NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
391527 |
1pdx   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1pdx
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 1355
_Distance_constraint_stats_list.Viol_count 2082
_Distance_constraint_stats_list.Viol_total 3267.384
_Distance_constraint_stats_list.Viol_max 0.816
_Distance_constraint_stats_list.Viol_rms 0.0480
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0123
_Distance_constraint_stats_list.Viol_average_violations_only 0.1121
_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 1 SER 3.709 0.333 14 0 "[ . 1 ]"
1 2 LYS 6.096 0.188 2 0 "[ . 1 ]"
1 3 VAL 11.029 0.323 11 0 "[ . 1 ]"
1 4 VAL 8.913 0.331 13 0 "[ . 1 ]"
1 5 TYR 10.171 0.313 11 0 "[ . 1 ]"
1 6 VAL 1.142 0.127 4 0 "[ . 1 ]"
1 7 SER 2.853 0.650 7 3 "[ . + -* ]"
1 8 HIS 3.020 0.125 11 0 "[ . 1 ]"
1 9 ASP 2.193 0.125 11 0 "[ . 1 ]"
1 10 GLY 0.934 0.097 2 0 "[ . 1 ]"
1 11 THR 5.292 0.262 11 0 "[ . 1 ]"
1 12 ARG 5.292 0.262 11 0 "[ . 1 ]"
1 13 ARG 6.879 0.650 7 3 "[ . + -* ]"
1 14 GLU 6.596 0.331 13 0 "[ . 1 ]"
1 15 LEU 16.293 0.323 11 0 "[ . 1 ]"
1 16 ASP 2.022 0.284 12 0 "[ . 1 ]"
1 17 VAL 13.339 0.333 14 0 "[ . 1 ]"
1 18 ALA 1.214 0.109 14 0 "[ . 1 ]"
1 19 ASP 2.911 0.176 12 0 "[ . 1 ]"
1 20 GLY 7.144 0.383 13 0 "[ . 1 ]"
1 21 VAL 15.153 0.477 4 0 "[ . 1 ]"
1 22 SER 1.868 0.167 5 0 "[ . 1 ]"
1 23 LEU 5.886 0.220 1 0 "[ . 1 ]"
1 24 MET 3.639 0.244 14 0 "[ . 1 ]"
1 25 GLN 2.305 0.218 14 0 "[ . 1 ]"
1 26 ALA 12.165 0.477 4 0 "[ . 1 ]"
1 27 ALA 4.801 0.220 1 0 "[ . 1 ]"
1 28 VAL 0.388 0.121 4 0 "[ . 1 ]"
1 29 SER 6.259 0.495 4 0 "[ . 1 ]"
1 30 ASN 7.041 0.244 4 0 "[ . 1 ]"
1 31 GLY 6.437 0.495 4 0 "[ . 1 ]"
1 32 ILE 6.324 0.240 11 0 "[ . 1 ]"
1 33 TYR 8.962 0.244 14 0 "[ . 1 ]"
1 34 ASP 3.013 0.229 13 0 "[ . 1 ]"
1 35 ILE 0.355 0.182 13 0 "[ . 1 ]"
1 39 CYS 0.710 0.212 4 0 "[ . 1 ]"
1 45 CYS 0.290 0.165 5 0 "[ . 1 ]"
1 47 THR 0.265 0.165 5 0 "[ . 1 ]"
1 48 CYS 1.350 0.212 4 0 "[ . 1 ]"
1 49 HIS 11.400 0.414 5 0 "[ . 1 ]"
1 50 VAL 3.077 0.240 11 0 "[ . 1 ]"
1 51 TYR 7.182 0.203 4 0 "[ . 1 ]"
1 52 VAL 9.508 0.279 4 0 "[ . 1 ]"
1 53 ASN 7.369 0.250 10 0 "[ . 1 ]"
1 54 GLU 0.714 0.083 6 0 "[ . 1 ]"
1 55 ALA 0.000 0.000 . 0 "[ . 1 ]"
1 56 PHE 2.386 0.104 7 0 "[ . 1 ]"
1 57 THR 2.851 0.144 4 0 "[ . 1 ]"
1 58 ASP 4.174 0.339 5 0 "[ . 1 ]"
1 59 LYS 1.393 0.153 4 0 "[ . 1 ]"
1 60 VAL 12.656 0.339 5 0 "[ . 1 ]"
1 61 PRO 4.542 0.286 14 0 "[ . 1 ]"
1 62 ALA 5.794 0.493 6 0 "[ . 1 ]"
1 63 ALA 9.642 0.804 7 4 "[ - .*+ 1 * ]"
1 64 ASN 4.821 0.401 9 0 "[ . 1 ]"
1 65 GLU 1.434 0.148 5 0 "[ . 1 ]"
1 66 ARG 0.205 0.086 6 0 "[ . 1 ]"
1 67 GLU 0.858 0.148 5 0 "[ . 1 ]"
1 68 ILE 1.152 0.127 11 0 "[ . 1 ]"
1 69 GLY 0.702 0.127 11 0 "[ . 1 ]"
1 70 MET 0.962 0.105 11 0 "[ . 1 ]"
1 71 LEU 3.220 0.259 4 0 "[ . 1 ]"
1 72 GLU 0.438 0.110 4 0 "[ . 1 ]"
1 73 CYS 0.195 0.040 8 0 "[ . 1 ]"
1 74 VAL 3.270 0.300 9 0 "[ . 1 ]"
1 75 THR 0.363 0.108 5 0 "[ . 1 ]"
1 76 ALA 2.503 0.263 13 0 "[ . 1 ]"
1 77 GLU 5.654 0.414 5 0 "[ . 1 ]"
1 78 LEU 7.123 0.816 9 1 "[ . +1 ]"
1 79 LYS 3.996 0.352 11 0 "[ . 1 ]"
1 80 PRO 1.388 0.141 5 0 "[ . 1 ]"
1 81 ASN 2.603 0.141 5 0 "[ . 1 ]"
1 82 SER 1.988 0.113 13 0 "[ . 1 ]"
1 83 ARG 8.342 0.816 9 5 "[ - .** +1 * ]"
1 84 LEU 1.596 0.105 11 0 "[ . 1 ]"
1 85 CYS 0.111 0.060 4 0 "[ . 1 ]"
1 86 CYS 1.095 0.140 1 0 "[ . 1 ]"
1 87 GLN 0.340 0.103 5 0 "[ . 1 ]"
1 88 ILE 3.029 0.219 9 0 "[ . 1 ]"
1 89 ILE 2.928 0.169 10 0 "[ . 1 ]"
1 90 MET 11.960 0.370 6 0 "[ . 1 ]"
1 91 THR 11.264 0.383 13 0 "[ . 1 ]"
1 92 PRO 5.466 0.335 6 0 "[ . 1 ]"
1 93 GLU 1.642 0.232 8 0 "[ . 1 ]"
1 94 LEU 2.652 0.153 4 0 "[ . 1 ]"
1 95 ASP 0.014 0.014 7 0 "[ . 1 ]"
1 96 GLY 3.157 0.188 2 0 "[ . 1 ]"
1 97 ILE 13.697 0.289 12 0 "[ . 1 ]"
1 98 VAL 5.784 0.248 4 0 "[ . 1 ]"
1 99 VAL 7.598 0.313 11 0 "[ . 1 ]"
1 100 ASP 3.587 0.259 5 0 "[ . 1 ]"
1 101 VAL 6.991 0.259 5 0 "[ . 1 ]"
1 102 PRO 5.013 0.274 5 0 "[ . 1 ]"
1 103 ASP 0.857 0.119 11 0 "[ . 1 ]"
1 104 ARG 4.583 0.296 11 0 "[ . 1 ]"
1 105 GLN 7.423 0.296 11 0 "[ . 1 ]"
1 106 TRP 3.381 0.279 9 0 "[ . 1 ]"
2 1 FES 0.000 0.000 . 0 "[ . 1 ]"
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 1 SER HA 1 2 LYS H 3.000 . 3.300 2.388 2.292 2.752 . 0 0 "[ . 1 ]" 1
2 1 1 SER HA 1 92 PRO HA 3.000 . 3.300 3.364 2.909 3.529 0.229 5 0 "[ . 1 ]" 1
3 1 1 SER QB 1 95 ASP HA 3.000 . 3.300 2.090 1.786 2.320 0.014 7 0 "[ . 1 ]" 1
4 1 1 SER HB2 1 2 LYS H 3.000 . 3.300 3.302 3.025 3.412 0.112 7 0 "[ . 1 ]" 1
5 1 1 SER HB2 1 90 MET ME 3.000 . 3.300 3.131 2.650 3.294 . 0 0 "[ . 1 ]" 1
6 1 1 SER HB2 1 96 GLY H 4.000 . 4.300 4.005 3.576 4.464 0.164 7 0 "[ . 1 ]" 1
7 1 1 SER HB3 1 2 LYS H 4.000 . 4.300 3.760 1.853 4.351 0.051 6 0 "[ . 1 ]" 1
8 1 1 SER HB3 1 17 VAL H 5.000 . 5.300 5.331 5.013 5.633 0.333 14 0 "[ . 1 ]" 1
9 1 1 SER HB3 1 96 GLY H 5.000 . 5.300 4.615 2.756 5.434 0.134 4 0 "[ . 1 ]" 1
10 1 2 LYS H 1 2 LYS HB2 3.000 . 3.300 2.076 1.940 2.123 . 0 0 "[ . 1 ]" 1
11 1 2 LYS H 1 2 LYS HB3 3.000 . 3.300 3.410 3.317 3.449 0.149 3 0 "[ . 1 ]" 1
12 1 2 LYS H 1 2 LYS QD 5.000 . 5.300 3.754 1.924 4.542 . 0 0 "[ . 1 ]" 1
13 1 2 LYS H 1 2 LYS QE 5.000 . 5.300 4.321 3.990 4.763 . 0 0 "[ . 1 ]" 1
14 1 2 LYS H 1 2 LYS QG 4.000 . 4.300 2.912 2.554 3.481 . 0 0 "[ . 1 ]" 1
15 1 2 LYS H 1 3 VAL H 5.000 . 5.300 4.581 4.493 4.633 . 0 0 "[ . 1 ]" 1
16 1 2 LYS H 1 96 GLY QA 4.000 . 4.300 3.838 3.501 3.938 . 0 0 "[ . 1 ]" 1
17 1 2 LYS H 1 97 ILE H 4.000 . 4.300 4.251 3.800 4.367 0.067 13 0 "[ . 1 ]" 1
18 1 2 LYS HA 1 3 VAL H 3.000 . 3.300 2.267 2.218 2.324 . 0 0 "[ . 1 ]" 1
19 1 2 LYS HA 1 16 ASP HA 3.000 . 3.300 2.732 2.426 2.944 . 0 0 "[ . 1 ]" 1
20 1 2 LYS HA 1 17 VAL H 4.000 . 4.300 4.141 3.807 4.417 0.117 10 0 "[ . 1 ]" 1
21 1 2 LYS QB 1 3 VAL H 3.000 . 3.300 2.983 2.913 3.061 . 0 0 "[ . 1 ]" 1
22 1 2 LYS QB 1 95 ASP HA 4.000 . 4.300 3.003 2.873 3.288 . 0 0 "[ . 1 ]" 1
23 1 2 LYS QB 1 96 GLY HA2 3.000 . 3.300 2.020 1.782 2.128 0.018 7 0 "[ . 1 ]" 1
24 1 2 LYS HB2 1 96 GLY H 3.000 . 3.300 2.244 2.116 2.386 . 0 0 "[ . 1 ]" 1
25 1 2 LYS HB2 1 97 ILE H 5.000 . 5.300 3.884 3.773 4.110 . 0 0 "[ . 1 ]" 1
26 1 2 LYS HB3 1 96 GLY H 3.000 . 3.300 3.207 2.783 3.353 0.053 5 0 "[ . 1 ]" 1
27 1 2 LYS HB3 1 97 ILE H 4.000 . 4.300 4.273 3.880 4.386 0.086 8 0 "[ . 1 ]" 1
28 1 2 LYS HD2 1 3 VAL H 4.000 . 4.300 4.221 3.964 4.357 0.057 10 0 "[ . 1 ]" 1
29 1 2 LYS QG 1 3 VAL H 4.000 . 4.300 3.866 3.454 4.032 . 0 0 "[ . 1 ]" 1
30 1 2 LYS QG 1 96 GLY H 4.000 . 4.300 4.083 4.025 4.164 . 0 0 "[ . 1 ]" 1
31 1 2 LYS O 1 96 GLY H 2.400 . 3.300 1.961 1.929 2.006 0.071 2 0 "[ . 1 ]" 1
32 1 2 LYS O 1 96 GLY N 3.400 3.000 4.300 2.854 2.812 2.897 0.188 2 0 "[ . 1 ]" 1
33 1 3 VAL H 1 3 VAL HB 4.000 . 4.300 2.475 2.434 2.529 . 0 0 "[ . 1 ]" 1
34 1 3 VAL H 1 3 VAL MG1 4.000 . 4.300 3.734 3.685 3.775 . 0 0 "[ . 1 ]" 1
35 1 3 VAL H 1 3 VAL MG2 3.000 . 3.300 2.926 2.871 2.989 . 0 0 "[ . 1 ]" 1
36 1 3 VAL H 1 15 LEU H 3.000 . 3.300 3.196 3.091 3.361 0.061 11 0 "[ . 1 ]" 1
37 1 3 VAL H 1 15 LEU O 2.400 . 3.300 2.509 2.128 2.681 . 0 0 "[ . 1 ]" 1
38 1 3 VAL H 1 16 ASP HA 3.000 . 3.300 3.413 3.362 3.454 0.154 6 0 "[ . 1 ]" 1
39 1 3 VAL H 1 17 VAL H 5.000 . 5.300 4.005 3.835 4.196 . 0 0 "[ . 1 ]" 1
40 1 3 VAL H 1 96 GLY H 5.000 . 5.300 4.540 4.452 4.619 . 0 0 "[ . 1 ]" 1
41 1 3 VAL H 1 97 ILE MG 4.000 . 4.300 3.782 3.723 3.882 . 0 0 "[ . 1 ]" 1
42 1 3 VAL HA 1 3 VAL MG1 3.000 . 3.300 2.531 2.460 2.603 . 0 0 "[ . 1 ]" 1
43 1 3 VAL HA 1 3 VAL MG2 3.000 . 3.300 2.068 1.970 2.213 . 0 0 "[ . 1 ]" 1
44 1 3 VAL HA 1 4 VAL H 3.000 . 3.300 2.157 2.117 2.217 . 0 0 "[ . 1 ]" 1
45 1 3 VAL HA 1 15 LEU H 5.000 . 5.300 4.382 4.295 4.449 . 0 0 "[ . 1 ]" 1
46 1 3 VAL HA 1 96 GLY H 4.000 . 4.300 3.948 3.825 4.113 . 0 0 "[ . 1 ]" 1
47 1 3 VAL HA 1 97 ILE H 3.000 . 3.300 3.204 2.978 3.297 . 0 0 "[ . 1 ]" 1
48 1 3 VAL HA 1 97 ILE MG 4.000 . 4.300 1.554 1.511 1.615 0.289 12 0 "[ . 1 ]" 1
49 1 3 VAL HB 1 15 LEU H 5.000 . 5.300 2.549 2.372 2.790 . 0 0 "[ . 1 ]" 1
50 1 3 VAL HB 1 17 VAL MG2 4.000 . 4.300 2.399 2.029 2.797 . 0 0 "[ . 1 ]" 1
51 1 3 VAL HB 1 23 LEU MD2 5.000 . 5.300 3.371 3.230 3.451 . 0 0 "[ . 1 ]" 1
52 1 3 VAL MG1 1 4 VAL H 3.000 . 3.300 2.662 2.572 2.719 . 0 0 "[ . 1 ]" 1
53 1 3 VAL MG1 1 5 TYR H 4.000 . 4.300 2.992 2.929 3.172 . 0 0 "[ . 1 ]" 1
54 1 3 VAL MG1 1 5 TYR QD 3.000 . 3.300 2.644 2.612 2.694 . 0 0 "[ . 1 ]" 1
55 1 3 VAL MG1 1 5 TYR QE 3.000 . 3.300 1.845 1.785 1.915 0.015 1 0 "[ . 1 ]" 1
56 1 3 VAL MG1 1 5 TYR HH 3.000 . 3.300 1.969 1.839 2.066 . 0 0 "[ . 1 ]" 1
57 1 3 VAL MG1 1 14 GLU HA 4.000 . 4.300 3.784 3.727 3.836 . 0 0 "[ . 1 ]" 1
58 1 3 VAL MG1 1 15 LEU H 4.000 . 4.300 2.796 2.576 2.864 . 0 0 "[ . 1 ]" 1
59 1 3 VAL MG1 1 15 LEU HB2 3.000 . 3.300 2.370 2.307 2.445 . 0 0 "[ . 1 ]" 1
60 1 3 VAL MG1 1 15 LEU HB3 4.000 . 4.300 3.685 3.613 3.742 . 0 0 "[ . 1 ]" 1
61 1 3 VAL MG1 1 15 LEU MD1 4.000 . 4.300 2.781 2.539 2.905 . 0 0 "[ . 1 ]" 1
62 1 3 VAL MG1 1 15 LEU MD2 5.000 . 5.300 3.825 3.759 3.876 . 0 0 "[ . 1 ]" 1
63 1 3 VAL MG1 1 17 VAL H 5.000 . 5.300 3.893 3.761 3.995 . 0 0 "[ . 1 ]" 1
64 1 3 VAL MG1 1 23 LEU HB2 5.000 . 5.300 4.600 4.537 4.685 . 0 0 "[ . 1 ]" 1
65 1 3 VAL MG1 1 23 LEU HB3 4.000 . 4.300 3.521 3.435 3.649 . 0 0 "[ . 1 ]" 1
66 1 3 VAL MG1 1 23 LEU MD1 4.000 . 4.300 2.334 1.857 2.628 . 0 0 "[ . 1 ]" 1
67 1 3 VAL MG1 1 23 LEU HG 4.000 . 4.300 3.863 3.796 3.927 . 0 0 "[ . 1 ]" 1
68 1 3 VAL MG1 1 97 ILE MG 3.000 . 3.300 2.397 2.361 2.466 . 0 0 "[ . 1 ]" 1
69 1 3 VAL MG1 1 99 VAL H 5.000 . 5.300 4.557 4.466 4.606 . 0 0 "[ . 1 ]" 1
70 1 3 VAL MG1 1 99 VAL MG2 4.000 . 4.300 2.737 2.658 2.860 . 0 0 "[ . 1 ]" 1
71 1 3 VAL MG2 1 4 VAL H 4.000 . 4.300 3.761 3.657 3.798 . 0 0 "[ . 1 ]" 1
72 1 3 VAL MG2 1 5 TYR HH 4.000 . 4.300 3.576 3.404 3.644 . 0 0 "[ . 1 ]" 1
73 1 3 VAL MG2 1 17 VAL H 4.000 . 4.300 1.893 1.641 2.390 0.159 8 0 "[ . 1 ]" 1
74 1 3 VAL MG2 1 90 MET QB 4.000 . 4.300 3.015 2.918 3.120 . 0 0 "[ . 1 ]" 1
75 1 3 VAL MG2 1 90 MET ME 4.000 . 4.300 3.061 2.882 3.128 . 0 0 "[ . 1 ]" 1
76 1 3 VAL MG2 1 96 GLY H 4.000 . 4.300 3.691 3.648 3.757 . 0 0 "[ . 1 ]" 1
77 1 3 VAL MG2 1 97 ILE H 5.000 . 5.300 3.445 3.271 3.615 . 0 0 "[ . 1 ]" 1
78 1 3 VAL N 1 15 LEU O 3.400 3.000 4.300 3.377 2.987 3.546 0.013 12 0 "[ . 1 ]" 1
79 1 3 VAL O 1 15 LEU H 2.400 . 3.300 1.907 1.870 1.963 0.130 5 0 "[ . 1 ]" 1
80 1 3 VAL O 1 15 LEU N 3.400 3.000 4.300 2.707 2.677 2.724 0.323 11 0 "[ . 1 ]" 1
81 1 4 VAL H 1 4 VAL HB 3.000 . 3.300 2.745 2.641 2.805 . 0 0 "[ . 1 ]" 1
82 1 4 VAL H 1 4 VAL MG2 3.000 . 3.300 2.783 2.721 2.805 . 0 0 "[ . 1 ]" 1
83 1 4 VAL H 1 5 TYR QD 5.000 . 5.300 4.510 4.462 4.592 . 0 0 "[ . 1 ]" 1
84 1 4 VAL H 1 97 ILE H 4.000 . 4.300 4.419 4.325 4.472 0.172 5 0 "[ . 1 ]" 1
85 1 4 VAL H 1 97 ILE O 2.400 . 3.300 2.050 1.966 2.279 0.034 10 0 "[ . 1 ]" 1
86 1 4 VAL H 1 98 VAL HA 3.000 . 3.300 3.272 3.037 3.356 0.056 9 0 "[ . 1 ]" 1
87 1 4 VAL H 1 99 VAL H 4.000 . 4.300 3.645 3.579 3.785 . 0 0 "[ . 1 ]" 1
88 1 4 VAL HA 1 4 VAL MG1 3.000 . 3.300 2.337 2.273 2.427 . 0 0 "[ . 1 ]" 1
89 1 4 VAL HA 1 4 VAL MG2 3.000 . 3.300 2.357 2.333 2.446 . 0 0 "[ . 1 ]" 1
90 1 4 VAL HA 1 5 TYR H 3.000 . 3.300 2.298 2.279 2.336 . 0 0 "[ . 1 ]" 1
91 1 4 VAL HA 1 5 TYR QD 5.000 . 5.300 3.288 3.219 3.380 . 0 0 "[ . 1 ]" 1
92 1 4 VAL HA 1 5 TYR QE 5.000 . 5.300 4.734 4.675 4.787 . 0 0 "[ . 1 ]" 1
93 1 4 VAL HA 1 14 GLU H 4.000 . 4.300 4.331 4.312 4.358 0.058 11 0 "[ . 1 ]" 1
94 1 4 VAL HA 1 14 GLU HA 3.000 . 3.300 2.099 1.971 2.183 . 0 0 "[ . 1 ]" 1
95 1 4 VAL HA 1 15 LEU H 4.000 . 4.300 3.428 3.377 3.464 . 0 0 "[ . 1 ]" 1
96 1 4 VAL HB 1 5 TYR H 5.000 . 5.300 4.452 4.427 4.496 . 0 0 "[ . 1 ]" 1
97 1 4 VAL HB 1 14 GLU HA 4.000 . 4.300 4.598 4.570 4.631 0.331 13 0 "[ . 1 ]" 1
98 1 4 VAL HB 1 98 VAL HA 3.000 . 3.300 2.790 2.574 2.929 . 0 0 "[ . 1 ]" 1
99 1 4 VAL MG1 1 5 TYR H 4.000 . 4.300 3.428 3.352 3.532 . 0 0 "[ . 1 ]" 1
100 1 4 VAL MG1 1 12 ARG QB 3.000 . 3.300 2.040 1.883 2.177 . 0 0 "[ . 1 ]" 1
101 1 4 VAL MG1 1 14 GLU HA 4.000 . 4.300 3.356 3.263 3.428 . 0 0 "[ . 1 ]" 1
102 1 4 VAL MG2 1 5 TYR H 5.000 . 5.300 4.274 4.245 4.356 . 0 0 "[ . 1 ]" 1
103 1 4 VAL MG2 1 14 GLU HA 4.000 . 4.300 2.337 2.216 2.408 . 0 0 "[ . 1 ]" 1
104 1 4 VAL MG2 1 15 LEU H 5.000 . 5.300 3.647 3.585 3.821 . 0 0 "[ . 1 ]" 1
105 1 4 VAL N 1 97 ILE O 3.400 3.000 4.300 2.866 2.790 2.990 0.210 4 0 "[ . 1 ]" 1
106 1 4 VAL O 1 99 VAL H 2.400 . 3.300 2.064 2.026 2.197 . 0 0 "[ . 1 ]" 1
107 1 4 VAL O 1 99 VAL N 3.400 3.000 4.300 2.981 2.925 3.115 0.075 4 0 "[ . 1 ]" 1
108 1 5 TYR H 1 5 TYR HB2 4.000 . 4.300 2.481 2.401 2.540 . 0 0 "[ . 1 ]" 1
109 1 5 TYR H 1 5 TYR HB3 4.000 . 4.300 3.522 3.490 3.566 . 0 0 "[ . 1 ]" 1
110 1 5 TYR H 1 6 VAL H 4.500 . 4.800 4.613 4.589 4.634 . 0 0 "[ . 1 ]" 1
111 1 5 TYR H 1 13 ARG H 3.000 . 3.300 3.078 2.990 3.141 . 0 0 "[ . 1 ]" 1
112 1 5 TYR H 1 13 ARG HA 5.000 . 5.300 5.143 5.002 5.232 . 0 0 "[ . 1 ]" 1
113 1 5 TYR H 1 14 GLU HA 4.000 . 4.300 3.788 3.596 3.930 . 0 0 "[ . 1 ]" 1
114 1 5 TYR H 1 32 ILE MD 5.000 . 5.300 3.470 3.307 3.617 . 0 0 "[ . 1 ]" 1
115 1 5 TYR H 1 32 ILE MG 5.000 . 5.300 4.491 4.434 4.546 . 0 0 "[ . 1 ]" 1
116 1 5 TYR H 1 99 VAL HB 4.000 . 4.300 4.505 4.454 4.613 0.313 11 0 "[ . 1 ]" 1
117 1 5 TYR H 1 99 VAL MG2 4.000 . 4.300 3.070 2.976 3.195 . 0 0 "[ . 1 ]" 1
118 1 5 TYR HA 1 5 TYR QD 4.000 . 4.300 3.128 3.056 3.204 . 0 0 "[ . 1 ]" 1
119 1 5 TYR HA 1 6 VAL H 3.000 . 3.300 2.295 2.247 2.369 . 0 0 "[ . 1 ]" 1
120 1 5 TYR HA 1 6 VAL MG2 4.000 . 4.300 3.388 3.254 3.519 . 0 0 "[ . 1 ]" 1
121 1 5 TYR HA 1 99 VAL H 4.000 . 4.300 2.302 2.075 2.438 . 0 0 "[ . 1 ]" 1
122 1 5 TYR HA 1 99 VAL MG2 3.000 . 3.300 1.799 1.729 1.839 0.071 2 0 "[ . 1 ]" 1
123 1 5 TYR HB2 1 5 TYR QD 3.000 . 3.300 2.556 2.514 2.616 . 0 0 "[ . 1 ]" 1
124 1 5 TYR HB2 1 6 VAL H 5.000 . 5.300 3.956 3.636 4.160 . 0 0 "[ . 1 ]" 1
125 1 5 TYR HB2 1 13 ARG QB 5.000 . 5.300 3.312 2.237 3.560 . 0 0 "[ . 1 ]" 1
126 1 5 TYR HB2 1 32 ILE MD 5.000 2.800 5.300 3.008 2.813 3.296 . 0 0 "[ . 1 ]" 1
127 1 5 TYR HB2 1 32 ILE MG 5.000 . 5.300 3.063 2.937 3.183 . 0 0 "[ . 1 ]" 1
