 2.366 . 3.066 2.786 2.778 2.805 . 0 0 "[ . 1 . 2]" 2
1543 1 54 GLN HA 1 54 GLN HG3 2.435 . 3.176 3.212 3.056 3.238 0.062 18 0 "[ . 1 . 2]" 2
1544 1 54 GLN HA 1 54 GLN HG2 2.357 . 3.051 2.675 2.607 2.704 . 0 0 "[ . 1 . 2]" 2
1545 1 54 GLN HA 1 54 GLN HB2 2.290 . 2.946 3.004 3.001 3.014 0.068 11 0 "[ . 1 . 2]" 2
1546 1 54 GLN HA 1 54 GLN HB3 2.207 . 2.816 2.366 2.354 2.422 . 0 0 "[ . 1 . 2]" 2
1547 1 54 GLN HA 1 57 LEU HB2 2.687 . 3.590 2.875 2.203 3.007 . 0 0 "[ . 1 . 2]" 2
1548 1 58 ARG HA 1 59 ASP H 2.773 . 3.734 3.522 3.497 3.550 . 0 0 "[ . 1 . 2]" 2
1549 1 58 ARG H 1 58 ARG HA 2.285 . 2.938 2.770 2.742 2.788 . 0 0 "[ . 1 . 2]" 2
1550 1 58 ARG HA 1 58 ARG QB 1.943 . 2.415 2.353 2.330 2.368 . 0 0 "[ . 1 . 2]" 2
1551 1 58 ARG HA 1 58 ARG HG2 2.276 . 2.923 2.686 2.625 2.793 . 0 0 "[ . 1 . 2]" 2
1552 1 46 VAL QG 1 58 ARG HA 2.849 . 3.864 3.377 3.299 3.457 . 0 0 "[ . 1 . 2]" 2
1553 1 29 CYS HA 1 30 VAL H 2.852 . 3.869 3.530 3.524 3.541 . 0 0 "[ . 1 . 2]" 2
1554 1 33 VAL MG2 1 78 PHE QD 2.832 . 3.834 3.867 3.855 3.884 0.050 19 0 "[ . 1 . 2]" 2
1555 1 47 GLU H 1 48 PHE HD1 2.787 . 3.758 3.783 3.757 3.793 0.035 9 0 "[ . 1 . 2]" 2
1556 1 13 ILE HB 1 24 PHE QE 2.685 . 3.586 2.762 2.603 2.830 . 0 0 "[ . 1 . 2]" 2
1557 1 48 PHE H 1 48 PHE HD1 2.319 . 2.991 2.195 2.141 2.232 . 0 0 "[ . 1 . 2]" 2
1558 1 48 PHE HD1 1 78 PHE QE 2.914 . 3.976 4.011 3.990 4.031 0.055 16 0 "[ . 1 . 2]" 2
1559 1 48 PHE HB2 1 48 PHE HD1 2.167 . 2.754 2.456 2.447 2.471 . 0 0 "[ . 1 . 2]" 2
1560 1 47 GLU HB2 1 48 PHE HD1 2.610 . 3.462 3.420 3.352 3.469 0.007 11 0 "[ . 1 . 2]" 2
1561 1 84 GLU H 1 84 GLU QG 2.398 . 3.117 2.913 2.530 3.121 0.004 18 0 "[ . 1 . 2]" 2
1562 1 84 GLU HB3 1 84 GLU QG 1.947 . 2.421 2.380 2.341 2.432 0.011 9 0 "[ . 1 . 2]" 2
1563 1 21 ILE H 1 21 ILE HB 2.103 . 2.656 2.732 2.711 2.747 0.091 18 0 "[ . 1 . 2]" 2
1564 1 17 ASN HD22 1 21 ILE HB 2.513 . 3.302 2.054 1.732 2.318 . 0 0 "[ . 1 . 2]" 2
1565 1 21 ILE HA 1 21 ILE HB 2.824 . 3.821 2.999 2.995 3.002 . 0 0 "[ . 1 . 2]" 2
1566 1 88 MET H 1 88 MET HB3 2.850 . 3.865 3.846 3.828 3.858 . 0 0 "[ . 1 . 2]" 2
1567 1 88 MET HB3 1 89 ARG H 2.597 . 3.440 2.486 2.437 2.537 . 0 0 "[ . 1 . 2]" 2
1568 1 88 MET H 1 88 MET HB2 2.636 . 3.505 2.786 2.753 2.808 . 0 0 "[ . 1 . 2]" 2
1569 1 88 MET HB2 1 89 ARG H 2.722 . 3.648 3.553 3.501 3.597 . 0 0 "[ . 1 . 2]" 2
1570 1 76 PHE QE 1 88 MET HB2 3.010 . 4.143 2.920 2.840 2.981 . 0 0 "[ . 1 . 2]" 2
1571 1 58 ARG HA 1 61 PHE QD 2.627 . 3.489 2.068 1.767 2.142 . 0 0 "[ . 1 . 2]" 2
1572 1 29 CYS HA 1 33 VAL H 2.774 . 3.736 3.074 3.006 3.132 . 0 0 "[ . 1 . 2]" 2
1573 1 12 PHE HB3 1 29 CYS HA 2.885 . 3.926 2.845 2.754 2.896 . 0 0 "[ . 1 . 2]" 2
1574 1 29 CYS H 1 29 CYS HA 2.433 . 3.173 2.721 2.701 2.740 . 0 0 "[ . 1 . 2]" 2
1575 1 29 CYS HA 1 32 THR H 2.710 . 3.628 3.279 3.217 3.307 . 0 0 "[ . 1 . 2]" 2
1576 1 12 PHE QD 1 29 CYS HA 2.412 . 3.139 2.765 2.701 2.858 . 0 0 "[ . 1 . 2]" 2
1577 1 12 PHE QE 1 29 CYS HA 2.844 . 3.855 3.647 3.591 3.763 . 0 0 "[ . 1 . 2]" 2
1578 1 29 CYS HA 1 32 THR HB 2.423 . 3.157 2.208 2.134 2.268 . 0 0 "[ . 1 . 2]" 2
1579 1 29 CYS HA 1 29 CYS HB3 2.188 . 2.787 2.441 2.425 2.457 . 0 0 "[ . 1 . 2]" 2
1580 1 29 CYS HA 1 29 CYS HB2 2.189 . 2.788 2.429 2.417 2.442 . 0 0 "[ . 1 . 2]" 2
1581 1 29 CYS HA 1 33 VAL MG2 2.479 . 3.247 2.752 2.696 2.830 . 0 0 "[ . 1 . 2]" 2
1582 1 24 PHE QE 1 26 ASP HB2 2.852 . 3.868 2.604 2.496 2.677 . 0 0 "[ . 1 . 2]" 2
1583 1 24 PHE QE 1 26 ASP HB3 2.712 . 3.631 3.696 3.688 3.709 0.078 7 0 "[ . 1 . 2]" 2
1584 1 15 ARG H 1 24 PHE QD 2.774 . 3.736 1.997 1.913 2.132 . 0 0 "[ . 1 . 2]" 2
1585 1 24 PHE QD 1 25 VAL HA 3.039 . 4.194 3.432 3.377 3.486 . 0 0 "[ . 1 . 2]" 2
1586 1 15 ARG QB 1 24 PHE QD 2.732 . 3.665 2.613 2.213 2.787 . 0 0 "[ . 1 . 2]" 2
1587 1 15 ARG HG3 1 24 PHE QD 2.743 . 3.683 2.804 2.514 3.236 . 0 0 "[ . 1 . 2]" 2
1588 1 13 ILE MG 1 24 PHE QD 2.561 . 3.381 3.400 3.370 3.422 0.041 10 0 "[ . 1 . 2]" 2
1589 1 74 VAL H 1 74 VAL HB 2.897 . 3.946 3.906 3.865 3.919 . 0 0 "[ . 1 . 2]" 2
1590 1 74 VAL HA 1 74 VAL HB 2.126 . 2.691 2.453 2.443 2.461 . 0 0 "[ . 1 . 2]" 2
1591 1 56 LEU MD2 1 74 VAL HB 2.326 . 3.002 1.850 1.754 1.901 . 0 0 "[ . 1 . 2]" 2
1592 1 74 VAL HB 1 74 VAL MG1 1.978 . 2.467 2.122 2.094 2.125 . 0 0 "[ . 1 . 2]" 2
1593 1 15 ARG H 1 15 ARG HB2 2.600 . 3.445 2.290 2.234 2.338 . 0 0 "[ . 1 . 2]" 2
1594 1 15 ARG HB2 1 24 PHE H 2.933 . 4.009 3.520 3.411 3.826 . 0 0 "[ . 1 . 2]" 2
1595 1 15 ARG QB 1 15 ARG HE 2.673 . 3.566 2.203 1.916 3.246 . 0 0 "[ . 1 . 2]" 2
1596 1 14 SER HA 1 15 ARG HB2 3.076 . 4.259 4.301 4.205 4.354 0.095 4 0 "[ . 1 . 2]" 2
1597 1 15 ARG QB 1 104 GLU HA 2.896 . 3.945 3.608 3.450 3.773 . 0 0 "[ . 1 . 2]" 2
1598 1 15 ARG QB 1 24 PHE HA 3.034 . 4.185 4.257 4.215 4.294 0.109 11 0 "[ . 1 . 2]" 2
1599 1 15 ARG QB 1 15 ARG HD2 2.726 . 3.655 2.333 2.242 2.423 . 0 0 "[ . 1 . 2]" 2
1600 1 15 ARG QB 1 24 PHE HB2 2.409 . 3.135 3.129 3.106 3.166 0.031 18 0 "[ . 1 . 2]" 2
1601 1 25 VAL HB 1 26 ASP H 2.891 . 3.936 3.972 3.959 3.989 0.053 11 0 "[ . 1 . 2]" 2
1602 1 25 VAL H 1 25 VAL HB 2.533 . 3.335 3.085 3.033 3.112 . 0 0 "[ . 1 . 2]" 2
1603 1 25 VAL HB 1 41 LEU MD1 2.572 . 3.399 3.315 3.229 3.376 . 0 0 "[ . 1 . 2]" 2
1604 1 25 VAL HB 1 25 VAL MG2 2.154 . 2.734 2.107 2.087 2.117 . 0 0 "[ . 1 . 2]" 2
1605 1 27 HIS H 1 27 HIS HA 2.267 . 2.909 2.749 2.721 2.760 . 0 0 "[ . 1 . 2]" 2
1606 1 27 HIS HA 1 30 VAL H 2.857 . 3.877 3.913 3.590 3.954 0.077 11 0 "[ . 1 . 2]" 2
1607 1 27 HIS HA 1 37 PRO HD2 2.643 . 3.516 3.559 3.533 3.590 0.074 1 0 "[ . 1 . 2]" 2
1608 1 27 HIS HA 1 27 HIS HB2 2.025 . 2.538 2.390 2.349 2.588 0.050 16 0 "[ . 1 . 2]" 2
1609 1 27 HIS HA 1 37 PRO HG2 2.296 . 2.955 3.012 2.980 3.071 0.116 16 0 "[ . 1 . 2]" 2
1610 1 27 HIS HA 1 37 PRO HG3 2.188 . 2.786 1.592 1.562 1.621 0.028 16 0 "[ . 1 . 2]" 2
1611 1 27 HIS HA 1 30 VAL QG 2.671 . 3.563 3.049 2.791 3.095 . 0 0 "[ . 1 . 2]" 2
1612 1 81 LYS HA 1 82 ASN H 3.039 . 4.194 3.441 3.403 3.474 . 0 0 "[ . 1 . 2]" 2
1613 1 35 TYR QE 1 81 LYS HA 2.476 . 3.242 2.728 2.636 2.767 . 0 0 "[ . 1 . 2]" 2
1614 1 35 TYR QD 1 81 LYS HA 2.868 . 3.896 3.985 3.953 4.008 0.112 1 0 "[ . 1 . 2]" 2
1615 1 81 LYS HA 1 81 LYS QE 2.970 . 4.073 4.187 4.151 4.230 0.157 8 0 "[ . 1 . 2]" 2
1616 1 81 LYS HA 1 81 LYS HG3 2.248 . 2.880 2.246 2.210 2.281 . 0 0 "[ . 1 . 2]" 2
1617 1 81 LYS HA 1 81 LYS HB2 2.153 . 2.733 2.547 2.523 2.570 . 0 0 "[ . 1 . 2]" 2
1618 1 21 ILE MD 1 44 ASN H 2.264 . 2.904 2.804 2.754 2.891 . 0 0 "[ . 1 . 2]" 2
1619 1 21 ILE H 1 21 ILE MD 2.276 . 2.924 2.974 2.962 3.016 0.092 18 0 "[ . 1 . 2]" 2
1620 1 21 ILE MD 1 44 ASN HD21 2.313 . 2.982 1.844 1.787 1.863 . 0 0 "[ . 1 . 2]" 2
1621 1 21 ILE MD 1 44 ASN HD22 2.470 . 3.233 3.242 3.155 3.260 0.027 18 0 "[ . 1 . 2]" 2
1622 1 21 ILE MD 1 44 ASN HA 2.186 . 2.783 2.156 2.098 2.237 . 0 0 "[ . 1 . 2]" 2
1623 1 21 ILE HA 1 21 ILE MD 2.118 . 2.679 2.278 2.225 2.310 . 0 0 "[ . 1 . 2]" 2
1624 1 21 ILE MD 1 44 ASN HB2 2.218 . 2.833 2.057 2.002 2.137 . 0 0 "[ . 1 . 2]" 2
1625 1 19 GLU HB3 1 21 ILE MD 2.419 . 3.151 2.974 2.924 3.021 . 0 0 "[ . 1 . 2]" 2
1626 1 21 ILE MD 1 21 ILE HG13 2.001 . 2.501 2.121 2.118 2.123 . 0 0 "[ . 1 . 2]" 2
1627 1 21 ILE MD 1 21 ILE HG12 2.002 . 2.503 2.103 2.097 2.107 . 0 0 "[ . 1 . 2]" 2
1628 1 44 ASN H 1 48 PHE HE1 3.023 . 4.165 4.103 3.875 4.170 0.005 8 0 "[ . 1 . 2]" 2
1629 1 40 LEU HA 1 48 PHE HE1 2.687 . 3.589 3.586 3.545 3.614 0.025 18 0 "[ . 1 . 2]" 2
1630 1 45 ILE HA 1 48 PHE HE1 3.083 . 4.271 3.889 3.864 3.921 . 0 0 "[ . 1 . 2]" 2
1631 1 43 LYS HB2 1 48 PHE HE1 2.293 . 2.950 2.071 2.025 2.184 . 0 0 "[ . 1 . 2]" 2
1632 1 43 LYS HB3 1 48 PHE HE1 2.333 . 3.013 2.036 1.921 2.091 . 0 0 "[ . 1 . 2]" 2
1633 1 43 LYS QD 1 48 PHE HE1 2.612 . 3.465 2.831 2.769 2.869 . 0 0 "[ . 1 . 2]" 2
1634 1 43 LYS HG3 1 48 PHE HE1 2.808 . 3.793 3.849 3.595 3.904 0.111 5 0 "[ . 1 . 2]" 2
1635 1 40 LEU QD 1 48 PHE HE1 2.415 . 3.144 2.838 2.813 2.953 . 0 0 "[ . 1 . 2]" 2
1636 1 20 GLY HA2 1 61 PHE QE 3.009 . 4.141 3.460 3.334 3.963 . 0 0 "[ . 1 . 2]" 2
1637 1 20 GLY HA3 1 61 PHE QE 2.956 . 4.049 3.192 3.061 3.656 . 0 0 "[ . 1 . 2]" 2
1638 1 54 GLN HE21 1 54 GLN HG3 2.728 . 3.658 2.966 2.897 3.450 . 0 0 "[ . 1 . 2]" 2
1639 1 54 GLN H 1 54 GLN HG3 2.385 . 3.096 1.915 1.875 2.087 . 0 0 "[ . 1 . 2]" 2
1640 1 54 GLN HB2 1 54 GLN HG3 2.478 . 3.246 2.437 2.417 2.467 . 0 0 "[ . 1 . 2]" 2
1641 1 54 GLN HB3 1 54 GLN HG3 2.523 . 3.318 2.986 2.982 2.988 . 0 0 "[ . 1 . 2]" 2
1642 1 46 VAL QG 1 54 GLN HG3 2.665 . 3.553 3.594 3.571 3.637 0.084 11 0 "[ . 1 . 2]" 2
1643 1 54 GLN HE21 1 54 GLN HG2 2.752 . 3.698 2.316 2.229 3.001 . 0 0 "[ . 1 . 2]" 2
1644 1 92 SER H 1 92 SER HA 2.851 . 3.867 2.889 2.884 2.900 . 0 0 "[ . 1 . 2]" 2
1645 1 92 SER HA 1 106 ILE H 2.742 . 3.682 3.724 3.699 3.750 0.068 2 0 "[ . 1 . 2]" 2
1646 1 92 SER HA 1 93 GLN H 2.122 . 2.685 2.105 2.095 2.118 . 0 0 "[ . 1 . 2]" 2
1647 1 61 PHE QE 1 92 SER HA 2.758 . 3.709 3.825 3.802 3.911 0.202 17 0 "[ . 1 . 2]" 2
1648 1 92 SER HA 1 92 SER HB3 2.514 . 3.304 2.289 2.279 2.295 . 0 0 "[ . 1 . 2]" 2
1649 1 92 SER HA 1 92 SER HB2 2.631 . 3.496 2.980 2.973 2.983 . 0 0 "[ . 1 . 2]" 2
1650 1 28 ARG H 1 28 ARG HA 2.612 . 3.465 2.838 2.801 2.849 . 0 0 "[ . 1 . 2]" 2
1651 1 68 LYS H 1 68 LYS HA 2.421 . 3.154 2.299 2.288 2.317 . 0 0 "[ . 1 . 2]" 2
1652 1 68 LYS HA 1 69 GLY H 2.268 . 2.911 2.265 2.158 2.451 . 0 0 "[ . 1 . 2]" 2
1653 1 52 GLU HA 1 54 GLN H 3.086 . 4.276 4.275 4.248 4.296 0.020 11 0 "[ . 1 . 2]" 2
1654 1 63 GLN H 1 63 GLN HA 2.329 . 3.007 2.863 2.854 2.868 . 0 0 "[ . 1 . 2]" 2
1655 1 63 GLN HA 1 66 LYS H 2.560 . 3.379 3.285 3.237 3.321 . 0 0 "[ . 1 . 2]" 2
1656 1 38 GLN H 1 38 GLN HA 2.370 . 3.072 2.840 2.828 2.850 . 0 0 "[ . 1 . 2]" 2
1657 1 38 GLN HA 1 39 GLU H 2.715 . 3.637 3.461 3.434 3.486 . 0 0 "[ . 1 . 2]" 2
1658 1 38 GLN HA 1 41 LEU H 2.564 . 3.386 2.946 2.891 3.006 . 0 0 "[ . 1 . 2]" 2
1659 1 38 GLN HA 1 40 LEU H 2.901 . 3.953 3.430 3.363 3.477 . 0 0 "[ . 1 . 2]" 2
1660 1 55 GLN H 1 55 GLN HA 2.411 . 3.138 2.798 2.779 2.844 . 0 0 "[ . 1 . 2]" 2
1661 1 55 GLN HA 1 56 LEU H 2.577 . 3.407 3.463 3.444 3.486 0.079 18 0 "[ . 1 . 2]" 2
1662 1 55 GLN HA 1 58 ARG QD 2.651 . 3.529 3.011 2.472 3.467 . 0 0 "[ . 1 . 2]" 2
1663 1 22 PHE QE 1 45 ILE HA 2.788 . 3.760 2.962 2.944 2.997 . 0 0 "[ . 1 . 2]" 2
1664 1 40 LEU QD 1 78 PHE HZ 2.898 . 3.674 1.827 1.811 1.854 0.037 6 0 "[ . 1 . 2]" 2
1665 1 12 PHE QE 1 14 SER QB 3.024 . 3.846 1.815 1.787 1.828 0.094 18 0 "[ . 1 . 2]" 2
1666 1 52 GLU H 1 52 GLU HA 2.276 . 2.924 2.780 2.753 2.787 . 0 0 "[ . 1 . 2]" 2
1667 1 33 VAL HB 1 80 SER HA 3.072 . 4.252 2.494 2.382 2.568 . 0 0 "[ . 1 . 2]" 2
1668 1 33 VAL HB 1 78 PHE QD 2.983 . 4.095 2.872 2.827 2.962 . 0 0 "[ . 1 . 2]" 2
1669 1 33 VAL HB 1 35 TYR QD 3.087 . 4.278 2.503 2.441 2.540 . 0 0 "[ . 1 . 2]" 2
1670 1 70 GLN QG 1 71 VAL H 2.606 . 3.455 3.137 2.960 3.247 . 0 0 "[ . 1 . 2]" 2
1671 1 67 LEU HB2 1 70 GLN QG 2.681 . 3.579 3.369 3.261 3.502 . 0 0 "[ . 1 . 2]" 2
1672 1 67 LEU HB3 1 70 GLN QG 2.540 . 3.346 3.423 3.409 3.445 0.099 19 0 "[ . 1 . 2]" 2
1673 1 67 LEU MD1 1 70 GLN QG 2.378 . 3.085 1.956 1.904 2.024 . 0 0 "[ . 1 . 2]" 2
1674 1 75 MET HB2 1 76 PHE H 2.983 . 4.095 4.209 4.187 4.231 0.136 5 0 "[ . 1 . 2]" 2
