NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
404554 |
1x37   |
6615 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1x37
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 917
_Distance_constraint_stats_list.Viol_count 1124
_Distance_constraint_stats_list.Viol_total 697.978
_Distance_constraint_stats_list.Viol_max 0.257
_Distance_constraint_stats_list.Viol_rms 0.0142
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0030
_Distance_constraint_stats_list.Viol_average_violations_only 0.0388
_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 2 ALA 0.085 0.070 11 0 "[ . 1 . ]"
1 3 GLY 0.317 0.173 13 0 "[ . 1 . ]"
1 4 TYR 0.431 0.173 13 0 "[ . 1 . ]"
1 5 THR 0.191 0.066 10 0 "[ . 1 . ]"
1 6 GLU 0.352 0.099 11 0 "[ . 1 . ]"
1 7 ILE 1.039 0.150 4 0 "[ . 1 . ]"
1 8 GLU 0.384 0.066 10 0 "[ . 1 . ]"
1 9 LYS 1.651 0.082 12 0 "[ . 1 . ]"
1 10 LEU 0.955 0.062 11 0 "[ . 1 . ]"
1 11 GLU 0.358 0.061 11 0 "[ . 1 . ]"
1 12 ILE 4.009 0.107 2 0 "[ . 1 . ]"
1 13 VAL 3.566 0.139 14 0 "[ . 1 . ]"
1 14 LYS 3.049 0.202 12 0 "[ . 1 . ]"
1 15 ASP 0.195 0.061 11 0 "[ . 1 . ]"
1 16 HIS 5.050 0.202 12 0 "[ . 1 . ]"
1 17 LEU 2.071 0.139 14 0 "[ . 1 . ]"
1 18 LEU 0.293 0.046 8 0 "[ . 1 . ]"
1 19 PRO 0.294 0.074 2 0 "[ . 1 . ]"
1 20 LYS 0.506 0.047 2 0 "[ . 1 . ]"
1 21 GLN 1.499 0.094 15 0 "[ . 1 . ]"
1 22 ILE 0.205 0.050 14 0 "[ . 1 . ]"
1 23 LYS 3.945 0.151 14 0 "[ . 1 . ]"
1 24 GLU 0.586 0.063 16 0 "[ . 1 . ]"
1 25 HIS 3.684 0.115 4 0 "[ . 1 . ]"
1 26 GLY 0.000 0.000 . 0 "[ . 1 . ]"
1 27 LEU 2.172 0.151 14 0 "[ . 1 . ]"
1 28 LYS 0.814 0.085 14 0 "[ . 1 . ]"
1 29 LYS 0.029 0.029 2 0 "[ . 1 . ]"
1 30 SER 0.349 0.042 12 0 "[ . 1 . ]"
1 31 ASN 0.320 0.042 12 0 "[ . 1 . ]"
1 32 LEU 0.432 0.142 13 0 "[ . 1 . ]"
1 33 GLN 1.468 0.084 16 0 "[ . 1 . ]"
1 34 LEU 1.240 0.250 3 0 "[ . 1 . ]"
1 35 ARG 0.949 0.078 5 0 "[ . 1 . ]"
1 36 ASP 0.056 0.025 9 0 "[ . 1 . ]"
1 37 GLN 0.225 0.060 1 0 "[ . 1 . ]"
1 38 ALA 0.249 0.037 11 0 "[ . 1 . ]"
1 39 ILE 0.061 0.033 3 0 "[ . 1 . ]"
1 40 LEU 1.032 0.073 10 0 "[ . 1 . ]"
1 41 ASP 1.386 0.073 10 0 "[ . 1 . ]"
1 42 ILE 0.403 0.088 13 0 "[ . 1 . ]"
1 43 ILE 0.486 0.111 13 0 "[ . 1 . ]"
1 44 ARG 0.111 0.038 6 0 "[ . 1 . ]"
1 45 TYR 0.343 0.055 12 0 "[ . 1 . ]"
1 46 TYR 0.349 0.110 13 0 "[ . 1 . ]"
1 47 THR 0.836 0.110 13 0 "[ . 1 . ]"
1 48 ARG 0.498 0.082 4 0 "[ . 1 . ]"
1 49 GLU 0.190 0.083 2 0 "[ . 1 . ]"
1 50 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 51 GLY 0.166 0.045 1 0 "[ . 1 . ]"
1 52 VAL 1.795 0.097 3 0 "[ . 1 . ]"
1 53 ARG 0.447 0.043 14 0 "[ . 1 . ]"
1 54 SER 1.099 0.076 2 0 "[ . 1 . ]"
1 55 LEU 1.913 0.076 2 0 "[ . 1 . ]"
1 56 GLU 0.697 0.069 15 0 "[ . 1 . ]"
1 57 ARG 1.324 0.051 16 0 "[ . 1 . ]"
1 58 GLN 0.468 0.044 8 0 "[ . 1 . ]"
1 59 LEU 2.317 0.100 3 0 "[ . 1 . ]"
1 60 ALA 1.197 0.069 15 0 "[ . 1 . ]"
1 61 ALA 2.294 0.100 3 0 "[ . 1 . ]"
1 62 ILE 1.986 0.126 16 0 "[ . 1 . ]"
1 63 CYS 1.259 0.126 16 0 "[ . 1 . ]"
1 64 ARG 0.442 0.032 11 0 "[ . 1 . ]"
1 65 LYS 0.810 0.081 12 0 "[ . 1 . ]"
1 66 ALA 0.918 0.070 16 0 "[ . 1 . ]"
1 67 ALA 0.458 0.064 11 0 "[ . 1 . ]"
1 68 LYS 0.894 0.045 3 0 "[ . 1 . ]"
1 69 ALA 0.910 0.060 2 0 "[ . 1 . ]"
1 70 ILE 0.330 0.060 2 0 "[ . 1 . ]"
1 71 VAL 0.404 0.047 16 0 "[ . 1 . ]"
1 72 ALA 0.109 0.047 16 0 "[ . 1 . ]"
1 73 GLU 0.057 0.038 11 0 "[ . 1 . ]"
1 76 LYS 0.023 0.023 9 0 "[ . 1 . ]"
1 77 ARG 0.069 0.046 11 0 "[ . 1 . ]"
1 78 ILE 0.774 0.058 3 0 "[ . 1 . ]"
1 79 THR 0.404 0.079 16 0 "[ . 1 . ]"
1 80 VAL 0.960 0.084 16 0 "[ . 1 . ]"
1 81 THR 0.119 0.043 15 0 "[ . 1 . ]"
1 82 GLU 0.311 0.061 4 0 "[ . 1 . ]"
1 83 LYS 0.378 0.081 4 0 "[ . 1 . ]"
1 84 ASN 0.426 0.055 13 0 "[ . 1 . ]"
1 85 LEU 1.009 0.257 10 0 "[ . 1 . ]"
1 86 GLN 0.202 0.061 4 0 "[ . 1 . ]"
1 87 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 88 PHE 0.420 0.055 13 0 "[ . 1 . ]"
1 89 ILE 2.428 0.158 15 0 "[ . 1 . ]"
1 90 GLY 0.082 0.045 13 0 "[ . 1 . ]"
1 91 LYS 0.082 0.045 13 0 "[ . 1 . ]"
1 92 ARG 0.028 0.028 8 0 "[ . 1 . ]"
1 93 ILE 0.073 0.028 8 0 "[ . 1 . ]"
1 94 PHE 0.147 0.043 13 0 "[ . 1 . ]"
1 95 ARG 0.152 0.086 3 0 "[ . 1 . ]"
1 96 TYR 0.062 0.042 7 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 2 ALA H 1 3 GLY H 2.000 . 4.200 3.187 2.071 4.201 0.001 7 0 "[ . 1 . ]" 1
2 1 2 ALA HA 1 3 GLY H 2.000 . 3.500 2.667 2.205 3.570 0.070 11 0 "[ . 1 . ]" 1
3 1 2 ALA MB 1 3 GLY H 2.000 . 5.200 3.397 1.834 3.731 . 0 0 "[ . 1 . ]" 1
4 1 3 GLY H 1 4 TYR H 2.000 . 4.800 2.540 1.744 3.276 0.056 13 0 "[ . 1 . ]" 1
5 1 3 GLY H 1 4 TYR HA 2.000 . 4.200 4.169 4.082 4.373 0.173 13 0 "[ . 1 . ]" 1
6 1 3 GLY QA 1 4 TYR H 2.000 . 4.000 2.546 2.259 2.877 . 0 0 "[ . 1 . ]" 1
7 1 4 TYR H 1 4 TYR QB 2.000 . 4.500 2.376 2.224 2.574 . 0 0 "[ . 1 . ]" 1
8 1 4 TYR H 1 4 TYR QD 2.000 . 5.500 2.563 1.798 4.162 0.002 8 0 "[ . 1 . ]" 1
9 1 4 TYR H 1 5 THR H 2.000 . 5.000 4.469 3.901 4.662 . 0 0 "[ . 1 . ]" 1
10 1 4 TYR H 1 5 THR MG 2.000 . 6.000 4.624 4.084 4.823 . 0 0 "[ . 1 . ]" 1
11 1 4 TYR HA 1 4 TYR QD 2.000 . 5.500 3.155 2.266 3.691 . 0 0 "[ . 1 . ]" 1
12 1 4 TYR HA 1 5 THR H 2.000 . 2.800 2.286 2.182 2.690 . 0 0 "[ . 1 . ]" 1
13 1 4 TYR HA 1 5 THR MG 2.000 . 7.000 3.586 3.264 4.138 . 0 0 "[ . 1 . ]" 1
14 1 4 TYR HA 1 8 GLU H 2.000 . 5.500 5.078 4.361 5.528 0.028 1 0 "[ . 1 . ]" 1
15 1 4 TYR HA 1 8 GLU QB 2.000 . 6.000 2.945 2.235 3.395 . 0 0 "[ . 1 . ]" 1
16 1 4 TYR HA 1 9 LYS H 2.000 . 5.200 4.967 4.367 5.241 0.041 8 0 "[ . 1 . ]" 1
17 1 4 TYR QB 1 4 TYR QD 2.000 . 6.500 2.157 2.149 2.199 . 0 0 "[ . 1 . ]" 1
18 1 4 TYR QB 1 5 THR H 2.000 . 4.500 3.232 2.196 4.083 . 0 0 "[ . 1 . ]" 1
19 1 4 TYR QB 1 8 GLU H 2.000 . 7.000 5.277 4.548 6.238 . 0 0 "[ . 1 . ]" 1
20 1 4 TYR QB 1 9 LYS H 2.000 . 6.500 4.032 3.364 5.707 . 0 0 "[ . 1 . ]" 1
21 1 4 TYR QD 1 5 THR H 2.000 . 6.000 3.631 2.097 4.429 . 0 0 "[ . 1 . ]" 1
22 1 4 TYR QD 1 8 GLU QB 2.000 . 6.000 3.033 2.306 3.234 . 0 0 "[ . 1 . ]" 1
23 1 4 TYR QD 1 9 LYS QG 2.000 . 6.000 2.781 2.247 4.163 . 0 0 "[ . 1 . ]" 1
24 1 4 TYR QD 1 12 ILE MD 2.000 . 7.500 3.813 3.174 4.516 . 0 0 "[ . 1 . ]" 1
25 1 4 TYR QD 1 51 GLY H 2.000 . 7.000 6.128 4.881 6.523 . 0 0 "[ . 1 . ]" 1
26 1 4 TYR QD 1 51 GLY QA 2.000 . 6.000 4.296 3.428 4.862 . 0 0 "[ . 1 . ]" 1
27 1 4 TYR QD 1 52 VAL H 2.000 . 7.000 4.195 3.568 4.949 . 0 0 "[ . 1 . ]" 1
28 1 4 TYR QE 1 8 GLU QB 2.000 . 6.500 4.751 3.702 5.233 . 0 0 "[ . 1 . ]" 1
29 1 4 TYR QE 1 9 LYS QG 2.000 . 6.000 3.419 2.314 4.834 . 0 0 "[ . 1 . ]" 1
30 1 4 TYR QE 1 12 ILE MD 2.000 . 7.000 4.274 2.563 5.401 . 0 0 "[ . 1 . ]" 1
31 1 4 TYR QE 1 51 GLY QA 2.000 . 5.500 3.156 2.291 4.262 . 0 0 "[ . 1 . ]" 1
32 1 4 TYR QE 1 52 VAL H 2.000 . 6.500 3.357 2.293 4.197 . 0 0 "[ . 1 . ]" 1
33 1 5 THR H 1 5 THR MG 2.000 . 5.500 2.482 1.779 3.279 0.021 11 0 "[ . 1 . ]" 1
34 1 5 THR H 1 8 GLU H 2.000 . 4.500 3.309 2.651 3.943 . 0 0 "[ . 1 . ]" 1
35 1 5 THR H 1 8 GLU HA 2.000 . 5.500 4.867 4.238 5.491 . 0 0 "[ . 1 . ]" 1
36 1 5 THR H 1 8 GLU QB 2.000 . 4.500 2.142 1.734 2.616 0.066 10 0 "[ . 1 . ]" 1
37 1 5 THR H 1 8 GLU QG 2.000 . 5.500 3.170 2.204 4.188 . 0 0 "[ . 1 . ]" 1
38 1 5 THR H 1 9 LYS H 2.000 . 5.000 3.868 2.796 4.469 . 0 0 "[ . 1 . ]" 1
39 1 5 THR HA 1 6 GLU H 2.000 . 3.200 2.539 2.278 3.065 . 0 0 "[ . 1 . ]" 1
40 1 5 THR HA 1 7 ILE H 2.000 . 5.000 4.589 4.209 5.002 0.002 11 0 "[ . 1 . ]" 1
41 1 5 THR HB 1 6 GLU H 2.000 . 3.500 2.541 2.024 3.299 . 0 0 "[ . 1 . ]" 1
42 1 5 THR HB 1 7 ILE H 2.000 . 5.000 3.441 2.828 4.716 . 0 0 "[ . 1 . ]" 1
43 1 5 THR MG 1 6 GLU H 2.000 . 5.500 3.689 2.072 4.153 . 0 0 "[ . 1 . ]" 1
44 1 6 GLU H 1 6 GLU QB 2.000 . 4.500 2.526 2.090 2.854 . 0 0 "[ . 1 . ]" 1
45 1 6 GLU H 1 6 GLU QG 2.000 . 5.500 2.393 1.701 4.088 0.099 11 0 "[ . 1 . ]" 1
46 1 6 GLU H 1 7 ILE H 2.000 . 3.500 2.907 2.495 3.063 . 0 0 "[ . 1 . ]" 1
47 1 6 GLU HA 1 7 ILE H 2.000 . 4.000 3.570 3.551 3.589 . 0 0 "[ . 1 . ]" 1
48 1 6 GLU HA 1 9 LYS H 2.000 . 4.200 3.807 3.471 4.028 . 0 0 "[ . 1 . ]" 1
49 1 6 GLU QB 1 7 ILE H 2.000 . 4.500 2.646 2.211 3.375 . 0 0 "[ . 1 . ]" 1
50 1 6 GLU QG 1 7 ILE H 2.000 . 6.000 3.501 1.760 4.418 0.040 13 0 "[ . 1 . ]" 1
51 1 6 GLU O 1 10 LEU H 2.000 . 2.100 2.070 1.927 2.122 0.022 11 0 "[ . 1 . ]" 1
52 1 6 GLU O 1 10 LEU N 3.000 2.800 3.100 2.988 2.818 3.065 . 0 0 "[ . 1 . ]" 1
53 1 7 ILE H 1 7 ILE HB 2.000 . 3.500 2.792 2.434 3.571 0.071 11 0 "[ . 1 . ]" 1
54 1 7 ILE H 1 7 ILE MD 2.000 . 5.000 3.082 1.650 3.580 0.150 4 0 "[ . 1 . ]" 1
55 1 7 ILE H 1 7 ILE QG 2.000 . 3.500 2.039 1.745 3.178 0.055 6 0 "[ . 1 . ]" 1
56 1 7 ILE H 1 7 ILE MG 2.000 . 5.500 3.492 1.791 3.774 0.009 11 0 "[ . 1 . ]" 1
57 1 7 ILE H 1 8 GLU H 2.000 . 3.500 2.922 2.676 3.084 . 0 0 "[ . 1 . ]" 1
58 1 7 ILE H 1 9 LYS H 2.000 . 5.000 4.562 4.340 4.925 . 0 0 "[ . 1 . ]" 1
59 1 7 ILE H 1 10 LEU H 2.000 . 5.300 4.786 4.624 4.911 . 0 0 "[ . 1 . ]" 1
60 1 7 ILE HA 1 7 ILE MD 2.000 . 5.000 3.491 2.068 4.143 . 0 0 "[ . 1 . ]" 1
61 1 7 ILE HA 1 7 ILE QG 2.000 . 5.000 2.687 2.319 3.282 . 0 0 "[ . 1 . ]" 1
62 1 7 ILE HA 1 7 ILE MG 2.000 . 6.000 2.313 2.199 2.504 . 0 0 "[ . 1 . ]" 1
63 1 7 ILE HA 1 8 GLU H 2.000 . 4.200 3.585 3.555 3.597 . 0 0 "[ . 1 . ]" 1
64 1 7 ILE HA 1 10 LEU H 2.000 . 3.500 3.511 3.452 3.562 0.062 11 0 "[ . 1 . ]" 1
65 1 7 ILE HA 1 10 LEU QB 2.000 . 4.000 2.675 2.320 2.902 . 0 0 "[ . 1 . ]" 1
66 1 7 ILE HB 1 8 GLU H 2.000 . 4.500 2.466 2.110 3.939 . 0 0 "[ . 1 . ]" 1
67 1 7 ILE MD 1 8 GLU H 2.000 . 5.500 3.962 2.868 4.592 . 0 0 "[ . 1 . ]" 1
68 1 7 ILE QG 1 8 GLU H 2.000 . 6.000 3.513 1.790 4.310 0.010 6 0 "[ . 1 . ]" 1
69 1 7 ILE MG 1 8 GLU H 2.000 . 6.500 3.320 2.897 4.057 . 0 0 "[ . 1 . ]" 1
70 1 7 ILE O 1 11 GLU H 2.000 . 2.100 1.931 1.796 2.132 0.032 10 0 "[ . 1 . ]" 1
71 1 7 ILE O 1 11 GLU N 3.000 2.800 3.100 2.882 2.756 3.062 0.044 11 0 "[ . 1 . ]" 1
