NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
429882 |
2jmx   |
15072 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2jmx
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 91
_Distance_constraint_stats_list.Viol_count 372
_Distance_constraint_stats_list.Viol_total 410.822
_Distance_constraint_stats_list.Viol_max 0.155
_Distance_constraint_stats_list.Viol_rms 0.0169
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0050
_Distance_constraint_stats_list.Viol_average_violations_only 0.0368
_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
2 3 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 4 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 5 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 6 ALA 1.053 0.155 3 0 "[ . 1 . 2 . 3]"
2 7 GLU 3.398 0.124 2 0 "[ . 1 . 2 . 3]"
2 8 VAL 6.866 0.155 3 0 "[ . 1 . 2 . 3]"
2 9 SER 1.821 0.105 19 0 "[ . 1 . 2 . 3]"
2 10 SER 5.864 0.141 15 0 "[ . 1 . 2 . 3]"
2 11 ILE 2.772 0.080 23 0 "[ . 1 . 2 . 3]"
2 12 LEU 0.905 0.070 23 0 "[ . 1 . 2 . 3]"
2 13 GLU 2.239 0.078 24 0 "[ . 1 . 2 . 3]"
2 14 GLU 1.230 0.047 24 0 "[ . 1 . 2 . 3]"
2 15 ARG 0.499 0.040 3 0 "[ . 1 . 2 . 3]"
2 16 ILE 0.635 0.073 5 0 "[ . 1 . 2 . 3]"
2 17 LEU 0.089 0.023 3 0 "[ . 1 . 2 . 3]"
2 18 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 19 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 20 ASP 0.014 0.006 21 0 "[ . 1 . 2 . 3]"
2 21 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 22 SER 0.002 0.002 20 0 "[ . 1 . 2 . 3]"
2 23 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 24 ASP 0.002 0.002 20 0 "[ . 1 . 2 . 3]"
2 25 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
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 2 3 THR HA 2 4 GLY H 5.000 . 5.000 2.527 2.257 3.629 . 0 0 "[ . 1 . 2 . 3]" 1
2 2 3 THR HB 2 4 GLY H 6.000 . 6.000 3.685 2.172 4.500 . 0 0 "[ . 1 . 2 . 3]" 1
3 2 4 GLY QA 2 5 THR H 5.000 . 5.000 2.311 2.196 2.751 . 0 0 "[ . 1 . 2 . 3]" 1
4 2 5 THR HA 2 6 ALA H 5.000 . 5.000 2.553 2.251 3.631 . 0 0 "[ . 1 . 2 . 3]" 1
5 2 5 THR HB 2 6 ALA H 5.000 . 5.000 3.572 2.166 4.722 . 0 0 "[ . 1 . 2 . 3]" 1
6 2 5 THR MG 2 6 ALA H 5.000 . 5.000 3.473 2.119 4.420 . 0 0 "[ . 1 . 2 . 3]" 1
7 2 6 ALA HA 2 7 GLU H 5.000 . 5.000 2.879 2.307 3.639 . 0 0 "[ . 1 . 2 . 3]" 1
8 2 6 ALA MB 2 7 GLU QG 6.000 . 6.000 4.803 3.872 5.600 . 0 0 "[ . 1 . 2 . 3]" 1
9 2 6 ALA HA 2 8 VAL QG 5.000 . 5.000 4.709 4.136 5.155 0.155 3 0 "[ . 1 . 2 . 3]" 1
10 2 6 ALA MB 2 8 VAL H 6.000 . 6.000 3.905 2.466 4.689 . 0 0 "[ . 1 . 2 . 3]" 1
11 2 6 ALA MB 2 8 VAL QG 5.000 . 5.000 3.100 2.192 3.898 . 0 0 "[ . 1 . 2 . 3]" 1
12 2 6 ALA MB 2 11 ILE MD 5.000 . 5.000 4.213 2.414 5.056 0.056 15 0 "[ . 1 . 2 . 3]" 1
13 2 6 ALA MB 2 11 ILE MG 5.000 . 5.000 4.893 4.559 5.057 0.057 5 0 "[ . 1 . 2 . 3]" 1
14 2 7 GLU H 2 7 GLU QG 5.000 . 5.000 3.212 2.370 4.223 . 0 0 "[ . 1 . 2 . 3]" 1
15 2 7 GLU H 2 8 VAL H 2.800 . 2.800 2.872 2.835 2.924 0.124 2 0 "[ . 1 . 2 . 3]" 1
16 2 7 GLU HA 2 8 VAL H 5.000 . 5.000 2.785 2.632 3.041 . 0 0 "[ . 1 . 2 . 3]" 1
17 2 7 GLU HA 2 10 SER H 3.500 . 3.500 3.537 3.347 3.584 0.084 29 0 "[ . 1 . 2 . 3]" 1
18 2 7 GLU HA 2 10 SER QB 5.000 . 5.000 3.742 3.436 3.828 . 0 0 "[ . 1 . 2 . 3]" 1
19 2 8 VAL HA 2 9 SER H 6.000 . 6.000 3.590 3.565 3.601 . 0 0 "[ . 1 . 2 . 3]" 1
20 2 8 VAL H 2 9 SER H 2.800 . 2.800 2.826 2.682 2.905 0.105 19 0 "[ . 1 . 2 . 3]" 1
21 2 8 VAL QG 2 9 SER H 6.000 . 6.000 2.967 2.025 3.284 . 0 0 "[ . 1 . 2 . 3]" 1
22 2 8 VAL QG 2 10 SER QB 5.000 . 5.000 5.090 5.006 5.141 0.141 15 0 "[ . 1 . 2 . 3]" 1
23 2 8 VAL HA 2 11 ILE H 3.500 . 3.500 3.446 3.188 3.580 0.080 23 0 "[ . 1 . 2 . 3]" 1
24 2 8 VAL HA 2 11 ILE HB 5.000 . 5.000 3.674 2.472 4.900 . 0 0 "[ . 1 . 2 . 3]" 1
25 2 9 SER HA 2 10 SER H 5.000 . 5.000 3.588 3.583 3.598 . 0 0 "[ . 1 . 2 . 3]" 1
26 2 9 SER H 2 10 SER H 2.800 . 2.800 2.737 2.536 2.813 0.013 10 0 "[ . 1 . 2 . 3]" 1
27 2 9 SER HA 2 12 LEU H 3.500 . 3.500 3.527 3.493 3.570 0.070 23 0 "[ . 1 . 2 . 3]" 1
28 2 9 SER HA 2 12 LEU QB 5.000 . 5.000 2.606 2.325 2.878 . 0 0 "[ . 1 . 2 . 3]" 1
29 2 10 SER H 2 11 ILE H 2.800 . 2.800 2.746 2.592 2.843 0.043 4 0 "[ . 1 . 2 . 3]" 1
30 2 10 SER HA 2 11 ILE H 5.000 . 5.000 3.611 3.594 3.624 . 0 0 "[ . 1 . 2 . 3]" 1
31 2 10 SER HA 2 13 GLU H 3.500 . 3.500 3.548 3.517 3.578 0.078 24 0 "[ . 1 . 2 . 3]" 1
32 2 10 SER HA 2 13 GLU QB 5.000 . 5.000 3.051 2.694 3.845 . 0 0 "[ . 1 . 2 . 3]" 1
33 2 11 ILE HA 2 12 LEU H 5.000 . 5.000 3.584 3.564 3.598 . 0 0 "[ . 1 . 2 . 3]" 1
34 2 11 ILE H 2 12 LEU H 2.800 . 2.800 2.731 2.619 2.799 . 0 0 "[ . 1 . 2 . 3]" 1
35 2 11 ILE HB 2 12 LEU H 5.000 . 5.000 3.534 2.572 4.115 . 0 0 "[ . 1 . 2 . 3]" 1
36 2 11 ILE HA 2 14 GLU H 3.500 . 3.500 3.517 3.449 3.543 0.043 21 0 "[ . 1 . 2 . 3]" 1
37 2 11 ILE HA 2 14 GLU QB 5.000 . 5.000 3.129 2.808 3.410 . 0 0 "[ . 1 . 2 . 3]" 1
38 2 12 LEU H 2 12 LEU QD 5.000 . 5.000 3.486 2.431 3.737 . 0 0 "[ . 1 . 2 . 3]" 1
39 2 12 LEU H 2 13 GLU H 2.800 . 2.800 2.725 2.592 2.803 0.003 9 0 "[ . 1 . 2 . 3]" 1
40 2 12 LEU HA 2 13 GLU H 5.000 . 5.000 3.596 3.593 3.603 . 0 0 "[ . 1 . 2 . 3]" 1
41 2 12 LEU QD 2 15 ARG QD 6.000 . 6.000 3.494 2.545 5.465 . 0 0 "[ . 1 . 2 . 3]" 1
42 2 12 LEU HA 2 15 ARG H 3.500 . 3.500 3.419 3.243 3.530 0.030 12 0 "[ . 1 . 2 . 3]" 1
43 2 12 LEU HA 2 15 ARG QB 5.000 . 5.000 2.946 2.532 3.621 . 0 0 "[ . 1 . 2 . 3]" 1
44 2 13 GLU H 2 13 GLU QG 5.000 . 5.000 3.681 2.115 4.062 . 0 0 "[ . 1 . 2 . 3]" 1
45 2 13 GLU HA 2 14 GLU H 5.000 . 5.000 3.593 3.563 3.599 . 0 0 "[ . 1 . 2 . 3]" 1
46 2 13 GLU H 2 14 GLU H 2.800 . 2.800 2.806 2.687 2.847 0.047 24 0 "[ . 1 . 2 . 3]" 1
47 2 13 GLU HA 2 16 ILE H 3.500 . 3.500 3.490 3.406 3.573 0.073 5 0 "[ . 1 . 2 . 3]" 1
48 2 13 GLU HA 2 16 ILE HB 5.000 . 5.000 4.091 3.017 5.013 0.013 19 0 "[ . 1 . 2 . 3]" 1
49 2 14 GLU HA 2 15 ARG H 5.000 . 5.000 3.592 3.586 3.596 . 0 0 "[ . 1 . 2 . 3]" 1
50 2 14 GLU H 2 15 ARG H 2.800 . 2.800 2.762 2.581 2.837 0.037 11 0 "[ . 1 . 2 . 3]" 1
51 2 14 GLU HA 2 17 LEU H 3.500 . 3.500 3.419 3.256 3.523 0.023 3 0 "[ . 1 . 2 . 3]" 1
52 2 14 GLU HA 2 17 LEU QB 5.000 . 5.000 3.917 3.388 4.965 . 0 0 "[ . 1 . 2 . 3]" 1
53 2 15 ARG H 2 15 ARG QG 5.000 . 5.000 3.533 2.366 4.055 . 0 0 "[ . 1 . 2 . 3]" 1
54 2 15 ARG H 2 16 ILE H 2.800 . 2.800 2.783 2.677 2.840 0.040 3 0 "[ . 1 . 2 . 3]" 1
55 2 15 ARG HA 2 16 ILE H 5.000 . 5.000 3.591 3.580 3.615 . 0 0 "[ . 1 . 2 . 3]" 1
56 2 15 ARG QB 2 16 ILE H 5.000 . 5.000 2.679 2.332 2.750 . 0 0 "[ . 1 . 2 . 3]" 1
57 2 15 ARG QG 2 16 ILE H 5.000 . 5.000 4.043 3.721 4.592 . 0 0 "[ . 1 . 2 . 3]" 1
58 2 16 ILE H 2 16 ILE QG 5.000 . 5.000 2.337 2.082 4.061 . 0 0 "[ . 1 . 2 . 3]" 1
59 2 16 ILE H 2 16 ILE MD 5.000 . 5.000 3.576 2.932 4.330 . 0 0 "[ . 1 . 2 . 3]" 1
60 2 16 ILE H 2 17 LEU H 2.800 . 2.800 2.466 2.344 2.818 0.018 3 0 "[ . 1 . 2 . 3]" 1
61 2 16 ILE HA 2 17 LEU H 5.000 . 5.000 3.589 3.569 3.617 . 0 0 "[ . 1 . 2 . 3]" 1
62 2 16 ILE HB 2 17 LEU H 5.000 . 5.000 3.319 2.438 4.112 . 0 0 "[ . 1 . 2 . 3]" 1
63 2 17 LEU HA 2 18 GLY H 5.000 . 5.000 2.578 2.251 3.630 . 0 0 "[ . 1 . 2 . 3]" 1
64 2 17 LEU QB 2 18 GLY H 5.000 . 5.000 3.489 2.148 4.087 . 0 0 "[ . 1 . 2 . 3]" 1
65 2 17 LEU QD 2 20 ASP QB 6.000 . 6.000 5.364 3.905 6.006 0.006 21 0 "[ . 1 . 2 . 3]" 1
66 2 18 GLY H 2 19 ALA H 5.000 . 5.000 3.380 2.348 4.666 . 0 0 "[ . 1 . 2 . 3]" 1
67 2 18 GLY QA 2 19 ALA H 5.000 . 5.000 2.429 2.200 2.771 . 0 0 "[ . 1 . 2 . 3]" 1
68 2 18 GLY QA 2 19 ALA MB 6.000 . 6.000 3.666 3.463 4.049 . 0 0 "[ . 1 . 2 . 3]" 1
69 2 19 ALA H 2 20 ASP H 5.000 . 5.000 3.854 2.344 4.565 . 0 0 "[ . 1 . 2 . 3]" 1
70 2 19 ALA HA 2 20 ASP H 5.000 . 5.000 2.540 2.255 3.629 . 0 0 "[ . 1 . 2 . 3]" 1
71 2 19 ALA MB 2 20 ASP H 5.000 . 5.000 3.195 2.190 3.766 . 0 0 "[ . 1 . 2 . 3]" 1
72 2 19 ALA MB 2 21 THR H 6.000 . 6.000 4.796 2.877 5.998 . 0 0 "[ . 1 . 2 . 3]" 1
73 2 20 ASP H 2 21 THR H 5.000 . 5.000 3.546 2.340 4.517 . 0 0 "[ . 1 . 2 . 3]" 1
74 2 20 ASP HA 2 21 THR H 5.000 . 5.000 2.706 2.254 3.631 . 0 0 "[ . 1 . 2 . 3]" 1
75 2 20 ASP QB 2 21 THR H 5.000 . 5.000 3.454 2.138 4.101 . 0 0 "[ . 1 . 2 . 3]" 1
76 2 21 THR H 2 22 SER H 5.000 . 5.000 3.899 2.541 4.526 . 0 0 "[ . 1 . 2 . 3]" 1
77 2 21 THR HA 2 22 SER H 5.000 . 5.000 2.461 2.254 2.931 . 0 0 "[ . 1 . 2 . 3]" 1
78 2 21 THR MG 2 22 SER H 5.000 . 5.000 3.653 2.073 4.417 . 0 0 "[ . 1 . 2 . 3]" 1
79 2 22 SER H 2 23 VAL H 6.000 . 6.000 3.930 2.348 4.537 . 0 0 "[ . 1 . 2 . 3]" 1
80 2 22 SER HA 2 23 VAL H 5.000 . 5.000 2.535 2.252 3.628 . 0 0 "[ . 1 . 2 . 3]" 1
81 2 22 SER QB 2 23 VAL H 5.000 . 5.000 3.418 2.140 4.112 . 0 0 "[ . 1 . 2 . 3]" 1
82 2 22 SER HA 2 23 VAL QG 5.000 . 5.000 3.557 2.963 4.148 . 0 0 "[ . 1 . 2 . 3]" 1
83 2 22 SER HA 2 24 ASP H 6.000 . 6.000 4.945 3.804 6.002 0.002 20 0 "[ . 1 . 2 . 3]" 1
84 2 22 SER QB 2 24 ASP H 6.000 . 6.000 4.686 2.699 5.789 . 0 0 "[ . 1 . 2 . 3]" 1
85 2 23 VAL H 2 24 ASP H 5.000 . 5.000 3.313 2.345 4.349 . 0 0 "[ . 1 . 2 . 3]" 1
86 2 23 VAL HA 2 24 ASP H 5.000 . 5.000 2.666 2.245 3.629 . 0 0 "[ . 1 . 2 . 3]" 1
87 2 23 VAL HB 2 24 ASP H 5.000 . 5.000 4.273 2.175 4.715 . 0 0 "[ . 1 . 2 . 3]" 1
88 2 23 VAL QG 2 24 ASP H 5.000 . 5.000 3.355 2.925 3.691 . 0 0 "[ . 1 . 2 . 3]" 1
89 2 24 ASP HA 2 25 LEU H 5.000 . 5.000 2.864 2.259 3.632 . 0 0 "[ . 1 . 2 . 3]" 1
90 2 24 ASP HA 2 25 LEU QD 6.000 . 6.000 4.832 3.340 5.582 . 0 0 "[ . 1 . 2 . 3]" 1
91 2 25 LEU H 2 25 LEU QD 5.000 . 5.000 3.589 2.110 3.946 . 0 0 "[ . 1 . 2 . 3]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 63
_Distance_constraint_stats_list.Viol_count 231
_Distance_constraint_stats_list.Viol_total 448.255
_Distance_constraint_stats_list.Viol_max 0.285
_Distance_constraint_stats_list.Viol_rms 0.0323
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0079
_Distance_constraint_stats_list.Viol_average_violations_only 0.0647
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 11 ILE 0.628 0.187 23 0 "[ . 1 . 2 . 3]"
1 14 ILE 0.664 0.054 19 0 "[ . 1 . 2 . 3]"
1 16 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 17 ARG 1.883 0.133 29 0 "[ . 1 . 2 . 3]"
1 19 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 20 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 21 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 22 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 23 TYR 1.883 0.133 29 0 "[ . 1 . 2 . 3]"
1 25 ALA 0.221 0.035 24 0 "[ . 1 . 2 . 3]"
1 26 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 29 GLN 0.014 0.014 27 0 "[ . 1 . 2 . 3]"
1 31 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 32 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 34 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 35 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 38 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 39 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 41 ARG 0.073 0.021 13 0 "[ . 1 . 2 . 3]"
1 42 VAL 2.277 0.159 25 0 "[ . 1 . 2 . 3]"
1 44 GLN 0.010 0.005 12 0 "[ . 1 . 2 . 3]"
1 45 ILE 0.063 0.021 13 0 "[ . 1 . 2 . 3]"
1 46 LEU 4.835 0.171 21 0 "[ . 1 . 2 . 3]"
1 48 GLU 2.330 0.159 25 0 "[ . 1 . 2 . 3]"
1 51 MET 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 52 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 54 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 55 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 56 LEU 2.568 0.171 21 0 "[ . 1 . 2 . 3]"
1 57 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 59 TYR 2.568 0.171 21 0 "[ . 1 . 2 . 3]"
1 60 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 62 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 65 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 69 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 72 MET 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 73 THR 6.201 0.285 18 0 "[ . 1 . 2 . 3]"
1 75 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 76 GLU 6.201 0.285 18 0 "[ . 1 . 2 . 3]"
1 78 PHE 6.201 0.285 18 0 "[ . 1 . 2 . 3]"
1 79 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 80 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 81 LEU 0.423 0.042 30 0 "[ . 1 . 2 . 3]"
1 82 THR 6.201 0.285 18 0 "[ . 1 . 2 . 3]"
1 84 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 85 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 86 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 88 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 95 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 97 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 98 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 99 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 101 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 102 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 104 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 105 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 106 SER 1.883 0.133 29 0 "[ . 1 . 2 . 3]"
1 107 THR 0.628 0.187 23 0 "[ . 1 . 2 . 3]"