1675 1 103 ILE HA 1 104 GLU H 2.032 . 2.548 2.124 2.111 2.159 . 0 0 "[ . 1 . 2]" 2
1676 1 62 GLN HA 1 62 GLN HB3 2.254 . 2.889 2.455 2.430 2.470 . 0 0 "[ . 1 . 2]" 2
1677 1 104 GLU HA 1 104 GLU HB3 2.460 . 3.216 2.997 2.993 3.015 . 0 0 "[ . 1 . 2]" 2
1678 1 102 GLU H 1 102 GLU HA 2.598 . 3.442 2.900 2.881 2.940 . 0 0 "[ . 1 . 2]" 2
1679 1 62 GLN H 1 62 GLN HA 2.206 . 2.815 2.842 2.838 2.846 0.031 2 0 "[ . 1 . 2]" 2
1680 1 63 GLN HA 1 63 GLN HB3 2.056 . 2.584 2.484 2.460 2.498 . 0 0 "[ . 1 . 2]" 2
1681 1 104 GLU HA 1 105 THR H 2.218 . 2.833 2.155 2.098 2.167 . 0 0 "[ . 1 . 2]" 2
1682 1 15 ARG HG2 1 104 GLU HA 2.607 . 3.457 2.027 1.905 2.085 . 0 0 "[ . 1 . 2]" 2
1683 1 77 ARG HA 1 77 ARG HG2 2.726 . 3.655 2.836 2.686 2.931 . 0 0 "[ . 1 . 2]" 2
1684 1 65 VAL H 1 103 ILE MD 2.721 . 3.646 3.412 3.373 3.442 . 0 0 "[ . 1 . 2]" 2
1685 1 22 PHE HA 1 23 THR H 2.327 . 3.004 2.141 2.119 2.172 . 0 0 "[ . 1 . 2]" 2
1686 1 22 PHE HA 1 24 PHE H 2.750 . 3.695 2.983 2.945 3.019 . 0 0 "[ . 1 . 2]" 2
1687 1 22 PHE HA 1 22 PHE HB2 2.751 . 3.697 2.988 2.986 2.992 . 0 0 "[ . 1 . 2]" 2
1688 1 22 PHE H 1 22 PHE HA 2.782 . 3.750 2.794 2.784 2.807 . 0 0 "[ . 1 . 2]" 2
1689 1 16 HIS HB3 1 22 PHE HA 2.513 . 3.302 1.860 1.789 1.923 . 0 0 "[ . 1 . 2]" 2
1690 1 22 PHE HA 1 22 PHE HB3 2.591 . 3.430 2.560 2.554 2.565 . 0 0 "[ . 1 . 2]" 2
1691 1 16 HIS HB2 1 22 PHE HA 2.565 . 3.387 2.979 2.924 3.035 . 0 0 "[ . 1 . 2]" 2
1692 1 98 PRO HA 1 98 PRO HG3 2.871 . 3.901 4.073 4.061 4.084 0.183 11 0 "[ . 1 . 2]" 2
1693 1 106 ILE H 1 106 ILE HA 2.735 . 3.670 2.919 2.911 2.933 . 0 0 "[ . 1 . 2]" 2
1694 1 106 ILE HA 1 107 ILE H 2.064 . 2.596 2.168 2.162 2.173 . 0 0 "[ . 1 . 2]" 2
1695 1 14 SER H 1 106 ILE HA 2.630 . 3.494 2.911 2.730 2.995 . 0 0 "[ . 1 . 2]" 2
1696 1 106 ILE HA 1 106 ILE QG 2.299 . 2.959 2.321 2.309 2.335 . 0 0 "[ . 1 . 2]" 2
1697 1 33 VAL H 1 33 VAL HA 2.448 . 3.197 2.933 2.926 2.936 . 0 0 "[ . 1 . 2]" 2
1698 1 33 VAL HA 1 34 GLY H 2.721 . 3.647 3.155 3.135 3.174 . 0 0 "[ . 1 . 2]" 2
1699 1 33 VAL HA 1 80 SER QB 2.842 . 3.852 2.256 1.977 2.395 . 0 0 "[ . 1 . 2]" 2
1700 1 33 VAL HA 1 33 VAL HB 2.006 . 2.509 2.475 2.461 2.490 . 0 0 "[ . 1 . 2]" 2
1701 1 33 VAL HA 1 88 MET ME 2.916 . 3.979 3.432 3.362 3.506 . 0 0 "[ . 1 . 2]" 2
1702 1 33 VAL HA 1 86 LEU QD 2.322 . 2.996 2.173 2.059 2.248 . 0 0 "[ . 1 . 2]" 2
1703 1 33 VAL HA 1 33 VAL MG2 2.350 . 3.040 3.186 3.182 3.189 0.149 4 0 "[ . 1 . 2]" 2
1704 1 87 TRP H 1 87 TRP HA 2.646 . 3.521 2.815 2.808 2.828 . 0 0 "[ . 1 . 2]" 2
1705 1 24 PHE H 1 24 PHE HA 2.552 . 3.366 2.805 2.796 2.812 . 0 0 "[ . 1 . 2]" 2
1706 1 24 PHE HA 1 24 PHE HB3 2.326 . 3.002 3.004 3.002 3.006 0.004 5 0 "[ . 1 . 2]" 2
1707 1 24 PHE HA 1 25 VAL H 1.932 . 2.399 2.265 2.248 2.281 . 0 0 "[ . 1 . 2]" 2
1708 1 24 PHE HA 1 24 PHE HB2 2.383 . 3.093 2.371 2.367 2.373 . 0 0 "[ . 1 . 2]" 2
1709 1 24 PHE HA 1 41 LEU HG 2.693 . 3.599 3.309 3.252 3.429 . 0 0 "[ . 1 . 2]" 2
1710 1 87 TRP HA 1 88 MET H 2.017 . 2.526 2.089 2.075 2.101 . 0 0 "[ . 1 . 2]" 2
1711 1 87 TRP HA 1 87 TRP HB2 2.453 . 3.205 2.961 2.958 2.969 . 0 0 "[ . 1 . 2]" 2
1712 1 87 TRP HA 1 87 TRP HB3 2.431 . 3.170 2.669 2.650 2.675 . 0 0 "[ . 1 . 2]" 2
1713 1 68 LYS HA 1 68 LYS HD2 2.750 . 3.695 3.179 1.899 3.970 0.275 11 0 "[ . 1 . 2]" 2
1714 1 40 LEU HA 1 48 PHE QE 2.722 . 3.648 3.505 3.465 3.529 . 0 0 "[ . 1 . 2]" 2
1715 1 87 TRP HB3 1 87 TRP HD1 2.810 . 3.797 3.741 3.731 3.754 . 0 0 "[ . 1 . 2]" 2
1716 1 12 PHE QE 1 40 LEU QD 2.611 . 3.463 3.179 3.121 3.228 . 0 0 "[ . 1 . 2]" 2
1717 1 64 VAL MG1 1 103 ILE MD 2.356 . 3.050 2.979 2.843 3.060 0.010 10 0 "[ . 1 . 2]" 2
1718 1 79 ARG HB2 1 85 TRP HE3 2.953 . 4.043 3.308 3.265 3.351 . 0 0 "[ . 1 . 2]" 2
1719 1 77 ARG HB2 1 77 ARG HG3 2.880 . 3.917 2.645 2.544 2.713 . 0 0 "[ . 1 . 2]" 2
1720 1 12 PHE HZ 1 25 VAL MG1 2.762 . 3.715 3.801 3.778 3.825 0.110 13 0 "[ . 1 . 2]" 2
1721 1 80 SER H 1 86 LEU QD 2.974 . 4.079 3.543 3.497 3.595 . 0 0 "[ . 1 . 2]" 2
1722 1 40 LEU QD 1 48 PHE HZ 2.182 . 2.777 2.570 2.504 2.683 . 0 0 "[ . 1 . 2]" 2
1723 1 107 ILE HA 1 107 ILE HB 2.705 . 3.619 3.011 3.008 3.014 . 0 0 "[ . 1 . 2]" 2
1724 1 49 CYS HB2 1 76 PHE QE 3.058 . 4.227 2.807 2.741 2.940 . 0 0 "[ . 1 . 2]" 2
1725 1 76 PHE QE 1 88 MET HG3 3.051 . 4.215 4.012 3.977 4.054 . 0 0 "[ . 1 . 2]" 2
1726 1 76 PHE QE 1 88 MET HB3 2.861 . 3.884 3.711 3.622 3.791 . 0 0 "[ . 1 . 2]" 2
1727 1 76 PHE QE 1 90 THR MG 2.130 . 2.697 1.676 1.647 1.760 . 0 0 "[ . 1 . 2]" 2
1728 1 76 PHE HA 1 87 TRP HH2 2.888 . 3.930 3.947 3.892 3.965 0.035 19 0 "[ . 1 . 2]" 2
1729 1 76 PHE H 1 76 PHE HA 2.532 . 3.334 2.935 2.932 2.938 . 0 0 "[ . 1 . 2]" 2
1730 1 99 TYR HA 1 100 SER H 2.422 . 3.155 2.943 2.874 3.008 . 0 0 "[ . 1 . 2]" 2
1731 1 99 TYR HA 1 99 TYR QD 2.149 . 2.727 2.776 2.678 2.924 0.197 9 0 "[ . 1 . 2]" 2
1732 1 76 PHE HA 1 87 TRP HZ3 2.316 . 2.987 2.939 2.884 2.981 . 0 0 "[ . 1 . 2]" 2
1733 1 12 PHE HA 1 13 ILE H 2.213 . 2.825 2.097 2.088 2.111 . 0 0 "[ . 1 . 2]" 2
1734 1 12 PHE H 1 12 PHE HA 2.582 . 3.416 2.936 2.933 2.938 . 0 0 "[ . 1 . 2]" 2
1735 1 99 TYR HA 1 102 GLU QG 2.798 . 3.777 2.351 2.120 3.215 . 0 0 "[ . 1 . 2]" 2
1736 1 12 PHE HA 1 13 ILE HG13 2.902 . 3.954 3.450 3.382 3.512 . 0 0 "[ . 1 . 2]" 2
1737 1 99 TYR HA 1 102 GLU HB2 2.810 . 3.797 3.654 3.137 3.893 0.096 17 0 "[ . 1 . 2]" 2
1738 1 95 ALA MB 1 99 TYR HA 2.884 . 3.923 3.972 3.934 4.026 0.103 10 0 "[ . 1 . 2]" 2
1739 1 56 LEU MD2 1 76 PHE HA 2.720 . 3.645 3.500 3.383 3.565 . 0 0 "[ . 1 . 2]" 2
1740 1 76 PHE HA 1 76 PHE HB2 2.239 . 2.866 2.364 2.358 2.370 . 0 0 "[ . 1 . 2]" 2
1741 1 99 TYR HA 1 99 TYR HB2 2.314 . 2.983 2.941 2.871 2.999 0.016 4 0 "[ . 1 . 2]" 2
1742 1 12 PHE HA 1 12 PHE HB3 2.273 . 2.919 2.530 2.522 2.538 . 0 0 "[ . 1 . 2]" 2
1743 1 64 VAL HB 1 93 GLN HA 2.482 . 3.252 1.772 1.720 1.825 . 0 0 "[ . 1 . 2]" 2
1744 1 93 GLN HA 1 93 GLN HB3 2.081 . 2.622 2.438 2.421 2.454 . 0 0 "[ . 1 . 2]" 2
1745 1 93 GLN HA 1 94 THR MG 2.848 . 3.862 3.466 3.417 3.561 . 0 0 "[ . 1 . 2]" 2
1746 1 64 VAL MG1 1 93 GLN HA 2.372 . 3.075 2.894 2.858 2.954 . 0 0 "[ . 1 . 2]" 2
1747 1 64 VAL MG2 1 93 GLN HA 2.177 . 2.769 2.248 2.152 2.405 . 0 0 "[ . 1 . 2]" 2
1748 1 93 GLN HA 1 93 GLN HB2 2.206 . 2.814 2.445 2.433 2.462 . 0 0 "[ . 1 . 2]" 2
1749 1 76 PHE HZ 1 107 ILE MD 2.342 . 3.028 2.438 2.319 2.530 . 0 0 "[ . 1 . 2]" 2
1750 1 61 PHE HA 1 61 PHE QD 1.995 . 2.492 2.069 2.043 2.155 . 0 0 "[ . 1 . 2]" 2
1751 1 61 PHE HA 1 103 ILE MD 2.366 . 3.066 2.234 2.191 2.263 . 0 0 "[ . 1 . 2]" 2
1752 1 81 LYS HB2 1 82 ASN H 3.191 . 4.464 3.967 3.895 4.030 . 0 0 "[ . 1 . 2]" 2
1753 1 35 TYR HA 1 81 LYS HB2 3.103 . 4.307 3.441 3.347 3.533 . 0 0 "[ . 1 . 2]" 2
1754 1 45 ILE MD 1 76 PHE HZ 2.531 . 3.332 3.223 3.172 3.295 . 0 0 "[ . 1 . 2]" 2
1755 1 33 VAL H 1 33 VAL HB 3.282 . 4.628 3.740 3.722 3.750 . 0 0 "[ . 1 . 2]" 2
1756 1 35 TYR QD 1 39 GLU HB3 2.485 . 3.257 2.702 2.532 2.820 . 0 0 "[ . 1 . 2]" 2
1757 1 65 VAL MG2 1 103 ILE MD 2.119 . 2.680 2.859 2.830 2.874 0.194 16 0 "[ . 1 . 2]" 2
1758 1 77 ARG HG2 1 87 TRP HZ2 3.295 . 4.652 4.096 3.623 4.492 . 0 0 "[ . 1 . 2]" 2
1759 1 77 ARG HG3 1 87 TRP HZ2 3.331 . 4.718 3.495 3.288 3.676 . 0 0 "[ . 1 . 2]" 2
1760 1 79 ARG H 1 85 TRP HH2 3.200 . 4.480 4.421 4.354 4.483 0.003 13 0 "[ . 1 . 2]" 2
1761 1 50 HIS H 1 85 TRP HH2 3.363 . 4.777 4.493 4.424 4.548 . 0 0 "[ . 1 . 2]" 2
1762 1 13 ILE MG 1 24 PHE HZ 3.608 . 5.235 4.748 4.657 4.794 . 0 0 "[ . 1 . 2]" 2
1763 1 33 VAL MG2 1 78 PHE HZ 2.567 . 3.391 3.077 3.026 3.155 . 0 0 "[ . 1 . 2]" 2
1764 1 56 LEU HG 1 57 LEU HA 2.903 . 3.956 3.505 3.430 3.596 . 0 0 "[ . 1 . 2]" 2
1765 1 8 GLN HA 1 9 PRO QD 1.920 . 2.381 1.999 1.718 2.080 . 0 0 "[ . 1 . 2]" 2
1766 1 8 GLN HA 1 8 GLN QG 2.306 . 2.970 2.551 2.412 3.024 0.054 15 0 "[ . 1 . 2]" 2
1767 1 8 GLN HA 1 8 GLN HB3 2.086 . 2.630 2.435 2.195 2.835 0.205 15 0 "[ . 1 . 2]" 2
1768 1 8 GLN HA 1 8 GLN HB2 2.277 . 2.925 2.958 2.202 3.012 0.087 1 0 "[ . 1 . 2]" 2
1769 1 72 LEU H 1 73 SER H 3.447 . 4.932 4.476 4.442 4.501 . 0 0 "[ . 1 . 2]" 2
1770 1 72 LEU H 1 92 SER HB2 3.399 . 4.843 3.428 3.375 3.482 . 0 0 "[ . 1 . 2]" 2
1771 1 72 LEU H 1 93 GLN HB3 3.298 . 4.657 3.370 3.283 3.539 . 0 0 "[ . 1 . 2]" 2
1772 1 72 LEU H 1 72 LEU HB2 3.060 . 4.230 2.284 2.251 2.344 . 0 0 "[ . 1 . 2]" 2
1773 1 15 ARG HE 1 15 ARG HG2 3.017 . 4.155 3.727 3.658 3.823 . 0 0 "[ . 1 . 2]" 2
1774 1 15 ARG HE 1 95 ALA MB 3.422 . 4.886 4.467 4.150 4.735 . 0 0 "[ . 1 . 2]" 2
1775 1 78 PHE QD 1 79 ARG H 2.964 . 4.062 3.633 3.491 3.694 . 0 0 "[ . 1 . 2]" 2
1776 1 79 ARG H 1 85 TRP HZ3 2.837 . 3.843 2.267 2.194 2.328 . 0 0 "[ . 1 . 2]" 2
1777 1 79 ARG H 1 79 ARG HA 2.786 . 3.756 2.834 2.817 2.841 . 0 0 "[ . 1 . 2]" 2
1778 1 78 PHE HB3 1 79 ARG H 3.496 . 5.024 4.320 4.298 4.333 . 0 0 "[ . 1 . 2]" 2
1779 1 78 PHE HB2 1 79 ARG H 3.468 . 4.971 4.586 4.570 4.600 . 0 0 "[ . 1 . 2]" 2
1780 1 48 PHE HB3 1 79 ARG H 2.997 . 4.119 3.070 3.000 3.172 . 0 0 "[ . 1 . 2]" 2
1781 1 79 ARG H 1 79 ARG HD2 3.538 . 5.103 4.512 4.290 4.567 . 0 0 "[ . 1 . 2]" 2
1782 1 79 ARG H 1 79 ARG HG2 3.318 . 4.694 4.458 4.400 4.468 . 0 0 "[ . 1 . 2]" 2
1783 1 50 HIS HD2 1 85 TRP HE1 3.300 . 4.662 3.253 3.121 3.409 . 0 0 "[ . 1 . 2]" 2
1784 1 44 ASN HB3 1 45 ILE H 3.362 . 4.775 4.173 4.141 4.212 . 0 0 "[ . 1 . 2]" 2
1785 1 45 ILE H 1 46 VAL H 2.806 . 3.790 2.898 2.871 2.935 . 0 0 "[ . 1 . 2]" 2
1786 1 44 ASN HD21 1 45 ILE H 3.716 . 5.442 4.781 4.721 4.885 . 0 0 "[ . 1 . 2]" 2
1787 1 22 PHE HZ 1 45 ILE H 3.723 . 5.456 4.845 4.765 4.876 . 0 0 "[ . 1 . 2]" 2
1788 1 44 ASN HA 1 45 ILE H 2.328 . 3.005 2.122 2.113 2.131 . 0 0 "[ . 1 . 2]" 2
1789 1 20 GLY HA3 1 45 ILE H 3.407 . 4.858 2.945 2.892 3.027 . 0 0 "[ . 1 . 2]" 2
1790 1 44 ASN HB2 1 45 ILE H 3.259 . 4.586 4.449 4.425 4.485 . 0 0 "[ . 1 . 2]" 2
1791 1 21 ILE HG12 1 45 ILE H 3.606 . 5.231 5.093 5.005 5.156 . 0 0 "[ . 1 . 2]" 2
1792 1 106 ILE H 1 107 ILE H 3.603 . 5.226 4.212 4.182 4.245 . 0 0 "[ . 1 . 2]" 2
1793 1 11 GLU HA 1 107 ILE H 3.622 . 5.262 4.990 4.950 5.091 . 0 0 "[ . 1 . 2]" 2
1794 1 11 GLU HB2 1 107 ILE H 3.206 . 4.491 4.549 4.530 4.574 0.083 9 0 "[ . 1 . 2]" 2
1795 1 107 ILE H 1 107 ILE HG13 2.381 . 3.090 2.289 2.268 2.306 . 0 0 "[ . 1 . 2]" 2
1796 1 22 PHE QD 1 45 ILE H 3.692 . 5.396 4.455 4.432 4.478 . 0 0 "[ . 1 . 2]" 2
1797 1 17 ASN H 1 20 GLY H 3.505 . 5.040 3.302 3.245 3.352 . 0 0 "[ . 1 . 2]" 2
1798 1 20 GLY H 1 20 GLY HA2 2.781 . 3.748 2.445 2.435 2.452 . 0 0 "[ . 1 . 2]" 2
1799 1 19 GLU HA 1 20 GLY H 3.081 . 4.267 3.466 3.461 3.479 . 0 0 "[ . 1 . 2]" 2
1800 1 18 ILE HA 1 20 GLY H 3.355 . 4.762 3.996 3.979 4.035 . 0 0 "[ . 1 . 2]" 2
1801 1 20 GLY H 1 20 GLY HA3 2.587 . 3.423 2.950 2.947 2.952 . 0 0 "[ . 1 . 2]" 2
1802 1 19 GLU QG 1 20 GLY H 3.183 . 4.449 4.259 4.194 4.366 . 0 0 "[ . 1 . 2]" 2
1803 1 19 GLU HB2 1 20 GLY H 2.941 . 4.023 2.749 2.652 2.808 . 0 0 "[ . 1 . 2]" 2
1804 1 20 GLY H 1 21 ILE HG12 3.621 . 5.260 3.435 3.403 3.495 . 0 0 "[ . 1 . 2]" 2
1805 1 20 GLY H 1 21 ILE HB 3.400 . 4.845 4.339 4.276 4.408 . 0 0 "[ . 1 . 2]" 2
1806 1 85 TRP HB2 1 87 TRP HE1 3.680 . 5.373 5.294 4.985 5.380 0.007 10 0 "[ . 1 . 2]" 2
1807 1 87 TRP HB3 1 87 TRP HE1 3.745 . 5.498 5.217 5.212 5.224 . 0 0 "[ . 1 . 2]" 2
1808 1 77 ARG HD2 1 87 TRP HE1 3.216 . 4.509 3.092 2.655 3.871 . 0 0 "[ . 1 . 2]" 2