128 1 5 TYR HB3 1 5 TYR QD 3.000 . 3.300 2.316 2.278 2.350 . 0 0 "[ . 1 ]" 1
129 1 5 TYR HB3 1 6 VAL H 5.000 . 5.300 3.117 2.648 3.363 . 0 0 "[ . 1 ]" 1
130 1 5 TYR HB3 1 32 ILE MD 5.000 . 5.300 4.102 3.832 4.421 . 0 0 "[ . 1 ]" 1
131 1 5 TYR HB3 1 32 ILE MG 5.000 . 5.300 3.602 3.322 3.796 . 0 0 "[ . 1 ]" 1
132 1 5 TYR HB3 1 99 VAL MG2 5.000 . 5.300 3.387 3.249 3.487 . 0 0 "[ . 1 ]" 1
133 1 5 TYR QD 1 6 VAL H 5.000 . 5.300 4.424 4.109 4.598 . 0 0 "[ . 1 ]" 1
134 1 5 TYR QD 1 13 ARG QB 5.000 . 5.300 2.776 2.277 2.912 . 0 0 "[ . 1 ]" 1
135 1 5 TYR QD 1 13 ARG QG 5.000 . 5.300 2.713 2.492 3.313 . 0 0 "[ . 1 ]" 1
136 1 5 TYR QD 1 14 GLU H 5.000 . 5.300 4.514 4.328 4.611 . 0 0 "[ . 1 ]" 1
137 1 5 TYR QD 1 14 GLU HA 5.000 . 5.300 3.954 3.826 4.071 . 0 0 "[ . 1 ]" 1
138 1 5 TYR QD 1 15 LEU H 4.000 . 4.300 3.827 3.756 3.887 . 0 0 "[ . 1 ]" 1
139 1 5 TYR QD 1 15 LEU QB 5.000 . 5.300 4.376 4.321 4.431 . 0 0 "[ . 1 ]" 1
140 1 5 TYR QD 1 15 LEU MD1 5.000 . 5.300 3.519 3.412 3.914 . 0 0 "[ . 1 ]" 1
141 1 5 TYR QD 1 15 LEU MD2 5.000 . 5.300 3.617 3.422 3.812 . 0 0 "[ . 1 ]" 1
142 1 5 TYR QD 1 15 LEU HG 5.000 . 5.300 2.746 2.676 2.894 . 0 0 "[ . 1 ]" 1
143 1 5 TYR QD 1 27 ALA MB 5.000 . 5.300 3.674 3.555 3.870 . 0 0 "[ . 1 ]" 1
144 1 5 TYR QD 1 32 ILE MD 4.000 . 4.300 2.204 2.046 2.354 . 0 0 "[ . 1 ]" 1
145 1 5 TYR QD 1 32 ILE MG 4.000 . 4.300 3.210 3.136 3.244 . 0 0 "[ . 1 ]" 1
146 1 5 TYR QD 1 50 VAL MG2 5.000 . 5.300 4.013 3.950 4.195 . 0 0 "[ . 1 ]" 1
147 1 5 TYR QD 1 99 VAL MG1 5.000 . 5.300 2.777 2.638 3.035 . 0 0 "[ . 1 ]" 1
148 1 5 TYR QD 1 99 VAL MG2 3.000 . 3.300 2.496 2.467 2.522 . 0 0 "[ . 1 ]" 1
149 1 5 TYR QE 1 13 ARG QB 5.000 . 5.300 4.305 4.240 4.353 . 0 0 "[ . 1 ]" 1
150 1 5 TYR QE 1 13 ARG QG 5.000 . 5.300 4.309 4.259 4.350 . 0 0 "[ . 1 ]" 1
151 1 5 TYR QE 1 14 GLU HA 5.000 . 5.300 4.839 4.782 4.892 . 0 0 "[ . 1 ]" 1
152 1 5 TYR QE 1 15 LEU HB2 3.000 . 3.300 2.852 2.725 2.921 . 0 0 "[ . 1 ]" 1
153 1 5 TYR QE 1 15 LEU HB3 4.000 . 4.300 3.787 3.700 3.839 . 0 0 "[ . 1 ]" 1
154 1 5 TYR QE 1 15 LEU MD1 4.000 . 4.300 1.852 1.797 2.272 0.003 1 0 "[ . 1 ]" 1
155 1 5 TYR QE 1 15 LEU MD2 4.000 . 4.300 3.271 3.233 3.314 . 0 0 "[ . 1 ]" 1
156 1 5 TYR QE 1 15 LEU HG 5.000 . 5.300 1.622 1.582 1.658 0.218 7 0 "[ . 1 ]" 1
157 1 5 TYR QE 1 23 LEU HA 4.000 . 4.300 3.726 3.487 3.863 . 0 0 "[ . 1 ]" 1
158 1 5 TYR QE 1 23 LEU QB 5.000 . 5.300 1.691 1.604 1.754 0.196 4 0 "[ . 1 ]" 1
159 1 5 TYR QE 1 23 LEU MD2 4.000 . 4.300 2.955 2.791 3.203 . 0 0 "[ . 1 ]" 1
160 1 5 TYR QE 1 26 ALA MB 5.000 . 5.300 3.719 3.546 3.922 . 0 0 "[ . 1 ]" 1
161 1 5 TYR QE 1 27 ALA H 5.000 . 5.300 3.797 3.707 3.907 . 0 0 "[ . 1 ]" 1
162 1 5 TYR QE 1 27 ALA HA 5.000 . 5.300 3.559 3.461 3.843 . 0 0 "[ . 1 ]" 1
163 1 5 TYR QE 1 27 ALA MB 4.000 . 4.300 2.745 2.655 2.978 . 0 0 "[ . 1 ]" 1
164 1 5 TYR QE 1 32 ILE HB 5.000 . 5.300 4.756 4.657 4.843 . 0 0 "[ . 1 ]" 1
165 1 5 TYR QE 1 32 ILE MD 5.000 . 5.300 2.395 2.168 2.548 . 0 0 "[ . 1 ]" 1
166 1 5 TYR QE 1 99 VAL MG1 5.000 . 5.300 3.376 3.147 3.766 . 0 0 "[ . 1 ]" 1
167 1 5 TYR QE 1 99 VAL MG2 5.000 . 5.300 2.995 2.918 3.081 . 0 0 "[ . 1 ]" 1
168 1 5 TYR HH 1 23 LEU QB 5.000 . 5.300 2.872 2.683 3.071 . 0 0 "[ . 1 ]" 1
169 1 5 TYR HH 1 23 LEU MD1 4.000 . 4.300 3.529 2.853 3.730 . 0 0 "[ . 1 ]" 1
170 1 5 TYR HH 1 23 LEU MD2 5.000 . 5.300 1.781 1.693 1.849 0.107 11 0 "[ . 1 ]" 1
171 1 5 TYR HH 1 26 ALA MB 3.000 . 3.300 2.610 2.417 2.754 . 0 0 "[ . 1 ]" 1
172 1 5 TYR HH 1 27 ALA H 3.000 . 3.300 2.807 2.656 2.992 . 0 0 "[ . 1 ]" 1
173 1 5 TYR HH 1 27 ALA MB 4.000 . 4.300 2.957 2.736 3.212 . 0 0 "[ . 1 ]" 1
174 1 5 TYR O 1 13 ARG H 2.400 . 3.300 2.047 1.933 2.123 0.067 1 0 "[ . 1 ]" 1
175 1 5 TYR O 1 13 ARG N 3.400 3.000 4.300 2.831 2.717 2.939 0.283 1 0 "[ . 1 ]" 1
176 1 6 VAL H 1 6 VAL HB 3.000 . 3.300 2.391 2.336 2.509 . 0 0 "[ . 1 ]" 1
177 1 6 VAL H 1 6 VAL MG1 4.000 . 4.300 3.730 3.710 3.774 . 0 0 "[ . 1 ]" 1
178 1 6 VAL H 1 6 VAL MG2 3.000 . 3.300 2.437 2.269 2.755 . 0 0 "[ . 1 ]" 1
179 1 6 VAL H 1 99 VAL H 4.000 . 4.300 3.378 3.154 3.773 . 0 0 "[ . 1 ]" 1
180 1 6 VAL H 1 99 VAL MG2 4.000 . 4.300 3.647 3.594 3.736 . 0 0 "[ . 1 ]" 1
181 1 6 VAL H 1 100 ASP HA 3.000 . 3.300 2.920 2.859 3.021 . 0 0 "[ . 1 ]" 1
182 1 6 VAL H 1 101 VAL H 4.000 . 4.300 3.541 3.317 3.731 . 0 0 "[ . 1 ]" 1
183 1 6 VAL HA 1 6 VAL MG1 3.000 . 3.300 2.349 2.267 2.402 . 0 0 "[ . 1 ]" 1
184 1 6 VAL HA 1 6 VAL MG2 3.000 . 3.300 2.298 2.247 2.383 . 0 0 "[ . 1 ]" 1
185 1 6 VAL HA 1 7 SER H 3.000 . 3.300 2.477 2.428 2.528 . 0 0 "[ . 1 ]" 1
186 1 6 VAL HB 1 7 SER H 4.000 . 4.300 3.644 3.527 3.730 . 0 0 "[ . 1 ]" 1
187 1 6 VAL HB 1 100 ASP HA 3.000 . 3.300 1.797 1.743 1.840 0.057 11 0 "[ . 1 ]" 1
188 1 6 VAL HB 1 101 VAL H 4.000 . 4.300 2.978 2.945 3.010 . 0 0 "[ . 1 ]" 1
189 1 6 VAL HB 1 101 VAL MG2 5.000 . 5.300 4.120 4.065 4.178 . 0 0 "[ . 1 ]" 1
190 1 6 VAL MG1 1 10 GLY H 4.000 . 4.300 3.097 3.009 3.183 . 0 0 "[ . 1 ]" 1
191 1 6 VAL MG1 1 10 GLY HA2 4.000 . 4.300 2.059 1.988 2.182 . 0 0 "[ . 1 ]" 1
192 1 6 VAL MG1 1 12 ARG QG 4.000 . 4.300 2.053 1.838 2.512 . 0 0 "[ . 1 ]" 1
193 1 6 VAL MG1 1 100 ASP HA 5.000 . 5.300 3.215 3.167 3.269 . 0 0 "[ . 1 ]" 1
194 1 6 VAL MG1 1 101 VAL H 5.000 . 5.300 3.404 3.272 3.591 . 0 0 "[ . 1 ]" 1
195 1 6 VAL MG2 1 10 GLY QA 5.000 . 5.300 4.024 3.969 4.046 . 0 0 "[ . 1 ]" 1
196 1 6 VAL MG2 1 12 ARG HA 5.000 . 5.300 3.631 3.345 3.858 . 0 0 "[ . 1 ]" 1
197 1 6 VAL MG2 1 12 ARG QB 3.000 . 3.300 2.485 2.420 2.495 . 0 0 "[ . 1 ]" 1
198 1 6 VAL MG2 1 99 VAL H 3.000 . 3.300 2.932 2.860 3.024 . 0 0 "[ . 1 ]" 1
199 1 6 VAL MG2 1 100 ASP HA 4.000 . 4.300 3.335 3.312 3.359 . 0 0 "[ . 1 ]" 1
200 1 6 VAL MG2 1 101 VAL H 5.000 . 5.300 4.516 4.460 4.549 . 0 0 "[ . 1 ]" 1
201 1 6 VAL O 1 101 VAL H 2.400 . 3.300 2.253 2.128 2.371 . 0 0 "[ . 1 ]" 1
202 1 6 VAL O 1 101 VAL N 3.400 3.000 4.300 2.930 2.873 2.969 0.127 4 0 "[ . 1 ]" 1
203 1 7 SER H 1 7 SER HB3 3.000 . 3.300 2.660 2.448 2.778 . 0 0 "[ . 1 ]" 1
204 1 7 SER H 1 8 HIS H 4.000 . 4.300 4.246 4.117 4.281 . 0 0 "[ . 1 ]" 1
205 1 7 SER H 1 8 HIS HD1 5.000 . 5.300 5.318 5.253 5.348 0.048 2 0 "[ . 1 ]" 1
206 1 7 SER H 1 11 THR H 4.000 . 4.300 3.401 2.838 3.663 . 0 0 "[ . 1 ]" 1
207 1 7 SER H 1 11 THR HB 5.000 . 5.300 4.385 4.086 4.524 . 0 0 "[ . 1 ]" 1
208 1 7 SER H 1 12 ARG H 5.000 . 5.300 4.577 4.413 4.797 . 0 0 "[ . 1 ]" 1
209 1 7 SER H 1 12 ARG HA 4.000 . 4.300 3.414 3.193 3.677 . 0 0 "[ . 1 ]" 1
210 1 7 SER H 1 100 ASP HA 5.000 . 5.300 4.845 4.754 4.932 . 0 0 "[ . 1 ]" 1
211 1 7 SER HA 1 8 HIS HD1 3.000 . 3.300 2.988 2.925 3.035 . 0 0 "[ . 1 ]" 1
212 1 7 SER HA 1 101 VAL H 3.000 . 3.300 3.348 3.296 3.394 0.094 11 0 "[ . 1 ]" 1
213 1 7 SER HA 1 101 VAL HB 3.000 . 3.300 1.795 1.767 1.839 0.033 2 0 "[ . 1 ]" 1
214 1 7 SER HA 1 101 VAL MG2 5.000 . 5.300 2.998 2.804 3.154 . 0 0 "[ . 1 ]" 1
215 1 7 SER QB 1 8 HIS HD1 4.000 . 4.300 3.650 3.468 3.795 . 0 0 "[ . 1 ]" 1
216 1 7 SER QB 1 8 HIS HD2 5.000 . 5.300 4.776 4.752 4.806 . 0 0 "[ . 1 ]" 1
217 1 7 SER QB 1 9 ASP H 4.000 . 4.300 3.075 2.947 3.333 . 0 0 "[ . 1 ]" 1
218 1 7 SER QB 1 13 ARG QH2 5.000 . 5.300 4.188 1.765 5.950 0.650 7 3 "[ . + -* ]" 1
219 1 7 SER HB2 1 11 THR MG 3.000 . 3.300 2.808 2.776 2.842 . 0 0 "[ . 1 ]" 1
220 1 8 HIS HA 1 8 HIS HD1 3.000 . 3.300 2.844 2.768 2.933 . 0 0 "[ . 1 ]" 1
221 1 8 HIS HA 1 8 HIS HD2 5.000 . 5.200 5.079 5.068 5.095 . 0 0 "[ . 1 ]" 1
222 1 8 HIS HA 1 9 ASP H 4.000 . 4.300 3.485 3.472 3.505 . 0 0 "[ . 1 ]" 1
223 1 8 HIS HA 1 10 GLY H 5.000 . 5.300 3.902 3.800 3.965 . 0 0 "[ . 1 ]" 1
224 1 8 HIS QB 1 9 ASP H 5.000 . 5.300 2.923 2.834 3.041 . 0 0 "[ . 1 ]" 1
225 1 8 HIS QB 1 103 ASP H 5.000 . 5.300 3.471 3.233 3.676 . 0 0 "[ . 1 ]" 1
226 1 8 HIS HB2 1 8 HIS HD2 4.000 . 4.300 2.786 2.757 2.807 . 0 0 "[ . 1 ]" 1
227 1 8 HIS HB2 1 102 PRO HA 5.000 . 5.300 5.381 5.253 5.412 0.112 4 0 "[ . 1 ]" 1
228 1 8 HIS HB2 1 103 ASP HA 4.000 . 4.300 4.314 4.243 4.370 0.070 2 0 "[ . 1 ]" 1
229 1 8 HIS HB3 1 9 ASP HA 5.000 . 5.300 5.312 5.248 5.371 0.071 2 0 "[ . 1 ]" 1
230 1 8 HIS HB3 1 103 ASP HA 4.000 . 4.300 3.444 3.332 3.559 . 0 0 "[ . 1 ]" 1
231 1 8 HIS HD1 1 9 ASP H 4.000 . 4.300 4.370 4.312 4.425 0.125 11 0 "[ . 1 ]" 1
232 1 8 HIS HD1 1 101 VAL HB 5.000 . 5.300 2.695 2.509 2.985 . 0 0 "[ . 1 ]" 1
233 1 8 HIS HD1 1 101 VAL MG1 5.000 . 5.300 2.109 1.833 2.821 . 0 0 "[ . 1 ]" 1
234 1 8 HIS HD2 1 103 ASP QB 5.000 . 5.300 4.101 3.306 4.520 . 0 0 "[ . 1 ]" 1
235 1 9 ASP H 1 9 ASP HB2 4.000 . 4.300 3.600 3.590 3.608 . 0 0 "[ . 1 ]" 1
236 1 9 ASP H 1 9 ASP HB3 3.000 . 3.300 2.514 2.426 2.587 . 0 0 "[ . 1 ]" 1
237 1 9 ASP H 1 10 GLY H 4.000 . 4.300 2.303 2.231 2.440 . 0 0 "[ . 1 ]" 1
238 1 9 ASP HA 1 10 GLY H 3.000 . 3.300 3.365 3.279 3.397 0.097 2 0 "[ . 1 ]" 1
239 1 9 ASP HB3 1 10 GLY H 5.000 . 5.300 4.119 4.046 4.184 . 0 0 "[ . 1 ]" 1
240 1 10 GLY H 1 10 GLY HA2 3.000 . 3.300 2.495 2.471 2.505 . 0 0 "[ . 1 ]" 1
241 1 10 GLY H 1 10 GLY HA3 3.000 . 3.300 2.993 2.990 3.007 . 0 0 "[ . 1 ]" 1
242 1 10 GLY H 1 11 THR H 3.000 . 3.300 2.440 2.158 2.607 . 0 0 "[ . 1 ]" 1
243 1 10 GLY HA2 1 11 THR H 4.000 . 4.300 3.451 3.281 3.524 . 0 0 "[ . 1 ]" 1
244 1 10 GLY HA3 1 11 THR H 4.000 . 4.300 3.191 3.066 3.412 . 0 0 "[ . 1 ]" 1
245 1 11 THR H 1 11 THR HB 3.000 . 3.300 1.975 1.909 2.010 . 0 0 "[ . 1 ]" 1
246 1 11 THR H 1 11 THR MG 4.000 . 4.300 3.307 3.221 3.348 . 0 0 "[ . 1 ]" 1
247 1 11 THR H 1 12 ARG H 4.000 . 4.300 4.522 4.507 4.562 0.262 11 0 "[ . 1 ]" 1
248 1 11 THR HA 1 11 THR MG 3.000 . 3.300 2.879 2.862 2.895 . 0 0 "[ . 1 ]" 1
249 1 11 THR HA 1 12 ARG H 3.000 . 3.300 2.161 2.143 2.188 . 0 0 "[ . 1 ]" 1
250 1 11 THR HB 1 12 ARG H 4.000 2.800 4.300 4.456 4.425 4.463 0.163 2 0 "[ . 1 ]" 1
251 1 11 THR MG 1 12 ARG H 3.000 . 3.300 2.886 2.805 2.918 . 0 0 "[ . 1 ]" 1
252 1 11 THR MG 1 13 ARG HA 6.000 3.800 6.300 5.149 5.077 5.199 . 0 0 "[ . 1 ]" 1
253 1 12 ARG H 1 12 ARG QB 3.000 . 3.300 2.797 2.710 2.954 . 0 0 "[ . 1 ]" 1
254 1 12 ARG H 1 13 ARG H 5.000 . 5.300 4.464 4.402 4.526 . 0 0 "[ . 1 ]" 1
255 1 12 ARG HA 1 13 ARG H 3.000 . 3.300 2.551 2.470 2.636 . 0 0 "[ . 1 ]" 1
256 1 12 ARG QB 1 13 ARG H 5.000 . 5.300 2.286 2.194 2.418 . 0 0 "[ . 1 ]" 1
257 1 12 ARG QG 1 13 ARG H 5.000 . 5.300 4.121 4.075 4.242 . 0 0 "[ . 1 ]" 1
258 1 13 ARG H 1 13 ARG QB 3.000 . 3.300 3.009 2.375 3.127 . 0 0 "[ . 1 ]" 1
259 1 13 ARG H 1 13 ARG QD 5.000 . 5.300 3.222 2.416 4.832 . 0 0 "[ . 1 ]" 1
260 1 13 ARG H 1 13 ARG QG 4.000 . 4.300 2.129 1.765 3.995 0.035 4 0 "[ . 1 ]" 1
261 1 13 ARG H 1 14 GLU HA 4.000 . 4.300 4.442 4.403 4.466 0.166 13 0 "[ . 1 ]" 1
262 1 13 ARG HA 1 13 ARG QD 4.000 . 4.300 3.182 2.967 3.766 . 0 0 "[ . 1 ]" 1
263 1 13 ARG HA 1 14 GLU H 3.000 . 3.300 2.666 2.590 2.706 . 0 0 "[ . 1 ]" 1
264 1 13 ARG HA 1 14 GLU QG 5.000 . 5.300 3.316 2.948 4.463 . 0 0 "[ . 1 ]" 1
265 1 13 ARG QB 1 14 GLU H 3.000 . 3.300 2.466 2.311 3.039 . 0 0 "[ . 1 ]" 1
266 1 13 ARG QB 1 14 GLU HA 4.000 . 4.300 3.832 3.799 3.904 . 0 0 "[ . 1 ]" 1
267 1 13 ARG QB 1 32 ILE MD 5.000 . 5.300 1.944 1.704 2.285 0.096 11 0 "[ . 1 ]" 1
268 1 13 ARG HD2 1 32 ILE MD 5.000 . 5.300 3.832 2.334 4.448 . 0 0 "[ . 1 ]" 1
269 1 13 ARG HD3 1 32 ILE MD 5.000 . 5.300 4.227 3.193 4.513 . 0 0 "[ . 1 ]" 1
270 1 13 ARG HE 1 32 ILE MD 5.000 . 5.300 3.685 2.998 4.452 . 0 0 "[ . 1 ]" 1
271 1 13 ARG QG 1 14 GLU H 5.000 . 5.300 3.819 1.886 4.189 . 0 0 "[ . 1 ]" 1
272 1 13 ARG QG 1 32 ILE MD 4.000 . 4.300 1.900 1.761 2.101 0.039 13 0 "[ . 1 ]" 1
273 1 13 ARG QH1 1 32 ILE MG 4.000 . 4.300 3.661 2.348 4.506 0.206 14 0 "[ . 1 ]" 1
274 1 13 ARG QH2 1 32 ILE MD 8.000 . 8.300 4.846 3.933 6.026 . 0 0 "[ . 1 ]" 1
275 1 14 GLU H 1 14 GLU QG 4.000 . 4.300 2.991 2.136 3.798 . 0 0 "[ . 1 ]" 1
276 1 14 GLU H 1 15 LEU H 5.000 . 5.300 3.949 3.865 4.063 . 0 0 "[ . 1 ]" 1
277 1 14 GLU HA 1 15 LEU H 3.000 . 3.300 2.214 2.170 2.250 . 0 0 "[ . 1 ]" 1
278 1 14 GLU HA 1 15 LEU QB 5.000 . 5.300 4.443 4.366 4.496 . 0 0 "[ . 1 ]" 1
279 1 14 GLU HA 1 15 LEU HG 5.000 . 5.300 3.881 3.777 4.157 . 0 0 "[ . 1 ]" 1
280 1 14 GLU QB 1 15 LEU H 5.000 . 5.300 3.568 3.499 3.649 . 0 0 "[ . 1 ]" 1
281 1 14 GLU QG 1 15 LEU H 5.000 . 5.300 4.379 3.946 4.765 . 0 0 "[ . 1 ]" 1
282 1 15 LEU H 1 15 LEU HB3 4.000 . 4.300 3.601 3.565 3.657 . 0 0 "[ . 1 ]" 1
283 1 15 LEU H 1 15 LEU MD1 5.000 . 5.300 3.896 3.828 4.000 . 0 0 "[ . 1 ]" 1
284 1 15 LEU H 1 15 LEU MD2 5.000 . 5.300 2.817 2.673 2.952 . 0 0 "[ . 1 ]" 1
285 1 15 LEU H 1 15 LEU HG 4.000 . 4.300 2.390 2.284 2.557 . 0 0 "[ . 1 ]" 1
286 1 15 LEU H 1 16 ASP H 5.000 . 5.300 4.213 4.144 4.391 . 0 0 "[ . 1 ]" 1
287 1 15 LEU HA 1 15 LEU HG 4.000 . 4.300 3.450 3.395 3.538 . 0 0 "[ . 1 ]" 1
288 1 15 LEU HA 1 16 ASP H 3.000 . 3.300 2.759 2.555 2.838 . 0 0 "[ . 1 ]" 1
289 1 15 LEU HA 1 32 ILE MD 5.000 . 5.300 4.252 3.958 4.433 . 0 0 "[ . 1 ]" 1
290 1 15 LEU QB 1 15 LEU MD1 3.000 . 3.300 1.962 1.866 2.014 . 0 0 "[ . 1 ]" 1
291 1 15 LEU QB 1 15 LEU MD2 3.000 . 3.300 2.454 2.417 2.497 . 0 0 "[ . 1 ]" 1
292 1 15 LEU HB2 1 16 ASP H 4.000 . 4.300 2.635 2.444 3.084 . 0 0 "[ . 1 ]" 1
293 1 15 LEU HB2 1 32 ILE MD 5.000 . 5.300 3.953 3.818 4.041 . 0 0 "[ . 1 ]" 1
294 1 15 LEU HB3 1 16 ASP H 4.000 . 4.300 1.846 1.783 2.060 0.017 6 0 "[ . 1 ]" 1
295 1 15 LEU MD1 1 16 ASP H 5.000 . 5.300 3.573 3.436 3.813 . 0 0 "[ . 1 ]" 1
296 1 15 LEU MD1 1 17 VAL MG2 6.000 . 6.300 2.489 2.161 2.810 . 0 0 "[ . 1 ]" 1
297 1 15 LEU MD1 1 26 ALA MB 5.000 . 5.300 1.772 1.617 1.905 0.183 7 0 "[ . 1 ]" 1
298 1 15 LEU MD1 1 27 ALA HA 4.000 . 4.300 1.659 1.632 1.758 0.168 11 0 "[ . 1 ]" 1
299 1 15 LEU MD1 1 28 VAL H 5.000 . 5.300 4.041 3.957 4.146 . 0 0 "[ . 1 ]" 1
300 1 15 LEU MD1 1 30 ASN H 4.000 . 4.300 3.142 2.942 3.501 . 0 0 "[ . 1 ]" 1
301 1 15 LEU MD1 1 30 ASN HB2 5.000 . 5.300 2.544 2.238 3.712 . 0 0 "[ . 1 ]" 1
302 1 15 LEU MD1 1 30 ASN HB3 4.000 . 4.300 3.657 3.548 3.825 . 0 0 "[ . 1 ]" 1
303 1 15 LEU MD1 1 30 ASN HD21 4.000 . 4.300 2.435 2.175 3.000 . 0 0 "[ . 1 ]" 1
304 1 15 LEU MD1 1 30 ASN HD22 4.000 . 4.300 2.720 1.738 2.997 0.062 6 0 "[ . 1 ]" 1
305 1 15 LEU MD1 1 32 ILE MD 3.000 . 3.300 1.746 1.631 1.816 0.169 6 0 "[ . 1 ]" 1