2 7 GLU 0.664 0.054 19 0 "[ . 1 . 2 . 3]"
2 9 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 10 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 13 GLU 0.123 0.035 24 0 "[ . 1 . 2 . 3]"
2 14 GLU 0.123 0.035 24 0 "[ . 1 . 2 . 3]"
2 16 ILE 0.359 0.030 11 0 "[ . 1 . 2 . 3]"
2 17 LEU 0.189 0.042 30 0 "[ . 1 . 2 . 3]"
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 11 ILE MD 1 104 ALA MB 5.000 . 5.000 2.691 1.707 4.042 . 0 0 "[ . 1 . 2 . 3]" 2
2 1 11 ILE MD 1 107 THR HB 3.500 . 3.500 3.447 2.807 3.687 0.187 23 0 "[ . 1 . 2 . 3]" 2
3 1 22 LEU HG 1 35 VAL QG 5.000 . 5.000 3.496 3.299 3.828 . 0 0 "[ . 1 . 2 . 3]" 2
4 1 41 ARG H 1 102 ILE MD 5.000 . 5.000 4.534 4.290 4.776 . 0 0 "[ . 1 . 2 . 3]" 2
5 1 46 LEU QD 1 59 TYR QD 6.000 . 6.000 6.086 6.026 6.171 0.171 21 0 "[ . 1 . 2 . 3]" 2
6 1 17 ARG HA 1 23 TYR QD 6.000 . 6.000 6.063 6.033 6.133 0.133 29 0 "[ . 1 . 2 . 3]" 2
7 1 16 GLY QA 1 20 THR H 5.000 . 5.000 4.313 4.023 4.651 . 0 0 "[ . 1 . 2 . 3]" 2
8 1 73 THR HA 1 78 PHE H 5.000 . 5.000 3.564 3.392 3.819 . 0 0 "[ . 1 . 2 . 3]" 2
9 1 73 THR HA 1 78 PHE HA 3.500 . 3.500 3.674 2.518 3.785 0.285 18 0 "[ . 1 . 2 . 3]" 2
10 1 73 THR HA 1 78 PHE QB 3.500 . 3.500 2.082 1.954 2.299 . 0 0 "[ . 1 . 2 . 3]" 2
11 1 73 THR HA 1 78 PHE QD 3.500 . 3.500 1.988 1.882 2.113 . 0 0 "[ . 1 . 2 . 3]" 2
12 1 73 THR HA 1 78 PHE QE 5.000 . 5.000 3.115 2.850 3.349 . 0 0 "[ . 1 . 2 . 3]" 2
13 1 73 THR HA 1 78 PHE HZ 5.000 . 5.000 4.768 4.650 4.856 . 0 0 "[ . 1 . 2 . 3]" 2
14 1 73 THR HA 1 86 ILE MD 5.000 . 5.000 3.609 2.862 3.834 . 0 0 "[ . 1 . 2 . 3]" 2
15 1 73 THR HA 1 79 SER H 6.000 . 6.000 2.317 2.218 2.884 . 0 0 "[ . 1 . 2 . 3]" 2
16 1 34 GLN QB 1 81 LEU H 5.000 . 5.000 3.602 3.116 4.192 . 0 0 "[ . 1 . 2 . 3]" 2
17 1 35 VAL QG 1 85 LEU QD 5.000 . 5.000 2.642 2.099 2.902 . 0 0 "[ . 1 . 2 . 3]" 2
18 1 81 LEU QB 1 85 LEU QD 5.000 . 5.000 2.900 2.121 3.579 . 0 0 "[ . 1 . 2 . 3]" 2
19 1 84 ASN QB 1 85 LEU QD 5.000 . 5.000 3.690 3.266 3.982 . 0 0 "[ . 1 . 2 . 3]" 2
20 1 31 LYS H 1 32 LEU QD 5.000 . 5.000 3.302 2.846 3.882 . 0 0 "[ . 1 . 2 . 3]" 2
21 1 19 ALA MB 1 22 LEU QD 6.000 . 6.000 2.786 2.464 2.986 . 0 0 "[ . 1 . 2 . 3]" 2
22 1 22 LEU QD 1 35 VAL HB 6.000 . 6.000 4.114 3.962 4.293 . 0 0 "[ . 1 . 2 . 3]" 2
23 1 22 LEU HG 1 35 VAL QG 5.000 . 5.000 3.288 3.004 3.543 . 0 0 "[ . 1 . 2 . 3]" 2
24 1 22 LEU H 1 35 VAL QG 5.000 . 5.000 3.641 3.504 3.777 . 0 0 "[ . 1 . 2 . 3]" 2
25 1 72 MET QG 1 73 THR HA 5.000 . 5.000 3.853 3.589 4.162 . 0 0 "[ . 1 . 2 . 3]" 2
26 1 69 LEU QB 1 73 THR HA 5.000 . 5.000 3.719 2.843 4.337 . 0 0 "[ . 1 . 2 . 3]" 2
27 1 69 LEU QD 1 73 THR MG 5.000 . 5.000 3.746 3.150 4.491 . 0 0 "[ . 1 . 2 . 3]" 2
28 1 60 VAL QG 1 62 ARG HA 5.000 . 5.000 2.990 2.356 4.297 . 0 0 "[ . 1 . 2 . 3]" 2
29 1 55 LEU QD 1 65 LYS QB 5.000 . 5.000 3.785 2.529 4.812 . 0 0 "[ . 1 . 2 . 3]" 2
30 1 55 LEU QD 1 65 LYS QG 5.000 . 5.000 3.083 1.956 4.538 . 0 0 "[ . 1 . 2 . 3]" 2
31 1 45 ILE MG 1 55 LEU QD 5.000 . 5.000 1.626 1.512 1.857 . 0 0 "[ . 1 . 2 . 3]" 2
32 1 54 SER QB 1 56 LEU H 5.000 . 5.000 4.269 3.799 4.594 . 0 0 "[ . 1 . 2 . 3]" 2
33 1 54 SER QB 1 55 LEU QB 5.000 . 5.000 4.008 3.726 4.248 . 0 0 "[ . 1 . 2 . 3]" 2
34 1 54 SER QB 1 55 LEU QD 5.000 . 5.000 3.507 2.601 4.196 . 0 0 "[ . 1 . 2 . 3]" 2
35 1 45 ILE MG 1 52 ALA HA 5.000 . 5.000 4.477 4.117 4.946 . 0 0 "[ . 1 . 2 . 3]" 2
36 1 52 ALA MB 1 55 LEU HG 5.000 . 5.000 3.765 3.032 4.608 . 0 0 "[ . 1 . 2 . 3]" 2
37 1 42 VAL QG 1 48 GLU QB 5.000 . 5.000 5.061 4.913 5.159 0.159 25 0 "[ . 1 . 2 . 3]" 2
38 1 46 LEU HA 1 48 GLU H 5.000 . 5.000 4.162 3.915 4.350 . 0 0 "[ . 1 . 2 . 3]" 2
39 1 46 LEU HA 1 55 LEU QD 5.000 . 5.000 2.150 1.819 3.097 . 0 0 "[ . 1 . 2 . 3]" 2
40 1 46 LEU QD 1 48 GLU H 5.000 . 5.000 3.451 2.466 4.128 . 0 0 "[ . 1 . 2 . 3]" 2
41 1 46 LEU QD 1 55 LEU QD 5.000 . 5.000 1.702 1.435 1.977 . 0 0 "[ . 1 . 2 . 3]" 2
42 1 45 ILE MG 1 46 LEU QD 5.000 . 5.000 2.071 1.455 2.776 . 0 0 "[ . 1 . 2 . 3]" 2
43 1 46 LEU QD 1 55 LEU HA 5.000 . 5.000 4.013 3.728 4.551 . 0 0 "[ . 1 . 2 . 3]" 2
44 1 45 ILE MG 1 48 GLU H 5.000 . 5.000 4.405 3.990 4.638 . 0 0 "[ . 1 . 2 . 3]" 2
45 1 41 ARG H 1 45 ILE MD 5.000 . 5.000 4.924 4.806 5.021 0.021 13 0 "[ . 1 . 2 . 3]" 2
46 1 41 ARG QD 1 44 GLN QG 6.000 . 6.000 5.222 4.347 6.005 0.005 12 0 "[ . 1 . 2 . 3]" 2
47 1 26 ALA MB 1 32 LEU QB 5.000 . 5.000 3.205 2.970 3.325 . 0 0 "[ . 1 . 2 . 3]" 2
48 1 22 LEU QB 1 105 PHE QD 5.000 . 5.000 4.447 4.137 4.736 . 0 0 "[ . 1 . 2 . 3]" 2
49 1 22 LEU QB 1 105 PHE QE 5.000 . 5.000 3.928 3.533 4.100 . 0 0 "[ . 1 . 2 . 3]" 2
50 1 14 ILE MD 2 7 GLU HA 4.000 . 4.000 3.211 2.682 4.005 0.005 3 0 "[ . 1 . 2 . 3]" 2
51 1 14 ILE MD 2 7 GLU QB 4.000 . 4.000 4.016 3.852 4.054 0.054 19 0 "[ . 1 . 2 . 3]" 2
52 1 14 ILE MD 2 7 GLU QG 4.000 . 4.000 2.942 2.154 4.008 0.008 15 0 "[ . 1 . 2 . 3]" 2
53 1 21 ALA MB 2 9 SER QB 4.000 . 4.000 2.164 1.757 2.628 . 0 0 "[ . 1 . 2 . 3]" 2
54 1 25 ALA MB 2 16 ILE MD 4.000 . 4.000 3.748 2.946 4.015 0.015 25 0 "[ . 1 . 2 . 3]" 2
55 1 25 ALA MB 2 13 GLU QB 4.000 . 4.000 3.752 1.980 4.023 0.023 19 0 "[ . 1 . 2 . 3]" 2
56 1 25 ALA MB 2 13 GLU QG 4.000 . 4.000 2.577 1.911 4.035 0.035 24 0 "[ . 1 . 2 . 3]" 2
57 1 25 ALA MB 2 17 LEU QD 4.000 . 4.000 1.841 1.574 2.594 . 0 0 "[ . 1 . 2 . 3]" 2
58 1 25 ALA MB 2 17 LEU HG 4.000 . 4.000 3.480 1.830 4.015 0.015 20 0 "[ . 1 . 2 . 3]" 2
59 1 29 GLN QG 2 16 ILE MD 4.000 . 4.000 3.277 1.931 4.014 0.014 27 0 "[ . 1 . 2 . 3]" 2
60 1 81 LEU QD 2 16 ILE MD 4.000 . 4.000 3.931 3.343 4.030 0.030 11 0 "[ . 1 . 2 . 3]" 2
61 1 81 LEU QD 2 17 LEU QD 4.000 . 4.000 3.908 2.957 4.042 0.042 30 0 "[ . 1 . 2 . 3]" 2
62 1 88 LEU QD 2 9 SER HA 4.000 . 4.000 2.479 1.933 3.432 . 0 0 "[ . 1 . 2 . 3]" 2
63 1 88 LEU QD 2 9 SER QB 4.000 . 4.000 2.246 1.638 3.249 . 0 0 "[ . 1 . 2 . 3]" 2
stop_
save_
save_distance_constraint_statistics_3
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 3
_Distance_constraint_stats_list.Constraint_count 1320
_Distance_constraint_stats_list.Viol_count 4595
_Distance_constraint_stats_list.Viol_total 9359.780
_Distance_constraint_stats_list.Viol_max 0.452
_Distance_constraint_stats_list.Viol_rms 0.0325
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0079
_Distance_constraint_stats_list.Viol_average_violations_only 0.0679
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 PHE 0.021 0.013 26 0 "[ . 1 . 2 . 3]"
1 2 ALA 0.008 0.006 19 0 "[ . 1 . 2 . 3]"
1 3 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 4 LEU 0.020 0.013 26 0 "[ . 1 . 2 . 3]"
1 5 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 6 ARG 0.081 0.038 6 0 "[ . 1 . 2 . 3]"
1 7 PRO 0.093 0.038 6 0 "[ . 1 . 2 . 3]"
1 8 PRO 0.153 0.032 4 0 "[ . 1 . 2 . 3]"
1 9 VAL 0.736 0.064 7 0 "[ . 1 . 2 . 3]"
1 10 GLN 0.353 0.105 26 0 "[ . 1 . 2 . 3]"
1 11 ILE 11.838 0.411 6 0 "[ . 1 . 2 . 3]"
1 12 TYR 14.296 0.411 6 0 "[ . 1 . 2 . 3]"
1 13 GLY 4.608 0.273 23 0 "[ . 1 . 2 . 3]"
1 14 ILE 4.183 0.166 9 0 "[ . 1 . 2 . 3]"
1 15 GLU 2.741 0.099 25 0 "[ . 1 . 2 . 3]"
1 16 GLY 4.394 0.273 23 0 "[ . 1 . 2 . 3]"
1 17 ARG 3.413 0.124 14 0 "[ . 1 . 2 . 3]"
1 18 TYR 10.328 0.224 25 0 "[ . 1 . 2 . 3]"
1 19 ALA 7.591 0.211 18 0 "[ . 1 . 2 . 3]"
1 20 THR 11.142 0.217 29 0 "[ . 1 . 2 . 3]"
1 21 ALA 9.159 0.224 25 0 "[ . 1 . 2 . 3]"
1 22 LEU 16.111 0.336 13 0 "[ . 1 . 2 . 3]"
1 23 TYR 35.425 0.417 28 0 "[ . 1 . 2 . 3]"
1 24 SER 8.416 0.190 22 0 "[ . 1 . 2 . 3]"
1 25 ALA 2.111 0.078 22 0 "[ . 1 . 2 . 3]"
1 26 ALA 11.076 0.265 20 0 "[ . 1 . 2 . 3]"
1 27 SER 6.764 0.207 22 0 "[ . 1 . 2 . 3]"
1 28 LYS 0.743 0.038 2 0 "[ . 1 . 2 . 3]"
1 29 GLN 1.777 0.452 27 0 "[ . 1 . 2 . 3]"
1 30 ASN 6.399 0.263 7 0 "[ . 1 . 2 . 3]"
1 31 LYS 1.567 0.452 27 0 "[ . 1 . 2 . 3]"
1 32 LEU 29.309 0.417 28 0 "[ . 1 . 2 . 3]"
1 33 GLU 3.735 0.144 23 0 "[ . 1 . 2 . 3]"
1 34 GLN 7.654 0.255 21 0 "[ . 1 . 2 . 3]"
1 35 VAL 14.769 0.263 7 0 "[ . 1 . 2 . 3]"
1 36 GLU 1.837 0.088 13 0 "[ . 1 . 2 . 3]"
1 37 LYS 3.629 0.139 30 0 "[ . 1 . 2 . 3]"
1 38 GLU 8.629 0.251 22 0 "[ . 1 . 2 . 3]"
1 39 LEU 1.750 0.053 28 0 "[ . 1 . 2 . 3]"
1 40 LEU 4.058 0.139 30 0 "[ . 1 . 2 . 3]"
1 41 ARG 1.365 0.052 12 0 "[ . 1 . 2 . 3]"
1 42 VAL 4.823 0.127 30 0 "[ . 1 . 2 . 3]"
1 43 GLY 1.205 0.082 26 0 "[ . 1 . 2 . 3]"
1 44 GLN 0.178 0.023 20 0 "[ . 1 . 2 . 3]"
1 45 ILE 7.649 0.164 30 0 "[ . 1 . 2 . 3]"
1 46 LEU 4.636 0.142 29 0 "[ . 1 . 2 . 3]"
1 47 LYS 6.641 0.297 20 0 "[ . 1 . 2 . 3]"
1 48 GLU 7.851 0.297 20 0 "[ . 1 . 2 . 3]"
1 49 PRO 2.368 0.098 19 0 "[ . 1 . 2 . 3]"
1 50 LYS 2.215 0.154 19 0 "[ . 1 . 2 . 3]"
1 51 MET 6.713 0.154 19 0 "[ . 1 . 2 . 3]"
1 52 ALA 4.544 0.098 19 0 "[ . 1 . 2 . 3]"
1 53 ALA 1.622 0.094 12 0 "[ . 1 . 2 . 3]"
1 54 SER 3.390 0.119 28 0 "[ . 1 . 2 . 3]"
1 55 LEU 1.351 0.086 10 0 "[ . 1 . 2 . 3]"
1 56 LEU 1.152 0.086 10 0 "[ . 1 . 2 . 3]"
1 57 ASN 7.832 0.277 7 0 "[ . 1 . 2 . 3]"
1 58 PRO 1.381 0.084 23 0 "[ . 1 . 2 . 3]"
1 59 TYR 5.340 0.277 7 0 "[ . 1 . 2 . 3]"
1 60 VAL 2.976 0.132 18 0 "[ . 1 . 2 . 3]"
1 61 LYS 0.865 0.093 13 0 "[ . 1 . 2 . 3]"
1 62 ARG 0.328 0.033 19 0 "[ . 1 . 2 . 3]"
1 63 SER 0.851 0.260 13 0 "[ . 1 . 2 . 3]"
1 64 VAL 1.637 0.260 13 0 "[ . 1 . 2 . 3]"
1 65 LYS 0.485 0.050 28 0 "[ . 1 . 2 . 3]"
1 66 VAL 1.268 0.097 19 0 "[ . 1 . 2 . 3]"
1 67 LYS 1.294 0.089 19 0 "[ . 1 . 2 . 3]"
1 68 SER 0.429 0.044 26 0 "[ . 1 . 2 . 3]"
1 69 LEU 0.948 0.054 1 0 "[ . 1 . 2 . 3]"
1 70 SER 2.654 0.066 1 0 "[ . 1 . 2 . 3]"
1 71 ASP 2.762 0.101 26 0 "[ . 1 . 2 . 3]"
1 72 MET 8.366 0.386 29 0 "[ . 1 . 2 . 3]"
1 73 THR 10.009 0.386 29 0 "[ . 1 . 2 . 3]"
1 74 ALA 2.819 0.101 26 0 "[ . 1 . 2 . 3]"
1 75 LYS 0.011 0.010 24 0 "[ . 1 . 2 . 3]"
1 76 GLU 1.814 0.068 25 0 "[ . 1 . 2 . 3]"
1 77 LYS 0.832 0.084 24 0 "[ . 1 . 2 . 3]"
1 78 PHE 11.912 0.251 22 0 "[ . 1 . 2 . 3]"
1 79 SER 12.737 0.313 27 0 "[ . 1 . 2 . 3]"
1 80 PRO 11.057 0.313 27 0 "[ . 1 . 2 . 3]"
1 81 LEU 17.593 0.255 21 0 "[ . 1 . 2 . 3]"
1 82 THR 9.039 0.207 21 0 "[ . 1 . 2 . 3]"
1 83 SER 11.383 0.440 24 0 "[ . 1 . 2 . 3]"
1 84 ASN 5.096 0.154 4 0 "[ . 1 . 2 . 3]"
1 85 LEU 5.995 0.180 20 0 "[ . 1 . 2 . 3]"
1 86 ILE 19.874 0.440 24 0 "[ . 1 . 2 . 3]"
1 87 ASN 0.990 0.090 5 0 "[ . 1 . 2 . 3]"
1 88 LEU 3.761 0.093 29 0 "[ . 1 . 2 . 3]"
1 89 LEU 8.958 0.160 29 0 "[ . 1 . 2 . 3]"
1 90 ALA 0.440 0.038 6 0 "[ . 1 . 2 . 3]"
1 91 GLU 6.060 0.160 29 0 "[ . 1 . 2 . 3]"
1 92 ASN 1.093 0.067 1 0 "[ . 1 . 2 . 3]"
1 93 GLY 3.035 0.146 6 0 "[ . 1 . 2 . 3]"
1 94 ARG 4.955 0.146 6 0 "[ . 1 . 2 . 3]"
1 95 LEU 6.665 0.293 20 0 "[ . 1 . 2 . 3]"
1 96 THR 4.902 0.141 20 0 "[ . 1 . 2 . 3]"
1 97 ASN 2.490 0.091 24 0 "[ . 1 . 2 . 3]"
1 98 THR 10.847 0.293 20 0 "[ . 1 . 2 . 3]"
1 99 PRO 3.893 0.122 28 0 "[ . 1 . 2 . 3]"
1 100 ALA 1.245 0.139 23 0 "[ . 1 . 2 . 3]"
1 101 VAL 1.593 0.085 25 0 "[ . 1 . 2 . 3]"
1 102 ILE 1.013 0.088 29 0 "[ . 1 . 2 . 3]"
1 103 SER 2.697 0.072 23 0 "[ . 1 . 2 . 3]"
1 104 ALA 1.230 0.067 29 0 "[ . 1 . 2 . 3]"
1 105 PHE 16.982 0.211 18 0 "[ . 1 . 2 . 3]"
1 106 SER 4.336 0.148 14 0 "[ . 1 . 2 . 3]"
1 107 THR 3.619 0.199 28 0 "[ . 1 . 2 . 3]"
1 108 MET 3.959 0.163 28 0 "[ . 1 . 2 . 3]"
1 109 MET 9.216 0.217 29 0 "[ . 1 . 2 . 3]"
1 110 SER 10.063 0.199 28 0 "[ . 1 . 2 . 3]"
1 111 VAL 2.043 0.111 20 0 "[ . 1 . 2 . 3]"
1 112 HIS 19.331 0.286 14 0 "[ . 1 . 2 . 3]"
1 113 ARG 7.608 0.178 20 0 "[ . 1 . 2 . 3]"
1 114 GLY 1.477 0.111 20 0 "[ . 1 . 2 . 3]"
1 115 GLU 0.325 0.052 8 0 "[ . 1 . 2 . 3]"
1 116 VAL 0.408 0.064 14 0 "[ . 1 . 2 . 3]"
1 117 PRO 0.064 0.064 14 0 "[ . 1 . 2 . 3]"
1 118 CYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 119 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 120 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
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 PHE QB 1 2 ALA H 5.000 . 5.000 3.404 2.159 4.074 . 0 0 "[ . 1 . 2 . 3]" 3
2 1 1 PHE QD 1 2 ALA HA 5.000 . 5.000 4.210 3.357 5.006 0.006 19 0 "[ . 1 . 2 . 3]" 3
3 1 1 PHE QD 1 4 LEU QD 6.000 . 6.000 5.129 3.526 6.013 0.013 26 0 "[ . 1 . 2 . 3]" 3
4 1 2 ALA HA 1 3 LYS H 5.000 . 5.000 2.818 2.288 3.628 . 0 0 "[ . 1 . 2 . 3]" 3
5 1 2 ALA MB 1 3 LYS H 5.000 . 5.000 2.950 2.106 3.763 . 0 0 "[ . 1 . 2 . 3]" 3
6 1 3 LYS H 1 3 LYS QD 5.000 . 5.000 4.456 2.629 4.917 . 0 0 "[ . 1 . 2 . 3]" 3
7 1 3 LYS H 1 3 LYS QG 5.000 . 5.000 3.524 2.115 4.213 . 0 0 "[ . 1 . 2 . 3]" 3
8 1 3 LYS HA 1 4 LEU H 5.000 . 5.000 2.493 2.259 3.623 . 0 0 "[ . 1 . 2 . 3]" 3
9 1 3 LYS QB 1 4 LEU H 5.000 . 5.000 3.554 2.159 4.098 . 0 0 "[ . 1 . 2 . 3]" 3
10 1 4 LEU H 1 4 LEU HG 5.000 . 5.000 3.810 2.387 4.770 . 0 0 "[ . 1 . 2 . 3]" 3
11 1 4 LEU H 1 4 LEU QD 5.000 . 5.000 3.281 2.122 3.951 . 0 0 "[ . 1 . 2 . 3]" 3
12 1 4 LEU HA 1 5 VAL H 5.000 . 5.000 2.456 2.255 2.810 . 0 0 "[ . 1 . 2 . 3]" 3
13 1 4 LEU QB 1 5 VAL H 5.000 . 5.000 2.963 2.155 4.036 . 0 0 "[ . 1 . 2 . 3]" 3
14 1 4 LEU QB 1 6 ARG QD 5.000 . 5.000 4.425 3.284 5.004 0.004 15 0 "[ . 1 . 2 . 3]" 3
15 1 5 VAL HA 1 6 ARG H 5.000 . 5.000 2.517 2.252 3.630 . 0 0 "[ . 1 . 2 . 3]" 3