1809 1 77 ARG HD3 1 87 TRP HE1 3.520 . 5.068 4.318 2.647 4.888 . 0 0 "[ . 1 . 2]" 2
1810 1 77 ARG HG3 1 87 TRP HE1 3.624 . 5.266 3.706 3.459 4.008 . 0 0 "[ . 1 . 2]" 2
1811 1 77 ARG HG2 1 87 TRP HE1 3.727 . 5.464 3.105 2.880 3.333 . 0 0 "[ . 1 . 2]" 2
1812 1 77 ARG HG2 1 78 PHE H 3.497 . 5.026 4.740 4.623 4.879 . 0 0 "[ . 1 . 2]" 2
1813 1 80 SER H 1 84 GLU H 2.830 . 3.831 2.709 2.353 2.865 . 0 0 "[ . 1 . 2]" 2
1814 1 78 PHE H 1 85 TRP HE3 3.075 . 4.257 3.838 3.748 3.919 . 0 0 "[ . 1 . 2]" 2
1815 1 78 PHE H 1 78 PHE HA 2.870 . 3.899 2.908 2.899 2.918 . 0 0 "[ . 1 . 2]" 2
1816 1 78 PHE H 1 86 LEU HB3 3.141 . 4.374 4.218 4.147 4.300 . 0 0 "[ . 1 . 2]" 2
1817 1 77 ARG HG3 1 78 PHE H 3.457 . 4.951 4.757 4.545 5.031 0.080 14 0 "[ . 1 . 2]" 2
1818 1 80 SER H 1 83 GLN H 3.283 . 4.631 3.979 3.783 4.112 . 0 0 "[ . 1 . 2]" 2
1819 1 80 SER H 1 86 LEU HG 2.797 . 3.775 2.761 2.733 2.798 . 0 0 "[ . 1 . 2]" 2
1820 1 99 TYR H 1 99 TYR HE1 3.548 . 5.122 4.423 4.181 5.139 0.017 4 0 "[ . 1 . 2]" 2
1821 1 99 TYR H 1 99 TYR HA 2.772 . 3.733 2.898 2.874 2.927 . 0 0 "[ . 1 . 2]" 2
1822 1 98 PRO HA 1 99 TYR H 2.708 . 3.625 3.228 3.127 3.360 . 0 0 "[ . 1 . 2]" 2
1823 1 99 TYR H 1 100 SER HA 3.392 . 4.831 4.686 4.535 4.772 . 0 0 "[ . 1 . 2]" 2
1824 1 99 TYR H 1 100 SER HB2 3.700 . 5.411 4.907 4.709 6.055 0.644 9 1 "[ . +1 . 2]" 2
1825 1 99 TYR H 1 99 TYR HB2 2.554 . 3.370 2.979 2.700 3.220 . 0 0 "[ . 1 . 2]" 2
1826 1 98 PRO HG3 1 99 TYR H 3.440 . 4.920 4.662 4.188 4.889 . 0 0 "[ . 1 . 2]" 2
1827 1 15 ARG HA 1 105 THR H 2.883 . 3.922 2.579 2.478 2.666 . 0 0 "[ . 1 . 2]" 2
1828 1 13 ILE HA 1 105 THR H 3.555 . 5.135 5.074 4.986 5.148 0.013 18 0 "[ . 1 . 2]" 2
1829 1 104 GLU HB3 1 105 THR H 2.998 . 4.122 4.210 4.180 4.459 0.337 7 0 "[ . 1 . 2]" 2
1830 1 15 ARG HG2 1 105 THR H 3.256 . 4.582 3.890 3.761 3.990 . 0 0 "[ . 1 . 2]" 2
1831 1 109 THR HB 1 119 GLU H 2.950 . 4.038 3.953 3.433 4.113 0.075 6 0 "[ . 1 . 2]" 2
1832 1 32 THR HA 1 119 GLU H 2.819 . 3.813 3.789 3.419 3.901 0.088 14 0 "[ . 1 . 2]" 2
1833 1 16 HIS HE2 1 105 THR H 3.529 . 5.086 4.062 3.992 4.117 . 0 0 "[ . 1 . 2]" 2
1834 1 16 HIS HD2 1 105 THR H 3.506 . 5.042 3.947 3.768 4.068 . 0 0 "[ . 1 . 2]" 2
1835 1 105 THR H 1 105 THR HA 2.969 . 4.071 2.938 2.935 2.942 . 0 0 "[ . 1 . 2]" 2
1836 1 105 THR H 1 106 ILE MD 3.755 . 5.517 3.848 3.796 3.955 . 0 0 "[ . 1 . 2]" 2
1837 1 103 ILE MG 1 105 THR H 3.483 . 5.000 3.841 3.791 3.913 . 0 0 "[ . 1 . 2]" 2
1838 1 86 LEU H 1 87 TRP H 3.742 . 5.492 4.321 4.284 4.384 . 0 0 "[ . 1 . 2]" 2
1839 1 86 LEU H 1 86 LEU HA 2.909 . 3.967 2.873 2.856 2.892 . 0 0 "[ . 1 . 2]" 2
1840 1 85 TRP HB2 1 86 LEU H 3.313 . 4.685 4.529 4.522 4.542 . 0 0 "[ . 1 . 2]" 2
1841 1 86 LEU H 1 86 LEU HG 2.626 . 3.488 2.775 2.657 2.895 . 0 0 "[ . 1 . 2]" 2
1842 1 77 ARG HB3 1 86 LEU H 3.404 . 4.852 4.142 4.027 4.304 . 0 0 "[ . 1 . 2]" 2
1843 1 95 ALA H 1 104 GLU H 2.889 . 3.933 2.508 2.294 2.620 . 0 0 "[ . 1 . 2]" 2
1844 1 94 THR H 1 95 ALA H 3.217 . 4.511 4.436 4.414 4.468 . 0 0 "[ . 1 . 2]" 2
1845 1 94 THR HB 1 95 ALA H 2.662 . 3.548 3.425 3.301 3.520 . 0 0 "[ . 1 . 2]" 2
1846 1 95 ALA H 1 95 ALA HA 2.623 . 3.483 2.745 2.710 2.765 . 0 0 "[ . 1 . 2]" 2
1847 1 95 ALA H 1 104 GLU HB2 3.396 . 4.838 3.725 3.565 4.261 . 0 0 "[ . 1 . 2]" 2
1848 1 95 ALA H 1 104 GLU HB3 3.391 . 4.828 4.651 3.913 4.838 0.010 10 0 "[ . 1 . 2]" 2
1849 1 95 ALA H 1 103 ILE HG13 3.557 . 5.138 4.507 4.419 4.604 . 0 0 "[ . 1 . 2]" 2
1850 1 64 VAL MG2 1 95 ALA H 3.323 . 4.704 4.567 4.471 4.650 . 0 0 "[ . 1 . 2]" 2
1851 1 95 ALA H 1 103 ILE MG 3.078 . 4.262 4.308 4.284 4.365 0.103 14 0 "[ . 1 . 2]" 2
1852 1 64 VAL MG2 1 104 GLU H 3.390 . 4.826 4.302 4.240 4.460 . 0 0 "[ . 1 . 2]" 2
1853 1 103 ILE H 1 104 GLU H 3.381 . 4.810 3.868 3.760 3.926 . 0 0 "[ . 1 . 2]" 2
1854 1 92 SER HA 1 104 GLU H 3.649 . 5.314 4.818 4.760 4.976 . 0 0 "[ . 1 . 2]" 2
1855 1 104 GLU H 1 104 GLU HA 2.950 . 4.038 2.865 2.844 2.873 . 0 0 "[ . 1 . 2]" 2
1856 1 104 GLU H 1 104 GLU HB2 2.576 . 3.406 2.355 2.299 2.829 . 0 0 "[ . 1 . 2]" 2
1857 1 103 ILE MG 1 104 GLU H 2.492 . 3.268 3.144 3.100 3.267 . 0 0 "[ . 1 . 2]" 2
1858 1 103 ILE HB 1 104 GLU H 3.354 . 4.760 4.378 4.359 4.404 . 0 0 "[ . 1 . 2]" 2
1859 1 22 PHE H 1 23 THR H 3.328 . 4.713 4.348 4.309 4.373 . 0 0 "[ . 1 . 2]" 2
1860 1 22 PHE H 1 42 GLY H 2.780 . 3.746 3.388 3.350 3.467 . 0 0 "[ . 1 . 2]" 2
1861 1 22 PHE H 1 43 LYS H 3.203 . 4.486 3.120 3.013 3.209 . 0 0 "[ . 1 . 2]" 2
1862 1 21 ILE H 1 22 PHE H 3.288 . 4.640 4.426 4.400 4.452 . 0 0 "[ . 1 . 2]" 2
1863 1 22 PHE H 1 22 PHE QE 3.584 . 5.190 4.756 4.743 4.775 . 0 0 "[ . 1 . 2]" 2
1864 1 22 PHE H 1 44 ASN HA 2.629 . 3.493 3.568 3.538 3.588 0.095 18 0 "[ . 1 . 2]" 2
1865 1 22 PHE H 1 42 GLY HA3 3.624 . 5.265 5.349 5.332 5.369 0.104 18 0 "[ . 1 . 2]" 2
1866 1 22 PHE H 1 22 PHE HB2 2.524 . 3.320 2.264 2.254 2.272 . 0 0 "[ . 1 . 2]" 2
1867 1 16 HIS HB3 1 22 PHE H 3.337 . 4.729 3.785 3.714 3.850 . 0 0 "[ . 1 . 2]" 2
1868 1 22 PHE H 1 22 PHE HB3 2.656 . 3.538 3.517 3.511 3.524 . 0 0 "[ . 1 . 2]" 2
1869 1 21 ILE HB 1 22 PHE H 3.181 . 4.446 4.125 4.079 4.147 . 0 0 "[ . 1 . 2]" 2
1870 1 22 PHE H 1 25 VAL MG2 3.646 . 5.308 4.717 4.698 4.749 . 0 0 "[ . 1 . 2]" 2
1871 1 72 LEU H 1 92 SER H 2.725 . 3.653 3.214 3.035 3.330 . 0 0 "[ . 1 . 2]" 2
1872 1 92 SER H 1 93 GLN H 3.411 . 4.865 4.469 4.431 4.496 . 0 0 "[ . 1 . 2]" 2
1873 1 91 SER HA 1 92 SER H 2.228 . 2.849 2.382 2.354 2.398 . 0 0 "[ . 1 . 2]" 2
1874 1 90 THR HB 1 92 SER H 3.559 . 5.143 3.857 3.781 3.948 . 0 0 "[ . 1 . 2]" 2
1875 1 92 SER H 1 92 SER HB3 2.727 . 3.657 3.580 3.570 3.593 . 0 0 "[ . 1 . 2]" 2
1876 1 72 LEU HB3 1 92 SER H 3.247 . 4.565 4.114 3.985 4.196 . 0 0 "[ . 1 . 2]" 2
1877 1 91 SER H 1 92 SER H 3.360 . 4.771 3.493 3.460 3.578 . 0 0 "[ . 1 . 2]" 2
1878 1 92 SER H 1 103 ILE MG 3.687 . 5.386 4.788 4.748 4.840 . 0 0 "[ . 1 . 2]" 2
1879 1 15 ARG H 1 26 ASP H 3.765 . 5.537 4.588 4.399 4.680 . 0 0 "[ . 1 . 2]" 2
1880 1 13 ILE H 1 26 ASP H 3.544 . 5.114 3.980 3.902 4.051 . 0 0 "[ . 1 . 2]" 2
1881 1 25 VAL H 1 26 ASP H 2.975 . 4.081 4.103 4.087 4.121 0.040 14 0 "[ . 1 . 2]" 2
1882 1 12 PHE QE 1 26 ASP H 3.588 . 5.197 4.272 4.174 4.347 . 0 0 "[ . 1 . 2]" 2
1883 1 14 SER QB 1 26 ASP H 3.498 . 4.760 3.495 3.429 3.565 . 0 0 "[ . 1 . 2]" 2
1884 1 26 ASP H 1 26 ASP HA 2.712 . 3.632 2.839 2.825 2.847 . 0 0 "[ . 1 . 2]" 2
1885 1 13 ILE HB 1 26 ASP H 3.464 . 4.964 4.136 4.014 4.177 . 0 0 "[ . 1 . 2]" 2
1886 1 13 ILE MG 1 26 ASP H 3.397 . 4.840 4.522 4.470 4.553 . 0 0 "[ . 1 . 2]" 2
1887 1 25 VAL MG2 1 26 ASP H 3.126 . 4.348 4.223 4.214 4.249 . 0 0 "[ . 1 . 2]" 2
1888 1 28 ARG H 1 30 VAL H 3.683 . 5.378 4.498 4.448 4.611 . 0 0 "[ . 1 . 2]" 2
1889 1 30 VAL H 1 31 ALA H 2.521 . 3.316 2.453 2.388 2.473 . 0 0 "[ . 1 . 2]" 2
1890 1 30 VAL H 1 32 THR H 2.697 . 3.606 3.644 3.626 3.690 0.084 20 0 "[ . 1 . 2]" 2
1891 1 28 ARG HA 1 30 VAL H 2.861 . 3.884 3.719 3.659 3.824 . 0 0 "[ . 1 . 2]" 2
1892 1 30 VAL H 1 32 THR HB 3.535 . 5.097 4.888 4.838 4.986 . 0 0 "[ . 1 . 2]" 2
1893 1 29 CYS HB3 1 30 VAL H 3.230 . 4.534 4.132 4.096 4.153 . 0 0 "[ . 1 . 2]" 2
1894 1 30 VAL H 1 31 ALA MB 3.099 . 4.299 4.173 4.100 4.193 . 0 0 "[ . 1 . 2]" 2
1895 1 29 CYS HB2 1 30 VAL H 3.352 . 4.757 3.982 3.949 4.015 . 0 0 "[ . 1 . 2]" 2
1896 1 30 VAL H 1 33 VAL MG2 3.589 . 5.199 4.565 4.532 4.597 . 0 0 "[ . 1 . 2]" 2
1897 1 25 VAL MG1 1 30 VAL H 3.712 . 5.435 5.057 5.017 5.092 . 0 0 "[ . 1 . 2]" 2
1898 1 24 PHE H 1 25 VAL H 2.998 . 4.122 4.186 4.165 4.198 0.076 8 0 "[ . 1 . 2]" 2
1899 1 24 PHE QD 1 25 VAL H 2.781 . 3.748 3.089 3.031 3.164 . 0 0 "[ . 1 . 2]" 2
1900 1 14 SER HA 1 25 VAL H 3.596 . 5.212 4.273 4.231 4.501 . 0 0 "[ . 1 . 2]" 2
1901 1 24 PHE HB3 1 25 VAL H 3.014 . 4.150 3.993 3.950 4.042 . 0 0 "[ . 1 . 2]" 2
1902 1 24 PHE HB2 1 25 VAL H 3.358 . 4.768 3.818 3.777 3.864 . 0 0 "[ . 1 . 2]" 2
1903 1 25 VAL H 1 37 PRO HB3 3.527 . 5.082 3.595 3.563 3.642 . 0 0 "[ . 1 . 2]" 2
1904 1 25 VAL H 1 41 LEU MD2 2.544 . 3.353 2.967 2.873 3.044 . 0 0 "[ . 1 . 2]" 2
1905 1 30 VAL H 1 40 LEU QD 3.790 . 5.586 4.735 4.688 4.776 . 0 0 "[ . 1 . 2]" 2
1906 1 89 ARG H 1 108 CYS H 2.782 . 3.750 2.671 2.590 2.758 . 0 0 "[ . 1 . 2]" 2
1907 1 107 ILE H 1 108 CYS H 3.228 . 4.530 4.351 4.321 4.384 . 0 0 "[ . 1 . 2]" 2
1908 1 11 GLU HB2 1 108 CYS H 3.266 . 4.599 4.249 4.191 4.336 . 0 0 "[ . 1 . 2]" 2
1909 1 88 MET HB3 1 108 CYS H 3.242 . 4.556 3.241 3.107 3.361 . 0 0 "[ . 1 . 2]" 2
1910 1 90 THR MG 1 108 CYS H 3.290 . 4.643 4.357 4.309 4.416 . 0 0 "[ . 1 . 2]" 2
1911 1 107 ILE HB 1 108 CYS H 3.348 . 4.749 4.386 4.366 4.394 . 0 0 "[ . 1 . 2]" 2
1912 1 87 TRP H 1 110 ASN H 3.584 . 5.190 4.789 4.629 5.030 . 0 0 "[ . 1 . 2]" 2
1913 1 86 LEU HA 1 87 TRP H 2.150 . 2.728 2.210 2.194 2.221 . 0 0 "[ . 1 . 2]" 2
1914 1 87 TRP H 1 87 TRP HB2 2.404 . 3.126 2.215 2.206 2.237 . 0 0 "[ . 1 . 2]" 2
1915 1 87 TRP H 1 87 TRP HB3 2.585 . 3.420 3.512 3.505 3.527 0.107 11 0 "[ . 1 . 2]" 2
1916 1 87 TRP H 1 110 ASN HB3 3.559 . 5.143 5.085 4.728 5.181 0.038 17 0 "[ . 1 . 2]" 2
1917 1 87 TRP H 1 88 MET ME 3.478 . 4.990 4.813 4.736 4.872 . 0 0 "[ . 1 . 2]" 2
1918 1 86 LEU HB3 1 87 TRP H 2.836 . 3.842 3.794 3.706 3.841 . 0 0 "[ . 1 . 2]" 2
1919 1 86 LEU QD 1 87 TRP H 2.751 . 3.697 3.501 3.471 3.515 . 0 0 "[ . 1 . 2]" 2
1920 1 80 SER H 1 81 LYS H 3.553 . 5.131 4.427 4.390 4.447 . 0 0 "[ . 1 . 2]" 2
1921 1 35 TYR HD2 1 81 LYS H 3.249 . 4.568 3.850 3.730 4.055 . 0 0 "[ . 1 . 2]" 2
1922 1 35 TYR H 1 81 LYS H 3.668 . 5.350 3.407 3.313 3.559 . 0 0 "[ . 1 . 2]" 2
1923 1 33 VAL HA 1 81 LYS H 3.246 . 4.563 3.764 3.677 3.832 . 0 0 "[ . 1 . 2]" 2
1924 1 81 LYS H 1 81 LYS HA 2.616 . 3.472 2.789 2.772 2.826 . 0 0 "[ . 1 . 2]" 2
1925 1 33 VAL HB 1 81 LYS H 3.271 . 4.609 3.514 3.422 3.649 . 0 0 "[ . 1 . 2]" 2
1926 1 81 LYS H 1 86 LEU HG 3.736 . 5.480 5.288 5.221 5.445 . 0 0 "[ . 1 . 2]" 2
1927 1 87 TRP H 1 88 MET H 3.331 . 4.718 4.494 4.474 4.512 . 0 0 "[ . 1 . 2]" 2
1928 1 75 MET HA 1 88 MET H 3.496 . 5.023 4.137 4.106 4.166 . 0 0 "[ . 1 . 2]" 2
1929 1 88 MET H 1 88 MET ME 3.440 . 4.919 4.968 4.946 4.984 0.065 7 0 "[ . 1 . 2]" 2
1930 1 88 MET H 1 107 ILE MG 3.724 . 5.457 4.745 4.719 4.772 . 0 0 "[ . 1 . 2]" 2
1931 1 23 THR H 1 24 PHE H 2.296 . 2.955 2.245 2.196 2.306 . 0 0 "[ . 1 . 2]" 2
1932 1 15 ARG H 1 24 PHE H 2.669 . 3.559 3.354 3.281 3.456 . 0 0 "[ . 1 . 2]" 2
1933 1 24 PHE H 1 24 PHE QD 3.323 . 4.703 4.301 4.279 4.331 . 0 0 "[ . 1 . 2]" 2
1934 1 16 HIS HA 1 24 PHE H 2.876 . 3.910 3.770 3.730 3.818 . 0 0 "[ . 1 . 2]" 2
1935 1 22 PHE HB2 1 24 PHE H 3.373 . 4.795 4.238 4.177 4.290 . 0 0 "[ . 1 . 2]" 2
1936 1 16 HIS HB3 1 24 PHE H 3.475 . 4.985 4.301 4.242 4.354 . 0 0 "[ . 1 . 2]" 2
1937 1 22 PHE HB3 1 24 PHE H 3.207 . 4.492 2.818 2.790 2.857 . 0 0 "[ . 1 . 2]" 2
1938 1 15 ARG QB 1 24 PHE H 2.909 . 3.967 3.357 3.284 3.513 . 0 0 "[ . 1 . 2]" 2
1939 1 23 THR MG 1 24 PHE H 3.059 . 4.228 4.014 3.987 4.063 . 0 0 "[ . 1 . 2]" 2
1940 1 110 ASN H 1 111 THR MG 3.410 . 4.864 3.573 2.626 4.718 . 0 0 "[ . 1 . 2]" 2
1941 1 89 ARG H 1 110 ASN H 3.362 . 4.775 4.782 4.531 4.822 0.047 7 0 "[ . 1 . 2]" 2
1942 1 110 ASN H 1 110 ASN HA 2.695 . 3.603 2.936 2.878 2.948 . 0 0 "[ . 1 . 2]" 2
1943 1 109 THR HA 1 110 ASN H 2.261 . 2.900 2.226 2.198 2.285 . 0 0 "[ . 1 . 2]" 2