72 1 8 GLU H 1 8 GLU QB 2.000 . 4.000 2.301 2.163 2.450 . 0 0 "[ . 1 . ]" 1
73 1 8 GLU H 1 8 GLU QG 2.000 . 4.500 3.003 2.158 4.084 . 0 0 "[ . 1 . ]" 1
74 1 8 GLU H 1 9 LYS H 2.000 . 3.500 3.037 2.910 3.157 . 0 0 "[ . 1 . ]" 1
75 1 8 GLU H 1 10 LEU H 2.000 . 5.000 4.218 4.023 4.407 . 0 0 "[ . 1 . ]" 1
76 1 8 GLU HA 1 9 LYS H 2.000 . 5.000 3.584 3.576 3.588 . 0 0 "[ . 1 . ]" 1
77 1 8 GLU HA 1 10 LEU H 2.000 . 5.500 4.350 4.221 4.466 . 0 0 "[ . 1 . ]" 1
78 1 8 GLU QB 1 9 LYS H 2.000 . 4.500 2.252 1.933 2.438 . 0 0 "[ . 1 . ]" 1
79 1 8 GLU O 1 12 ILE H 2.000 . 2.100 2.041 1.852 2.140 0.040 1 0 "[ . 1 . ]" 1
80 1 8 GLU O 1 12 ILE N 3.000 2.800 3.100 2.990 2.811 3.107 0.007 11 0 "[ . 1 . ]" 1
81 1 9 LYS H 1 9 LYS QB 2.000 . 4.800 2.411 2.074 2.909 . 0 0 "[ . 1 . ]" 1
82 1 9 LYS H 1 9 LYS QD 2.000 . 4.500 3.834 2.590 4.143 . 0 0 "[ . 1 . ]" 1
83 1 9 LYS H 1 9 LYS QG 2.000 . 4.200 2.496 1.742 3.995 0.058 11 0 "[ . 1 . ]" 1
84 1 9 LYS H 1 10 LEU H 2.000 . 3.500 2.923 2.841 2.987 . 0 0 "[ . 1 . ]" 1
85 1 9 LYS H 1 12 ILE MD 2.000 . 6.500 3.934 3.628 4.062 . 0 0 "[ . 1 . ]" 1
86 1 9 LYS HA 1 9 LYS QG 2.000 . 5.000 2.346 2.161 3.169 . 0 0 "[ . 1 . ]" 1
87 1 9 LYS HA 1 10 LEU H 2.000 . 5.000 3.570 3.553 3.586 . 0 0 "[ . 1 . ]" 1
88 1 9 LYS HA 1 12 ILE H 2.000 . 4.200 3.814 3.689 4.042 . 0 0 "[ . 1 . ]" 1
89 1 9 LYS HA 1 12 ILE HB 2.000 . 4.500 4.547 4.476 4.574 0.074 5 0 "[ . 1 . ]" 1
90 1 9 LYS HA 1 12 ILE MD 2.000 . 7.000 2.105 2.019 2.142 . 0 0 "[ . 1 . ]" 1
91 1 9 LYS HA 1 12 ILE QG 2.000 . 8.000 2.277 2.216 2.354 . 0 0 "[ . 1 . ]" 1
92 1 9 LYS HA 1 12 ILE MG 2.000 . 7.500 4.600 4.549 4.706 . 0 0 "[ . 1 . ]" 1
93 1 9 LYS QB 1 10 LEU H 2.000 . 5.000 2.628 2.513 3.129 . 0 0 "[ . 1 . ]" 1
94 1 9 LYS QG 1 10 LEU H 2.000 . 5.500 4.029 2.305 4.408 . 0 0 "[ . 1 . ]" 1
95 1 9 LYS QG 1 12 ILE MD 2.000 . 7.500 3.032 2.723 4.300 . 0 0 "[ . 1 . ]" 1
96 1 9 LYS O 1 13 VAL H 2.000 . 2.100 2.021 1.958 2.108 0.008 5 0 "[ . 1 . ]" 1
97 1 9 LYS O 1 13 VAL N 3.000 2.800 3.100 2.761 2.718 2.856 0.082 12 0 "[ . 1 . ]" 1
98 1 10 LEU H 1 10 LEU QB 2.000 . 4.200 2.220 2.084 2.408 . 0 0 "[ . 1 . ]" 1
99 1 10 LEU H 1 10 LEU QD 2.000 . 6.500 3.291 2.016 3.777 . 0 0 "[ . 1 . ]" 1
100 1 10 LEU H 1 11 GLU H 2.000 . 3.000 2.729 2.632 2.974 . 0 0 "[ . 1 . ]" 1
101 1 10 LEU HA 1 10 LEU QD 2.000 . 7.000 2.216 1.924 2.992 . 0 0 "[ . 1 . ]" 1
102 1 10 LEU HA 1 11 GLU H 2.000 . 5.000 3.568 3.557 3.596 . 0 0 "[ . 1 . ]" 1
103 1 10 LEU HA 1 13 VAL H 2.000 . 4.200 4.223 4.195 4.249 0.049 8 0 "[ . 1 . ]" 1
104 1 10 LEU QB 1 11 GLU H 2.000 . 4.500 2.483 2.100 2.697 . 0 0 "[ . 1 . ]" 1
105 1 10 LEU QD 1 11 GLU H 2.000 . 6.500 3.748 3.244 4.085 . 0 0 "[ . 1 . ]" 1
106 1 10 LEU O 1 14 LYS H 2.000 . 2.100 2.115 2.096 2.130 0.030 7 0 "[ . 1 . ]" 1
107 1 10 LEU O 1 14 LYS N 3.000 2.800 3.100 2.992 2.961 3.046 . 0 0 "[ . 1 . ]" 1
108 1 11 GLU H 1 11 GLU QB 2.000 . 4.500 2.281 2.060 2.699 . 0 0 "[ . 1 . ]" 1
109 1 11 GLU H 1 11 GLU QG 2.000 . 5.500 3.305 1.753 4.085 0.047 10 0 "[ . 1 . ]" 1
110 1 11 GLU H 1 12 ILE H 2.000 . 3.500 2.939 2.846 3.113 . 0 0 "[ . 1 . ]" 1
111 1 11 GLU HA 1 12 ILE H 2.000 . 4.200 3.591 3.584 3.603 . 0 0 "[ . 1 . ]" 1
112 1 11 GLU HA 1 14 LYS H 2.000 . 4.500 4.148 3.936 4.310 . 0 0 "[ . 1 . ]" 1
113 1 11 GLU HA 1 15 ASP H 2.000 . 5.000 4.147 3.873 4.407 . 0 0 "[ . 1 . ]" 1
114 1 11 GLU QB 1 13 VAL H 2.000 . 6.500 4.937 4.701 5.535 . 0 0 "[ . 1 . ]" 1
115 1 11 GLU QB 1 15 ASP H 2.000 . 6.500 5.088 4.703 5.410 . 0 0 "[ . 1 . ]" 1
116 1 11 GLU QG 1 12 ILE H 2.000 . 5.500 3.745 1.782 4.446 0.018 10 0 "[ . 1 . ]" 1
117 1 11 GLU O 1 15 ASP H 2.000 . 2.100 2.044 1.829 2.161 0.061 11 0 "[ . 1 . ]" 1
118 1 11 GLU O 1 15 ASP N 3.000 2.800 3.100 2.956 2.791 3.070 0.009 6 0 "[ . 1 . ]" 1
119 1 12 ILE H 1 12 ILE HB 2.000 . 4.000 3.537 3.524 3.563 . 0 0 "[ . 1 . ]" 1
120 1 12 ILE H 1 12 ILE MD 2.000 . 5.500 3.492 3.462 3.532 . 0 0 "[ . 1 . ]" 1
121 1 12 ILE H 1 12 ILE QG 2.000 . 4.500 1.768 1.734 1.821 0.066 1 0 "[ . 1 . ]" 1
122 1 12 ILE H 1 12 ILE MG 2.000 . 6.000 2.824 2.719 2.891 . 0 0 "[ . 1 . ]" 1
123 1 12 ILE H 1 13 VAL H 2.000 . 3.500 2.908 2.843 3.039 . 0 0 "[ . 1 . ]" 1
124 1 12 ILE HA 1 12 ILE MD 2.000 . 5.500 4.130 4.115 4.134 . 0 0 "[ . 1 . ]" 1
125 1 12 ILE HA 1 12 ILE QG 2.000 . 4.000 3.241 3.222 3.252 . 0 0 "[ . 1 . ]" 1
126 1 12 ILE HA 1 12 ILE MG 2.000 . 5.000 2.205 2.187 2.214 . 0 0 "[ . 1 . ]" 1
127 1 12 ILE HA 1 13 VAL H 2.000 . 4.200 3.589 3.573 3.599 . 0 0 "[ . 1 . ]" 1
128 1 12 ILE HA 1 15 ASP H 2.000 . 3.800 3.273 3.135 3.436 . 0 0 "[ . 1 . ]" 1
129 1 12 ILE HA 1 15 ASP QB 2.000 . 5.500 2.703 2.514 2.847 . 0 0 "[ . 1 . ]" 1
130 1 12 ILE HA 1 16 HIS H 2.000 . 5.000 2.923 2.640 3.163 . 0 0 "[ . 1 . ]" 1
131 1 12 ILE HA 1 16 HIS HD2 2.000 . 4.500 4.530 4.510 4.543 0.043 14 0 "[ . 1 . ]" 1
132 1 12 ILE HB 1 13 VAL H 2.000 . 3.500 2.753 2.686 2.868 . 0 0 "[ . 1 . ]" 1
133 1 12 ILE MD 1 13 VAL H 2.000 . 7.000 2.659 2.571 2.780 . 0 0 "[ . 1 . ]" 1
134 1 12 ILE MD 1 16 HIS HD2 2.000 . 6.500 5.338 5.319 5.353 . 0 0 "[ . 1 . ]" 1
135 1 12 ILE QG 1 13 VAL H 2.000 . 6.000 1.746 1.721 1.771 0.079 11 0 "[ . 1 . ]" 1
136 1 12 ILE QG 1 16 HIS HD2 2.000 . 7.500 5.429 5.396 5.462 . 0 0 "[ . 1 . ]" 1
137 1 12 ILE MG 1 13 VAL H 2.000 . 6.500 3.922 3.897 3.967 . 0 0 "[ . 1 . ]" 1
138 1 12 ILE MG 1 16 HIS HD2 2.000 . 6.500 5.257 5.177 5.294 . 0 0 "[ . 1 . ]" 1
139 1 12 ILE O 1 16 HIS H 2.000 . 2.300 1.937 1.775 2.221 0.025 4 0 "[ . 1 . ]" 1
140 1 12 ILE O 1 16 HIS N 3.000 2.800 3.300 2.735 2.693 2.792 0.107 2 0 "[ . 1 . ]" 1
141 1 13 VAL H 1 13 VAL HB 2.000 . 3.200 2.669 2.594 2.721 . 0 0 "[ . 1 . ]" 1
142 1 13 VAL H 1 13 VAL QG 2.000 . 5.500 1.901 1.814 2.068 . 0 0 "[ . 1 . ]" 1
143 1 13 VAL H 1 14 LYS H 2.000 . 3.500 3.035 3.013 3.075 . 0 0 "[ . 1 . ]" 1
144 1 13 VAL HA 1 13 VAL QG 2.000 . 5.500 2.100 2.066 2.112 . 0 0 "[ . 1 . ]" 1
145 1 13 VAL HA 1 14 LYS H 2.000 . 5.000 3.558 3.552 3.577 . 0 0 "[ . 1 . ]" 1
146 1 13 VAL HA 1 16 HIS H 2.000 . 5.500 4.498 4.231 4.925 . 0 0 "[ . 1 . ]" 1
147 1 13 VAL HA 1 17 LEU H 2.000 . 3.800 3.899 3.853 3.939 0.139 14 0 "[ . 1 . ]" 1
148 1 13 VAL HA 1 17 LEU QB 2.000 . 5.500 4.349 4.029 4.507 . 0 0 "[ . 1 . ]" 1
149 1 13 VAL HA 1 17 LEU QD 2.000 . 7.000 4.271 3.045 4.905 . 0 0 "[ . 1 . ]" 1
150 1 13 VAL HA 1 17 LEU HG 2.000 . 5.500 5.066 4.421 5.568 0.068 12 0 "[ . 1 . ]" 1
151 1 13 VAL HB 1 14 LYS H 2.000 . 3.500 2.696 2.673 2.742 . 0 0 "[ . 1 . ]" 1
152 1 13 VAL QG 1 14 LYS H 2.000 . 5.500 3.243 3.202 3.268 . 0 0 "[ . 1 . ]" 1
153 1 13 VAL QG 1 15 ASP H 2.000 . 8.000 4.796 4.731 4.926 . 0 0 "[ . 1 . ]" 1
154 1 13 VAL QG 1 17 LEU H 2.000 . 8.000 4.445 4.358 4.531 . 0 0 "[ . 1 . ]" 1
155 1 14 LYS H 1 14 LYS QB 2.000 . 4.000 2.327 2.252 2.521 . 0 0 "[ . 1 . ]" 1
156 1 14 LYS H 1 14 LYS QG 2.000 . 5.000 3.657 2.288 4.097 . 0 0 "[ . 1 . ]" 1
157 1 14 LYS H 1 15 ASP H 2.000 . 3.500 2.550 2.493 2.607 . 0 0 "[ . 1 . ]" 1
158 1 14 LYS HA 1 15 ASP H 2.000 . 4.000 3.564 3.554 3.582 . 0 0 "[ . 1 . ]" 1
159 1 14 LYS HA 1 16 HIS HD2 2.000 . 4.000 4.174 4.135 4.202 0.202 12 0 "[ . 1 . ]" 1
160 1 14 LYS QB 1 15 ASP H 2.000 . 4.500 2.629 2.304 3.486 . 0 0 "[ . 1 . ]" 1
161 1 14 LYS QG 1 15 ASP H 2.000 . 5.500 3.808 1.778 4.312 0.022 11 0 "[ . 1 . ]" 1
162 1 15 ASP H 1 15 ASP QB 2.000 . 3.500 2.357 2.271 2.522 . 0 0 "[ . 1 . ]" 1
163 1 15 ASP H 1 16 HIS H 2.000 . 3.500 2.728 2.588 3.060 . 0 0 "[ . 1 . ]" 1
164 1 15 ASP H 1 16 HIS QB 2.000 . 6.000 4.574 4.494 4.687 . 0 0 "[ . 1 . ]" 1
165 1 15 ASP HA 1 16 HIS H 2.000 . 4.200 3.571 3.564 3.585 . 0 0 "[ . 1 . ]" 1
166 1 15 ASP HA 1 16 HIS HD2 2.000 . 5.500 5.230 5.039 5.425 . 0 0 "[ . 1 . ]" 1
167 1 15 ASP QB 1 16 HIS H 2.000 . 4.500 2.326 1.862 2.625 . 0 0 "[ . 1 . ]" 1
168 1 15 ASP QB 1 16 HIS HD2 2.000 . 5.500 4.714 4.514 4.795 . 0 0 "[ . 1 . ]" 1
169 1 16 HIS H 1 16 HIS QB 2.000 . 4.000 2.208 2.112 2.293 . 0 0 "[ . 1 . ]" 1
170 1 16 HIS H 1 17 LEU H 2.000 . 3.500 2.859 2.687 3.092 . 0 0 "[ . 1 . ]" 1
171 1 16 HIS H 1 17 LEU HA 2.000 . 5.500 5.407 5.254 5.590 0.090 12 0 "[ . 1 . ]" 1
172 1 16 HIS H 1 17 LEU QB 2.000 . 6.000 4.975 4.592 5.340 . 0 0 "[ . 1 . ]" 1
173 1 16 HIS H 1 18 LEU H 2.000 . 5.000 4.658 4.568 4.807 . 0 0 "[ . 1 . ]" 1
174 1 16 HIS HA 1 16 HIS HD2 2.000 . 5.000 4.246 4.197 4.358 . 0 0 "[ . 1 . ]" 1
175 1 16 HIS HA 1 17 LEU H 2.000 . 5.000 3.561 3.526 3.583 . 0 0 "[ . 1 . ]" 1
176 1 16 HIS HA 1 18 LEU H 2.000 . 5.500 3.941 3.882 4.090 . 0 0 "[ . 1 . ]" 1
177 1 16 HIS QB 1 17 LEU H 2.000 . 4.500 3.413 3.309 3.455 . 0 0 "[ . 1 . ]" 1
178 1 16 HIS QB 1 19 PRO QB 2.000 . 6.500 4.955 4.653 5.004 . 0 0 "[ . 1 . ]" 1
179 1 16 HIS QB 1 20 LYS QB 2.000 . 6.000 2.563 2.254 3.219 . 0 0 "[ . 1 . ]" 1
180 1 16 HIS HD2 1 17 LEU HG 2.000 . 4.500 3.489 2.651 4.618 0.118 3 0 "[ . 1 . ]" 1
181 1 16 HIS HD2 1 39 ILE MD 2.000 . 6.000 4.671 4.395 4.885 . 0 0 "[ . 1 . ]" 1
182 1 16 HIS HD2 1 39 ILE QG 2.000 . 7.500 6.349 5.652 6.735 . 0 0 "[ . 1 . ]" 1
183 1 16 HIS HD2 1 39 ILE MG 2.000 . 6.500 4.974 4.368 5.228 . 0 0 "[ . 1 . ]" 1
184 1 16 HIS O 1 20 LYS H 2.000 . 2.300 1.981 1.888 2.104 . 0 0 "[ . 1 . ]" 1
185 1 16 HIS O 1 20 LYS N 3.000 2.800 3.300 2.799 2.753 2.850 0.047 2 0 "[ . 1 . ]" 1
186 1 17 LEU H 1 17 LEU QB 2.000 . 4.000 2.482 2.076 2.761 . 0 0 "[ . 1 . ]" 1
187 1 17 LEU H 1 17 LEU QD 2.000 . 7.000 3.081 2.719 3.769 . 0 0 "[ . 1 . ]" 1
188 1 17 LEU H 1 17 LEU HG 2.000 . 4.500 2.568 1.791 4.360 0.009 5 0 "[ . 1 . ]" 1
189 1 17 LEU H 1 18 LEU H 2.000 . 4.200 3.093 3.001 3.153 . 0 0 "[ . 1 . ]" 1
190 1 17 LEU HA 1 17 LEU QD 2.000 . 6.000 3.033 1.893 3.365 . 0 0 "[ . 1 . ]" 1
191 1 17 LEU HA 1 17 LEU HG 2.000 . 4.500 3.435 2.337 3.652 . 0 0 "[ . 1 . ]" 1
192 1 17 LEU HA 1 18 LEU H 2.000 . 5.000 3.567 3.549 3.593 . 0 0 "[ . 1 . ]" 1
193 1 17 LEU QB 1 18 LEU H 2.000 . 4.500 3.230 2.549 3.528 . 0 0 "[ . 1 . ]" 1