16 1 5 VAL HB 1 6 ARG H 5.000 . 5.000 4.187 2.168 4.714 . 0 0 "[ . 1 . 2 . 3]" 3
17 1 5 VAL QG 1 6 ARG H 5.000 . 5.000 3.181 2.124 3.733 . 0 0 "[ . 1 . 2 . 3]" 3
18 1 6 ARG H 1 6 ARG QG 5.000 . 5.000 3.486 2.175 4.236 . 0 0 "[ . 1 . 2 . 3]" 3
19 1 6 ARG HA 1 7 PRO QD 3.500 . 3.500 2.210 2.010 3.538 0.038 6 0 "[ . 1 . 2 . 3]" 3
20 1 6 ARG H 1 7 PRO QD 5.000 . 5.000 3.650 2.031 4.446 . 0 0 "[ . 1 . 2 . 3]" 3
21 1 6 ARG QB 1 7 PRO QD 5.000 . 5.000 3.143 1.847 3.886 . 0 0 "[ . 1 . 2 . 3]" 3
22 1 6 ARG QG 1 7 PRO QD 5.000 . 5.000 3.328 1.943 4.145 . 0 0 "[ . 1 . 2 . 3]" 3
23 1 7 PRO HA 1 8 PRO QD 3.500 . 3.500 2.104 2.007 2.265 . 0 0 "[ . 1 . 2 . 3]" 3
24 1 7 PRO QB 1 8 PRO QD 5.000 . 5.000 2.673 2.025 3.389 . 0 0 "[ . 1 . 2 . 3]" 3
25 1 7 PRO QG 1 8 PRO QD 5.000 . 5.000 4.259 3.812 4.671 . 0 0 "[ . 1 . 2 . 3]" 3
26 1 7 PRO QB 1 9 VAL H 6.000 . 6.000 5.174 2.774 6.013 0.013 10 0 "[ . 1 . 2 . 3]" 3
27 1 7 PRO QB 1 9 VAL QG 5.000 . 5.000 3.652 2.088 4.841 . 0 0 "[ . 1 . 2 . 3]" 3
28 1 8 PRO HA 1 9 VAL H 5.000 . 5.000 2.640 2.262 3.623 . 0 0 "[ . 1 . 2 . 3]" 3
29 1 8 PRO HA 1 9 VAL QG 5.000 . 5.000 3.372 2.997 4.654 . 0 0 "[ . 1 . 2 . 3]" 3
30 1 8 PRO QB 1 9 VAL H 5.000 . 5.000 2.900 2.134 3.995 . 0 0 "[ . 1 . 2 . 3]" 3
31 1 8 PRO QB 1 9 VAL QG 5.000 . 5.000 3.701 2.244 4.539 . 0 0 "[ . 1 . 2 . 3]" 3
32 1 8 PRO QD 1 9 VAL H 5.000 . 5.000 4.576 2.527 5.032 0.032 4 0 "[ . 1 . 2 . 3]" 3
33 1 8 PRO QD 1 9 VAL QG 5.000 . 5.000 4.218 3.197 5.029 0.029 10 0 "[ . 1 . 2 . 3]" 3
34 1 9 VAL HA 1 10 GLN H 5.000 . 5.000 2.484 2.226 3.629 . 0 0 "[ . 1 . 2 . 3]" 3
35 1 9 VAL HB 1 10 GLN H 5.000 . 5.000 3.721 2.162 4.514 . 0 0 "[ . 1 . 2 . 3]" 3
36 1 9 VAL H 1 10 GLN H 5.000 . 5.000 3.934 2.349 4.615 . 0 0 "[ . 1 . 2 . 3]" 3
37 1 9 VAL QG 1 10 GLN H 5.000 . 5.000 3.190 2.027 3.751 . 0 0 "[ . 1 . 2 . 3]" 3
38 1 9 VAL HA 1 12 TYR QD 5.000 . 5.000 4.623 2.851 5.042 0.042 21 0 "[ . 1 . 2 . 3]" 3
39 1 9 VAL HA 1 12 TYR QE 6.000 . 6.000 4.275 2.925 6.005 0.005 26 0 "[ . 1 . 2 . 3]" 3
40 1 9 VAL HB 1 12 TYR QD 5.000 . 5.000 4.524 2.861 5.024 0.024 6 0 "[ . 1 . 2 . 3]" 3
41 1 9 VAL QG 1 12 TYR QD 5.000 . 5.000 3.539 1.875 5.064 0.064 7 0 "[ . 1 . 2 . 3]" 3
42 1 9 VAL QG 1 12 TYR QE 5.000 . 5.000 3.249 1.985 5.035 0.035 24 0 "[ . 1 . 2 . 3]" 3
43 1 10 GLN H 1 10 GLN QG 5.000 . 5.000 3.415 2.103 4.308 . 0 0 "[ . 1 . 2 . 3]" 3
44 1 10 GLN HA 1 11 ILE H 5.000 . 5.000 2.810 2.238 3.631 . 0 0 "[ . 1 . 2 . 3]" 3
45 1 10 GLN H 1 11 ILE H 5.000 . 5.000 3.545 2.286 4.599 . 0 0 "[ . 1 . 2 . 3]" 3
46 1 10 GLN QB 1 11 ILE H 5.000 . 5.000 2.950 2.141 4.088 . 0 0 "[ . 1 . 2 . 3]" 3
47 1 10 GLN QG 1 11 ILE H 5.000 . 5.000 3.773 2.632 4.262 . 0 0 "[ . 1 . 2 . 3]" 3
48 1 10 GLN QB 1 12 TYR QD 6.000 . 6.000 5.000 4.144 5.832 . 0 0 "[ . 1 . 2 . 3]" 3
49 1 10 GLN QB 1 12 TYR QE 5.000 . 5.000 4.299 2.994 5.105 0.105 26 0 "[ . 1 . 2 . 3]" 3
50 1 10 GLN QG 1 12 TYR QE 5.000 . 5.000 4.464 3.741 5.088 0.088 22 0 "[ . 1 . 2 . 3]" 3
51 1 11 ILE H 1 11 ILE MD 5.000 . 5.000 3.270 2.223 4.647 . 0 0 "[ . 1 . 2 . 3]" 3
52 1 11 ILE H 1 11 ILE QG 5.000 . 5.000 3.252 2.531 4.308 . 0 0 "[ . 1 . 2 . 3]" 3
53 1 11 ILE HA 1 12 TYR H 5.000 . 5.000 2.463 2.221 3.637 . 0 0 "[ . 1 . 2 . 3]" 3
54 1 11 ILE HA 1 12 TYR QD 5.000 . 5.000 3.564 2.734 4.664 . 0 0 "[ . 1 . 2 . 3]" 3
55 1 11 ILE HA 1 12 TYR QE 5.000 . 5.000 3.773 3.073 5.191 0.191 23 0 "[ . 1 . 2 . 3]" 3
56 1 11 ILE HB 1 12 TYR H 5.000 . 5.000 4.251 2.139 4.699 . 0 0 "[ . 1 . 2 . 3]" 3
57 1 11 ILE HB 1 12 TYR QE 5.000 . 5.000 5.141 4.625 5.411 0.411 6 0 "[ . 1 . 2 . 3]" 3
58 1 11 ILE H 1 12 TYR H 5.000 . 5.000 3.871 2.172 4.549 . 0 0 "[ . 1 . 2 . 3]" 3
59 1 11 ILE MD 1 12 TYR QD 5.000 . 5.000 4.781 4.248 5.080 0.080 22 0 "[ . 1 . 2 . 3]" 3
60 1 11 ILE MD 1 12 TYR QE 5.000 . 5.000 4.469 3.691 5.012 0.012 4 0 "[ . 1 . 2 . 3]" 3
61 1 11 ILE QG 1 12 TYR H 5.000 . 5.000 3.881 2.096 4.831 . 0 0 "[ . 1 . 2 . 3]" 3
62 1 11 ILE QG 1 12 TYR QE 5.000 . 5.000 4.954 4.144 5.161 0.161 22 0 "[ . 1 . 2 . 3]" 3
63 1 11 ILE MG 1 12 TYR H 5.000 . 5.000 3.079 2.025 3.850 . 0 0 "[ . 1 . 2 . 3]" 3
64 1 11 ILE MG 1 12 TYR QD 5.000 . 5.000 4.310 2.606 4.639 . 0 0 "[ . 1 . 2 . 3]" 3
65 1 11 ILE MG 1 12 TYR QE 5.000 . 5.000 5.064 1.941 5.347 0.347 13 0 "[ . 1 . 2 . 3]" 3
66 1 11 ILE MD 1 104 ALA HA 5.000 . 5.000 3.577 2.391 5.027 0.027 11 0 "[ . 1 . 2 . 3]" 3
67 1 11 ILE MD 1 104 ALA MB 5.000 . 5.000 3.083 1.708 4.755 . 0 0 "[ . 1 . 2 . 3]" 3
68 1 11 ILE QG 1 104 ALA HA 5.000 . 5.000 4.269 2.116 5.016 0.016 18 0 "[ . 1 . 2 . 3]" 3
69 1 11 ILE MG 1 104 ALA MB 5.000 . 5.000 4.067 1.983 5.028 0.028 24 0 "[ . 1 . 2 . 3]" 3
70 1 12 TYR H 1 12 TYR QD 5.000 . 5.000 2.871 2.206 3.358 . 0 0 "[ . 1 . 2 . 3]" 3
71 1 12 TYR H 1 12 TYR QE 5.000 . 5.000 4.155 3.950 4.601 . 0 0 "[ . 1 . 2 . 3]" 3
72 1 12 TYR HA 1 13 GLY H 5.000 . 5.000 2.837 2.364 3.633 . 0 0 "[ . 1 . 2 . 3]" 3
73 1 12 TYR H 1 13 GLY H 3.500 . 3.500 3.138 2.331 3.577 0.077 23 0 "[ . 1 . 2 . 3]" 3
74 1 12 TYR QB 1 13 GLY H 5.000 . 5.000 3.321 2.136 3.975 . 0 0 "[ . 1 . 2 . 3]" 3
75 1 12 TYR QD 1 13 GLY H 6.000 . 6.000 4.394 2.958 5.014 . 0 0 "[ . 1 . 2 . 3]" 3
76 1 12 TYR QD 1 16 GLY QA 6.000 . 6.000 5.209 3.015 6.034 0.034 14 0 "[ . 1 . 2 . 3]" 3
77 1 12 TYR QD 1 100 ALA HA 6.000 . 6.000 6.021 5.947 6.043 0.043 17 0 "[ . 1 . 2 . 3]" 3
78 1 12 TYR QD 1 100 ALA MB 5.000 . 5.000 4.391 3.766 4.911 . 0 0 "[ . 1 . 2 . 3]" 3
79 1 12 TYR QE 1 100 ALA HA 6.000 . 6.000 4.678 3.815 5.797 . 0 0 "[ . 1 . 2 . 3]" 3
80 1 12 TYR QE 1 100 ALA MB 5.000 . 5.000 3.818 2.023 5.139 0.139 23 0 "[ . 1 . 2 . 3]" 3
81 1 12 TYR QE 1 103 SER QB 5.000 . 5.000 4.201 2.698 5.072 0.072 23 0 "[ . 1 . 2 . 3]" 3
82 1 12 TYR QD 1 104 ALA MB 5.000 . 5.000 4.598 1.883 5.022 0.022 14 0 "[ . 1 . 2 . 3]" 3
83 1 12 TYR QE 1 104 ALA MB 5.000 . 5.000 4.279 2.028 4.760 . 0 0 "[ . 1 . 2 . 3]" 3
84 1 13 GLY H 1 14 ILE H 3.500 . 3.500 3.559 2.876 3.666 0.166 9 0 "[ . 1 . 2 . 3]" 3
85 1 13 GLY QA 1 14 ILE H 5.000 . 5.000 2.244 2.154 2.746 . 0 0 "[ . 1 . 2 . 3]" 3
86 1 13 GLY QA 1 16 GLY H 3.500 . 3.500 3.545 3.318 3.773 0.273 23 0 "[ . 1 . 2 . 3]" 3
87 1 14 ILE H 1 14 ILE QG 5.000 . 5.000 3.849 2.166 4.092 . 0 0 "[ . 1 . 2 . 3]" 3
88 1 14 ILE HA 1 15 GLU H 5.000 . 5.000 3.583 3.571 3.593 . 0 0 "[ . 1 . 2 . 3]" 3
89 1 14 ILE HB 1 15 GLU H 5.000 . 5.000 3.843 2.727 4.076 . 0 0 "[ . 1 . 2 . 3]" 3
90 1 14 ILE H 1 15 GLU H 3.500 . 3.500 2.915 2.306 3.026 . 0 0 "[ . 1 . 2 . 3]" 3
91 1 14 ILE MD 1 15 GLU H 5.000 . 5.000 4.216 3.438 4.652 . 0 0 "[ . 1 . 2 . 3]" 3
92 1 14 ILE MG 1 15 GLU HA 5.000 . 5.000 3.275 3.069 3.417 . 0 0 "[ . 1 . 2 . 3]" 3
93 1 14 ILE MG 1 15 GLU H 5.000 . 5.000 2.196 2.030 3.319 . 0 0 "[ . 1 . 2 . 3]" 3
94 1 14 ILE HA 1 17 ARG H 3.500 . 3.500 3.313 3.039 3.575 0.075 24 0 "[ . 1 . 2 . 3]" 3
95 1 14 ILE HA 1 17 ARG QB 3.500 . 3.500 2.727 2.337 3.484 . 0 0 "[ . 1 . 2 . 3]" 3
96 1 14 ILE HA 1 17 ARG QD 5.000 . 5.000 3.763 2.026 5.008 0.008 15 0 "[ . 1 . 2 . 3]" 3
97 1 14 ILE MD 1 17 ARG QD 5.000 . 5.000 3.373 1.983 4.881 . 0 0 "[ . 1 . 2 . 3]" 3
98 1 14 ILE MG 1 17 ARG H 5.000 . 5.000 4.914 4.753 5.017 0.017 23 0 "[ . 1 . 2 . 3]" 3
99 1 14 ILE HA 1 18 TYR QE 6.000 . 6.000 5.400 4.270 6.030 0.030 14 0 "[ . 1 . 2 . 3]" 3
100 1 14 ILE MD 1 18 TYR QB 5.000 . 5.000 4.962 4.461 5.119 0.119 25 0 "[ . 1 . 2 . 3]" 3
101 1 14 ILE MD 1 18 TYR QD 5.000 . 5.000 3.085 2.662 3.421 . 0 0 "[ . 1 . 2 . 3]" 3
102 1 14 ILE MD 1 18 TYR QE 5.000 . 5.000 2.879 1.987 3.725 . 0 0 "[ . 1 . 2 . 3]" 3
103 1 14 ILE QG 1 18 TYR QE 5.000 . 5.000 3.441 2.283 4.592 . 0 0 "[ . 1 . 2 . 3]" 3
104 1 14 ILE MG 1 18 TYR QD 5.000 . 5.000 4.391 2.553 4.856 . 0 0 "[ . 1 . 2 . 3]" 3
105 1 14 ILE MG 1 18 TYR QE 5.000 . 5.000 4.041 1.948 4.530 . 0 0 "[ . 1 . 2 . 3]" 3
106 1 14 ILE MG 1 94 ARG QD 5.000 . 5.000 4.703 3.395 5.030 0.030 24 0 "[ . 1 . 2 . 3]" 3
107 1 15 GLU H 1 15 GLU QG 5.000 . 5.000 3.193 2.369 4.000 . 0 0 "[ . 1 . 2 . 3]" 3
108 1 15 GLU HA 1 16 GLY H 5.000 . 5.000 3.593 3.585 3.605 . 0 0 "[ . 1 . 2 . 3]" 3
109 1 15 GLU H 1 16 GLY H 2.800 . 2.800 2.762 2.517 2.872 0.072 19 0 "[ . 1 . 2 . 3]" 3
110 1 15 GLU QB 1 16 GLY H 5.000 . 5.000 2.776 2.659 2.857 . 0 0 "[ . 1 . 2 . 3]" 3
111 1 15 GLU QG 1 16 GLY H 5.000 . 5.000 4.450 4.262 4.604 . 0 0 "[ . 1 . 2 . 3]" 3
112 1 15 GLU HA 1 18 TYR H 3.500 . 3.500 3.492 3.281 3.548 0.048 24 0 "[ . 1 . 2 . 3]" 3
113 1 15 GLU HA 1 18 TYR QB 3.500 . 3.500 3.071 2.335 3.568 0.068 30 0 "[ . 1 . 2 . 3]" 3
114 1 15 GLU HA 1 18 TYR QD 5.000 . 5.000 3.553 3.180 3.812 . 0 0 "[ . 1 . 2 . 3]" 3
115 1 15 GLU HA 1 18 TYR QE 5.000 . 5.000 4.525 3.831 5.017 0.017 15 0 "[ . 1 . 2 . 3]" 3
116 1 15 GLU QG 1 18 TYR QD 6.000 . 6.000 4.510 3.984 4.773 . 0 0 "[ . 1 . 2 . 3]" 3
117 1 15 GLU QG 1 18 TYR QE 5.000 . 5.000 4.912 4.224 5.099 0.099 25 0 "[ . 1 . 2 . 3]" 3
118 1 15 GLU QG 1 89 LEU QD 6.000 . 6.000 4.308 3.255 5.245 . 0 0 "[ . 1 . 2 . 3]" 3
119 1 15 GLU QG 1 100 ALA MB 5.000 . 5.000 4.372 3.173 5.019 0.019 10 0 "[ . 1 . 2 . 3]" 3
120 1 15 GLU HA 1 101 VAL QG 5.000 . 5.000 2.735 1.991 3.176 . 0 0 "[ . 1 . 2 . 3]" 3
121 1 15 GLU QB 1 101 VAL HA 5.000 . 5.000 3.162 2.040 4.749 . 0 0 "[ . 1 . 2 . 3]" 3
122 1 15 GLU QG 1 101 VAL HA 5.000 . 5.000 4.571 3.773 5.018 0.018 19 0 "[ . 1 . 2 . 3]" 3
123 1 15 GLU QG 1 101 VAL QG 5.000 . 5.000 2.103 1.705 2.662 . 0 0 "[ . 1 . 2 . 3]" 3
124 1 16 GLY H 1 17 ARG H 2.800 . 2.800 2.654 2.562 2.768 . 0 0 "[ . 1 . 2 . 3]" 3
125 1 16 GLY QA 1 17 ARG H 5.000 . 5.000 2.763 2.667 2.824 . 0 0 "[ . 1 . 2 . 3]" 3
126 1 16 GLY QA 1 19 ALA H 3.500 . 3.500 3.551 3.511 3.606 0.106 9 0 "[ . 1 . 2 . 3]" 3
127 1 16 GLY QA 1 19 ALA MB 3.500 . 3.500 3.397 3.114 3.540 0.040 29 0 "[ . 1 . 2 . 3]" 3
128 1 16 GLY QA 1 104 ALA MB 5.000 . 5.000 2.092 1.746 2.816 . 0 0 "[ . 1 . 2 . 3]" 3
129 1 17 ARG H 1 17 ARG QD 5.000 . 5.000 4.001 3.265 4.539 . 0 0 "[ . 1 . 2 . 3]" 3
130 1 17 ARG H 1 17 ARG QG 5.000 . 5.000 2.990 2.135 4.040 . 0 0 "[ . 1 . 2 . 3]" 3
131 1 17 ARG HA 1 18 TYR H 5.000 . 5.000 3.568 3.552 3.585 . 0 0 "[ . 1 . 2 . 3]" 3
132 1 17 ARG H 1 18 TYR H 2.800 . 2.800 2.804 2.698 2.846 0.046 10 0 "[ . 1 . 2 . 3]" 3
133 1 17 ARG H 1 18 TYR QD 5.000 . 5.000 4.443 4.120 4.973 . 0 0 "[ . 1 . 2 . 3]" 3
134 1 17 ARG QB 1 18 TYR QD 6.000 . 6.000 3.215 2.975 3.506 . 0 0 "[ . 1 . 2 . 3]" 3
135 1 17 ARG QB 1 18 TYR QE 6.000 . 6.000 4.628 4.278 5.061 . 0 0 "[ . 1 . 2 . 3]" 3
136 1 17 ARG HA 1 20 THR HA 5.000 . 5.000 5.065 4.848 5.124 0.124 14 0 "[ . 1 . 2 . 3]" 3
137 1 17 ARG HA 1 20 THR HB 3.500 . 3.500 3.335 2.462 3.519 0.019 30 0 "[ . 1 . 2 . 3]" 3
138 1 17 ARG HA 1 20 THR H 3.500 . 3.500 3.086 2.954 3.276 . 0 0 "[ . 1 . 2 . 3]" 3
139 1 17 ARG HA 1 20 THR MG 5.000 . 5.000 4.001 3.742 4.076 . 0 0 "[ . 1 . 2 . 3]" 3
140 1 17 ARG HA 1 21 ALA MB 5.000 . 5.000 4.053 3.696 4.391 . 0 0 "[ . 1 . 2 . 3]" 3
141 1 18 TYR H 1 18 TYR QD 5.000 . 5.000 2.410 2.146 2.874 . 0 0 "[ . 1 . 2 . 3]" 3
142 1 18 TYR H 1 18 TYR QE 5.000 . 5.000 4.719 4.469 5.025 0.025 15 0 "[ . 1 . 2 . 3]" 3
143 1 18 TYR HA 1 19 ALA H 5.000 . 5.000 3.594 3.585 3.607 . 0 0 "[ . 1 . 2 . 3]" 3
144 1 18 TYR H 1 19 ALA H 2.800 . 2.800 2.820 2.744 2.871 0.071 20 0 "[ . 1 . 2 . 3]" 3
145 1 18 TYR QB 1 19 ALA H 5.000 . 5.000 2.646 2.394 2.735 . 0 0 "[ . 1 . 2 . 3]" 3
146 1 18 TYR QD 1 19 ALA H 5.000 . 5.000 4.494 4.363 4.599 . 0 0 "[ . 1 . 2 . 3]" 3
147 1 18 TYR HA 1 21 ALA H 3.500 . 3.500 3.646 3.568 3.724 0.224 25 0 "[ . 1 . 2 . 3]" 3
148 1 18 TYR HA 1 21 ALA MB 3.500 . 3.500 2.898 2.691 3.217 . 0 0 "[ . 1 . 2 . 3]" 3
149 1 18 TYR QD 1 85 LEU QD 5.000 . 5.000 2.476 2.057 3.173 . 0 0 "[ . 1 . 2 . 3]" 3
150 1 18 TYR QD 1 88 LEU MD1 5.000 . 5.000 3.826 2.980 5.006 0.006 24 0 "[ . 1 . 2 . 3]" 3
151 1 18 TYR QD 1 88 LEU MD2 5.000 . 5.000 3.450 2.350 4.349 . 0 0 "[ . 1 . 2 . 3]" 3
152 1 18 TYR QE 1 88 LEU HA 5.000 . 5.000 4.103 3.366 5.015 0.015 21 0 "[ . 1 . 2 . 3]" 3
153 1 18 TYR QE 1 88 LEU QD 5.000 . 5.000 2.212 1.859 2.997 . 0 0 "[ . 1 . 2 . 3]" 3
154 1 18 TYR QD 1 89 LEU HG 5.000 . 5.000 3.970 3.598 4.767 . 0 0 "[ . 1 . 2 . 3]" 3
155 1 18 TYR QD 1 89 LEU H 6.000 . 6.000 4.850 4.236 5.859 . 0 0 "[ . 1 . 2 . 3]" 3
156 1 18 TYR QD 1 89 LEU MD1 5.000 . 5.000 4.982 4.805 5.070 0.070 25 0 "[ . 1 . 2 . 3]" 3
157 1 18 TYR QD 1 89 LEU MD2 5.000 . 5.000 3.732 2.929 4.576 . 0 0 "[ . 1 . 2 . 3]" 3
158 1 18 TYR QE 1 89 LEU HA 6.000 . 6.000 4.428 4.030 4.802 . 0 0 "[ . 1 . 2 . 3]" 3
159 1 18 TYR QE 1 89 LEU HG 5.000 . 5.000 5.008 4.620 5.084 0.084 29 0 "[ . 1 . 2 . 3]" 3
160 1 18 TYR QE 1 89 LEU H 6.000 . 6.000 4.858 4.598 5.220 . 0 0 "[ . 1 . 2 . 3]" 3
161 1 18 TYR QE 1 89 LEU QD 5.000 . 5.000 4.371 3.421 4.791 . 0 0 "[ . 1 . 2 . 3]" 3
162 1 18 TYR QE 1 92 ASN QD 6.000 . 6.000 5.115 4.156 6.010 0.010 5 0 "[ . 1 . 2 . 3]" 3
163 1 18 TYR QD 1 94 ARG QG 6.000 . 6.000 4.478 3.099 5.369 . 0 0 "[ . 1 . 2 . 3]" 3
164 1 18 TYR QE 1 94 ARG QD 5.000 . 5.000 3.429 2.264 4.883 . 0 0 "[ . 1 . 2 . 3]" 3