1944 1 88 MET ME 1 110 ASN H 3.337 . 4.729 4.351 4.198 4.452 . 0 0 "[ . 1 . 2]" 2
1945 1 109 THR MG 1 110 ASN H 2.827 . 3.826 3.845 3.796 3.917 0.091 6 0 "[ . 1 . 2]" 2
1946 1 74 VAL H 1 75 MET H 3.307 . 4.674 4.349 4.334 4.381 . 0 0 "[ . 1 . 2]" 2
1947 1 74 VAL H 1 74 VAL HA 2.914 . 3.976 2.946 2.942 2.958 . 0 0 "[ . 1 . 2]" 2
1948 1 74 VAL H 1 90 THR HB 3.254 . 4.577 4.625 4.609 4.639 0.062 11 0 "[ . 1 . 2]" 2
1949 1 73 SER HB2 1 74 VAL H 3.163 . 4.413 4.414 3.810 4.456 0.043 4 0 "[ . 1 . 2]" 2
1950 1 74 VAL H 1 89 ARG HB3 3.480 . 4.993 4.500 4.452 4.564 . 0 0 "[ . 1 . 2]" 2
1951 1 74 VAL H 1 90 THR MG 2.999 . 4.123 3.475 3.402 3.589 . 0 0 "[ . 1 . 2]" 2
1952 1 74 VAL H 1 89 ARG QD 3.706 . 5.423 5.417 5.314 5.440 0.017 18 0 "[ . 1 . 2]" 2
1953 1 27 HIS H 1 28 ARG H 2.578 . 3.409 2.962 2.922 3.012 . 0 0 "[ . 1 . 2]" 2
1954 1 12 PHE HA 1 28 ARG H 3.830 . 5.664 4.311 4.201 4.500 . 0 0 "[ . 1 . 2]" 2
1955 1 26 ASP HA 1 28 ARG H 3.581 . 5.184 3.925 3.870 4.010 . 0 0 "[ . 1 . 2]" 2
1956 1 27 HIS HB2 1 28 ARG H 3.420 . 4.882 4.255 3.927 4.304 . 0 0 "[ . 1 . 2]" 2
1957 1 28 ARG H 1 28 ARG HB2 2.784 . 3.753 2.273 2.217 2.313 . 0 0 "[ . 1 . 2]" 2
1958 1 28 ARG H 1 28 ARG HB3 2.823 . 3.819 3.549 3.513 3.570 . 0 0 "[ . 1 . 2]" 2
1959 1 12 PHE HB3 1 28 ARG H 3.479 . 4.992 4.135 4.047 4.348 . 0 0 "[ . 1 . 2]" 2
1960 1 57 LEU HA 1 61 PHE H 3.391 . 4.828 4.600 4.533 4.661 . 0 0 "[ . 1 . 2]" 2
1961 1 61 PHE H 1 63 GLN H 3.188 . 4.459 4.112 4.069 4.142 . 0 0 "[ . 1 . 2]" 2
1962 1 60 SER H 1 61 PHE H 2.511 . 3.299 2.919 2.878 2.952 . 0 0 "[ . 1 . 2]" 2
1963 1 61 PHE H 1 62 GLN H 2.438 . 3.181 2.758 2.719 2.780 . 0 0 "[ . 1 . 2]" 2
1964 1 61 PHE H 1 61 PHE QE 3.109 . 4.317 4.157 4.073 4.208 . 0 0 "[ . 1 . 2]" 2
1965 1 61 PHE H 1 61 PHE HA 2.681 . 3.580 2.767 2.761 2.778 . 0 0 "[ . 1 . 2]" 2
1966 1 59 ASP HA 1 61 PHE H 3.310 . 4.680 4.679 4.629 4.709 0.029 3 0 "[ . 1 . 2]" 2
1967 1 61 PHE H 1 61 PHE HB2 2.281 . 2.931 2.673 2.647 2.721 . 0 0 "[ . 1 . 2]" 2
1968 1 61 PHE H 1 64 VAL MG1 3.693 . 5.398 3.642 3.596 3.702 . 0 0 "[ . 1 . 2]" 2
1969 1 61 PHE H 1 103 ILE MD 3.133 . 4.360 4.405 4.382 4.432 0.072 3 0 "[ . 1 . 2]" 2
1970 1 71 VAL H 1 72 LEU H 3.300 . 4.662 4.547 4.536 4.556 . 0 0 "[ . 1 . 2]" 2
1971 1 71 VAL H 1 71 VAL HA 2.710 . 3.628 2.873 2.871 2.879 . 0 0 "[ . 1 . 2]" 2
1972 1 70 GLN HA 1 71 VAL H 2.012 . 2.518 2.156 2.145 2.176 . 0 0 "[ . 1 . 2]" 2
1973 1 76 PHE H 1 77 ARG H 3.378 . 4.805 4.429 4.418 4.435 . 0 0 "[ . 1 . 2]" 2
1974 1 77 ARG H 1 85 TRP HE3 3.441 . 4.921 4.834 4.721 4.916 . 0 0 "[ . 1 . 2]" 2
1975 1 77 ARG H 1 87 TRP HZ3 3.355 . 4.762 4.806 4.783 4.827 0.065 2 0 "[ . 1 . 2]" 2
1976 1 76 PHE HA 1 77 ARG H 2.493 . 3.270 2.392 2.360 2.432 . 0 0 "[ . 1 . 2]" 2
1977 1 76 PHE HB2 1 77 ARG H 2.751 . 3.697 2.456 2.424 2.492 . 0 0 "[ . 1 . 2]" 2
1978 1 76 PHE HB3 1 77 ARG H 2.825 . 3.822 3.849 3.835 3.866 0.044 5 0 "[ . 1 . 2]" 2
1979 1 53 ASP HB2 1 77 ARG H 3.162 . 4.411 3.108 3.006 3.168 . 0 0 "[ . 1 . 2]" 2
1980 1 50 HIS HB3 1 77 ARG H 3.166 . 4.419 3.168 3.055 3.277 . 0 0 "[ . 1 . 2]" 2
1981 1 77 ARG H 1 77 ARG HD2 3.505 . 5.041 4.558 4.297 4.850 . 0 0 "[ . 1 . 2]" 2
1982 1 50 HIS HB2 1 77 ARG H 3.040 . 4.195 3.321 3.248 3.393 . 0 0 "[ . 1 . 2]" 2
1983 1 77 ARG H 1 77 ARG HB2 2.802 . 3.784 2.405 2.322 2.526 . 0 0 "[ . 1 . 2]" 2
1984 1 77 ARG H 1 77 ARG HG2 3.135 . 4.364 4.090 3.761 4.314 . 0 0 "[ . 1 . 2]" 2
1985 1 77 ARG H 1 78 PHE H 3.441 . 4.921 4.269 4.223 4.299 . 0 0 "[ . 1 . 2]" 2
1986 1 12 PHE QD 1 13 ILE H 3.154 . 4.397 3.842 3.822 3.892 . 0 0 "[ . 1 . 2]" 2
1987 1 13 ILE H 1 26 ASP HB2 3.314 . 4.687 2.845 2.780 2.957 . 0 0 "[ . 1 . 2]" 2
1988 1 13 ILE H 1 26 ASP HB3 2.641 . 3.513 2.097 2.002 2.165 . 0 0 "[ . 1 . 2]" 2
1989 1 102 GLU H 1 103 ILE H 3.298 . 4.658 4.230 4.151 4.304 . 0 0 "[ . 1 . 2]" 2
1990 1 15 ARG HA 1 103 ILE H 3.543 . 5.112 4.575 4.339 4.805 . 0 0 "[ . 1 . 2]" 2
1991 1 102 GLU HA 1 103 ILE H 2.448 . 3.197 2.843 2.762 2.954 . 0 0 "[ . 1 . 2]" 2
1992 1 103 ILE H 1 103 ILE HA 2.988 . 4.104 2.905 2.900 2.915 . 0 0 "[ . 1 . 2]" 2
1993 1 102 GLU HB2 1 103 ILE H 2.257 . 2.894 2.698 2.625 2.949 0.055 10 0 "[ . 1 . 2]" 2
1994 1 85 TRP H 1 86 LEU H 3.435 . 4.910 4.093 4.012 4.176 . 0 0 "[ . 1 . 2]" 2
1995 1 95 ALA MB 1 103 ILE H 3.266 . 4.599 3.069 2.923 3.232 . 0 0 "[ . 1 . 2]" 2
1996 1 13 ILE HB 1 14 SER H 3.273 . 4.612 4.332 4.314 4.345 . 0 0 "[ . 1 . 2]" 2
1997 1 14 SER H 1 15 ARG H 3.478 . 4.990 4.315 4.288 4.342 . 0 0 "[ . 1 . 2]" 2
1998 1 14 SER H 1 105 THR H 3.101 . 4.303 3.886 3.801 4.020 . 0 0 "[ . 1 . 2]" 2
1999 1 12 PHE QD 1 14 SER H 3.689 . 5.390 3.815 3.750 3.868 . 0 0 "[ . 1 . 2]" 2
2000 1 13 ILE MG 1 14 SER H 2.463 . 3.221 3.128 3.101 3.167 . 0 0 "[ . 1 . 2]" 2
2001 1 14 SER H 1 104 GLU HG3 3.702 . 5.415 5.309 4.702 5.438 0.023 16 0 "[ . 1 . 2]" 2
2002 1 66 LYS H 1 67 LEU H 2.255 . 2.891 2.479 2.388 2.519 . 0 0 "[ . 1 . 2]" 2
2003 1 65 VAL H 1 67 LEU H 3.241 . 4.554 3.961 3.888 4.039 . 0 0 "[ . 1 . 2]" 2
2004 1 67 LEU H 1 67 LEU HA 2.527 . 3.325 2.915 2.907 2.922 . 0 0 "[ . 1 . 2]" 2
2005 1 66 LYS HA 1 67 LEU H 2.711 . 3.630 3.499 3.487 3.505 . 0 0 "[ . 1 . 2]" 2
2006 1 65 VAL HA 1 67 LEU H 3.250 . 4.570 4.358 4.279 4.441 . 0 0 "[ . 1 . 2]" 2
2007 1 17 ASN HD22 1 21 ILE H 3.446 . 4.930 3.308 2.559 3.419 . 0 0 "[ . 1 . 2]" 2
2008 1 21 ILE H 1 44 ASN HA 3.362 . 4.775 3.314 3.270 3.357 . 0 0 "[ . 1 . 2]" 2
2009 1 20 GLY HA3 1 21 ILE H 3.002 . 4.128 3.186 3.146 3.207 . 0 0 "[ . 1 . 2]" 2
2010 1 21 ILE H 1 21 ILE MG 2.713 . 3.633 3.713 3.710 3.721 0.088 19 0 "[ . 1 . 2]" 2
2011 1 43 LYS H 1 48 PHE QE 3.459 . 4.955 4.635 4.589 4.690 . 0 0 "[ . 1 . 2]" 2
2012 1 19 GLU H 1 21 ILE H 3.223 . 4.521 3.989 3.964 4.055 . 0 0 "[ . 1 . 2]" 2
2013 1 20 GLY HA2 1 21 ILE H 3.136 . 4.365 3.356 3.343 3.374 . 0 0 "[ . 1 . 2]" 2
2014 1 31 ALA H 1 31 ALA HA 2.333 . 3.013 2.886 2.882 2.889 . 0 0 "[ . 1 . 2]" 2
2015 1 30 VAL HA 1 31 ALA H 2.943 . 4.026 3.508 3.475 3.518 . 0 0 "[ . 1 . 2]" 2
2016 1 29 CYS HA 1 31 ALA H 3.702 . 5.415 4.308 4.215 4.354 . 0 0 "[ . 1 . 2]" 2
2017 1 30 VAL QG 1 31 ALA H 2.681 . 3.579 2.383 2.356 2.428 . 0 0 "[ . 1 . 2]" 2
2018 1 75 MET H 1 76 PHE H 3.354 . 4.760 4.420 4.414 4.425 . 0 0 "[ . 1 . 2]" 2
2019 1 76 PHE H 1 76 PHE HE1 3.327 . 4.711 4.311 4.255 4.344 . 0 0 "[ . 1 . 2]" 2
2020 1 76 PHE H 1 87 TRP HA 3.277 . 4.619 4.311 4.231 4.414 . 0 0 "[ . 1 . 2]" 2
2021 1 76 PHE H 1 76 PHE HB2 3.160 . 4.408 3.915 3.910 3.924 . 0 0 "[ . 1 . 2]" 2
2022 1 76 PHE H 1 76 PHE HB3 3.054 . 4.220 3.105 3.098 3.118 . 0 0 "[ . 1 . 2]" 2
2023 1 75 MET HG2 1 76 PHE H 3.182 . 4.447 4.075 3.949 4.116 . 0 0 "[ . 1 . 2]" 2
2024 1 76 PHE H 1 88 MET HG2 3.637 . 5.290 5.347 5.319 5.367 0.077 2 0 "[ . 1 . 2]" 2
2025 1 75 MET HB3 1 76 PHE H 2.784 . 3.753 3.207 3.178 3.224 . 0 0 "[ . 1 . 2]" 2
2026 1 75 MET ME 1 76 PHE H 3.585 . 5.191 3.920 3.150 4.020 . 0 0 "[ . 1 . 2]" 2
2027 1 76 PHE H 1 90 THR MG 3.117 . 4.332 3.846 3.808 3.901 . 0 0 "[ . 1 . 2]" 2
2028 1 42 GLY H 1 43 LYS H 2.552 . 3.366 2.568 2.510 2.651 . 0 0 "[ . 1 . 2]" 2
2029 1 43 LYS H 1 43 LYS HA 2.667 . 3.556 2.929 2.925 2.934 . 0 0 "[ . 1 . 2]" 2
2030 1 22 PHE HB2 1 43 LYS H 3.007 . 4.138 2.669 2.593 2.723 . 0 0 "[ . 1 . 2]" 2
2031 1 22 PHE HB3 1 43 LYS H 3.229 . 4.533 4.342 4.271 4.396 . 0 0 "[ . 1 . 2]" 2
2032 1 43 LYS H 1 43 LYS HB3 2.718 . 3.642 3.691 3.674 3.707 0.065 16 0 "[ . 1 . 2]" 2
2033 1 44 ASN H 1 45 ILE H 3.388 . 4.823 4.413 4.389 4.431 . 0 0 "[ . 1 . 2]" 2
2034 1 21 ILE HG12 1 44 ASN H 3.638 . 5.293 5.361 5.339 5.414 0.121 18 0 "[ . 1 . 2]" 2
2035 1 44 ASN H 1 44 ASN HD21 3.279 . 4.623 4.306 4.210 4.414 . 0 0 "[ . 1 . 2]" 2
2036 1 44 ASN H 1 48 PHE QE 3.324 . 4.705 4.090 3.865 4.156 . 0 0 "[ . 1 . 2]" 2
2037 1 44 ASN H 1 44 ASN HA 2.231 . 2.853 2.851 2.841 2.879 0.026 6 0 "[ . 1 . 2]" 2
2038 1 21 ILE HA 1 44 ASN H 3.361 . 4.773 3.799 3.739 3.892 . 0 0 "[ . 1 . 2]" 2
2039 1 44 ASN H 1 47 GLU HB2 3.276 . 4.618 3.314 3.195 3.364 . 0 0 "[ . 1 . 2]" 2
2040 1 43 LYS QD 1 44 ASN H 3.334 . 4.723 4.504 3.756 4.598 . 0 0 "[ . 1 . 2]" 2
2041 1 43 LYS HG2 1 44 ASN H 3.129 . 4.353 4.455 4.391 4.473 0.120 14 0 "[ . 1 . 2]" 2
2042 1 43 LYS H 1 44 ASN H 3.342 . 4.738 4.487 4.470 4.516 . 0 0 "[ . 1 . 2]" 2
2043 1 18 ILE H 1 20 GLY H 3.333 . 4.721 4.142 4.117 4.193 . 0 0 "[ . 1 . 2]" 2
2044 1 17 ASN HD22 1 18 ILE H 3.797 . 5.599 5.528 5.145 5.613 0.014 19 0 "[ . 1 . 2]" 2
2045 1 17 ASN HA 1 18 ILE H 2.577 . 3.407 2.606 2.586 2.647 . 0 0 "[ . 1 . 2]" 2
2046 1 18 ILE H 1 102 GLU HA 3.586 . 5.193 4.316 4.201 4.521 . 0 0 "[ . 1 . 2]" 2
2047 1 18 ILE H 1 18 ILE HA 2.345 . 3.032 2.760 2.747 2.765 . 0 0 "[ . 1 . 2]" 2
2048 1 17 ASN HB3 1 18 ILE H 2.746 . 3.689 3.587 3.154 3.720 0.031 18 0 "[ . 1 . 2]" 2
2049 1 18 ILE H 1 19 GLU QG 3.664 . 5.342 4.793 4.656 5.109 . 0 0 "[ . 1 . 2]" 2
2050 1 18 ILE H 1 19 GLU HB2 3.430 . 4.900 4.803 4.688 4.872 . 0 0 "[ . 1 . 2]" 2
2051 1 18 ILE H 1 18 ILE MG 2.476 . 3.242 2.131 2.085 2.196 . 0 0 "[ . 1 . 2]" 2
2052 1 74 VAL HA 1 75 MET H 2.233 . 2.856 2.195 2.185 2.205 . 0 0 "[ . 1 . 2]" 2
2053 1 75 MET H 1 75 MET HG3 3.042 . 4.198 3.006 2.939 3.317 . 0 0 "[ . 1 . 2]" 2
2054 1 75 MET H 1 75 MET HG2 3.069 . 4.246 3.760 3.709 3.844 . 0 0 "[ . 1 . 2]" 2
2055 1 75 MET H 1 75 MET HB2 2.467 . 3.228 2.457 2.400 2.501 . 0 0 "[ . 1 . 2]" 2
2056 1 101 ASP H 1 102 GLU H 2.399 . 3.118 2.533 2.448 2.704 . 0 0 "[ . 1 . 2]" 2
2057 1 99 TYR HA 1 102 GLU H 3.454 . 4.946 3.502 3.396 3.969 . 0 0 "[ . 1 . 2]" 2
2058 1 28 ARG HB2 1 29 CYS H 2.672 . 3.565 3.057 3.005 3.114 . 0 0 "[ . 1 . 2]" 2
2059 1 12 PHE QD 1 29 CYS H 3.079 . 4.264 3.694 3.645 3.733 . 0 0 "[ . 1 . 2]" 2
2060 1 12 PHE QE 1 29 CYS H 3.735 . 5.479 5.131 5.072 5.186 . 0 0 "[ . 1 . 2]" 2
2061 1 29 CYS H 1 30 VAL H 2.591 . 3.430 2.937 2.879 2.959 . 0 0 "[ . 1 . 2]" 2
2062 1 29 CYS H 1 29 CYS HB2 2.564 . 3.386 3.518 3.508 3.524 0.138 20 0 "[ . 1 . 2]" 2
2063 1 29 CYS H 1 40 LEU QD 3.683 . 5.379 4.629 4.586 4.692 . 0 0 "[ . 1 . 2]" 2
2064 1 70 GLN H 1 70 GLN HA 2.433 . 3.173 2.768 2.741 2.805 . 0 0 "[ . 1 . 2]" 2
2065 1 67 LEU HB2 1 70 GLN H 3.272 . 4.611 2.954 2.900 3.051 . 0 0 "[ . 1 . 2]" 2
2066 1 69 GLY H 1 70 GLN H 2.863 . 3.887 2.804 2.744 2.875 . 0 0 "[ . 1 . 2]" 2
2067 1 68 LYS H 1 70 GLN H 3.449 . 4.936 4.375 4.182 4.558 . 0 0 "[ . 1 . 2]" 2
2068 1 70 GLN H 1 70 GLN HB3 2.323 . 2.998 2.709 2.596 2.854 . 0 0 "[ . 1 . 2]" 2
2069 1 57 LEU H 1 59 ASP H 3.374 . 4.797 3.803 3.748 3.884 . 0 0 "[ . 1 . 2]" 2
2070 1 55 GLN HA 1 57 LEU H 3.287 . 4.637 4.418 4.262 4.535 . 0 0 "[ . 1 . 2]" 2
2071 1 52 GLU H 1 53 ASP H 2.579 . 3.411 2.729 2.702 2.768 . 0 0 "[ . 1 . 2]" 2
2072 1 50 HIS HA 1 52 GLU H 3.781 . 5.568 4.625 4.498 4.705 . 0 0 "[ . 1 . 2]" 2
2073 1 52 GLU H 1 52 GLU HG2 2.429 . 3.167 3.015 2.184 3.321 0.154 4 0 "[ . 1 . 2]" 2
2074 1 50 HIS HB3 1 52 GLU H 3.646 . 5.307 4.225 4.109 4.314 . 0 0 "[ . 1 . 2]" 2
2075 1 89 ARG H 1 89 ARG HA 2.891 . 3.935 2.942 2.940 2.944 . 0 0 "[ . 1 . 2]" 2
2076 1 89 ARG H 1 109 THR HA 3.211 . 4.500 4.222 4.094 4.280 . 0 0 "[ . 1 . 2]" 2
2077 1 89 ARG H 1 107 ILE HA 3.384 . 4.816 4.079 4.038 4.118 . 0 0 "[ . 1 . 2]" 2
2078 1 89 ARG H 1 89 ARG HD2 3.603 . 5.226 5.085 5.044 5.113 . 0 0 "[ . 1 . 2]" 2