194 1 17 LEU QB 1 21 GLN H 2.000 . 6.500 5.240 4.878 5.827 . 0 0 "[ . 1 . ]" 1
195 1 18 LEU H 1 18 LEU QB 2.000 . 5.000 2.146 2.118 2.174 . 0 0 "[ . 1 . ]" 1
196 1 18 LEU H 1 18 LEU QD 2.000 . 6.000 3.326 2.362 3.691 . 0 0 "[ . 1 . ]" 1
197 1 18 LEU H 1 18 LEU HG 2.000 . 4.500 3.416 3.125 4.307 . 0 0 "[ . 1 . ]" 1
198 1 18 LEU H 1 19 PRO QD 2.000 . 3.500 2.133 2.030 2.233 . 0 0 "[ . 1 . ]" 1
199 1 18 LEU H 1 20 LYS H 2.000 . 4.200 4.210 4.122 4.246 0.046 8 0 "[ . 1 . ]" 1
200 1 18 LEU HA 1 18 LEU QD 2.000 . 6.000 2.209 1.925 2.245 . 0 0 "[ . 1 . ]" 1
201 1 18 LEU HA 1 18 LEU HG 2.000 . 4.500 2.380 2.242 3.566 . 0 0 "[ . 1 . ]" 1
202 1 18 LEU QB 1 19 PRO QD 2.000 . 6.500 1.865 1.841 1.941 . 0 0 "[ . 1 . ]" 1
203 1 18 LEU QD 1 19 PRO QD 2.000 . 8.000 3.227 3.180 3.399 . 0 0 "[ . 1 . ]" 1
204 1 18 LEU HG 1 19 PRO QD 2.000 . 8.000 4.127 3.887 4.342 . 0 0 "[ . 1 . ]" 1
205 1 19 PRO HA 1 20 LYS H 2.000 . 4.200 3.588 3.575 3.597 . 0 0 "[ . 1 . ]" 1
206 1 19 PRO HA 1 22 ILE MD 2.000 . 6.000 5.053 4.980 5.106 . 0 0 "[ . 1 . ]" 1
207 1 19 PRO HA 1 22 ILE MG 2.000 . 6.500 3.060 1.996 3.533 . 0 0 "[ . 1 . ]" 1
208 1 19 PRO QB 1 20 LYS H 2.000 . 4.500 2.826 2.452 3.007 . 0 0 "[ . 1 . ]" 1
209 1 19 PRO QD 1 20 LYS H 2.000 . 4.500 2.868 2.294 3.103 . 0 0 "[ . 1 . ]" 1
210 1 19 PRO O 1 23 LYS H 2.000 . 2.300 1.883 1.790 1.971 0.010 2 0 "[ . 1 . ]" 1
211 1 19 PRO O 1 23 LYS N 3.000 2.800 3.300 2.805 2.726 2.925 0.074 2 0 "[ . 1 . ]" 1
212 1 20 LYS H 1 20 LYS QB 2.000 . 4.500 2.196 2.107 2.289 . 0 0 "[ . 1 . ]" 1
213 1 20 LYS H 1 20 LYS QD 2.000 . 5.500 4.107 3.703 4.564 . 0 0 "[ . 1 . ]" 1
214 1 20 LYS H 1 20 LYS QG 2.000 . 4.500 3.920 3.334 4.093 . 0 0 "[ . 1 . ]" 1
215 1 20 LYS H 1 21 GLN H 2.000 . 3.500 3.183 2.855 3.411 . 0 0 "[ . 1 . ]" 1
216 1 20 LYS H 1 22 ILE H 2.000 . 5.000 4.483 4.333 4.644 . 0 0 "[ . 1 . ]" 1
217 1 20 LYS HA 1 21 GLN H 2.000 . 4.500 3.574 3.544 3.591 . 0 0 "[ . 1 . ]" 1
218 1 20 LYS HA 1 23 LYS H 2.000 . 4.500 4.098 3.637 4.397 . 0 0 "[ . 1 . ]" 1
219 1 20 LYS QB 1 21 GLN H 2.000 . 4.500 2.107 1.785 2.577 0.015 1 0 "[ . 1 . ]" 1
220 1 20 LYS QG 1 21 GLN H 2.000 . 5.000 3.622 2.429 4.355 . 0 0 "[ . 1 . ]" 1
221 1 21 GLN H 1 21 GLN QB 2.000 . 4.500 2.571 2.290 2.842 . 0 0 "[ . 1 . ]" 1
222 1 21 GLN H 1 21 GLN QG 2.000 . 5.000 2.200 1.749 3.323 0.051 6 0 "[ . 1 . ]" 1
223 1 21 GLN H 1 22 ILE H 2.000 . 3.500 2.788 2.560 3.095 . 0 0 "[ . 1 . ]" 1
224 1 21 GLN H 1 23 LYS H 2.000 . 5.500 4.212 4.017 4.370 . 0 0 "[ . 1 . ]" 1
225 1 21 GLN HA 1 22 ILE H 2.000 . 4.200 3.583 3.572 3.592 . 0 0 "[ . 1 . ]" 1
226 1 21 GLN HA 1 23 LYS H 2.000 . 5.500 4.226 4.133 4.393 . 0 0 "[ . 1 . ]" 1
227 1 21 GLN HA 1 25 HIS HD2 2.000 . 4.500 4.555 4.533 4.594 0.094 15 0 "[ . 1 . ]" 1
228 1 21 GLN HA 1 25 HIS HE1 2.000 . 4.500 2.631 2.472 3.045 . 0 0 "[ . 1 . ]" 1
229 1 21 GLN QB 1 22 ILE H 2.000 . 5.500 2.372 2.212 3.030 . 0 0 "[ . 1 . ]" 1
230 1 21 GLN QB 1 25 HIS HE1 2.000 . 6.000 3.903 3.324 4.309 . 0 0 "[ . 1 . ]" 1
231 1 21 GLN QG 1 25 HIS HE1 2.000 . 6.500 4.310 3.220 5.331 . 0 0 "[ . 1 . ]" 1
232 1 21 GLN O 1 25 HIS H 2.000 . 2.300 1.935 1.836 2.241 . 0 0 "[ . 1 . ]" 1
233 1 21 GLN O 1 25 HIS N 3.000 2.800 3.300 2.812 2.724 3.075 0.076 5 0 "[ . 1 . ]" 1
234 1 22 ILE H 1 22 ILE HB 2.000 . 3.500 2.377 2.182 2.508 . 0 0 "[ . 1 . ]" 1
235 1 22 ILE H 1 22 ILE MD 2.000 . 5.500 3.455 3.263 3.633 . 0 0 "[ . 1 . ]" 1
236 1 22 ILE H 1 22 ILE QG 2.000 . 4.500 2.744 2.164 4.078 . 0 0 "[ . 1 . ]" 1
237 1 22 ILE H 1 22 ILE MG 2.000 . 5.500 3.549 2.747 3.785 . 0 0 "[ . 1 . ]" 1
238 1 22 ILE H 1 23 LYS H 2.000 . 3.500 2.952 2.845 2.985 . 0 0 "[ . 1 . ]" 1
239 1 22 ILE H 1 24 GLU H 2.000 . 5.500 5.500 5.399 5.550 0.050 14 0 "[ . 1 . ]" 1
240 1 22 ILE HA 1 22 ILE MD 2.000 . 5.500 2.073 2.022 2.146 . 0 0 "[ . 1 . ]" 1
241 1 22 ILE HA 1 22 ILE QG 2.000 . 5.000 2.672 2.499 2.782 . 0 0 "[ . 1 . ]" 1
242 1 22 ILE HA 1 22 ILE MG 2.000 . 5.500 2.651 2.431 3.155 . 0 0 "[ . 1 . ]" 1
243 1 22 ILE HA 1 23 LYS H 2.000 . 4.200 3.565 3.561 3.568 . 0 0 "[ . 1 . ]" 1
244 1 22 ILE HB 1 23 LYS H 2.000 . 4.500 3.029 2.763 3.712 . 0 0 "[ . 1 . ]" 1
245 1 22 ILE MD 1 23 LYS H 2.000 . 6.500 4.714 4.680 4.797 . 0 0 "[ . 1 . ]" 1
246 1 22 ILE MD 1 31 ASN HA 2.000 . 7.000 5.883 5.777 5.956 . 0 0 "[ . 1 . ]" 1
247 1 22 ILE MD 1 77 ARG HA 2.000 . 8.000 6.423 5.817 6.697 . 0 0 "[ . 1 . ]" 1
248 1 22 ILE QG 1 23 LYS H 2.000 . 5.500 4.289 4.178 4.355 . 0 0 "[ . 1 . ]" 1
249 1 22 ILE MG 1 23 LYS H 2.000 . 5.500 2.892 1.885 3.316 . 0 0 "[ . 1 . ]" 1
250 1 23 LYS H 1 23 LYS QB 2.000 . 4.500 2.268 2.111 2.346 . 0 0 "[ . 1 . ]" 1
251 1 23 LYS H 1 23 LYS QG 2.000 . 5.500 3.569 2.396 4.081 . 0 0 "[ . 1 . ]" 1
252 1 23 LYS H 1 24 GLU H 2.000 . 3.500 3.215 3.170 3.250 . 0 0 "[ . 1 . ]" 1
253 1 23 LYS HA 1 24 GLU H 2.000 . 3.800 3.548 3.542 3.558 . 0 0 "[ . 1 . ]" 1
254 1 23 LYS HA 1 25 HIS H 2.000 . 4.200 4.297 4.269 4.315 0.115 4 0 "[ . 1 . ]" 1
255 1 23 LYS HA 1 26 GLY H 2.000 . 5.000 3.256 3.169 3.336 . 0 0 "[ . 1 . ]" 1
256 1 23 LYS HA 1 27 LEU H 2.000 . 4.500 4.475 4.379 4.524 0.024 14 0 "[ . 1 . ]" 1
257 1 23 LYS QB 1 24 GLU H 2.000 . 5.500 1.850 1.737 2.039 0.063 16 0 "[ . 1 . ]" 1
258 1 23 LYS QG 1 24 GLU H 2.000 . 5.500 3.189 2.419 4.003 . 0 0 "[ . 1 . ]" 1
259 1 23 LYS O 1 27 LEU H 2.000 . 2.300 2.408 2.365 2.451 0.151 14 0 "[ . 1 . ]" 1
260 1 23 LYS O 1 27 LEU N 3.000 2.800 3.300 3.272 3.232 3.307 0.007 14 0 "[ . 1 . ]" 1
261 1 24 GLU H 1 24 GLU QB 2.000 . 4.500 2.391 2.123 2.739 . 0 0 "[ . 1 . ]" 1
262 1 24 GLU H 1 24 GLU QG 2.000 . 4.500 3.099 1.773 4.099 0.027 4 0 "[ . 1 . ]" 1
263 1 24 GLU H 1 25 HIS H 2.000 . 3.500 2.902 2.866 2.956 . 0 0 "[ . 1 . ]" 1
264 1 24 GLU H 1 26 GLY H 2.000 . 5.000 4.141 4.079 4.186 . 0 0 "[ . 1 . ]" 1
265 1 24 GLU HA 1 25 HIS H 2.000 . 3.800 3.527 3.516 3.541 . 0 0 "[ . 1 . ]" 1
266 1 24 GLU QB 1 25 HIS H 2.000 . 4.500 2.578 2.554 2.617 . 0 0 "[ . 1 . ]" 1
267 1 24 GLU QB 1 26 GLY H 2.000 . 6.000 4.620 4.580 4.656 . 0 0 "[ . 1 . ]" 1
268 1 24 GLU QG 1 25 HIS HE1 2.000 . 4.500 3.727 3.325 3.943 . 0 0 "[ . 1 . ]" 1
269 1 25 HIS H 1 25 HIS QB 2.000 . 3.500 2.566 2.539 2.606 . 0 0 "[ . 1 . ]" 1
270 1 25 HIS H 1 26 GLY H 2.000 . 2.800 2.374 2.346 2.405 . 0 0 "[ . 1 . ]" 1
271 1 25 HIS H 1 27 LEU H 2.000 . 5.000 4.187 4.158 4.229 . 0 0 "[ . 1 . ]" 1
272 1 25 HIS HA 1 26 GLY H 2.000 . 4.200 3.528 3.521 3.536 . 0 0 "[ . 1 . ]" 1
273 1 25 HIS QB 1 26 GLY H 2.000 . 5.500 2.595 2.557 2.634 . 0 0 "[ . 1 . ]" 1
274 1 25 HIS QB 1 27 LEU H 2.000 . 6.000 4.592 4.562 4.636 . 0 0 "[ . 1 . ]" 1
275 1 25 HIS HD2 1 63 CYS QB 2.000 . 5.000 2.402 2.171 2.738 . 0 0 "[ . 1 . ]" 1
276 1 25 HIS HD2 1 64 ARG HA 2.000 . 3.500 3.040 2.426 3.349 . 0 0 "[ . 1 . ]" 1
277 1 25 HIS HD2 1 64 ARG QB 2.000 . 4.500 3.959 3.769 4.134 . 0 0 "[ . 1 . ]" 1
278 1 25 HIS HD2 1 64 ARG QG 2.000 . 6.500 4.819 2.778 5.471 . 0 0 "[ . 1 . ]" 1
279 1 25 HIS HE1 1 60 ALA HA 2.000 . 3.500 3.462 3.231 3.554 0.054 5 0 "[ . 1 . ]" 1
280 1 25 HIS HE1 1 60 ALA MB 2.000 . 6.000 3.217 2.730 3.634 . 0 0 "[ . 1 . ]" 1
281 1 25 HIS HE1 1 63 CYS QB 2.000 . 5.000 3.672 3.435 3.975 . 0 0 "[ . 1 . ]" 1
282 1 25 HIS HE1 1 64 ARG QB 2.000 . 5.500 3.643 2.680 4.959 . 0 0 "[ . 1 . ]" 1
283 1 25 HIS HE1 1 64 ARG QG 2.000 . 6.500 4.563 2.820 5.531 . 0 0 "[ . 1 . ]" 1
284 1 25 HIS O 1 28 LYS H 2.000 . 2.300 1.809 1.780 1.830 0.020 14 0 "[ . 1 . ]" 1
285 1 25 HIS O 1 28 LYS N 3.000 2.800 3.300 2.751 2.715 2.776 0.085 14 0 "[ . 1 . ]" 1
286 1 26 GLY QA 1 27 LEU H 2.000 . 4.000 2.763 2.755 2.772 . 0 0 "[ . 1 . ]" 1
287 1 27 LEU H 1 27 LEU QB 2.000 . 3.800 2.299 2.130 2.721 . 0 0 "[ . 1 . ]" 1
288 1 27 LEU H 1 27 LEU QD 2.000 . 6.000 2.901 1.669 3.783 0.131 8 0 "[ . 1 . ]" 1
289 1 27 LEU H 1 27 LEU HG 2.000 . 4.200 3.557 1.785 4.282 0.082 9 0 "[ . 1 . ]" 1
290 1 27 LEU H 1 28 LYS H 2.000 . 5.000 3.009 2.957 3.024 . 0 0 "[ . 1 . ]" 1
291 1 27 LEU QB 1 28 LYS H 2.000 . 4.500 2.682 2.567 2.797 . 0 0 "[ . 1 . ]" 1
292 1 27 LEU QD 1 28 LYS H 2.000 . 7.000 3.822 3.518 4.060 . 0 0 "[ . 1 . ]" 1
293 1 28 LYS H 1 28 LYS QB 2.000 . 4.500 2.418 2.238 2.932 . 0 0 "[ . 1 . ]" 1
294 1 28 LYS H 1 28 LYS QG 2.000 . 5.500 2.970 1.915 4.145 . 0 0 "[ . 1 . ]" 1
295 1 28 LYS H 1 31 ASN QB 2.000 . 5.500 4.932 4.103 5.045 . 0 0 "[ . 1 . ]" 1
296 1 28 LYS HA 1 29 LYS H 2.000 . 4.000 2.443 2.328 2.512 . 0 0 "[ . 1 . ]" 1
297 1 28 LYS QB 1 29 LYS H 2.000 . 5.000 2.683 2.413 3.863 . 0 0 "[ . 1 . ]" 1
298 1 28 LYS QG 1 29 LYS H 2.000 . 5.500 3.775 1.807 4.637 . 0 0 "[ . 1 . ]" 1
299 1 29 LYS H 1 29 LYS QB 2.000 . 4.500 2.423 2.268 2.579 . 0 0 "[ . 1 . ]" 1
300 1 29 LYS H 1 29 LYS QG 2.000 . 5.500 2.752 2.019 3.991 . 0 0 "[ . 1 . ]" 1
301 1 29 LYS QB 1 30 SER H 2.000 . 5.000 2.940 2.571 3.464 . 0 0 "[ . 1 . ]" 1
302 1 29 LYS QB 1 31 ASN H 2.000 . 6.000 5.198 4.964 5.420 . 0 0 "[ . 1 . ]" 1
303 1 29 LYS QG 1 30 SER H 2.000 . 5.500 3.168 1.771 3.955 0.029 2 0 "[ . 1 . ]" 1
304 1 29 LYS QG 1 31 ASN H 2.000 . 5.000 4.293 4.083 4.499 . 0 0 "[ . 1 . ]" 1
305 1 30 SER H 1 30 SER QB 2.000 . 5.000 2.501 2.243 3.123 . 0 0 "[ . 1 . ]" 1
306 1 30 SER H 1 31 ASN H 2.000 . 4.200 4.149 3.076 4.242 0.042 12 0 "[ . 1 . ]" 1
307 1 30 SER HA 1 31 ASN H 2.000 . 4.200 2.292 2.260 2.596 . 0 0 "[ . 1 . ]" 1
308 1 30 SER HA 1 32 LEU H 2.000 . 5.500 4.000 3.640 4.288 . 0 0 "[ . 1 . ]" 1
309 1 30 SER QB 1 31 ASN H 2.000 . 5.500 3.837 3.720 4.023 . 0 0 "[ . 1 . ]" 1
310 1 30 SER QB 1 32 LEU H 2.000 . 6.500 3.982 3.429 4.835 . 0 0 "[ . 1 . ]" 1
311 1 31 ASN H 1 31 ASN QB 2.000 . 4.500 2.496 2.448 2.709 . 0 0 "[ . 1 . ]" 1
312 1 31 ASN H 1 32 LEU H 2.000 . 3.500 3.099 2.425 3.375 . 0 0 "[ . 1 . ]" 1
313 1 31 ASN HA 1 32 LEU H 2.000 . 4.000 2.730 2.598 2.941 . 0 0 "[ . 1 . ]" 1
314 1 31 ASN HA 1 77 ARG HA 2.000 . 3.500 2.445 2.255 2.891 . 0 0 "[ . 1 . ]" 1