306 1 15 LEU MD2 1 16 ASP H 5.000 2.800 5.300 3.666 3.459 3.798 . 0 0 "[ . 1 ]" 1
307 1 15 LEU MD2 1 27 ALA HA 5.000 . 5.300 2.887 2.606 3.146 . 0 0 "[ . 1 ]" 1
308 1 15 LEU MD2 1 30 ASN H 4.000 . 4.300 3.673 3.638 3.794 . 0 0 "[ . 1 ]" 1
309 1 15 LEU MD2 1 30 ASN HB2 5.000 . 5.300 1.901 1.785 2.321 0.015 11 0 "[ . 1 ]" 1
310 1 15 LEU MD2 1 30 ASN HB3 4.000 . 4.300 2.325 2.215 2.629 . 0 0 "[ . 1 ]" 1
311 1 15 LEU MD2 1 30 ASN HD21 4.000 . 4.300 3.117 2.767 3.263 . 0 0 "[ . 1 ]" 1
312 1 15 LEU MD2 1 32 ILE MD 3.000 . 3.300 1.694 1.580 1.864 0.220 9 0 "[ . 1 ]" 1
313 1 15 LEU HG 1 16 ASP H 5.000 . 5.300 4.471 4.376 4.709 . 0 0 "[ . 1 ]" 1
314 1 15 LEU HG 1 17 VAL H 5.000 . 5.300 5.538 5.481 5.592 0.292 14 0 "[ . 1 ]" 1
315 1 15 LEU HG 1 26 ALA MB 5.000 . 5.300 3.975 3.788 4.164 . 0 0 "[ . 1 ]" 1
316 1 15 LEU HG 1 32 ILE MD 4.000 . 4.300 2.152 1.983 2.310 . 0 0 "[ . 1 ]" 1
317 1 16 ASP H 1 16 ASP HB2 3.000 . 3.300 3.035 2.805 3.584 0.284 12 0 "[ . 1 ]" 1
318 1 16 ASP H 1 16 ASP HB3 3.000 . 3.300 3.104 2.744 3.380 0.080 12 0 "[ . 1 ]" 1
319 1 16 ASP H 1 17 VAL H 5.000 . 5.300 3.016 2.920 3.163 . 0 0 "[ . 1 ]" 1
320 1 16 ASP HA 1 17 VAL H 3.000 . 3.300 2.505 2.444 2.568 . 0 0 "[ . 1 ]" 1
321 1 16 ASP HB2 1 17 VAL H 5.000 . 5.300 4.619 4.348 4.683 . 0 0 "[ . 1 ]" 1
322 1 16 ASP HB3 1 17 VAL H 5.000 . 5.300 4.381 4.304 4.670 . 0 0 "[ . 1 ]" 1
323 1 17 VAL H 1 17 VAL HB 3.000 . 3.300 2.659 2.451 2.795 . 0 0 "[ . 1 ]" 1
324 1 17 VAL H 1 17 VAL MG2 3.000 . 3.300 1.904 1.698 2.172 0.102 9 0 "[ . 1 ]" 1
325 1 17 VAL H 1 18 ALA H 5.000 . 5.300 4.451 4.350 4.533 . 0 0 "[ . 1 ]" 1
326 1 17 VAL H 1 26 ALA MB 5.000 . 5.300 3.714 3.489 3.892 . 0 0 "[ . 1 ]" 1
327 1 17 VAL H 1 90 MET ME 6.000 . 6.300 5.399 5.210 5.472 . 0 0 "[ . 1 ]" 1
328 1 17 VAL HA 1 17 VAL MG2 3.000 . 3.300 2.556 2.463 2.637 . 0 0 "[ . 1 ]" 1
329 1 17 VAL HA 1 18 ALA H 3.000 . 3.300 2.131 2.105 2.162 . 0 0 "[ . 1 ]" 1
330 1 17 VAL HA 1 18 ALA MB 5.000 . 5.300 3.865 3.782 3.938 . 0 0 "[ . 1 ]" 1
331 1 17 VAL HA 1 21 VAL MG2 3.000 . 3.300 3.001 2.966 3.030 . 0 0 "[ . 1 ]" 1
332 1 17 VAL HA 1 23 LEU MD2 5.000 . 5.500 4.510 4.179 4.635 . 0 0 "[ . 1 ]" 1
333 1 17 VAL HB 1 18 ALA H 4.000 . 4.300 4.115 4.015 4.279 . 0 0 "[ . 1 ]" 1
334 1 17 VAL HB 1 21 VAL MG1 4.000 . 4.300 3.788 3.621 3.914 . 0 0 "[ . 1 ]" 1
335 1 17 VAL HB 1 23 LEU HA 5.000 . 5.500 3.952 3.769 4.168 . 0 0 "[ . 1 ]" 1
336 1 17 VAL HB 1 90 MET HA 4.000 . 4.300 4.415 4.333 4.563 0.263 6 0 "[ . 1 ]" 1
337 1 17 VAL HB 1 90 MET QB 3.000 . 3.300 1.956 1.827 2.153 . 0 0 "[ . 1 ]" 1
338 1 17 VAL HB 1 90 MET QG 4.000 . 4.300 1.896 1.756 2.293 0.044 4 0 "[ . 1 ]" 1
339 1 17 VAL MG1 1 18 ALA H 3.000 . 3.300 2.842 2.767 2.952 . 0 0 "[ . 1 ]" 1
340 1 17 VAL MG1 1 21 VAL H 4.000 . 4.300 3.386 3.005 3.603 . 0 0 "[ . 1 ]" 1
341 1 17 VAL MG1 1 21 VAL HB 4.000 . 4.300 1.626 1.559 1.649 0.241 4 0 "[ . 1 ]" 1
342 1 17 VAL MG1 1 26 ALA H 3.000 . 3.300 2.695 2.422 2.910 . 0 0 "[ . 1 ]" 1
343 1 17 VAL MG1 1 26 ALA MB 4.000 . 4.300 1.998 1.651 2.634 0.149 12 0 "[ . 1 ]" 1
344 1 17 VAL MG1 1 90 MET QB 6.000 . 6.300 2.106 1.700 2.395 0.100 14 0 "[ . 1 ]" 1
345 1 17 VAL MG2 1 18 ALA H 5.000 . 5.300 4.294 4.225 4.350 . 0 0 "[ . 1 ]" 1
346 1 17 VAL MG2 1 23 LEU HA 4.000 . 4.300 2.287 2.084 2.448 . 0 0 "[ . 1 ]" 1
347 1 17 VAL MG2 1 26 ALA HA 5.000 . 5.300 3.869 3.773 4.013 . 0 0 "[ . 1 ]" 1
348 1 17 VAL MG2 1 26 ALA MB 4.000 . 4.300 1.595 1.550 1.696 0.250 11 0 "[ . 1 ]" 1
349 1 17 VAL MG2 1 90 MET QG 5.000 . 5.300 2.841 2.638 3.373 . 0 0 "[ . 1 ]" 1
350 1 18 ALA H 1 18 ALA MB 3.000 . 3.300 2.102 1.969 2.171 . 0 0 "[ . 1 ]" 1
351 1 18 ALA H 1 19 ASP H 5.000 . 5.300 4.484 4.424 4.536 . 0 0 "[ . 1 ]" 1
352 1 18 ALA H 1 21 VAL HB 5.000 . 5.300 2.770 2.156 3.212 . 0 0 "[ . 1 ]" 1
353 1 18 ALA H 1 21 VAL MG1 5.000 . 5.300 3.616 3.126 3.905 . 0 0 "[ . 1 ]" 1
354 1 18 ALA H 1 21 VAL MG2 3.000 . 3.300 2.358 2.225 2.556 . 0 0 "[ . 1 ]" 1
355 1 18 ALA H 1 26 ALA MB 5.000 . 5.300 4.454 4.309 4.506 . 0 0 "[ . 1 ]" 1
356 1 18 ALA H 1 90 MET QG 6.000 . 6.300 4.970 4.676 5.288 . 0 0 "[ . 1 ]" 1
357 1 18 ALA HA 1 19 ASP H 3.000 . 3.300 2.521 2.436 2.620 . 0 0 "[ . 1 ]" 1
358 1 18 ALA MB 1 19 ASP H 3.000 . 3.300 2.043 1.841 2.350 . 0 0 "[ . 1 ]" 1
359 1 18 ALA MB 1 19 ASP HB2 5.000 . 5.300 4.556 4.473 4.615 . 0 0 "[ . 1 ]" 1
360 1 18 ALA MB 1 21 VAL H 4.000 . 4.300 3.726 3.649 3.777 . 0 0 "[ . 1 ]" 1
361 1 18 ALA MB 1 21 VAL MG2 4.000 . 4.300 2.716 2.587 2.837 . 0 0 "[ . 1 ]" 1
362 1 18 ALA O 1 21 VAL H 2.400 . 3.300 1.977 1.922 2.067 0.078 14 0 "[ . 1 ]" 1
363 1 18 ALA O 1 21 VAL N 3.400 3.000 4.300 2.947 2.891 3.029 0.109 14 0 "[ . 1 ]" 1
364 1 19 ASP H 1 19 ASP HB2 3.000 . 3.300 3.380 3.118 3.453 0.153 2 0 "[ . 1 ]" 1
365 1 19 ASP H 1 19 ASP HB3 4.000 . 4.300 2.841 1.869 3.373 . 0 0 "[ . 1 ]" 1
366 1 19 ASP H 1 20 GLY H 4.000 . 4.300 4.409 4.348 4.476 0.176 12 0 "[ . 1 ]" 1
367 1 19 ASP H 1 92 PRO HG3 5.000 . 5.300 4.520 4.060 5.148 . 0 0 "[ . 1 ]" 1
368 1 19 ASP HA 1 20 GLY H 3.000 . 3.300 2.144 2.061 2.203 . 0 0 "[ . 1 ]" 1
369 1 19 ASP HA 1 21 VAL H 4.000 . 4.300 3.763 3.558 3.949 . 0 0 "[ . 1 ]" 1
370 1 19 ASP HA 1 89 ILE MG 3.000 . 3.300 2.887 2.811 2.970 . 0 0 "[ . 1 ]" 1
371 1 19 ASP HA 1 90 MET QB 5.000 . 5.300 4.302 4.095 4.575 . 0 0 "[ . 1 ]" 1
372 1 19 ASP HA 1 91 THR H 5.000 . 5.300 4.402 4.183 4.623 . 0 0 "[ . 1 ]" 1
373 1 19 ASP HA 1 91 THR MG 5.000 . 5.300 3.233 1.866 3.877 . 0 0 "[ . 1 ]" 1
374 1 19 ASP QB 1 20 GLY H 4.000 . 4.300 3.455 3.170 3.855 . 0 0 "[ . 1 ]" 1
375 1 19 ASP QB 1 92 PRO HD3 5.000 . 5.300 1.880 1.793 2.093 0.007 5 0 "[ . 1 ]" 1
376 1 19 ASP HB2 1 91 THR HA 5.000 . 5.300 3.741 2.645 4.066 . 0 0 "[ . 1 ]" 1
377 1 19 ASP HB3 1 91 THR HA 5.000 . 5.300 2.582 2.357 3.428 . 0 0 "[ . 1 ]" 1
378 1 20 GLY H 1 21 VAL H 3.000 . 3.300 2.642 2.429 2.941 . 0 0 "[ . 1 ]" 1
379 1 20 GLY H 1 89 ILE MG . . 3.300 1.726 1.697 1.789 0.103 1 0 "[ . 1 ]" 1
380 1 20 GLY H 1 90 MET H 5.000 . 5.300 3.867 3.719 4.103 . 0 0 "[ . 1 ]" 1
381 1 20 GLY H 1 90 MET QB 5.000 . 5.300 4.611 4.429 4.760 . 0 0 "[ . 1 ]" 1
382 1 20 GLY H 1 91 THR HB 5.000 3.000 5.300 5.478 5.361 5.683 0.383 13 0 "[ . 1 ]" 1
383 1 20 GLY H 1 91 THR MG 6.000 3.000 6.300 4.009 2.725 4.712 0.275 11 0 "[ . 1 ]" 1
384 1 20 GLY HA2 1 21 VAL H 4.000 . 4.300 3.541 3.488 3.578 . 0 0 "[ . 1 ]" 1
385 1 20 GLY HA2 1 89 ILE MG 4.000 . 4.300 2.315 2.015 2.556 . 0 0 "[ . 1 ]" 1
386 1 20 GLY HA3 1 21 VAL H 4.000 . 4.300 3.166 3.122 3.200 . 0 0 "[ . 1 ]" 1
387 1 20 GLY HA3 1 21 VAL HA 4.000 . 4.300 4.392 4.368 4.431 0.131 14 0 "[ . 1 ]" 1
388 1 21 VAL H 1 21 VAL HB 3.000 . 3.300 2.419 2.337 2.477 . 0 0 "[ . 1 ]" 1
389 1 21 VAL H 1 21 VAL MG1 4.000 . 4.300 3.731 3.704 3.748 . 0 0 "[ . 1 ]" 1
390 1 21 VAL H 1 21 VAL MG2 3.000 . 3.300 2.465 2.259 2.756 . 0 0 "[ . 1 ]" 1
391 1 21 VAL H 1 89 ILE MG 5.000 . 5.300 3.110 2.790 3.432 . 0 0 "[ . 1 ]" 1
392 1 21 VAL H 1 90 MET H 3.000 . 3.300 3.583 3.525 3.670 0.370 6 0 "[ . 1 ]" 1
393 1 21 VAL H 1 90 MET QB 5.000 . 5.300 3.924 3.791 4.083 . 0 0 "[ . 1 ]" 1
394 1 21 VAL HA 1 21 VAL MG1 3.000 . 3.300 2.370 2.250 2.557 . 0 0 "[ . 1 ]" 1
395 1 21 VAL HA 1 22 SER H 3.000 . 3.300 2.231 2.188 2.287 . 0 0 "[ . 1 ]" 1
396 1 21 VAL HA 1 25 GLN HB2 5.000 . 5.300 4.510 4.011 5.134 . 0 0 "[ . 1 ]" 1
397 1 21 VAL HA 1 25 GLN QG 5.000 . 5.300 3.995 3.245 4.331 . 0 0 "[ . 1 ]" 1
398 1 21 VAL HB 1 22 SER H 4.000 . 4.300 3.915 3.724 4.160 . 0 0 "[ . 1 ]" 1
399 1 21 VAL HB 1 26 ALA H 4.000 . 4.300 4.631 4.568 4.777 0.477 4 0 "[ . 1 ]" 1
400 1 21 VAL HB 1 26 ALA MB 5.000 . 5.300 3.885 3.786 4.027 . 0 0 "[ . 1 ]" 1
401 1 21 VAL MG1 1 22 SER H 3.000 . 3.300 2.141 2.000 2.308 . 0 0 "[ . 1 ]" 1
402 1 21 VAL MG1 1 25 GLN HB2 5.000 . 5.300 3.282 3.040 3.616 . 0 0 "[ . 1 ]" 1
403 1 21 VAL MG1 1 25 GLN QB 5.000 . 5.300 2.067 1.902 2.314 . 0 0 "[ . 1 ]" 1
404 1 21 VAL MG1 1 25 GLN HB3 5.000 . 5.300 2.090 1.914 2.347 . 0 0 "[ . 1 ]" 1
405 1 21 VAL MG1 1 26 ALA H 4.000 . 4.300 2.168 2.043 2.295 . 0 0 "[ . 1 ]" 1
406 1 21 VAL MG1 1 26 ALA MB 3.000 . 3.300 2.108 1.816 2.306 . 0 0 "[ . 1 ]" 1
407 1 21 VAL MG2 1 22 SER H 4.000 . 4.300 3.817 3.743 3.849 . 0 0 "[ . 1 ]" 1
408 1 21 VAL MG2 1 26 ALA MB 5.000 . 5.300 3.692 3.484 3.765 . 0 0 "[ . 1 ]" 1
409 1 21 VAL O 1 90 MET H 2.400 . 3.300 1.986 1.886 2.053 0.114 13 0 "[ . 1 ]" 1
410 1 21 VAL O 1 90 MET N 3.400 3.000 4.300 2.908 2.799 2.956 0.201 13 0 "[ . 1 ]" 1
411 1 22 SER H 1 22 SER HB3 4.000 . 4.300 3.242 3.119 3.388 . 0 0 "[ . 1 ]" 1
412 1 22 SER H 1 25 GLN QB 5.000 . 5.300 2.144 1.935 2.389 . 0 0 "[ . 1 ]" 1
413 1 22 SER H 1 25 GLN QG 5.000 . 5.300 3.599 3.245 3.952 . 0 0 "[ . 1 ]" 1
414 1 22 SER H 1 26 ALA H 4.000 . 4.300 3.936 3.765 4.032 . 0 0 "[ . 1 ]" 1
415 1 22 SER H 1 89 ILE MD 4.000 . 4.300 3.446 3.194 3.608 . 0 0 "[ . 1 ]" 1
416 1 22 SER HA 1 23 LEU H 4.000 . 4.300 2.285 2.249 2.325 . 0 0 "[ . 1 ]" 1
417 1 22 SER HA 1 23 LEU MD2 5.000 . 5.300 4.486 4.298 4.604 . 0 0 "[ . 1 ]" 1
418 1 22 SER HA 1 26 ALA H 5.000 . 5.300 5.331 5.150 5.399 0.099 5 0 "[ . 1 ]" 1
419 1 22 SER HA 1 88 ILE H 5.000 . 5.300 4.144 3.869 4.464 . 0 0 "[ . 1 ]" 1
420 1 22 SER HA 1 89 ILE H 4.000 . 4.300 4.347 4.264 4.467 0.167 5 0 "[ . 1 ]" 1
421 1 22 SER HA 1 89 ILE HA 3.000 . 3.300 2.199 1.931 2.372 . 0 0 "[ . 1 ]" 1
422 1 22 SER HA 1 89 ILE MD 4.000 . 4.300 2.011 1.768 2.312 0.032 5 0 "[ . 1 ]" 1
423 1 22 SER HA 1 89 ILE MG 5.000 . 5.300 4.139 3.453 4.500 . 0 0 "[ . 1 ]" 1
424 1 22 SER HA 1 90 MET H 4.000 . 4.300 3.416 3.079 3.620 . 0 0 "[ . 1 ]" 1
425 1 22 SER HA 1 90 MET QB 5.000 . 5.300 4.535 4.129 4.784 . 0 0 "[ . 1 ]" 1
426 1 22 SER HA 2 1 FES FE2 10.000 7.800 11.000 10.344 9.965 10.688 . 0 0 "[ . 1 ]" 1
427 1 22 SER QB 1 23 LEU H 4.000 . 4.300 3.282 3.085 3.489 . 0 0 "[ . 1 ]" 1
428 1 22 SER HB2 1 25 GLN QE 5.000 . 5.300 4.468 4.118 4.732 . 0 0 "[ . 1 ]" 1
429 1 22 SER HB2 1 86 CYS HA 5.000 . 5.300 2.847 2.292 3.034 . 0 0 "[ . 1 ]" 1
430 1 22 SER HB2 1 86 CYS HB3 5.000 . 5.300 5.198 4.731 5.383 0.083 4 0 "[ . 1 ]" 1
431 1 22 SER HB2 1 87 GLN H 5.000 . 5.300 4.656 4.123 4.954 . 0 0 "[ . 1 ]" 1
432 1 22 SER HB2 1 88 ILE H 5.000 . 5.300 3.872 3.540 4.348 . 0 0 "[ . 1 ]" 1
433 1 22 SER HB2 1 89 ILE MD 5.000 . 5.300 3.381 3.109 3.660 . 0 0 "[ . 1 ]" 1
434 1 22 SER HB3 1 23 LEU H 5.000 . 5.300 4.017 3.724 4.254 . 0 0 "[ . 1 ]" 1
435 1 22 SER HB3 1 25 GLN QE 5.000 . 5.300 4.398 3.821 4.747 . 0 0 "[ . 1 ]" 1
436 1 22 SER HB3 1 87 GLN H 5.000 . 5.300 4.958 4.486 5.365 0.065 4 0 "[ . 1 ]" 1
437 1 22 SER HB3 1 88 ILE H 5.000 . 5.300 3.868 3.362 4.609 . 0 0 "[ . 1 ]" 1
438 1 22 SER HB3 1 89 ILE MD 5.000 . 5.300 2.111 1.765 2.399 0.035 2 0 "[ . 1 ]" 1
439 1 23 LEU H 1 23 LEU MD1 4.000 . 4.300 3.738 3.664 3.865 . 0 0 "[ . 1 ]" 1
440 1 23 LEU H 1 23 LEU MD2 5.000 . 5.300 2.995 2.745 3.101 . 0 0 "[ . 1 ]" 1
441 1 23 LEU H 1 23 LEU HG 4.000 . 4.300 2.322 2.233 2.473 . 0 0 "[ . 1 ]" 1
442 1 23 LEU H 1 24 MET H 5.000 . 5.300 2.753 2.660 2.936 . 0 0 "[ . 1 ]" 1
443 1 23 LEU H 1 88 ILE H 5.000 . 5.300 4.028 3.782 4.416 . 0 0 "[ . 1 ]" 1
444 1 23 LEU H 1 88 ILE O 2.400 . 3.300 2.049 2.006 2.103 . 0 0 "[ . 1 ]" 1
445 1 23 LEU H 1 89 ILE HA 4.000 . 4.300 3.602 3.382 3.752 . 0 0 "[ . 1 ]" 1
446 1 23 LEU H 1 90 MET H 4.000 . 4.300 3.953 3.764 4.205 . 0 0 "[ . 1 ]" 1
447 1 23 LEU HA 1 23 LEU MD1 4.000 . 4.300 3.604 3.470 3.652 . 0 0 "[ . 1 ]" 1
448 1 23 LEU HA 1 23 LEU MD2 4.000 . 4.300 1.761 1.653 1.834 0.147 10 0 "[ . 1 ]" 1
449 1 23 LEU HA 1 25 GLN H 4.000 . 4.300 3.923 3.491 4.355 0.055 10 0 "[ . 1 ]" 1
450 1 23 LEU HA 1 26 ALA MB 4.000 . 4.300 2.763 2.365 3.081 . 0 0 "[ . 1 ]" 1
451 1 23 LEU QB 1 24 MET HB3 4.000 . 4.300 4.121 3.999 4.197 . 0 0 "[ . 1 ]" 1
452 1 23 LEU QB 1 33 TYR QE 5.000 . 5.300 4.048 3.292 4.365 . 0 0 "[ . 1 ]" 1
453 1 23 LEU HB2 1 85 CYS QB 5.000 . 5.300 3.447 2.250 4.477 . 0 0 "[ . 1 ]" 1
454 1 23 LEU HB2 1 99 VAL MG1 5.000 . 5.300 4.193 3.947 4.415 . 0 0 "[ . 1 ]" 1
455 1 23 LEU HB2 1 99 VAL MG2 5.000 . 5.300 4.417 4.308 4.484 . 0 0 "[ . 1 ]" 1
456 1 23 LEU HB3 1 85 CYS QB 5.000 . 5.300 3.653 2.684 4.603 . 0 0 "[ . 1 ]" 1
457 1 23 LEU HB3 1 99 VAL MG1 5.000 . 5.300 3.843 3.498 4.205 . 0 0 "[ . 1 ]" 1
458 1 23 LEU HG 1 99 VAL MG2 5.000 . 5.300 4.354 4.233 4.435 . 0 0 "[ . 1 ]" 1
459 1 23 LEU N 1 88 ILE O 3.400 3.000 4.300 2.959 2.920 3.023 0.080 9 0 "[ . 1 ]" 1
460 1 23 LEU O 1 27 ALA H 2.400 . 3.300 1.991 1.904 2.093 0.096 7 0 "[ . 1 ]" 1
461 1 23 LEU O 1 27 ALA N 3.400 3.000 4.300 2.852 2.780 2.972 0.220 1 0 "[ . 1 ]" 1
462 1 24 MET H 1 24 MET HB2 4.000 . 4.300 2.970 2.735 3.174 . 0 0 "[ . 1 ]" 1
463 1 24 MET H 1 24 MET HB3 4.000 . 4.300 1.902 1.829 2.069 . 0 0 "[ . 1 ]" 1
464 1 24 MET H 1 25 GLN H 5.000 . 5.300 2.520 2.446 2.659 . 0 0 "[ . 1 ]" 1
465 1 24 MET H 1 86 CYS HA 5.000 . 6.100 3.583 3.147 3.877 . 0 0 "[ . 1 ]" 1
466 1 24 MET HA 1 25 GLN H 5.000 . 5.300 3.440 3.345 3.534 . 0 0 "[ . 1 ]" 1
467 1 24 MET HA 1 25 GLN HB3 5.000 . 5.300 5.452 5.407 5.518 0.218 14 0 "[ . 1 ]" 1
468 1 24 MET HA 1 27 ALA MB 5.000 . 5.300 2.639 2.300 2.941 . 0 0 "[ . 1 ]" 1
469 1 24 MET HA 1 33 TYR QD 5.000 . 5.300 2.630 2.116 3.283 . 0 0 "[ . 1 ]" 1
470 1 24 MET HA 1 33 TYR QE 5.000 . 5.300 1.697 1.556 1.826 0.244 14 0 "[ . 1 ]" 1
471 1 24 MET HB2 1 25 GLN H 5.000 . 5.300 4.200 3.900 4.414 . 0 0 "[ . 1 ]" 1
472 1 24 MET HB2 1 86 CYS HA 5.000 . 5.300 2.693 2.165 3.206 . 0 0 "[ . 1 ]" 1
473 1 24 MET HB2 1 86 CYS HB2 5.000 . 5.300 4.524 3.896 5.091 . 0 0 "[ . 1 ]" 1
474 1 24 MET HB2 1 86 CYS HB3 5.000 . 5.300 3.306 2.794 4.066 . 0 0 "[ . 1 ]" 1
475 1 24 MET HB3 1 25 GLN H 5.000 . 5.300 3.111 2.750 3.457 . 0 0 "[ . 1 ]" 1
476 1 24 MET HB3 1 86 CYS HA 5.000 . 5.300 1.897 1.782 2.197 0.018 11 0 "[ . 1 ]" 1
477 1 24 MET HB3 1 86 CYS HB2 5.000 . 5.300 4.280 3.869 4.648 . 0 0 "[ . 1 ]" 1
478 1 24 MET HB3 1 86 CYS HB3 5.000 . 5.300 3.699 3.098 4.020 . 0 0 "[ . 1 ]" 1
479 1 24 MET ME 1 28 VAL MG1 5.000 . 5.300 3.297 2.526 3.698 . 0 0 "[ . 1 ]" 1
480 1 24 MET ME 1 28 VAL MG2 5.000 . 5.300 2.676 1.988 3.007 . 0 0 "[ . 1 ]" 1