2079 1 88 MET HG2 1 89 ARG H 3.364 . 4.778 4.615 4.593 4.631 . 0 0 "[ . 1 . 2]" 2
2080 1 88 MET HG3 1 89 ARG H 3.423 . 4.887 4.989 4.962 5.019 0.132 10 0 "[ . 1 . 2]" 2
2081 1 89 ARG H 1 89 ARG HG2 2.583 . 3.417 3.174 3.073 3.237 . 0 0 "[ . 1 . 2]" 2
2082 1 97 ASN H 1 97 ASN HB3 3.028 . 4.174 3.208 2.402 4.103 . 0 0 "[ . 1 . 2]" 2
2083 1 96 GLN HB3 1 97 ASN H 3.330 . 4.716 3.092 2.695 4.504 . 0 0 "[ . 1 . 2]" 2
2084 1 101 ASP HA 1 102 GLU H 2.900 . 3.951 3.295 3.074 3.363 . 0 0 "[ . 1 . 2]" 2
2085 1 95 ALA MB 1 102 GLU H 2.811 . 3.799 3.321 3.203 3.456 . 0 0 "[ . 1 . 2]" 2
2086 1 56 LEU H 1 57 LEU H 2.444 . 3.191 2.356 2.292 2.510 . 0 0 "[ . 1 . 2]" 2
2087 1 53 ASP HA 1 56 LEU H 3.249 . 4.569 3.255 3.116 3.311 . 0 0 "[ . 1 . 2]" 2
2088 1 55 GLN QG 1 56 LEU H 3.004 . 4.132 3.941 3.806 4.301 0.169 18 0 "[ . 1 . 2]" 2
2089 1 55 GLN HB3 1 56 LEU H 2.470 . 3.233 2.804 2.467 2.917 . 0 0 "[ . 1 . 2]" 2
2090 1 11 GLU H 1 12 PHE H 3.422 . 4.885 4.097 4.076 4.115 . 0 0 "[ . 1 . 2]" 2
2091 1 11 GLU H 1 108 CYS HA 3.420 . 4.882 4.263 4.208 4.353 . 0 0 "[ . 1 . 2]" 2
2092 1 11 GLU H 1 11 GLU HG2 2.552 . 3.366 2.829 2.780 2.885 . 0 0 "[ . 1 . 2]" 2
2093 1 68 LYS H 1 69 GLY H 3.580 . 5.182 3.532 3.401 3.632 . 0 0 "[ . 1 . 2]" 2
2094 1 67 LEU H 1 68 LYS H 2.823 . 3.819 2.312 2.208 2.444 . 0 0 "[ . 1 . 2]" 2
2095 1 68 LYS H 1 68 LYS HB2 2.274 . 2.920 2.876 2.700 3.041 0.121 19 0 "[ . 1 . 2]" 2
2096 1 66 LYS H 1 66 LYS HA 2.356 . 3.050 2.848 2.840 2.867 . 0 0 "[ . 1 . 2]" 2
2097 1 65 VAL HA 1 66 LYS H 2.838 . 3.845 3.485 3.467 3.497 . 0 0 "[ . 1 . 2]" 2
2098 1 66 LYS H 1 66 LYS HB2 2.100 . 2.651 2.180 2.147 2.202 . 0 0 "[ . 1 . 2]" 2
2099 1 48 PHE HD1 1 49 CYS H 2.743 . 3.684 3.878 3.868 3.895 0.211 2 0 "[ . 1 . 2]" 2
2100 1 48 PHE HB3 1 49 CYS H 3.171 . 4.428 3.729 3.705 3.766 . 0 0 "[ . 1 . 2]" 2
2101 1 49 CYS H 1 50 HIS H 3.525 . 5.078 4.647 4.634 4.656 . 0 0 "[ . 1 . 2]" 2
2102 1 48 PHE H 1 49 CYS H 2.353 . 3.045 2.157 2.120 2.219 . 0 0 "[ . 1 . 2]" 2
2103 1 52 GLU H 1 53 ASP HB2 3.753 . 5.514 4.901 4.778 5.012 . 0 0 "[ . 1 . 2]" 2
2104 1 46 VAL H 1 48 PHE H 3.501 . 5.033 4.217 4.176 4.315 . 0 0 "[ . 1 . 2]" 2
2105 1 20 GLY HA2 1 46 VAL H 3.716 . 5.442 4.775 4.693 4.863 . 0 0 "[ . 1 . 2]" 2
2106 1 44 ASN HA 1 46 VAL H 3.462 . 4.960 3.937 3.900 4.015 . 0 0 "[ . 1 . 2]" 2
2107 1 56 LEU H 1 59 ASP H 3.160 . 4.408 4.431 4.417 4.458 0.050 18 0 "[ . 1 . 2]" 2
2108 1 59 ASP H 1 61 PHE H 3.373 . 4.795 4.388 4.233 4.442 . 0 0 "[ . 1 . 2]" 2
2109 1 59 ASP H 1 60 SER QB 3.391 . 4.828 4.518 4.392 4.766 . 0 0 "[ . 1 . 2]" 2
2110 1 55 GLN HA 1 59 ASP H 3.014 . 4.150 3.962 3.822 4.066 . 0 0 "[ . 1 . 2]" 2
2111 1 58 ARG QD 1 59 ASP H 3.458 . 4.952 4.643 4.420 4.772 . 0 0 "[ . 1 . 2]" 2
2112 1 59 ASP H 1 59 ASP HB3 2.246 . 2.876 2.560 2.482 2.606 . 0 0 "[ . 1 . 2]" 2
2113 1 58 ARG HB2 1 59 ASP H 2.295 . 2.953 2.628 2.470 2.769 . 0 0 "[ . 1 . 2]" 2
2114 1 53 ASP H 1 55 GLN H 3.578 . 5.178 4.220 4.157 4.314 . 0 0 "[ . 1 . 2]" 2
2115 1 55 GLN H 1 56 LEU H 2.554 . 3.369 2.609 2.460 2.686 . 0 0 "[ . 1 . 2]" 2
2116 1 55 GLN H 1 57 LEU H 3.621 . 5.260 4.031 3.883 4.076 . 0 0 "[ . 1 . 2]" 2
2117 1 54 GLN H 1 55 GLN H 2.794 . 3.770 2.667 2.618 2.691 . 0 0 "[ . 1 . 2]" 2
2118 1 53 ASP HA 1 55 GLN H 3.577 . 5.177 3.890 3.689 4.016 . 0 0 "[ . 1 . 2]" 2
2119 1 55 GLN H 1 55 GLN HB3 2.176 . 2.768 2.602 2.533 2.803 0.035 18 0 "[ . 1 . 2]" 2
2120 1 46 VAL H 1 49 CYS HB3 3.608 . 5.235 4.568 4.534 4.688 . 0 0 "[ . 1 . 2]" 2
2121 1 44 ASN HB2 1 46 VAL H 3.518 . 5.065 4.970 4.909 5.063 . 0 0 "[ . 1 . 2]" 2
2122 1 58 ARG H 1 59 ASP H 2.469 . 3.231 2.717 2.665 2.879 . 0 0 "[ . 1 . 2]" 2
2123 1 11 GLU HA 1 109 THR H 2.826 . 3.824 2.984 2.923 3.062 . 0 0 "[ . 1 . 2]" 2
2124 1 109 THR H 1 109 THR HA 2.670 . 3.561 2.821 2.793 2.844 . 0 0 "[ . 1 . 2]" 2
2125 1 109 THR H 1 109 THR HB 2.703 . 3.616 3.613 3.600 3.621 0.005 18 0 "[ . 1 . 2]" 2
2126 1 108 CYS HB3 1 109 THR H 3.093 . 4.289 4.255 4.157 4.299 0.010 9 0 "[ . 1 . 2]" 2
2127 1 108 CYS HB2 1 109 THR H 3.032 . 4.181 4.106 3.996 4.188 0.007 9 0 "[ . 1 . 2]" 2
2128 1 11 GLU HB3 1 109 THR H 3.149 . 4.389 3.751 3.675 3.827 . 0 0 "[ . 1 . 2]" 2
2129 1 32 THR MG 1 109 THR H 3.084 . 4.273 3.236 3.085 3.431 . 0 0 "[ . 1 . 2]" 2
2130 1 63 GLN H 1 64 VAL H 2.470 . 3.233 2.528 2.506 2.579 . 0 0 "[ . 1 . 2]" 2
2131 1 64 VAL H 1 66 LYS H 3.183 . 4.450 3.912 3.830 3.956 . 0 0 "[ . 1 . 2]" 2
2132 1 61 PHE QD 1 64 VAL H 3.552 . 5.129 5.021 4.950 5.161 0.032 17 0 "[ . 1 . 2]" 2
2133 1 64 VAL H 1 65 VAL H 2.524 . 3.320 2.556 2.530 2.579 . 0 0 "[ . 1 . 2]" 2
2134 1 61 PHE HA 1 64 VAL H 3.080 . 4.266 3.365 3.296 3.427 . 0 0 "[ . 1 . 2]" 2
2135 1 63 GLN HA 1 64 VAL H 2.798 . 3.776 3.558 3.552 3.567 . 0 0 "[ . 1 . 2]" 2
2136 1 64 VAL H 1 72 LEU HB3 3.486 . 5.005 5.038 5.025 5.053 0.048 19 0 "[ . 1 . 2]" 2
2137 1 64 VAL H 1 103 ILE MD 3.434 . 4.908 4.307 4.272 4.332 . 0 0 "[ . 1 . 2]" 2
2138 1 54 GLN H 1 57 LEU H 3.595 . 5.210 4.680 4.645 4.739 . 0 0 "[ . 1 . 2]" 2
2139 1 54 GLN H 1 56 LEU H 3.460 . 4.957 4.118 4.007 4.310 . 0 0 "[ . 1 . 2]" 2
2140 1 54 GLN H 1 54 GLN HE21 3.324 . 4.705 4.727 4.672 4.745 0.040 17 0 "[ . 1 . 2]" 2
2141 1 53 ASP HA 1 54 GLN H 2.986 . 4.100 3.447 3.407 3.464 . 0 0 "[ . 1 . 2]" 2
2142 1 54 GLN H 1 55 GLN HA 3.585 . 5.192 5.250 5.220 5.266 0.074 12 0 "[ . 1 . 2]" 2
2143 1 53 ASP HB3 1 54 GLN H 3.207 . 4.492 4.055 3.955 4.155 . 0 0 "[ . 1 . 2]" 2
2144 1 54 GLN H 1 54 GLN HG2 2.730 . 3.662 3.062 3.010 3.330 . 0 0 "[ . 1 . 2]" 2
2145 1 54 GLN H 1 54 GLN HB2 2.444 . 3.190 2.710 2.602 2.738 . 0 0 "[ . 1 . 2]" 2
2146 1 54 GLN H 1 54 GLN HB3 2.630 . 3.495 3.576 3.571 3.604 0.109 16 0 "[ . 1 . 2]" 2
2147 1 46 VAL QG 1 54 GLN H 3.373 . 4.795 4.543 4.525 4.602 . 0 0 "[ . 1 . 2]" 2
2148 1 52 GLU H 1 54 GLN H 3.251 . 4.572 4.182 4.057 4.213 . 0 0 "[ . 1 . 2]" 2
2149 1 15 ARG H 1 16 HIS H 3.423 . 4.888 4.539 4.525 4.546 . 0 0 "[ . 1 . 2]" 2
2150 1 15 ARG H 1 24 PHE QE 3.311 . 4.682 4.131 4.031 4.204 . 0 0 "[ . 1 . 2]" 2
2151 1 15 ARG H 1 22 PHE HA 3.579 . 5.180 4.674 4.629 4.730 . 0 0 "[ . 1 . 2]" 2
2152 1 15 ARG H 1 15 ARG HG2 3.222 . 4.520 4.108 3.975 4.337 . 0 0 "[ . 1 . 2]" 2
2153 1 15 ARG H 1 25 VAL MG1 3.623 . 5.264 4.682 4.515 4.749 . 0 0 "[ . 1 . 2]" 2
2154 1 15 ARG H 1 23 THR H 3.455 . 4.947 4.523 4.429 4.655 . 0 0 "[ . 1 . 2]" 2
2155 1 100 SER H 1 101 ASP H 2.963 . 4.060 2.707 2.639 2.780 . 0 0 "[ . 1 . 2]" 2
2156 1 101 ASP H 1 101 ASP HA 2.773 . 3.734 2.860 2.843 2.888 . 0 0 "[ . 1 . 2]" 2
2157 1 99 TYR HA 1 101 ASP H 3.391 . 4.829 3.427 3.163 3.614 . 0 0 "[ . 1 . 2]" 2
2158 1 5 ASN H 1 6 VAL H 3.370 . 4.790 3.190 2.001 4.621 . 0 0 "[ . 1 . 2]" 2
2159 1 3 MET ME 1 5 ASN H 3.497 . 5.026 3.913 3.250 4.661 . 0 0 "[ . 1 . 2]" 2
2160 1 5 ASN H 1 30 VAL QG 3.370 . 4.790 3.409 2.309 4.495 . 0 0 "[ . 1 . 2]" 2
2161 1 58 ARG H 1 59 ASP HB3 3.524 . 5.077 4.930 4.868 5.002 . 0 0 "[ . 1 . 2]" 2
2162 1 56 LEU HA 1 58 ARG H 3.512 . 5.054 4.856 4.787 4.881 . 0 0 "[ . 1 . 2]" 2
2163 1 57 LEU HG 1 58 ARG H 3.119 . 4.335 3.624 3.532 4.627 0.292 17 0 "[ . 1 . 2]" 2
2164 1 58 ARG H 1 60 SER H 3.388 . 4.823 4.368 4.268 4.420 . 0 0 "[ . 1 . 2]" 2
2165 1 57 LEU H 1 58 ARG H 2.487 . 3.260 2.745 2.657 2.774 . 0 0 "[ . 1 . 2]" 2
2166 1 55 GLN HA 1 58 ARG H 2.938 . 4.017 3.889 3.723 3.981 . 0 0 "[ . 1 . 2]" 2
2167 1 58 ARG H 1 58 ARG HG3 2.147 . 2.723 1.997 1.911 2.080 . 0 0 "[ . 1 . 2]" 2
2168 1 57 LEU HB2 1 58 ARG H 2.707 . 3.623 3.480 2.666 3.566 . 0 0 "[ . 1 . 2]" 2
2169 1 15 ARG QB 1 23 THR H 3.637 . 5.291 3.684 3.616 3.809 . 0 0 "[ . 1 . 2]" 2
2170 1 22 PHE QD 1 23 THR H 3.089 . 4.282 3.643 3.572 3.730 . 0 0 "[ . 1 . 2]" 2
2171 1 22 PHE HB2 1 23 THR H 3.517 . 5.064 4.466 4.452 4.486 . 0 0 "[ . 1 . 2]" 2
2172 1 21 ILE MG 1 23 THR H 3.607 . 5.233 4.597 4.479 4.718 . 0 0 "[ . 1 . 2]" 2
2173 1 3 MET ME 1 36 GLN H 3.574 . 5.171 4.653 3.419 5.165 . 0 0 "[ . 1 . 2]" 2
2174 1 35 TYR QD 1 36 GLN H 2.959 . 4.053 3.829 3.753 3.913 . 0 0 "[ . 1 . 2]" 2
2175 1 36 GLN H 1 37 PRO HD2 3.406 . 4.856 4.916 4.903 4.926 0.070 15 0 "[ . 1 . 2]" 2
2176 1 36 GLN H 1 36 GLN QG 2.326 . 3.002 1.922 1.784 2.029 . 0 0 "[ . 1 . 2]" 2
2177 1 36 GLN H 1 39 GLU HB2 2.639 . 3.510 2.111 2.029 2.260 . 0 0 "[ . 1 . 2]" 2
2178 1 36 GLN H 1 81 LYS HD3 3.457 . 4.951 3.932 3.686 4.094 . 0 0 "[ . 1 . 2]" 2
2179 1 36 GLN H 1 40 LEU QD 3.753 . 5.513 4.066 4.028 4.098 . 0 0 "[ . 1 . 2]" 2
2180 1 53 ASP H 1 77 ARG H 3.738 . 5.485 5.364 5.229 5.434 . 0 0 "[ . 1 . 2]" 2
2181 1 53 ASP H 1 54 GLN H 2.265 . 2.906 2.211 2.146 2.255 . 0 0 "[ . 1 . 2]" 2
2182 1 53 ASP H 1 53 ASP HA 2.739 . 3.677 2.931 2.925 2.938 . 0 0 "[ . 1 . 2]" 2
2183 1 50 HIS HB3 1 53 ASP H 3.108 . 4.315 3.035 2.942 3.144 . 0 0 "[ . 1 . 2]" 2
2184 1 50 HIS H 1 53 ASP H 3.373 . 4.795 4.643 4.573 4.705 . 0 0 "[ . 1 . 2]" 2
2185 1 26 ASP HA 1 27 HIS H 2.455 . 3.209 2.181 2.165 2.197 . 0 0 "[ . 1 . 2]" 2
2186 1 46 VAL H 1 47 GLU H 2.547 . 3.358 2.604 2.575 2.689 . 0 0 "[ . 1 . 2]" 2
2187 1 44 ASN H 1 47 GLU H 3.354 . 4.760 4.549 4.474 4.587 . 0 0 "[ . 1 . 2]" 2
2188 1 47 GLU H 1 48 PHE H 2.433 . 3.173 2.707 2.691 2.720 . 0 0 "[ . 1 . 2]" 2
2189 1 47 GLU H 1 49 CYS H 2.953 . 4.043 3.888 3.866 3.916 . 0 0 "[ . 1 . 2]" 2
2190 1 47 GLU H 1 48 PHE QE 3.579 . 5.180 5.172 5.121 5.208 0.028 11 0 "[ . 1 . 2]" 2
2191 1 44 ASN HB3 1 47 GLU H 2.791 . 3.764 2.442 2.404 2.475 . 0 0 "[ . 1 . 2]" 2
2192 1 48 PHE H 1 48 PHE HB3 2.719 . 3.643 3.635 3.626 3.646 0.003 6 0 "[ . 1 . 2]" 2
2193 1 46 VAL QG 1 48 PHE H 3.295 . 4.652 4.053 4.025 4.108 . 0 0 "[ . 1 . 2]" 2
2194 1 48 PHE H 1 76 PHE QE 3.646 . 5.308 5.270 5.194 5.318 0.010 18 0 "[ . 1 . 2]" 2
2195 1 48 PHE H 1 49 CYS HA 3.771 . 5.549 4.842 4.812 4.897 . 0 0 "[ . 1 . 2]" 2
2196 1 48 PHE H 1 49 CYS HB3 3.257 . 4.583 4.196 4.145 4.271 . 0 0 "[ . 1 . 2]" 2
2197 1 60 SER H 1 60 SER QB 2.380 . 3.088 2.180 2.072 2.757 . 0 0 "[ . 1 . 2]" 2
2198 1 58 ARG HA 1 60 SER H 3.172 . 4.430 4.437 4.360 4.458 0.028 14 0 "[ . 1 . 2]" 2
2199 1 59 ASP HB3 1 60 SER H 2.687 . 3.590 2.395 2.367 2.423 . 0 0 "[ . 1 . 2]" 2
2200 1 59 ASP HB2 1 60 SER H 2.764 . 3.719 3.753 3.734 3.770 0.051 17 0 "[ . 1 . 2]" 2
2201 1 60 SER H 1 74 VAL MG1 2.960 . 4.055 3.062 3.000 3.360 . 0 0 "[ . 1 . 2]" 2
2202 1 57 LEU QD 1 60 SER H 3.684 . 5.380 4.428 4.387 4.462 . 0 0 "[ . 1 . 2]" 2
2203 1 59 ASP H 1 60 SER H 2.472 . 3.236 2.772 2.538 2.841 . 0 0 "[ . 1 . 2]" 2
2204 1 40 LEU QD 1 41 LEU H 3.338 . 4.731 3.929 3.897 3.954 . 0 0 "[ . 1 . 2]" 2
2205 1 41 LEU H 1 42 GLY H 3.261 . 4.591 4.534 4.520 4.555 . 0 0 "[ . 1 . 2]" 2
2206 1 40 LEU H 1 41 LEU H 2.232 . 2.854 1.914 1.869 1.945 . 0 0 "[ . 1 . 2]" 2
2207 1 25 VAL MG2 1 41 LEU H 3.122 . 4.341 2.349 2.238 2.419 . 0 0 "[ . 1 . 2]" 2
2208 1 84 GLU H 1 85 TRP H 3.524 . 5.076 4.420 4.327 4.471 . 0 0 "[ . 1 . 2]" 2
2209 1 83 GLN HB2 1 84 GLU H 3.404 . 4.853 4.202 4.122 4.323 . 0 0 "[ . 1 . 2]" 2
2210 1 79 ARG HG2 1 84 GLU H 3.664 . 5.342 3.316 2.998 3.502 . 0 0 "[ . 1 . 2]" 2
2211 1 71 VAL HA 1 93 GLN H 3.589 . 5.199 4.602 4.494 4.656 . 0 0 "[ . 1 . 2]" 2
2212 1 93 GLN H 1 93 GLN HB2 3.153 . 4.396 3.977 3.948 3.997 . 0 0 "[ . 1 . 2]" 2
2213 1 93 GLN H 1 93 GLN HB3 2.598 . 3.442 3.455 3.421 3.478 0.036 15 0 "[ . 1 . 2]" 2
2214 1 64 VAL MG1 1 93 GLN H 3.151 . 4.392 3.625 3.589 3.684 . 0 0 "[ . 1 . 2]" 2