165 1 18 TYR H 1 101 VAL QG 6.000 . 6.000 3.519 3.042 4.015 . 0 0 "[ . 1 . 2 . 3]" 3
166 1 18 TYR QB 1 101 VAL QG 5.000 . 5.000 2.182 1.875 2.383 . 0 0 "[ . 1 . 2 . 3]" 3
167 1 18 TYR QD 1 101 VAL QG 5.000 . 5.000 3.378 2.514 3.770 . 0 0 "[ . 1 . 2 . 3]" 3
168 1 18 TYR QE 1 101 VAL QG 5.000 . 5.000 4.702 4.047 5.024 0.024 18 0 "[ . 1 . 2 . 3]" 3
169 1 19 ALA HA 1 20 THR H 5.000 . 5.000 3.595 3.584 3.602 . 0 0 "[ . 1 . 2 . 3]" 3
170 1 19 ALA H 1 20 THR H 2.800 . 2.800 2.551 2.491 2.596 . 0 0 "[ . 1 . 2 . 3]" 3
171 1 19 ALA MB 1 20 THR H 5.000 . 5.000 2.668 2.618 2.743 . 0 0 "[ . 1 . 2 . 3]" 3
172 1 19 ALA HA 1 22 LEU H 3.500 . 3.500 3.524 3.363 3.570 0.070 15 0 "[ . 1 . 2 . 3]" 3
173 1 19 ALA HA 1 22 LEU QB 3.500 . 3.500 2.871 2.564 3.120 . 0 0 "[ . 1 . 2 . 3]" 3
174 1 19 ALA HA 1 22 LEU QD 5.000 . 5.000 3.550 3.178 4.508 . 0 0 "[ . 1 . 2 . 3]" 3
175 1 19 ALA HA 1 23 TYR H 5.000 . 5.000 3.654 3.491 3.911 . 0 0 "[ . 1 . 2 . 3]" 3
176 1 19 ALA HA 1 39 LEU QD 5.000 . 5.000 3.246 2.924 3.608 . 0 0 "[ . 1 . 2 . 3]" 3
177 1 19 ALA MB 1 39 LEU QD 5.000 . 5.000 2.640 1.853 3.115 . 0 0 "[ . 1 . 2 . 3]" 3
178 1 19 ALA HA 1 101 VAL QG 5.000 . 5.000 3.830 3.115 4.638 . 0 0 "[ . 1 . 2 . 3]" 3
179 1 19 ALA H 1 101 VAL QG 5.000 . 5.000 2.730 2.187 3.596 . 0 0 "[ . 1 . 2 . 3]" 3
180 1 19 ALA MB 1 101 VAL HA 5.000 . 5.000 4.136 2.776 4.930 . 0 0 "[ . 1 . 2 . 3]" 3
181 1 19 ALA MB 1 101 VAL QG 5.000 . 5.000 2.505 1.806 3.432 . 0 0 "[ . 1 . 2 . 3]" 3
182 1 19 ALA MB 1 104 ALA H 5.000 . 5.000 4.798 4.499 5.015 0.015 23 0 "[ . 1 . 2 . 3]" 3
183 1 19 ALA MB 1 104 ALA MB 5.000 . 5.000 3.231 2.932 3.759 . 0 0 "[ . 1 . 2 . 3]" 3
184 1 19 ALA MB 1 105 PHE H 5.000 . 5.000 3.224 2.954 3.590 . 0 0 "[ . 1 . 2 . 3]" 3
185 1 19 ALA MB 1 105 PHE HZ 5.000 . 5.000 5.129 5.079 5.211 0.211 18 0 "[ . 1 . 2 . 3]" 3
186 1 19 ALA MB 1 105 PHE QB 5.000 . 5.000 2.274 1.999 2.813 . 0 0 "[ . 1 . 2 . 3]" 3
187 1 19 ALA MB 1 105 PHE QD 5.000 . 5.000 1.837 1.791 1.877 . 0 0 "[ . 1 . 2 . 3]" 3
188 1 19 ALA MB 1 105 PHE QE 5.000 . 5.000 3.490 3.202 3.617 . 0 0 "[ . 1 . 2 . 3]" 3
189 1 19 ALA MB 1 106 SER H 6.000 . 6.000 5.038 4.706 5.577 . 0 0 "[ . 1 . 2 . 3]" 3
190 1 20 THR HA 1 21 ALA H 5.000 . 5.000 3.566 3.544 3.590 . 0 0 "[ . 1 . 2 . 3]" 3
191 1 20 THR HB 1 21 ALA H 5.000 . 5.000 3.322 2.891 3.615 . 0 0 "[ . 1 . 2 . 3]" 3
192 1 20 THR H 1 21 ALA H 2.800 . 2.800 2.616 2.569 2.685 . 0 0 "[ . 1 . 2 . 3]" 3
193 1 20 THR H 1 21 ALA MB 5.000 . 5.000 4.286 4.219 4.342 . 0 0 "[ . 1 . 2 . 3]" 3
194 1 20 THR MG 1 21 ALA H 5.000 . 5.000 4.310 4.162 4.384 . 0 0 "[ . 1 . 2 . 3]" 3
195 1 20 THR HA 1 23 TYR H 3.500 . 3.500 3.504 3.363 3.564 0.064 29 0 "[ . 1 . 2 . 3]" 3
196 1 20 THR HA 1 23 TYR QB 3.500 . 3.500 3.584 3.480 3.628 0.128 23 0 "[ . 1 . 2 . 3]" 3
197 1 20 THR HA 1 23 TYR QD 5.000 . 5.000 1.922 1.794 1.979 . 0 0 "[ . 1 . 2 . 3]" 3
198 1 20 THR HA 1 23 TYR QE 5.000 . 5.000 2.741 2.647 3.074 . 0 0 "[ . 1 . 2 . 3]" 3
199 1 20 THR MG 1 23 TYR QD 5.000 . 5.000 2.860 2.736 2.976 . 0 0 "[ . 1 . 2 . 3]" 3
200 1 20 THR MG 1 23 TYR QE 5.000 . 5.000 1.873 1.816 2.157 . 0 0 "[ . 1 . 2 . 3]" 3
201 1 20 THR HA 1 24 SER H 5.000 . 5.000 3.583 3.421 4.331 . 0 0 "[ . 1 . 2 . 3]" 3
202 1 20 THR MG 1 24 SER H 5.000 . 5.000 4.694 4.466 4.986 . 0 0 "[ . 1 . 2 . 3]" 3
203 1 20 THR MG 1 105 PHE QD 5.000 . 5.000 5.078 4.762 5.150 0.150 22 0 "[ . 1 . 2 . 3]" 3
204 1 20 THR HA 1 108 MET QB 5.000 . 5.000 3.787 3.627 3.956 . 0 0 "[ . 1 . 2 . 3]" 3
205 1 20 THR MG 1 108 MET QB 5.000 . 5.000 1.823 1.761 1.922 . 0 0 "[ . 1 . 2 . 3]" 3
206 1 20 THR MG 1 109 MET HA 5.000 . 5.000 5.082 4.931 5.217 0.217 29 0 "[ . 1 . 2 . 3]" 3
207 1 20 THR MG 1 109 MET H 5.000 . 5.000 4.585 4.239 4.721 . 0 0 "[ . 1 . 2 . 3]" 3
208 1 21 ALA HA 1 22 LEU H 5.000 . 5.000 3.496 3.439 3.522 . 0 0 "[ . 1 . 2 . 3]" 3
209 1 21 ALA H 1 22 LEU H 2.800 . 2.800 2.535 2.458 2.610 . 0 0 "[ . 1 . 2 . 3]" 3
210 1 21 ALA MB 1 22 LEU H 5.000 . 5.000 3.068 2.973 3.205 . 0 0 "[ . 1 . 2 . 3]" 3
211 1 21 ALA HA 1 23 TYR H 5.000 . 5.000 4.889 4.678 4.993 . 0 0 "[ . 1 . 2 . 3]" 3
212 1 21 ALA HA 1 24 SER H 3.500 . 3.500 3.659 3.608 3.690 0.190 22 0 "[ . 1 . 2 . 3]" 3
213 1 21 ALA HA 1 24 SER QB 3.500 . 3.500 2.793 2.592 3.238 . 0 0 "[ . 1 . 2 . 3]" 3
214 1 21 ALA MB 1 88 LEU QD 5.000 . 5.000 4.655 4.271 5.011 0.011 23 0 "[ . 1 . 2 . 3]" 3
215 1 22 LEU H 1 22 LEU HG 5.000 . 5.000 4.408 4.364 4.697 . 0 0 "[ . 1 . 2 . 3]" 3
216 1 22 LEU H 1 22 LEU QD 5.000 . 5.000 3.771 3.587 3.807 . 0 0 "[ . 1 . 2 . 3]" 3
217 1 22 LEU HA 1 23 TYR H 5.000 . 5.000 3.597 3.587 3.606 . 0 0 "[ . 1 . 2 . 3]" 3
218 1 22 LEU HG 1 23 TYR H 5.000 . 5.000 3.989 3.813 4.946 . 0 0 "[ . 1 . 2 . 3]" 3
219 1 22 LEU H 1 23 TYR H 2.800 . 2.800 2.240 2.218 2.262 . 0 0 "[ . 1 . 2 . 3]" 3
220 1 22 LEU H 1 23 TYR QD 5.000 . 5.000 4.520 4.414 4.561 . 0 0 "[ . 1 . 2 . 3]" 3
221 1 22 LEU H 1 23 TYR QE 6.000 . 6.000 6.297 6.237 6.336 0.336 13 0 "[ . 1 . 2 . 3]" 3
222 1 22 LEU QB 1 23 TYR H 5.000 . 5.000 2.458 2.381 2.572 . 0 0 "[ . 1 . 2 . 3]" 3
223 1 22 LEU QD 1 23 TYR H 5.000 . 5.000 3.496 3.303 3.653 . 0 0 "[ . 1 . 2 . 3]" 3
224 1 22 LEU HA 1 25 ALA H 5.000 . 5.000 4.181 4.067 4.372 . 0 0 "[ . 1 . 2 . 3]" 3
225 1 22 LEU HA 1 25 ALA MB 5.000 . 5.000 4.189 4.067 4.376 . 0 0 "[ . 1 . 2 . 3]" 3
226 1 22 LEU HA 1 26 ALA H 5.000 . 5.000 5.166 5.128 5.229 0.229 21 0 "[ . 1 . 2 . 3]" 3
227 1 22 LEU QD 1 26 ALA H 5.000 . 5.000 4.962 4.063 5.077 0.077 19 0 "[ . 1 . 2 . 3]" 3
228 1 22 LEU QD 1 26 ALA MB 5.000 . 5.000 3.946 3.345 4.116 . 0 0 "[ . 1 . 2 . 3]" 3
229 1 22 LEU QD 1 35 VAL QG 5.000 . 5.000 1.893 1.786 2.031 . 0 0 "[ . 1 . 2 . 3]" 3
230 1 22 LEU QD 1 39 LEU QD 5.000 . 5.000 2.914 2.453 3.795 . 0 0 "[ . 1 . 2 . 3]" 3
231 1 22 LEU QD 1 82 THR HA 6.000 . 6.000 3.433 3.065 4.121 . 0 0 "[ . 1 . 2 . 3]" 3
232 1 22 LEU QD 1 85 LEU QD 5.000 . 5.000 1.912 1.684 2.705 . 0 0 "[ . 1 . 2 . 3]" 3
233 1 22 LEU QD 1 105 PHE HZ 5.000 . 5.000 4.939 4.671 5.033 0.033 1 0 "[ . 1 . 2 . 3]" 3
234 1 22 LEU QD 1 105 PHE QD 5.000 . 5.000 4.605 4.248 5.047 0.047 21 0 "[ . 1 . 2 . 3]" 3
235 1 22 LEU QD 1 105 PHE QE 5.000 . 5.000 3.496 3.208 3.721 . 0 0 "[ . 1 . 2 . 3]" 3
236 1 23 TYR H 1 23 TYR QD 5.000 . 5.000 3.214 3.139 3.300 . 0 0 "[ . 1 . 2 . 3]" 3
237 1 23 TYR H 1 23 TYR QE 6.000 . 6.000 5.223 5.147 5.323 . 0 0 "[ . 1 . 2 . 3]" 3
238 1 23 TYR HA 1 24 SER H 5.000 . 5.000 3.518 3.504 3.533 . 0 0 "[ . 1 . 2 . 3]" 3
239 1 23 TYR H 1 24 SER H 2.800 . 2.800 2.588 2.507 2.647 . 0 0 "[ . 1 . 2 . 3]" 3
240 1 23 TYR QB 1 24 SER H 5.000 . 5.000 3.660 3.604 3.692 . 0 0 "[ . 1 . 2 . 3]" 3
241 1 23 TYR QD 1 24 SER HA 5.000 . 5.000 4.095 3.992 4.163 . 0 0 "[ . 1 . 2 . 3]" 3
242 1 23 TYR QD 1 24 SER H 5.000 . 5.000 3.826 3.753 3.854 . 0 0 "[ . 1 . 2 . 3]" 3
243 1 23 TYR QD 1 24 SER QB 5.000 . 5.000 4.827 4.748 4.972 . 0 0 "[ . 1 . 2 . 3]" 3
244 1 23 TYR QE 1 24 SER HA 5.000 . 5.000 4.144 4.075 4.189 . 0 0 "[ . 1 . 2 . 3]" 3
245 1 23 TYR QE 1 24 SER H 5.000 . 5.000 4.933 4.880 4.967 . 0 0 "[ . 1 . 2 . 3]" 3
246 1 23 TYR QE 1 24 SER QB 5.000 . 5.000 5.049 4.959 5.083 0.083 4 0 "[ . 1 . 2 . 3]" 3
247 1 23 TYR HA 1 26 ALA H 5.000 . 5.000 2.554 2.513 2.589 . 0 0 "[ . 1 . 2 . 3]" 3
248 1 23 TYR HA 1 26 ALA MB 5.000 . 5.000 1.881 1.829 1.962 . 0 0 "[ . 1 . 2 . 3]" 3
249 1 23 TYR QD 1 26 ALA H 6.000 . 6.000 4.155 4.030 4.230 . 0 0 "[ . 1 . 2 . 3]" 3
250 1 23 TYR QD 1 27 SER H 5.000 . 5.000 2.617 2.496 2.726 . 0 0 "[ . 1 . 2 . 3]" 3
251 1 23 TYR QD 1 27 SER QB 5.000 . 5.000 2.787 2.490 3.319 . 0 0 "[ . 1 . 2 . 3]" 3
252 1 23 TYR QE 1 27 SER QB 5.000 . 5.000 2.017 1.915 2.104 . 0 0 "[ . 1 . 2 . 3]" 3
253 1 23 TYR HA 1 32 LEU QD 5.000 . 5.000 4.144 3.863 4.475 . 0 0 "[ . 1 . 2 . 3]" 3
254 1 23 TYR H 1 32 LEU QD 5.000 . 5.000 5.129 5.104 5.162 0.162 12 0 "[ . 1 . 2 . 3]" 3
255 1 23 TYR QB 1 32 LEU QD 6.000 . 6.000 2.787 2.751 2.843 . 0 0 "[ . 1 . 2 . 3]" 3
256 1 23 TYR QD 1 32 LEU HA 5.000 . 5.000 3.578 3.390 3.665 . 0 0 "[ . 1 . 2 . 3]" 3
257 1 23 TYR QD 1 32 LEU H 5.000 . 5.000 4.450 4.194 4.633 . 0 0 "[ . 1 . 2 . 3]" 3
258 1 23 TYR QD 1 32 LEU QD 5.000 . 5.000 2.007 1.745 2.368 . 0 0 "[ . 1 . 2 . 3]" 3
259 1 23 TYR QE 1 32 LEU HA 5.000 . 5.000 4.919 4.736 5.127 0.127 23 0 "[ . 1 . 2 . 3]" 3
260 1 23 TYR QE 1 32 LEU H 5.000 . 5.000 5.323 5.199 5.417 0.417 28 0 "[ . 1 . 2 . 3]" 3
261 1 23 TYR QE 1 32 LEU QD 5.000 . 5.000 1.803 1.782 1.822 . 0 0 "[ . 1 . 2 . 3]" 3
262 1 23 TYR QD 1 35 VAL QG 6.000 . 6.000 3.931 3.750 4.147 . 0 0 "[ . 1 . 2 . 3]" 3
263 1 23 TYR QE 1 35 VAL QG 6.000 . 6.000 5.506 5.334 5.711 . 0 0 "[ . 1 . 2 . 3]" 3
264 1 23 TYR HA 1 105 PHE HZ 5.000 . 5.000 4.034 3.993 4.081 . 0 0 "[ . 1 . 2 . 3]" 3
265 1 23 TYR HA 1 105 PHE QD 6.000 . 6.000 5.930 5.825 6.059 0.059 20 0 "[ . 1 . 2 . 3]" 3
266 1 23 TYR HA 1 105 PHE QE 5.000 . 5.000 3.899 3.766 4.089 . 0 0 "[ . 1 . 2 . 3]" 3
267 1 23 TYR H 1 105 PHE HZ 6.000 . 6.000 5.039 4.897 5.113 . 0 0 "[ . 1 . 2 . 3]" 3
268 1 23 TYR H 1 105 PHE QD 5.000 . 5.000 4.737 4.586 4.893 . 0 0 "[ . 1 . 2 . 3]" 3
269 1 23 TYR H 1 105 PHE QE 5.000 . 5.000 3.585 3.360 3.784 . 0 0 "[ . 1 . 2 . 3]" 3
270 1 23 TYR QB 1 105 PHE HZ 5.000 . 5.000 1.926 1.886 1.955 . 0 0 "[ . 1 . 2 . 3]" 3
271 1 23 TYR QB 1 105 PHE QD 5.000 . 5.000 3.399 3.327 3.511 . 0 0 "[ . 1 . 2 . 3]" 3
272 1 23 TYR QB 1 105 PHE QE 5.000 . 5.000 1.955 1.855 2.173 . 0 0 "[ . 1 . 2 . 3]" 3
273 1 23 TYR QD 1 105 PHE HZ 5.000 . 5.000 3.482 3.360 3.574 . 0 0 "[ . 1 . 2 . 3]" 3
274 1 23 TYR QD 1 105 PHE QD 5.000 . 5.000 3.804 3.641 4.001 . 0 0 "[ . 1 . 2 . 3]" 3
275 1 23 TYR QD 1 105 PHE QE 5.000 . 5.000 3.487 3.358 3.578 . 0 0 "[ . 1 . 2 . 3]" 3
276 1 23 TYR QE 1 105 PHE HZ 5.000 . 5.000 5.028 4.868 5.153 0.153 20 0 "[ . 1 . 2 . 3]" 3
277 1 23 TYR QE 1 105 PHE QD 5.000 . 5.000 4.950 4.619 5.091 0.091 4 0 "[ . 1 . 2 . 3]" 3
278 1 23 TYR QE 1 105 PHE QE 5.000 . 5.000 4.665 4.429 4.817 . 0 0 "[ . 1 . 2 . 3]" 3
279 1 23 TYR QD 1 108 MET H 6.000 . 6.000 6.085 6.021 6.124 0.124 13 0 "[ . 1 . 2 . 3]" 3
280 1 23 TYR QD 1 108 MET QB 5.000 . 5.000 3.688 3.546 4.036 . 0 0 "[ . 1 . 2 . 3]" 3
281 1 23 TYR QE 1 108 MET H 6.000 . 6.000 4.812 4.388 4.977 . 0 0 "[ . 1 . 2 . 3]" 3
282 1 23 TYR QE 1 108 MET QB 5.000 . 5.000 2.022 1.929 2.227 . 0 0 "[ . 1 . 2 . 3]" 3
283 1 23 TYR QD 1 109 MET HA 5.000 . 5.000 4.887 4.777 5.009 0.009 11 0 "[ . 1 . 2 . 3]" 3
284 1 23 TYR QD 1 109 MET H 6.000 . 6.000 5.357 5.221 5.446 . 0 0 "[ . 1 . 2 . 3]" 3
285 1 23 TYR QE 1 109 MET HA 5.000 . 5.000 3.432 3.227 3.550 . 0 0 "[ . 1 . 2 . 3]" 3
286 1 23 TYR QE 1 109 MET H 6.000 . 6.000 4.059 3.722 4.196 . 0 0 "[ . 1 . 2 . 3]" 3
287 1 23 TYR QD 1 112 HIS QB 5.000 . 5.000 4.709 4.633 4.762 . 0 0 "[ . 1 . 2 . 3]" 3
288 1 23 TYR QE 1 112 HIS HA 5.000 . 5.000 5.066 5.039 5.119 0.119 29 0 "[ . 1 . 2 . 3]" 3
289 1 23 TYR QE 1 112 HIS H 5.000 . 5.000 4.980 4.790 5.036 0.036 29 0 "[ . 1 . 2 . 3]" 3
290 1 23 TYR QE 1 112 HIS QB 5.000 . 5.000 2.720 2.644 2.791 . 0 0 "[ . 1 . 2 . 3]" 3
291 1 23 TYR QE 1 112 HIS HD2 6.000 . 6.000 3.256 3.092 3.442 . 0 0 "[ . 1 . 2 . 3]" 3
292 1 23 TYR QE 1 112 HIS HE1 6.000 . 6.000 5.692 5.394 5.940 . 0 0 "[ . 1 . 2 . 3]" 3
293 1 24 SER HA 1 25 ALA H 5.000 . 5.000 3.584 3.575 3.588 . 0 0 "[ . 1 . 2 . 3]" 3
294 1 24 SER H 1 25 ALA H 2.800 . 2.800 2.825 2.800 2.848 0.048 20 0 "[ . 1 . 2 . 3]" 3
295 1 24 SER QB 1 25 ALA H 5.000 . 5.000 2.942 2.687 3.410 . 0 0 "[ . 1 . 2 . 3]" 3
296 1 24 SER HA 1 27 SER H 3.500 . 3.500 3.544 3.503 3.570 0.070 10 0 "[ . 1 . 2 . 3]" 3
297 1 24 SER HA 1 27 SER QB 3.500 . 3.500 2.989 2.797 3.597 0.097 2 0 "[ . 1 . 2 . 3]" 3
298 1 24 SER HA 1 32 LEU QD 6.000 . 6.000 4.723 4.548 4.939 . 0 0 "[ . 1 . 2 . 3]" 3
299 1 25 ALA HA 1 26 ALA H 5.000 . 5.000 3.603 3.597 3.609 . 0 0 "[ . 1 . 2 . 3]" 3
300 1 25 ALA H 1 26 ALA H 2.800 . 2.800 2.439 2.404 2.468 . 0 0 "[ . 1 . 2 . 3]" 3
301 1 25 ALA MB 1 26 ALA H 5.000 . 5.000 2.553 2.466 2.655 . 0 0 "[ . 1 . 2 . 3]" 3
302 1 25 ALA HA 1 28 LYS H 3.500 . 3.500 3.482 3.367 3.512 0.012 29 0 "[ . 1 . 2 . 3]" 3
303 1 25 ALA HA 1 28 LYS QB 3.500 . 3.500 3.131 2.614 3.301 . 0 0 "[ . 1 . 2 . 3]" 3
304 1 25 ALA HA 1 28 LYS QD 5.000 . 5.000 3.945 2.140 5.000 . 0 0 "[ . 1 . 2 . 3]" 3
305 1 25 ALA HA 1 29 GLN H 5.000 . 5.000 4.675 4.443 4.960 . 0 0 "[ . 1 . 2 . 3]" 3
306 1 25 ALA HA 1 29 GLN QE 6.000 . 6.000 5.274 3.696 6.002 0.002 27 0 "[ . 1 . 2 . 3]" 3
307 1 25 ALA MB 1 29 GLN QE 6.000 . 6.000 3.668 2.448 4.570 . 0 0 "[ . 1 . 2 . 3]" 3
308 1 25 ALA HA 1 81 LEU QD 5.000 . 5.000 5.044 5.010 5.078 0.078 22 0 "[ . 1 . 2 . 3]" 3
309 1 25 ALA MB 1 81 LEU QD 5.000 . 5.000 3.040 2.872 3.166 . 0 0 "[ . 1 . 2 . 3]" 3
310 1 26 ALA HA 1 27 SER H 5.000 . 5.000 3.599 3.593 3.602 . 0 0 "[ . 1 . 2 . 3]" 3
311 1 26 ALA H 1 27 SER H 2.800 . 2.800 2.807 2.753 2.865 0.065 27 0 "[ . 1 . 2 . 3]" 3
312 1 26 ALA MB 1 27 SER H 5.000 . 5.000 2.547 2.419 2.653 . 0 0 "[ . 1 . 2 . 3]" 3