481 1 24 MET ME 1 33 TYR QB 5.000 . 5.300 3.946 3.598 4.031 . 0 0 "[ . 1 ]" 1
482 1 24 MET ME 1 86 CYS HA 5.000 . 5.300 4.181 3.466 4.445 . 0 0 "[ . 1 ]" 1
483 1 24 MET ME 1 86 CYS HB2 5.000 . 5.300 4.368 3.950 4.536 . 0 0 "[ . 1 ]" 1
484 1 24 MET QG 1 33 TYR QE 5.000 . 5.300 3.820 2.676 4.365 . 0 0 "[ . 1 ]" 1
485 1 24 MET QG 1 86 CYS QB 5.000 . 5.300 2.509 1.853 3.755 . 0 0 "[ . 1 ]" 1
486 1 25 GLN H 1 25 GLN HB3 4.000 . 4.300 2.094 2.046 2.172 . 0 0 "[ . 1 ]" 1
487 1 25 GLN H 1 26 ALA H 5.000 . 5.300 2.786 2.490 3.104 . 0 0 "[ . 1 ]" 1
488 1 25 GLN HA 1 26 ALA H 4.000 . 4.300 3.634 3.614 3.663 . 0 0 "[ . 1 ]" 1
489 1 25 GLN HA 1 28 VAL H 4.000 . 4.300 3.786 3.645 3.907 . 0 0 "[ . 1 ]" 1
490 1 25 GLN HA 1 28 VAL HB 5.000 . 5.300 3.191 3.093 3.267 . 0 0 "[ . 1 ]" 1
491 1 25 GLN HA 1 28 VAL MG1 5.000 . 5.300 2.925 2.721 3.131 . 0 0 "[ . 1 ]" 1
492 1 25 GLN HA 1 28 VAL MG2 5.000 . 5.300 4.442 4.379 4.504 . 0 0 "[ . 1 ]" 1
493 1 25 GLN QB 1 26 ALA H 4.000 . 4.300 2.257 2.089 2.329 . 0 0 "[ . 1 ]" 1
494 1 25 GLN HB3 1 26 ALA H 5.000 . 5.300 2.277 2.102 2.352 . 0 0 "[ . 1 ]" 1
495 1 26 ALA H 1 26 ALA MB 3.000 . 3.300 2.134 2.067 2.189 . 0 0 "[ . 1 ]" 1
496 1 26 ALA H 1 27 ALA H 3.000 . 3.300 3.086 2.943 3.185 . 0 0 "[ . 1 ]" 1
497 1 26 ALA HA 1 27 ALA H 4.000 . 4.300 3.628 3.608 3.643 . 0 0 "[ . 1 ]" 1
498 1 26 ALA HA 1 28 VAL H 5.000 . 5.300 4.578 4.306 4.837 . 0 0 "[ . 1 ]" 1
499 1 26 ALA HA 1 29 SER H 4.000 . 4.300 3.450 3.389 3.579 . 0 0 "[ . 1 ]" 1
500 1 26 ALA HA 1 29 SER HB3 4.000 . 4.300 2.111 1.993 2.263 0.007 2 0 "[ . 1 ]" 1
501 1 26 ALA HA 1 30 ASN H 4.000 . 4.300 4.320 4.267 4.367 0.067 13 0 "[ . 1 ]" 1
502 1 26 ALA HA 1 30 ASN QD 4.000 . 4.300 2.781 2.474 2.969 . 0 0 "[ . 1 ]" 1
503 1 26 ALA MB 1 27 ALA H 4.000 . 4.300 2.293 2.185 2.401 . 0 0 "[ . 1 ]" 1
504 1 26 ALA MB 1 30 ASN QD 4.000 . 4.300 2.613 2.235 2.837 . 0 0 "[ . 1 ]" 1
505 1 26 ALA O 1 30 ASN H 2.400 . 3.300 2.050 1.980 2.098 0.020 4 0 "[ . 1 ]" 1
506 1 26 ALA O 1 30 ASN N 3.400 3.000 4.300 2.848 2.775 2.946 0.225 9 0 "[ . 1 ]" 1
507 1 27 ALA H 1 28 VAL H 3.000 . 3.300 2.952 2.892 3.052 . 0 0 "[ . 1 ]" 1
508 1 27 ALA H 1 32 ILE MG 5.000 . 5.300 4.515 4.462 4.575 . 0 0 "[ . 1 ]" 1
509 1 27 ALA HA 1 28 VAL H 5.000 . 5.300 3.562 3.533 3.592 . 0 0 "[ . 1 ]" 1
510 1 27 ALA HA 1 29 SER H 5.000 . 5.300 3.625 3.604 3.656 . 0 0 "[ . 1 ]" 1
511 1 27 ALA HA 1 30 ASN H 5.000 . 5.300 3.379 3.218 3.562 . 0 0 "[ . 1 ]" 1
512 1 27 ALA HA 1 30 ASN HB2 5.000 . 5.300 3.099 2.642 4.120 . 0 0 "[ . 1 ]" 1
513 1 27 ALA HA 1 30 ASN HB3 5.000 . 5.300 4.676 4.283 5.107 . 0 0 "[ . 1 ]" 1
514 1 27 ALA HA 1 30 ASN QD 5.000 . 5.300 3.448 3.295 3.677 . 0 0 "[ . 1 ]" 1
515 1 27 ALA HA 1 31 GLY H 5.000 . 5.300 4.571 4.390 4.710 . 0 0 "[ . 1 ]" 1
516 1 27 ALA HA 1 32 ILE H 4.000 . 4.300 3.339 3.180 3.418 . 0 0 "[ . 1 ]" 1
517 1 27 ALA HA 1 32 ILE HB 4.000 . 4.300 2.064 1.858 2.340 . 0 0 "[ . 1 ]" 1
518 1 27 ALA HA 1 32 ILE MD 3.000 . 3.300 1.896 1.811 2.070 . 0 0 "[ . 1 ]" 1
519 1 27 ALA HA 1 32 ILE MG 5.000 . 5.300 3.002 2.904 3.179 . 0 0 "[ . 1 ]" 1
520 1 27 ALA MB 1 28 VAL H 4.000 . 4.300 2.295 2.155 2.434 . 0 0 "[ . 1 ]" 1
521 1 27 ALA MB 1 32 ILE H 5.000 . 5.300 3.787 3.556 3.926 . 0 0 "[ . 1 ]" 1
522 1 27 ALA MB 1 32 ILE HA 5.000 . 5.300 4.376 4.263 4.469 . 0 0 "[ . 1 ]" 1
523 1 27 ALA MB 1 32 ILE MD 4.000 . 4.300 2.445 1.846 2.729 . 0 0 "[ . 1 ]" 1
524 1 27 ALA MB 1 32 ILE MG 4.000 . 4.300 1.797 1.746 1.924 0.054 9 0 "[ . 1 ]" 1
525 1 27 ALA MB 1 33 TYR QD 5.000 . 5.300 2.672 2.189 3.023 . 0 0 "[ . 1 ]" 1
526 1 27 ALA MB 1 33 TYR QE 5.000 . 5.300 2.754 2.109 3.342 . 0 0 "[ . 1 ]" 1
527 1 28 VAL H 1 28 VAL HB 4.000 . 4.300 1.907 1.872 1.941 . 0 0 "[ . 1 ]" 1
528 1 28 VAL H 1 29 SER H 3.000 . 3.300 2.644 2.552 2.692 . 0 0 "[ . 1 ]" 1
529 1 28 VAL H 1 30 ASN H 5.000 . 5.300 4.273 4.202 4.355 . 0 0 "[ . 1 ]" 1
530 1 28 VAL H 1 30 ASN QD 5.000 . 5.300 4.710 4.614 4.816 . 0 0 "[ . 1 ]" 1
531 1 28 VAL HA 1 31 GLY H 5.000 . 5.300 3.621 3.504 3.772 . 0 0 "[ . 1 ]" 1
532 1 28 VAL HA 1 32 ILE H 5.000 . 5.300 3.609 3.278 3.766 . 0 0 "[ . 1 ]" 1
533 1 28 VAL HA 1 32 ILE HB 5.000 . 5.300 4.061 3.749 4.389 . 0 0 "[ . 1 ]" 1
534 1 28 VAL HA 1 33 TYR HB3 5.000 . 5.300 3.975 3.191 5.068 . 0 0 "[ . 1 ]" 1
535 1 28 VAL HB 1 29 SER H 4.000 . 4.300 3.752 3.690 3.801 . 0 0 "[ . 1 ]" 1
536 1 28 VAL HB 1 33 TYR QE 5.000 . 5.300 4.920 4.845 5.134 . 0 0 "[ . 1 ]" 1
537 1 28 VAL MG1 1 29 SER H 4.000 . 4.300 3.185 3.058 3.300 . 0 0 "[ . 1 ]" 1
538 1 28 VAL MG1 1 29 SER HA 5.000 . 5.300 3.335 3.224 3.381 . 0 0 "[ . 1 ]" 1
539 1 28 VAL MG2 1 29 SER H 5.000 . 5.300 4.428 4.407 4.437 . 0 0 "[ . 1 ]" 1
540 1 28 VAL MG2 1 33 TYR HB2 5.000 . 5.300 1.919 1.749 2.372 0.051 1 0 "[ . 1 ]" 1
541 1 28 VAL MG2 1 33 TYR HB3 5.000 . 5.300 2.443 1.679 3.642 0.121 4 0 "[ . 1 ]" 1
542 1 29 SER H 1 30 ASN H 3.000 . 3.300 2.065 2.015 2.108 . 0 0 "[ . 1 ]" 1
543 1 29 SER H 1 31 GLY H 5.000 . 5.300 3.297 3.169 3.432 . 0 0 "[ . 1 ]" 1
544 1 29 SER HA 1 30 ASN H 4.000 . 4.300 3.509 3.478 3.568 . 0 0 "[ . 1 ]" 1
545 1 29 SER HA 1 31 GLY H 4.000 . 4.300 3.772 3.607 3.964 . 0 0 "[ . 1 ]" 1
546 1 29 SER QB 1 30 ASN QD 3.000 . 3.300 2.664 2.629 2.735 . 0 0 "[ . 1 ]" 1
547 1 29 SER HB3 1 30 ASN H 3.000 . 3.300 3.109 3.012 3.166 . 0 0 "[ . 1 ]" 1
548 1 29 SER HB3 1 31 GLY H 4.000 . 4.300 4.747 4.696 4.795 0.495 4 0 "[ . 1 ]" 1
549 1 30 ASN H 1 30 ASN HB2 3.000 . 3.300 2.372 2.199 3.153 . 0 0 "[ . 1 ]" 1
550 1 30 ASN H 1 30 ASN HB3 3.000 . 3.300 3.486 3.387 3.544 0.244 4 0 "[ . 1 ]" 1
551 1 30 ASN H 1 31 GLY H 3.000 . 3.300 2.213 2.115 2.293 . 0 0 "[ . 1 ]" 1
552 1 30 ASN H 1 32 ILE H 4.000 . 4.300 3.158 3.022 3.354 . 0 0 "[ . 1 ]" 1
553 1 30 ASN H 1 32 ILE MD 5.000 . 5.300 4.349 4.232 4.554 . 0 0 "[ . 1 ]" 1
554 1 30 ASN H 1 32 ILE QG 4.000 . 4.300 3.639 3.060 3.876 . 0 0 "[ . 1 ]" 1
555 1 30 ASN HA 1 30 ASN HD21 3.000 . 3.300 3.417 3.296 3.505 0.205 5 0 "[ . 1 ]" 1
556 1 30 ASN HA 1 30 ASN HD22 5.000 . 5.300 4.134 4.018 4.525 . 0 0 "[ . 1 ]" 1
557 1 30 ASN HA 1 31 GLY H 3.000 . 3.300 3.301 3.257 3.345 0.045 6 0 "[ . 1 ]" 1
558 1 30 ASN HB2 1 31 GLY H 5.000 . 5.300 3.430 3.292 3.712 . 0 0 "[ . 1 ]" 1
559 1 30 ASN HB2 1 32 ILE H 5.000 . 5.300 3.153 2.892 3.657 . 0 0 "[ . 1 ]" 1
560 1 30 ASN HB2 1 32 ILE MD 5.000 . 5.300 3.030 2.787 3.531 . 0 0 "[ . 1 ]" 1
561 1 30 ASN HB2 1 32 ILE HG13 5.000 . 5.300 2.167 1.903 2.429 . 0 0 "[ . 1 ]" 1
562 1 30 ASN HB3 1 31 GLY H 5.000 . 5.300 4.258 4.176 4.498 . 0 0 "[ . 1 ]" 1
563 1 30 ASN HB3 1 32 ILE MD 5.000 . 5.300 3.837 3.493 4.431 . 0 0 "[ . 1 ]" 1
564 1 30 ASN HB3 1 32 ILE HG13 5.000 . 5.300 3.244 2.857 4.002 . 0 0 "[ . 1 ]" 1
565 1 30 ASN QD 1 32 ILE MD 5.000 . 5.300 4.015 3.993 4.092 . 0 0 "[ . 1 ]" 1
566 1 31 GLY H 1 31 GLY HA2 3.000 . 3.300 2.404 2.388 2.429 . 0 0 "[ . 1 ]" 1
567 1 31 GLY H 1 31 GLY HA3 3.000 . 3.300 2.967 2.951 2.983 . 0 0 "[ . 1 ]" 1
568 1 31 GLY H 1 32 ILE H 3.000 . 3.300 2.334 2.262 2.392 . 0 0 "[ . 1 ]" 1
569 1 31 GLY H 1 32 ILE HB 5.000 . 5.300 4.230 4.157 4.336 . 0 0 "[ . 1 ]" 1
570 1 31 GLY HA2 1 32 ILE H 4.000 . 4.300 3.087 2.941 3.208 . 0 0 "[ . 1 ]" 1
571 1 31 GLY HA2 1 33 TYR H 5.000 . 5.300 4.449 4.143 4.687 . 0 0 "[ . 1 ]" 1
572 1 31 GLY HA3 1 32 ILE H 4.000 . 4.300 3.437 3.370 3.527 . 0 0 "[ . 1 ]" 1
573 1 32 ILE H 1 32 ILE HB 3.000 . 3.300 2.194 2.109 2.349 . 0 0 "[ . 1 ]" 1
574 1 32 ILE H 1 32 ILE MD 5.000 . 5.300 3.740 3.664 3.833 . 0 0 "[ . 1 ]" 1
575 1 32 ILE H 1 32 ILE QG 4.000 . 4.300 2.342 2.130 2.536 . 0 0 "[ . 1 ]" 1
576 1 32 ILE H 1 33 TYR H 4.000 . 4.300 2.695 2.596 2.833 . 0 0 "[ . 1 ]" 1
577 1 32 ILE HA 1 32 ILE MD 4.000 . 4.300 3.611 3.482 3.660 . 0 0 "[ . 1 ]" 1
578 1 32 ILE HA 1 32 ILE MG 3.000 . 3.300 2.568 2.469 2.643 . 0 0 "[ . 1 ]" 1
579 1 32 ILE HA 1 33 TYR H 3.000 . 3.300 3.521 3.501 3.540 0.240 11 0 "[ . 1 ]" 1
580 1 32 ILE HA 1 33 TYR QD 5.000 . 5.300 4.646 4.323 4.843 . 0 0 "[ . 1 ]" 1
581 1 32 ILE HA 1 34 ASP H 5.000 . 5.300 3.868 3.735 4.082 . 0 0 "[ . 1 ]" 1
582 1 32 ILE HB 1 33 TYR H 3.000 . 3.300 2.215 1.926 2.429 . 0 0 "[ . 1 ]" 1
583 1 32 ILE MD 1 33 TYR H 5.000 . 5.300 4.343 4.231 4.475 . 0 0 "[ . 1 ]" 1
584 1 32 ILE MG 1 33 TYR H 4.000 . 4.300 2.830 2.708 3.010 . 0 0 "[ . 1 ]" 1
585 1 32 ILE MG 1 33 TYR QD 4.000 . 4.300 2.406 1.898 2.792 . 0 0 "[ . 1 ]" 1
586 1 32 ILE MG 1 34 ASP H 5.000 . 5.300 4.285 4.143 4.431 . 0 0 "[ . 1 ]" 1
587 1 33 TYR H 1 33 TYR QB 3.000 . 3.300 2.181 2.041 2.351 . 0 0 "[ . 1 ]" 1
588 1 33 TYR H 1 34 ASP H 3.000 . 3.300 3.347 2.737 3.529 0.229 13 0 "[ . 1 ]" 1
589 1 33 TYR HA 1 33 TYR QD 3.000 . 3.300 1.704 1.640 1.784 0.160 1 0 "[ . 1 ]" 1
590 1 33 TYR HA 1 33 TYR QE 4.000 . 4.300 4.018 3.958 4.102 . 0 0 "[ . 1 ]" 1
591 1 33 TYR HA 1 34 ASP H 5.000 . 5.300 2.760 2.607 3.226 . 0 0 "[ . 1 ]" 1
592 1 33 TYR HA 1 35 ILE H 5.000 . 5.300 3.240 3.038 3.754 . 0 0 "[ . 1 ]" 1
593 1 33 TYR HB2 1 34 ASP H 5.000 . 5.300 4.250 3.680 4.355 . 0 0 "[ . 1 ]" 1
594 1 33 TYR HB3 1 34 ASP H 4.000 . 4.300 4.388 4.339 4.435 0.135 2 0 "[ . 1 ]" 1
595 1 33 TYR QD 1 34 ASP H 5.000 2.800 5.300 4.073 3.899 4.484 . 0 0 "[ . 1 ]" 1
596 1 33 TYR QE 1 50 VAL MG1 5.000 . 5.300 3.564 3.057 3.959 . 0 0 "[ . 1 ]" 1
597 1 33 TYR QE 1 85 CYS HA 5.000 . 5.300 4.539 3.889 4.859 . 0 0 "[ . 1 ]" 1
598 1 33 TYR QE 1 85 CYS QB 5.000 . 5.300 2.086 1.844 2.425 . 0 0 "[ . 1 ]" 1
599 1 33 TYR QE 1 101 VAL QG 5.000 . 5.300 3.364 3.079 3.511 . 0 0 "[ . 1 ]" 1
600 1 34 ASP H 1 34 ASP HB2 4.000 . 4.300 3.536 3.511 3.574 . 0 0 "[ . 1 ]" 1
601 1 34 ASP H 1 34 ASP HB3 4.000 . 4.300 2.417 2.232 2.583 . 0 0 "[ . 1 ]" 1
602 1 34 ASP H 1 35 ILE H 3.000 . 3.300 2.962 2.751 3.482 0.182 13 0 "[ . 1 ]" 1
603 1 34 ASP HA 1 35 ILE H 4.000 . 4.300 3.310 2.772 3.546 . 0 0 "[ . 1 ]" 1
604 1 34 ASP QB 1 35 ILE H 5.000 . 5.300 3.708 3.398 4.072 . 0 0 "[ . 1 ]" 1
605 1 39 CYS CA 1 45 CYS CA 6.000 5.300 6.700 5.672 5.285 6.344 0.015 10 0 "[ . 1 ]" 1
606 1 39 CYS CA 1 48 CYS CA 8.800 8.100 9.500 9.199 8.018 9.712 0.212 4 0 "[ . 1 ]" 1
607 1 39 CYS CA 1 86 CYS CA 9.600 8.900 10.300 9.128 8.872 9.712 0.028 10 0 "[ . 1 ]" 1
608 1 45 CYS CA 1 48 CYS CA 7.600 6.900 8.300 7.416 7.269 7.802 . 0 0 "[ . 1 ]" 1
609 1 45 CYS CA 1 86 CYS CA 10.100 9.400 10.800 10.151 9.613 10.505 . 0 0 "[ . 1 ]" 1
610 1 45 CYS SG 1 47 THR H 2.400 . 3.300 3.105 2.957 3.465 0.165 5 0 "[ . 1 ]" 1
611 1 45 CYS SG 1 47 THR N 3.400 3.000 4.300 3.915 3.785 4.401 0.101 5 0 "[ . 1 ]" 1
612 1 48 CYS CA 1 86 CYS CA 6.300 5.600 7.000 6.958 6.027 7.140 0.140 1 0 "[ . 1 ]" 1
613 1 49 HIS HA 1 49 HIS HD2 5.000 . 5.300 4.868 4.774 4.900 . 0 0 "[ . 1 ]" 1
614 1 49 HIS HA 1 49 HIS HE1 5.000 . 5.300 4.722 4.391 4.859 . 0 0 "[ . 1 ]" 1
615 1 49 HIS HA 1 50 VAL H 5.000 . 5.300 2.210 2.137 2.245 . 0 0 "[ . 1 ]" 1
616 1 49 HIS HA 1 50 VAL MG2 5.000 . 5.300 4.592 4.494 4.638 . 0 0 "[ . 1 ]" 1
617 1 49 HIS HA 1 71 LEU MD2 5.000 . 5.300 3.421 3.188 3.664 . 0 0 "[ . 1 ]" 1
618 1 49 HIS HA 1 84 LEU MD2 5.000 . 5.300 2.130 1.709 3.537 0.091 2 0 "[ . 1 ]" 1
619 1 49 HIS QB 1 50 VAL H 5.000 . 5.300 3.883 3.780 3.994 . 0 0 "[ . 1 ]" 1
620 1 49 HIS HB2 1 74 VAL MG1 5.000 . 5.300 1.817 1.733 2.207 0.067 3 0 "[ . 1 ]" 1
621 1 49 HIS HB2 1 74 VAL MG2 5.000 . 5.300 3.887 3.308 4.351 . 0 0 "[ . 1 ]" 1
622 1 49 HIS HB2 1 105 GLN HA 3.000 . 3.300 3.329 3.157 3.439 0.139 2 0 "[ . 1 ]" 1
623 1 49 HIS HB3 1 74 VAL MG2 5.000 . 5.300 4.776 4.102 5.184 . 0 0 "[ . 1 ]" 1
624 1 49 HIS HD1 1 51 TYR QD 5.000 . 5.300 4.922 4.840 4.984 . 0 0 "[ . 1 ]" 1
625 1 49 HIS HD1 1 51 TYR QE 5.000 . 5.300 4.033 3.874 4.138 . 0 0 "[ . 1 ]" 1
626 1 49 HIS HD1 1 74 VAL HA 5.000 . 5.300 5.469 5.384 5.600 0.300 9 0 "[ . 1 ]" 1
627 1 49 HIS HD1 1 74 VAL HB 4.000 . 4.300 3.483 3.388 3.641 . 0 0 "[ . 1 ]" 1
628 1 49 HIS HD1 1 74 VAL MG1 5.000 . 5.300 2.084 1.947 2.279 . 0 0 "[ . 1 ]" 1
629 1 49 HIS HD1 1 74 VAL MG2 4.000 . 4.300 2.857 2.137 3.451 . 0 0 "[ . 1 ]" 1
630 1 49 HIS HD1 1 76 ALA H 5.000 . 5.300 5.422 5.233 5.563 0.263 13 0 "[ . 1 ]" 1
631 1 49 HIS HD1 1 76 ALA MB 5.000 . 5.300 4.524 4.366 4.637 . 0 0 "[ . 1 ]" 1
632 1 49 HIS HD2 1 76 ALA MB 5.000 . 5.300 2.066 1.747 2.622 0.053 5 0 "[ . 1 ]" 1
633 1 49 HIS HD2 1 102 PRO QD 5.000 . 5.300 3.990 3.713 4.536 . 0 0 "[ . 1 ]" 1
634 1 49 HIS HE1 1 51 TYR QD 4.000 . 4.300 4.000 3.938 4.050 . 0 0 "[ . 1 ]" 1
635 1 49 HIS HE1 1 51 TYR QE 3.000 . 3.300 2.526 2.283 2.694 . 0 0 "[ . 1 ]" 1
636 1 49 HIS HE1 1 71 LEU MD1 5.000 . 5.300 4.538 4.496 4.573 . 0 0 "[ . 1 ]" 1
637 1 49 HIS HE1 1 74 VAL MG1 4.000 . 4.300 3.676 3.451 4.025 . 0 0 "[ . 1 ]" 1
638 1 49 HIS HE1 1 74 VAL MG2 5.000 . 5.300 2.631 2.358 2.835 . 0 0 "[ . 1 ]" 1
639 1 49 HIS HE1 1 76 ALA H 5.000 . 5.300 4.307 3.946 4.544 . 0 0 "[ . 1 ]" 1
640 1 49 HIS HE1 1 76 ALA MB 4.000 . 4.300 3.378 3.033 3.590 . 0 0 "[ . 1 ]" 1
641 1 49 HIS HE1 1 77 GLU H 5.000 . 5.300 4.942 3.640 5.294 . 0 0 "[ . 1 ]" 1
642 1 49 HIS HE1 1 77 GLU HB3 5.000 . 5.300 5.647 5.481 5.714 0.414 5 0 "[ . 1 ]" 1
643 1 49 HIS HE1 1 77 GLU QG 5.000 . 5.300 4.765 4.718 4.808 . 0 0 "[ . 1 ]" 1
644 1 49 HIS HE1 1 78 LEU HA 4.000 . 4.300 3.120 2.933 3.329 . 0 0 "[ . 1 ]" 1
645 1 49 HIS HE1 1 78 LEU MD1 5.000 . 5.300 2.511 2.293 3.352 . 0 0 "[ . 1 ]" 1
646 1 49 HIS HE1 1 78 LEU HG 4.000 . 4.300 3.845 3.666 4.422 0.122 9 0 "[ . 1 ]" 1
647 1 49 HIS HE1 1 82 SER HB3 4.000 . 4.300 4.332 3.901 4.409 0.109 2 0 "[ . 1 ]" 1
648 1 49 HIS HE1 1 82 SER HG 3.000 . 3.300 2.838 2.444 3.056 . 0 0 "[ . 1 ]" 1
649 1 49 HIS HE1 1 102 PRO HB3 5.000 . 5.300 4.277 3.901 4.743 . 0 0 "[ . 1 ]" 1
650 1 50 VAL H 1 50 VAL MG1 4.000 . 4.300 2.426 2.394 2.522 . 0 0 "[ . 1 ]" 1
651 1 50 VAL H 1 50 VAL MG2 4.000 . 4.300 2.850 2.571 3.012 . 0 0 "[ . 1 ]" 1
652 1 50 VAL H 1 51 TYR HA 5.000 . 5.300 4.645 4.551 4.685 . 0 0 "[ . 1 ]" 1
653 1 50 VAL H 1 71 LEU MD2 5.000 . 5.300 3.373 3.122 3.859 . 0 0 "[ . 1 ]" 1
654 1 50 VAL H 1 83 ARG H 3.000 . 3.300 3.462 3.329 3.540 0.240 11 0 "[ . 1 ]" 1
655 1 50 VAL H 1 83 ARG O 2.400 . 3.300 2.365 2.053 3.267 . 0 0 "[ . 1 ]" 1
656 1 50 VAL H 1 102 PRO QD 5.000 . 5.300 4.152 3.980 4.319 . 0 0 "[ . 1 ]" 1