2215 1 64 VAL MG2 1 93 GLN H 3.156 . 4.401 3.294 3.227 3.388 . 0 0 "[ . 1 . 2]" 2
2216 1 93 GLN H 1 103 ILE MG 2.634 . 3.501 2.448 2.351 2.580 . 0 0 "[ . 1 . 2]" 2
2217 1 16 HIS H 1 17 ASN H 3.586 . 5.193 4.361 4.354 4.368 . 0 0 "[ . 1 . 2]" 2
2218 1 16 HIS H 1 23 THR H 3.651 . 5.317 3.794 3.706 3.901 . 0 0 "[ . 1 . 2]" 2
2219 1 16 HIS H 1 16 HIS HD2 3.192 . 4.466 4.219 4.136 4.271 . 0 0 "[ . 1 . 2]" 2
2220 1 16 HIS H 1 16 HIS HA 2.938 . 4.017 2.853 2.843 2.866 . 0 0 "[ . 1 . 2]" 2
2221 1 16 HIS H 1 16 HIS HB3 3.297 . 4.655 3.483 3.443 3.506 . 0 0 "[ . 1 . 2]" 2
2222 1 15 ARG QB 1 16 HIS H 2.501 . 3.283 2.606 2.528 2.768 . 0 0 "[ . 1 . 2]" 2
2223 1 15 ARG HG2 1 16 HIS H 2.945 . 4.029 3.654 3.268 3.873 . 0 0 "[ . 1 . 2]" 2
2224 1 16 HIS H 1 23 THR MG 3.371 . 4.792 4.068 3.900 4.330 . 0 0 "[ . 1 . 2]" 2
2225 1 16 HIS H 1 103 ILE MG 3.249 . 4.568 4.491 4.440 4.540 . 0 0 "[ . 1 . 2]" 2
2226 1 16 HIS H 1 103 ILE HB 3.096 . 4.294 3.882 3.731 4.015 . 0 0 "[ . 1 . 2]" 2
2227 1 61 PHE HA 1 63 GLN H 3.668 . 5.350 4.105 4.043 4.156 . 0 0 "[ . 1 . 2]" 2
2228 1 62 GLN HG3 1 63 GLN H 3.397 . 4.839 4.572 4.391 4.686 . 0 0 "[ . 1 . 2]" 2
2229 1 59 ASP HA 1 63 GLN H 3.452 . 4.942 4.347 4.318 4.380 . 0 0 "[ . 1 . 2]" 2
2230 1 61 PHE QB 1 63 GLN H 3.485 . 5.003 4.604 4.564 4.652 . 0 0 "[ . 1 . 2]" 2
2231 1 63 GLN H 1 63 GLN HG2 2.437 . 3.180 2.339 2.258 2.398 . 0 0 "[ . 1 . 2]" 2
2232 1 37 PRO HA 1 39 GLU H 3.333 . 4.722 4.222 4.134 4.305 . 0 0 "[ . 1 . 2]" 2
2233 1 39 GLU H 1 40 LEU HB2 3.327 . 4.711 4.289 4.241 4.338 . 0 0 "[ . 1 . 2]" 2
2234 1 39 GLU H 1 40 LEU QD 3.676 . 5.260 4.027 3.979 4.076 . 0 0 "[ . 1 . 2]" 2
2235 1 36 GLN H 1 39 GLU H 3.164 . 4.416 3.740 3.707 3.791 . 0 0 "[ . 1 . 2]" 2
2236 1 38 GLN H 1 39 GLU H 2.806 . 3.790 2.463 2.410 2.513 . 0 0 "[ . 1 . 2]" 2
2237 1 39 GLU H 1 41 LEU H 3.003 . 4.131 4.016 3.973 4.056 . 0 0 "[ . 1 . 2]" 2
2238 1 39 GLU H 1 40 LEU H 2.317 . 2.988 2.549 2.509 2.581 . 0 0 "[ . 1 . 2]" 2
2239 1 35 TYR HB3 1 39 GLU H 3.307 . 4.674 4.405 4.326 4.445 . 0 0 "[ . 1 . 2]" 2
2240 1 39 GLU H 1 39 GLU HB3 2.406 . 3.129 3.195 3.173 3.259 0.130 6 0 "[ . 1 . 2]" 2
2241 1 39 GLU H 1 39 GLU HB2 2.294 . 2.952 2.039 2.004 2.077 . 0 0 "[ . 1 . 2]" 2
2242 1 38 GLN QB 1 39 GLU H 2.863 . 3.888 3.505 3.451 3.559 . 0 0 "[ . 1 . 2]" 2
2243 1 37 PRO HB2 1 39 GLU H 3.450 . 4.938 4.804 4.698 4.902 . 0 0 "[ . 1 . 2]" 2
2244 1 36 GLN QB 1 39 GLU H 2.969 . 4.071 2.440 2.338 2.541 . 0 0 "[ . 1 . 2]" 2
2245 1 39 GLU H 1 41 LEU HB2 3.401 . 4.847 4.843 4.789 4.874 0.027 2 0 "[ . 1 . 2]" 2
2246 1 39 GLU H 1 41 LEU MD1 3.722 . 5.454 4.497 4.394 4.604 . 0 0 "[ . 1 . 2]" 2
2247 1 96 GLN H 1 99 TYR QD 3.541 . 5.108 3.790 3.035 4.562 . 0 0 "[ . 1 . 2]" 2
2248 1 15 ARG HD3 1 96 GLN H 3.572 . 5.167 3.439 3.102 3.886 . 0 0 "[ . 1 . 2]" 2
2249 1 96 GLN H 1 96 GLN HG2 2.393 . 3.109 2.213 1.774 3.379 0.270 4 0 "[ . 1 . 2]" 2
2250 1 96 GLN H 1 96 GLN HB3 2.634 . 3.501 3.578 3.541 3.661 0.160 4 0 "[ . 1 . 2]" 2
2251 1 35 TYR H 1 36 GLN H 3.397 . 4.840 4.454 4.436 4.470 . 0 0 "[ . 1 . 2]" 2
2252 1 33 VAL H 1 35 TYR H 3.115 . 4.328 3.750 3.712 3.798 . 0 0 "[ . 1 . 2]" 2
2253 1 34 GLY H 1 35 TYR H 2.598 . 3.442 3.073 3.038 3.106 . 0 0 "[ . 1 . 2]" 2
2254 1 33 VAL HB 1 35 TYR H 3.255 . 4.579 3.391 3.353 3.420 . 0 0 "[ . 1 . 2]" 2
2255 1 35 TYR H 1 35 TYR HB2 2.458 . 3.213 2.382 2.371 2.408 . 0 0 "[ . 1 . 2]" 2
2256 1 35 TYR H 1 81 LYS HG3 3.808 . 5.621 5.679 5.628 5.698 0.077 18 0 "[ . 1 . 2]" 2
2257 1 35 TYR H 1 81 LYS HB2 3.197 . 4.475 2.961 2.915 3.007 . 0 0 "[ . 1 . 2]" 2
2258 1 65 VAL HA 1 94 THR H 3.479 . 4.992 4.712 4.635 4.846 . 0 0 "[ . 1 . 2]" 2
2259 1 94 THR H 1 94 THR HB 2.647 . 3.523 3.569 3.555 3.588 0.065 16 0 "[ . 1 . 2]" 2
2260 1 64 VAL HB 1 94 THR H 2.991 . 4.109 3.143 3.035 3.302 . 0 0 "[ . 1 . 2]" 2
2261 1 94 THR H 1 103 ILE MG 3.464 . 4.964 3.842 3.711 3.961 . 0 0 "[ . 1 . 2]" 2
2262 1 19 GLU H 1 44 ASN HD22 3.633 . 5.283 5.129 4.953 5.284 0.001 15 0 "[ . 1 . 2]" 2
2263 1 18 ILE H 1 19 GLU H 2.818 . 3.811 2.789 2.751 2.880 . 0 0 "[ . 1 . 2]" 2
2264 1 19 GLU H 1 20 GLY H 2.216 . 2.830 2.593 2.575 2.647 . 0 0 "[ . 1 . 2]" 2
2265 1 17 ASN HD22 1 19 GLU H 3.403 . 4.851 4.242 3.715 4.408 . 0 0 "[ . 1 . 2]" 2
2266 1 19 GLU H 1 19 GLU HA 2.507 . 3.292 2.802 2.786 2.805 . 0 0 "[ . 1 . 2]" 2
2267 1 19 GLU H 1 19 GLU HB2 2.229 . 2.850 2.349 2.254 2.476 . 0 0 "[ . 1 . 2]" 2
2268 1 18 ILE HB 1 19 GLU H 2.856 . 3.876 3.914 3.889 3.934 0.058 15 0 "[ . 1 . 2]" 2
2269 1 18 ILE HG13 1 19 GLU H 3.202 . 4.484 3.861 3.742 3.940 . 0 0 "[ . 1 . 2]" 2
2270 1 19 GLU H 1 21 ILE HG12 3.473 . 4.981 4.308 4.266 4.432 . 0 0 "[ . 1 . 2]" 2
2271 1 19 GLU H 1 103 ILE MD 3.355 . 4.762 4.855 4.827 4.870 0.108 6 0 "[ . 1 . 2]" 2
2272 1 39 GLU HB2 1 40 LEU H 2.935 . 4.012 3.677 3.554 3.757 . 0 0 "[ . 1 . 2]" 2
2273 1 40 LEU H 1 40 LEU QD 3.052 . 4.133 3.086 3.027 3.132 . 0 0 "[ . 1 . 2]" 2
2274 1 40 LEU H 1 40 LEU HA 2.586 . 3.422 2.945 2.942 2.947 . 0 0 "[ . 1 . 2]" 2
2275 1 35 TYR HB3 1 40 LEU H 3.618 . 5.254 4.123 4.026 4.178 . 0 0 "[ . 1 . 2]" 2
2276 1 16 HIS HD1 1 17 ASN H 3.330 . 4.716 3.137 3.016 3.220 . 0 0 "[ . 1 . 2]" 2
2277 1 17 ASN H 1 23 THR H 3.274 . 4.614 3.901 3.826 3.969 . 0 0 "[ . 1 . 2]" 2
2278 1 17 ASN H 1 18 ILE H 3.319 . 4.696 4.534 4.484 4.552 . 0 0 "[ . 1 . 2]" 2
2279 1 17 ASN H 1 21 ILE H 2.703 . 3.616 3.357 3.299 3.459 . 0 0 "[ . 1 . 2]" 2
2280 1 16 HIS HA 1 17 ASN H 2.431 . 3.170 2.519 2.469 2.569 . 0 0 "[ . 1 . 2]" 2
2281 1 17 ASN H 1 22 PHE HA 3.124 . 4.344 4.330 4.284 4.376 0.032 18 0 "[ . 1 . 2]" 2
2282 1 17 ASN H 1 17 ASN HA 2.839 . 3.846 2.913 2.907 2.928 . 0 0 "[ . 1 . 2]" 2
2283 1 17 ASN H 1 21 ILE HB 2.979 . 4.088 3.137 3.083 3.376 . 0 0 "[ . 1 . 2]" 2
2284 1 55 GLN HB3 1 55 GLN QE 3.364 . 4.779 3.895 3.790 4.271 . 0 0 "[ . 1 . 2]" 2
2285 1 55 GLN QE 1 59 ASP H 3.394 . 4.834 3.521 3.321 4.454 . 0 0 "[ . 1 . 2]" 2
2286 1 55 GLN HA 1 55 GLN QE 3.346 . 4.746 2.442 2.206 3.455 . 0 0 "[ . 1 . 2]" 2
2287 1 55 GLN QE 1 58 ARG QB 3.141 . 4.374 3.070 2.759 3.745 . 0 0 "[ . 1 . 2]" 2
2288 1 55 GLN QE 1 58 ARG QD 3.340 . 4.734 3.590 3.241 4.065 . 0 0 "[ . 1 . 2]" 2
2289 1 17 ASN H 1 19 GLU H 3.776 . 5.558 4.617 4.543 4.668 . 0 0 "[ . 1 . 2]" 2
2290 1 16 HIS HD1 1 20 GLY H 2.970 . 4.072 3.342 3.261 3.365 . 0 0 "[ . 1 . 2]" 2
2291 1 16 HIS HD1 1 61 PHE QD 3.839 . 5.681 4.732 4.703 4.774 . 0 0 "[ . 1 . 2]" 2
2292 1 16 HIS HD1 1 61 PHE QE 3.594 . 5.208 5.066 5.025 5.258 0.050 17 0 "[ . 1 . 2]" 2
2293 1 16 HIS HA 1 16 HIS HD1 3.646 . 5.307 3.997 3.984 4.019 . 0 0 "[ . 1 . 2]" 2
2294 1 16 HIS HD1 1 20 GLY HA2 3.210 . 4.498 2.919 2.866 2.975 . 0 0 "[ . 1 . 2]" 2
2295 1 16 HIS HD1 1 103 ILE MG 3.233 . 4.540 3.874 3.838 3.922 . 0 0 "[ . 1 . 2]" 2
2296 1 90 THR H 1 91 SER H 3.333 . 4.722 4.511 4.500 4.520 . 0 0 "[ . 1 . 2]" 2
2297 1 76 PHE QE 1 90 THR H 3.662 . 5.338 4.179 4.133 4.209 . 0 0 "[ . 1 . 2]" 2
2298 1 74 VAL H 1 90 THR H 2.706 . 3.622 2.592 2.568 2.625 . 0 0 "[ . 1 . 2]" 2
2299 1 89 ARG HA 1 90 THR H 2.201 . 2.806 2.192 2.184 2.208 . 0 0 "[ . 1 . 2]" 2
2300 1 90 THR H 1 90 THR HB 3.234 . 4.541 3.697 3.687 3.710 . 0 0 "[ . 1 . 2]" 2
2301 1 89 ARG QD 1 90 THR H 3.425 . 4.891 4.891 4.827 4.921 0.030 3 0 "[ . 1 . 2]" 2
2302 1 89 ARG HB2 1 90 THR H 3.119 . 4.335 4.175 4.139 4.210 . 0 0 "[ . 1 . 2]" 2
2303 1 89 ARG HB3 1 90 THR H 2.712 . 3.632 3.452 3.420 3.518 . 0 0 "[ . 1 . 2]" 2
2304 1 74 VAL MG1 1 90 THR H 3.530 . 5.088 4.882 4.854 4.904 . 0 0 "[ . 1 . 2]" 2
2305 1 82 ASN H 1 83 GLN HA 3.752 . 5.512 4.620 4.501 4.713 . 0 0 "[ . 1 . 2]" 2
2306 1 81 LYS HB3 1 82 ASN H 3.269 . 4.604 3.075 2.960 3.213 . 0 0 "[ . 1 . 2]" 2
2307 1 55 GLN QE 1 59 ASP HB2 3.782 . 5.570 3.019 2.612 3.609 . 0 0 "[ . 1 . 2]" 2
2308 1 62 GLN H 1 64 VAL H 3.337 . 4.729 4.175 4.142 4.224 . 0 0 "[ . 1 . 2]" 2
2309 1 62 GLN H 1 63 GLN H 2.415 . 3.144 2.490 2.474 2.514 . 0 0 "[ . 1 . 2]" 2
2310 1 61 PHE HA 1 62 GLN H 3.126 . 4.348 3.517 3.512 3.522 . 0 0 "[ . 1 . 2]" 2
2311 1 61 PHE HB2 1 62 GLN H 2.481 . 3.250 2.761 2.742 2.810 . 0 0 "[ . 1 . 2]" 2
2312 1 62 GLN H 1 62 GLN HB2 2.174 . 2.765 2.524 2.493 2.579 . 0 0 "[ . 1 . 2]" 2
2313 1 96 GLN HE21 1 96 GLN HG2 2.668 . 3.558 2.804 2.216 3.481 . 0 0 "[ . 1 . 2]" 2
2314 1 96 GLN HE22 1 96 GLN HG2 2.948 . 4.035 3.740 3.468 4.057 0.022 16 0 "[ . 1 . 2]" 2
2315 1 91 SER H 1 106 ILE H 2.773 . 3.734 2.438 2.370 2.471 . 0 0 "[ . 1 . 2]" 2
2316 1 90 THR HB 1 91 SER H 2.544 . 3.353 3.005 2.955 3.031 . 0 0 "[ . 1 . 2]" 2
2317 1 91 SER H 1 107 ILE HA 3.159 . 4.406 3.847 3.808 3.880 . 0 0 "[ . 1 . 2]" 2
2318 1 91 SER H 1 91 SER HB3 2.921 . 3.988 3.480 3.453 3.498 . 0 0 "[ . 1 . 2]" 2
2319 1 91 SER H 1 91 SER HB2 2.913 . 3.974 2.347 2.332 2.371 . 0 0 "[ . 1 . 2]" 2
2320 1 96 GLN HA 1 96 GLN HE21 3.611 . 5.241 3.909 2.558 4.558 . 0 0 "[ . 1 . 2]" 2
2321 1 96 GLN HA 1 96 GLN HE22 3.679 . 5.371 4.558 3.434 5.424 0.053 13 0 "[ . 1 . 2]" 2
2322 1 68 LYS HB2 1 69 GLY H 3.164 . 4.415 4.563 4.515 4.593 0.178 16 0 "[ . 1 . 2]" 2
2323 1 68 LYS QG 1 69 GLY H 3.635 . 5.287 4.171 3.554 4.838 . 0 0 "[ . 1 . 2]" 2
2324 1 81 LYS HA 1 83 GLN HE21 3.316 . 4.690 4.619 4.286 4.723 0.033 17 0 "[ . 1 . 2]" 2
2325 1 83 GLN H 1 83 GLN HE21 3.320 . 4.698 4.049 2.542 4.579 . 0 0 "[ . 1 . 2]" 2
2326 1 83 GLN HA 1 83 GLN HE21 3.393 . 4.832 4.059 3.326 4.452 . 0 0 "[ . 1 . 2]" 2
2327 1 83 GLN HA 1 83 GLN HE22 3.583 . 5.187 5.157 4.743 5.411 0.224 5 0 "[ . 1 . 2]" 2
2328 1 38 GLN H 1 40 LEU H 3.634 . 5.285 3.894 3.874 3.936 . 0 0 "[ . 1 . 2]" 2
2329 1 37 PRO HD3 1 38 GLN H 3.280 . 4.625 4.172 4.142 4.218 . 0 0 "[ . 1 . 2]" 2
2330 1 38 GLN H 1 38 GLN HG3 2.718 . 3.642 2.991 2.582 3.471 . 0 0 "[ . 1 . 2]" 2
2331 1 36 GLN QB 1 38 GLN H 3.154 . 3.682 2.821 2.745 2.940 . 0 0 "[ . 1 . 2]" 2
2332 1 73 SER H 1 74 VAL H 3.385 . 4.817 4.116 4.078 4.141 . 0 0 "[ . 1 . 2]" 2
2333 1 72 LEU HA 1 73 SER H 2.082 . 2.624 2.259 2.208 2.288 . 0 0 "[ . 1 . 2]" 2
2334 1 72 LEU HB2 1 73 SER H 3.242 . 4.556 4.105 4.039 4.224 . 0 0 "[ . 1 . 2]" 2
2335 1 99 TYR H 1 100 SER H 2.535 . 3.338 2.914 2.771 3.065 . 0 0 "[ . 1 . 2]" 2
2336 1 98 PRO HA 1 100 SER H 3.102 . 4.305 3.233 3.143 3.407 . 0 0 "[ . 1 . 2]" 2
2337 1 99 TYR HB3 1 100 SER H 3.397 . 4.840 4.626 4.571 4.658 . 0 0 "[ . 1 . 2]" 2
2338 1 95 ALA MB 1 100 SER H 3.430 . 4.900 3.958 3.838 4.058 . 0 0 "[ . 1 . 2]" 2
2339 1 10 THR H 1 11 GLU H 2.597 . 3.440 2.121 2.014 2.390 . 0 0 "[ . 1 . 2]" 2
2340 1 10 THR H 1 109 THR MG 3.456 . 4.949 3.466 3.132 3.692 . 0 0 "[ . 1 . 2]" 2
2341 1 9 PRO HA 1 10 THR H 2.268 . 2.911 2.682 2.636 2.726 . 0 0 "[ . 1 . 2]" 2
2342 1 82 ASN H 1 83 GLN H 2.940 . 4.020 2.453 2.351 2.515 . 0 0 "[ . 1 . 2]" 2
2343 1 83 GLN H 1 84 GLU H 2.476 . 3.242 2.662 2.562 2.834 . 0 0 "[ . 1 . 2]" 2
2344 1 82 ASN HA 1 83 GLN H 2.889 . 3.932 3.211 3.100 3.251 . 0 0 "[ . 1 . 2]" 2
2345 1 81 LYS HA 1 83 GLN H 3.174 . 4.433 3.499 3.421 3.627 . 0 0 "[ . 1 . 2]" 2
2346 1 82 ASN HB3 1 83 GLN H 3.420 . 4.882 4.305 4.202 4.499 . 0 0 "[ . 1 . 2]" 2
2347 1 81 LYS HB3 1 83 GLN H 3.717 . 5.444 4.843 4.730 4.982 . 0 0 "[ . 1 . 2]" 2
2348 1 36 GLN QB 1 38 GLN HE21 3.517 . 5.063 3.437 2.444 4.536 . 0 0 "[ . 1 . 2]" 2
2349 1 69 GLY HA2 1 93 GLN HE21 3.459 . 4.955 3.714 3.363 3.967 . 0 0 "[ . 1 . 2]" 2