313 1 26 ALA H 1 28 LYS H 5.000 . 5.000 4.406 4.320 4.462 . 0 0 "[ . 1 . 2 . 3]" 3
314 1 26 ALA HA 1 29 GLN H 3.500 . 3.500 3.233 3.118 3.559 0.059 27 0 "[ . 1 . 2 . 3]" 3
315 1 26 ALA HA 1 29 GLN QB 3.500 . 3.500 2.633 2.340 3.447 . 0 0 "[ . 1 . 2 . 3]" 3
316 1 26 ALA HA 1 30 ASN H 6.000 . 6.000 4.320 3.630 4.819 . 0 0 "[ . 1 . 2 . 3]" 3
317 1 26 ALA MB 1 30 ASN H 6.000 . 6.000 4.622 4.363 4.938 . 0 0 "[ . 1 . 2 . 3]" 3
318 1 26 ALA HA 1 31 LYS H 5.000 . 5.000 3.302 3.010 3.487 . 0 0 "[ . 1 . 2 . 3]" 3
319 1 26 ALA HA 1 31 LYS QB 5.000 . 5.000 2.385 1.973 2.885 . 0 0 "[ . 1 . 2 . 3]" 3
320 1 26 ALA MB 1 31 LYS H 5.000 . 5.000 2.929 2.792 3.065 . 0 0 "[ . 1 . 2 . 3]" 3
321 1 26 ALA MB 1 31 LYS QB 5.000 . 5.000 1.942 1.824 2.365 . 0 0 "[ . 1 . 2 . 3]" 3
322 1 26 ALA H 1 32 LEU QD 5.000 . 5.000 4.822 4.423 5.265 0.265 20 0 "[ . 1 . 2 . 3]" 3
323 1 26 ALA MB 1 32 LEU H 5.000 . 5.000 3.459 3.177 3.682 . 0 0 "[ . 1 . 2 . 3]" 3
324 1 26 ALA MB 1 32 LEU QD 5.000 . 5.000 2.849 2.318 3.447 . 0 0 "[ . 1 . 2 . 3]" 3
325 1 26 ALA HA 1 35 VAL QG 6.000 . 6.000 3.920 3.676 4.272 . 0 0 "[ . 1 . 2 . 3]" 3
326 1 26 ALA H 1 35 VAL QG 5.000 . 5.000 4.134 3.960 4.409 . 0 0 "[ . 1 . 2 . 3]" 3
327 1 26 ALA MB 1 35 VAL HB 5.000 . 5.000 3.656 3.383 4.009 . 0 0 "[ . 1 . 2 . 3]" 3
328 1 26 ALA MB 1 35 VAL QG 5.000 . 5.000 1.979 1.816 2.379 . 0 0 "[ . 1 . 2 . 3]" 3
329 1 26 ALA HA 1 81 LEU QD 5.000 . 5.000 2.402 2.063 2.995 . 0 0 "[ . 1 . 2 . 3]" 3
330 1 26 ALA H 1 81 LEU QD 5.000 . 5.000 2.737 2.635 2.910 . 0 0 "[ . 1 . 2 . 3]" 3
331 1 26 ALA MB 1 81 LEU QD 5.000 . 5.000 1.737 1.600 2.337 . 0 0 "[ . 1 . 2 . 3]" 3
332 1 26 ALA MB 1 105 PHE HZ 3.500 . 3.500 3.541 3.511 3.581 0.081 29 0 "[ . 1 . 2 . 3]" 3
333 1 26 ALA MB 1 105 PHE QE 5.000 . 5.000 4.171 4.112 4.279 . 0 0 "[ . 1 . 2 . 3]" 3
334 1 27 SER HA 1 28 LYS H 5.000 . 5.000 3.599 3.595 3.602 . 0 0 "[ . 1 . 2 . 3]" 3
335 1 27 SER H 1 28 LYS H 2.800 . 2.800 2.822 2.757 2.838 0.038 2 0 "[ . 1 . 2 . 3]" 3
336 1 27 SER QB 1 28 LYS H 5.000 . 5.000 2.934 2.452 3.380 . 0 0 "[ . 1 . 2 . 3]" 3
337 1 27 SER HA 1 30 ASN H 5.000 . 5.000 3.413 3.205 5.026 0.026 27 0 "[ . 1 . 2 . 3]" 3
338 1 27 SER HA 1 32 LEU HG 3.500 . 3.500 3.632 3.541 3.707 0.207 22 0 "[ . 1 . 2 . 3]" 3
339 1 27 SER HA 1 32 LEU QD 5.000 . 5.000 1.867 1.790 1.964 . 0 0 "[ . 1 . 2 . 3]" 3
340 1 27 SER H 1 32 LEU QD 5.000 . 5.000 3.164 2.806 3.625 . 0 0 "[ . 1 . 2 . 3]" 3
341 1 27 SER QB 1 32 LEU HG 5.000 . 5.000 4.148 3.650 4.580 . 0 0 "[ . 1 . 2 . 3]" 3
342 1 27 SER QB 1 32 LEU QD 5.000 . 5.000 2.512 2.168 2.887 . 0 0 "[ . 1 . 2 . 3]" 3
343 1 28 LYS H 1 28 LYS QD 5.000 . 5.000 3.957 2.124 4.533 . 0 0 "[ . 1 . 2 . 3]" 3
344 1 28 LYS H 1 28 LYS QG 5.000 . 5.000 3.427 2.135 4.046 . 0 0 "[ . 1 . 2 . 3]" 3
345 1 28 LYS HA 1 29 GLN H 5.000 . 5.000 3.595 3.593 3.597 . 0 0 "[ . 1 . 2 . 3]" 3
346 1 28 LYS H 1 29 GLN H 3.500 . 3.500 2.673 2.570 2.893 . 0 0 "[ . 1 . 2 . 3]" 3
347 1 28 LYS QB 1 29 GLN H 5.000 . 5.000 2.621 2.536 2.911 . 0 0 "[ . 1 . 2 . 3]" 3
348 1 28 LYS QG 1 29 GLN H 5.000 . 5.000 4.162 3.855 4.548 . 0 0 "[ . 1 . 2 . 3]" 3
349 1 29 GLN H 1 29 GLN QG 5.000 . 5.000 2.696 2.266 4.061 . 0 0 "[ . 1 . 2 . 3]" 3
350 1 29 GLN HA 1 30 ASN H 5.000 . 5.000 3.409 3.285 3.554 . 0 0 "[ . 1 . 2 . 3]" 3
351 1 29 GLN H 1 30 ASN HA 5.000 . 5.000 4.891 4.593 4.967 . 0 0 "[ . 1 . 2 . 3]" 3
352 1 29 GLN H 1 30 ASN H 2.800 . 2.800 2.617 2.538 2.941 0.141 27 0 "[ . 1 . 2 . 3]" 3
353 1 29 GLN QB 1 30 ASN H 5.000 . 5.000 3.339 2.051 3.589 . 0 0 "[ . 1 . 2 . 3]" 3
354 1 29 GLN QG 1 30 ASN H 5.000 . 5.000 4.456 4.066 4.665 . 0 0 "[ . 1 . 2 . 3]" 3
355 1 29 GLN HA 1 31 LYS H 5.000 . 5.000 5.052 5.021 5.452 0.452 27 0 "[ . 1 . 2 . 3]" 3
356 1 29 GLN H 1 31 LYS H 5.000 . 5.000 3.915 3.621 4.069 . 0 0 "[ . 1 . 2 . 3]" 3
357 1 29 GLN QE 1 81 LEU QD 5.000 . 5.000 3.697 2.550 5.007 0.007 27 0 "[ . 1 . 2 . 3]" 3
358 1 30 ASN HA 1 31 LYS H 5.000 . 5.000 2.864 2.838 2.881 . 0 0 "[ . 1 . 2 . 3]" 3
359 1 30 ASN H 1 31 LYS H 2.800 . 2.800 2.632 2.173 2.761 . 0 0 "[ . 1 . 2 . 3]" 3
360 1 30 ASN QB 1 31 LYS H 5.000 . 5.000 3.905 3.891 3.916 . 0 0 "[ . 1 . 2 . 3]" 3
361 1 30 ASN HA 1 32 LEU H 6.000 . 6.000 3.340 3.304 3.473 . 0 0 "[ . 1 . 2 . 3]" 3
362 1 30 ASN H 1 32 LEU H 5.000 . 5.000 4.482 4.426 4.552 . 0 0 "[ . 1 . 2 . 3]" 3
363 1 30 ASN H 1 32 LEU QD 5.000 . 5.000 4.084 3.742 4.494 . 0 0 "[ . 1 . 2 . 3]" 3
364 1 30 ASN H 1 35 VAL QG 6.000 . 6.000 6.208 6.103 6.263 0.263 7 0 "[ . 1 . 2 . 3]" 3
365 1 31 LYS H 1 31 LYS QD 5.000 . 5.000 3.632 2.589 4.491 . 0 0 "[ . 1 . 2 . 3]" 3
366 1 31 LYS H 1 31 LYS QG 5.000 . 5.000 3.183 2.547 3.940 . 0 0 "[ . 1 . 2 . 3]" 3
367 1 31 LYS HA 1 32 LEU H 5.000 . 5.000 3.278 3.193 3.438 . 0 0 "[ . 1 . 2 . 3]" 3
368 1 31 LYS HA 1 32 LEU QD 6.000 . 6.000 4.797 4.384 5.383 . 0 0 "[ . 1 . 2 . 3]" 3
369 1 31 LYS H 1 32 LEU H 3.500 . 3.500 2.544 2.411 2.604 . 0 0 "[ . 1 . 2 . 3]" 3
370 1 31 LYS QB 1 32 LEU H 5.000 . 5.000 3.603 3.394 3.699 . 0 0 "[ . 1 . 2 . 3]" 3
371 1 31 LYS QG 1 32 LEU H 5.000 . 5.000 4.670 4.435 4.968 . 0 0 "[ . 1 . 2 . 3]" 3
372 1 31 LYS HA 1 33 GLU H 5.000 . 5.000 3.543 3.454 3.730 . 0 0 "[ . 1 . 2 . 3]" 3
373 1 31 LYS HA 1 34 GLN H 3.500 . 3.500 2.912 2.701 3.132 . 0 0 "[ . 1 . 2 . 3]" 3
374 1 31 LYS HA 1 34 GLN QB 3.500 . 3.500 2.799 2.278 3.355 . 0 0 "[ . 1 . 2 . 3]" 3
375 1 31 LYS HA 1 34 GLN QG 5.000 . 5.000 2.973 1.990 4.648 . 0 0 "[ . 1 . 2 . 3]" 3
376 1 31 LYS HA 1 35 VAL H 5.000 . 5.000 4.512 4.182 5.000 . 0 0 "[ . 1 . 2 . 3]" 3
377 1 31 LYS HA 1 35 VAL QG 5.000 . 5.000 4.020 3.741 4.386 . 0 0 "[ . 1 . 2 . 3]" 3
378 1 31 LYS QB 1 35 VAL QG 5.000 . 5.000 2.341 1.955 2.844 . 0 0 "[ . 1 . 2 . 3]" 3
379 1 31 LYS HA 1 81 LEU QD 5.000 . 5.000 4.018 3.824 4.988 . 0 0 "[ . 1 . 2 . 3]" 3
380 1 32 LEU H 1 32 LEU HG 5.000 . 5.000 3.299 2.809 3.714 . 0 0 "[ . 1 . 2 . 3]" 3
381 1 32 LEU H 1 32 LEU QD 5.000 . 5.000 2.318 1.962 2.819 . 0 0 "[ . 1 . 2 . 3]" 3
382 1 32 LEU HA 1 33 GLU H 5.000 . 5.000 3.586 3.581 3.593 . 0 0 "[ . 1 . 2 . 3]" 3
383 1 32 LEU H 1 33 GLU H 2.800 . 2.800 2.898 2.874 2.944 0.144 23 0 "[ . 1 . 2 . 3]" 3
384 1 32 LEU QB 1 33 GLU H 5.000 . 5.000 2.737 2.612 2.835 . 0 0 "[ . 1 . 2 . 3]" 3
385 1 32 LEU QD 1 33 GLU H 5.000 . 5.000 4.002 3.850 4.174 . 0 0 "[ . 1 . 2 . 3]" 3
386 1 32 LEU H 1 34 GLN H 5.000 . 5.000 4.304 4.132 4.429 . 0 0 "[ . 1 . 2 . 3]" 3
387 1 32 LEU HA 1 35 VAL HB 3.500 . 3.500 3.210 2.894 3.493 . 0 0 "[ . 1 . 2 . 3]" 3
388 1 32 LEU HA 1 35 VAL H 3.500 . 3.500 3.447 3.272 3.618 0.118 27 0 "[ . 1 . 2 . 3]" 3
389 1 32 LEU QD 1 36 GLU HA 5.000 . 5.000 5.021 4.892 5.088 0.088 13 0 "[ . 1 . 2 . 3]" 3
390 1 32 LEU QD 1 36 GLU QG 5.000 . 5.000 4.076 3.700 4.614 . 0 0 "[ . 1 . 2 . 3]" 3
391 1 32 LEU HA 1 105 PHE HZ 5.000 . 5.000 2.377 2.120 2.656 . 0 0 "[ . 1 . 2 . 3]" 3
392 1 32 LEU HA 1 105 PHE QD 5.000 . 5.000 5.101 5.050 5.158 0.158 25 0 "[ . 1 . 2 . 3]" 3
393 1 32 LEU HA 1 105 PHE QE 5.000 . 5.000 2.846 2.772 2.952 . 0 0 "[ . 1 . 2 . 3]" 3
394 1 32 LEU QD 1 105 PHE HZ 5.000 . 5.000 2.518 2.349 2.660 . 0 0 "[ . 1 . 2 . 3]" 3
395 1 32 LEU QD 1 105 PHE QD 5.000 . 5.000 3.210 2.919 3.407 . 0 0 "[ . 1 . 2 . 3]" 3
396 1 32 LEU QD 1 105 PHE QE 5.000 . 5.000 1.836 1.792 1.920 . 0 0 "[ . 1 . 2 . 3]" 3
397 1 32 LEU H 1 112 HIS HD2 6.000 . 6.000 5.311 4.926 5.639 . 0 0 "[ . 1 . 2 . 3]" 3
398 1 32 LEU QB 1 112 HIS HD2 6.000 . 6.000 4.645 4.349 5.039 . 0 0 "[ . 1 . 2 . 3]" 3
399 1 32 LEU QD 1 112 HIS HD2 5.000 . 5.000 2.607 2.376 2.838 . 0 0 "[ . 1 . 2 . 3]" 3
400 1 32 LEU QD 1 112 HIS HE1 5.000 . 5.000 3.542 2.980 3.914 . 0 0 "[ . 1 . 2 . 3]" 3
401 1 33 GLU H 1 33 GLU QG 5.000 . 5.000 3.262 2.172 4.055 . 0 0 "[ . 1 . 2 . 3]" 3
402 1 33 GLU HA 1 34 GLN H 5.000 . 5.000 3.595 3.591 3.598 . 0 0 "[ . 1 . 2 . 3]" 3
403 1 33 GLU H 1 34 GLN H 2.800 . 2.800 2.536 2.454 2.645 . 0 0 "[ . 1 . 2 . 3]" 3
404 1 33 GLU QB 1 34 GLN H 5.000 . 5.000 2.511 2.447 2.576 . 0 0 "[ . 1 . 2 . 3]" 3
405 1 33 GLU QG 1 34 GLN H 5.000 . 5.000 4.065 3.597 4.415 . 0 0 "[ . 1 . 2 . 3]" 3
406 1 33 GLU HA 1 36 GLU H 3.500 . 3.500 3.527 3.504 3.555 0.055 23 0 "[ . 1 . 2 . 3]" 3
407 1 33 GLU HA 1 36 GLU QB 3.500 . 3.500 2.816 2.552 3.047 . 0 0 "[ . 1 . 2 . 3]" 3
408 1 34 GLN H 1 34 GLN QG 5.000 . 5.000 2.588 2.146 4.050 . 0 0 "[ . 1 . 2 . 3]" 3
409 1 34 GLN HA 1 35 VAL H 5.000 . 5.000 3.559 3.532 3.574 . 0 0 "[ . 1 . 2 . 3]" 3
410 1 34 GLN H 1 35 VAL H 2.800 . 2.800 2.743 2.668 2.803 0.003 27 0 "[ . 1 . 2 . 3]" 3
411 1 34 GLN H 1 35 VAL QG 6.000 . 6.000 3.778 3.598 3.979 . 0 0 "[ . 1 . 2 . 3]" 3
412 1 34 GLN QB 1 35 VAL H 5.000 . 5.000 2.871 2.793 3.031 . 0 0 "[ . 1 . 2 . 3]" 3
413 1 34 GLN QG 1 35 VAL H 5.000 . 5.000 4.256 4.118 4.531 . 0 0 "[ . 1 . 2 . 3]" 3
414 1 34 GLN HA 1 37 LYS H 5.000 . 5.000 4.385 4.175 4.707 . 0 0 "[ . 1 . 2 . 3]" 3
415 1 34 GLN HA 1 37 LYS QB 5.000 . 5.000 3.871 3.434 4.361 . 0 0 "[ . 1 . 2 . 3]" 3
416 1 34 GLN QE 1 79 SER H 5.000 . 5.000 5.040 5.004 5.100 0.100 30 0 "[ . 1 . 2 . 3]" 3
417 1 34 GLN QE 1 80 PRO HA 6.000 . 6.000 5.799 5.397 6.012 0.012 21 0 "[ . 1 . 2 . 3]" 3
418 1 34 GLN HA 1 81 LEU QB 5.000 . 5.000 5.213 5.168 5.255 0.255 21 0 "[ . 1 . 2 . 3]" 3
419 1 35 VAL HA 1 36 GLU H 5.000 . 5.000 3.603 3.585 3.617 . 0 0 "[ . 1 . 2 . 3]" 3
420 1 35 VAL HB 1 36 GLU H 5.000 . 5.000 2.653 2.431 2.822 . 0 0 "[ . 1 . 2 . 3]" 3
421 1 35 VAL H 1 36 GLU H 2.800 . 2.800 2.299 2.275 2.333 . 0 0 "[ . 1 . 2 . 3]" 3
422 1 35 VAL QG 1 36 GLU H 5.000 . 5.000 3.273 3.157 3.372 . 0 0 "[ . 1 . 2 . 3]" 3
423 1 35 VAL HA 1 38 GLU H 3.500 . 3.500 3.628 3.560 3.682 0.182 5 0 "[ . 1 . 2 . 3]" 3
424 1 35 VAL HA 1 38 GLU QB 3.500 . 3.500 2.976 2.756 3.173 . 0 0 "[ . 1 . 2 . 3]" 3
425 1 35 VAL HA 1 39 LEU H 5.000 . 5.000 3.654 3.143 4.102 . 0 0 "[ . 1 . 2 . 3]" 3
426 1 35 VAL QG 1 39 LEU HG 5.000 . 5.000 3.688 2.591 5.017 0.017 28 0 "[ . 1 . 2 . 3]" 3
427 1 35 VAL QG 1 39 LEU QD 5.000 . 5.000 2.169 1.753 2.882 . 0 0 "[ . 1 . 2 . 3]" 3
428 1 35 VAL HA 1 78 PHE QD 6.000 . 6.000 5.918 5.693 6.085 0.085 16 0 "[ . 1 . 2 . 3]" 3
429 1 35 VAL QG 1 80 PRO HA 6.000 . 6.000 6.119 6.072 6.170 0.170 17 0 "[ . 1 . 2 . 3]" 3
430 1 35 VAL HA 1 81 LEU H 5.000 . 5.000 4.725 4.545 4.923 . 0 0 "[ . 1 . 2 . 3]" 3
431 1 35 VAL QG 1 81 LEU QB 5.000 . 5.000 1.601 1.580 1.667 . 0 0 "[ . 1 . 2 . 3]" 3
432 1 35 VAL QG 1 81 LEU QD 5.000 . 5.000 1.816 1.591 2.488 . 0 0 "[ . 1 . 2 . 3]" 3
433 1 35 VAL QG 1 82 THR MG 5.000 . 5.000 3.581 3.228 3.950 . 0 0 "[ . 1 . 2 . 3]" 3
434 1 35 VAL QG 1 105 PHE HZ 5.000 . 5.000 2.780 2.646 2.912 . 0 0 "[ . 1 . 2 . 3]" 3
435 1 35 VAL QG 1 105 PHE QD 5.000 . 5.000 3.757 3.356 4.120 . 0 0 "[ . 1 . 2 . 3]" 3
436 1 35 VAL QG 1 105 PHE QE 5.000 . 5.000 2.268 1.867 2.705 . 0 0 "[ . 1 . 2 . 3]" 3
437 1 36 GLU H 1 36 GLU QG 5.000 . 5.000 3.921 3.816 4.035 . 0 0 "[ . 1 . 2 . 3]" 3
438 1 36 GLU HA 1 37 LYS H 5.000 . 5.000 3.573 3.544 3.593 . 0 0 "[ . 1 . 2 . 3]" 3
439 1 36 GLU H 1 37 LYS H 2.800 . 2.800 2.724 2.597 2.854 0.054 22 0 "[ . 1 . 2 . 3]" 3
440 1 36 GLU QB 1 37 LYS H 5.000 . 5.000 2.811 2.656 3.005 . 0 0 "[ . 1 . 2 . 3]" 3
441 1 36 GLU QG 1 37 LYS H 5.000 . 5.000 4.258 3.952 4.564 . 0 0 "[ . 1 . 2 . 3]" 3
442 1 36 GLU HA 1 39 LEU H 5.000 . 5.000 4.003 3.713 4.279 . 0 0 "[ . 1 . 2 . 3]" 3
443 1 36 GLU HA 1 39 LEU QB 5.000 . 5.000 2.916 2.578 3.294 . 0 0 "[ . 1 . 2 . 3]" 3
444 1 36 GLU HA 1 39 LEU QD 5.000 . 5.000 3.148 2.676 3.828 . 0 0 "[ . 1 . 2 . 3]" 3
445 1 36 GLU QB 1 39 LEU QD 6.000 . 6.000 4.568 4.257 5.187 . 0 0 "[ . 1 . 2 . 3]" 3
446 1 36 GLU HA 1 40 LEU H 5.000 . 5.000 4.540 3.889 4.867 . 0 0 "[ . 1 . 2 . 3]" 3
447 1 36 GLU HA 1 105 PHE QD 5.000 . 5.000 3.629 3.479 3.833 . 0 0 "[ . 1 . 2 . 3]" 3
448 1 36 GLU HA 1 105 PHE QE 5.000 . 5.000 3.736 3.668 3.786 . 0 0 "[ . 1 . 2 . 3]" 3
449 1 36 GLU H 1 105 PHE QD 5.000 . 5.000 4.771 4.452 5.011 0.011 30 0 "[ . 1 . 2 . 3]" 3
450 1 36 GLU H 1 105 PHE QE 5.000 . 5.000 3.420 3.031 3.578 . 0 0 "[ . 1 . 2 . 3]" 3
451 1 36 GLU QB 1 105 PHE HZ 5.000 . 5.000 3.522 3.319 3.797 . 0 0 "[ . 1 . 2 . 3]" 3
452 1 36 GLU QB 1 105 PHE QD 5.000 . 5.000 3.004 2.691 3.206 . 0 0 "[ . 1 . 2 . 3]" 3
453 1 36 GLU QB 1 105 PHE QE 5.000 . 5.000 2.128 2.054 2.242 . 0 0 "[ . 1 . 2 . 3]" 3
454 1 36 GLU QG 1 105 PHE QD 5.000 . 5.000 2.198 1.887 3.699 . 0 0 "[ . 1 . 2 . 3]" 3
455 1 36 GLU QG 1 105 PHE QE 5.000 . 5.000 3.230 2.915 4.051 . 0 0 "[ . 1 . 2 . 3]" 3
456 1 37 LYS H 1 37 LYS QD 5.000 . 5.000 4.183 2.891 4.666 . 0 0 "[ . 1 . 2 . 3]" 3
457 1 37 LYS H 1 37 LYS QG 5.000 . 5.000 3.639 2.529 4.087 . 0 0 "[ . 1 . 2 . 3]" 3
458 1 37 LYS HA 1 38 GLU H 5.000 . 5.000 3.603 3.591 3.636 . 0 0 "[ . 1 . 2 . 3]" 3
459 1 37 LYS H 1 38 GLU H 2.800 . 2.800 2.478 2.327 2.726 . 0 0 "[ . 1 . 2 . 3]" 3
460 1 37 LYS QB 1 38 GLU H 5.000 . 5.000 2.662 2.505 2.771 . 0 0 "[ . 1 . 2 . 3]" 3
461 1 37 LYS QD 1 38 GLU H 5.000 . 5.000 4.728 3.304 5.021 0.021 21 0 "[ . 1 . 2 . 3]" 3
462 1 37 LYS QG 1 38 GLU H 5.000 . 5.000 4.167 3.624 4.553 . 0 0 "[ . 1 . 2 . 3]" 3