315 1 31 ASN HA 1 77 ARG QB 2.000 . 5.500 4.279 3.234 4.858 . 0 0 "[ . 1 . ]" 1
316 1 31 ASN HA 1 77 ARG QG 2.000 . 6.000 4.006 3.518 5.363 . 0 0 "[ . 1 . ]" 1
317 1 31 ASN HA 1 78 ILE H 2.000 . 4.000 2.917 2.713 3.204 . 0 0 "[ . 1 . ]" 1
318 1 31 ASN HA 1 78 ILE MG 2.000 . 7.000 5.849 5.624 5.934 . 0 0 "[ . 1 . ]" 1
319 1 31 ASN QB 1 32 LEU H 2.000 . 4.500 3.963 3.847 4.044 . 0 0 "[ . 1 . ]" 1
320 1 31 ASN QB 1 77 ARG HA 2.000 . 6.000 4.575 4.369 4.962 . 0 0 "[ . 1 . ]" 1
321 1 32 LEU H 1 32 LEU QB 2.000 . 4.500 2.875 2.776 3.273 . 0 0 "[ . 1 . ]" 1
322 1 32 LEU H 1 32 LEU QD 2.000 . 6.500 3.905 1.909 4.118 . 0 0 "[ . 1 . ]" 1
323 1 32 LEU H 1 32 LEU HG 2.000 . 5.000 4.553 3.177 5.142 0.142 13 0 "[ . 1 . ]" 1
324 1 32 LEU H 1 33 GLN H 2.000 . 4.500 4.076 3.885 4.301 . 0 0 "[ . 1 . ]" 1
325 1 32 LEU H 1 77 ARG QG 2.000 . 6.500 4.148 3.389 5.341 . 0 0 "[ . 1 . ]" 1
326 1 32 LEU H 1 78 ILE H 2.000 . 4.800 3.455 3.273 3.637 . 0 0 "[ . 1 . ]" 1
327 1 32 LEU H 1 78 ILE HB 2.000 . 5.000 4.998 4.858 5.038 0.038 2 0 "[ . 1 . ]" 1
328 1 32 LEU HA 1 32 LEU QD 2.000 . 5.500 2.373 1.925 3.273 . 0 0 "[ . 1 . ]" 1
329 1 32 LEU HA 1 32 LEU HG 2.000 . 4.000 2.668 2.334 3.673 . 0 0 "[ . 1 . ]" 1
330 1 32 LEU HA 1 33 GLN H 2.000 . 2.500 2.199 2.176 2.267 . 0 0 "[ . 1 . ]" 1
331 1 32 LEU HA 1 33 GLN HA 2.000 . 5.500 4.470 4.448 4.519 . 0 0 "[ . 1 . ]" 1
332 1 32 LEU HA 1 78 ILE H 2.000 . 3.500 3.370 2.712 3.531 0.031 8 0 "[ . 1 . ]" 1
333 1 32 LEU HA 1 78 ILE HB 2.000 . 4.500 3.121 2.587 3.512 . 0 0 "[ . 1 . ]" 1
334 1 32 LEU HA 1 78 ILE MD 2.000 . 7.000 4.327 3.805 5.501 . 0 0 "[ . 1 . ]" 1
335 1 32 LEU HA 1 78 ILE QG 2.000 . 8.000 4.330 3.385 4.929 . 0 0 "[ . 1 . ]" 1
336 1 32 LEU HA 1 78 ILE MG 2.000 . 6.000 4.506 4.229 4.825 . 0 0 "[ . 1 . ]" 1
337 1 32 LEU QB 1 33 GLN H 2.000 . 5.000 3.728 2.869 3.906 . 0 0 "[ . 1 . ]" 1
338 1 32 LEU QD 1 33 GLN H 2.000 . 6.500 3.112 1.850 4.088 . 0 0 "[ . 1 . ]" 1
339 1 32 LEU HG 1 33 GLN H 2.000 . 4.500 3.012 2.505 4.515 0.015 13 0 "[ . 1 . ]" 1
340 1 33 GLN H 1 33 GLN QB 2.000 . 4.500 2.664 2.524 2.770 . 0 0 "[ . 1 . ]" 1
341 1 33 GLN H 1 33 GLN QG 2.000 . 5.500 3.928 3.561 4.377 . 0 0 "[ . 1 . ]" 1
342 1 33 GLN H 1 34 LEU H 2.000 . 4.500 3.264 2.984 3.617 . 0 0 "[ . 1 . ]" 1
343 1 33 GLN H 1 66 ALA MB 2.000 . 8.000 5.492 4.886 6.255 . 0 0 "[ . 1 . ]" 1
344 1 33 GLN H 1 78 ILE O 2.000 . 2.100 2.117 2.034 2.158 0.058 3 0 "[ . 1 . ]" 1
345 1 33 GLN H 1 79 THR HA 2.000 . 3.500 3.472 3.157 3.579 0.079 16 0 "[ . 1 . ]" 1
346 1 33 GLN H 1 80 VAL H 2.000 . 4.500 4.032 3.816 4.299 . 0 0 "[ . 1 . ]" 1
347 1 33 GLN H 1 80 VAL QG 2.000 . 7.500 3.091 2.839 3.441 . 0 0 "[ . 1 . ]" 1
348 1 33 GLN HA 1 34 LEU H 2.000 . 2.500 2.437 2.294 2.566 0.066 14 0 "[ . 1 . ]" 1
349 1 33 GLN HA 1 80 VAL H 2.000 . 5.000 5.027 4.940 5.084 0.084 16 0 "[ . 1 . ]" 1
350 1 33 GLN QB 1 34 LEU H 2.000 . 5.500 3.940 3.877 4.050 . 0 0 "[ . 1 . ]" 1
351 1 33 GLN QB 1 79 THR HA 2.000 . 4.500 2.166 2.031 2.354 . 0 0 "[ . 1 . ]" 1
352 1 33 GLN QG 1 34 LEU H 2.000 . 5.500 4.358 3.876 4.727 . 0 0 "[ . 1 . ]" 1
353 1 33 GLN QG 1 79 THR HA 2.000 . 6.500 4.004 2.663 4.468 . 0 0 "[ . 1 . ]" 1
354 1 33 GLN N 1 78 ILE O 3.000 2.800 3.100 2.810 2.774 2.937 0.026 2 0 "[ . 1 . ]" 1
355 1 33 GLN O 1 80 VAL H 2.000 . 2.100 2.033 1.880 2.120 0.020 3 0 "[ . 1 . ]" 1
356 1 33 GLN O 1 80 VAL N 3.000 2.800 3.100 2.968 2.768 3.059 0.032 16 0 "[ . 1 . ]" 1
357 1 34 LEU H 1 34 LEU QB 2.000 . 3.500 2.655 2.161 2.992 . 0 0 "[ . 1 . ]" 1
358 1 34 LEU H 1 34 LEU QD 2.000 . 7.000 2.607 1.550 3.794 0.250 3 0 "[ . 1 . ]" 1
359 1 34 LEU H 1 35 ARG H 2.000 . 4.500 4.535 4.465 4.578 0.078 5 0 "[ . 1 . ]" 1
360 1 34 LEU HA 1 34 LEU QD 2.000 . 6.000 3.063 2.213 3.433 . 0 0 "[ . 1 . ]" 1
361 1 34 LEU HA 1 34 LEU HG 2.000 . 3.800 3.202 2.257 3.675 . 0 0 "[ . 1 . ]" 1
362 1 34 LEU HA 1 35 ARG H 2.000 . 2.500 2.402 2.191 2.534 0.034 1 0 "[ . 1 . ]" 1
363 1 34 LEU HA 1 80 VAL HB 2.000 . 3.800 2.378 2.199 2.973 . 0 0 "[ . 1 . ]" 1
364 1 34 LEU HA 1 80 VAL QG 2.000 . 7.000 3.019 2.374 3.587 . 0 0 "[ . 1 . ]" 1
365 1 34 LEU QD 1 35 ARG H 2.000 . 8.000 3.001 1.887 4.172 . 0 0 "[ . 1 . ]" 1
366 1 34 LEU QD 1 38 ALA H 2.000 . 8.000 4.744 3.401 5.923 . 0 0 "[ . 1 . ]" 1
367 1 34 LEU QD 1 38 ALA MB 2.000 . 8.000 3.014 1.875 3.532 . 0 0 "[ . 1 . ]" 1
368 1 34 LEU QD 1 39 ILE H 2.000 . 7.000 3.457 1.811 4.567 . 0 0 "[ . 1 . ]" 1
369 1 34 LEU QD 1 39 ILE HA 2.000 . 7.500 4.246 3.116 5.077 . 0 0 "[ . 1 . ]" 1
370 1 34 LEU QD 1 39 ILE HB 2.000 . 8.000 4.100 2.965 5.356 . 0 0 "[ . 1 . ]" 1
371 1 34 LEU QD 1 39 ILE MD 2.000 . 8.000 2.409 2.090 3.666 . 0 0 "[ . 1 . ]" 1
372 1 34 LEU QD 1 39 ILE QG 2.000 . 8.000 2.361 1.896 2.949 . 0 0 "[ . 1 . ]" 1
373 1 34 LEU QD 1 39 ILE MG 2.000 . 8.000 4.124 3.784 4.581 . 0 0 "[ . 1 . ]" 1
374 1 34 LEU QD 1 80 VAL QG 2.000 . 8.000 2.885 1.954 3.394 . 0 0 "[ . 1 . ]" 1
375 1 35 ARG H 1 35 ARG QB 2.000 . 4.500 2.521 2.251 2.755 . 0 0 "[ . 1 . ]" 1
376 1 35 ARG H 1 35 ARG QD 2.000 . 5.000 4.161 2.413 4.491 . 0 0 "[ . 1 . ]" 1
377 1 35 ARG H 1 35 ARG QG 2.000 . 4.500 2.940 2.106 3.786 . 0 0 "[ . 1 . ]" 1
378 1 35 ARG H 1 38 ALA H 2.000 . 5.500 3.649 3.283 4.176 . 0 0 "[ . 1 . ]" 1
379 1 35 ARG H 1 80 VAL H 2.000 . 4.500 4.324 3.621 4.537 0.037 7 0 "[ . 1 . ]" 1
380 1 35 ARG HA 1 36 ASP H 2.000 . 2.800 2.452 2.289 2.722 . 0 0 "[ . 1 . ]" 1
381 1 35 ARG HA 1 37 GLN H 2.000 . 5.000 4.511 4.196 4.972 . 0 0 "[ . 1 . ]" 1
382 1 35 ARG HA 1 38 ALA H 2.000 . 5.000 4.749 4.486 5.027 0.027 3 0 "[ . 1 . ]" 1
383 1 35 ARG QB 1 36 ASP H 2.000 . 5.000 2.515 1.965 3.157 . 0 0 "[ . 1 . ]" 1
384 1 35 ARG QB 1 37 GLN H 2.000 . 5.000 2.832 2.673 3.078 . 0 0 "[ . 1 . ]" 1
385 1 35 ARG QB 1 38 ALA H 2.000 . 4.500 2.773 2.509 3.082 . 0 0 "[ . 1 . ]" 1
386 1 35 ARG QB 1 81 THR HA 2.000 . 5.000 3.793 2.397 4.107 . 0 0 "[ . 1 . ]" 1
387 1 35 ARG QD 1 36 ASP H 2.000 . 5.500 4.181 1.775 4.944 0.025 9 0 "[ . 1 . ]" 1
388 1 35 ARG QD 1 37 GLN H 2.000 . 7.500 4.493 2.772 5.392 . 0 0 "[ . 1 . ]" 1
389 1 35 ARG QD 1 38 ALA H 2.000 . 6.000 4.743 4.070 5.382 . 0 0 "[ . 1 . ]" 1
390 1 35 ARG QG 1 36 ASP H 2.000 . 6.000 3.887 3.555 4.310 . 0 0 "[ . 1 . ]" 1
391 1 35 ARG QG 1 37 GLN H 2.000 . 6.500 4.894 4.528 5.200 . 0 0 "[ . 1 . ]" 1
392 1 35 ARG QG 1 38 ALA H 2.000 . 6.000 4.758 4.389 5.042 . 0 0 "[ . 1 . ]" 1
393 1 36 ASP H 1 36 ASP QB 2.000 . 4.500 2.487 2.079 2.768 . 0 0 "[ . 1 . ]" 1
394 1 36 ASP H 1 37 GLN H 2.000 . 5.000 2.761 2.486 3.020 . 0 0 "[ . 1 . ]" 1
395 1 36 ASP HA 1 37 GLN H 2.000 . 4.500 3.566 3.551 3.586 . 0 0 "[ . 1 . ]" 1
396 1 36 ASP HA 1 38 ALA H 2.000 . 4.800 4.296 4.117 4.482 . 0 0 "[ . 1 . ]" 1
397 1 36 ASP HA 1 39 ILE H 2.000 . 5.000 3.837 3.395 4.115 . 0 0 "[ . 1 . ]" 1
398 1 36 ASP HA 1 40 LEU H 2.000 . 5.000 4.063 3.756 4.291 . 0 0 "[ . 1 . ]" 1
399 1 36 ASP QB 1 37 GLN H 2.000 . 4.500 2.624 2.308 3.339 . 0 0 "[ . 1 . ]" 1
400 1 36 ASP O 1 40 LEU H 2.000 . 2.100 2.024 1.842 2.107 0.007 6 0 "[ . 1 . ]" 1
401 1 36 ASP O 1 40 LEU N 3.000 2.800 3.100 2.975 2.796 3.079 0.004 10 0 "[ . 1 . ]" 1
402 1 37 GLN H 1 37 GLN QB 2.000 . 4.500 2.391 2.215 2.765 . 0 0 "[ . 1 . ]" 1
403 1 37 GLN H 1 37 GLN QG 2.000 . 5.000 3.100 1.796 4.091 0.004 12 0 "[ . 1 . ]" 1
404 1 37 GLN H 1 38 ALA H 2.000 . 3.500 2.846 2.724 2.971 . 0 0 "[ . 1 . ]" 1
405 1 37 GLN H 1 39 ILE H 2.000 . 5.500 4.976 4.483 5.348 . 0 0 "[ . 1 . ]" 1
406 1 37 GLN H 1 40 LEU H 2.000 . 5.500 4.923 4.844 5.032 . 0 0 "[ . 1 . ]" 1
407 1 37 GLN HA 1 38 ALA H 2.000 . 4.800 3.561 3.551 3.576 . 0 0 "[ . 1 . ]" 1
408 1 37 GLN HA 1 39 ILE H 2.000 . 5.500 5.184 4.616 5.466 . 0 0 "[ . 1 . ]" 1
409 1 37 GLN HA 1 40 LEU H 2.000 . 5.000 3.760 3.646 3.923 . 0 0 "[ . 1 . ]" 1
410 1 37 GLN QB 1 38 ALA H 2.000 . 5.000 2.668 2.373 3.377 . 0 0 "[ . 1 . ]" 1
411 1 37 GLN QG 1 82 GLU H 2.000 . 6.500 5.173 3.782 5.825 . 0 0 "[ . 1 . ]" 1
412 1 37 GLN O 1 41 ASP H 2.000 . 2.100 1.966 1.838 2.136 0.036 5 0 "[ . 1 . ]" 1
413 1 37 GLN O 1 41 ASP N 3.000 2.800 3.100 2.888 2.740 3.069 0.060 1 0 "[ . 1 . ]" 1
414 1 38 ALA H 1 38 ALA MB 2.000 . 4.500 2.208 2.068 2.255 . 0 0 "[ . 1 . ]" 1
415 1 38 ALA H 1 39 ILE H 2.000 . 3.500 3.102 2.845 3.385 . 0 0 "[ . 1 . ]" 1
416 1 38 ALA H 1 40 LEU H 2.000 . 5.000 4.173 3.991 4.541 . 0 0 "[ . 1 . ]" 1
417 1 38 ALA HA 1 39 ILE H 2.000 . 5.000 3.577 3.550 3.589 . 0 0 "[ . 1 . ]" 1
418 1 38 ALA MB 1 39 ILE H 2.000 . 5.200 2.015 1.779 2.397 0.021 16 0 "[ . 1 . ]" 1
419 1 38 ALA MB 1 81 THR HA 2.000 . 6.000 2.877 2.227 3.526 . 0 0 "[ . 1 . ]" 1
420 1 38 ALA MB 1 82 GLU H 2.000 . 7.000 4.152 3.465 4.932 . 0 0 "[ . 1 . ]" 1
421 1 38 ALA O 1 42 ILE H 2.000 . 2.100 2.103 2.030 2.137 0.037 11 0 "[ . 1 . ]" 1
422 1 38 ALA O 1 42 ILE N 3.000 2.800 3.100 3.039 2.870 3.097 . 0 0 "[ . 1 . ]" 1
423 1 39 ILE H 1 39 ILE HB 2.000 . 3.000 2.497 2.310 2.718 . 0 0 "[ . 1 . ]" 1
424 1 39 ILE H 1 39 ILE MD 2.000 . 5.000 3.577 3.318 3.991 . 0 0 "[ . 1 . ]" 1
425 1 39 ILE H 1 39 ILE QG 2.000 . 3.800 2.174 1.767 2.565 0.033 3 0 "[ . 1 . ]" 1
426 1 39 ILE H 1 39 ILE MG 2.000 . 5.000 3.768 3.721 3.790 . 0 0 "[ . 1 . ]" 1
427 1 39 ILE H 1 40 LEU H 2.000 . 3.500 2.960 2.902 3.059 . 0 0 "[ . 1 . ]" 1
428 1 39 ILE H 1 41 ASP H 2.000 . 5.000 4.459 4.214 4.886 . 0 0 "[ . 1 . ]" 1
429 1 39 ILE HA 1 39 ILE MD 2.000 . 6.000 3.135 2.235 3.884 . 0 0 "[ . 1 . ]" 1
430 1 39 ILE HA 1 39 ILE QG 2.000 . 5.000 2.422 2.267 2.584 . 0 0 "[ . 1 . ]" 1
431 1 39 ILE HA 1 39 ILE MG 2.000 . 6.000 2.440 2.294 2.616 . 0 0 "[ . 1 . ]" 1
432 1 39 ILE HA 1 40 LEU H 2.000 . 5.000 3.570 3.551 3.587 . 0 0 "[ . 1 . ]" 1
433 1 39 ILE HA 1 42 ILE H 2.000 . 4.200 3.578 3.121 4.184 . 0 0 "[ . 1 . ]" 1
434 1 39 ILE HA 1 43 ILE H 2.000 . 5.500 4.052 3.757 4.324 . 0 0 "[ . 1 . ]" 1