2350 1 71 VAL HB 1 93 GLN HE21 3.762 . 5.531 3.376 2.591 5.494 . 0 0 "[ . 1 . 2]" 2
2351 1 93 GLN HE21 1 94 THR MG 3.443 . 4.925 5.021 4.958 5.060 0.135 14 0 "[ . 1 . 2]" 2
2352 1 61 PHE QB 1 65 VAL H 3.594 . 5.208 4.764 4.706 4.805 . 0 0 "[ . 1 . 2]" 2
2353 1 63 GLN H 1 65 VAL H 3.277 . 4.620 3.911 3.842 3.976 . 0 0 "[ . 1 . 2]" 2
2354 1 65 VAL H 1 66 LYS H 2.323 . 2.998 2.365 2.332 2.400 . 0 0 "[ . 1 . 2]" 2
2355 1 62 GLN HA 1 65 VAL H 2.907 . 3.963 3.838 3.779 3.871 . 0 0 "[ . 1 . 2]" 2
2356 1 110 ASN HB2 1 110 ASN HD22 2.623 . 3.483 3.478 3.438 3.704 0.221 5 0 "[ . 1 . 2]" 2
2357 1 5 ASN HD22 1 36 GLN QB 3.669 . 5.352 3.773 3.179 4.525 . 0 0 "[ . 1 . 2]" 2
2358 1 38 GLN QB 1 38 GLN HE21 3.661 . 5.336 3.395 2.794 3.802 . 0 0 "[ . 1 . 2]" 2
2359 1 38 GLN HE21 1 38 GLN HG2 2.905 . 3.960 2.777 2.236 3.473 . 0 0 "[ . 1 . 2]" 2
2360 1 38 GLN HE21 1 38 GLN HG3 3.029 . 4.176 2.605 2.225 3.478 . 0 0 "[ . 1 . 2]" 2
2361 1 93 GLN HE21 1 93 GLN HG2 2.524 . 3.321 3.439 3.433 3.451 0.130 1 0 "[ . 1 . 2]" 2
2362 1 71 VAL QG 1 93 GLN HE21 2.732 . 3.665 3.109 2.353 3.366 . 0 0 "[ . 1 . 2]" 2
2363 1 75 MET ME 1 110 ASN HD21 3.563 . 5.150 2.070 1.967 2.261 0.009 18 0 "[ . 1 . 2]" 2
2364 1 38 GLN HE22 1 38 GLN HG2 2.894 . 3.941 3.729 3.478 4.059 0.118 19 0 "[ . 1 . 2]" 2
2365 1 38 GLN HE22 1 38 GLN HG3 3.062 . 4.234 3.648 3.476 4.062 . 0 0 "[ . 1 . 2]" 2
2366 1 38 GLN QB 1 38 GLN HE22 3.619 . 5.256 3.888 3.583 4.078 . 0 0 "[ . 1 . 2]" 2
2367 1 36 GLN QB 1 38 GLN HE22 3.688 . 5.388 4.564 3.941 4.986 . 0 0 "[ . 1 . 2]" 2
2368 1 89 ARG QD 1 110 ASN HD22 3.785 . 5.576 2.685 2.046 3.755 . 0 0 "[ . 1 . 2]" 2
2369 1 75 MET ME 1 110 ASN HD22 3.566 . 5.156 2.787 2.703 2.876 . 0 0 "[ . 1 . 2]" 2
2370 1 82 ASN HB3 1 82 ASN HD21 3.012 . 4.146 3.111 2.238 3.482 . 0 0 "[ . 1 . 2]" 2
2371 1 82 ASN HB3 1 82 ASN HD22 3.088 . 4.280 3.881 3.482 4.059 . 0 0 "[ . 1 . 2]" 2
2372 1 12 PHE H 1 12 PHE QE 3.626 . 5.269 4.497 4.465 4.525 . 0 0 "[ . 1 . 2]" 2
2373 1 11 GLU HB3 1 12 PHE H 2.891 . 3.936 4.071 4.058 4.085 0.149 17 0 "[ . 1 . 2]" 2
2374 1 12 PHE H 1 32 THR MG 3.309 . 4.677 3.600 3.361 3.676 . 0 0 "[ . 1 . 2]" 2
2375 1 63 GLN HA 1 63 GLN HE21 3.505 . 5.041 2.956 2.152 4.104 . 0 0 "[ . 1 . 2]" 2
2376 1 63 GLN HE21 1 67 LEU HG 3.628 . 5.273 4.185 3.156 5.272 . 0 0 "[ . 1 . 2]" 2
2377 1 19 GLU QG 1 44 ASN HD22 3.199 . 4.478 4.006 3.863 4.088 . 0 0 "[ . 1 . 2]" 2
2378 1 19 GLU HB3 1 44 ASN HD22 3.041 . 4.197 2.120 1.884 2.356 0.001 16 0 "[ . 1 . 2]" 2
2379 1 20 GLY HA3 1 44 ASN HD22 3.394 . 4.834 3.603 3.538 3.682 . 0 0 "[ . 1 . 2]" 2
2380 1 63 GLN HA 1 63 GLN HE22 3.714 . 5.438 3.473 3.119 4.110 . 0 0 "[ . 1 . 2]" 2
2381 1 63 GLN HE22 1 67 LEU HG 3.603 . 5.225 4.553 3.888 5.179 . 0 0 "[ . 1 . 2]" 2
2382 1 12 PHE H 1 12 PHE HB2 3.317 . 4.692 3.873 3.852 3.882 . 0 0 "[ . 1 . 2]" 2
2383 1 12 PHE H 1 109 THR H 3.424 . 4.889 4.839 4.770 4.903 0.014 20 0 "[ . 1 . 2]" 2
2384 1 12 PHE H 1 107 ILE H 2.765 . 3.720 3.420 3.387 3.532 . 0 0 "[ . 1 . 2]" 2
2385 1 11 GLU HA 1 12 PHE H 2.348 . 3.037 2.188 2.172 2.200 . 0 0 "[ . 1 . 2]" 2
2386 1 12 PHE H 1 13 ILE HA 3.614 . 5.247 4.796 4.775 4.839 . 0 0 "[ . 1 . 2]" 2
2387 1 12 PHE H 1 12 PHE HB3 3.321 . 4.700 3.022 2.962 3.041 . 0 0 "[ . 1 . 2]" 2
2388 1 11 GLU HB2 1 12 PHE H 2.645 . 3.519 3.048 3.028 3.085 . 0 0 "[ . 1 . 2]" 2
2389 1 82 ASN H 1 82 ASN HD21 3.485 . 5.003 2.701 2.120 3.852 . 0 0 "[ . 1 . 2]" 2
2390 1 34 GLY HA3 1 82 ASN HD21 3.617 . 5.253 4.520 3.766 6.016 0.763 9 1 "[ . +1 . 2]" 2
2391 1 54 GLN HB2 1 54 GLN HE21 3.220 . 4.516 4.234 2.429 4.441 . 0 0 "[ . 1 . 2]" 2
2392 1 49 CYS HB3 1 54 GLN HE22 3.520 . 5.069 4.873 4.786 5.113 0.044 11 0 "[ . 1 . 2]" 2
2393 1 54 GLN HE22 1 54 GLN HG3 2.956 . 4.048 3.802 3.769 4.036 . 0 0 "[ . 1 . 2]" 2
2394 1 51 PRO HB3 1 54 GLN HE22 3.359 . 4.769 4.702 4.617 4.758 . 0 0 "[ . 1 . 2]" 2
2395 1 54 GLN HE22 1 54 GLN HG2 2.915 . 3.977 3.517 3.478 3.812 . 0 0 "[ . 1 . 2]" 2
2396 1 54 GLN HB2 1 54 GLN HE22 3.466 . 4.968 4.562 3.672 4.680 . 0 0 "[ . 1 . 2]" 2
2397 1 17 ASN H 1 17 ASN HD22 3.671 . 5.355 3.934 3.376 4.086 . 0 0 "[ . 1 . 2]" 2
2398 1 22 PHE HB3 1 42 GLY H 2.991 . 4.109 3.450 3.393 3.487 . 0 0 "[ . 1 . 2]" 2
2399 1 23 THR MG 1 42 GLY H 3.729 . 5.467 4.887 4.773 4.951 . 0 0 "[ . 1 . 2]" 2
2400 1 17 ASN HA 1 17 ASN HD21 3.539 . 5.104 4.550 4.081 4.609 . 0 0 "[ . 1 . 2]" 2
2401 1 17 ASN HD21 1 18 ILE H 3.701 . 5.413 4.857 4.186 4.975 . 0 0 "[ . 1 . 2]" 2
2402 1 17 ASN HD21 1 19 GLU HB2 3.318 . 4.695 3.717 2.211 4.059 . 0 0 "[ . 1 . 2]" 2
2403 1 17 ASN HD21 1 21 ILE HB 2.921 . 3.987 3.084 1.932 3.319 . 0 0 "[ . 1 . 2]" 2
2404 1 17 ASN HD21 1 21 ILE HG13 3.455 . 4.947 3.478 3.125 3.653 . 0 0 "[ . 1 . 2]" 2
2405 1 17 ASN HD21 1 21 ILE MG 3.130 . 4.355 4.099 3.556 4.438 0.083 15 0 "[ . 1 . 2]" 2
2406 1 50 HIS H 1 79 ARG H 3.499 . 5.029 4.464 4.409 4.562 . 0 0 "[ . 1 . 2]" 2
2407 1 50 HIS H 1 85 TRP HZ3 2.885 . 3.925 3.171 3.084 3.259 . 0 0 "[ . 1 . 2]" 2
2408 1 50 HIS H 1 78 PHE HA 3.399 . 4.844 4.021 3.968 4.060 . 0 0 "[ . 1 . 2]" 2
2409 1 50 HIS H 1 50 HIS HD2 3.654 . 5.323 5.066 5.019 5.138 . 0 0 "[ . 1 . 2]" 2
2410 1 50 HIS H 1 50 HIS HA 2.835 . 3.839 2.802 2.777 2.817 . 0 0 "[ . 1 . 2]" 2
2411 1 49 CYS HB3 1 50 HIS H 3.209 . 4.497 4.030 3.971 4.111 . 0 0 "[ . 1 . 2]" 2
2412 1 49 CYS HB2 1 50 HIS H 3.201 . 4.482 3.944 3.860 4.060 . 0 0 "[ . 1 . 2]" 2
2413 1 50 HIS H 1 50 HIS HB2 2.578 . 3.409 2.418 2.394 2.460 . 0 0 "[ . 1 . 2]" 2
2414 1 34 GLY H 1 81 LYS HB2 3.522 . 5.073 4.685 4.566 4.749 . 0 0 "[ . 1 . 2]" 2
2415 1 33 VAL H 1 34 GLY H 2.277 . 2.925 2.203 2.164 2.243 . 0 0 "[ . 1 . 2]" 2
2416 1 34 GLY H 1 81 LYS HB3 3.499 . 5.029 4.912 4.850 5.008 . 0 0 "[ . 1 . 2]" 2
2417 1 32 THR MG 1 34 GLY H 3.691 . 5.394 4.831 4.803 4.862 . 0 0 "[ . 1 . 2]" 2
2418 1 30 VAL QG 1 34 GLY H 3.288 . 4.639 4.138 4.116 4.169 . 0 0 "[ . 1 . 2]" 2
2419 1 33 VAL MG1 1 34 GLY H 3.212 . 4.502 4.212 4.202 4.222 . 0 0 "[ . 1 . 2]" 2
2420 1 33 VAL HB 1 34 GLY H 3.466 . 4.968 4.357 4.333 4.373 . 0 0 "[ . 1 . 2]" 2
2421 1 29 CYS H 1 32 THR H 3.495 . 5.022 4.656 4.601 4.697 . 0 0 "[ . 1 . 2]" 2
2422 1 32 THR H 1 33 VAL H 2.434 . 3.174 2.653 2.622 2.707 . 0 0 "[ . 1 . 2]" 2
2423 1 31 ALA H 1 32 THR H 2.407 . 3.131 2.251 2.241 2.265 . 0 0 "[ . 1 . 2]" 2
2424 1 32 THR H 1 33 VAL HA 3.561 . 5.146 5.132 5.103 5.169 0.023 20 0 "[ . 1 . 2]" 2
2425 1 30 VAL HA 1 32 THR H 3.318 . 4.695 4.074 4.033 4.217 . 0 0 "[ . 1 . 2]" 2
2426 1 9 PRO HB3 1 32 THR H 3.511 . 5.052 2.880 2.698 3.589 . 0 0 "[ . 1 . 2]" 2
2427 1 30 VAL QG 1 32 THR H 3.557 . 5.138 3.942 3.917 4.002 . 0 0 "[ . 1 . 2]" 2
2428 1 32 THR H 1 33 VAL MG2 3.032 . 4.181 4.084 4.007 4.170 . 0 0 "[ . 1 . 2]" 2
2429 1 32 THR H 1 33 VAL MG1 3.443 . 4.925 4.678 4.640 4.723 . 0 0 "[ . 1 . 2]" 2
2430 1 29 CYS HB3 1 33 VAL H 3.611 . 5.241 5.154 5.095 5.206 . 0 0 "[ . 1 . 2]" 2
2431 1 33 VAL H 1 35 TYR QD 3.566 . 5.155 5.216 5.175 5.235 0.080 15 0 "[ . 1 . 2]" 2
2432 1 32 THR HA 1 33 VAL H 2.678 . 3.575 3.565 3.560 3.570 . 0 0 "[ . 1 . 2]" 2
2433 1 32 THR MG 1 33 VAL H 3.007 . 4.137 3.304 3.239 3.347 . 0 0 "[ . 1 . 2]" 2
2434 1 33 VAL H 1 86 LEU QD 3.759 . 5.525 4.312 4.249 4.344 . 0 0 "[ . 1 . 2]" 2
2435 1 77 ARG HE 1 85 TRP HE3 3.253 . 4.576 4.035 3.828 4.643 0.067 13 0 "[ . 1 . 2]" 2
2436 1 50 HIS HB3 1 77 ARG HE 3.312 . 4.683 4.122 2.013 4.719 0.036 8 0 "[ . 1 . 2]" 2
2437 1 77 ARG HB2 1 77 ARG HE 3.079 . 4.264 2.673 1.833 2.988 0.061 12 0 "[ . 1 . 2]" 2
2438 1 90 THR HA 1 106 ILE H 3.512 . 5.054 4.226 4.137 4.273 . 0 0 "[ . 1 . 2]" 2
2439 1 13 ILE HA 1 106 ILE H 3.620 . 5.258 4.620 4.579 4.671 . 0 0 "[ . 1 . 2]" 2
2440 1 105 THR HB 1 106 ILE H 3.414 . 4.871 4.439 4.366 4.472 . 0 0 "[ . 1 . 2]" 2
2441 1 91 SER HB2 1 106 ILE H 3.283 . 4.630 2.718 2.672 2.777 . 0 0 "[ . 1 . 2]" 2
2442 1 104 GLU HG2 1 106 ILE H 3.635 . 5.287 4.690 4.373 4.811 . 0 0 "[ . 1 . 2]" 2
2443 1 51 PRO HB2 1 52 GLU H 2.653 . 3.533 2.099 2.037 2.203 . 0 0 "[ . 1 . 2]" 2
2444 1 52 GLU H 1 52 GLU HB3 2.639 . 3.509 3.566 3.560 3.574 0.065 11 0 "[ . 1 . 2]" 2
2445 1 77 ARG H 1 77 ARG HB3 2.943 . 4.026 3.617 3.584 3.657 . 0 0 "[ . 1 . 2]" 2
2446 1 81 LYS H 1 82 ASN H 3.032 . 4.181 2.622 2.495 2.670 . 0 0 "[ . 1 . 2]" 2
2447 1 93 GLN HB2 1 94 THR H 2.691 . 3.596 2.892 2.711 3.001 . 0 0 "[ . 1 . 2]" 2
2448 1 92 SER HA 1 105 THR H 3.750 . 5.508 4.238 4.198 4.309 . 0 0 "[ . 1 . 2]" 2
2449 1 77 ARG HG2 1 88 MET H 3.883 . 5.768 5.576 5.245 5.818 0.050 5 0 "[ . 1 . 2]" 2
2450 1 16 HIS H 1 16 HIS HD1 3.851 . 5.705 3.639 3.593 3.681 . 0 0 "[ . 1 . 2]" 2
2451 1 16 HIS HD1 1 103 ILE H 3.843 . 5.689 3.931 3.856 4.065 . 0 0 "[ . 1 . 2]" 2
2452 1 10 THR H 1 109 THR H 3.779 . 5.564 4.274 4.165 4.368 . 0 0 "[ . 1 . 2]" 2
2453 1 16 HIS HD1 1 18 ILE MD 3.905 . 5.812 5.028 4.940 5.169 . 0 0 "[ . 1 . 2]" 2
2454 1 59 ASP H 1 62 GLN H 4.062 . 6.125 4.651 4.623 4.682 . 0 0 "[ . 1 . 2]" 2
2455 1 60 SER H 1 63 GLN H 3.348 . 4.749 4.728 4.697 4.755 0.006 1 0 "[ . 1 . 2]" 2
2456 1 11 GLU H 1 109 THR H 3.847 . 5.697 4.467 4.372 4.631 . 0 0 "[ . 1 . 2]" 2
2457 1 14 SER H 1 107 ILE H 3.367 . 4.784 3.355 3.158 3.406 . 0 0 "[ . 1 . 2]" 2
2458 1 70 GLN H 1 94 THR H 3.832 . 5.667 4.980 4.758 5.150 . 0 0 "[ . 1 . 2]" 2
2459 1 72 LEU H 1 92 SER HB3 3.587 . 5.195 4.886 4.850 4.922 . 0 0 "[ . 1 . 2]" 2
2460 1 64 VAL HA 1 72 LEU H 3.795 . 5.595 4.952 4.799 5.214 . 0 0 "[ . 1 . 2]" 2
2461 1 32 THR H 1 35 TYR H 4.068 . 6.136 5.724 5.679 5.802 . 0 0 "[ . 1 . 2]" 2
2462 1 32 THR H 1 34 GLY H 2.899 . 3.950 3.317 3.276 3.385 . 0 0 "[ . 1 . 2]" 2
2463 1 38 GLN H 1 41 LEU H 3.885 . 5.772 4.491 4.467 4.521 . 0 0 "[ . 1 . 2]" 2
2464 1 45 ILE H 1 47 GLU H 3.603 . 5.226 4.166 4.140 4.188 . 0 0 "[ . 1 . 2]" 2
2465 1 46 VAL H 1 49 CYS H 3.844 . 5.691 4.550 4.506 4.577 . 0 0 "[ . 1 . 2]" 2
2466 1 49 CYS H 1 79 ARG H 3.935 . 5.870 4.658 4.544 4.852 . 0 0 "[ . 1 . 2]" 2
2467 1 58 ARG H 1 61 PHE H 3.503 . 5.037 4.999 4.921 5.033 . 0 0 "[ . 1 . 2]" 2
2468 1 56 LEU H 1 58 ARG H 3.062 . 4.234 4.217 4.170 4.297 0.063 18 0 "[ . 1 . 2]" 2
2469 1 61 PHE H 1 64 VAL H 3.803 . 5.611 4.755 4.703 4.796 . 0 0 "[ . 1 . 2]" 2
2470 1 62 GLN H 1 65 VAL H 3.987 . 5.974 4.853 4.826 4.880 . 0 0 "[ . 1 . 2]" 2
2471 1 67 LEU H 1 69 GLY H 3.953 . 5.906 4.796 4.476 5.028 . 0 0 "[ . 1 . 2]" 2
2472 1 74 VAL H 1 92 SER H 4.247 . 6.502 4.682 4.587 4.734 . 0 0 "[ . 1 . 2]" 2
2473 1 50 HIS H 1 77 ARG H 3.065 . 4.240 2.906 2.848 2.987 . 0 0 "[ . 1 . 2]" 2
2474 1 78 PHE H 1 88 MET H 3.030 . 4.178 3.889 3.841 3.953 . 0 0 "[ . 1 . 2]" 2
2475 1 78 PHE H 1 86 LEU H 2.640 . 3.511 3.253 3.128 3.395 . 0 0 "[ . 1 . 2]" 2
2476 1 93 GLN H 1 106 ILE H 3.522 . 5.073 5.024 4.956 5.077 0.004 2 0 "[ . 1 . 2]" 2
2477 1 93 GLN H 1 104 GLU H 2.730 . 3.662 3.284 3.223 3.456 . 0 0 "[ . 1 . 2]" 2
2478 1 95 ALA H 1 102 GLU H 2.827 . 3.826 3.835 3.569 3.884 0.058 1 0 "[ . 1 . 2]" 2
2479 1 62 GLN HB2 1 63 GLN H 2.452 . 3.203 2.819 2.777 2.875 . 0 0 "[ . 1 . 2]" 2
2480 1 107 ILE H 1 107 ILE HA 2.952 . 4.042 2.880 2.876 2.884 . 0 0 "[ . 1 . 2]" 2
stop_
save_
save_distance_constraint_statistics_3
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 3
_Distance_constraint_stats_list.Constraint_count 100
_Distance_constraint_stats_list.Viol_count 521