657 1 50 VAL HA 1 51 TYR H 3.000 . 3.300 2.629 2.544 2.684 . 0 0 "[ . 1 ]" 1
658 1 50 VAL HA 1 51 TYR QD 4.000 . 4.300 2.718 2.479 2.912 . 0 0 "[ . 1 ]" 1
659 1 50 VAL HA 1 101 VAL HA 3.000 . 3.300 2.594 2.388 2.754 . 0 0 "[ . 1 ]" 1
660 1 50 VAL HA 1 102 PRO HD3 3.000 . 3.300 1.759 1.733 1.783 0.067 12 0 "[ . 1 ]" 1
661 1 50 VAL HB 1 51 TYR H 3.000 . 3.300 2.577 2.407 2.740 . 0 0 "[ . 1 ]" 1
662 1 50 VAL HB 1 100 ASP H 4.000 . 4.300 4.125 3.708 4.336 0.036 4 0 "[ . 1 ]" 1
663 1 50 VAL MG1 1 51 TYR H 5.000 . 5.300 3.899 3.846 3.981 . 0 0 "[ . 1 ]" 1
664 1 50 VAL MG1 1 85 CYS QB 5.000 . 5.300 2.370 1.740 3.247 0.060 4 0 "[ . 1 ]" 1
665 1 50 VAL MG1 1 102 PRO HD3 5.000 . 5.300 3.971 3.748 4.191 . 0 0 "[ . 1 ]" 1
666 1 50 VAL MG2 1 51 TYR H 4.000 . 4.300 1.925 1.869 2.136 . 0 0 "[ . 1 ]" 1
667 1 50 VAL MG2 1 51 TYR HA 5.000 . 5.300 3.081 3.048 3.151 . 0 0 "[ . 1 ]" 1
668 1 50 VAL MG2 1 51 TYR QD 5.000 . 5.300 4.110 3.960 4.254 . 0 0 "[ . 1 ]" 1
669 1 50 VAL MG2 1 82 SER HA 5.000 . 5.300 4.685 4.644 4.776 . 0 0 "[ . 1 ]" 1
670 1 50 VAL MG2 1 84 LEU H 5.000 . 5.300 4.465 4.338 4.570 . 0 0 "[ . 1 ]" 1
671 1 50 VAL MG2 1 84 LEU HA 5.000 . 5.300 3.551 3.063 4.342 . 0 0 "[ . 1 ]" 1
672 1 50 VAL MG2 1 85 CYS HA 5.000 . 5.300 3.465 3.096 3.831 . 0 0 "[ . 1 ]" 1
673 1 50 VAL MG2 1 85 CYS HB2 5.000 . 5.300 3.793 2.861 4.550 . 0 0 "[ . 1 ]" 1
674 1 50 VAL MG2 1 85 CYS HB3 5.000 . 5.300 3.941 2.967 4.598 . 0 0 "[ . 1 ]" 1
675 1 50 VAL MG2 1 100 ASP H 3.000 . 3.300 2.908 2.865 2.959 . 0 0 "[ . 1 ]" 1
676 1 50 VAL N 1 83 ARG O 3.400 3.000 4.300 3.121 2.975 3.863 0.025 1 0 "[ . 1 ]" 1
677 1 51 TYR H 1 51 TYR HB2 3.000 . 3.300 2.407 2.320 2.444 . 0 0 "[ . 1 ]" 1
678 1 51 TYR H 1 51 TYR HB3 4.000 . 4.300 3.628 3.591 3.649 . 0 0 "[ . 1 ]" 1
679 1 51 TYR H 1 51 TYR QD 3.000 . 3.300 2.942 2.826 3.023 . 0 0 "[ . 1 ]" 1
680 1 51 TYR H 1 52 VAL H 5.000 . 5.300 3.977 3.849 4.055 . 0 0 "[ . 1 ]" 1
681 1 51 TYR H 1 100 ASP H 3.000 . 3.300 2.518 2.338 2.586 . 0 0 "[ . 1 ]" 1
682 1 51 TYR H 1 101 VAL HA 3.000 . 3.300 3.459 3.425 3.503 0.203 4 0 "[ . 1 ]" 1
683 1 51 TYR H 1 102 PRO QD 5.000 . 5.300 3.475 3.224 3.659 . 0 0 "[ . 1 ]" 1
684 1 51 TYR HA 1 51 TYR QD 3.000 . 3.300 2.700 2.542 2.898 . 0 0 "[ . 1 ]" 1
685 1 51 TYR HA 1 52 VAL H 3.000 . 3.300 2.246 2.213 2.263 . 0 0 "[ . 1 ]" 1
686 1 51 TYR HA 1 52 VAL MG2 4.000 . 4.300 3.416 3.348 3.481 . 0 0 "[ . 1 ]" 1
687 1 51 TYR HA 1 81 ASN QD 5.000 . 5.300 4.248 4.096 4.390 . 0 0 "[ . 1 ]" 1
688 1 51 TYR HA 1 82 SER H 5.000 . 5.300 5.052 4.934 5.170 . 0 0 "[ . 1 ]" 1
689 1 51 TYR HA 1 82 SER HA 3.000 . 3.300 2.536 2.353 2.643 . 0 0 "[ . 1 ]" 1
690 1 51 TYR HA 1 83 ARG H 5.000 . 5.300 2.766 2.494 3.247 . 0 0 "[ . 1 ]" 1
691 1 51 TYR HA 1 100 ASP HB2 4.000 . 4.300 4.296 4.173 4.362 0.062 9 0 "[ . 1 ]" 1
692 1 51 TYR QB 1 81 ASN QD 4.000 . 4.300 3.350 3.147 3.460 . 0 0 "[ . 1 ]" 1
693 1 51 TYR QB 1 82 SER HA 5.000 . 5.300 3.866 3.533 3.982 . 0 0 "[ . 1 ]" 1
694 1 51 TYR QB 1 102 PRO QD 5.000 . 5.300 4.000 3.661 4.281 . 0 0 "[ . 1 ]" 1
695 1 51 TYR HB2 1 52 VAL H 4.000 . 4.300 4.440 4.419 4.464 0.164 2 0 "[ . 1 ]" 1
696 1 51 TYR HB2 1 100 ASP HA 5.000 . 5.300 4.014 3.950 4.051 . 0 0 "[ . 1 ]" 1
697 1 51 TYR HB3 1 52 VAL H 4.000 . 4.300 3.832 3.742 3.929 . 0 0 "[ . 1 ]" 1
698 1 51 TYR HB3 1 100 ASP H 4.000 . 4.300 3.996 3.889 4.082 . 0 0 "[ . 1 ]" 1
699 1 51 TYR QD 1 79 LYS H 4.000 . 4.300 3.444 3.218 3.503 . 0 0 "[ . 1 ]" 1
700 1 51 TYR QD 1 79 LYS HB2 3.000 . 3.300 1.875 1.787 1.955 0.013 5 0 "[ . 1 ]" 1
701 1 51 TYR QD 1 79 LYS HB3 3.000 . 3.300 2.978 2.959 2.994 . 0 0 "[ . 1 ]" 1
702 1 51 TYR QD 1 79 LYS QD 4.000 . 4.300 3.425 2.925 3.646 . 0 0 "[ . 1 ]" 1
703 1 51 TYR QD 1 79 LYS HG2 3.000 . 3.300 2.862 2.550 3.224 . 0 0 "[ . 1 ]" 1
704 1 51 TYR QD 1 79 LYS HG3 4.000 . 4.300 2.764 1.759 4.004 0.041 12 0 "[ . 1 ]" 1
705 1 51 TYR QD 1 82 SER H 4.000 . 4.300 3.839 3.732 3.890 . 0 0 "[ . 1 ]" 1
706 1 51 TYR QD 1 82 SER HA 3.000 . 3.300 2.279 2.072 2.364 . 0 0 "[ . 1 ]" 1
707 1 51 TYR QD 1 82 SER HG 4.000 . 4.300 3.266 3.101 3.434 . 0 0 "[ . 1 ]" 1
708 1 51 TYR QD 1 83 ARG H 4.000 . 4.300 4.019 3.882 4.193 . 0 0 "[ . 1 ]" 1
709 1 51 TYR QD 1 102 PRO HB3 3.000 . 3.300 3.069 2.986 3.150 . 0 0 "[ . 1 ]" 1
710 1 51 TYR QD 1 102 PRO QD 5.000 . 5.300 2.251 1.822 2.572 . 0 0 "[ . 1 ]" 1
711 1 51 TYR QE 1 71 LEU MD2 4.000 . 4.300 3.477 3.431 3.542 . 0 0 "[ . 1 ]" 1
712 1 51 TYR QE 1 76 ALA MB 5.000 . 5.300 2.517 2.378 2.729 . 0 0 "[ . 1 ]" 1
713 1 51 TYR QE 1 78 LEU HA 4.000 . 4.300 1.686 1.603 2.009 0.197 5 0 "[ . 1 ]" 1
714 1 51 TYR QE 1 78 LEU MD1 4.000 . 4.300 3.303 2.943 3.380 . 0 0 "[ . 1 ]" 1
715 1 51 TYR QE 1 79 LYS H 5.000 . 5.300 1.804 1.735 1.844 0.065 9 0 "[ . 1 ]" 1
716 1 51 TYR QE 1 79 LYS QD 5.000 . 5.300 3.600 2.358 4.336 . 0 0 "[ . 1 ]" 1
717 1 51 TYR QE 1 79 LYS QE 5.000 . 5.300 4.230 4.118 4.278 . 0 0 "[ . 1 ]" 1
718 1 51 TYR QE 1 82 SER HA 3.000 . 3.300 3.190 3.097 3.246 . 0 0 "[ . 1 ]" 1
719 1 51 TYR QE 1 82 SER HB2 4.000 . 4.300 3.698 3.168 3.908 . 0 0 "[ . 1 ]" 1
720 1 51 TYR QE 1 82 SER HB3 4.000 . 4.300 3.773 3.638 3.903 . 0 0 "[ . 1 ]" 1
721 1 51 TYR QE 1 82 SER HG 4.000 . 4.300 1.971 1.788 2.449 0.012 8 0 "[ . 1 ]" 1
722 1 51 TYR QE 1 102 PRO HA 4.000 . 4.300 3.909 3.763 4.033 . 0 0 "[ . 1 ]" 1
723 1 51 TYR QE 1 102 PRO HB3 4.000 . 4.300 1.758 1.680 1.902 0.120 5 0 "[ . 1 ]" 1
724 1 51 TYR HH 1 78 LEU HA 4.000 . 4.300 2.461 1.752 2.977 0.048 5 0 "[ . 1 ]" 1
725 1 51 TYR HH 1 78 LEU MD1 5.000 . 5.300 3.092 2.027 4.248 . 0 0 "[ . 1 ]" 1
726 1 52 VAL H 1 52 VAL HB 3.000 . 3.300 2.586 2.532 2.686 . 0 0 "[ . 1 ]" 1
727 1 52 VAL H 1 52 VAL MG1 4.000 . 4.300 3.679 3.659 3.698 . 0 0 "[ . 1 ]" 1
728 1 52 VAL H 1 52 VAL MG2 3.000 . 3.300 1.768 1.703 1.841 0.097 2 0 "[ . 1 ]" 1
729 1 52 VAL H 1 53 ASN H 5.000 . 5.300 4.598 4.574 4.624 . 0 0 "[ . 1 ]" 1
730 1 52 VAL H 1 57 THR MG 5.000 . 5.300 3.262 3.156 3.331 . 0 0 "[ . 1 ]" 1
731 1 52 VAL H 1 81 ASN HD21 5.000 . 5.300 4.569 3.722 5.418 0.118 10 0 "[ . 1 ]" 1
732 1 52 VAL H 1 81 ASN HD22 5.000 . 5.300 4.448 4.101 4.890 . 0 0 "[ . 1 ]" 1
733 1 52 VAL H 1 82 SER HA 5.000 . 5.300 3.812 3.699 3.966 . 0 0 "[ . 1 ]" 1
734 1 52 VAL H 1 83 ARG H 5.000 . 5.300 3.715 3.405 4.434 . 0 0 "[ . 1 ]" 1
735 1 52 VAL H 1 99 VAL HA 4.000 . 4.300 4.532 4.412 4.579 0.279 4 0 "[ . 1 ]" 1
736 1 52 VAL H 1 99 VAL MG1 4.000 . 4.300 3.600 3.438 3.643 . 0 0 "[ . 1 ]" 1
737 1 52 VAL HA 1 52 VAL MG1 3.000 . 3.300 2.322 2.292 2.357 . 0 0 "[ . 1 ]" 1
738 1 52 VAL HA 1 52 VAL MG2 3.000 . 3.300 2.582 2.512 2.641 . 0 0 "[ . 1 ]" 1
739 1 52 VAL HA 1 53 ASN H 3.000 . 3.300 2.267 2.239 2.314 . 0 0 "[ . 1 ]" 1
740 1 52 VAL HA 1 99 VAL HA 3.000 . 3.300 1.947 1.865 2.007 . 0 0 "[ . 1 ]" 1
741 1 52 VAL HA 1 99 VAL HB 5.000 . 5.300 4.528 4.474 4.606 . 0 0 "[ . 1 ]" 1
742 1 52 VAL HA 1 99 VAL MG1 5.000 . 5.300 1.983 1.954 2.023 0.046 11 0 "[ . 1 ]" 1
743 1 52 VAL HA 1 100 ASP H 5.000 . 5.300 3.031 2.937 3.120 . 0 0 "[ . 1 ]" 1
744 1 52 VAL HA 1 100 ASP QB 4.000 . 4.300 4.102 4.062 4.120 . 0 0 "[ . 1 ]" 1
745 1 52 VAL HB 1 53 ASN H 5.000 . 5.300 4.063 3.967 4.169 . 0 0 "[ . 1 ]" 1
746 1 52 VAL HB 1 57 THR H 4.000 . 4.300 4.234 4.077 4.325 0.025 11 0 "[ . 1 ]" 1
747 1 52 VAL HB 1 57 THR HA 4.000 . 4.300 3.336 3.179 3.479 . 0 0 "[ . 1 ]" 1
748 1 52 VAL HB 1 57 THR MG 4.000 . 4.300 1.678 1.656 1.692 0.144 4 0 "[ . 1 ]" 1
749 1 52 VAL HB 1 81 ASN HD22 5.000 . 5.300 4.978 4.666 5.360 0.060 11 0 "[ . 1 ]" 1
750 1 52 VAL HB 1 97 ILE MD 5.000 . 5.300 4.125 3.996 4.387 . 0 0 "[ . 1 ]" 1
751 1 52 VAL MG1 1 53 ASN H 3.000 . 3.300 2.609 2.476 2.722 . 0 0 "[ . 1 ]" 1
752 1 52 VAL MG1 1 56 PHE H 4.000 . 4.300 3.446 3.354 3.566 . 0 0 "[ . 1 ]" 1
753 1 52 VAL MG1 1 56 PHE HB2 3.000 . 3.300 2.014 1.933 2.095 . 0 0 "[ . 1 ]" 1
754 1 52 VAL MG1 1 56 PHE HB3 3.000 . 3.300 2.714 2.598 2.802 . 0 0 "[ . 1 ]" 1
755 1 52 VAL MG1 1 57 THR H 4.000 . 4.300 3.462 3.390 3.580 . 0 0 "[ . 1 ]" 1
756 1 52 VAL MG1 1 57 THR HA 3.000 . 3.300 2.828 2.785 2.868 . 0 0 "[ . 1 ]" 1
757 1 52 VAL MG1 1 57 THR HB 5.000 . 5.300 4.172 4.032 4.292 . 0 0 "[ . 1 ]" 1
758 1 52 VAL MG1 1 57 THR MG 4.000 . 4.300 2.203 2.054 2.356 . 0 0 "[ . 1 ]" 1
759 1 52 VAL MG1 1 88 ILE MD 5.000 . 5.300 2.538 1.796 3.091 0.004 9 0 "[ . 1 ]" 1
760 1 52 VAL MG1 1 97 ILE MD 3.000 . 3.300 1.741 1.684 1.947 0.116 14 0 "[ . 1 ]" 1
761 1 52 VAL MG1 1 99 VAL MG1 4.000 . 4.300 2.850 2.670 2.984 . 0 0 "[ . 1 ]" 1
762 1 52 VAL MG2 1 53 ASN H 5.000 . 5.300 4.330 4.284 4.383 . 0 0 "[ . 1 ]" 1
763 1 52 VAL MG2 1 57 THR HA 4.000 . 4.300 3.682 3.607 3.744 . 0 0 "[ . 1 ]" 1
764 1 52 VAL MG2 1 57 THR MG 4.000 . 4.300 3.022 3.002 3.053 . 0 0 "[ . 1 ]" 1
765 1 52 VAL MG2 1 82 SER HA 5.000 . 5.300 4.555 4.489 4.648 . 0 0 "[ . 1 ]" 1
766 1 52 VAL MG2 1 83 ARG H 5.000 . 5.300 3.775 3.536 4.431 . 0 0 "[ . 1 ]" 1
767 1 52 VAL MG2 1 83 ARG HE 5.000 . 5.300 4.201 3.744 4.543 . 0 0 "[ . 1 ]" 1
768 1 52 VAL MG2 1 88 ILE HB 4.000 . 4.300 3.700 3.653 3.736 . 0 0 "[ . 1 ]" 1
769 1 53 ASN H 1 53 ASN HB2 3.000 . 3.300 3.116 2.668 3.550 0.250 10 0 "[ . 1 ]" 1
770 1 53 ASN H 1 53 ASN HB3 3.000 . 3.300 2.499 2.194 2.845 . 0 0 "[ . 1 ]" 1
771 1 53 ASN H 1 56 PHE HB2 5.000 . 5.300 3.877 3.686 4.145 . 0 0 "[ . 1 ]" 1
772 1 53 ASN H 1 57 THR MG 5.000 . 5.300 3.889 3.786 4.000 . 0 0 "[ . 1 ]" 1
773 1 53 ASN H 1 97 ILE MD 5.000 . 5.300 3.047 2.641 4.521 . 0 0 "[ . 1 ]" 1
774 1 53 ASN H 1 98 VAL H 5.000 . 5.300 3.642 3.498 3.726 . 0 0 "[ . 1 ]" 1
775 1 53 ASN H 1 98 VAL HB 3.000 . 3.300 3.415 3.388 3.437 0.137 3 0 "[ . 1 ]" 1
776 1 53 ASN H 1 98 VAL MG1 5.000 . 5.300 4.396 4.324 4.425 . 0 0 "[ . 1 ]" 1
777 1 53 ASN H 1 99 VAL HA 4.000 . 4.300 2.593 2.497 2.713 . 0 0 "[ . 1 ]" 1
778 1 53 ASN H 1 99 VAL MG1 4.000 . 4.300 3.715 3.660 3.776 . 0 0 "[ . 1 ]" 1
779 1 53 ASN HA 1 54 GLU H 3.000 . 3.300 2.338 2.293 2.413 . 0 0 "[ . 1 ]" 1
780 1 53 ASN HA 1 81 ASN QD 4.000 . 4.300 3.344 2.803 3.744 . 0 0 "[ . 1 ]" 1
781 1 53 ASN HA 1 98 VAL H 5.000 . 5.300 5.443 5.358 5.548 0.248 4 0 "[ . 1 ]" 1
782 1 53 ASN QB 1 56 PHE QD 3.000 . 3.300 2.733 2.507 3.016 . 0 0 "[ . 1 ]" 1
783 1 53 ASN QB 1 98 VAL HB 4.000 . 4.300 1.844 1.687 2.038 0.113 2 0 "[ . 1 ]" 1
784 1 53 ASN QB 1 98 VAL MG1 4.000 . 4.300 3.102 2.978 3.226 . 0 0 "[ . 1 ]" 1
785 1 53 ASN HB2 1 54 GLU H 5.000 . 5.300 3.371 2.724 3.955 . 0 0 "[ . 1 ]" 1
786 1 53 ASN HB2 1 98 VAL H 4.000 . 4.300 3.938 3.647 4.260 . 0 0 "[ . 1 ]" 1
787 1 53 ASN HB3 1 54 GLU H 5.000 . 5.300 3.991 3.688 4.233 . 0 0 "[ . 1 ]" 1
788 1 53 ASN HB3 1 98 VAL H 4.000 . 4.300 3.128 2.412 3.878 . 0 0 "[ . 1 ]" 1
789 1 53 ASN QD 1 54 GLU H 5.000 . 5.300 4.178 4.056 4.305 . 0 0 "[ . 1 ]" 1
790 1 53 ASN QD 1 97 ILE HA 5.000 . 5.300 3.614 3.106 4.130 . 0 0 "[ . 1 ]" 1
791 1 53 ASN QD 1 97 ILE MD 5.000 . 5.300 2.832 1.598 3.817 0.202 11 0 "[ . 1 ]" 1
792 1 53 ASN QD 1 98 VAL HA 5.000 . 5.300 4.736 4.565 4.791 . 0 0 "[ . 1 ]" 1
793 1 53 ASN HD21 1 98 VAL HB 5.000 . 5.300 3.452 2.544 4.368 . 0 0 "[ . 1 ]" 1
794 1 53 ASN HD22 1 98 VAL HB 5.000 . 5.300 4.003 3.908 4.059 . 0 0 "[ . 1 ]" 1
795 1 53 ASN O 1 56 PHE H 2.400 . 3.300 2.121 2.011 2.311 . 0 0 "[ . 1 ]" 1
796 1 53 ASN O 1 56 PHE N 3.400 3.000 4.300 3.051 2.928 3.259 0.072 13 0 "[ . 1 ]" 1
797 1 54 GLU H 1 54 GLU QG 4.000 . 4.300 1.860 1.785 2.009 0.015 5 0 "[ . 1 ]" 1
798 1 54 GLU H 1 55 ALA H 3.000 . 3.300 2.807 2.663 2.902 . 0 0 "[ . 1 ]" 1
799 1 54 GLU H 1 57 THR H 5.000 . 5.300 5.350 5.312 5.383 0.083 6 0 "[ . 1 ]" 1
800 1 54 GLU H 1 57 THR MG 5.000 . 5.300 3.715 3.577 3.887 . 0 0 "[ . 1 ]" 1
801 1 54 GLU H 1 81 ASN QD 5.000 . 5.300 3.489 2.850 3.984 . 0 0 "[ . 1 ]" 1
802 1 54 GLU HA 1 55 ALA H 4.000 . 4.300 3.388 3.295 3.429 . 0 0 "[ . 1 ]" 1
803 1 54 GLU HA 1 56 PHE H 4.000 . 4.300 3.589 3.547 3.664 . 0 0 "[ . 1 ]" 1
804 1 54 GLU HA 1 57 THR MG 3.000 . 3.300 2.019 1.850 2.167 . 0 0 "[ . 1 ]" 1
805 1 54 GLU HA 1 81 ASN HB3 5.000 . 5.300 3.318 2.707 3.637 . 0 0 "[ . 1 ]" 1
806 1 54 GLU QB 1 55 ALA H 4.000 . 4.300 3.773 3.732 3.840 . 0 0 "[ . 1 ]" 1
807 1 54 GLU HB3 1 81 ASN QD 5.000 . 5.300 3.575 3.386 3.759 . 0 0 "[ . 1 ]" 1
808 1 54 GLU QG 1 55 ALA H 4.000 . 4.300 2.660 2.422 3.763 . 0 0 "[ . 1 ]" 1
809 1 54 GLU QG 1 81 ASN QD 5.000 . 5.300 4.249 4.198 4.329 . 0 0 "[ . 1 ]" 1
810 1 55 ALA H 1 56 PHE H 4.000 . 4.300 2.489 2.412 2.641 . 0 0 "[ . 1 ]" 1
811 1 55 ALA H 1 56 PHE QD 4.000 . 4.300 2.787 2.743 2.954 . 0 0 "[ . 1 ]" 1
812 1 55 ALA H 1 57 THR H 4.000 . 4.300 3.943 3.865 4.017 . 0 0 "[ . 1 ]" 1
813 1 55 ALA HA 1 56 PHE H 4.000 . 4.300 3.247 3.214 3.281 . 0 0 "[ . 1 ]" 1
814 1 55 ALA HA 1 57 THR H 5.000 . 5.300 4.128 4.094 4.176 . 0 0 "[ . 1 ]" 1
815 1 55 ALA HA 1 58 ASP QB 5.000 . 5.300 4.902 4.866 5.092 . 0 0 "[ . 1 ]" 1
816 1 55 ALA MB 1 56 PHE H 4.000 . 4.300 3.368 3.336 3.397 . 0 0 "[ . 1 ]" 1
817 1 55 ALA MB 1 56 PHE QD 4.000 . 4.300 2.394 2.349 2.449 . 0 0 "[ . 1 ]" 1
818 1 55 ALA MB 1 56 PHE QE 4.000 . 4.300 2.051 1.998 2.147 . 0 0 "[ . 1 ]" 1
819 1 55 ALA MB 1 56 PHE HZ 4.000 . 4.300 3.647 3.616 3.701 . 0 0 "[ . 1 ]" 1
820 1 56 PHE H 1 56 PHE HB2 4.000 . 4.200 2.671 2.618 2.749 . 0 0 "[ . 1 ]" 1
821 1 56 PHE H 1 56 PHE HB3 4.000 . 4.300 3.821 3.782 3.857 . 0 0 "[ . 1 ]" 1
822 1 56 PHE H 1 57 THR H 3.000 . 3.300 1.780 1.743 1.801 0.057 11 0 "[ . 1 ]" 1
823 1 56 PHE H 1 57 THR MG 4.000 . 4.300 2.754 2.624 2.818 . 0 0 "[ . 1 ]" 1
824 1 56 PHE HA 1 57 THR H 4.000 . 4.300 3.260 3.219 3.314 . 0 0 "[ . 1 ]" 1
825 1 56 PHE HA 1 59 LYS H 3.000 . 3.300 3.232 3.105 3.380 0.080 4 0 "[ . 1 ]" 1
826 1 56 PHE HA 1 59 LYS QB 4.000 . 4.300 2.237 2.089 2.334 . 0 0 "[ . 1 ]" 1
827 1 56 PHE HA 1 59 LYS QD 4.000 . 4.300 3.220 3.146 3.269 . 0 0 "[ . 1 ]" 1
828 1 56 PHE HA 1 59 LYS QG 4.000 . 4.300 2.026 1.905 2.095 0.095 5 0 "[ . 1 ]" 1
829 1 56 PHE HA 1 60 VAL H 5.000 . 5.300 3.098 2.980 3.231 . 0 0 "[ . 1 ]" 1
830 1 56 PHE HA 1 60 VAL HB 4.000 . 4.300 3.252 3.099 3.375 . 0 0 "[ . 1 ]" 1
831 1 56 PHE HA 1 94 LEU MD1 3.000 . 3.300 2.771 2.755 2.815 . 0 0 "[ . 1 ]" 1
832 1 56 PHE HA 1 94 LEU MD2 3.000 . 3.300 1.841 1.777 1.940 0.023 5 0 "[ . 1 ]" 1