435 1 39 ILE HA 1 62 ILE MD 2.000 . 6.500 5.373 5.308 5.409 . 0 0 "[ . 1 . ]" 1
436 1 39 ILE HA 1 62 ILE MG 2.000 . 6.500 5.126 4.882 5.308 . 0 0 "[ . 1 . ]" 1
437 1 39 ILE HB 1 40 LEU H 2.000 . 4.200 2.567 2.145 2.819 . 0 0 "[ . 1 . ]" 1
438 1 40 LEU H 1 40 LEU QB 2.000 . 4.500 2.280 2.080 2.540 . 0 0 "[ . 1 . ]" 1
439 1 40 LEU H 1 40 LEU QD 2.000 . 6.500 3.205 2.956 3.584 . 0 0 "[ . 1 . ]" 1
440 1 40 LEU H 1 40 LEU HG 2.000 . 3.500 2.719 1.946 3.507 0.007 9 0 "[ . 1 . ]" 1
441 1 40 LEU HA 1 41 ASP H 2.000 . 3.500 3.555 3.537 3.573 0.073 10 0 "[ . 1 . ]" 1
442 1 40 LEU HA 1 43 ILE H 2.000 . 5.000 4.235 3.972 4.518 . 0 0 "[ . 1 . ]" 1
443 1 40 LEU HA 1 44 ARG H 2.000 . 5.000 3.924 3.667 4.362 . 0 0 "[ . 1 . ]" 1
444 1 40 LEU QB 1 41 ASP H 2.000 . 4.500 2.516 2.236 2.706 . 0 0 "[ . 1 . ]" 1
445 1 40 LEU QD 1 41 ASP H 2.000 . 7.000 3.990 3.812 4.134 . 0 0 "[ . 1 . ]" 1
446 1 40 LEU HG 1 41 ASP H 2.000 . 5.000 4.580 4.098 4.950 . 0 0 "[ . 1 . ]" 1
447 1 40 LEU O 1 44 ARG H 2.000 . 2.300 2.014 1.860 2.317 0.017 16 0 "[ . 1 . ]" 1
448 1 40 LEU O 1 44 ARG N 3.000 2.800 3.300 2.900 2.762 3.249 0.038 6 0 "[ . 1 . ]" 1
449 1 41 ASP H 1 41 ASP QB 2.000 . 4.000 2.349 2.088 2.568 . 0 0 "[ . 1 . ]" 1
450 1 41 ASP HA 1 42 ILE H 2.000 . 5.500 3.580 3.554 3.599 . 0 0 "[ . 1 . ]" 1
451 1 41 ASP HA 1 44 ARG H 2.000 . 4.800 3.706 3.284 4.019 . 0 0 "[ . 1 . ]" 1
452 1 41 ASP HA 1 45 TYR QD 2.000 . 5.000 3.665 3.076 4.855 . 0 0 "[ . 1 . ]" 1
453 1 41 ASP HA 1 45 TYR QE 2.000 . 6.000 3.647 3.300 4.024 . 0 0 "[ . 1 . ]" 1
454 1 41 ASP QB 1 42 ILE H 2.000 . 4.500 2.451 2.055 3.438 . 0 0 "[ . 1 . ]" 1
455 1 41 ASP QB 1 45 TYR QD 2.000 . 6.000 3.871 2.817 4.819 . 0 0 "[ . 1 . ]" 1
456 1 41 ASP QB 1 45 TYR QE 2.000 . 6.500 3.318 2.262 4.623 . 0 0 "[ . 1 . ]" 1
457 1 41 ASP O 1 45 TYR H 2.000 . 2.100 1.945 1.805 2.155 0.055 12 0 "[ . 1 . ]" 1
458 1 41 ASP O 1 45 TYR N 3.000 2.800 3.100 2.837 2.749 3.016 0.051 16 0 "[ . 1 . ]" 1
459 1 42 ILE H 1 42 ILE MD 2.000 . 6.500 3.813 3.199 4.363 . 0 0 "[ . 1 . ]" 1
460 1 42 ILE H 1 42 ILE QG 2.000 . 6.000 2.747 1.776 3.991 0.024 7 0 "[ . 1 . ]" 1
461 1 42 ILE H 1 42 ILE MG 2.000 . 6.000 3.096 1.712 3.788 0.088 13 0 "[ . 1 . ]" 1
462 1 42 ILE H 1 43 ILE H 2.000 . 4.200 3.226 2.998 3.418 . 0 0 "[ . 1 . ]" 1
463 1 42 ILE H 1 82 GLU QB 2.000 . 6.500 5.832 5.717 5.872 . 0 0 "[ . 1 . ]" 1
464 1 42 ILE H 1 89 ILE MD 2.000 . 7.800 5.791 4.830 6.503 . 0 0 "[ . 1 . ]" 1
465 1 42 ILE HA 1 42 ILE MG 2.000 . 6.000 2.684 2.320 3.199 . 0 0 "[ . 1 . ]" 1
466 1 42 ILE HA 1 43 ILE H 2.000 . 5.000 3.577 3.551 3.614 . 0 0 "[ . 1 . ]" 1
467 1 42 ILE HA 1 46 TYR H 2.000 . 4.800 4.203 3.689 4.730 . 0 0 "[ . 1 . ]" 1
468 1 42 ILE HA 1 46 TYR QD 2.000 . 6.500 3.335 2.734 4.120 . 0 0 "[ . 1 . ]" 1
469 1 42 ILE HA 1 46 TYR QE 2.000 . 5.500 3.441 3.007 3.744 . 0 0 "[ . 1 . ]" 1
470 1 43 ILE H 1 43 ILE HB 2.000 . 3.500 2.843 2.178 3.611 0.111 13 0 "[ . 1 . ]" 1
471 1 43 ILE H 1 43 ILE MD 2.000 . 6.000 3.730 1.740 4.334 0.060 6 0 "[ . 1 . ]" 1
472 1 43 ILE H 1 43 ILE QG 2.000 . 5.500 3.031 1.752 3.997 0.048 9 0 "[ . 1 . ]" 1
473 1 43 ILE H 1 43 ILE MG 2.000 . 6.000 2.507 1.825 3.792 . 0 0 "[ . 1 . ]" 1
474 1 43 ILE H 1 44 ARG H 2.000 . 4.200 2.878 2.514 3.017 . 0 0 "[ . 1 . ]" 1
475 1 43 ILE HA 1 43 ILE MD 2.000 . 5.000 3.621 2.076 4.141 . 0 0 "[ . 1 . ]" 1
476 1 43 ILE HA 1 43 ILE QG 2.000 . 5.500 2.693 2.277 3.365 . 0 0 "[ . 1 . ]" 1
477 1 43 ILE HA 1 43 ILE MG 2.000 . 5.000 2.750 2.189 3.198 . 0 0 "[ . 1 . ]" 1
478 1 43 ILE HA 1 44 ARG H 2.000 . 5.000 3.561 3.544 3.585 . 0 0 "[ . 1 . ]" 1
479 1 43 ILE HA 1 47 THR MG 2.000 . 6.500 5.039 4.155 5.451 . 0 0 "[ . 1 . ]" 1
480 1 43 ILE HB 1 44 ARG H 2.000 . 4.500 3.482 2.274 3.977 . 0 0 "[ . 1 . ]" 1
481 1 44 ARG H 1 44 ARG QB 2.000 . 5.500 2.236 2.086 2.422 . 0 0 "[ . 1 . ]" 1
482 1 44 ARG H 1 44 ARG QG 2.000 . 5.500 3.724 2.290 4.080 . 0 0 "[ . 1 . ]" 1
483 1 44 ARG H 1 45 TYR H 2.000 . 4.200 2.815 2.720 2.934 . 0 0 "[ . 1 . ]" 1
484 1 44 ARG H 1 59 LEU QD 2.000 . 8.000 5.772 5.536 5.891 . 0 0 "[ . 1 . ]" 1
485 1 44 ARG HA 1 45 TYR H 2.000 . 5.000 3.565 3.549 3.591 . 0 0 "[ . 1 . ]" 1
486 1 45 TYR H 1 45 TYR QB 2.000 . 4.500 2.312 2.208 2.680 . 0 0 "[ . 1 . ]" 1
487 1 45 TYR H 1 45 TYR QD 2.000 . 6.000 2.529 2.146 3.012 . 0 0 "[ . 1 . ]" 1
488 1 45 TYR H 1 45 TYR QE 2.000 . 7.000 4.527 4.108 4.811 . 0 0 "[ . 1 . ]" 1
489 1 45 TYR H 1 46 TYR QB 2.000 . 6.000 4.593 4.387 5.287 . 0 0 "[ . 1 . ]" 1
490 1 45 TYR H 1 46 TYR QD 2.000 . 6.000 3.825 3.378 4.565 . 0 0 "[ . 1 . ]" 1
491 1 45 TYR H 1 46 TYR QE 2.000 . 6.500 5.315 5.036 5.774 . 0 0 "[ . 1 . ]" 1
492 1 45 TYR HA 1 45 TYR QD 2.000 . 5.000 2.483 2.236 2.910 . 0 0 "[ . 1 . ]" 1
493 1 45 TYR HA 1 45 TYR QE 2.000 . 5.500 4.367 4.256 4.563 . 0 0 "[ . 1 . ]" 1
494 1 45 TYR HA 1 46 TYR H 2.000 . 5.000 3.544 3.532 3.562 . 0 0 "[ . 1 . ]" 1
495 1 45 TYR HA 1 93 ILE H 2.000 . 6.000 5.615 5.134 6.018 0.018 10 0 "[ . 1 . ]" 1
496 1 45 TYR HA 1 94 PHE H 2.000 . 5.000 4.848 4.433 5.013 0.013 4 0 "[ . 1 . ]" 1
497 1 45 TYR HA 1 94 PHE QB 2.000 . 6.000 3.382 2.922 3.954 . 0 0 "[ . 1 . ]" 1
498 1 45 TYR QB 1 45 TYR QD 2.000 . 5.500 2.203 2.160 2.259 . 0 0 "[ . 1 . ]" 1
499 1 45 TYR QB 1 46 TYR H 2.000 . 5.500 2.619 2.448 2.662 . 0 0 "[ . 1 . ]" 1
500 1 45 TYR QB 1 46 TYR QE 2.000 . 7.000 3.400 2.844 3.906 . 0 0 "[ . 1 . ]" 1
501 1 45 TYR QE 1 46 TYR H 2.000 . 7.000 6.345 5.770 6.508 . 0 0 "[ . 1 . ]" 1
502 1 46 TYR H 1 46 TYR QB 2.000 . 4.500 2.447 2.303 3.225 . 0 0 "[ . 1 . ]" 1
503 1 46 TYR H 1 46 TYR QE 2.000 . 7.000 4.341 4.023 4.658 . 0 0 "[ . 1 . ]" 1
504 1 46 TYR H 1 47 THR H 2.000 . 2.800 2.785 2.620 2.910 0.110 13 0 "[ . 1 . ]" 1
505 1 46 TYR H 1 89 ILE MD 2.000 . 8.000 5.870 5.128 6.441 . 0 0 "[ . 1 . ]" 1
506 1 46 TYR HA 1 47 THR H 2.000 . 4.500 3.412 2.528 3.596 . 0 0 "[ . 1 . ]" 1
507 1 46 TYR HA 1 93 ILE H 2.000 . 5.200 4.687 4.006 5.181 . 0 0 "[ . 1 . ]" 1
508 1 46 TYR HA 1 93 ILE HB 2.000 . 4.500 3.810 3.036 4.331 . 0 0 "[ . 1 . ]" 1
509 1 46 TYR HA 1 93 ILE MD 2.000 . 8.000 3.820 2.264 4.545 . 0 0 "[ . 1 . ]" 1
510 1 46 TYR HA 1 93 ILE QG 2.000 . 8.000 4.637 2.477 5.512 . 0 0 "[ . 1 . ]" 1
511 1 46 TYR HA 1 93 ILE MG 2.000 . 8.000 4.831 3.999 5.381 . 0 0 "[ . 1 . ]" 1
512 1 46 TYR HA 1 94 PHE H 2.000 . 5.500 4.212 3.395 5.264 . 0 0 "[ . 1 . ]" 1
513 1 46 TYR HA 1 94 PHE QD 2.000 . 6.500 3.146 2.464 4.699 . 0 0 "[ . 1 . ]" 1
514 1 46 TYR HA 1 94 PHE QE 2.000 . 8.000 2.887 2.333 3.773 . 0 0 "[ . 1 . ]" 1
515 1 46 TYR HA 1 94 PHE HZ 2.000 . 5.000 4.470 3.385 4.928 . 0 0 "[ . 1 . ]" 1
516 1 46 TYR QB 1 47 THR H 2.000 . 4.500 2.461 1.980 4.038 . 0 0 "[ . 1 . ]" 1
517 1 46 TYR QD 1 89 ILE MD 2.000 . 8.000 3.988 3.539 4.324 . 0 0 "[ . 1 . ]" 1
518 1 46 TYR QD 1 93 ILE H 2.000 . 6.500 4.713 3.656 5.325 . 0 0 "[ . 1 . ]" 1
519 1 46 TYR QD 1 94 PHE H 2.000 . 6.500 5.293 4.593 5.996 . 0 0 "[ . 1 . ]" 1
520 1 46 TYR QE 1 48 ARG QB 2.000 . 8.000 6.113 5.796 6.353 . 0 0 "[ . 1 . ]" 1
521 1 46 TYR QE 1 48 ARG QG 2.000 . 6.000 4.574 4.146 4.837 . 0 0 "[ . 1 . ]" 1
522 1 46 TYR QE 1 89 ILE HB 2.000 . 5.500 4.724 4.488 5.039 . 0 0 "[ . 1 . ]" 1
523 1 46 TYR QE 1 89 ILE MD 2.000 . 7.500 2.387 2.139 2.942 . 0 0 "[ . 1 . ]" 1
524 1 46 TYR QE 1 89 ILE QG 2.000 . 7.500 4.061 3.578 4.673 . 0 0 "[ . 1 . ]" 1
525 1 46 TYR QE 1 89 ILE MG 2.000 . 7.500 3.186 2.469 3.542 . 0 0 "[ . 1 . ]" 1
526 1 46 TYR QE 1 92 ARG HA 2.000 . 5.500 3.737 2.437 5.181 . 0 0 "[ . 1 . ]" 1
527 1 47 THR H 1 47 THR MG 2.000 . 4.500 3.411 1.717 3.888 0.083 16 0 "[ . 1 . ]" 1
528 1 47 THR HA 1 47 THR MG 2.000 . 5.000 2.396 2.121 3.148 . 0 0 "[ . 1 . ]" 1
529 1 47 THR HA 1 48 ARG H 2.000 . 3.500 3.282 3.153 3.553 0.053 16 0 "[ . 1 . ]" 1
530 1 47 THR HA 1 94 PHE QD 2.000 . 8.000 6.766 6.070 7.162 . 0 0 "[ . 1 . ]" 1
531 1 47 THR HA 1 94 PHE QE 2.000 . 7.000 5.658 4.759 6.473 . 0 0 "[ . 1 . ]" 1
532 1 47 THR HB 1 48 ARG H 2.000 . 3.800 3.795 3.665 3.882 0.082 4 0 "[ . 1 . ]" 1
533 1 47 THR HB 1 94 PHE QE 2.000 . 6.500 4.049 2.345 5.706 . 0 0 "[ . 1 . ]" 1
534 1 47 THR MG 1 94 PHE QD 2.000 . 8.000 5.171 3.742 6.123 . 0 0 "[ . 1 . ]" 1
535 1 47 THR MG 1 94 PHE QE 2.000 . 7.500 4.342 2.197 5.271 . 0 0 "[ . 1 . ]" 1
536 1 47 THR MG 1 94 PHE HZ 2.000 . 6.500 4.935 3.212 5.434 . 0 0 "[ . 1 . ]" 1
537 1 48 ARG H 1 48 ARG QB 2.000 . 4.800 2.694 2.314 2.913 . 0 0 "[ . 1 . ]" 1
538 1 48 ARG H 1 48 ARG QG 2.000 . 5.000 2.087 1.813 3.090 . 0 0 "[ . 1 . ]" 1
539 1 48 ARG HA 1 49 GLU H 2.000 . 2.800 2.385 2.184 2.826 0.026 8 0 "[ . 1 . ]" 1
540 1 48 ARG HA 1 94 PHE QE 2.000 . 8.000 4.506 3.792 5.464 . 0 0 "[ . 1 . ]" 1
541 1 48 ARG QB 1 49 GLU H 2.000 . 5.500 3.369 1.753 4.059 0.047 8 0 "[ . 1 . ]" 1
542 1 48 ARG QB 1 94 PHE QD 2.000 . 7.000 5.084 4.564 5.587 . 0 0 "[ . 1 . ]" 1
543 1 48 ARG QB 1 94 PHE QE 2.000 . 6.500 3.064 2.363 3.847 . 0 0 "[ . 1 . ]" 1
544 1 48 ARG QB 1 94 PHE HZ 2.000 . 6.500 2.882 2.336 3.459 . 0 0 "[ . 1 . ]" 1
545 1 48 ARG QG 1 49 GLU H 2.000 . 5.200 4.183 3.479 4.485 . 0 0 "[ . 1 . ]" 1
546 1 49 GLU H 1 49 GLU QB 2.000 . 4.500 2.989 2.351 3.455 . 0 0 "[ . 1 . ]" 1
547 1 49 GLU H 1 49 GLU QG 2.000 . 4.500 2.592 1.717 4.012 0.083 2 0 "[ . 1 . ]" 1
548 1 49 GLU HA 1 51 GLY H 2.000 . 5.000 4.470 3.757 4.984 . 0 0 "[ . 1 . ]" 1
549 1 49 GLU QB 1 51 GLY H 2.000 . 5.000 3.164 2.487 4.073 . 0 0 "[ . 1 . ]" 1
550 1 49 GLU QG 1 51 GLY H 2.000 . 5.500 3.951 1.796 4.866 0.004 5 0 "[ . 1 . ]" 1
551 1 50 ALA HA 1 51 GLY H 2.000 . 4.500 2.762 2.504 3.102 . 0 0 "[ . 1 . ]" 1
552 1 50 ALA MB 1 51 GLY H 2.000 . 4.500 3.685 3.515 3.735 . 0 0 "[ . 1 . ]" 1
553 1 51 GLY H 1 52 VAL H 2.000 . 4.200 4.126 3.905 4.245 0.045 1 0 "[ . 1 . ]" 1
554 1 51 GLY QA 1 52 VAL H 2.000 . 3.800 2.209 2.155 2.273 . 0 0 "[ . 1 . ]" 1
555 1 51 GLY QA 1 53 ARG H 2.000 . 5.200 3.532 3.385 3.718 . 0 0 "[ . 1 . ]" 1