463 1 37 LYS H 1 39 LEU H 5.000 . 5.000 3.950 3.785 4.146 . 0 0 "[ . 1 . 2 . 3]" 3
464 1 37 LYS HA 1 40 LEU H 3.500 . 3.500 3.598 3.543 3.639 0.139 30 0 "[ . 1 . 2 . 3]" 3
465 1 37 LYS HA 1 40 LEU QB 3.500 . 3.500 3.034 2.670 3.341 . 0 0 "[ . 1 . 2 . 3]" 3
466 1 37 LYS HA 1 40 LEU QD 5.000 . 5.000 3.391 2.076 4.451 . 0 0 "[ . 1 . 2 . 3]" 3
467 1 37 LYS H 1 82 THR MG 6.000 . 6.000 5.906 5.567 6.081 0.081 28 0 "[ . 1 . 2 . 3]" 3
468 1 38 GLU H 1 38 GLU QG 5.000 . 5.000 2.943 2.096 3.605 . 0 0 "[ . 1 . 2 . 3]" 3
469 1 38 GLU HA 1 39 LEU H 5.000 . 5.000 3.593 3.584 3.615 . 0 0 "[ . 1 . 2 . 3]" 3
470 1 38 GLU H 1 39 LEU H 2.800 . 2.800 2.588 2.480 2.716 . 0 0 "[ . 1 . 2 . 3]" 3
471 1 38 GLU QB 1 39 LEU H 5.000 . 5.000 2.665 2.425 2.776 . 0 0 "[ . 1 . 2 . 3]" 3
472 1 38 GLU QG 1 39 LEU H 5.000 . 5.000 4.357 3.976 4.618 . 0 0 "[ . 1 . 2 . 3]" 3
473 1 38 GLU HA 1 41 ARG H 3.500 . 3.500 3.413 3.285 3.515 0.015 22 0 "[ . 1 . 2 . 3]" 3
474 1 38 GLU HA 1 41 ARG QB 3.500 . 3.500 3.282 2.823 3.503 0.003 6 0 "[ . 1 . 2 . 3]" 3
475 1 38 GLU HA 1 41 ARG QD 5.000 . 5.000 3.978 1.988 5.004 0.004 4 0 "[ . 1 . 2 . 3]" 3
476 1 38 GLU HA 1 78 PHE HZ 5.000 . 5.000 4.999 4.142 5.062 0.062 19 0 "[ . 1 . 2 . 3]" 3
477 1 38 GLU HA 1 78 PHE QD 5.000 . 5.000 3.678 3.351 3.911 . 0 0 "[ . 1 . 2 . 3]" 3
478 1 38 GLU HA 1 78 PHE QE 5.000 . 5.000 2.756 2.015 2.906 . 0 0 "[ . 1 . 2 . 3]" 3
479 1 38 GLU H 1 78 PHE QD 5.000 . 5.000 5.130 5.083 5.251 0.251 22 0 "[ . 1 . 2 . 3]" 3
480 1 38 GLU H 1 78 PHE QE 6.000 . 6.000 4.977 4.554 5.131 . 0 0 "[ . 1 . 2 . 3]" 3
481 1 38 GLU QB 1 78 PHE QD 5.000 . 5.000 1.897 1.821 1.975 . 0 0 "[ . 1 . 2 . 3]" 3
482 1 38 GLU QB 1 78 PHE QE 5.000 . 5.000 2.199 1.970 2.676 . 0 0 "[ . 1 . 2 . 3]" 3
483 1 38 GLU QG 1 78 PHE QD 5.000 . 5.000 2.428 1.961 3.512 . 0 0 "[ . 1 . 2 . 3]" 3
484 1 38 GLU QG 1 78 PHE QE 5.000 . 5.000 3.497 2.660 4.368 . 0 0 "[ . 1 . 2 . 3]" 3
485 1 38 GLU HA 1 82 THR MG 5.000 . 5.000 3.764 3.357 3.904 . 0 0 "[ . 1 . 2 . 3]" 3
486 1 38 GLU H 1 82 THR MG 5.000 . 5.000 4.080 3.858 4.326 . 0 0 "[ . 1 . 2 . 3]" 3
487 1 38 GLU QB 1 82 THR MG 5.000 . 5.000 1.781 1.688 1.844 . 0 0 "[ . 1 . 2 . 3]" 3
488 1 38 GLU QG 1 82 THR MG 5.000 . 5.000 3.394 3.091 3.798 . 0 0 "[ . 1 . 2 . 3]" 3
489 1 39 LEU H 1 39 LEU HG 5.000 . 5.000 3.483 2.386 4.497 . 0 0 "[ . 1 . 2 . 3]" 3
490 1 39 LEU H 1 39 LEU QD 5.000 . 5.000 3.027 2.114 3.680 . 0 0 "[ . 1 . 2 . 3]" 3
491 1 39 LEU HA 1 40 LEU H 5.000 . 5.000 3.597 3.589 3.602 . 0 0 "[ . 1 . 2 . 3]" 3
492 1 39 LEU HG 1 40 LEU H 5.000 . 5.000 4.770 3.814 5.049 0.049 1 0 "[ . 1 . 2 . 3]" 3
493 1 39 LEU H 1 40 LEU H 2.800 . 2.800 2.799 2.728 2.831 0.031 20 0 "[ . 1 . 2 . 3]" 3
494 1 39 LEU QB 1 40 LEU H 5.000 . 5.000 2.739 2.591 2.806 . 0 0 "[ . 1 . 2 . 3]" 3
495 1 39 LEU QD 1 40 LEU H 5.000 . 5.000 4.090 3.926 4.202 . 0 0 "[ . 1 . 2 . 3]" 3
496 1 39 LEU QD 1 41 ARG H 6.000 . 6.000 5.195 5.057 5.356 . 0 0 "[ . 1 . 2 . 3]" 3
497 1 39 LEU HA 1 42 VAL HB 3.500 . 3.500 3.520 3.495 3.553 0.053 28 0 "[ . 1 . 2 . 3]" 3
498 1 39 LEU HA 1 42 VAL H 3.500 . 3.500 3.473 3.399 3.518 0.018 21 0 "[ . 1 . 2 . 3]" 3
499 1 39 LEU HA 1 42 VAL QG 5.000 . 5.000 2.724 2.452 3.076 . 0 0 "[ . 1 . 2 . 3]" 3
500 1 39 LEU H 1 42 VAL QG 6.000 . 6.000 4.891 4.684 5.209 . 0 0 "[ . 1 . 2 . 3]" 3
501 1 39 LEU QD 1 42 VAL HB 5.000 . 5.000 3.729 2.847 4.848 . 0 0 "[ . 1 . 2 . 3]" 3
502 1 39 LEU QD 1 42 VAL H 6.000 . 6.000 4.541 4.000 5.094 . 0 0 "[ . 1 . 2 . 3]" 3
503 1 39 LEU QD 1 42 VAL QG 5.000 . 5.000 3.104 2.514 3.827 . 0 0 "[ . 1 . 2 . 3]" 3
504 1 39 LEU QD 1 43 GLY H 6.000 . 6.000 5.100 4.408 5.891 . 0 0 "[ . 1 . 2 . 3]" 3
505 1 39 LEU HA 1 82 THR MG 5.000 . 5.000 3.000 2.462 3.502 . 0 0 "[ . 1 . 2 . 3]" 3
506 1 39 LEU HG 1 82 THR MG 5.000 . 5.000 3.504 2.716 5.011 0.011 28 0 "[ . 1 . 2 . 3]" 3
507 1 39 LEU H 1 82 THR MG 5.000 . 5.000 3.095 2.887 3.545 . 0 0 "[ . 1 . 2 . 3]" 3
508 1 39 LEU QB 1 82 THR MG 5.000 . 5.000 3.961 3.260 4.434 . 0 0 "[ . 1 . 2 . 3]" 3
509 1 39 LEU QD 1 82 THR HA 5.000 . 5.000 3.799 2.887 4.789 . 0 0 "[ . 1 . 2 . 3]" 3
510 1 39 LEU QD 1 82 THR MG 5.000 . 5.000 2.729 1.808 3.784 . 0 0 "[ . 1 . 2 . 3]" 3
511 1 39 LEU QD 1 85 LEU QD 5.000 . 5.000 1.710 1.556 2.011 . 0 0 "[ . 1 . 2 . 3]" 3
512 1 39 LEU QD 1 86 ILE MD 5.000 . 5.000 4.574 2.908 5.006 0.006 13 0 "[ . 1 . 2 . 3]" 3
513 1 39 LEU QD 1 101 VAL QG 5.000 . 5.000 3.127 1.938 4.075 . 0 0 "[ . 1 . 2 . 3]" 3
514 1 39 LEU QD 1 102 ILE HA 5.000 . 5.000 2.943 2.017 3.340 . 0 0 "[ . 1 . 2 . 3]" 3
515 1 39 LEU QD 1 102 ILE H 6.000 . 6.000 4.460 3.574 5.025 . 0 0 "[ . 1 . 2 . 3]" 3
516 1 39 LEU QD 1 102 ILE MD 5.000 . 5.000 3.363 2.039 4.259 . 0 0 "[ . 1 . 2 . 3]" 3
517 1 39 LEU QD 1 102 ILE QG 6.000 . 6.000 2.495 1.794 3.681 . 0 0 "[ . 1 . 2 . 3]" 3
518 1 39 LEU QD 1 102 ILE MG 5.000 . 5.000 3.072 1.932 3.656 . 0 0 "[ . 1 . 2 . 3]" 3
519 1 39 LEU QD 1 105 PHE HA 5.000 . 5.000 5.000 4.845 5.042 0.042 18 0 "[ . 1 . 2 . 3]" 3
520 1 39 LEU QD 1 105 PHE HZ 6.000 . 6.000 4.342 3.830 5.134 . 0 0 "[ . 1 . 2 . 3]" 3
521 1 39 LEU QD 1 105 PHE QB 5.000 . 5.000 3.083 2.895 3.241 . 0 0 "[ . 1 . 2 . 3]" 3
522 1 39 LEU QD 1 105 PHE QD 5.000 . 5.000 2.443 2.163 2.773 . 0 0 "[ . 1 . 2 . 3]" 3
523 1 39 LEU QD 1 105 PHE QE 5.000 . 5.000 2.925 2.315 3.508 . 0 0 "[ . 1 . 2 . 3]" 3
524 1 39 LEU QD 1 106 SER H 6.000 . 6.000 5.806 5.458 6.015 0.015 20 0 "[ . 1 . 2 . 3]" 3
525 1 40 LEU H 1 40 LEU HG 5.000 . 5.000 4.029 2.560 4.547 . 0 0 "[ . 1 . 2 . 3]" 3
526 1 40 LEU H 1 40 LEU QD 5.000 . 5.000 3.540 3.073 3.730 . 0 0 "[ . 1 . 2 . 3]" 3
527 1 40 LEU HA 1 41 ARG H 5.000 . 5.000 3.588 3.582 3.593 . 0 0 "[ . 1 . 2 . 3]" 3
528 1 40 LEU HG 1 41 ARG H 5.000 . 5.000 4.486 3.934 5.018 0.018 5 0 "[ . 1 . 2 . 3]" 3
529 1 40 LEU H 1 41 ARG H 2.800 . 2.800 2.815 2.776 2.852 0.052 12 0 "[ . 1 . 2 . 3]" 3
530 1 40 LEU QB 1 41 ARG H 5.000 . 5.000 2.682 2.595 2.798 . 0 0 "[ . 1 . 2 . 3]" 3
531 1 40 LEU QD 1 41 ARG H 5.000 . 5.000 3.837 3.073 4.222 . 0 0 "[ . 1 . 2 . 3]" 3
532 1 40 LEU H 1 42 VAL H 5.000 . 5.000 4.485 4.387 4.619 . 0 0 "[ . 1 . 2 . 3]" 3
533 1 40 LEU H 1 42 VAL QG 6.000 . 6.000 5.027 4.822 5.298 . 0 0 "[ . 1 . 2 . 3]" 3
534 1 40 LEU HA 1 43 GLY H 3.500 . 3.500 3.374 3.295 3.467 . 0 0 "[ . 1 . 2 . 3]" 3
535 1 41 ARG H 1 41 ARG QD 5.000 . 5.000 3.787 2.081 4.418 . 0 0 "[ . 1 . 2 . 3]" 3
536 1 41 ARG H 1 41 ARG QG 5.000 . 5.000 2.928 2.129 4.047 . 0 0 "[ . 1 . 2 . 3]" 3
537 1 41 ARG HA 1 42 VAL H 5.000 . 5.000 3.601 3.594 3.617 . 0 0 "[ . 1 . 2 . 3]" 3
538 1 41 ARG HA 1 42 VAL QG 6.000 . 6.000 4.784 4.680 4.833 . 0 0 "[ . 1 . 2 . 3]" 3
539 1 41 ARG H 1 42 VAL H 2.800 . 2.800 2.824 2.814 2.842 0.042 25 0 "[ . 1 . 2 . 3]" 3
540 1 41 ARG H 1 42 VAL QG 5.000 . 5.000 4.154 4.091 4.231 . 0 0 "[ . 1 . 2 . 3]" 3
541 1 41 ARG QB 1 42 VAL H 5.000 . 5.000 2.579 2.406 2.690 . 0 0 "[ . 1 . 2 . 3]" 3
542 1 41 ARG QG 1 42 VAL H 5.000 . 5.000 4.157 3.694 4.522 . 0 0 "[ . 1 . 2 . 3]" 3
543 1 41 ARG H 1 43 GLY H 5.000 . 5.000 4.292 4.170 4.381 . 0 0 "[ . 1 . 2 . 3]" 3
544 1 41 ARG HA 1 44 GLN H 3.500 . 3.500 3.444 3.315 3.523 0.023 20 0 "[ . 1 . 2 . 3]" 3
545 1 41 ARG HA 1 44 GLN QB 3.500 . 3.500 2.700 2.411 2.927 . 0 0 "[ . 1 . 2 . 3]" 3
546 1 41 ARG HA 1 44 GLN QG 5.000 . 5.000 4.234 3.141 4.959 . 0 0 "[ . 1 . 2 . 3]" 3
547 1 41 ARG H 1 78 PHE QE 5.000 . 5.000 3.977 3.647 4.268 . 0 0 "[ . 1 . 2 . 3]" 3
548 1 41 ARG QB 1 78 PHE HZ 5.000 . 5.000 2.519 1.835 2.885 . 0 0 "[ . 1 . 2 . 3]" 3
549 1 41 ARG QB 1 78 PHE QE 5.000 . 5.000 2.535 2.105 2.818 . 0 0 "[ . 1 . 2 . 3]" 3
550 1 41 ARG QD 1 78 PHE HZ 6.000 . 6.000 4.390 3.091 5.640 . 0 0 "[ . 1 . 2 . 3]" 3
551 1 41 ARG QD 1 78 PHE QE 6.000 . 6.000 3.983 2.230 5.340 . 0 0 "[ . 1 . 2 . 3]" 3
552 1 41 ARG QG 1 78 PHE HZ 5.000 . 5.000 3.984 2.838 4.765 . 0 0 "[ . 1 . 2 . 3]" 3
553 1 41 ARG QG 1 78 PHE QE 5.000 . 5.000 3.621 2.865 4.177 . 0 0 "[ . 1 . 2 . 3]" 3
554 1 42 VAL HA 1 43 GLY H 5.000 . 5.000 3.596 3.581 3.599 . 0 0 "[ . 1 . 2 . 3]" 3
555 1 42 VAL HB 1 43 GLY H 5.000 . 5.000 2.659 2.615 2.778 . 0 0 "[ . 1 . 2 . 3]" 3
556 1 42 VAL H 1 43 GLY H 2.800 . 2.800 2.763 2.675 2.819 0.019 26 0 "[ . 1 . 2 . 3]" 3
557 1 42 VAL QG 1 43 GLY H 5.000 . 5.000 3.272 3.224 3.354 . 0 0 "[ . 1 . 2 . 3]" 3
558 1 42 VAL QG 1 44 GLN H 6.000 . 6.000 4.778 4.723 4.829 . 0 0 "[ . 1 . 2 . 3]" 3
559 1 42 VAL HA 1 45 ILE HB 3.500 . 3.500 2.713 2.535 2.894 . 0 0 "[ . 1 . 2 . 3]" 3
560 1 42 VAL HA 1 45 ILE H 3.500 . 3.500 3.509 3.464 3.536 0.036 29 0 "[ . 1 . 2 . 3]" 3
561 1 42 VAL HA 1 45 ILE MD 5.000 . 5.000 1.914 1.834 2.231 . 0 0 "[ . 1 . 2 . 3]" 3
562 1 42 VAL HA 1 45 ILE MG 5.000 . 5.000 3.901 3.764 4.079 . 0 0 "[ . 1 . 2 . 3]" 3
563 1 42 VAL HB 1 45 ILE MD 5.000 . 5.000 4.421 4.299 4.721 . 0 0 "[ . 1 . 2 . 3]" 3
564 1 42 VAL H 1 45 ILE MD 5.000 . 5.000 3.487 3.305 3.769 . 0 0 "[ . 1 . 2 . 3]" 3
565 1 42 VAL HA 1 72 MET ME 5.000 . 5.000 4.188 3.654 4.541 . 0 0 "[ . 1 . 2 . 3]" 3
566 1 42 VAL MG1 1 72 MET ME 5.000 . 5.000 4.512 4.056 4.847 . 0 0 "[ . 1 . 2 . 3]" 3
567 1 42 VAL MG2 1 72 MET ME 5.000 . 5.000 3.684 3.016 3.987 . 0 0 "[ . 1 . 2 . 3]" 3
568 1 42 VAL QG 1 73 THR MG 6.000 . 6.000 5.905 5.613 6.031 0.031 1 0 "[ . 1 . 2 . 3]" 3
569 1 42 VAL HB 1 78 PHE HZ 5.000 . 5.000 5.006 4.791 5.039 0.039 26 0 "[ . 1 . 2 . 3]" 3
570 1 42 VAL H 1 78 PHE HZ 5.000 . 5.000 3.532 3.146 3.753 . 0 0 "[ . 1 . 2 . 3]" 3
571 1 42 VAL H 1 78 PHE QE 5.000 . 5.000 4.058 3.901 4.189 . 0 0 "[ . 1 . 2 . 3]" 3
572 1 42 VAL QG 1 78 PHE HZ 5.000 . 5.000 2.413 2.052 2.761 . 0 0 "[ . 1 . 2 . 3]" 3
573 1 42 VAL QG 1 78 PHE QD 5.000 . 5.000 4.612 4.098 4.740 . 0 0 "[ . 1 . 2 . 3]" 3
574 1 42 VAL QG 1 78 PHE QE 5.000 . 5.000 3.173 2.877 3.319 . 0 0 "[ . 1 . 2 . 3]" 3
575 1 42 VAL QG 1 82 THR MG 5.000 . 5.000 3.158 2.702 3.481 . 0 0 "[ . 1 . 2 . 3]" 3
576 1 42 VAL HB 1 86 ILE MD 6.000 . 6.000 4.937 4.066 5.756 . 0 0 "[ . 1 . 2 . 3]" 3
577 1 42 VAL QG 1 86 ILE QG 6.000 . 6.000 2.580 1.925 3.190 . 0 0 "[ . 1 . 2 . 3]" 3
578 1 42 VAL HB 1 89 LEU QD 5.000 . 5.000 3.265 3.180 3.382 . 0 0 "[ . 1 . 2 . 3]" 3
579 1 42 VAL H 1 89 LEU QD 5.000 . 5.000 5.077 5.034 5.127 0.127 30 0 "[ . 1 . 2 . 3]" 3
580 1 43 GLY H 1 44 GLN H 2.800 . 2.800 2.717 2.602 2.782 . 0 0 "[ . 1 . 2 . 3]" 3
581 1 43 GLY QA 1 44 GLN H 5.000 . 5.000 2.708 2.684 2.747 . 0 0 "[ . 1 . 2 . 3]" 3
582 1 43 GLY H 1 45 ILE HB 5.000 . 5.000 5.037 5.010 5.082 0.082 26 0 "[ . 1 . 2 . 3]" 3
583 1 43 GLY QA 1 46 LEU H 3.500 . 3.500 3.427 3.271 3.524 0.024 20 0 "[ . 1 . 2 . 3]" 3
584 1 43 GLY QA 1 46 LEU QB 3.500 . 3.500 2.991 2.649 3.154 . 0 0 "[ . 1 . 2 . 3]" 3
585 1 43 GLY H 1 98 THR MG 5.000 . 5.000 4.314 3.444 4.917 . 0 0 "[ . 1 . 2 . 3]" 3
586 1 43 GLY H 1 102 ILE MD 5.000 . 5.000 2.645 2.022 3.356 . 0 0 "[ . 1 . 2 . 3]" 3
587 1 43 GLY QA 1 102 ILE MD 5.000 . 5.000 2.637 1.886 3.965 . 0 0 "[ . 1 . 2 . 3]" 3
588 1 44 GLN H 1 44 GLN QG 5.000 . 5.000 3.297 2.367 4.040 . 0 0 "[ . 1 . 2 . 3]" 3
589 1 44 GLN HA 1 45 ILE H 5.000 . 5.000 3.591 3.586 3.597 . 0 0 "[ . 1 . 2 . 3]" 3
590 1 44 GLN H 1 45 ILE H 2.800 . 2.800 2.770 2.686 2.812 0.012 26 0 "[ . 1 . 2 . 3]" 3
591 1 44 GLN QB 1 45 ILE H 5.000 . 5.000 2.618 2.513 2.729 . 0 0 "[ . 1 . 2 . 3]" 3
592 1 44 GLN QB 1 45 ILE MD 5.000 . 5.000 4.171 2.795 4.335 . 0 0 "[ . 1 . 2 . 3]" 3
593 1 44 GLN QG 1 45 ILE H 6.000 . 6.000 4.146 3.714 4.383 . 0 0 "[ . 1 . 2 . 3]" 3
594 1 44 GLN H 1 46 LEU H 5.000 . 5.000 4.384 4.126 4.725 . 0 0 "[ . 1 . 2 . 3]" 3
595 1 44 GLN HA 1 47 LYS H 3.500 . 3.500 3.278 3.106 3.522 0.022 9 0 "[ . 1 . 2 . 3]" 3
596 1 44 GLN HA 1 47 LYS QB 3.500 . 3.500 2.351 2.053 2.840 . 0 0 "[ . 1 . 2 . 3]" 3
597 1 44 GLN QG 1 47 LYS QE 5.000 . 5.000 4.498 3.187 5.014 0.014 28 0 "[ . 1 . 2 . 3]" 3
598 1 45 ILE H 1 45 ILE MD 5.000 . 5.000 3.061 2.105 3.244 . 0 0 "[ . 1 . 2 . 3]" 3
599 1 45 ILE H 1 45 ILE QG 5.000 . 5.000 2.186 2.137 3.097 . 0 0 "[ . 1 . 2 . 3]" 3
600 1 45 ILE HA 1 46 LEU H 5.000 . 5.000 3.601 3.588 3.619 . 0 0 "[ . 1 . 2 . 3]" 3
601 1 45 ILE HB 1 46 LEU H 5.000 . 5.000 2.561 2.236 2.763 . 0 0 "[ . 1 . 2 . 3]" 3
602 1 45 ILE H 1 46 LEU H 2.800 . 2.800 2.798 2.724 2.885 0.085 29 0 "[ . 1 . 2 . 3]" 3
603 1 45 ILE MD 1 46 LEU H 5.000 . 5.000 4.272 3.972 4.460 . 0 0 "[ . 1 . 2 . 3]" 3
604 1 45 ILE MG 1 46 LEU H 5.000 . 5.000 3.333 2.965 3.523 . 0 0 "[ . 1 . 2 . 3]" 3
605 1 45 ILE HA 1 47 LYS H 5.000 . 5.000 4.453 4.126 4.616 . 0 0 "[ . 1 . 2 . 3]" 3
606 1 45 ILE H 1 47 LYS H 5.000 . 5.000 4.042 3.803 4.256 . 0 0 "[ . 1 . 2 . 3]" 3
607 1 45 ILE MG 1 47 LYS H 6.000 . 6.000 4.993 4.681 5.174 . 0 0 "[ . 1 . 2 . 3]" 3
608 1 45 ILE HA 1 48 GLU H 3.500 . 3.500 3.577 3.359 3.664 0.164 30 0 "[ . 1 . 2 . 3]" 3
609 1 45 ILE HA 1 48 GLU QB 3.500 . 3.500 2.795 2.430 3.257 . 0 0 "[ . 1 . 2 . 3]" 3
610 1 45 ILE HA 1 48 GLU QG 5.000 . 5.000 3.137 2.711 3.772 . 0 0 "[ . 1 . 2 . 3]" 3
611 1 45 ILE MG 1 48 GLU QB 5.000 . 5.000 3.897 3.589 4.114 . 0 0 "[ . 1 . 2 . 3]" 3