833 1 56 PHE HA 1 97 ILE HB 5.000 . 5.300 4.694 4.523 4.957 . 0 0 "[ . 1 ]" 1
834 1 56 PHE HA 1 97 ILE MD 5.000 . 5.300 3.954 3.733 4.251 . 0 0 "[ . 1 ]" 1
835 1 56 PHE HB2 1 57 THR H 5.000 . 5.300 3.548 3.496 3.610 . 0 0 "[ . 1 ]" 1
836 1 56 PHE HB2 1 97 ILE HA 5.000 . 5.300 3.648 3.518 3.921 . 0 0 "[ . 1 ]" 1
837 1 56 PHE HB2 1 97 ILE MD 4.000 . 4.300 1.875 1.705 2.219 0.095 2 0 "[ . 1 ]" 1
838 1 56 PHE HB2 1 97 ILE HG12 5.000 . 5.300 3.832 3.531 4.030 . 0 0 "[ . 1 ]" 1
839 1 56 PHE HB3 1 57 THR H 4.000 . 4.300 4.282 4.242 4.320 0.020 10 0 "[ . 1 ]" 1
840 1 56 PHE HB3 1 60 VAL MG1 5.000 . 5.300 3.989 3.819 4.220 . 0 0 "[ . 1 ]" 1
841 1 56 PHE HB3 1 97 ILE HB 3.000 . 3.300 2.845 2.680 3.170 . 0 0 "[ . 1 ]" 1
842 1 56 PHE HB3 1 97 ILE MD 4.000 . 4.300 2.111 1.696 2.472 0.104 7 0 "[ . 1 ]" 1
843 1 56 PHE HB3 1 97 ILE HG12 5.000 . 5.300 3.294 2.972 3.970 . 0 0 "[ . 1 ]" 1
844 1 56 PHE HB3 1 97 ILE HG13 5.000 . 5.300 4.168 2.587 4.614 . 0 0 "[ . 1 ]" 1
845 1 56 PHE HB3 1 98 VAL H 5.000 . 5.300 4.376 4.228 4.555 . 0 0 "[ . 1 ]" 1
846 1 56 PHE QD 1 59 LYS QB 8.400 . 8.700 3.998 3.938 4.022 . 0 0 "[ . 1 ]" 1
847 1 56 PHE QD 1 59 LYS QD 5.000 . 5.300 4.218 4.199 4.238 . 0 0 "[ . 1 ]" 1
848 1 56 PHE QD 1 59 LYS QG 5.000 . 5.300 4.177 4.133 4.215 . 0 0 "[ . 1 ]" 1
849 1 56 PHE QD 1 94 LEU HA 4.000 . 4.300 3.567 3.320 3.736 . 0 0 "[ . 1 ]" 1
850 1 56 PHE QD 1 94 LEU HB3 4.000 . 4.300 1.759 1.713 1.808 0.087 1 0 "[ . 1 ]" 1
851 1 56 PHE QD 1 94 LEU MD1 4.000 . 4.300 3.209 3.164 3.245 . 0 0 "[ . 1 ]" 1
852 1 56 PHE QD 1 94 LEU MD2 3.000 . 3.300 2.385 2.271 2.472 . 0 0 "[ . 1 ]" 1
853 1 56 PHE QD 1 96 GLY H 5.000 . 5.300 4.885 4.850 4.916 . 0 0 "[ . 1 ]" 1
854 1 56 PHE QD 1 97 ILE H 4.000 . 4.300 3.682 3.611 3.744 . 0 0 "[ . 1 ]" 1
855 1 56 PHE QD 1 97 ILE HA 5.000 . 5.300 2.739 2.706 2.827 . 0 0 "[ . 1 ]" 1
856 1 56 PHE QD 1 97 ILE HB 5.000 . 5.300 1.944 1.837 2.009 . 0 0 "[ . 1 ]" 1
857 1 56 PHE QD 1 97 ILE MD 5.000 . 5.300 2.548 2.124 2.727 . 0 0 "[ . 1 ]" 1
858 1 56 PHE QD 1 97 ILE HG12 4.000 . 4.300 3.898 3.850 4.096 . 0 0 "[ . 1 ]" 1
859 1 56 PHE QD 1 97 ILE HG13 5.000 . 5.300 4.351 2.806 4.669 . 0 0 "[ . 1 ]" 1
860 1 56 PHE QD 1 97 ILE MG 4.000 . 4.300 3.430 3.382 3.555 . 0 0 "[ . 1 ]" 1
861 1 56 PHE QD 1 98 VAL H 3.000 . 3.300 2.929 2.803 3.087 . 0 0 "[ . 1 ]" 1
862 1 56 PHE QE 1 90 MET ME 4.000 . 4.300 3.114 2.770 3.241 . 0 0 "[ . 1 ]" 1
863 1 56 PHE QE 1 94 LEU HA 4.000 . 4.300 2.545 2.265 2.732 . 0 0 "[ . 1 ]" 1
864 1 56 PHE QE 1 94 LEU HB2 4.000 . 4.300 4.047 3.996 4.113 . 0 0 "[ . 1 ]" 1
865 1 56 PHE QE 1 94 LEU MD2 3.000 . 3.300 2.560 2.530 2.587 . 0 0 "[ . 1 ]" 1
866 1 56 PHE QE 1 94 LEU HG 5.000 . 5.300 4.670 4.635 4.700 . 0 0 "[ . 1 ]" 1
867 1 56 PHE QE 1 96 GLY HA3 4.000 . 4.300 3.832 3.685 3.937 . 0 0 "[ . 1 ]" 1
868 1 56 PHE QE 1 97 ILE HA 4.000 . 4.300 2.811 2.676 2.875 . 0 0 "[ . 1 ]" 1
869 1 56 PHE QE 1 97 ILE HB 5.000 . 5.300 3.240 2.830 3.362 . 0 0 "[ . 1 ]" 1
870 1 56 PHE QE 1 97 ILE MD 5.000 . 5.300 3.730 3.634 4.042 . 0 0 "[ . 1 ]" 1
871 1 56 PHE QE 1 98 VAL H 5.000 . 5.300 3.513 3.432 3.722 . 0 0 "[ . 1 ]" 1
872 1 56 PHE QE 1 98 VAL MG2 3.000 . 3.300 2.514 2.484 2.592 . 0 0 "[ . 1 ]" 1
873 1 56 PHE HZ 1 96 GLY HA2 5.000 . 5.300 4.636 4.390 4.811 . 0 0 "[ . 1 ]" 1
874 1 56 PHE HZ 1 96 GLY HA3 5.000 . 5.300 3.331 3.044 3.612 . 0 0 "[ . 1 ]" 1
875 1 56 PHE HZ 1 97 ILE HA 4.000 . 4.300 3.194 2.919 3.307 . 0 0 "[ . 1 ]" 1
876 1 56 PHE HZ 1 98 VAL MG2 4.000 . 4.300 3.685 3.617 3.726 . 0 0 "[ . 1 ]" 1
877 1 57 THR H 1 57 THR HB 4.000 . 4.300 3.604 3.595 3.612 . 0 0 "[ . 1 ]" 1
878 1 57 THR H 1 57 THR MG 3.000 . 3.300 2.188 2.065 2.261 . 0 0 "[ . 1 ]" 1
879 1 57 THR H 1 58 ASP H 3.000 . 3.300 2.183 2.063 2.226 . 0 0 "[ . 1 ]" 1
880 1 57 THR H 1 59 LYS QD 5.000 . 5.300 4.734 4.670 4.762 . 0 0 "[ . 1 ]" 1
881 1 57 THR H 1 59 LYS QG 3.000 . 3.300 3.138 3.109 3.154 . 0 0 "[ . 1 ]" 1
882 1 57 THR HA 1 57 THR MG 3.000 . 3.300 2.481 2.419 2.574 . 0 0 "[ . 1 ]" 1
883 1 57 THR HA 1 58 ASP H 4.000 . 4.300 3.536 3.469 3.555 . 0 0 "[ . 1 ]" 1
884 1 57 THR HA 1 60 VAL H 4.000 . 4.300 4.112 3.998 4.240 . 0 0 "[ . 1 ]" 1
885 1 57 THR HA 1 60 VAL HB 4.000 . 4.300 3.849 3.728 3.977 . 0 0 "[ . 1 ]" 1
886 1 57 THR HA 1 60 VAL MG1 3.000 . 3.300 2.887 2.860 2.934 . 0 0 "[ . 1 ]" 1
887 1 57 THR HA 1 88 ILE MD 5.000 . 5.300 2.736 2.473 3.083 . 0 0 "[ . 1 ]" 1
888 1 57 THR HB 1 58 ASP H 4.000 . 4.300 3.798 3.697 3.958 . 0 0 "[ . 1 ]" 1
889 1 57 THR MG 1 58 ASP H 4.000 . 4.300 3.538 3.385 3.627 . 0 0 "[ . 1 ]" 1
890 1 57 THR MG 1 81 ASN HB3 4.000 . 4.300 3.053 2.885 3.425 . 0 0 "[ . 1 ]" 1
891 1 57 THR MG 1 81 ASN QD 4.000 . 4.300 2.625 1.760 3.211 0.040 5 0 "[ . 1 ]" 1
892 1 57 THR MG 1 81 ASN HD22 5.000 . 5.300 3.583 3.149 3.984 . 0 0 "[ . 1 ]" 1
893 1 58 ASP H 1 59 LYS H 3.000 . 3.300 2.330 2.188 2.462 . 0 0 "[ . 1 ]" 1
894 1 58 ASP H 1 60 VAL H 4.000 . 4.300 4.079 3.899 4.150 . 0 0 "[ . 1 ]" 1
895 1 58 ASP HA 1 59 LYS H 4.000 . 4.300 3.252 3.009 3.282 . 0 0 "[ . 1 ]" 1
896 1 58 ASP HA 1 60 VAL H 4.000 . 4.300 4.598 4.558 4.639 0.339 5 0 "[ . 1 ]" 1
897 1 58 ASP QB 1 59 LYS H 4.000 . 4.300 3.544 3.501 3.784 . 0 0 "[ . 1 ]" 1
898 1 59 LYS H 1 59 LYS HB2 3.000 . 3.300 2.583 2.551 2.597 . 0 0 "[ . 1 ]" 1
899 1 59 LYS H 1 59 LYS HB3 4.000 . 4.300 3.556 3.489 3.681 . 0 0 "[ . 1 ]" 1
900 1 59 LYS H 1 59 LYS QD 5.000 2.800 5.300 4.019 3.951 4.305 . 0 0 "[ . 1 ]" 1
901 1 59 LYS H 1 59 LYS QG 3.000 . 3.300 2.095 2.004 2.423 . 0 0 "[ . 1 ]" 1
902 1 59 LYS H 1 60 VAL H 3.000 . 3.300 2.043 1.817 2.089 . 0 0 "[ . 1 ]" 1
903 1 59 LYS HA 1 59 LYS QG 3.000 . 3.300 2.629 2.590 2.724 . 0 0 "[ . 1 ]" 1
904 1 59 LYS HA 1 60 VAL H 4.000 . 4.300 3.471 3.462 3.480 . 0 0 "[ . 1 ]" 1
905 1 59 LYS HA 1 94 LEU MD1 5.000 . 5.300 3.412 3.377 3.465 . 0 0 "[ . 1 ]" 1
906 1 59 LYS HA 1 94 LEU MD2 4.000 . 4.300 3.771 3.716 3.795 . 0 0 "[ . 1 ]" 1
907 1 59 LYS QB 1 60 VAL H 4.000 . 4.300 2.072 2.017 2.107 . 0 0 "[ . 1 ]" 1
908 1 59 LYS QB 1 60 VAL MG2 4.000 . 4.300 3.365 3.336 3.409 . 0 0 "[ . 1 ]" 1
909 1 59 LYS HB2 1 94 LEU MD1 3.000 . 3.300 1.777 1.741 1.817 0.059 4 0 "[ . 1 ]" 1
910 1 59 LYS HB3 1 59 LYS QE 4.000 . 4.300 1.990 1.856 2.178 . 0 0 "[ . 1 ]" 1
911 1 59 LYS HB3 1 94 LEU MD2 5.000 . 5.300 1.744 1.647 1.762 0.153 4 0 "[ . 1 ]" 1
912 1 59 LYS QG 1 60 VAL H 5.000 . 5.300 3.199 3.127 3.249 . 0 0 "[ . 1 ]" 1
913 1 60 VAL H 1 60 VAL HB 3.000 . 3.300 1.776 1.742 1.803 0.058 4 0 "[ . 1 ]" 1
914 1 60 VAL H 1 60 VAL MG1 4.000 . 4.300 3.088 2.995 3.119 . 0 0 "[ . 1 ]" 1
915 1 60 VAL H 1 60 VAL MG2 3.000 . 3.300 3.089 3.061 3.128 . 0 0 "[ . 1 ]" 1
916 1 60 VAL H 1 61 PRO HD2 5.000 . 5.300 4.758 4.501 4.880 . 0 0 "[ . 1 ]" 1
917 1 60 VAL HA 1 61 PRO HD2 3.000 . 3.300 3.097 2.932 3.191 . 0 0 "[ . 1 ]" 1
918 1 60 VAL HA 1 61 PRO HD3 3.000 . 3.300 2.550 2.413 2.744 . 0 0 "[ . 1 ]" 1
919 1 60 VAL HA 1 94 LEU MD1 5.000 . 5.300 2.189 2.086 2.304 . 0 0 "[ . 1 ]" 1
920 1 60 VAL HB 1 61 PRO HD3 4.000 . 4.300 4.490 4.448 4.586 0.286 14 0 "[ . 1 ]" 1
921 1 60 VAL HB 1 89 ILE H 5.000 . 5.300 5.373 5.321 5.469 0.169 10 0 "[ . 1 ]" 1
922 1 60 VAL HB 1 90 MET ME 4.000 . 4.300 3.861 3.808 3.904 . 0 0 "[ . 1 ]" 1
923 1 60 VAL HB 1 94 LEU MD1 3.000 . 3.300 2.185 2.101 2.241 . 0 0 "[ . 1 ]" 1
924 1 60 VAL MG1 1 61 PRO HD2 4.000 . 4.300 1.665 1.627 1.692 0.173 11 0 "[ . 1 ]" 1
925 1 60 VAL MG1 1 61 PRO HD3 3.000 . 3.300 2.909 2.869 2.980 . 0 0 "[ . 1 ]" 1
926 1 60 VAL MG1 1 83 ARG HH12 5.000 . 5.300 3.468 2.654 4.491 . 0 0 "[ . 1 ]" 1
927 1 60 VAL MG1 1 83 ARG HH22 4.000 . 4.300 2.932 1.848 4.498 0.198 5 0 "[ . 1 ]" 1
928 1 60 VAL MG1 1 88 ILE MD 3.000 . 3.300 1.672 1.581 1.770 0.219 9 0 "[ . 1 ]" 1
929 1 60 VAL MG1 1 88 ILE MG 4.000 . 4.300 1.903 1.679 2.528 0.121 1 0 "[ . 1 ]" 1
930 1 60 VAL MG2 1 61 PRO HD2 5.000 . 5.300 2.578 2.315 2.798 . 0 0 "[ . 1 ]" 1
931 1 60 VAL MG2 1 61 PRO HD3 5.000 . 5.300 2.714 2.568 2.846 . 0 0 "[ . 1 ]" 1
932 1 60 VAL MG2 1 88 ILE MD 5.000 . 5.300 3.394 2.833 3.689 . 0 0 "[ . 1 ]" 1
933 1 60 VAL MG2 1 88 ILE MG 5.000 . 5.300 2.543 2.289 2.894 . 0 0 "[ . 1 ]" 1
934 1 60 VAL MG2 1 90 MET HA 3.000 . 3.300 2.468 2.157 2.691 . 0 0 "[ . 1 ]" 1
935 1 60 VAL MG2 1 94 LEU HB2 3.000 . 3.300 2.922 2.862 2.988 . 0 0 "[ . 1 ]" 1
936 1 60 VAL MG2 1 94 LEU HB3 3.000 . 3.300 2.851 2.803 2.896 . 0 0 "[ . 1 ]" 1
937 1 61 PRO HA 1 62 ALA H 3.000 . 3.300 2.067 2.031 2.141 . 0 0 "[ . 1 ]" 1
938 1 61 PRO HA 1 62 ALA MB 4.000 . 4.300 3.679 3.625 3.728 . 0 0 "[ . 1 ]" 1
939 1 61 PRO HB2 1 62 ALA H 4.000 . 4.300 3.769 3.511 4.030 . 0 0 "[ . 1 ]" 1
940 1 61 PRO HB3 1 62 ALA H 4.000 . 4.300 4.069 3.837 4.285 . 0 0 "[ . 1 ]" 1
941 1 61 PRO QD 1 62 ALA H 5.000 . 5.300 4.770 4.589 4.870 . 0 0 "[ . 1 ]" 1
942 1 61 PRO QD 1 88 ILE MG 5.000 . 5.300 3.487 3.155 3.864 . 0 0 "[ . 1 ]" 1
943 1 61 PRO QG 1 62 ALA H 5.000 . 5.300 4.739 4.649 4.778 . 0 0 "[ . 1 ]" 1
944 1 61 PRO QG 1 89 ILE H 5.000 . 5.300 1.975 1.804 2.246 . 0 0 "[ . 1 ]" 1
945 1 62 ALA H 1 63 ALA H 3.000 . 3.300 3.702 3.587 3.793 0.493 6 0 "[ . 1 ]" 1
946 1 62 ALA HA 1 63 ALA H 3.000 . 3.300 2.460 2.361 2.591 . 0 0 "[ . 1 ]" 1
947 1 62 ALA HA 1 83 ARG QH2 3.000 . 3.300 2.159 1.722 3.025 0.078 14 0 "[ . 1 ]" 1
948 1 62 ALA MB 1 63 ALA H 4.000 . 4.300 3.656 3.630 3.684 . 0 0 "[ . 1 ]" 1
949 1 63 ALA H 1 63 ALA MB 3.000 . 3.300 2.154 2.025 2.219 . 0 0 "[ . 1 ]" 1
950 1 63 ALA H 1 83 ARG HD3 5.000 . 5.300 4.921 4.217 5.425 0.125 14 0 "[ . 1 ]" 1
951 1 63 ALA HA 1 64 ASN H 3.000 . 3.300 2.360 2.232 2.515 . 0 0 "[ . 1 ]" 1
952 1 63 ALA HA 1 83 ARG QH1 5.000 . 5.300 5.279 3.678 6.104 0.804 7 4 "[ - .*+ 1 * ]" 1
953 1 63 ALA MB 1 64 ASN H 5.000 . 5.500 2.786 2.381 3.501 . 0 0 "[ . 1 ]" 1
954 1 63 ALA MB 1 67 GLU QG 4.000 . 4.300 2.702 1.921 3.281 . 0 0 "[ . 1 ]" 1
955 1 63 ALA MB 1 68 ILE MD 5.000 . 5.300 3.472 2.935 3.777 . 0 0 "[ . 1 ]" 1
956 1 63 ALA MB 1 83 ARG HD3 5.000 . 5.300 3.934 2.960 4.480 . 0 0 "[ . 1 ]" 1
957 1 63 ALA MB 1 83 ARG HE 4.000 . 4.300 3.182 1.974 3.688 . 0 0 "[ . 1 ]" 1
958 1 63 ALA MB 1 83 ARG QH1 5.000 . 5.300 3.556 1.865 4.518 . 0 0 "[ . 1 ]" 1
959 1 64 ASN H 1 64 ASN HB3 4.000 . 4.300 2.795 2.387 3.535 . 0 0 "[ . 1 ]" 1
960 1 64 ASN HA 1 65 GLU H 3.000 . 3.300 2.820 2.610 3.010 . 0 0 "[ . 1 ]" 1
961 1 64 ASN HA 1 66 ARG H 5.000 . 5.300 4.431 4.288 4.600 . 0 0 "[ . 1 ]" 1
962 1 64 ASN HB2 1 64 ASN QD 5.000 2.800 5.300 2.692 2.399 3.328 0.401 9 0 "[ . 1 ]" 1
963 1 64 ASN HB2 1 65 GLU H 3.000 . 3.300 1.860 1.786 2.026 0.014 14 0 "[ . 1 ]" 1
964 1 64 ASN HB2 1 65 GLU QG 5.000 . 5.300 3.147 2.027 4.513 . 0 0 "[ . 1 ]" 1
965 1 64 ASN HB2 1 66 ARG H 5.000 . 5.300 3.862 3.188 4.527 . 0 0 "[ . 1 ]" 1
966 1 64 ASN HB3 1 64 ASN QD 5.000 2.800 5.300 2.946 2.480 3.390 0.320 14 0 "[ . 1 ]" 1
967 1 64 ASN HB3 1 65 GLU H 3.000 . 3.300 3.318 2.715 3.421 0.121 11 0 "[ . 1 ]" 1
968 1 64 ASN HB3 1 66 ARG H 5.000 . 5.300 4.698 4.350 4.946 . 0 0 "[ . 1 ]" 1
969 1 64 ASN QD 1 65 GLU H 5.000 . 5.300 3.376 2.565 4.121 . 0 0 "[ . 1 ]" 1
970 1 64 ASN QD 1 66 ARG HE 5.000 . 5.300 3.882 2.077 4.756 . 0 0 "[ . 1 ]" 1
971 1 64 ASN O 1 68 ILE H 2.400 . 3.300 2.094 1.999 2.278 0.001 12 0 "[ . 1 ]" 1
972 1 64 ASN O 1 68 ILE N 3.400 3.000 4.300 3.035 2.964 3.216 0.036 5 0 "[ . 1 ]" 1
973 1 65 GLU H 1 65 GLU QB 3.000 . 3.300 2.300 2.017 2.568 . 0 0 "[ . 1 ]" 1
974 1 65 GLU H 1 65 GLU QG 4.000 . 4.300 2.426 1.919 3.654 . 0 0 "[ . 1 ]" 1
975 1 65 GLU H 1 66 ARG H 3.000 . 3.300 3.124 2.843 3.257 . 0 0 "[ . 1 ]" 1
976 1 65 GLU H 1 67 GLU H 5.000 . 5.300 5.270 4.943 5.448 0.148 5 0 "[ . 1 ]" 1
977 1 65 GLU H 1 68 ILE MD 5.000 . 5.300 3.706 3.347 4.205 . 0 0 "[ . 1 ]" 1
978 1 65 GLU H 1 68 ILE QG 5.000 . 5.300 4.739 4.618 4.859 . 0 0 "[ . 1 ]" 1
979 1 65 GLU HA 1 66 ARG H 4.000 . 4.300 3.565 3.533 3.597 . 0 0 "[ . 1 ]" 1
980 1 65 GLU HA 1 68 ILE H 4.000 . 4.300 3.483 3.131 3.864 . 0 0 "[ . 1 ]" 1
981 1 65 GLU HA 1 68 ILE HB 3.000 . 3.300 2.009 1.911 2.183 . 0 0 "[ . 1 ]" 1
982 1 65 GLU HA 1 68 ILE MD 5.000 . 5.300 3.457 3.085 3.728 . 0 0 "[ . 1 ]" 1
983 1 65 GLU HA 1 68 ILE QG 4.000 . 4.300 3.812 3.568 3.894 . 0 0 "[ . 1 ]" 1
984 1 65 GLU HA 1 68 ILE MG 4.000 . 4.300 2.557 2.057 3.381 . 0 0 "[ . 1 ]" 1
985 1 65 GLU HA 1 69 GLY H 4.000 . 4.300 3.813 3.424 4.321 0.021 1 0 "[ . 1 ]" 1
986 1 65 GLU QB 1 66 ARG H 4.000 . 4.300 3.444 3.120 3.609 . 0 0 "[ . 1 ]" 1
987 1 65 GLU QG 1 66 ARG H 5.000 . 5.300 2.010 1.847 2.270 . 0 0 "[ . 1 ]" 1
988 1 66 ARG H 1 66 ARG HB2 3.000 . 3.300 1.982 1.957 2.065 . 0 0 "[ . 1 ]" 1
989 1 66 ARG H 1 66 ARG HB3 3.000 . 3.300 3.300 3.253 3.386 0.086 6 0 "[ . 1 ]" 1
990 1 66 ARG H 1 68 ILE H 5.000 . 5.300 3.949 3.658 4.247 . 0 0 "[ . 1 ]" 1
991 1 66 ARG HA 1 67 GLU H 4.000 . 4.300 3.561 3.529 3.574 . 0 0 "[ . 1 ]" 1
992 1 66 ARG HA 1 68 ILE H 5.000 . 5.300 4.714 4.277 5.057 . 0 0 "[ . 1 ]" 1
993 1 66 ARG HA 1 69 GLY H 4.000 . 4.300 3.857 3.619 4.272 . 0 0 "[ . 1 ]" 1
994 1 66 ARG QB 1 67 GLU H 4.000 . 4.300 2.078 1.973 2.258 . 0 0 "[ . 1 ]" 1
995 1 66 ARG QD 1 70 MET ME 5.000 . 5.300 3.565 2.625 3.940 . 0 0 "[ . 1 ]" 1
996 1 66 ARG QG 1 67 GLU H 5.000 . 5.300 4.024 3.939 4.152 . 0 0 "[ . 1 ]" 1
997 1 66 ARG QG 1 70 MET ME 5.000 . 5.300 3.799 3.382 4.001 . 0 0 "[ . 1 ]" 1
998 1 67 GLU H 1 67 GLU QG 4.000 . 4.300 3.626 3.281 3.911 . 0 0 "[ . 1 ]" 1
999 1 67 GLU H 1 68 ILE H 3.000 . 3.300 2.713 2.588 2.837 . 0 0 "[ . 1 ]" 1
1000 1 67 GLU H 1 68 ILE HB 5.000 . 5.300 4.488 4.268 4.901 . 0 0 "[ . 1 ]" 1
1001 1 67 GLU H 1 70 MET ME 3.000 . 3.300 2.877 2.783 3.047 . 0 0 "[ . 1 ]" 1
1002 1 67 GLU HA 1 68 ILE H 5.000 . 5.300 3.557 3.517 3.587 . 0 0 "[ . 1 ]" 1
1003 1 67 GLU HA 1 84 LEU MD1 5.000 . 5.300 3.949 1.924 4.470 . 0 0 "[ . 1 ]" 1
1004 1 67 GLU QB 1 68 ILE MD 5.000 . 5.300 3.059 2.249 3.979 . 0 0 "[ . 1 ]" 1
1005 1 67 GLU QG 1 68 ILE MD 5.000 . 5.300 2.895 1.700 3.950 0.100 2 0 "[ . 1 ]" 1
1006 1 67 GLU QG 1 84 LEU H 5.000 . 5.300 2.720 1.758 4.076 0.042 3 0 "[ . 1 ]" 1
1007 1 68 ILE H 1 68 ILE HB 3.000 . 3.300 2.128 2.020 2.382 . 0 0 "[ . 1 ]" 1
1008 1 68 ILE H 1 68 ILE MD 5.000 . 5.300 2.132 1.802 3.395 . 0 0 "[ . 1 ]" 1