_Distance_constraint_stats_list.Viol_total 511.339
_Distance_constraint_stats_list.Viol_max 0.189
_Distance_constraint_stats_list.Viol_rms 0.0293
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0128
_Distance_constraint_stats_list.Viol_average_violations_only 0.0491
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 12 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 ILE 0.178 0.026 6 0 "[ . 1 . 2]"
1 14 SER 0.033 0.029 15 0 "[ . 1 . 2]"
1 15 ARG 3.549 0.121 1 0 "[ . 1 . 2]"
1 16 HIS 0.931 0.058 19 0 "[ . 1 . 2]"
1 17 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 21 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 PHE 0.414 0.038 4 0 "[ . 1 . 2]"
1 23 THR 1.342 0.078 8 0 "[ . 1 . 2]"
1 24 PHE 2.207 0.121 1 0 "[ . 1 . 2]"
1 26 ASP 0.202 0.026 6 0 "[ . 1 . 2]"
1 28 ARG 0.017 0.008 16 0 "[ . 1 . 2]"
1 29 CYS 1.461 0.086 15 0 "[ . 1 . 2]"
1 32 THR 0.017 0.008 16 0 "[ . 1 . 2]"
1 33 VAL 1.438 0.086 15 0 "[ . 1 . 2]"
1 37 PRO 1.381 0.081 14 0 "[ . 1 . 2]"
1 40 LEU 0.388 0.035 19 0 "[ . 1 . 2]"
1 41 LEU 1.357 0.081 14 0 "[ . 1 . 2]"
1 42 GLY 0.369 0.038 4 0 "[ . 1 . 2]"
1 43 LYS 0.410 0.035 19 0 "[ . 1 . 2]"
1 44 ASN 0.944 0.057 8 0 "[ . 1 . 2]"
1 45 ILE 1.200 0.077 16 0 "[ . 1 . 2]"
1 46 VAL 2.112 0.107 17 0 "[ . 1 . 2]"
1 47 GLU 0.944 0.057 8 0 "[ . 1 . 2]"
1 48 PHE 1.200 0.077 16 0 "[ . 1 . 2]"
1 49 CYS 2.112 0.107 17 0 "[ . 1 . 2]"
1 50 HIS 1.542 0.128 11 0 "[ . 1 . 2]"
1 51 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 ASP 1.542 0.128 11 0 "[ . 1 . 2]"
1 54 GLN 0.299 0.028 12 0 "[ . 1 . 2]"
1 55 GLN 0.234 0.047 19 0 "[ . 1 . 2]"
1 56 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 57 LEU 0.101 0.042 6 0 "[ . 1 . 2]"
1 58 ARG 0.319 0.028 12 0 "[ . 1 . 2]"
1 59 ASP 0.234 0.047 19 0 "[ . 1 . 2]"
1 60 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 PHE 0.101 0.042 6 0 "[ . 1 . 2]"
1 62 GLN 0.020 0.019 17 0 "[ . 1 . 2]"
1 63 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 LEU 2.525 0.110 1 0 "[ . 1 . 2]"
1 74 VAL 4.715 0.189 5 0 "[ . 1 . 2]"
1 76 PHE 0.443 0.034 8 0 "[ . 1 . 2]"
1 78 PHE 0.413 0.035 15 0 "[ . 1 . 2]"
1 79 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 SER 0.005 0.005 13 0 "[ . 1 . 2]"
1 84 GLU 0.005 0.005 13 0 "[ . 1 . 2]"
1 86 LEU 0.413 0.035 15 0 "[ . 1 . 2]"
1 87 TRP 0.027 0.014 10 0 "[ . 1 . 2]"
1 88 MET 0.443 0.034 8 0 "[ . 1 . 2]"
1 89 ARG 0.123 0.029 15 0 "[ . 1 . 2]"
1 90 THR 4.715 0.189 5 0 "[ . 1 . 2]"
1 91 SER 0.713 0.058 7 0 "[ . 1 . 2]"
1 92 SER 2.525 0.110 1 0 "[ . 1 . 2]"
1 93 GLN 1.823 0.115 15 0 "[ . 1 . 2]"
1 103 ILE 0.931 0.058 19 0 "[ . 1 . 2]"
1 104 GLU 1.823 0.115 15 0 "[ . 1 . 2]"
1 105 THR 0.033 0.029 15 0 "[ . 1 . 2]"
1 106 ILE 0.713 0.058 7 0 "[ . 1 . 2]"
1 107 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 108 CYS 0.123 0.029 15 0 "[ . 1 . 2]"
1 110 ASN 0.027 0.014 10 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 12 PHE H 1 107 ILE O 1.800 . 2.300 1.909 1.865 1.931 . 0 0 "[ . 1 . 2]" 3
2 1 12 PHE N 1 107 ILE O 2.800 2.800 3.300 2.848 2.804 2.873 . 0 0 "[ . 1 . 2]" 3
3 1 14 SER H 1 105 THR O 1.800 . 2.300 2.068 2.002 2.107 . 0 0 "[ . 1 . 2]" 3
4 1 14 SER N 1 105 THR O 2.800 2.800 3.300 2.977 2.876 3.027 . 0 0 "[ . 1 . 2]" 3
5 1 15 ARG H 1 24 PHE O 1.800 . 2.300 2.011 1.923 2.045 . 0 0 "[ . 1 . 2]" 3
6 1 15 ARG N 1 24 PHE O 2.800 2.800 3.300 2.712 2.679 2.741 0.121 1 0 "[ . 1 . 2]" 3
7 1 16 HIS H 1 103 ILE O 1.800 . 2.300 2.335 2.274 2.358 0.058 19 0 "[ . 1 . 2]" 3
8 1 16 HIS N 1 103 ILE O 2.800 2.800 3.300 3.128 3.080 3.176 . 0 0 "[ . 1 . 2]" 3
9 1 17 ASN H 1 21 ILE O 1.800 . 2.300 2.175 2.111 2.284 . 0 0 "[ . 1 . 2]" 3
10 1 17 ASN N 1 21 ILE O 2.800 2.800 3.300 3.041 2.983 3.145 . 0 0 "[ . 1 . 2]" 3
11 1 22 PHE H 1 43 LYS O 1.800 . 2.300 1.939 1.830 1.991 . 0 0 "[ . 1 . 2]" 3
12 1 22 PHE N 1 43 LYS O 2.800 2.800 3.300 2.892 2.776 2.948 0.024 6 0 "[ . 1 . 2]" 3
13 1 15 ARG O 1 23 THR H 1.800 . 2.300 2.032 1.987 2.087 . 0 0 "[ . 1 . 2]" 3
14 1 15 ARG O 1 23 THR N 2.800 2.800 3.300 2.733 2.722 2.752 0.078 8 0 "[ . 1 . 2]" 3
15 1 15 ARG O 1 24 PHE H 1.800 . 2.300 2.322 2.307 2.334 0.034 3 0 "[ . 1 . 2]" 3
16 1 15 ARG O 1 24 PHE N 2.800 2.800 3.300 3.136 3.074 3.164 . 0 0 "[ . 1 . 2]" 3
17 1 13 ILE O 1 26 ASP H 1.800 . 2.300 2.081 2.056 2.107 . 0 0 "[ . 1 . 2]" 3
18 1 13 ILE O 1 26 ASP N 2.800 2.800 3.300 2.792 2.774 2.813 0.026 6 0 "[ . 1 . 2]" 3
19 1 26 ASP O 1 29 CYS H 1.800 . 2.300 1.851 1.826 1.869 . 0 0 "[ . 1 . 2]" 3
20 1 26 ASP O 1 29 CYS N 2.800 2.800 3.300 2.814 2.786 2.830 0.014 11 0 "[ . 1 . 2]" 3
21 1 28 ARG O 1 32 THR H 1.800 . 2.300 1.979 1.914 2.032 . 0 0 "[ . 1 . 2]" 3
22 1 28 ARG O 1 32 THR N 2.800 2.800 3.300 2.842 2.792 2.895 0.008 16 0 "[ . 1 . 2]" 3
23 1 29 CYS O 1 33 VAL H 1.800 . 2.300 1.819 1.805 1.844 . 0 0 "[ . 1 . 2]" 3
24 1 29 CYS O 1 33 VAL N 2.800 2.800 3.300 2.728 2.714 2.743 0.086 15 0 "[ . 1 . 2]" 3
25 1 37 PRO O 1 40 LEU H 1.800 . 2.300 2.271 2.154 2.313 0.013 6 0 "[ . 1 . 2]" 3
26 1 37 PRO O 1 40 LEU N 2.800 2.800 3.300 3.151 3.036 3.189 . 0 0 "[ . 1 . 2]" 3
27 1 37 PRO O 1 41 LEU H 1.800 . 2.300 1.836 1.818 1.858 . 0 0 "[ . 1 . 2]" 3
28 1 37 PRO O 1 41 LEU N 2.800 2.800 3.300 2.732 2.719 2.748 0.081 14 0 "[ . 1 . 2]" 3
29 1 22 PHE O 1 42 GLY H 1.800 . 2.300 1.827 1.810 1.841 . 0 0 "[ . 1 . 2]" 3
30 1 22 PHE O 1 42 GLY N 2.800 2.800 3.300 2.782 2.762 2.792 0.038 4 0 "[ . 1 . 2]" 3
31 1 40 LEU O 1 43 LYS H 1.800 . 2.300 1.921 1.897 1.956 . 0 0 "[ . 1 . 2]" 3
32 1 40 LEU O 1 43 LYS N 2.800 2.800 3.300 2.782 2.765 2.806 0.035 19 0 "[ . 1 . 2]" 3
33 1 20 GLY O 1 45 ILE H 1.800 . 2.300 2.023 1.956 2.110 . 0 0 "[ . 1 . 2]" 3
34 1 20 GLY O 1 45 ILE N 2.800 2.800 3.300 2.979 2.908 3.064 . 0 0 "[ . 1 . 2]" 3
35 1 44 ASN O 1 47 GLU H 1.800 . 2.300 2.053 2.033 2.077 . 0 0 "[ . 1 . 2]" 3
36 1 44 ASN O 1 47 GLU N 2.800 2.800 3.300 2.753 2.743 2.764 0.057 8 0 "[ . 1 . 2]" 3
37 1 45 ILE O 1 48 PHE H 1.800 . 2.300 2.360 2.322 2.377 0.077 16 0 "[ . 1 . 2]" 3
38 1 45 ILE O 1 48 PHE N 2.800 2.800 3.300 3.204 3.152 3.232 . 0 0 "[ . 1 . 2]" 3
39 1 46 VAL O 1 49 CYS H 1.800 . 2.300 2.312 2.300 2.321 0.021 15 0 "[ . 1 . 2]" 3
40 1 46 VAL O 1 49 CYS N 2.800 2.800 3.300 2.706 2.693 2.711 0.107 17 0 "[ . 1 . 2]" 3
41 1 50 HIS O 1 53 ASP H 1.800 . 2.300 1.912 1.817 1.944 . 0 0 "[ . 1 . 2]" 3
42 1 50 HIS O 1 53 ASP N 2.800 2.800 3.300 2.723 2.672 2.740 0.128 11 0 "[ . 1 . 2]" 3
43 1 51 PRO O 1 54 GLN H 1.800 . 2.300 2.097 2.022 2.156 . 0 0 "[ . 1 . 2]" 3
44 1 51 PRO O 1 54 GLN N 2.800 2.800 3.300 2.916 2.835 2.980 . 0 0 "[ . 1 . 2]" 3
45 1 54 GLN O 1 58 ARG H 1.800 . 2.300 1.841 1.804 1.959 . 0 0 "[ . 1 . 2]" 3
46 1 54 GLN O 1 58 ARG N 2.800 2.800 3.300 2.798 2.772 2.927 0.028 12 0 "[ . 1 . 2]" 3
47 1 55 GLN O 1 59 ASP H 1.800 . 2.300 2.269 1.967 2.347 0.047 19 0 "[ . 1 . 2]" 3
48 1 55 GLN O 1 59 ASP N 2.800 2.800 3.300 3.068 2.812 3.118 . 0 0 "[ . 1 . 2]" 3
49 1 56 LEU O 1 60 SER H 1.800 . 2.300 2.114 2.056 2.158 . 0 0 "[ . 1 . 2]" 3
50 1 56 LEU O 1 60 SER N 2.800 2.800 3.300 3.043 2.974 3.095 . 0 0 "[ . 1 . 2]" 3
51 1 57 LEU O 1 61 PHE H 1.800 . 2.300 2.287 2.184 2.342 0.042 6 0 "[ . 1 . 2]" 3
52 1 57 LEU O 1 61 PHE N 2.800 2.800 3.300 3.243 3.140 3.297 . 0 0 "[ . 1 . 2]" 3
53 1 58 ARG O 1 62 GLN H 1.800 . 2.300 1.980 1.921 2.059 . 0 0 "[ . 1 . 2]" 3
54 1 58 ARG O 1 62 GLN N 2.800 2.800 3.300 2.834 2.781 2.903 0.019 17 0 "[ . 1 . 2]" 3
55 1 59 ASP O 1 63 GLN H 1.800 . 2.300 2.091 2.054 2.128 . 0 0 "[ . 1 . 2]" 3
56 1 59 ASP O 1 63 GLN N 2.800 2.800 3.300 2.898 2.862 2.924 . 0 0 "[ . 1 . 2]" 3
57 1 60 SER O 1 64 VAL H 1.800 . 2.300 1.902 1.865 1.943 . 0 0 "[ . 1 . 2]" 3
58 1 60 SER O 1 64 VAL N 2.800 2.800 3.300 2.844 2.802 2.883 . 0 0 "[ . 1 . 2]" 3
59 1 63 GLN O 1 67 LEU H 1.800 . 2.300 1.946 1.908 1.996 . 0 0 "[ . 1 . 2]" 3
60 1 63 GLN O 1 67 LEU N 2.800 2.800 3.300 2.880 2.844 2.936 . 0 0 "[ . 1 . 2]" 3
61 1 72 LEU H 1 92 SER O 1.800 . 2.300 1.795 1.769 1.848 0.031 2 0 "[ . 1 . 2]" 3
62 1 72 LEU N 1 92 SER O 2.800 2.800 3.300 2.716 2.690 2.729 0.110 1 0 "[ . 1 . 2]" 3
63 1 74 VAL H 1 90 THR O 1.800 . 2.300 2.476 2.464 2.489 0.189 5 0 "[ . 1 . 2]" 3
64 1 74 VAL N 1 90 THR O 2.800 2.800 3.300 3.360 3.347 3.376 0.076 5 0 "[ . 1 . 2]" 3
65 1 76 PHE H 1 88 MET O 1.800 . 2.300 1.981 1.941 2.023 . 0 0 "[ . 1 . 2]" 3
66 1 76 PHE N 1 88 MET O 2.800 2.800 3.300 2.884 2.853 2.915 . 0 0 "[ . 1 . 2]" 3
67 1 78 PHE H 1 86 LEU O 1.800 . 2.300 1.821 1.811 1.833 . 0 0 "[ . 1 . 2]" 3
68 1 78 PHE N 1 86 LEU O 2.800 2.800 3.300 2.779 2.765 2.789 0.035 15 0 "[ . 1 . 2]" 3
69 1 48 PHE O 1 79 ARG H 1.800 . 2.300 2.081 2.013 2.205 . 0 0 "[ . 1 . 2]" 3
70 1 48 PHE O 1 79 ARG N 2.800 2.800 3.300 3.043 2.966 3.171 . 0 0 "[ . 1 . 2]" 3
71 1 80 SER H 1 84 GLU O 1.800 . 2.300 2.224 2.088 2.305 0.005 13 0 "[ . 1 . 2]" 3
72 1 80 SER N 1 84 GLU O 2.800 2.800 3.300 3.165 3.032 3.245 . 0 0 "[ . 1 . 2]" 3
73 1 78 PHE O 1 86 LEU H 1.800 . 2.300 2.011 1.965 2.086 . 0 0 "[ . 1 . 2]" 3
74 1 78 PHE O 1 86 LEU N 2.800 2.800 3.300 2.908 2.874 2.959 . 0 0 "[ . 1 . 2]" 3
75 1 76 PHE O 1 88 MET H 1.800 . 2.300 1.859 1.842 1.927 . 0 0 "[ . 1 . 2]" 3
76 1 76 PHE O 1 88 MET N 2.800 2.800 3.300 2.781 2.766 2.849 0.034 8 0 "[ . 1 . 2]" 3
77 1 89 ARG H 1 108 CYS O 1.800 . 2.300 1.878 1.847 1.911 . 0 0 "[ . 1 . 2]" 3
78 1 89 ARG N 1 108 CYS O 2.800 2.800 3.300 2.800 2.771 2.826 0.029 15 0 "[ . 1 . 2]" 3
79 1 74 VAL O 1 90 THR H 1.800 . 2.300 1.872 1.857 1.889 . 0 0 "[ . 1 . 2]" 3
80 1 74 VAL O 1 90 THR N 2.800 2.800 3.300 2.837 2.822 2.857 . 0 0 "[ . 1 . 2]" 3
81 1 91 SER H 1 106 ILE O 1.800 . 2.300 2.276 2.237 2.302 0.002 2 0 "[ . 1 . 2]" 3
82 1 91 SER N 1 106 ILE O 2.800 2.800 3.300 3.067 3.029 3.090 . 0 0 "[ . 1 . 2]" 3
83 1 72 LEU O 1 92 SER H 1.800 . 2.300 2.326 2.270 2.351 0.051 4 0 "[ . 1 . 2]" 3
84 1 72 LEU O 1 92 SER N 2.800 2.800 3.300 3.096 3.067 3.109 . 0 0 "[ . 1 . 2]" 3
85 1 93 GLN H 1 104 GLU O 1.800 . 2.300 2.146 2.020 2.310 0.010 7 0 "[ . 1 . 2]" 3
86 1 93 GLN N 1 104 GLU O 2.800 2.800 3.300 3.010 2.914 3.174 . 0 0 "[ . 1 . 2]" 3
87 1 16 HIS O 1 103 ILE H 1.800 . 2.300 2.034 1.967 2.244 . 0 0 "[ . 1 . 2]" 3
88 1 16 HIS O 1 103 ILE N 2.800 2.800 3.300 2.839 2.754 3.041 0.046 1 0 "[ . 1 . 2]" 3
89 1 93 GLN O 1 104 GLU H 1.800 . 2.300 1.946 1.921 2.034 . 0 0 "[ . 1 . 2]" 3
90 1 93 GLN O 1 104 GLU N 2.800 2.800 3.300 2.709 2.685 2.728 0.115 15 0 "[ . 1 . 2]" 3
91 1 14 SER O 1 105 THR H 1.800 . 2.300 2.029 1.914 2.131 . 0 0 "[ . 1 . 2]" 3
92 1 14 SER O 1 105 THR N 2.800 2.800 3.300 2.904 2.771 3.005 0.029 15 0 "[ . 1 . 2]" 3
93 1 91 SER O 1 106 ILE H 1.800 . 2.300 2.336 2.319 2.358 0.058 7 0 "[ . 1 . 2]" 3
94 1 91 SER O 1 106 ILE N 2.800 2.800 3.300 3.280 3.260 3.291 . 0 0 "[ . 1 . 2]" 3
95 1 12 PHE O 1 107 ILE H 1.800 . 2.300 2.202 2.174 2.225 . 0 0 "[ . 1 . 2]" 3
96 1 12 PHE O 1 107 ILE N 2.800 2.800 3.300 3.042 3.008 3.063 . 0 0 "[ . 1 . 2]" 3
97 1 89 ARG O 1 108 CYS H 1.800 . 2.300 1.945 1.916 2.019 . 0 0 "[ . 1 . 2]" 3
98 1 89 ARG O 1 108 CYS N 2.800 2.800 3.300 2.916 2.889 2.990 . 0 0 "[ . 1 . 2]" 3
99 1 87 TRP O 1 110 ASN H 1.800 . 2.300 2.031 1.929 2.186 . 0 0 "[ . 1 . 2]" 3
100 1 87 TRP O 1 110 ASN N 2.800 2.800 3.300 2.922 2.786 3.068 0.014 10 0 "[ . 1 . 2]" 3
stop_
save_
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