612 1 45 ILE MG 1 48 GLU QG 5.000 . 5.000 4.763 4.319 5.007 0.007 21 0 "[ . 1 . 2 . 3]" 3
613 1 45 ILE HA 1 51 MET HA 6.000 . 6.000 6.052 6.020 6.109 0.109 15 0 "[ . 1 . 2 . 3]" 3
614 1 45 ILE HA 1 51 MET QG 5.000 . 5.000 2.865 2.436 3.788 . 0 0 "[ . 1 . 2 . 3]" 3
615 1 45 ILE MG 1 51 MET HA 6.000 . 6.000 4.476 3.916 4.836 . 0 0 "[ . 1 . 2 . 3]" 3
616 1 45 ILE MG 1 51 MET QB 5.000 . 5.000 2.737 1.885 3.363 . 0 0 "[ . 1 . 2 . 3]" 3
617 1 45 ILE MG 1 51 MET ME 5.000 . 5.000 2.172 1.655 3.098 . 0 0 "[ . 1 . 2 . 3]" 3
618 1 45 ILE MG 1 51 MET QG 5.000 . 5.000 1.856 1.695 2.786 . 0 0 "[ . 1 . 2 . 3]" 3
619 1 45 ILE MG 1 54 SER QB 5.000 . 5.000 5.051 4.934 5.119 0.119 28 0 "[ . 1 . 2 . 3]" 3
620 1 45 ILE MD 1 72 MET QB 5.000 . 5.000 4.767 4.124 5.013 0.013 29 0 "[ . 1 . 2 . 3]" 3
621 1 45 ILE MD 1 72 MET QG 5.000 . 5.000 4.137 3.659 4.585 . 0 0 "[ . 1 . 2 . 3]" 3
622 1 45 ILE MG 1 72 MET ME 5.000 . 5.000 3.461 2.768 4.016 . 0 0 "[ . 1 . 2 . 3]" 3
623 1 45 ILE MD 1 76 GLU QB 5.000 . 5.000 4.754 3.563 5.022 0.022 7 0 "[ . 1 . 2 . 3]" 3
624 1 45 ILE MD 1 76 GLU QG 5.000 . 5.000 4.131 3.206 4.893 . 0 0 "[ . 1 . 2 . 3]" 3
625 1 45 ILE MD 1 78 PHE HZ 5.000 . 5.000 3.358 2.917 3.957 . 0 0 "[ . 1 . 2 . 3]" 3
626 1 45 ILE MD 1 78 PHE QE 5.000 . 5.000 3.827 3.018 4.381 . 0 0 "[ . 1 . 2 . 3]" 3
627 1 46 LEU H 1 46 LEU HG 5.000 . 5.000 4.269 2.149 4.611 . 0 0 "[ . 1 . 2 . 3]" 3
628 1 46 LEU H 1 46 LEU QD 5.000 . 5.000 3.398 2.053 3.756 . 0 0 "[ . 1 . 2 . 3]" 3
629 1 46 LEU HA 1 47 LYS H 5.000 . 5.000 3.570 3.538 3.587 . 0 0 "[ . 1 . 2 . 3]" 3
630 1 46 LEU HG 1 47 LYS H 5.000 . 5.000 4.590 3.921 5.127 0.127 13 0 "[ . 1 . 2 . 3]" 3
631 1 46 LEU H 1 47 LYS H 2.800 . 2.800 2.590 2.448 2.832 0.032 9 0 "[ . 1 . 2 . 3]" 3
632 1 46 LEU QB 1 47 LYS H 5.000 . 5.000 2.780 2.656 3.015 . 0 0 "[ . 1 . 2 . 3]" 3
633 1 46 LEU HA 1 48 GLU H 5.000 . 5.000 4.240 4.030 4.434 . 0 0 "[ . 1 . 2 . 3]" 3
634 1 46 LEU H 1 48 GLU H 5.000 . 5.000 4.040 3.850 4.387 . 0 0 "[ . 1 . 2 . 3]" 3
635 1 46 LEU HA 1 51 MET QB 5.000 . 5.000 3.933 2.861 4.592 . 0 0 "[ . 1 . 2 . 3]" 3
636 1 46 LEU HA 1 51 MET ME 5.000 . 5.000 4.963 4.545 5.077 0.077 20 0 "[ . 1 . 2 . 3]" 3
637 1 46 LEU HA 1 51 MET QG 5.000 . 5.000 4.285 3.463 5.098 0.098 18 0 "[ . 1 . 2 . 3]" 3
638 1 46 LEU QD 1 51 MET HA 6.000 . 6.000 5.875 5.274 6.078 0.078 24 0 "[ . 1 . 2 . 3]" 3
639 1 46 LEU QD 1 51 MET QB 5.000 . 5.000 4.437 3.557 5.095 0.095 19 0 "[ . 1 . 2 . 3]" 3
640 1 46 LEU QD 1 51 MET ME 5.000 . 5.000 4.594 4.028 5.025 0.025 28 0 "[ . 1 . 2 . 3]" 3
641 1 46 LEU QD 1 51 MET QG 5.000 . 5.000 4.542 4.001 5.142 0.142 29 0 "[ . 1 . 2 . 3]" 3
642 1 46 LEU HA 1 55 LEU QD 5.000 . 5.000 2.158 1.820 3.152 . 0 0 "[ . 1 . 2 . 3]" 3
643 1 46 LEU QD 1 99 PRO QD 5.000 . 5.000 3.342 2.106 4.380 . 0 0 "[ . 1 . 2 . 3]" 3
644 1 47 LYS H 1 47 LYS QD 5.000 . 5.000 4.152 3.418 4.680 . 0 0 "[ . 1 . 2 . 3]" 3
645 1 47 LYS H 1 47 LYS QG 5.000 . 5.000 3.539 2.294 4.047 . 0 0 "[ . 1 . 2 . 3]" 3
646 1 47 LYS HA 1 48 GLU H 5.000 . 5.000 3.577 3.565 3.588 . 0 0 "[ . 1 . 2 . 3]" 3
647 1 47 LYS H 1 48 GLU HA 5.000 . 5.000 5.172 5.126 5.297 0.297 20 0 "[ . 1 . 2 . 3]" 3
648 1 47 LYS H 1 48 GLU H 2.800 . 2.800 2.539 2.491 2.666 . 0 0 "[ . 1 . 2 . 3]" 3
649 1 47 LYS H 1 48 GLU QG 5.000 . 5.000 4.617 4.360 4.793 . 0 0 "[ . 1 . 2 . 3]" 3
650 1 47 LYS QB 1 48 GLU H 5.000 . 5.000 2.794 2.657 2.877 . 0 0 "[ . 1 . 2 . 3]" 3
651 1 47 LYS QD 1 48 GLU H 5.000 . 5.000 4.504 3.231 5.038 0.038 23 0 "[ . 1 . 2 . 3]" 3
652 1 48 GLU H 1 48 GLU QG 5.000 . 5.000 2.680 2.370 2.845 . 0 0 "[ . 1 . 2 . 3]" 3
653 1 48 GLU HA 1 49 PRO QD 3.500 . 3.500 2.068 2.047 2.093 . 0 0 "[ . 1 . 2 . 3]" 3
654 1 48 GLU HA 1 49 PRO QG 5.000 . 5.000 3.972 3.945 4.001 . 0 0 "[ . 1 . 2 . 3]" 3
655 1 48 GLU QB 1 49 PRO QD 5.000 . 5.000 2.877 2.601 3.054 . 0 0 "[ . 1 . 2 . 3]" 3
656 1 48 GLU QG 1 49 PRO QD 5.000 . 5.000 3.182 2.713 3.708 . 0 0 "[ . 1 . 2 . 3]" 3
657 1 48 GLU HA 1 50 LYS H 5.000 . 5.000 4.151 3.940 4.356 . 0 0 "[ . 1 . 2 . 3]" 3
658 1 48 GLU QB 1 50 LYS H 5.000 . 5.000 3.030 2.860 3.192 . 0 0 "[ . 1 . 2 . 3]" 3
659 1 48 GLU QG 1 50 LYS H 5.000 . 5.000 4.736 4.417 4.994 . 0 0 "[ . 1 . 2 . 3]" 3
660 1 48 GLU QB 1 51 MET QG 5.000 . 5.000 3.106 1.910 3.989 . 0 0 "[ . 1 . 2 . 3]" 3
661 1 48 GLU QG 1 51 MET QG 5.000 . 5.000 4.354 3.146 5.012 0.012 2 0 "[ . 1 . 2 . 3]" 3
662 1 49 PRO HA 1 50 LYS H 5.000 . 5.000 3.596 3.575 3.615 . 0 0 "[ . 1 . 2 . 3]" 3
663 1 49 PRO QB 1 50 LYS H 5.000 . 5.000 3.142 2.968 3.309 . 0 0 "[ . 1 . 2 . 3]" 3
664 1 49 PRO QD 1 50 LYS H 5.000 . 5.000 2.572 2.490 2.654 . 0 0 "[ . 1 . 2 . 3]" 3
665 1 49 PRO QG 1 50 LYS H 5.000 . 5.000 2.317 2.145 2.525 . 0 0 "[ . 1 . 2 . 3]" 3
666 1 49 PRO HA 1 52 ALA H 3.500 . 3.500 3.460 3.211 3.598 0.098 19 0 "[ . 1 . 2 . 3]" 3
667 1 49 PRO HA 1 52 ALA MB 3.500 . 3.500 2.388 2.224 2.502 . 0 0 "[ . 1 . 2 . 3]" 3
668 1 49 PRO QB 1 52 ALA MB 5.000 . 5.000 3.977 3.764 4.085 . 0 0 "[ . 1 . 2 . 3]" 3
669 1 49 PRO QG 1 52 ALA MB 5.000 . 5.000 5.047 5.010 5.078 0.078 23 0 "[ . 1 . 2 . 3]" 3
670 1 50 LYS H 1 50 LYS QD 5.000 . 5.000 3.876 2.076 4.583 . 0 0 "[ . 1 . 2 . 3]" 3
671 1 50 LYS H 1 50 LYS QG 5.000 . 5.000 3.316 2.156 4.061 . 0 0 "[ . 1 . 2 . 3]" 3
672 1 50 LYS HA 1 51 MET H 5.000 . 5.000 3.578 3.558 3.592 . 0 0 "[ . 1 . 2 . 3]" 3
673 1 50 LYS H 1 51 MET H 2.800 . 2.800 2.601 2.407 2.823 0.023 7 0 "[ . 1 . 2 . 3]" 3
674 1 50 LYS H 1 51 MET QB 5.000 . 5.000 4.459 4.186 4.908 . 0 0 "[ . 1 . 2 . 3]" 3
675 1 50 LYS H 1 51 MET QG 6.000 . 6.000 5.513 4.185 6.154 0.154 19 0 "[ . 1 . 2 . 3]" 3
676 1 50 LYS QB 1 51 MET H 5.000 . 5.000 2.695 2.416 2.902 . 0 0 "[ . 1 . 2 . 3]" 3
677 1 50 LYS QD 1 51 MET H 5.000 . 5.000 4.657 3.450 5.010 0.010 12 0 "[ . 1 . 2 . 3]" 3
678 1 50 LYS H 1 52 ALA H 5.000 . 5.000 4.006 3.807 4.306 . 0 0 "[ . 1 . 2 . 3]" 3
679 1 50 LYS H 1 52 ALA MB 6.000 . 6.000 4.586 4.440 4.777 . 0 0 "[ . 1 . 2 . 3]" 3
680 1 50 LYS HA 1 53 ALA H 5.000 . 5.000 4.210 3.701 5.005 0.005 19 0 "[ . 1 . 2 . 3]" 3
681 1 50 LYS HA 1 53 ALA MB 5.000 . 5.000 3.780 3.305 4.955 . 0 0 "[ . 1 . 2 . 3]" 3
682 1 51 MET H 1 51 MET QG 5.000 . 5.000 3.396 2.118 4.092 . 0 0 "[ . 1 . 2 . 3]" 3
683 1 51 MET HA 1 52 ALA H 5.000 . 5.000 3.566 3.168 3.595 . 0 0 "[ . 1 . 2 . 3]" 3
684 1 51 MET HA 1 52 ALA MB 6.000 . 6.000 4.983 4.778 5.007 . 0 0 "[ . 1 . 2 . 3]" 3
685 1 51 MET H 1 52 ALA H 2.800 . 2.800 2.458 2.336 2.695 . 0 0 "[ . 1 . 2 . 3]" 3
686 1 51 MET H 1 52 ALA MB 5.000 . 5.000 4.048 3.862 4.254 . 0 0 "[ . 1 . 2 . 3]" 3
687 1 51 MET QB 1 52 ALA H 5.000 . 5.000 2.803 2.571 3.714 . 0 0 "[ . 1 . 2 . 3]" 3
688 1 51 MET QG 1 52 ALA H 5.000 . 5.000 4.033 3.763 4.654 . 0 0 "[ . 1 . 2 . 3]" 3
689 1 51 MET QG 1 52 ALA MB 6.000 . 6.000 5.008 4.598 5.766 . 0 0 "[ . 1 . 2 . 3]" 3
690 1 51 MET HA 1 53 ALA H 5.000 . 5.000 4.174 3.987 4.590 . 0 0 "[ . 1 . 2 . 3]" 3
691 1 51 MET HA 1 54 SER H 3.500 . 3.500 3.350 3.038 3.521 0.021 19 0 "[ . 1 . 2 . 3]" 3
692 1 51 MET HA 1 54 SER QB 3.500 . 3.500 3.112 2.544 3.511 0.011 13 0 "[ . 1 . 2 . 3]" 3
693 1 51 MET HA 1 55 LEU QD 5.000 . 5.000 3.975 2.902 4.942 . 0 0 "[ . 1 . 2 . 3]" 3
694 1 51 MET QB 1 55 LEU QD 5.000 . 5.000 2.941 1.791 4.241 . 0 0 "[ . 1 . 2 . 3]" 3
695 1 51 MET ME 1 55 LEU QD 5.000 . 5.000 2.193 1.774 3.470 . 0 0 "[ . 1 . 2 . 3]" 3
696 1 51 MET QG 1 55 LEU QD 5.000 . 5.000 2.667 1.780 4.170 . 0 0 "[ . 1 . 2 . 3]" 3
697 1 52 ALA HA 1 53 ALA H 5.000 . 5.000 3.587 3.578 3.608 . 0 0 "[ . 1 . 2 . 3]" 3
698 1 52 ALA H 1 53 ALA H 2.800 . 2.800 2.830 2.342 2.894 0.094 12 0 "[ . 1 . 2 . 3]" 3
699 1 52 ALA MB 1 53 ALA H 5.000 . 5.000 2.634 2.435 2.703 . 0 0 "[ . 1 . 2 . 3]" 3
700 1 52 ALA MB 1 54 SER H 6.000 . 6.000 4.479 4.317 4.589 . 0 0 "[ . 1 . 2 . 3]" 3
701 1 52 ALA HA 1 55 LEU H 3.500 . 3.500 3.527 3.502 3.572 0.072 19 0 "[ . 1 . 2 . 3]" 3
702 1 52 ALA HA 1 55 LEU QB 3.500 . 3.500 2.715 2.417 2.997 . 0 0 "[ . 1 . 2 . 3]" 3
703 1 52 ALA MB 1 56 LEU H 6.000 . 6.000 4.503 4.057 4.976 . 0 0 "[ . 1 . 2 . 3]" 3
704 1 52 ALA MB 1 56 LEU QD 5.000 . 5.000 4.170 3.323 4.972 . 0 0 "[ . 1 . 2 . 3]" 3
705 1 53 ALA HA 1 54 SER H 5.000 . 5.000 3.579 3.553 3.595 . 0 0 "[ . 1 . 2 . 3]" 3
706 1 53 ALA H 1 54 SER H 2.800 . 2.800 2.776 2.609 2.834 0.034 14 0 "[ . 1 . 2 . 3]" 3
707 1 53 ALA H 1 54 SER QB 5.000 . 5.000 4.692 4.441 4.975 . 0 0 "[ . 1 . 2 . 3]" 3
708 1 53 ALA MB 1 54 SER H 5.000 . 5.000 2.733 2.521 2.954 . 0 0 "[ . 1 . 2 . 3]" 3
709 1 53 ALA H 1 55 LEU H 5.000 . 5.000 4.439 4.177 4.733 . 0 0 "[ . 1 . 2 . 3]" 3
710 1 53 ALA HA 1 56 LEU H 5.000 . 5.000 4.083 3.475 4.561 . 0 0 "[ . 1 . 2 . 3]" 3
711 1 53 ALA HA 1 56 LEU QB 5.000 . 5.000 3.737 2.818 4.608 . 0 0 "[ . 1 . 2 . 3]" 3
712 1 54 SER HA 1 55 LEU H 5.000 . 5.000 3.608 3.591 3.629 . 0 0 "[ . 1 . 2 . 3]" 3
713 1 54 SER H 1 55 LEU H 2.800 . 2.800 2.493 2.319 2.772 . 0 0 "[ . 1 . 2 . 3]" 3
714 1 54 SER QB 1 55 LEU H 5.000 . 5.000 2.468 2.260 2.667 . 0 0 "[ . 1 . 2 . 3]" 3
715 1 54 SER HA 1 56 LEU H 5.000 . 5.000 4.283 4.158 4.465 . 0 0 "[ . 1 . 2 . 3]" 3
716 1 54 SER H 1 56 LEU H 5.000 . 5.000 3.897 3.604 4.166 . 0 0 "[ . 1 . 2 . 3]" 3
717 1 54 SER QB 1 56 LEU H 5.000 . 5.000 4.604 4.405 4.811 . 0 0 "[ . 1 . 2 . 3]" 3
718 1 54 SER HA 1 57 ASN H 3.500 . 3.500 3.534 3.288 3.600 0.100 7 0 "[ . 1 . 2 . 3]" 3
719 1 54 SER HA 1 57 ASN QB 3.500 . 3.500 2.301 1.959 2.857 . 0 0 "[ . 1 . 2 . 3]" 3
720 1 54 SER HA 1 57 ASN QD 5.000 . 5.000 3.684 2.250 4.904 . 0 0 "[ . 1 . 2 . 3]" 3
721 1 54 SER QB 1 57 ASN H 5.000 . 5.000 4.880 4.721 5.012 0.012 16 0 "[ . 1 . 2 . 3]" 3
722 1 54 SER QB 1 57 ASN QB 5.000 . 5.000 4.197 3.809 4.707 . 0 0 "[ . 1 . 2 . 3]" 3
723 1 54 SER HA 1 60 VAL QG 5.000 . 5.000 3.124 2.143 4.470 . 0 0 "[ . 1 . 2 . 3]" 3
724 1 54 SER H 1 60 VAL QG 6.000 . 6.000 5.250 4.279 5.921 . 0 0 "[ . 1 . 2 . 3]" 3
725 1 54 SER QB 1 60 VAL QG 5.000 . 5.000 3.453 1.938 4.776 . 0 0 "[ . 1 . 2 . 3]" 3
726 1 55 LEU H 1 55 LEU HG 5.000 . 5.000 3.221 2.174 4.519 . 0 0 "[ . 1 . 2 . 3]" 3
727 1 55 LEU H 1 55 LEU QD 5.000 . 5.000 2.829 2.083 3.457 . 0 0 "[ . 1 . 2 . 3]" 3
728 1 55 LEU HA 1 56 LEU H 5.000 . 5.000 3.578 3.558 3.592 . 0 0 "[ . 1 . 2 . 3]" 3
729 1 55 LEU HG 1 56 LEU H 5.000 . 5.000 4.729 4.345 5.086 0.086 10 0 "[ . 1 . 2 . 3]" 3
730 1 55 LEU H 1 56 LEU H 2.800 . 2.800 2.761 2.586 2.845 0.045 8 0 "[ . 1 . 2 . 3]" 3
731 1 55 LEU QB 1 56 LEU H 5.000 . 5.000 2.803 2.608 2.926 . 0 0 "[ . 1 . 2 . 3]" 3
732 1 55 LEU QD 1 56 LEU H 5.000 . 5.000 4.127 3.854 4.278 . 0 0 "[ . 1 . 2 . 3]" 3
733 1 55 LEU HA 1 57 ASN H 5.000 . 5.000 4.280 3.930 4.778 . 0 0 "[ . 1 . 2 . 3]" 3
734 1 55 LEU HA 1 65 LYS QE 5.000 . 5.000 3.020 1.936 4.728 . 0 0 "[ . 1 . 2 . 3]" 3
735 1 55 LEU HA 1 65 LYS QG 5.000 . 5.000 4.327 3.379 5.005 0.005 8 0 "[ . 1 . 2 . 3]" 3
736 1 55 LEU QD 1 65 LYS QE 5.000 . 5.000 2.976 1.854 4.800 . 0 0 "[ . 1 . 2 . 3]" 3
737 1 56 LEU H 1 56 LEU HG 5.000 . 5.000 4.477 4.359 4.732 . 0 0 "[ . 1 . 2 . 3]" 3
738 1 56 LEU H 1 56 LEU QD 5.000 . 5.000 3.688 3.468 3.830 . 0 0 "[ . 1 . 2 . 3]" 3
739 1 56 LEU HA 1 57 ASN H 5.000 . 5.000 3.259 2.925 3.589 . 0 0 "[ . 1 . 2 . 3]" 3
740 1 56 LEU H 1 57 ASN HA 5.000 . 5.000 4.856 4.642 5.045 0.045 26 0 "[ . 1 . 2 . 3]" 3
741 1 56 LEU H 1 57 ASN H 3.500 . 3.500 2.639 2.326 2.968 . 0 0 "[ . 1 . 2 . 3]" 3
742 1 56 LEU QB 1 57 ASN H 5.000 . 5.000 3.467 2.688 3.912 . 0 0 "[ . 1 . 2 . 3]" 3
743 1 56 LEU QD 1 57 ASN H 6.000 . 6.000 3.816 3.123 4.399 . 0 0 "[ . 1 . 2 . 3]" 3
744 1 56 LEU HA 1 60 VAL QG 6.000 . 6.000 5.456 3.975 6.056 0.056 21 0 "[ . 1 . 2 . 3]" 3
745 1 56 LEU HA 1 96 THR MG 5.000 . 5.000 4.860 4.073 5.031 0.031 22 0 "[ . 1 . 2 . 3]" 3
746 1 56 LEU QD 1 96 THR HA 5.000 . 5.000 4.241 2.169 5.030 0.030 9 0 "[ . 1 . 2 . 3]" 3
747 1 56 LEU QD 1 96 THR HB 6.000 . 6.000 5.000 3.206 6.030 0.030 26 0 "[ . 1 . 2 . 3]" 3
748 1 57 ASN HA 1 58 PRO HA 5.000 . 5.000 4.465 4.411 4.534 . 0 0 "[ . 1 . 2 . 3]" 3
749 1 57 ASN HA 1 58 PRO QD 3.500 . 3.500 2.015 1.977 2.086 . 0 0 "[ . 1 . 2 . 3]" 3
750 1 57 ASN HA 1 58 PRO QG 5.000 . 5.000 3.936 3.881 3.995 . 0 0 "[ . 1 . 2 . 3]" 3
751 1 57 ASN H 1 58 PRO QD 5.000 . 5.000 4.348 4.112 4.454 . 0 0 "[ . 1 . 2 . 3]" 3
752 1 57 ASN QB 1 58 PRO QD 5.000 . 5.000 3.236 2.570 3.706 . 0 0 "[ . 1 . 2 . 3]" 3
753 1 57 ASN HA 1 59 TYR H 5.000 . 5.000 3.712 3.430 3.948 . 0 0 "[ . 1 . 2 . 3]" 3
754 1 57 ASN HA 1 59 TYR QD 5.000 . 5.000 3.888 3.554 4.351 . 0 0 "[ . 1 . 2 . 3]" 3
755 1 57 ASN HA 1 59 TYR QE 6.000 . 6.000 5.081 4.505 6.008 0.008 18 0 "[ . 1 . 2 . 3]" 3
756 1 57 ASN H 1 59 TYR QB 6.000 . 6.000 6.124 5.928 6.277 0.277 7 0 "[ . 1 . 2 . 3]" 3
757 1 57 ASN QB 1 59 TYR QD 5.000 . 5.000 3.335 2.213 4.440 . 0 0 "[ . 1 . 2 . 3]" 3
758 1 57 ASN QD 1 59 TYR QD 6.000 . 6.000 3.362 2.162 5.007 . 0 0 "[ . 1 . 2 . 3]" 3
759 1 57 ASN HA 1 60 VAL H 5.000 . 5.000 5.078 5.020 5.132 0.132 18 0 "[ . 1 . 2 . 3]" 3
760 1 57 ASN HA 1 60 VAL QG 6.000 . 6.000 4.487 4.076 4.901 . 0 0 "[ . 1 . 2 . 3]" 3