1009 1 68 ILE H 1 68 ILE QG 4.000 . 4.300 3.127 1.853 3.561 . 0 0 "[ . 1 ]" 1
1010 1 68 ILE H 1 68 ILE MG . . 4.300 3.596 3.493 3.692 . 0 0 "[ . 1 ]" 1
1011 1 68 ILE H 1 69 GLY H 3.000 . 3.300 2.709 2.478 2.924 . 0 0 "[ . 1 ]" 1
1012 1 68 ILE H 1 69 GLY QA 5.000 . 5.300 4.595 4.377 4.801 . 0 0 "[ . 1 ]" 1
1013 1 68 ILE HA 1 68 ILE MG 3.000 . 3.300 2.604 2.235 2.753 . 0 0 "[ . 1 ]" 1
1014 1 68 ILE HA 1 69 GLY H 5.000 . 5.300 3.437 3.281 3.506 . 0 0 "[ . 1 ]" 1
1015 1 68 ILE HA 1 71 LEU H 5.000 . 5.300 4.096 3.834 4.251 . 0 0 "[ . 1 ]" 1
1016 1 68 ILE HA 1 71 LEU HB2 5.000 . 5.300 3.643 3.277 3.827 . 0 0 "[ . 1 ]" 1
1017 1 68 ILE HA 1 71 LEU HB3 5.000 . 5.300 2.457 2.170 2.786 . 0 0 "[ . 1 ]" 1
1018 1 68 ILE HA 1 71 LEU MD1 3.000 . 3.300 2.624 2.276 2.766 . 0 0 "[ . 1 ]" 1
1019 1 68 ILE HB 1 69 GLY H 3.000 . 3.300 3.299 3.140 3.427 0.127 11 0 "[ . 1 ]" 1
1020 1 68 ILE QG 1 69 GLY H 5.000 . 5.300 4.609 4.070 4.737 . 0 0 "[ . 1 ]" 1
1021 1 68 ILE QG 1 71 LEU MD1 4.000 . 4.300 3.276 3.218 3.381 . 0 0 "[ . 1 ]" 1
1022 1 68 ILE MG 1 69 GLY H 5.000 . 5.300 3.483 3.128 4.159 . 0 0 "[ . 1 ]" 1
1023 1 68 ILE MG 1 69 GLY QA 5.000 . 5.300 3.285 3.056 3.980 . 0 0 "[ . 1 ]" 1
1024 1 68 ILE O 1 72 GLU H 2.400 . 3.300 2.236 2.107 2.535 . 0 0 "[ . 1 ]" 1
1025 1 68 ILE O 1 72 GLU N 3.400 3.000 4.300 3.029 2.935 3.369 0.065 11 0 "[ . 1 ]" 1
1026 1 69 GLY H 1 69 GLY HA2 3.000 . 3.300 2.954 2.942 2.965 . 0 0 "[ . 1 ]" 1
1027 1 69 GLY H 1 69 GLY HA3 3.000 . 3.300 2.404 2.389 2.431 . 0 0 "[ . 1 ]" 1
1028 1 69 GLY H 1 70 MET H 4.000 . 4.300 2.883 2.670 3.039 . 0 0 "[ . 1 ]" 1
1029 1 69 GLY H 1 71 LEU H 5.000 . 5.300 3.377 3.054 3.477 . 0 0 "[ . 1 ]" 1
1030 1 69 GLY HA2 1 71 LEU H 4.000 . 4.300 4.195 3.904 4.367 0.067 11 0 "[ . 1 ]" 1
1031 1 69 GLY HA2 1 72 GLU H 5.000 . 5.300 3.214 3.027 3.345 . 0 0 "[ . 1 ]" 1
1032 1 69 GLY HA3 1 70 MET H 4.000 . 4.300 2.447 2.379 2.552 . 0 0 "[ . 1 ]" 1
1033 1 69 GLY HA3 1 71 LEU H 5.000 . 5.300 4.181 3.925 4.337 . 0 0 "[ . 1 ]" 1
1034 1 69 GLY HA3 1 72 GLU HB3 4.000 . 4.300 3.853 3.604 4.410 0.110 4 0 "[ . 1 ]" 1
1035 1 69 GLY HA3 1 72 GLU QG 5.000 . 5.300 4.732 3.734 4.857 . 0 0 "[ . 1 ]" 1
1036 1 70 MET H 1 70 MET HB2 4.000 . 4.300 3.545 3.405 3.600 . 0 0 "[ . 1 ]" 1
1037 1 70 MET H 1 70 MET HB3 4.000 . 4.300 2.746 2.585 3.333 . 0 0 "[ . 1 ]" 1
1038 1 70 MET HA 1 71 LEU H 4.000 . 4.300 3.522 3.437 3.572 . 0 0 "[ . 1 ]" 1
1039 1 70 MET HA 1 72 GLU H 5.000 . 5.300 4.670 4.449 4.756 . 0 0 "[ . 1 ]" 1
1040 1 70 MET HA 1 73 CYS H 4.000 . 4.300 3.374 3.198 3.561 . 0 0 "[ . 1 ]" 1
1041 1 70 MET HA 1 73 CYS HB2 5.000 . 5.300 2.141 1.871 2.397 . 0 0 "[ . 1 ]" 1
1042 1 70 MET HA 1 73 CYS HB3 3.000 . 3.300 3.219 2.773 3.340 0.040 8 0 "[ . 1 ]" 1
1043 1 70 MET HB2 1 84 LEU MD1 5.000 . 5.300 1.989 1.704 2.922 0.096 2 0 "[ . 1 ]" 1
1044 1 70 MET HB3 1 84 LEU MD1 5.000 . 5.300 3.289 2.662 4.435 . 0 0 "[ . 1 ]" 1
1045 1 70 MET ME 1 71 LEU QB 5.000 . 5.300 4.021 3.963 4.085 . 0 0 "[ . 1 ]" 1
1046 1 70 MET ME 1 84 LEU MD1 5.000 . 5.300 2.854 1.711 3.561 0.089 2 0 "[ . 1 ]" 1
1047 1 70 MET ME 1 86 CYS QB 5.000 . 5.300 3.997 3.924 4.053 . 0 0 "[ . 1 ]" 1
1048 1 70 MET QG 1 84 LEU HB2 5.000 . 5.300 3.198 2.738 3.947 . 0 0 "[ . 1 ]" 1
1049 1 70 MET QG 1 84 LEU HB3 5.000 . 5.300 3.539 2.610 4.386 . 0 0 "[ . 1 ]" 1
1050 1 70 MET QG 1 84 LEU MD1 5.000 . 5.300 2.043 1.695 3.086 0.105 11 0 "[ . 1 ]" 1
1051 1 71 LEU H 1 71 LEU HB2 4.000 . 4.300 2.381 2.318 2.553 . 0 0 "[ . 1 ]" 1
1052 1 71 LEU H 1 71 LEU HB3 3.000 . 3.300 2.367 2.231 2.428 . 0 0 "[ . 1 ]" 1
1053 1 71 LEU H 1 72 GLU H 3.000 . 3.300 2.633 2.436 2.783 . 0 0 "[ . 1 ]" 1
1054 1 71 LEU HA 1 71 LEU MD2 3.000 . 3.300 1.907 1.858 1.990 . 0 0 "[ . 1 ]" 1
1055 1 71 LEU HA 1 71 LEU HG 3.000 . 3.300 3.455 3.180 3.559 0.259 4 0 "[ . 1 ]" 1
1056 1 71 LEU HA 1 72 GLU H 4.000 . 4.300 3.582 3.554 3.624 . 0 0 "[ . 1 ]" 1
1057 1 71 LEU HA 1 74 VAL MG1 3.000 . 3.300 1.869 1.739 2.024 0.061 11 0 "[ . 1 ]" 1
1058 1 71 LEU HA 1 84 LEU MD1 5.000 . 5.300 2.950 2.441 4.047 . 0 0 "[ . 1 ]" 1
1059 1 71 LEU HB2 1 72 GLU H 5.000 . 5.300 3.631 3.575 3.771 . 0 0 "[ . 1 ]" 1
1060 1 71 LEU HB3 1 71 LEU MD1 3.000 . 3.300 2.064 1.853 2.116 . 0 0 "[ . 1 ]" 1
1061 1 71 LEU HB3 1 71 LEU MD2 3.000 . 3.300 3.061 2.899 3.102 . 0 0 "[ . 1 ]" 1
1062 1 71 LEU HB3 1 72 GLU H 5.000 . 5.300 2.212 2.119 2.357 . 0 0 "[ . 1 ]" 1
1063 1 71 LEU HB3 1 78 LEU MD1 5.000 . 5.300 3.721 3.608 3.812 . 0 0 "[ . 1 ]" 1
1064 1 71 LEU MD1 1 82 SER HB2 5.000 . 5.300 2.196 1.892 2.468 . 0 0 "[ . 1 ]" 1
1065 1 71 LEU MD1 1 83 ARG HA 5.000 . 5.300 4.057 2.643 4.451 . 0 0 "[ . 1 ]" 1
1066 1 71 LEU MD2 1 72 GLU H 5.000 . 5.300 3.720 3.314 3.836 . 0 0 "[ . 1 ]" 1
1067 1 71 LEU MD2 1 82 SER HA 5.000 . 5.300 3.513 3.412 3.659 . 0 0 "[ . 1 ]" 1
1068 1 71 LEU MD2 1 82 SER HB2 5.000 . 5.300 3.172 2.947 3.304 . 0 0 "[ . 1 ]" 1
1069 1 71 LEU MD2 1 82 SER QB 4.000 . 4.300 1.800 1.754 1.885 0.046 9 0 "[ . 1 ]" 1
1070 1 71 LEU MD2 1 82 SER HB3 5.000 . 5.300 1.810 1.762 1.896 0.038 9 0 "[ . 1 ]" 1
1071 1 71 LEU MD2 1 83 ARG H 5.000 . 5.300 3.032 2.278 3.202 . 0 0 "[ . 1 ]" 1
1072 1 71 LEU MD2 1 83 ARG HA 5.000 . 5.300 3.982 3.582 4.213 . 0 0 "[ . 1 ]" 1
1073 1 71 LEU O 1 74 VAL H 2.400 . 3.300 2.388 2.051 2.612 . 0 0 "[ . 1 ]" 1
1074 1 71 LEU O 1 74 VAL N 3.400 3.000 4.300 2.991 2.939 3.158 0.061 4 0 "[ . 1 ]" 1
1075 1 72 GLU H 1 72 GLU QG 4.000 . 4.300 3.720 2.941 3.893 . 0 0 "[ . 1 ]" 1
1076 1 72 GLU H 1 73 CYS H 3.000 . 3.300 2.611 2.443 2.649 . 0 0 "[ . 1 ]" 1
1077 1 72 GLU H 1 78 LEU MD2 5.000 . 5.300 4.377 4.251 4.446 . 0 0 "[ . 1 ]" 1
1078 1 72 GLU HA 1 73 CYS H 4.000 . 4.300 3.470 3.418 3.500 . 0 0 "[ . 1 ]" 1
1079 1 72 GLU HA 1 78 LEU MD2 3.000 . 3.300 2.803 2.638 3.015 . 0 0 "[ . 1 ]" 1
1080 1 72 GLU QB 1 73 CYS H 4.000 . 4.300 3.031 2.899 3.553 . 0 0 "[ . 1 ]" 1
1081 1 73 CYS H 1 74 VAL H 4.000 . 4.300 2.544 2.326 2.713 . 0 0 "[ . 1 ]" 1
1082 1 73 CYS HA 1 74 VAL H 5.000 . 5.300 3.565 3.470 3.599 . 0 0 "[ . 1 ]" 1
1083 1 74 VAL H 1 74 VAL MG1 3.000 . 3.300 1.797 1.732 1.967 . 0 0 "[ . 1 ]" 1
1084 1 74 VAL HA 1 75 THR H 3.000 . 3.300 2.418 2.228 2.545 . 0 0 "[ . 1 ]" 1
1085 1 74 VAL HB 1 75 THR H 4.000 . 4.300 2.740 2.532 3.046 . 0 0 "[ . 1 ]" 1
1086 1 74 VAL HB 1 76 ALA H 4.000 . 4.300 2.986 2.629 3.992 . 0 0 "[ . 1 ]" 1
1087 1 74 VAL MG1 1 75 THR H 4.000 . 4.300 4.005 3.835 4.098 . 0 0 "[ . 1 ]" 1
1088 1 74 VAL MG1 1 106 TRP HE1 4.000 . 4.300 3.896 1.812 4.151 . 0 0 "[ . 1 ]" 1
1089 1 74 VAL MG2 1 75 THR H 5.000 . 5.300 3.336 2.919 3.658 . 0 0 "[ . 1 ]" 1
1090 1 74 VAL MG2 1 76 ALA H 5.000 . 5.300 2.302 2.069 2.749 . 0 0 "[ . 1 ]" 1
1091 1 74 VAL MG2 2 1 FES FE2 10.000 7.800 11.000 8.965 8.718 9.181 . 0 0 "[ . 1 ]" 1
1092 1 75 THR H 1 75 THR MG 4.000 . 4.300 3.711 3.681 3.737 . 0 0 "[ . 1 ]" 1
1093 1 75 THR H 1 76 ALA H 4.000 . 4.300 2.611 2.223 3.230 . 0 0 "[ . 1 ]" 1
1094 1 75 THR HA 1 75 THR MG 3.000 . 3.300 2.380 2.344 2.426 . 0 0 "[ . 1 ]" 1
1095 1 75 THR HA 1 76 ALA H 4.000 . 4.300 3.038 2.867 3.257 . 0 0 "[ . 1 ]" 1
1096 1 75 THR HB 1 76 ALA H 5.000 . 5.300 4.020 3.667 4.451 . 0 0 "[ . 1 ]" 1
1097 1 75 THR HB 1 104 ARG HA 5.000 . 5.300 4.977 4.745 5.354 0.054 2 0 "[ . 1 ]" 1
1098 1 75 THR HB 1 104 ARG QD 5.000 . 5.300 4.018 3.132 4.689 . 0 0 "[ . 1 ]" 1
1099 1 75 THR HB 1 104 ARG HE 5.000 . 5.300 5.170 5.000 5.408 0.108 5 0 "[ . 1 ]" 1
1100 1 75 THR HB 1 104 ARG QG 5.000 . 5.300 3.813 1.863 4.784 . 0 0 "[ . 1 ]" 1
1101 1 75 THR HB 1 106 TRP HD1 5.000 . 5.300 2.154 1.862 4.443 . 0 0 "[ . 1 ]" 1
1102 1 75 THR MG 1 76 ALA H 5.000 . 5.300 4.074 4.004 4.094 . 0 0 "[ . 1 ]" 1
1103 1 75 THR MG 1 104 ARG QD 4.000 . 4.300 2.599 1.929 3.246 . 0 0 "[ . 1 ]" 1
1104 1 75 THR MG 1 104 ARG HE 5.000 . 5.300 4.419 4.259 4.468 . 0 0 "[ . 1 ]" 1
1105 1 76 ALA H 1 76 ALA MB 3.000 . 3.300 2.176 1.963 2.439 . 0 0 "[ . 1 ]" 1
1106 1 76 ALA H 1 77 GLU H 5.000 . 5.300 4.193 3.039 4.337 . 0 0 "[ . 1 ]" 1
1107 1 76 ALA H 1 78 LEU MD1 5.000 . 5.300 4.085 3.809 5.057 . 0 0 "[ . 1 ]" 1
1108 1 76 ALA HA 1 77 GLU H 3.000 . 3.300 2.739 2.604 3.476 0.176 13 0 "[ . 1 ]" 1
1109 1 76 ALA HA 1 104 ARG QB 3.000 . 3.300 2.199 1.795 2.586 0.005 13 0 "[ . 1 ]" 1
1110 1 76 ALA HA 1 104 ARG QD 4.000 . 4.300 3.593 3.180 3.926 . 0 0 "[ . 1 ]" 1
1111 1 76 ALA MB 1 77 GLU H 3.000 . 3.300 1.963 1.758 2.079 0.042 13 0 "[ . 1 ]" 1
1112 1 76 ALA MB 1 102 PRO QB 4.000 . 4.300 1.808 1.671 1.962 0.129 13 0 "[ . 1 ]" 1
1113 1 76 ALA MB 1 103 ASP H 5.000 . 5.300 3.167 3.031 3.385 . 0 0 "[ . 1 ]" 1
1114 1 76 ALA MB 1 104 ARG H 5.000 . 5.300 2.050 1.835 2.277 . 0 0 "[ . 1 ]" 1
1115 1 76 ALA MB 1 104 ARG HE 5.000 . 5.300 4.236 2.593 4.530 . 0 0 "[ . 1 ]" 1
1116 1 77 GLU H 1 77 GLU HB2 3.000 . 3.300 3.008 2.903 3.627 0.327 13 0 "[ . 1 ]" 1
1117 1 77 GLU H 1 77 GLU HB3 3.000 . 3.300 1.836 1.763 2.486 0.037 5 0 "[ . 1 ]" 1
1118 1 77 GLU HA 1 77 GLU QG 3.000 . 3.300 3.014 2.994 3.031 . 0 0 "[ . 1 ]" 1
1119 1 77 GLU QB 1 78 LEU H 4.000 . 4.300 4.097 4.055 4.118 . 0 0 "[ . 1 ]" 1
1120 1 78 LEU H 1 78 LEU MD1 5.000 . 5.300 3.715 3.496 4.060 . 0 0 "[ . 1 ]" 1
1121 1 78 LEU HA 1 78 LEU MD1 3.000 . 3.300 2.539 2.065 2.682 . 0 0 "[ . 1 ]" 1
1122 1 78 LEU HA 1 78 LEU MD2 4.000 . 4.300 3.313 1.812 3.464 . 0 0 "[ . 1 ]" 1
1123 1 78 LEU HA 1 78 LEU HG 4.000 . 4.300 1.986 1.850 3.391 . 0 0 "[ . 1 ]" 1
1124 1 78 LEU HA 1 79 LYS H 3.000 . 3.300 2.150 1.982 2.219 . 0 0 "[ . 1 ]" 1
1125 1 78 LEU HA 1 79 LYS HB2 3.000 . 3.300 3.527 3.425 3.652 0.352 11 0 "[ . 1 ]" 1
1126 1 78 LEU HA 1 79 LYS HB3 5.000 . 5.300 5.066 4.979 5.139 . 0 0 "[ . 1 ]" 1
1127 1 78 LEU HA 1 82 SER QB 4.000 . 4.300 3.710 3.416 3.855 . 0 0 "[ . 1 ]" 1
1128 1 78 LEU HA 1 82 SER HG 4.000 . 4.300 2.439 1.863 3.127 . 0 0 "[ . 1 ]" 1
1129 1 78 LEU QB 1 78 LEU MD1 3.000 . 3.300 2.029 1.989 2.234 . 0 0 "[ . 1 ]" 1
1130 1 78 LEU QB 1 78 LEU MD2 3.000 . 3.300 1.980 1.945 2.285 . 0 0 "[ . 1 ]" 1
1131 1 78 LEU MD1 1 79 LYS H 4.000 . 4.300 3.338 1.801 3.497 . 0 0 "[ . 1 ]" 1
1132 1 78 LEU MD1 1 82 SER HA 5.000 . 5.300 4.465 3.747 4.556 . 0 0 "[ . 1 ]" 1
1133 1 78 LEU MD1 1 82 SER HB3 3.000 . 3.300 2.797 1.850 2.920 . 0 0 "[ . 1 ]" 1
1134 1 78 LEU MD2 1 79 LYS H 5.000 . 5.300 2.760 2.675 3.099 . 0 0 "[ . 1 ]" 1
1135 1 78 LEU MD2 1 79 LYS QB 5.000 . 5.300 4.075 4.035 4.142 . 0 0 "[ . 1 ]" 1
1136 1 78 LEU MD2 1 82 SER HA 5.000 . 5.300 4.667 4.325 4.739 . 0 0 "[ . 1 ]" 1
1137 1 78 LEU MD2 1 82 SER HB3 5.000 . 5.300 3.033 2.844 3.242 . 0 0 "[ . 1 ]" 1
1138 1 78 LEU MD2 1 82 SER HG 5.000 . 5.300 3.320 1.853 3.997 . 0 0 "[ . 1 ]" 1
1139 1 78 LEU HG 1 79 LYS H 5.000 . 5.300 1.954 1.687 4.449 0.113 11 0 "[ . 1 ]" 1
1140 1 78 LEU HG 1 82 SER HG 4.000 . 4.300 2.168 1.770 3.932 0.030 8 0 "[ . 1 ]" 1
1141 1 78 LEU HG 1 83 ARG H 5.000 . 5.300 5.368 5.060 6.116 0.816 9 1 "[ . +1 ]" 1
1142 1 79 LYS H 1 79 LYS HB2 4.000 . 4.300 2.052 1.893 2.116 . 0 0 "[ . 1 ]" 1
1143 1 79 LYS H 1 82 SER H 3.000 . 3.300 3.244 3.060 3.313 0.013 9 0 "[ . 1 ]" 1
1144 1 79 LYS H 1 82 SER HA 5.000 . 5.300 3.567 3.469 3.675 . 0 0 "[ . 1 ]" 1
1145 1 79 LYS H 1 82 SER QB 4.000 . 4.300 2.564 2.069 2.791 . 0 0 "[ . 1 ]" 1
1146 1 79 LYS H 1 82 SER HG 3.000 . 3.300 2.412 1.783 3.207 0.017 9 0 "[ . 1 ]" 1
1147 1 79 LYS HA 1 79 LYS QE 4.000 . 4.300 2.806 1.818 3.883 . 0 0 "[ . 1 ]" 1
1148 1 79 LYS HA 1 79 LYS QG 3.000 . 3.300 2.495 2.297 2.647 . 0 0 "[ . 1 ]" 1
1149 1 79 LYS HA 1 80 PRO HD2 3.000 . 3.300 2.703 2.573 2.916 . 0 0 "[ . 1 ]" 1
1150 1 79 LYS HA 1 80 PRO HD3 3.000 . 3.300 2.348 2.270 2.498 . 0 0 "[ . 1 ]" 1
1151 1 79 LYS HB2 1 80 PRO QD 4.000 . 4.300 3.397 3.310 3.519 . 0 0 "[ . 1 ]" 1
1152 1 79 LYS HB2 1 81 ASN H 4.000 . 4.300 3.460 3.216 3.704 . 0 0 "[ . 1 ]" 1
1153 1 79 LYS HB3 1 80 PRO QD 3.000 . 3.300 1.915 1.756 2.199 0.044 11 0 "[ . 1 ]" 1
1154 1 79 LYS HB3 1 81 ASN H 3.000 . 3.300 2.087 1.883 2.226 . 0 0 "[ . 1 ]" 1
1155 1 79 LYS HG3 1 80 PRO QD 5.000 . 5.300 3.050 1.864 4.019 . 0 0 "[ . 1 ]" 1
1156 1 80 PRO HA 1 81 ASN H 4.000 . 4.300 3.477 3.460 3.489 . 0 0 "[ . 1 ]" 1
1157 1 80 PRO HA 1 82 SER H 4.000 . 4.300 3.954 3.868 4.077 . 0 0 "[ . 1 ]" 1
1158 1 80 PRO HB2 1 81 ASN H 3.000 . 3.300 3.396 3.354 3.441 0.141 5 0 "[ . 1 ]" 1
1159 1 80 PRO QD 1 81 ASN H 4.000 . 4.300 2.188 1.983 2.424 . 0 0 "[ . 1 ]" 1
1160 1 80 PRO QD 1 82 SER H 5.000 . 5.300 3.878 3.643 4.099 . 0 0 "[ . 1 ]" 1
1161 1 80 PRO QG 1 81 ASN H 5.000 . 5.300 2.449 2.358 2.502 . 0 0 "[ . 1 ]" 1
1162 1 81 ASN H 1 81 ASN QB 3.000 . 3.300 2.615 2.352 2.878 . 0 0 "[ . 1 ]" 1
1163 1 81 ASN H 1 81 ASN QD 5.000 . 5.300 3.318 2.757 3.978 . 0 0 "[ . 1 ]" 1
1164 1 81 ASN H 1 82 SER H 3.000 . 3.300 2.469 2.397 2.583 . 0 0 "[ . 1 ]" 1
1165 1 81 ASN HA 1 82 SER H 4.000 . 4.300 3.183 3.146 3.207 . 0 0 "[ . 1 ]" 1
1166 1 81 ASN HB2 1 82 SER H 5.000 . 5.300 4.494 4.348 4.623 . 0 0 "[ . 1 ]" 1
1167 1 81 ASN HB3 1 82 SER H 5.000 . 5.300 4.401 4.195 4.601 . 0 0 "[ . 1 ]" 1
1168 1 81 ASN HD21 1 82 SER HA 5.000 . 5.300 5.263 4.682 5.413 0.113 13 0 "[ . 1 ]" 1
1169 1 82 SER H 1 82 SER QB 3.000 . 3.300 2.057 1.931 2.173 . 0 0 "[ . 1 ]" 1
1170 1 82 SER H 1 82 SER HG 4.000 . 4.300 3.923 3.822 4.086 . 0 0 "[ . 1 ]" 1
1171 1 82 SER H 1 83 ARG H 5.000 . 5.300 4.701 4.626 4.737 . 0 0 "[ . 1 ]" 1
1172 1 82 SER HA 1 83 ARG H 3.000 . 3.300 2.342 2.267 2.634 . 0 0 "[ . 1 ]" 1
1173 1 82 SER HA 1 83 ARG QG 5.000 . 5.300 4.510 3.928 4.990 . 0 0 "[ . 1 ]" 1
1174 1 82 SER HB3 1 83 ARG H 3.000 . 3.300 3.017 2.042 3.325 0.025 7 0 "[ . 1 ]" 1
1175 1 83 ARG HB2 1 84 LEU H 5.000 . 5.300 4.158 3.914 4.597 . 0 0 "[ . 1 ]" 1
1176 1 83 ARG HB2 1 88 ILE MD 5.000 . 5.300 3.781 3.338 4.498 . 0 0 "[ . 1 ]" 1
1177 1 83 ARG HB3 1 84 LEU H 5.000 . 5.300 3.009 2.594 3.744 . 0 0 "[ . 1 ]" 1
1178 1 83 ARG HB3 1 88 ILE MD 5.000 . 5.300 3.306 2.837 4.236 . 0 0 "[ . 1 ]" 1
1179 1 83 ARG HD3 1 83 ARG HE 3.000 . 3.300 2.761 2.434 2.979 . 0 0 "[ . 1 ]" 1
1180 1 83 ARG HE 1 84 LEU H 5.000 . 5.300 4.465 2.632 5.376 0.076 4 0 "[ . 1 ]" 1
1181 1 83 ARG HE 1 88 ILE MD 5.000 . 5.300 3.017 1.798 4.298 0.002 8 0 "[ . 1 ]" 1
1182 1 83 ARG QG 1 84 LEU H 5.000 . 5.300 3.688 2.765 4.515 . 0 0 "[ . 1 ]" 1