556 1 52 VAL H 1 52 VAL QG 2.000 . 5.000 1.754 1.703 1.891 0.097 3 0 "[ . 1 . ]" 1
557 1 52 VAL H 1 53 ARG H 2.000 . 2.800 2.672 2.485 2.822 0.022 8 0 "[ . 1 . ]" 1
558 1 52 VAL H 1 53 ARG QB 2.000 . 5.500 4.478 4.218 4.809 . 0 0 "[ . 1 . ]" 1
559 1 52 VAL HA 1 52 VAL QG 2.000 . 5.000 2.276 2.197 2.349 . 0 0 "[ . 1 . ]" 1
560 1 52 VAL HA 1 53 ARG H 2.000 . 4.200 3.560 3.549 3.572 . 0 0 "[ . 1 . ]" 1
561 1 52 VAL HA 1 55 LEU H 2.000 . 4.200 3.184 3.113 3.236 . 0 0 "[ . 1 . ]" 1
562 1 52 VAL HA 1 56 GLU H 2.000 . 5.000 3.839 3.657 4.189 . 0 0 "[ . 1 . ]" 1
563 1 52 VAL HB 1 55 LEU H 2.000 . 5.000 5.034 5.015 5.051 0.051 4 0 "[ . 1 . ]" 1
564 1 52 VAL QG 1 53 ARG H 2.000 . 6.500 1.895 1.798 1.989 0.002 11 0 "[ . 1 . ]" 1
565 1 52 VAL O 1 56 GLU H 2.000 . 2.100 1.868 1.799 2.052 0.001 12 0 "[ . 1 . ]" 1
566 1 52 VAL O 1 56 GLU N 3.000 2.800 3.100 2.819 2.760 3.009 0.040 6 0 "[ . 1 . ]" 1
567 1 53 ARG H 1 53 ARG HA 2.000 . 2.800 2.762 2.736 2.783 . 0 0 "[ . 1 . ]" 1
568 1 53 ARG H 1 53 ARG QB 2.000 . 4.200 2.315 2.165 2.661 . 0 0 "[ . 1 . ]" 1
569 1 53 ARG H 1 53 ARG QD 2.000 . 6.000 4.136 2.862 4.835 . 0 0 "[ . 1 . ]" 1
570 1 53 ARG H 1 53 ARG QG 2.000 . 5.500 3.342 1.839 4.109 . 0 0 "[ . 1 . ]" 1
571 1 53 ARG H 1 54 SER H 2.000 . 3.500 3.048 2.897 3.177 . 0 0 "[ . 1 . ]" 1
572 1 53 ARG H 1 55 LEU H 2.000 . 5.000 4.372 4.159 4.685 . 0 0 "[ . 1 . ]" 1
573 1 53 ARG HA 1 56 GLU H 2.000 . 4.200 3.841 3.569 4.050 . 0 0 "[ . 1 . ]" 1
574 1 53 ARG QB 1 54 SER H 2.000 . 5.200 2.460 2.071 3.379 . 0 0 "[ . 1 . ]" 1
575 1 53 ARG QD 1 57 ARG H 2.000 . 6.500 5.195 4.394 5.859 . 0 0 "[ . 1 . ]" 1
576 1 53 ARG O 1 57 ARG H 2.000 . 2.100 2.118 1.983 2.143 0.043 14 0 "[ . 1 . ]" 1
577 1 53 ARG O 1 57 ARG N 3.000 2.800 3.100 3.011 2.858 3.060 . 0 0 "[ . 1 . ]" 1
578 1 54 SER H 1 54 SER QB 2.000 . 5.000 2.626 2.474 2.800 . 0 0 "[ . 1 . ]" 1
579 1 54 SER H 1 55 LEU H 2.000 . 4.200 2.741 2.616 2.845 . 0 0 "[ . 1 . ]" 1
580 1 54 SER HA 1 55 LEU H 2.000 . 3.500 3.564 3.550 3.576 0.076 2 0 "[ . 1 . ]" 1
581 1 54 SER HA 1 57 ARG H 2.000 . 5.000 3.235 3.108 3.316 . 0 0 "[ . 1 . ]" 1
582 1 54 SER QB 1 55 LEU H 2.000 . 5.200 2.445 2.211 3.285 . 0 0 "[ . 1 . ]" 1
583 1 54 SER QB 1 57 ARG H 2.000 . 5.000 4.578 4.557 4.616 . 0 0 "[ . 1 . ]" 1
584 1 54 SER O 1 58 GLN H 2.000 . 2.100 1.929 1.845 2.015 . 0 0 "[ . 1 . ]" 1
585 1 54 SER O 1 58 GLN N 3.000 2.800 3.100 2.835 2.767 2.922 0.033 14 0 "[ . 1 . ]" 1
586 1 55 LEU H 1 55 LEU QB 2.000 . 4.500 2.228 2.070 2.720 . 0 0 "[ . 1 . ]" 1
587 1 55 LEU H 1 55 LEU QD 2.000 . 6.500 3.438 1.971 3.779 . 0 0 "[ . 1 . ]" 1
588 1 55 LEU H 1 55 LEU HG 2.000 . 5.000 3.958 1.797 4.517 0.003 6 0 "[ . 1 . ]" 1
589 1 55 LEU H 1 56 GLU H 2.000 . 4.200 2.953 2.809 3.080 . 0 0 "[ . 1 . ]" 1
590 1 55 LEU HA 1 58 GLN H 2.000 . 4.200 3.355 3.238 3.539 . 0 0 "[ . 1 . ]" 1
591 1 55 LEU O 1 59 LEU H 2.000 . 2.100 2.093 1.813 2.148 0.048 13 0 "[ . 1 . ]" 1
592 1 55 LEU O 1 59 LEU N 3.000 2.800 3.100 3.052 2.782 3.101 0.018 6 0 "[ . 1 . ]" 1
593 1 56 GLU H 1 56 GLU QB 2.000 . 4.500 2.454 2.144 2.681 . 0 0 "[ . 1 . ]" 1
594 1 56 GLU H 1 56 GLU QG 2.000 . 5.500 2.610 1.800 4.070 . 0 0 "[ . 1 . ]" 1
595 1 56 GLU H 1 57 ARG H 2.000 . 3.500 2.784 2.656 2.862 . 0 0 "[ . 1 . ]" 1
596 1 56 GLU HA 1 57 ARG H 2.000 . 4.200 3.558 3.551 3.565 . 0 0 "[ . 1 . ]" 1
597 1 56 GLU HA 1 59 LEU H 2.000 . 3.500 3.486 3.374 3.539 0.039 12 0 "[ . 1 . ]" 1
598 1 56 GLU HA 1 60 ALA H 2.000 . 4.500 3.825 3.699 3.939 . 0 0 "[ . 1 . ]" 1
599 1 56 GLU O 1 60 ALA H 2.000 . 2.100 1.832 1.799 1.885 0.001 6 0 "[ . 1 . ]" 1
600 1 56 GLU O 1 60 ALA N 3.000 2.800 3.100 2.788 2.731 2.854 0.069 15 0 "[ . 1 . ]" 1
601 1 57 ARG H 1 57 ARG QB 2.000 . 5.000 2.210 2.066 2.281 . 0 0 "[ . 1 . ]" 1
602 1 57 ARG H 1 57 ARG QG 2.000 . 5.000 3.900 3.468 4.062 . 0 0 "[ . 1 . ]" 1
603 1 57 ARG H 1 58 GLN H 2.000 . 3.500 2.698 2.654 2.752 . 0 0 "[ . 1 . ]" 1
604 1 57 ARG HA 1 60 ALA H 2.000 . 3.500 3.528 3.426 3.551 0.051 16 0 "[ . 1 . ]" 1
605 1 57 ARG O 1 61 ALA H 2.000 . 2.100 1.914 1.876 2.029 . 0 0 "[ . 1 . ]" 1
606 1 57 ARG O 1 61 ALA N 3.000 2.800 3.100 2.788 2.754 2.931 0.046 4 0 "[ . 1 . ]" 1
607 1 58 GLN H 1 58 GLN QB 2.000 . 4.500 2.251 2.128 2.393 . 0 0 "[ . 1 . ]" 1
608 1 58 GLN H 1 59 LEU H 2.000 . 3.500 2.747 2.680 2.811 . 0 0 "[ . 1 . ]" 1
609 1 58 GLN H 1 60 ALA H 2.000 . 5.000 4.142 4.005 4.369 . 0 0 "[ . 1 . ]" 1
610 1 58 GLN HA 1 59 LEU H 2.000 . 5.000 3.575 3.556 3.592 . 0 0 "[ . 1 . ]" 1
611 1 58 GLN HA 1 60 ALA H 2.000 . 5.000 4.628 4.458 4.773 . 0 0 "[ . 1 . ]" 1
612 1 58 GLN HA 1 61 ALA H 2.000 . 3.500 3.486 3.389 3.544 0.044 8 0 "[ . 1 . ]" 1
613 1 58 GLN QB 1 59 LEU H 2.000 . 4.500 2.437 2.280 2.714 . 0 0 "[ . 1 . ]" 1
614 1 58 GLN O 1 62 ILE H 2.000 . 2.100 2.095 1.932 2.134 0.034 16 0 "[ . 1 . ]" 1
615 1 58 GLN O 1 62 ILE N 3.000 2.800 3.100 3.062 2.908 3.103 0.003 10 0 "[ . 1 . ]" 1
616 1 59 LEU H 1 59 LEU QB 2.000 . 4.000 2.649 2.516 2.743 . 0 0 "[ . 1 . ]" 1
617 1 59 LEU H 1 59 LEU QD 2.000 . 5.500 2.646 2.312 2.937 . 0 0 "[ . 1 . ]" 1
618 1 59 LEU H 1 59 LEU HG 2.000 . 3.000 1.800 1.761 1.988 0.039 11 0 "[ . 1 . ]" 1
619 1 59 LEU H 1 60 ALA H 2.000 . 3.500 2.685 2.574 2.811 . 0 0 "[ . 1 . ]" 1
620 1 59 LEU H 1 60 ALA MB 2.000 . 6.500 4.331 4.240 4.381 . 0 0 "[ . 1 . ]" 1
621 1 59 LEU HA 1 59 LEU QD 2.000 . 6.500 2.160 2.113 2.242 . 0 0 "[ . 1 . ]" 1
622 1 59 LEU HA 1 59 LEU HG 2.000 . 4.500 3.191 2.822 3.405 . 0 0 "[ . 1 . ]" 1
623 1 59 LEU HA 1 62 ILE H 2.000 . 3.500 3.506 3.402 3.532 0.032 9 0 "[ . 1 . ]" 1
624 1 59 LEU HA 1 62 ILE MD 2.000 . 6.500 4.387 4.265 4.584 . 0 0 "[ . 1 . ]" 1
625 1 59 LEU HA 1 62 ILE MG 2.000 . 6.500 2.527 2.215 2.872 . 0 0 "[ . 1 . ]" 1
626 1 59 LEU HA 1 89 ILE MD 2.000 . 7.000 5.303 4.501 5.751 . 0 0 "[ . 1 . ]" 1
627 1 59 LEU QB 1 60 ALA H 2.000 . 4.500 2.462 2.278 2.585 . 0 0 "[ . 1 . ]" 1
628 1 59 LEU QB 1 61 ALA H 2.000 . 6.500 4.550 4.437 4.624 . 0 0 "[ . 1 . ]" 1
629 1 59 LEU QD 1 60 ALA H 2.000 . 6.500 3.898 3.830 3.970 . 0 0 "[ . 1 . ]" 1
630 1 59 LEU QD 1 61 ALA H 2.000 . 7.500 5.079 4.959 5.276 . 0 0 "[ . 1 . ]" 1
631 1 59 LEU QD 1 62 ILE H 2.000 . 7.500 4.793 4.652 5.055 . 0 0 "[ . 1 . ]" 1
632 1 59 LEU HG 1 60 ALA H 2.000 . 4.500 3.831 3.654 4.109 . 0 0 "[ . 1 . ]" 1
633 1 59 LEU HG 1 61 ALA H 2.000 . 5.500 5.574 5.540 5.600 0.100 3 0 "[ . 1 . ]" 1
634 1 59 LEU O 1 63 CYS H 2.000 . 2.100 1.929 1.816 2.102 0.002 3 0 "[ . 1 . ]" 1
635 1 59 LEU O 1 63 CYS N 3.000 2.800 3.100 2.887 2.791 3.076 0.009 6 0 "[ . 1 . ]" 1
636 1 60 ALA H 1 60 ALA MB 2.000 . 4.000 2.229 2.066 2.258 . 0 0 "[ . 1 . ]" 1
637 1 60 ALA H 1 61 ALA H 2.000 . 3.500 2.642 2.578 2.737 . 0 0 "[ . 1 . ]" 1
638 1 60 ALA HA 1 61 ALA H 2.000 . 4.200 3.529 3.521 3.538 . 0 0 "[ . 1 . ]" 1
639 1 60 ALA HA 1 63 CYS H 2.000 . 4.200 3.720 3.492 3.796 . 0 0 "[ . 1 . ]" 1
640 1 60 ALA O 1 64 ARG H 2.000 . 2.100 2.102 1.995 2.132 0.032 8 0 "[ . 1 . ]" 1
641 1 60 ALA O 1 64 ARG N 3.000 2.800 3.100 3.007 2.864 3.071 . 0 0 "[ . 1 . ]" 1
642 1 61 ALA H 1 61 ALA MB 2.000 . 4.500 2.228 2.213 2.247 . 0 0 "[ . 1 . ]" 1
643 1 61 ALA H 1 62 ILE H 2.000 . 3.500 2.925 2.852 3.002 . 0 0 "[ . 1 . ]" 1
644 1 61 ALA H 1 63 CYS H 2.000 . 5.500 4.164 4.037 4.400 . 0 0 "[ . 1 . ]" 1
645 1 61 ALA HA 1 62 ILE H 2.000 . 4.200 3.604 3.595 3.608 . 0 0 "[ . 1 . ]" 1
646 1 61 ALA HA 1 63 CYS H 2.000 . 5.000 4.647 4.503 4.835 . 0 0 "[ . 1 . ]" 1
647 1 61 ALA MB 1 62 ILE H 2.000 . 5.000 2.179 2.048 2.265 . 0 0 "[ . 1 . ]" 1
648 1 61 ALA MB 1 63 CYS H 2.000 . 6.000 4.391 4.267 4.555 . 0 0 "[ . 1 . ]" 1
649 1 61 ALA MB 1 89 ILE HA 2.000 . 8.000 6.193 5.146 6.565 . 0 0 "[ . 1 . ]" 1
650 1 61 ALA O 1 65 LYS H 2.000 . 2.100 1.883 1.842 1.928 . 0 0 "[ . 1 . ]" 1
651 1 61 ALA O 1 65 LYS N 3.000 2.800 3.100 2.766 2.719 2.832 0.081 12 0 "[ . 1 . ]" 1
652 1 62 ILE H 1 62 ILE HB 2.000 . 4.000 2.287 2.206 2.378 . 0 0 "[ . 1 . ]" 1
653 1 62 ILE H 1 62 ILE MD 2.000 . 6.000 4.288 4.221 4.376 . 0 0 "[ . 1 . ]" 1
654 1 62 ILE H 1 62 ILE QG 2.000 . 5.000 3.880 3.798 3.941 . 0 0 "[ . 1 . ]" 1
655 1 62 ILE H 1 62 ILE MG 2.000 . 6.000 2.599 2.381 2.776 . 0 0 "[ . 1 . ]" 1
656 1 62 ILE H 1 63 CYS H 2.000 . 3.500 2.763 2.705 2.860 . 0 0 "[ . 1 . ]" 1
657 1 62 ILE HA 1 62 ILE MD 2.000 . 5.000 3.755 3.717 3.796 . 0 0 "[ . 1 . ]" 1
658 1 62 ILE HA 1 62 ILE QG 2.000 . 4.500 2.254 2.203 2.314 . 0 0 "[ . 1 . ]" 1
659 1 62 ILE HA 1 62 ILE MG 2.000 . 5.000 3.171 3.128 3.187 . 0 0 "[ . 1 . ]" 1
660 1 62 ILE HA 1 63 CYS H 2.000 . 4.200 3.560 3.553 3.575 . 0 0 "[ . 1 . ]" 1
661 1 62 ILE HA 1 65 LYS H 2.000 . 4.200 3.823 3.617 4.061 . 0 0 "[ . 1 . ]" 1
662 1 62 ILE HA 1 65 LYS QB 2.000 . 5.000 2.292 2.245 2.431 . 0 0 "[ . 1 . ]" 1
663 1 62 ILE HA 1 66 ALA H 2.000 . 5.500 4.108 3.997 4.218 . 0 0 "[ . 1 . ]" 1
664 1 62 ILE HA 1 88 PHE QB 2.000 . 4.500 3.326 2.811 3.589 . 0 0 "[ . 1 . ]" 1
665 1 62 ILE HA 1 88 PHE QD 2.000 . 5.500 4.940 4.580 5.193 . 0 0 "[ . 1 . ]" 1
666 1 62 ILE HA 1 88 PHE QE 2.000 . 7.500 6.465 6.158 6.750 . 0 0 "[ . 1 . ]" 1
667 1 62 ILE MD 1 63 CYS H 2.000 . 7.000 4.462 4.182 4.599 . 0 0 "[ . 1 . ]" 1
668 1 62 ILE MD 1 88 PHE QD 2.000 . 7.500 3.082 2.641 3.660 . 0 0 "[ . 1 . ]" 1
669 1 62 ILE MD 1 88 PHE QE 2.000 . 8.000 4.736 4.173 5.383 . 0 0 "[ . 1 . ]" 1
670 1 62 ILE MD 1 89 ILE MD 2.000 . 7.500 2.286 1.975 2.876 . 0 0 "[ . 1 . ]" 1
671 1 62 ILE QG 1 89 ILE MD 2.000 . 7.500 3.229 2.550 3.805 . 0 0 "[ . 1 . ]" 1
672 1 62 ILE MG 1 63 CYS H 2.000 . 7.000 1.751 1.674 1.804 0.126 16 0 "[ . 1 . ]" 1
673 1 62 ILE MG 1 80 VAL QG 2.000 . 8.000 3.288 2.592 3.815 . 0 0 "[ . 1 . ]" 1
674 1 62 ILE MG 1 88 PHE QD 2.000 . 7.000 4.514 4.205 4.770 . 0 0 "[ . 1 . ]" 1
675 1 62 ILE MG 1 88 PHE QE 2.000 . 7.500 5.450 5.235 5.568 . 0 0 "[ . 1 . ]" 1
676 1 62 ILE MG 1 89 ILE MD 2.000 . 8.000 3.880 3.367 4.267 . 0 0 "[ . 1 . ]" 1
677 1 62 ILE O 1 66 ALA H 2.000 . 2.100 2.143 2.116 2.170 0.070 16 0 "[ . 1 . ]" 1
678 1 62 ILE O 1 66 ALA N 3.000 2.800 3.100 2.992 2.963 3.019 . 0 0 "[ . 1 . ]" 1
679 1 63 CYS H 1 63 CYS QB 2.000 . 4.500 2.406 2.223 2.513 . 0 0 "[ . 1 . ]" 1
680 1 63 CYS H 1 64 ARG H 2.000 . 3.500 3.147 3.050 3.228 . 0 0 "[ . 1 . ]" 1
681 1 63 CYS HA 1 64 ARG H 2.000 . 4.200 3.588 3.568 3.600 . 0 0 "[ . 1 . ]" 1
682 1 63 CYS HA 1 65 LYS H 2.000 . 5.500 4.754 4.602 4.914 . 0 0 "[ . 1 . ]" 1
683 1 63 CYS HA 1 66 ALA H 2.000 . 4.200 3.777 3.607 3.905 . 0 0 "[ . 1 . ]" 1
684 1 63 CYS QB 1 64 ARG H 2.000 . 5.000 2.083 1.911 2.248 . 0 0 "[ . 1 . ]" 1
685 1 63 CYS O 1 67 ALA H 2.000 . 2.100 2.128 2.087 2.164 0.064 11 0 "[ . 1 . ]" 1
686 1 63 CYS O 1 67 ALA N 3.000 2.800 3.100 3.002 2.949 3.048 . 0 0 "[ . 1 . ]" 1
687 1 64 ARG H 1 64 ARG QB 2.000 . 4.500 2.393 2.106 2.655 . 0 0 "[ . 1 . ]" 1
688 1 64 ARG H 1 65 LYS H 2.000 . 3.500 2.848 2.756 2.992 . 0 0 "[ . 1 . ]" 1
689 1 64 ARG H 1 66 ALA H 2.000 . 5.500 4.157 4.072 4.197 . 0 0 "[ . 1 . ]" 1
690 1 64 ARG HA 1 65 LYS H 2.000 . 4.200 3.586 3.578 3.595 . 0 0 "[ . 1 . ]" 1
691 1 64 ARG HA 1 66 ALA H 2.000 . 5.500 3.915 3.869 3.986 . 0 0 "[ . 1 . ]" 1
692 1 64 ARG HA 1 67 ALA H 2.000 . 5.000 2.612 2.538 2.682 . 0 0 "[ . 1 . ]" 1
693 1 64 ARG HA 1 68 LYS H 2.000 . 5.500 3.882 3.519 4.155 . 0 0 "[ . 1 . ]" 1
694 1 64 ARG QB 1 65 LYS H 2.000 . 5.000 3.072 2.367 3.383 . 0 0 "[ . 1 . ]" 1
695 1 64 ARG QB 1 67 ALA H 2.000 . 4.500 4.189 4.115 4.316 . 0 0 "[ . 1 . ]" 1
696 1 64 ARG O 1 68 LYS H 2.000 . 2.100 1.896 1.832 2.073 . 0 0 "[ . 1 . ]" 1
697 1 64 ARG O 1 68 LYS N 3.000 2.800 3.100 2.807 2.768 2.980 0.032 11 0 "[ . 1 . ]" 1
698 1 65 LYS H 1 65 LYS HA 2.000 . 3.000 2.774 2.757 2.791 . 0 0 "[ . 1 . ]" 1
699 1 65 LYS H 1 65 LYS QB 2.000 . 4.500 2.305 2.280 2.322 . 0 0 "[ . 1 . ]" 1
700 1 65 LYS H 1 65 LYS QG 2.000 . 5.000 4.057 3.998 4.103 . 0 0 "[ . 1 . ]" 1
701 1 65 LYS H 1 66 ALA H 2.000 . 2.800 2.811 2.754 2.832 0.032 15 0 "[ . 1 . ]" 1
702 1 65 LYS H 1 66 ALA MB 2.000 . 6.500 4.515 4.436 4.540 . 0 0 "[ . 1 . ]" 1
703 1 65 LYS H 1 67 ALA H 2.000 . 5.500 4.039 3.997 4.067 . 0 0 "[ . 1 . ]" 1
704 1 65 LYS H 1 68 LYS H 2.000 . 5.500 4.829 4.743 4.995 . 0 0 "[ . 1 . ]" 1
705 1 65 LYS QB 1 66 ALA H 2.000 . 4.500 2.555 2.527 2.601 . 0 0 "[ . 1 . ]" 1
706 1 65 LYS QB 1 88 PHE QD 2.000 . 6.000 4.091 3.755 4.330 . 0 0 "[ . 1 . ]" 1
707 1 65 LYS QB 1 88 PHE QE 2.000 . 8.000 5.432 5.223 5.653 . 0 0 "[ . 1 . ]" 1
708 1 65 LYS QG 1 88 PHE QD 2.000 . 6.000 3.134 2.483 3.567 . 0 0 "[ . 1 . ]" 1
709 1 65 LYS QG 1 88 PHE QE 2.000 . 8.000 4.728 3.898 5.165 . 0 0 "[ . 1 . ]" 1
710 1 66 ALA H 1 66 ALA MB 2.000 . 4.500 2.250 2.190 2.272 . 0 0 "[ . 1 . ]" 1
711 1 66 ALA H 1 67 ALA H 2.000 . 3.500 2.498 2.474 2.524 . 0 0 "[ . 1 . ]" 1
712 1 66 ALA H 1 68 LYS H 2.000 . 5.000 4.213 4.097 4.603 . 0 0 "[ . 1 . ]" 1
713 1 66 ALA HA 1 88 PHE QD 2.000 . 6.000 3.047 2.715 3.657 . 0 0 "[ . 1 . ]" 1
714 1 66 ALA MB 1 67 ALA H 2.000 . 4.500 2.570 2.537 2.615 . 0 0 "[ . 1 . ]" 1
715 1 66 ALA MB 1 68 LYS H 2.000 . 6.000 4.623 4.474 4.973 . 0 0 "[ . 1 . ]" 1
716 1 66 ALA MB 1 88 PHE QD 2.000 . 8.000 3.171 2.888 3.485 . 0 0 "[ . 1 . ]" 1
717 1 66 ALA MB 1 88 PHE QE 2.000 . 7.000 2.459 2.207 2.916 . 0 0 "[ . 1 . ]" 1
718 1 67 ALA H 1 67 ALA MB 2.000 . 4.500 2.247 2.232 2.266 . 0 0 "[ . 1 . ]" 1
719 1 67 ALA H 1 68 LYS H 2.000 . 3.500 2.795 2.709 2.981 . 0 0 "[ . 1 . ]" 1
720 1 67 ALA H 1 69 ALA H 2.000 . 5.500 4.158 3.979 4.268 . 0 0 "[ . 1 . ]" 1
721 1 67 ALA HA 1 68 LYS H 2.000 . 4.500 3.564 3.548 3.589 . 0 0 "[ . 1 . ]" 1
722 1 67 ALA MB 1 68 LYS H 2.000 . 5.000 2.413 2.008 2.539 . 0 0 "[ . 1 . ]" 1
723 1 68 LYS H 1 68 LYS HA 2.000 . 3.000 2.855 2.800 2.903 . 0 0 "[ . 1 . ]" 1
724 1 68 LYS H 1 68 LYS QB 2.000 . 4.500 2.318 2.065 2.644 . 0 0 "[ . 1 . ]" 1
725 1 68 LYS H 1 68 LYS QG 2.000 . 5.000 3.042 1.858 4.072 . 0 0 "[ . 1 . ]" 1
726 1 68 LYS H 1 69 ALA H 2.000 . 2.800 2.677 2.525 2.815 0.015 16 0 "[ . 1 . ]" 1
727 1 68 LYS H 1 70 ILE H 2.000 . 5.000 4.063 3.997 4.126 . 0 0 "[ . 1 . ]" 1
728 1 68 LYS HA 1 69 ALA H 2.000 . 3.500 3.541 3.538 3.545 0.045 3 0 "[ . 1 . ]" 1
729 1 68 LYS QB 1 69 ALA H 2.000 . 4.500 2.607 2.551 2.748 . 0 0 "[ . 1 . ]" 1
730 1 68 LYS QG 1 69 ALA H 2.000 . 6.500 4.043 3.619 4.537 . 0 0 "[ . 1 . ]" 1
731 1 69 ALA H 1 69 ALA MB 2.000 . 4.500 2.237 2.051 2.261 . 0 0 "[ . 1 . ]" 1
732 1 69 ALA H 1 70 ILE H 2.000 . 2.800 2.811 2.770 2.860 0.060 2 0 "[ . 1 . ]" 1
733 1 69 ALA HA 1 70 ILE H 2.000 . 4.200 3.319 3.085 3.433 . 0 0 "[ . 1 . ]" 1
734 1 69 ALA MB 1 70 ILE H 2.000 . 5.500 3.224 2.987 3.503 . 0 0 "[ . 1 . ]" 1
735 1 69 ALA MB 1 71 VAL H 2.000 . 6.500 4.088 3.722 4.407 . 0 0 "[ . 1 . ]" 1
736 1 70 ILE H 1 70 ILE MD 2.000 . 5.500 4.006 3.427 4.293 . 0 0 "[ . 1 . ]" 1
737 1 70 ILE H 1 70 ILE QG 2.000 . 5.000 3.621 2.291 4.096 . 0 0 "[ . 1 . ]" 1
738 1 70 ILE H 1 70 ILE MG 2.000 . 5.500 2.576 1.935 3.765 . 0 0 "[ . 1 . ]" 1
739 1 70 ILE H 1 72 ALA H 2.000 . 5.000 4.478 4.219 4.935 . 0 0 "[ . 1 . ]" 1
740 1 70 ILE HA 1 70 ILE HB 2.000 . 3.000 2.631 2.426 3.024 0.024 12 0 "[ . 1 . ]" 1
741 1 70 ILE HA 1 70 ILE MD 2.000 . 4.000 2.624 2.057 3.347 . 0 0 "[ . 1 . ]" 1
742 1 70 ILE HA 1 70 ILE QG 2.000 . 5.000 2.493 2.218 3.030 . 0 0 "[ . 1 . ]" 1
743 1 70 ILE HA 1 70 ILE MG 2.000 . 5.000 3.019 2.437 3.210 . 0 0 "[ . 1 . ]" 1
744 1 70 ILE HA 1 71 VAL H 2.000 . 5.000 3.388 2.963 3.520 . 0 0 "[ . 1 . ]" 1
745 1 70 ILE HB 1 71 VAL H 2.000 . 4.500 3.936 2.975 4.532 0.032 13 0 "[ . 1 . ]" 1
746 1 71 VAL H 1 71 VAL QG 2.000 . 6.500 1.921 1.760 2.222 0.040 12 0 "[ . 1 . ]" 1
747 1 71 VAL H 1 72 ALA H 2.000 . 4.200 2.710 2.385 2.956 . 0 0 "[ . 1 . ]" 1
748 1 71 VAL HA 1 71 VAL HB 2.000 . 3.000 2.684 2.436 3.031 0.031 4 0 "[ . 1 . ]" 1
749 1 71 VAL HA 1 71 VAL QG 2.000 . 4.500 2.204 2.049 2.378 . 0 0 "[ . 1 . ]" 1
750 1 71 VAL HA 1 72 ALA H 2.000 . 3.500 3.407 2.953 3.547 0.047 16 0 "[ . 1 . ]" 1
751 1 72 ALA H 1 72 ALA HA 2.000 . 3.000 2.900 2.829 2.956 . 0 0 "[ . 1 . ]" 1
752 1 72 ALA H 1 72 ALA MB 2.000 . 4.500 2.250 2.179 2.309 . 0 0 "[ . 1 . ]" 1
753 1 72 ALA HA 1 73 GLU H 2.000 . 3.000 2.762 2.269 3.018 0.018 13 0 "[ . 1 . ]" 1
754 1 72 ALA MB 1 73 GLU H 2.000 . 4.500 2.273 1.762 3.706 0.038 11 0 "[ . 1 . ]" 1
755 1 73 GLU H 1 73 GLU HA 2.000 . 3.000 2.758 2.344 2.994 . 0 0 "[ . 1 . ]" 1
756 1 73 GLU H 1 73 GLU QB 2.000 . 3.500 2.627 2.261 2.958 . 0 0 "[ . 1 . ]" 1
757 1 76 LYS HA 1 77 ARG H 2.000 . 2.800 2.461 2.193 2.823 0.023 9 0 "[ . 1 . ]" 1
758 1 76 LYS QB 1 77 ARG H 2.000 . 6.000 2.765 1.863 3.980 . 0 0 "[ . 1 . ]" 1
759 1 76 LYS QD 1 77 ARG H 2.000 . 6.000 4.500 3.797 5.373 . 0 0 "[ . 1 . ]" 1
760 1 77 ARG H 1 77 ARG QB 2.000 . 4.500 3.171 2.496 3.430 . 0 0 "[ . 1 . ]" 1
761 1 77 ARG H 1 77 ARG QG 2.000 . 5.500 2.429 1.754 2.899 0.046 11 0 "[ . 1 . ]" 1
762 1 77 ARG H 1 78 ILE H 2.000 . 5.000 3.868 3.376 4.697 . 0 0 "[ . 1 . ]" 1
763 1 77 ARG HA 1 77 ARG QD 2.000 . 6.000 3.895 2.302 4.519 . 0 0 "[ . 1 . ]" 1
764 1 77 ARG HA 1 77 ARG QG 2.000 . 5.000 2.562 2.180 3.365 . 0 0 "[ . 1 . ]" 1
765 1 77 ARG HA 1 78 ILE H 2.000 . 2.500 2.276 2.187 2.407 . 0 0 "[ . 1 . ]" 1
766 1 77 ARG QB 1 78 ILE H 2.000 . 5.200 3.549 2.777 3.860 . 0 0 "[ . 1 . ]" 1
767 1 77 ARG QG 1 78 ILE H 2.000 . 6.000 4.395 4.044 4.625 . 0 0 "[ . 1 . ]" 1
768 1 78 ILE H 1 78 ILE HB 2.000 . 3.000 2.581 2.419 2.709 . 0 0 "[ . 1 . ]" 1
769 1 78 ILE H 1 78 ILE MD 2.000 . 6.000 3.436 2.620 3.686 . 0 0 "[ . 1 . ]" 1
770 1 78 ILE H 1 78 ILE QG 2.000 . 5.500 2.131 1.891 2.494 . 0 0 "[ . 1 . ]" 1
771 1 78 ILE H 1 78 ILE MG 2.000 . 5.500 3.791 3.766 3.817 . 0 0 "[ . 1 . ]" 1
772 1 78 ILE HA 1 78 ILE MD 2.000 . 4.500 3.611 2.070 3.857 . 0 0 "[ . 1 . ]" 1
773 1 78 ILE HA 1 78 ILE QG 2.000 . 4.500 2.536 2.394 3.110 . 0 0 "[ . 1 . ]" 1
774 1 78 ILE HA 1 78 ILE MG 2.000 . 5.000 2.312 2.263 2.388 . 0 0 "[ . 1 . ]" 1
775 1 78 ILE HA 1 79 THR H 2.000 . 2.500 2.194 2.179 2.236 . 0 0 "[ . 1 . ]" 1
776 1 78 ILE HB 1 88 PHE QD 2.000 . 7.500 6.945 6.706 6.993 . 0 0 "[ . 1 . ]" 1
777 1 78 ILE MD 1 88 PHE QD 2.000 . 8.000 5.482 5.152 6.035 . 0 0 "[ . 1 . ]" 1
778 1 78 ILE MG 1 88 PHE QD 2.000 . 8.000 4.652 4.150 4.981 . 0 0 "[ . 1 . ]" 1
779 1 79 THR H 1 79 THR HB 2.000 . 3.500 2.770 2.611 3.523 0.023 15 0 "[ . 1 . ]" 1
780 1 79 THR H 1 79 THR MG 2.000 . 5.500 3.728 2.947 3.822 . 0 0 "[ . 1 . ]" 1
781 1 79 THR H 1 80 VAL H 2.000 . 5.000 4.566 4.499 4.620 . 0 0 "[ . 1 . ]" 1
782 1 79 THR HA 1 79 THR MG 2.000 . 5.000 2.271 2.117 2.343 . 0 0 "[ . 1 . ]" 1
783 1 79 THR HA 1 80 VAL H 2.000 . 2.500 2.217 2.182 2.280 . 0 0 "[ . 1 . ]" 1
784 1 79 THR HA 1 80 VAL QG 2.000 . 8.000 3.374 3.196 3.600 . 0 0 "[ . 1 . ]" 1
785 1 79 THR HB 1 80 VAL H 2.000 . 4.000 3.938 3.414 4.031 0.031 12 0 "[ . 1 . ]" 1
786 1 79 THR MG 1 80 VAL H 2.000 . 4.500 2.644 2.192 3.661 . 0 0 "[ . 1 . ]" 1
787 1 80 VAL H 1 80 VAL HB 2.000 . 3.000 2.726 2.538 2.925 . 0 0 "[ . 1 . ]" 1
788 1 80 VAL H 1 80 VAL QG 2.000 . 5.000 2.430 2.121 2.599 . 0 0 "[ . 1 . ]" 1
789 1 80 VAL H 1 81 THR H 2.000 . 5.000 4.204 3.444 4.601 . 0 0 "[ . 1 . ]" 1
790 1 80 VAL HA 1 80 VAL QG 2.000 . 5.000 2.089 2.039 2.128 . 0 0 "[ . 1 . ]" 1
791 1 80 VAL HA 1 81 THR H 2.000 . 2.500 2.281 2.176 2.532 0.032 1 0 "[ . 1 . ]" 1
792 1 80 VAL HA 1 88 PHE QD 2.000 . 8.000 4.658 3.672 5.456 . 0 0 "[ . 1 . ]" 1
793 1 80 VAL HA 1 88 PHE QE 2.000 . 7.500 3.003 2.394 4.891 . 0 0 "[ . 1 . ]" 1
794 1 80 VAL QG 1 81 THR H 2.000 . 5.500 2.803 1.803 3.613 . 0 0 "[ . 1 . ]" 1
795 1 80 VAL QG 1 88 PHE QD 2.000 . 8.000 2.726 2.332 3.107 . 0 0 "[ . 1 . ]" 1
796 1 80 VAL QG 1 88 PHE QE 2.000 . 8.000 2.231 2.022 2.848 . 0 0 "[ . 1 . ]" 1
797 1 80 VAL QG 1 88 PHE HZ 2.000 . 8.000 3.398 2.910 4.522 . 0 0 "[ . 1 . ]" 1