1183 1 83 ARG QG 1 88 ILE HA 5.000 . 5.300 4.792 4.676 4.916 . 0 0 "[ . 1 ]" 1
1184 1 83 ARG QG 1 88 ILE MD 4.000 . 4.300 2.152 1.796 3.206 0.004 12 0 "[ . 1 ]" 1
1185 1 83 ARG QH2 1 88 ILE MD 4.000 . 4.300 2.327 1.695 4.218 . 0 0 "[ . 1 ]" 1
1186 1 84 LEU H 1 84 LEU HB2 4.000 . 4.300 2.365 2.228 2.646 . 0 0 "[ . 1 ]" 1
1187 1 84 LEU H 1 84 LEU HG 4.000 . 4.300 3.284 2.499 4.351 0.051 9 0 "[ . 1 ]" 1
1188 1 84 LEU HA 1 84 LEU MD2 3.000 . 3.300 1.860 1.722 2.790 0.078 4 0 "[ . 1 ]" 1
1189 1 85 CYS H 1 86 CYS H 5.000 . 5.300 3.241 2.946 3.497 . 0 0 "[ . 1 ]" 1
1190 1 85 CYS HA 1 86 CYS H 5.000 . 5.300 3.574 3.516 3.617 . 0 0 "[ . 1 ]" 1
1191 1 86 CYS H 1 86 CYS HB2 4.000 . 4.300 3.576 3.544 3.618 . 0 0 "[ . 1 ]" 1
1192 1 86 CYS HA 1 86 CYS HB2 2.500 . 2.800 2.512 2.431 2.726 . 0 0 "[ . 1 ]" 1
1193 1 86 CYS HA 1 86 CYS HB3 2.500 . 2.800 2.423 2.277 2.501 . 0 0 "[ . 1 ]" 1
1194 1 86 CYS HB2 1 87 GLN QE 5.000 . 5.300 3.397 2.642 4.770 . 0 0 "[ . 1 ]" 1
1195 1 87 GLN H 1 87 GLN QB 3.000 . 3.300 2.427 2.317 2.867 . 0 0 "[ . 1 ]" 1
1196 1 87 GLN H 1 87 GLN QE 4.000 . 4.300 3.497 2.897 3.837 . 0 0 "[ . 1 ]" 1
1197 1 87 GLN H 1 88 ILE H 5.000 . 5.300 2.192 1.941 2.432 . 0 0 "[ . 1 ]" 1
1198 1 87 GLN HA 1 88 ILE H 3.000 . 3.300 3.239 3.106 3.403 0.103 5 0 "[ . 1 ]" 1
1199 1 87 GLN QB 1 88 ILE H 4.000 . 4.300 3.523 3.200 3.869 . 0 0 "[ . 1 ]" 1
1200 1 87 GLN QG 1 88 ILE H 5.000 . 5.300 4.524 2.828 4.789 . 0 0 "[ . 1 ]" 1
1201 1 88 ILE H 1 88 ILE MD 5.000 . 5.300 4.029 3.622 4.466 . 0 0 "[ . 1 ]" 1
1202 1 88 ILE H 1 88 ILE QG 4.000 . 4.300 2.962 2.529 3.411 . 0 0 "[ . 1 ]" 1
1203 1 88 ILE HA 1 88 ILE MG 3.000 . 3.300 2.583 2.456 2.755 . 0 0 "[ . 1 ]" 1
1204 1 88 ILE HA 1 89 ILE H 3.000 . 3.300 2.274 2.172 2.320 . 0 0 "[ . 1 ]" 1
1205 1 88 ILE HA 1 89 ILE MD 4.000 . 4.300 3.583 3.405 3.639 . 0 0 "[ . 1 ]" 1
1206 1 88 ILE HB 1 89 ILE H 5.000 . 5.300 4.581 4.508 4.668 . 0 0 "[ . 1 ]" 1
1207 1 88 ILE MG 1 89 ILE H 5.000 . 5.300 3.252 2.861 3.471 . 0 0 "[ . 1 ]" 1
1208 1 89 ILE H 1 89 ILE HB 3.000 . 3.300 2.256 2.099 2.453 . 0 0 "[ . 1 ]" 1
1209 1 89 ILE H 1 89 ILE MD 4.000 . 4.300 2.513 2.186 2.864 . 0 0 "[ . 1 ]" 1
1210 1 89 ILE H 1 89 ILE QG 4.000 . 4.300 3.066 2.226 3.779 . 0 0 "[ . 1 ]" 1
1211 1 89 ILE H 1 89 ILE MG 4.000 . 4.300 3.628 3.504 3.749 . 0 0 "[ . 1 ]" 1
1212 1 89 ILE HA 1 89 ILE MD 3.000 . 3.300 1.816 1.796 1.834 0.004 11 0 "[ . 1 ]" 1
1213 1 89 ILE HA 1 89 ILE MG 3.000 . 3.300 2.510 2.274 2.706 . 0 0 "[ . 1 ]" 1
1214 1 89 ILE HA 1 90 MET H 3.000 . 3.300 2.200 2.160 2.261 . 0 0 "[ . 1 ]" 1
1215 1 89 ILE MD 1 90 MET H 4.000 . 4.300 3.632 3.589 3.679 . 0 0 "[ . 1 ]" 1
1216 1 89 ILE MG 1 90 MET H 5.000 . 5.300 2.647 2.501 2.779 . 0 0 "[ . 1 ]" 1
1217 1 89 ILE MG 1 90 MET HA 5.000 . 5.300 3.959 3.740 4.239 . 0 0 "[ . 1 ]" 1
1218 1 90 MET H 1 90 MET QB 3.000 . 3.300 2.062 1.965 2.187 . 0 0 "[ . 1 ]" 1
1219 1 90 MET H 1 91 THR H 4.000 . 4.300 4.532 4.473 4.601 0.301 6 0 "[ . 1 ]" 1
1220 1 90 MET HA 1 90 MET ME 4.000 . 4.300 1.998 1.806 2.365 . 0 0 "[ . 1 ]" 1
1221 1 90 MET HA 1 91 THR H 3.000 . 3.300 2.233 2.191 2.283 . 0 0 "[ . 1 ]" 1
1222 1 90 MET HA 1 94 LEU HB3 4.000 . 4.400 4.251 4.007 4.418 0.018 5 0 "[ . 1 ]" 1
1223 1 90 MET QB 1 91 THR H 5.000 . 5.300 3.608 3.069 3.893 . 0 0 "[ . 1 ]" 1
1224 1 90 MET ME 1 91 THR H 4.000 . 4.300 2.298 1.965 2.933 . 0 0 "[ . 1 ]" 1
1225 1 90 MET ME 1 94 LEU H 5.000 . 5.400 3.902 3.790 4.130 . 0 0 "[ . 1 ]" 1
1226 1 90 MET ME 1 94 LEU HA 5.000 . 5.400 3.846 3.641 3.968 . 0 0 "[ . 1 ]" 1
1227 1 90 MET ME 1 94 LEU HB2 4.000 . 4.400 2.239 2.044 2.433 . 0 0 "[ . 1 ]" 1
1228 1 90 MET ME 1 94 LEU HB3 4.000 . 4.400 1.950 1.731 2.120 0.069 10 0 "[ . 1 ]" 1
1229 1 90 MET ME 1 95 ASP HA 4.000 . 4.400 3.772 3.733 3.816 . 0 0 "[ . 1 ]" 1
1230 1 90 MET ME 1 96 GLY H 4.000 . 4.300 3.556 3.314 3.607 . 0 0 "[ . 1 ]" 1
1231 1 90 MET ME 1 97 ILE H 5.000 . 5.300 2.856 2.626 2.986 . 0 0 "[ . 1 ]" 1
1232 1 90 MET ME 1 97 ILE MD 5.000 . 5.300 3.324 1.807 3.689 . 0 0 "[ . 1 ]" 1
1233 1 90 MET ME 1 97 ILE HG13 5.000 . 5.300 3.983 3.694 4.136 . 0 0 "[ . 1 ]" 1
1234 1 90 MET ME 1 97 ILE MG 4.000 . 4.300 1.772 1.651 2.384 0.149 14 0 "[ . 1 ]" 1
1235 1 90 MET QG 1 91 THR H 5.000 . 5.300 3.843 3.275 4.582 . 0 0 "[ . 1 ]" 1
1236 1 91 THR H 1 91 THR MG 4.000 . 4.300 2.321 1.748 3.586 0.052 5 0 "[ . 1 ]" 1
1237 1 91 THR H 1 92 PRO QD 5.000 . 5.300 4.319 4.263 4.397 . 0 0 "[ . 1 ]" 1
1238 1 91 THR H 1 93 GLU H 5.000 . 5.300 4.446 4.236 5.031 . 0 0 "[ . 1 ]" 1
1239 1 91 THR H 1 94 LEU H 5.000 . 5.300 3.503 3.320 3.692 . 0 0 "[ . 1 ]" 1
1240 1 91 THR H 1 94 LEU HB2 4.000 . 4.300 2.192 1.997 2.356 . 0 0 "[ . 1 ]" 1
1241 1 91 THR H 1 94 LEU HB3 5.000 . 5.300 3.564 3.447 3.715 . 0 0 "[ . 1 ]" 1
1242 1 91 THR H 1 94 LEU MD2 5.000 . 5.300 4.702 4.610 4.746 . 0 0 "[ . 1 ]" 1
1243 1 91 THR HA 1 91 THR MG 3.000 . 3.300 2.585 1.964 2.825 . 0 0 "[ . 1 ]" 1
1244 1 91 THR HA 1 92 PRO HB2 5.000 . 5.300 5.582 5.523 5.635 0.335 6 0 "[ . 1 ]" 1
1245 1 91 THR HA 1 92 PRO HD2 3.000 . 3.300 2.757 2.305 3.285 . 0 0 "[ . 1 ]" 1
1246 1 91 THR HA 1 92 PRO HD3 3.000 . 3.300 2.279 2.145 2.424 . 0 0 "[ . 1 ]" 1
1247 1 91 THR HB 1 92 PRO HD2 3.000 . 3.300 2.066 1.830 2.478 . 0 0 "[ . 1 ]" 1
1248 1 91 THR HB 1 92 PRO QG 5.000 . 5.300 3.720 3.385 3.857 . 0 0 "[ . 1 ]" 1
1249 1 91 THR HB 1 93 GLU H 3.000 . 3.300 3.054 2.120 3.532 0.232 8 0 "[ . 1 ]" 1
1250 1 91 THR HB 1 94 LEU H 5.000 . 5.300 3.947 2.960 4.478 . 0 0 "[ . 1 ]" 1
1251 1 91 THR MG 1 92 PRO HD2 4.000 . 4.300 3.148 1.827 3.614 . 0 0 "[ . 1 ]" 1
1252 1 91 THR MG 1 93 GLU H 4.000 . 4.300 3.718 3.651 3.816 . 0 0 "[ . 1 ]" 1
1253 1 92 PRO HA 1 93 GLU H 5.000 . 5.300 3.443 3.389 3.543 . 0 0 "[ . 1 ]" 1
1254 1 92 PRO HA 1 94 LEU H 5.000 . 5.300 4.223 4.084 4.370 . 0 0 "[ . 1 ]" 1
1255 1 92 PRO HA 1 95 ASP HB2 5.000 . 5.300 4.929 3.888 5.271 . 0 0 "[ . 1 ]" 1
1256 1 92 PRO QB 1 93 GLU H 5.000 . 5.300 3.510 3.113 3.657 . 0 0 "[ . 1 ]" 1
1257 1 92 PRO QD 1 93 GLU H 4.000 . 4.300 2.484 1.850 2.918 . 0 0 "[ . 1 ]" 1
1258 1 92 PRO QD 1 93 GLU QG 4.000 . 4.300 3.182 2.482 3.578 . 0 0 "[ . 1 ]" 1
1259 1 93 GLU H 1 93 GLU QB 3.000 . 3.300 2.642 2.059 3.056 . 0 0 "[ . 1 ]" 1
1260 1 93 GLU H 1 93 GLU QG 4.000 . 4.300 1.996 1.675 2.564 0.125 9 0 "[ . 1 ]" 1
1261 1 93 GLU H 1 94 LEU H 3.000 . 3.200 2.174 1.996 2.595 . 0 0 "[ . 1 ]" 1
1262 1 93 GLU HA 1 93 GLU QG 3.000 . 3.300 3.183 3.095 3.268 . 0 0 "[ . 1 ]" 1
1263 1 93 GLU HA 1 94 LEU H 4.000 . 4.300 3.453 3.416 3.495 . 0 0 "[ . 1 ]" 1
1264 1 93 GLU QB 1 94 LEU H 3.000 . 3.300 3.161 3.092 3.224 . 0 0 "[ . 1 ]" 1
1265 1 93 GLU QG 1 94 LEU H 5.000 . 5.300 2.178 1.707 2.681 0.093 11 0 "[ . 1 ]" 1
1266 1 93 GLU QG 1 94 LEU MD2 5.000 . 5.300 3.580 2.860 4.067 . 0 0 "[ . 1 ]" 1
1267 1 94 LEU H 1 94 LEU HB2 3.000 . 3.300 2.194 2.108 2.290 . 0 0 "[ . 1 ]" 1
1268 1 94 LEU H 1 94 LEU HB3 4.000 . 4.300 3.488 3.425 3.538 . 0 0 "[ . 1 ]" 1
1269 1 94 LEU H 1 94 LEU MD1 4.000 . 4.300 3.394 3.322 3.512 . 0 0 "[ . 1 ]" 1
1270 1 94 LEU H 1 94 LEU MD2 4.000 . 4.300 3.690 3.588 3.746 . 0 0 "[ . 1 ]" 1
1271 1 94 LEU H 1 94 LEU HG 4.000 . 4.300 2.467 2.373 2.553 . 0 0 "[ . 1 ]" 1
1272 1 94 LEU HA 1 94 LEU MD2 3.000 . 3.300 1.758 1.666 1.814 0.134 1 0 "[ . 1 ]" 1
1273 1 94 LEU HA 1 94 LEU HG 4.000 . 4.300 2.598 2.503 2.760 . 0 0 "[ . 1 ]" 1
1274 1 94 LEU HA 1 95 ASP H 4.000 . 4.300 2.973 2.902 3.015 . 0 0 "[ . 1 ]" 1
1275 1 94 LEU HB3 1 94 LEU MD1 3.000 . 3.300 2.540 2.489 2.595 . 0 0 "[ . 1 ]" 1
1276 1 94 LEU HB3 1 94 LEU MD2 3.000 . 3.300 2.157 2.107 2.227 . 0 0 "[ . 1 ]" 1
1277 1 94 LEU MD2 1 95 ASP H 5.000 . 5.300 4.402 4.347 4.443 . 0 0 "[ . 1 ]" 1
1278 1 95 ASP H 1 95 ASP QB 3.000 . 3.300 2.404 1.936 2.565 . 0 0 "[ . 1 ]" 1
1279 1 95 ASP HA 1 96 GLY H 3.000 . 3.300 2.272 2.232 2.310 . 0 0 "[ . 1 ]" 1
1280 1 95 ASP HA 1 97 ILE H 4.000 . 4.300 3.831 3.682 4.153 . 0 0 "[ . 1 ]" 1
1281 1 95 ASP HB2 1 96 GLY H 4.000 . 4.300 3.926 3.808 4.210 . 0 0 "[ . 1 ]" 1
1282 1 95 ASP HB3 1 96 GLY H 5.000 . 5.300 4.558 4.485 4.690 . 0 0 "[ . 1 ]" 1
1283 1 96 GLY H 1 97 ILE H 3.000 . 3.300 1.882 1.832 2.079 . 0 0 "[ . 1 ]" 1
1284 1 96 GLY H 1 97 ILE HB 5.000 . 5.300 4.283 3.933 4.426 . 0 0 "[ . 1 ]" 1
1285 1 96 GLY H 1 97 ILE MG 5.000 . 5.300 2.777 2.657 3.174 . 0 0 "[ . 1 ]" 1
1286 1 96 GLY HA2 1 97 ILE H 4.000 . 4.300 3.060 3.018 3.107 . 0 0 "[ . 1 ]" 1
1287 1 96 GLY HA3 1 97 ILE H 4.000 . 4.300 3.449 3.392 3.543 . 0 0 "[ . 1 ]" 1
1288 1 97 ILE H 1 97 ILE HB 3.000 . 3.300 2.682 2.330 2.777 . 0 0 "[ . 1 ]" 1
1289 1 97 ILE H 1 97 ILE MD 4.000 . 4.300 3.948 3.910 3.965 . 0 0 "[ . 1 ]" 1
1290 1 97 ILE H 1 97 ILE MG 3.000 . 3.300 1.745 1.720 1.831 0.080 3 0 "[ . 1 ]" 1
1291 1 97 ILE H 1 98 VAL H 5.000 . 5.300 4.595 4.583 4.604 . 0 0 "[ . 1 ]" 1
1292 1 97 ILE HA 1 97 ILE MD 4.000 . 4.300 2.080 1.834 3.483 . 0 0 "[ . 1 ]" 1
1293 1 97 ILE HA 1 98 VAL H 3.000 . 3.300 2.195 2.164 2.296 . 0 0 "[ . 1 ]" 1
1294 1 97 ILE HB 1 97 ILE MD 3.000 . 3.300 2.359 1.861 2.495 . 0 0 "[ . 1 ]" 1
1295 1 97 ILE HB 1 98 VAL H 5.000 . 5.300 3.931 3.796 4.024 . 0 0 "[ . 1 ]" 1
1296 1 97 ILE MD 1 98 VAL H 4.000 . 4.300 1.978 1.667 3.629 0.133 9 0 "[ . 1 ]" 1
1297 1 97 ILE QG 1 98 VAL H 4.000 . 4.300 3.132 1.823 3.516 . 0 0 "[ . 1 ]" 1
1298 1 97 ILE MG 1 98 VAL H 5.000 . 5.300 4.079 3.504 4.198 . 0 0 "[ . 1 ]" 1
1299 1 98 VAL H 1 98 VAL MG1 5.000 2.800 5.300 3.823 3.788 3.898 . 0 0 "[ . 1 ]" 1
1300 1 98 VAL H 1 98 VAL MG2 3.000 . 3.300 2.194 2.016 2.509 . 0 0 "[ . 1 ]" 1
1301 1 98 VAL HA 1 98 VAL MG1 3.000 . 3.300 2.150 2.081 2.289 . 0 0 "[ . 1 ]" 1
1302 1 98 VAL HA 1 98 VAL MG2 3.000 . 3.300 2.573 2.496 2.609 . 0 0 "[ . 1 ]" 1
1303 1 98 VAL HA 1 99 VAL H 3.000 . 3.300 2.275 2.249 2.303 . 0 0 "[ . 1 ]" 1
1304 1 98 VAL HA 1 99 VAL MG2 5.000 . 5.300 3.336 3.266 3.371 . 0 0 "[ . 1 ]" 1
1305 1 98 VAL HB 1 99 VAL H 5.000 . 5.300 4.248 4.221 4.284 . 0 0 "[ . 1 ]" 1
1306 1 98 VAL MG1 1 99 VAL H 4.000 . 4.300 3.252 3.090 3.371 . 0 0 "[ . 1 ]" 1
1307 1 98 VAL MG2 1 99 VAL H 5.000 . 5.300 4.435 4.401 4.457 . 0 0 "[ . 1 ]" 1
1308 1 99 VAL H 1 99 VAL MG1 4.000 . 4.300 3.689 3.676 3.699 . 0 0 "[ . 1 ]" 1
1309 1 99 VAL H 1 99 VAL MG2 3.000 . 3.300 1.791 1.747 1.848 0.053 4 0 "[ . 1 ]" 1
1310 1 99 VAL H 1 100 ASP H 5.000 2.800 5.300 4.591 4.572 4.623 . 0 0 "[ . 1 ]" 1
1311 1 99 VAL HA 1 99 VAL MG1 3.000 . 3.300 1.849 1.825 1.877 . 0 0 "[ . 1 ]" 1
1312 1 99 VAL HA 1 99 VAL MG2 3.000 . 3.300 2.767 2.729 2.788 . 0 0 "[ . 1 ]" 1
1313 1 99 VAL HA 1 100 ASP H 3.000 . 3.300 2.328 2.304 2.410 . 0 0 "[ . 1 ]" 1
1314 1 99 VAL HB 1 100 ASP H 3.000 . 3.300 3.317 3.264 3.352 0.052 9 0 "[ . 1 ]" 1
1315 1 99 VAL MG1 1 100 ASP H 4.000 . 4.300 2.463 2.342 2.532 . 0 0 "[ . 1 ]" 1
1316 1 100 ASP H 1 100 ASP QB 3.000 . 3.300 2.262 2.238 2.286 . 0 0 "[ . 1 ]" 1
1317 1 100 ASP HA 1 101 VAL H 3.000 . 3.300 2.152 2.143 2.174 . 0 0 "[ . 1 ]" 1
1318 1 100 ASP HA 1 101 VAL HB 5.000 . 5.300 4.390 4.336 4.497 . 0 0 "[ . 1 ]" 1
1319 1 100 ASP HA 1 101 VAL MG2 4.000 . 4.300 3.599 3.527 3.657 . 0 0 "[ . 1 ]" 1
1320 1 100 ASP QB 1 101 VAL H 4.000 . 4.300 3.538 3.441 3.680 . 0 0 "[ . 1 ]" 1
1321 1 100 ASP HB2 1 101 VAL H 4.000 . 4.300 4.512 4.467 4.559 0.259 5 0 "[ . 1 ]" 1
1322 1 101 VAL H 1 101 VAL HB 3.000 . 3.300 2.302 2.271 2.392 . 0 0 "[ . 1 ]" 1
1323 1 101 VAL H 1 101 VAL MG1 4.000 . 4.300 3.696 3.679 3.748 . 0 0 "[ . 1 ]" 1
1324 1 101 VAL H 1 102 PRO QD 5.000 . 5.300 4.236 4.152 4.317 . 0 0 "[ . 1 ]" 1
1325 1 101 VAL HA 1 101 VAL MG1 3.000 . 3.300 2.451 2.366 2.488 . 0 0 "[ . 1 ]" 1
1326 1 101 VAL HA 1 101 VAL MG2 3.000 . 3.300 2.331 2.301 2.417 . 0 0 "[ . 1 ]" 1
1327 1 101 VAL HA 1 102 PRO HD2 3.000 . 3.300 2.352 2.052 2.627 . 0 0 "[ . 1 ]" 1
1328 1 101 VAL HA 1 102 PRO HD3 3.000 . 3.300 1.968 1.796 2.194 0.004 9 0 "[ . 1 ]" 1
1329 1 101 VAL MG1 1 102 PRO HD2 4.000 . 4.300 2.204 1.924 2.545 . 0 0 "[ . 1 ]" 1
1330 1 101 VAL MG1 1 102 PRO HD3 5.000 . 5.300 3.280 2.887 3.718 . 0 0 "[ . 1 ]" 1
1331 1 101 VAL MG2 1 102 PRO HD2 5.000 . 5.300 3.598 3.447 3.729 . 0 0 "[ . 1 ]" 1
1332 1 101 VAL MG2 1 102 PRO HD3 5.000 . 5.300 3.833 3.545 4.112 . 0 0 "[ . 1 ]" 1
1333 1 102 PRO HA 1 103 ASP H 3.000 . 3.300 2.473 2.429 2.521 . 0 0 "[ . 1 ]" 1
1334 1 102 PRO HA 1 104 ARG H 4.000 . 4.300 4.051 3.956 4.146 . 0 0 "[ . 1 ]" 1
1335 1 102 PRO QB 1 103 ASP H 4.000 . 4.300 2.458 2.250 2.626 . 0 0 "[ . 1 ]" 1
1336 1 102 PRO QB 1 104 ARG H 5.000 . 5.300 2.180 1.984 2.256 . 0 0 "[ . 1 ]" 1
1337 1 102 PRO HB3 1 105 GLN HA 5.000 . 5.300 5.454 5.411 5.574 0.274 5 0 "[ . 1 ]" 1
1338 1 103 ASP H 1 104 ARG H 4.000 . 4.300 2.225 2.177 2.326 . 0 0 "[ . 1 ]" 1
1339 1 103 ASP HA 1 104 ARG H 4.000 . 4.300 3.448 3.411 3.465 . 0 0 "[ . 1 ]" 1
1340 1 103 ASP HA 1 104 ARG HE 5.000 . 5.300 5.339 5.268 5.419 0.119 11 0 "[ . 1 ]" 1
1341 1 103 ASP QB 1 104 ARG H 4.000 . 4.300 3.141 2.930 3.637 . 0 0 "[ . 1 ]" 1
1342 1 104 ARG H 1 104 ARG QD 5.000 . 5.300 4.273 3.557 4.763 . 0 0 "[ . 1 ]" 1
1343 1 104 ARG H 1 105 GLN HA 4.000 . 4.300 4.551 4.507 4.596 0.296 11 0 "[ . 1 ]" 1
1344 1 104 ARG HA 1 104 ARG QD 4.000 . 4.300 3.583 2.419 3.803 . 0 0 "[ . 1 ]" 1
1345 1 104 ARG HA 1 104 ARG HE 5.000 . 5.300 2.234 1.815 4.001 . 0 0 "[ . 1 ]" 1
1346 1 104 ARG HA 1 105 GLN H 3.000 . 3.300 2.486 2.407 2.551 . 0 0 "[ . 1 ]" 1
1347 1 104 ARG QB 1 104 ARG QD 3.000 . 3.300 2.369 2.291 2.673 . 0 0 "[ . 1 ]" 1
1348 1 104 ARG QB 1 104 ARG HE 4.000 . 4.300 2.102 1.673 2.327 0.127 5 0 "[ . 1 ]" 1
1349 1 104 ARG QG 1 105 GLN H 5.000 . 5.300 4.397 3.924 4.693 . 0 0 "[ . 1 ]" 1
1350 1 105 GLN H 1 106 TRP H 3.000 . 3.300 3.380 3.221 3.486 0.186 2 0 "[ . 1 ]" 1
1351 1 105 GLN HA 1 106 TRP H 4.000 . 4.300 2.693 2.567 2.780 . 0 0 "[ . 1 ]" 1
1352 1 105 GLN HA 1 106 TRP QB 5.000 . 5.300 4.652 4.496 4.695 . 0 0 "[ . 1 ]" 1
1353 1 106 TRP H 1 106 TRP HD1 5.000 . 5.300 2.873 2.555 3.049 . 0 0 "[ . 1 ]" 1
1354 1 106 TRP HA 1 106 TRP HE3 3.000 . 3.300 3.456 3.377 3.579 0.279 9 0 "[ . 1 ]" 1
1355 1 106 TRP QB 1 106 TRP HZ3 5.000 . 5.300 4.861 4.798 4.887 . 0 0 "[ . 1 ]" 1
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