798 1 81 THR H 1 81 THR MG 2.000 . 5.500 2.851 1.878 4.079 . 0 0 "[ . 1 . ]" 1
799 1 81 THR H 1 84 ASN H 2.000 . 4.200 3.325 2.854 3.726 . 0 0 "[ . 1 . ]" 1
800 1 81 THR H 1 85 LEU H 2.000 . 5.000 3.802 2.988 4.489 . 0 0 "[ . 1 . ]" 1
801 1 81 THR HA 1 81 THR MG 2.000 . 5.000 2.398 2.229 3.139 . 0 0 "[ . 1 . ]" 1
802 1 81 THR HA 1 82 GLU H 2.000 . 4.500 2.820 2.315 3.513 . 0 0 "[ . 1 . ]" 1
803 1 81 THR HB 1 82 GLU H 2.000 . 4.500 2.475 1.804 3.603 . 0 0 "[ . 1 . ]" 1
804 1 81 THR MG 1 82 GLU H 2.000 . 6.500 3.079 1.757 3.838 0.043 15 0 "[ . 1 . ]" 1
805 1 82 GLU H 1 82 GLU QB 2.000 . 4.500 2.694 2.339 3.256 . 0 0 "[ . 1 . ]" 1
806 1 82 GLU H 1 83 LYS H 2.000 . 5.000 2.498 1.760 2.984 0.040 10 0 "[ . 1 . ]" 1
807 1 82 GLU HA 1 83 LYS H 2.000 . 4.200 3.431 2.931 3.568 . 0 0 "[ . 1 . ]" 1
808 1 82 GLU HA 1 86 GLN H 2.000 . 5.500 5.415 5.083 5.561 0.061 4 0 "[ . 1 . ]" 1
809 1 83 LYS H 1 83 LYS QB 2.000 . 4.000 2.451 2.151 2.945 . 0 0 "[ . 1 . ]" 1
810 1 83 LYS H 1 84 ASN H 2.000 . 3.500 2.456 1.755 2.860 0.045 4 0 "[ . 1 . ]" 1
811 1 83 LYS H 1 85 LEU H 2.000 . 5.000 3.800 3.001 4.196 . 0 0 "[ . 1 . ]" 1
812 1 83 LYS HA 1 84 ASN H 2.000 . 4.200 3.553 3.474 3.585 . 0 0 "[ . 1 . ]" 1
813 1 83 LYS HA 1 85 LEU H 2.000 . 4.200 4.205 4.122 4.281 0.081 4 0 "[ . 1 . ]" 1
814 1 83 LYS QB 1 84 ASN H 2.000 . 4.500 2.495 1.965 3.578 . 0 0 "[ . 1 . ]" 1
815 1 84 ASN H 1 84 ASN QB 2.000 . 4.500 2.411 2.076 2.764 . 0 0 "[ . 1 . ]" 1
816 1 84 ASN H 1 85 LEU H 2.000 . 3.200 2.797 2.562 2.944 . 0 0 "[ . 1 . ]" 1
817 1 84 ASN H 1 86 GLN H 2.000 . 5.000 4.603 4.185 5.011 0.011 8 0 "[ . 1 . ]" 1
818 1 84 ASN HA 1 85 LEU H 2.000 . 4.200 3.548 3.533 3.559 . 0 0 "[ . 1 . ]" 1
819 1 84 ASN HA 1 86 GLN H 2.000 . 5.000 4.254 3.967 4.982 . 0 0 "[ . 1 . ]" 1
820 1 84 ASN HA 1 87 ASP H 2.000 . 4.200 3.119 2.961 3.355 . 0 0 "[ . 1 . ]" 1
821 1 84 ASN QB 1 85 LEU H 2.000 . 5.500 2.615 2.583 2.698 . 0 0 "[ . 1 . ]" 1
822 1 84 ASN O 1 88 PHE H 2.000 . 2.100 2.106 1.929 2.155 0.055 13 0 "[ . 1 . ]" 1
823 1 84 ASN O 1 88 PHE N 3.000 2.800 3.100 3.009 2.892 3.080 . 0 0 "[ . 1 . ]" 1
824 1 85 LEU H 1 85 LEU QB 2.000 . 4.000 2.367 2.097 2.791 . 0 0 "[ . 1 . ]" 1
825 1 85 LEU H 1 85 LEU QD 2.000 . 6.500 2.968 1.543 3.791 0.257 10 0 "[ . 1 . ]" 1
826 1 85 LEU H 1 85 LEU HG 2.000 . 4.500 3.598 1.783 4.617 0.117 9 0 "[ . 1 . ]" 1
827 1 85 LEU H 1 86 GLN H 2.000 . 3.500 3.026 2.776 3.319 . 0 0 "[ . 1 . ]" 1
828 1 85 LEU HA 1 86 GLN H 2.000 . 5.000 3.569 3.542 3.598 . 0 0 "[ . 1 . ]" 1
829 1 85 LEU HA 1 87 ASP H 2.000 . 5.000 4.437 4.224 4.864 . 0 0 "[ . 1 . ]" 1
830 1 85 LEU HA 1 88 PHE H 2.000 . 5.000 3.470 3.194 3.793 . 0 0 "[ . 1 . ]" 1
831 1 85 LEU HA 1 88 PHE QD 2.000 . 5.500 2.433 2.295 2.674 . 0 0 "[ . 1 . ]" 1
832 1 85 LEU QB 1 86 GLN H 2.000 . 6.000 2.624 2.055 3.437 . 0 0 "[ . 1 . ]" 1
833 1 85 LEU QB 1 88 PHE QD 2.000 . 7.000 4.346 4.033 4.578 . 0 0 "[ . 1 . ]" 1
834 1 85 LEU HG 1 86 GLN H 2.000 . 5.500 3.725 1.838 4.824 . 0 0 "[ . 1 . ]" 1
835 1 85 LEU O 1 89 ILE H 2.000 . 2.100 1.982 1.803 2.110 0.010 11 0 "[ . 1 . ]" 1
836 1 85 LEU O 1 89 ILE N 3.000 2.800 3.100 2.829 2.765 3.002 0.035 5 0 "[ . 1 . ]" 1
837 1 86 GLN H 1 86 GLN QB 2.000 . 4.500 2.398 2.252 2.659 . 0 0 "[ . 1 . ]" 1
838 1 86 GLN H 1 86 GLN QG 2.000 . 5.000 2.831 1.908 4.075 . 0 0 "[ . 1 . ]" 1
839 1 86 GLN H 1 87 ASP H 2.000 . 3.500 2.742 2.576 2.956 . 0 0 "[ . 1 . ]" 1
840 1 86 GLN HA 1 87 ASP H 2.000 . 4.200 3.556 3.542 3.584 . 0 0 "[ . 1 . ]" 1
841 1 86 GLN HA 1 88 PHE H 2.000 . 5.000 4.304 4.185 4.440 . 0 0 "[ . 1 . ]" 1
842 1 86 GLN HA 1 89 ILE H 2.000 . 4.200 3.867 3.413 4.207 0.007 2 0 "[ . 1 . ]" 1
843 1 86 GLN QB 1 87 ASP H 2.000 . 5.500 2.582 2.299 3.405 . 0 0 "[ . 1 . ]" 1
844 1 87 ASP H 1 87 ASP QB 2.000 . 4.500 2.394 2.209 2.672 . 0 0 "[ . 1 . ]" 1
845 1 87 ASP QB 1 88 PHE H 2.000 . 5.200 2.643 2.536 3.404 . 0 0 "[ . 1 . ]" 1
846 1 87 ASP QB 1 88 PHE QD 2.000 . 7.500 3.928 3.790 4.737 . 0 0 "[ . 1 . ]" 1
847 1 88 PHE H 1 88 PHE QB 2.000 . 4.500 2.405 2.250 2.493 . 0 0 "[ . 1 . ]" 1
848 1 88 PHE H 1 89 ILE H 2.000 . 3.500 2.744 2.497 2.981 . 0 0 "[ . 1 . ]" 1
849 1 88 PHE H 1 89 ILE HB 2.000 . 5.500 4.654 4.412 5.550 0.050 8 0 "[ . 1 . ]" 1
850 1 88 PHE H 1 89 ILE MD 2.000 . 7.500 5.692 4.961 5.977 . 0 0 "[ . 1 . ]" 1
851 1 88 PHE H 1 89 ILE QG 2.000 . 6.500 5.435 3.447 5.787 . 0 0 "[ . 1 . ]" 1
852 1 88 PHE H 1 89 ILE MG 2.000 . 6.500 5.395 4.957 5.522 . 0 0 "[ . 1 . ]" 1
853 1 88 PHE H 1 90 GLY H 2.000 . 5.000 4.111 3.782 4.695 . 0 0 "[ . 1 . ]" 1
854 1 88 PHE HA 1 88 PHE QD 2.000 . 4.500 2.298 2.244 2.369 . 0 0 "[ . 1 . ]" 1
855 1 88 PHE HA 1 88 PHE QE 2.000 . 5.500 4.362 4.257 4.430 . 0 0 "[ . 1 . ]" 1
856 1 88 PHE HA 1 89 ILE H 2.000 . 5.000 3.568 3.534 3.587 . 0 0 "[ . 1 . ]" 1
857 1 88 PHE QB 1 88 PHE QD 2.000 . 5.500 2.169 2.162 2.175 . 0 0 "[ . 1 . ]" 1
858 1 88 PHE QB 1 89 ILE H 2.000 . 5.000 2.113 1.838 2.578 . 0 0 "[ . 1 . ]" 1
859 1 88 PHE QB 1 90 GLY H 2.000 . 6.500 4.562 4.305 5.077 . 0 0 "[ . 1 . ]" 1
860 1 89 ILE H 1 89 ILE MD 2.000 . 5.500 3.651 3.436 4.063 . 0 0 "[ . 1 . ]" 1
861 1 89 ILE H 1 89 ILE QG 2.000 . 5.500 3.021 1.715 3.597 0.085 8 0 "[ . 1 . ]" 1
862 1 89 ILE H 1 89 ILE MG 2.000 . 6.000 3.492 3.118 3.598 . 0 0 "[ . 1 . ]" 1
863 1 89 ILE H 1 90 GLY H 2.000 . 3.500 2.785 2.599 3.012 . 0 0 "[ . 1 . ]" 1
864 1 89 ILE HA 1 89 ILE HB 2.000 . 2.800 2.930 2.837 2.958 0.158 15 0 "[ . 1 . ]" 1
865 1 89 ILE HA 1 89 ILE MD 2.000 . 6.000 3.721 3.684 3.924 . 0 0 "[ . 1 . ]" 1
866 1 89 ILE HA 1 89 ILE QG 2.000 . 6.500 2.232 2.140 2.993 . 0 0 "[ . 1 . ]" 1
867 1 89 ILE HA 1 89 ILE MG 2.000 . 4.000 2.725 2.104 3.006 . 0 0 "[ . 1 . ]" 1
868 1 89 ILE HA 1 90 GLY H 2.000 . 4.200 3.585 3.562 3.593 . 0 0 "[ . 1 . ]" 1
869 1 89 ILE HB 1 90 GLY H 2.000 . 5.500 2.676 1.962 3.139 . 0 0 "[ . 1 . ]" 1
870 1 89 ILE MD 1 90 GLY H 2.000 . 7.500 4.401 3.703 4.625 . 0 0 "[ . 1 . ]" 1
871 1 89 ILE QG 1 90 GLY H 2.000 . 6.500 4.179 2.582 4.386 . 0 0 "[ . 1 . ]" 1
872 1 89 ILE MG 1 90 GLY H 2.000 . 7.000 2.314 1.893 3.643 . 0 0 "[ . 1 . ]" 1
873 1 90 GLY H 1 91 LYS H 2.000 . 4.200 3.399 2.669 4.245 0.045 13 0 "[ . 1 . ]" 1
874 1 90 GLY QA 1 91 LYS H 2.000 . 3.800 2.501 2.164 2.802 . 0 0 "[ . 1 . ]" 1
875 1 91 LYS H 1 91 LYS QB 2.000 . 4.500 2.797 2.209 3.165 . 0 0 "[ . 1 . ]" 1
876 1 91 LYS H 1 91 LYS QG 2.000 . 5.000 3.555 1.879 4.341 . 0 0 "[ . 1 . ]" 1
877 1 91 LYS HA 1 92 ARG H 2.000 . 3.000 2.427 2.207 2.834 . 0 0 "[ . 1 . ]" 1
878 1 92 ARG H 1 92 ARG QB 2.000 . 4.500 2.842 2.375 3.305 . 0 0 "[ . 1 . ]" 1
879 1 92 ARG HA 1 93 ILE H 2.000 . 3.000 2.608 2.197 3.028 0.028 8 0 "[ . 1 . ]" 1
880 1 92 ARG QG 1 93 ILE H 2.000 . 6.000 3.410 2.368 4.397 . 0 0 "[ . 1 . ]" 1
881 1 93 ILE H 1 93 ILE HA 2.000 . 3.000 2.986 2.974 2.998 . 0 0 "[ . 1 . ]" 1
882 1 93 ILE H 1 93 ILE HB 2.000 . 3.000 2.681 2.446 2.897 . 0 0 "[ . 1 . ]" 1
883 1 93 ILE H 1 93 ILE MD 2.000 . 5.000 3.899 3.328 4.205 . 0 0 "[ . 1 . ]" 1
884 1 93 ILE H 1 93 ILE QG 2.000 . 5.500 2.657 2.068 3.112 . 0 0 "[ . 1 . ]" 1
885 1 93 ILE H 1 93 ILE MG 2.000 . 5.000 3.870 3.780 3.972 . 0 0 "[ . 1 . ]" 1
886 1 93 ILE H 1 94 PHE H 2.000 . 2.800 2.281 1.916 2.801 0.001 15 0 "[ . 1 . ]" 1
887 1 93 ILE H 1 94 PHE QD 2.000 . 6.500 3.784 2.991 4.995 . 0 0 "[ . 1 . ]" 1
888 1 93 ILE HA 1 93 ILE MD 2.000 . 4.500 3.706 2.177 3.836 . 0 0 "[ . 1 . ]" 1
889 1 93 ILE HA 1 93 ILE QG 2.000 . 5.000 2.469 2.372 3.045 . 0 0 "[ . 1 . ]" 1
890 1 93 ILE HA 1 93 ILE MG 2.000 . 5.000 2.332 2.217 2.395 . 0 0 "[ . 1 . ]" 1
891 1 93 ILE HA 1 94 PHE H 2.000 . 4.200 3.572 3.513 3.595 . 0 0 "[ . 1 . ]" 1
892 1 93 ILE HB 1 94 PHE H 2.000 . 3.500 2.297 1.791 2.865 0.009 15 0 "[ . 1 . ]" 1
893 1 93 ILE MD 1 94 PHE H 2.000 . 6.000 4.270 3.954 4.633 . 0 0 "[ . 1 . ]" 1
894 1 93 ILE MD 1 94 PHE QD 2.000 . 7.000 4.070 3.720 5.001 . 0 0 "[ . 1 . ]" 1
895 1 93 ILE MD 1 94 PHE HZ 2.000 . 6.500 4.792 3.531 5.363 . 0 0 "[ . 1 . ]" 1
896 1 93 ILE QG 1 94 PHE H 2.000 . 6.500 3.847 3.426 4.079 . 0 0 "[ . 1 . ]" 1
897 1 93 ILE MG 1 94 PHE H 2.000 . 6.000 3.261 2.974 3.711 . 0 0 "[ . 1 . ]" 1
898 1 93 ILE MG 1 94 PHE HA 2.000 . 8.000 3.535 3.243 3.966 . 0 0 "[ . 1 . ]" 1
899 1 93 ILE MG 1 94 PHE QD 2.000 . 7.000 3.088 2.303 3.689 . 0 0 "[ . 1 . ]" 1
900 1 93 ILE MG 1 94 PHE QE 2.000 . 6.500 3.088 2.115 3.696 . 0 0 "[ . 1 . ]" 1
901 1 93 ILE MG 1 94 PHE HZ 2.000 . 6.000 4.263 3.404 4.849 . 0 0 "[ . 1 . ]" 1
902 1 94 PHE H 1 94 PHE QB 2.000 . 5.000 2.499 2.364 2.742 . 0 0 "[ . 1 . ]" 1
903 1 94 PHE H 1 94 PHE QD 2.000 . 5.500 2.137 1.757 2.891 0.043 13 0 "[ . 1 . ]" 1
904 1 94 PHE H 1 95 ARG H 2.000 . 5.000 4.293 3.705 4.669 . 0 0 "[ . 1 . ]" 1
905 1 94 PHE HA 1 94 PHE QD 2.000 . 5.000 2.832 2.187 3.142 . 0 0 "[ . 1 . ]" 1
906 1 94 PHE HA 1 95 ARG H 2.000 . 2.800 2.303 2.185 2.558 . 0 0 "[ . 1 . ]" 1
907 1 94 PHE QB 1 94 PHE QD 2.000 . 5.500 2.181 2.151 2.282 . 0 0 "[ . 1 . ]" 1
908 1 94 PHE QB 1 95 ARG H 2.000 . 5.200 3.466 2.630 3.917 . 0 0 "[ . 1 . ]" 1
909 1 94 PHE QD 1 95 ARG H 2.000 . 6.000 4.498 3.957 4.904 . 0 0 "[ . 1 . ]" 1
910 1 94 PHE QD 1 96 TYR H 2.000 . 6.500 5.739 5.366 6.065 . 0 0 "[ . 1 . ]" 1
911 1 95 ARG H 1 95 ARG QB 2.000 . 4.500 2.564 2.185 3.028 . 0 0 "[ . 1 . ]" 1
912 1 95 ARG H 1 95 ARG QD 2.000 . 6.500 3.932 1.811 4.842 . 0 0 "[ . 1 . ]" 1
913 1 95 ARG H 1 95 ARG QG 2.000 . 4.500 2.824 1.714 4.073 0.086 3 0 "[ . 1 . ]" 1
914 1 95 ARG H 1 96 TYR H 2.000 . 5.000 3.848 3.485 4.177 . 0 0 "[ . 1 . ]" 1
915 1 95 ARG HA 1 96 TYR H 2.000 . 2.500 2.407 2.279 2.542 0.042 7 0 "[ . 1 . ]" 1
916 1 95 ARG QB 1 96 TYR H 2.000 . 6.000 3.919 3.731 4.046 . 0 0 "[ . 1 . ]" 1
917 1 96 TYR H 1 96 TYR QB 2.000 . 5.000 2.865 2.118 3.467 . 0 0 "[ . 1 . ]" 1
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