761 1 57 ASN QB 1 60 VAL HB 5.000 . 5.000 4.074 3.275 5.018 0.018 14 0 "[ . 1 . 2 . 3]" 3
762 1 57 ASN QB 1 60 VAL QG 5.000 . 5.000 2.237 1.796 3.238 . 0 0 "[ . 1 . 2 . 3]" 3
763 1 57 ASN QD 1 60 VAL QG 5.000 . 5.000 3.648 2.276 5.027 0.027 3 0 "[ . 1 . 2 . 3]" 3
764 1 58 PRO HA 1 59 TYR H 5.000 . 5.000 3.410 3.308 3.487 . 0 0 "[ . 1 . 2 . 3]" 3
765 1 58 PRO HA 1 59 TYR QD 5.000 . 5.000 4.842 4.412 5.017 0.017 9 0 "[ . 1 . 2 . 3]" 3
766 1 58 PRO HA 1 59 TYR QE 6.000 . 6.000 6.044 6.014 6.084 0.084 23 0 "[ . 1 . 2 . 3]" 3
767 1 58 PRO QB 1 59 TYR H 5.000 . 5.000 3.741 3.607 3.873 . 0 0 "[ . 1 . 2 . 3]" 3
768 1 58 PRO QB 1 59 TYR QD 5.000 . 5.000 4.138 3.457 4.474 . 0 0 "[ . 1 . 2 . 3]" 3
769 1 58 PRO QB 1 59 TYR QE 5.000 . 5.000 4.408 3.977 4.646 . 0 0 "[ . 1 . 2 . 3]" 3
770 1 58 PRO QD 1 59 TYR H 5.000 . 5.000 2.734 2.629 2.849 . 0 0 "[ . 1 . 2 . 3]" 3
771 1 58 PRO QD 1 59 TYR QD 5.000 . 5.000 2.175 1.970 2.460 . 0 0 "[ . 1 . 2 . 3]" 3
772 1 58 PRO QD 1 59 TYR QE 5.000 . 5.000 2.879 2.410 3.746 . 0 0 "[ . 1 . 2 . 3]" 3
773 1 58 PRO QG 1 59 TYR QD 5.000 . 5.000 2.871 2.026 3.417 . 0 0 "[ . 1 . 2 . 3]" 3
774 1 58 PRO QG 1 59 TYR QE 5.000 . 5.000 2.628 2.367 2.958 . 0 0 "[ . 1 . 2 . 3]" 3
775 1 59 TYR H 1 59 TYR QD 5.000 . 5.000 2.133 2.100 2.164 . 0 0 "[ . 1 . 2 . 3]" 3
776 1 59 TYR H 1 59 TYR QE 5.000 . 5.000 4.268 4.124 4.525 . 0 0 "[ . 1 . 2 . 3]" 3
777 1 59 TYR HA 1 60 VAL H 5.000 . 5.000 3.517 3.326 3.631 . 0 0 "[ . 1 . 2 . 3]" 3
778 1 59 TYR H 1 60 VAL H 2.800 . 2.800 2.461 2.328 2.740 . 0 0 "[ . 1 . 2 . 3]" 3
779 1 59 TYR H 1 60 VAL QG 5.000 . 5.000 3.446 3.181 3.730 . 0 0 "[ . 1 . 2 . 3]" 3
780 1 59 TYR QB 1 60 VAL H 5.000 . 5.000 2.971 2.140 3.526 . 0 0 "[ . 1 . 2 . 3]" 3
781 1 59 TYR QB 1 60 VAL QG 5.000 . 5.000 3.216 2.741 4.095 . 0 0 "[ . 1 . 2 . 3]" 3
782 1 59 TYR QD 1 60 VAL HA 6.000 . 6.000 5.957 5.878 6.016 0.016 21 0 "[ . 1 . 2 . 3]" 3
783 1 59 TYR QD 1 60 VAL QG 5.000 . 5.000 4.483 4.061 4.901 . 0 0 "[ . 1 . 2 . 3]" 3
784 1 60 VAL HA 1 61 LYS H 5.000 . 5.000 3.264 2.424 3.621 . 0 0 "[ . 1 . 2 . 3]" 3
785 1 60 VAL HB 1 61 LYS H 5.000 . 5.000 3.733 2.103 4.561 . 0 0 "[ . 1 . 2 . 3]" 3
786 1 60 VAL H 1 61 LYS H 3.500 . 3.500 2.966 2.741 3.570 0.070 4 0 "[ . 1 . 2 . 3]" 3
787 1 60 VAL QG 1 61 LYS H 5.000 . 5.000 3.310 2.084 3.807 . 0 0 "[ . 1 . 2 . 3]" 3
788 1 60 VAL QG 1 64 VAL HB 5.000 . 5.000 3.765 3.016 5.017 0.017 26 0 "[ . 1 . 2 . 3]" 3
789 1 60 VAL HA 1 65 LYS H 6.000 . 6.000 5.552 4.520 6.050 0.050 28 0 "[ . 1 . 2 . 3]" 3
790 1 60 VAL HB 1 65 LYS QE 6.000 . 6.000 4.184 1.955 6.007 0.007 29 0 "[ . 1 . 2 . 3]" 3
791 1 60 VAL QG 1 65 LYS QB 6.000 . 6.000 2.566 1.862 3.876 . 0 0 "[ . 1 . 2 . 3]" 3
792 1 60 VAL QG 1 65 LYS QE 6.000 . 6.000 2.937 1.692 4.049 . 0 0 "[ . 1 . 2 . 3]" 3
793 1 60 VAL QG 1 65 LYS QG 6.000 . 6.000 2.747 1.761 4.063 . 0 0 "[ . 1 . 2 . 3]" 3
794 1 61 LYS H 1 61 LYS QD 5.000 . 5.000 4.216 2.861 4.987 . 0 0 "[ . 1 . 2 . 3]" 3
795 1 61 LYS H 1 61 LYS QG 5.000 . 5.000 3.373 2.373 4.122 . 0 0 "[ . 1 . 2 . 3]" 3
796 1 61 LYS HA 1 62 ARG H 5.000 . 5.000 2.665 2.235 2.809 . 0 0 "[ . 1 . 2 . 3]" 3
797 1 61 LYS H 1 62 ARG H 5.000 . 5.000 4.670 4.309 4.748 . 0 0 "[ . 1 . 2 . 3]" 3
798 1 61 LYS QB 1 62 ARG H 5.000 . 5.000 2.437 2.143 3.604 . 0 0 "[ . 1 . 2 . 3]" 3
799 1 61 LYS QG 1 62 ARG H 5.000 . 5.000 2.941 2.097 4.484 . 0 0 "[ . 1 . 2 . 3]" 3
800 1 61 LYS HA 1 64 VAL HB 5.000 . 5.000 4.985 4.578 5.093 0.093 13 0 "[ . 1 . 2 . 3]" 3
801 1 61 LYS HA 1 64 VAL QG 5.000 . 5.000 4.687 4.182 4.902 . 0 0 "[ . 1 . 2 . 3]" 3
802 1 61 LYS H 1 64 VAL QG 5.000 . 5.000 4.781 3.380 5.009 0.009 24 0 "[ . 1 . 2 . 3]" 3
803 1 61 LYS QB 1 64 VAL QG 5.000 . 5.000 2.315 1.841 2.623 . 0 0 "[ . 1 . 2 . 3]" 3
804 1 61 LYS QD 1 64 VAL QG 5.000 . 5.000 2.902 1.797 4.183 . 0 0 "[ . 1 . 2 . 3]" 3
805 1 61 LYS QE 1 64 VAL QG 5.000 . 5.000 3.677 1.925 5.004 0.004 4 0 "[ . 1 . 2 . 3]" 3
806 1 61 LYS QG 1 64 VAL QG 5.000 . 5.000 3.169 2.312 4.046 . 0 0 "[ . 1 . 2 . 3]" 3
807 1 62 ARG H 1 62 ARG QD 5.000 . 5.000 4.474 3.936 4.776 . 0 0 "[ . 1 . 2 . 3]" 3
808 1 62 ARG H 1 62 ARG QG 5.000 . 5.000 3.864 2.440 4.118 . 0 0 "[ . 1 . 2 . 3]" 3
809 1 62 ARG HA 1 63 SER H 5.000 . 5.000 3.587 2.543 3.628 . 0 0 "[ . 1 . 2 . 3]" 3
810 1 62 ARG H 1 63 SER H 5.000 . 5.000 2.470 2.313 4.725 . 0 0 "[ . 1 . 2 . 3]" 3
811 1 62 ARG QB 1 63 SER H 5.000 . 5.000 2.304 2.157 3.010 . 0 0 "[ . 1 . 2 . 3]" 3
812 1 62 ARG QD 1 63 SER H 5.000 . 5.000 4.038 2.583 4.992 . 0 0 "[ . 1 . 2 . 3]" 3
813 1 62 ARG QG 1 63 SER H 5.000 . 5.000 3.778 2.161 4.336 . 0 0 "[ . 1 . 2 . 3]" 3
814 1 62 ARG QD 1 66 VAL QG 5.000 . 5.000 3.535 2.538 4.876 . 0 0 "[ . 1 . 2 . 3]" 3
815 1 62 ARG QG 1 66 VAL QG 5.000 . 5.000 3.640 2.351 4.823 . 0 0 "[ . 1 . 2 . 3]" 3
816 1 62 ARG QD 1 91 GLU HA 3.500 . 3.500 3.416 2.542 3.533 0.033 19 0 "[ . 1 . 2 . 3]" 3
817 1 63 SER HA 1 64 VAL H 5.000 . 5.000 3.595 3.560 3.617 . 0 0 "[ . 1 . 2 . 3]" 3
818 1 63 SER H 1 64 VAL H 3.500 . 3.500 2.796 2.328 3.760 0.260 13 0 "[ . 1 . 2 . 3]" 3
819 1 63 SER QB 1 64 VAL H 5.000 . 5.000 2.744 2.138 3.413 . 0 0 "[ . 1 . 2 . 3]" 3
820 1 63 SER HA 1 66 VAL HB 3.500 . 3.500 3.125 2.624 3.597 0.097 19 0 "[ . 1 . 2 . 3]" 3
821 1 63 SER HA 1 66 VAL H 3.500 . 3.500 3.509 3.449 3.550 0.050 19 0 "[ . 1 . 2 . 3]" 3
822 1 63 SER HA 1 66 VAL QG 5.000 . 5.000 2.469 1.867 3.065 . 0 0 "[ . 1 . 2 . 3]" 3
823 1 63 SER H 1 66 VAL QG 5.000 . 5.000 4.206 2.586 4.638 . 0 0 "[ . 1 . 2 . 3]" 3
824 1 64 VAL HA 1 65 LYS H 5.000 . 5.000 3.597 3.589 3.619 . 0 0 "[ . 1 . 2 . 3]" 3
825 1 64 VAL HB 1 65 LYS H 5.000 . 5.000 2.572 2.392 2.686 . 0 0 "[ . 1 . 2 . 3]" 3
826 1 64 VAL H 1 65 LYS H 5.000 . 5.000 2.704 2.456 2.869 . 0 0 "[ . 1 . 2 . 3]" 3
827 1 64 VAL QG 1 65 LYS H 5.000 . 5.000 3.228 3.109 3.291 . 0 0 "[ . 1 . 2 . 3]" 3
828 1 64 VAL HA 1 67 LYS H 3.500 . 3.500 3.499 3.383 3.589 0.089 19 0 "[ . 1 . 2 . 3]" 3
829 1 64 VAL HA 1 67 LYS QB 3.500 . 3.500 3.018 2.628 3.390 . 0 0 "[ . 1 . 2 . 3]" 3
830 1 65 LYS H 1 65 LYS QD 5.000 . 5.000 4.282 3.837 4.628 . 0 0 "[ . 1 . 2 . 3]" 3
831 1 65 LYS H 1 65 LYS QG 5.000 . 5.000 3.759 2.275 4.059 . 0 0 "[ . 1 . 2 . 3]" 3
832 1 65 LYS HA 1 66 VAL H 5.000 . 5.000 3.594 3.586 3.602 . 0 0 "[ . 1 . 2 . 3]" 3
833 1 65 LYS H 1 66 VAL H 2.800 . 2.800 2.769 2.608 2.847 0.047 18 0 "[ . 1 . 2 . 3]" 3
834 1 65 LYS H 1 66 VAL QG 5.000 . 5.000 4.077 3.808 4.162 . 0 0 "[ . 1 . 2 . 3]" 3
835 1 65 LYS QB 1 66 VAL H 5.000 . 5.000 2.625 2.547 2.741 . 0 0 "[ . 1 . 2 . 3]" 3
836 1 65 LYS HA 1 68 SER H 3.500 . 3.500 3.406 3.256 3.544 0.044 26 0 "[ . 1 . 2 . 3]" 3
837 1 65 LYS HA 1 68 SER QB 3.500 . 3.500 2.800 2.228 3.401 . 0 0 "[ . 1 . 2 . 3]" 3
838 1 65 LYS QE 1 68 SER QB 5.000 . 5.000 4.081 2.298 5.016 0.016 1 0 "[ . 1 . 2 . 3]" 3
839 1 66 VAL HA 1 67 LYS H 5.000 . 5.000 3.599 3.593 3.606 . 0 0 "[ . 1 . 2 . 3]" 3
840 1 66 VAL HB 1 67 LYS H 5.000 . 5.000 2.634 2.489 3.927 . 0 0 "[ . 1 . 2 . 3]" 3
841 1 66 VAL H 1 67 LYS H 2.800 . 2.800 2.770 2.624 2.817 0.017 8 0 "[ . 1 . 2 . 3]" 3
842 1 66 VAL QG 1 67 LYS HA 6.000 . 6.000 3.540 3.016 3.630 . 0 0 "[ . 1 . 2 . 3]" 3
843 1 66 VAL QG 1 67 LYS H 5.000 . 5.000 3.199 2.069 3.286 . 0 0 "[ . 1 . 2 . 3]" 3
844 1 66 VAL HA 1 69 LEU H 3.500 . 3.500 3.496 3.364 3.554 0.054 1 0 "[ . 1 . 2 . 3]" 3
845 1 66 VAL HA 1 69 LEU QB 3.500 . 3.500 2.884 2.558 3.160 . 0 0 "[ . 1 . 2 . 3]" 3
846 1 66 VAL QG 1 69 LEU H 6.000 . 6.000 4.314 4.136 4.439 . 0 0 "[ . 1 . 2 . 3]" 3
847 1 66 VAL QG 1 87 ASN HA 6.000 . 6.000 3.253 2.644 4.102 . 0 0 "[ . 1 . 2 . 3]" 3
848 1 66 VAL QG 1 90 ALA MB 5.000 . 5.000 2.741 1.924 3.449 . 0 0 "[ . 1 . 2 . 3]" 3
849 1 66 VAL QG 1 91 GLU HA 5.000 . 5.000 2.941 2.276 3.936 . 0 0 "[ . 1 . 2 . 3]" 3
850 1 66 VAL QG 1 91 GLU H 6.000 . 6.000 4.516 4.077 5.495 . 0 0 "[ . 1 . 2 . 3]" 3
851 1 66 VAL QG 1 91 GLU QB 6.000 . 6.000 3.787 2.976 4.796 . 0 0 "[ . 1 . 2 . 3]" 3
852 1 66 VAL QG 1 91 GLU QG 6.000 . 6.000 3.815 2.390 4.831 . 0 0 "[ . 1 . 2 . 3]" 3
853 1 67 LYS H 1 67 LYS QG 5.000 . 5.000 3.509 2.218 4.053 . 0 0 "[ . 1 . 2 . 3]" 3
854 1 67 LYS HA 1 68 SER H 5.000 . 5.000 3.595 3.590 3.597 . 0 0 "[ . 1 . 2 . 3]" 3
855 1 67 LYS H 1 68 SER H 2.800 . 2.800 2.732 2.605 2.815 0.015 6 0 "[ . 1 . 2 . 3]" 3
856 1 67 LYS QB 1 68 SER H 5.000 . 5.000 2.575 2.490 2.713 . 0 0 "[ . 1 . 2 . 3]" 3
857 1 67 LYS QD 1 68 SER H 5.000 . 5.000 4.551 3.722 5.002 0.002 21 0 "[ . 1 . 2 . 3]" 3
858 1 67 LYS QG 1 68 SER H 5.000 . 5.000 4.123 3.742 4.561 . 0 0 "[ . 1 . 2 . 3]" 3
859 1 67 LYS HA 1 70 SER H 3.500 . 3.500 3.515 3.434 3.554 0.054 4 0 "[ . 1 . 2 . 3]" 3
860 1 67 LYS HA 1 70 SER QB 3.500 . 3.500 3.019 2.680 3.507 0.007 19 0 "[ . 1 . 2 . 3]" 3
861 1 68 SER HA 1 69 LEU H 5.000 . 5.000 3.595 3.588 3.604 . 0 0 "[ . 1 . 2 . 3]" 3
862 1 68 SER H 1 69 LEU H 2.800 . 2.800 2.774 2.636 2.824 0.024 6 0 "[ . 1 . 2 . 3]" 3
863 1 68 SER QB 1 69 LEU H 5.000 . 5.000 2.647 2.552 3.391 . 0 0 "[ . 1 . 2 . 3]" 3
864 1 68 SER HA 1 71 ASP H 3.500 . 3.500 3.465 3.359 3.526 0.026 26 0 "[ . 1 . 2 . 3]" 3
865 1 68 SER HA 1 71 ASP QB 3.500 . 3.500 2.696 2.437 2.892 . 0 0 "[ . 1 . 2 . 3]" 3
866 1 69 LEU H 1 69 LEU HG 5.000 . 5.000 2.989 2.166 4.518 . 0 0 "[ . 1 . 2 . 3]" 3
867 1 69 LEU H 1 69 LEU QD 5.000 . 5.000 2.900 2.073 3.329 . 0 0 "[ . 1 . 2 . 3]" 3
868 1 69 LEU HA 1 70 SER H 5.000 . 5.000 3.608 3.595 3.620 . 0 0 "[ . 1 . 2 . 3]" 3
869 1 69 LEU HG 1 70 SER H 5.000 . 5.000 4.640 4.330 4.958 . 0 0 "[ . 1 . 2 . 3]" 3
870 1 69 LEU H 1 70 SER H 2.800 . 2.800 2.803 2.676 2.833 0.033 29 0 "[ . 1 . 2 . 3]" 3
871 1 69 LEU QB 1 70 SER H 5.000 . 5.000 2.524 2.314 2.644 . 0 0 "[ . 1 . 2 . 3]" 3
872 1 69 LEU QD 1 70 SER H 5.000 . 5.000 3.986 3.715 4.125 . 0 0 "[ . 1 . 2 . 3]" 3
873 1 69 LEU HA 1 72 MET H 3.500 . 3.500 3.395 3.277 3.515 0.015 19 0 "[ . 1 . 2 . 3]" 3
874 1 69 LEU HA 1 72 MET QB 3.500 . 3.500 2.661 2.399 2.837 . 0 0 "[ . 1 . 2 . 3]" 3
875 1 69 LEU HA 1 72 MET QG 5.000 . 5.000 4.725 4.440 4.893 . 0 0 "[ . 1 . 2 . 3]" 3
876 1 69 LEU QD 1 90 ALA HA 5.000 . 5.000 3.863 3.431 4.075 . 0 0 "[ . 1 . 2 . 3]" 3
877 1 69 LEU QD 1 90 ALA MB 5.000 . 5.000 1.703 1.531 2.021 . 0 0 "[ . 1 . 2 . 3]" 3
878 1 70 SER HA 1 71 ASP H 5.000 . 5.000 3.599 3.595 3.611 . 0 0 "[ . 1 . 2 . 3]" 3
879 1 70 SER H 1 71 ASP H 2.800 . 2.800 2.751 2.631 2.814 0.014 4 0 "[ . 1 . 2 . 3]" 3
880 1 70 SER QB 1 71 ASP H 5.000 . 5.000 2.645 2.421 3.385 . 0 0 "[ . 1 . 2 . 3]" 3
881 1 70 SER HA 1 73 THR HB 3.500 . 3.500 2.498 2.355 2.731 . 0 0 "[ . 1 . 2 . 3]" 3
882 1 70 SER HA 1 73 THR H 3.500 . 3.500 3.524 3.451 3.556 0.056 19 0 "[ . 1 . 2 . 3]" 3
883 1 70 SER HA 1 73 THR MG 5.000 . 5.000 3.513 3.311 3.704 . 0 0 "[ . 1 . 2 . 3]" 3
884 1 70 SER H 1 73 THR HB 5.000 . 5.000 4.791 4.583 5.021 0.021 18 0 "[ . 1 . 2 . 3]" 3
885 1 70 SER HA 1 86 ILE MG 5.000 . 5.000 4.599 4.084 5.016 0.016 30 0 "[ . 1 . 2 . 3]" 3
886 1 70 SER H 1 86 ILE MG 5.000 . 5.000 5.020 4.783 5.066 0.066 1 0 "[ . 1 . 2 . 3]" 3
887 1 71 ASP HA 1 72 MET H 5.000 . 5.000 3.524 3.504 3.556 . 0 0 "[ . 1 . 2 . 3]" 3
888 1 71 ASP H 1 72 MET H 2.800 . 2.800 2.675 2.616 2.732 . 0 0 "[ . 1 . 2 . 3]" 3
889 1 71 ASP QB 1 72 MET H 5.000 . 5.000 3.044 2.877 3.133 . 0 0 "[ . 1 . 2 . 3]" 3
890 1 71 ASP HA 1 73 THR H 5.000 . 5.000 4.734 4.504 4.806 . 0 0 "[ . 1 . 2 . 3]" 3
891 1 71 ASP H 1 73 THR H 5.000 . 5.000 4.321 4.193 4.440 . 0 0 "[ . 1 . 2 . 3]" 3
892 1 71 ASP HA 1 74 ALA H 3.500 . 3.500 3.587 3.577 3.601 0.101 26 0 "[ . 1 . 2 . 3]" 3
893 1 71 ASP HA 1 74 ALA MB 3.500 . 3.500 2.711 2.502 2.965 . 0 0 "[ . 1 . 2 . 3]" 3
894 1 71 ASP HA 1 75 LYS H 6.000 . 6.000 4.692 4.187 5.105 . 0 0 "[ . 1 . 2 . 3]" 3
895 1 72 MET H 1 72 MET QG 5.000 . 5.000 3.991 3.969 4.068 . 0 0 "[ . 1 . 2 . 3]" 3
896 1 72 MET HA 1 73 THR H 5.000 . 5.000 3.587 3.581 3.592 . 0 0 "[ . 1 . 2 . 3]" 3
897 1 72 MET H 1 73 THR H 2.800 . 2.800 2.305 2.267 2.433 . 0 0 "[ . 1 . 2 . 3]" 3
898 1 72 MET H 1 73 THR MG 5.000 . 5.000 5.275 5.160 5.386 0.386 29 0 "[ . 1 . 2 . 3]" 3
899 1 72 MET QB 1 73 THR H 5.000 . 5.000 2.404 2.347 2.565 . 0 0 "[ . 1 . 2 . 3]" 3
900 1 72 MET QB 1 73 THR MG 6.000 . 6.000 5.214 5.171 5.266 . 0 0 "[ . 1 . 2 . 3]" 3
901 1 72 MET ME 1 73 THR H 5.000 . 5.000 3.339 2.979 3.695 . 0 0 "[ . 1 . 2 . 3]" 3
902 1 72 MET ME 1 73 THR MG 5.000 . 5.000 4.879 4.446 5.009 0.009 23 0 "[ . 1 . 2 . 3]" 3
903 1 72 MET QG 1 73 THR H 5.000 . 5.000 3.784 3.541 4.020 . 0 0 "[ . 1 . 2 . 3]" 3
904 1 72 MET QG 1 73 THR MG 6.000 . 6.000 5.752 5.491 6.021 0.021 13 0 "[ . 1 . 2 . 3]" 3
905 1 72 MET HA 1 75 LYS H 3.500 . 3.500 3.402 3.277 3.501 0.001 24 0 "[ . 1 . 2 . 3]" 3
906 1 72 MET HA 1 75 LYS QB 3.500 . 3.500 3.142 2.792 3.510 0.010 24 0 "[ . 1 . 2 . 3]" 3
907 1 72 MET ME 1 78 PHE HZ 5.000 . 5.000 3.728 2.998 4.524 . 0 0 "[ . 1 . 2 . 3]" 3
908 1 72 MET ME 1 78 PHE QD 6.000 . 6.000 4.066 3.527 4.516 . 0 0 "[ . 1 . 2 . 3]" 3
909 1 72 MET ME 1 78 PHE QE 5.000 . 5.000 2.584 2.046 2.942 . 0 0 "[ . 1 . 2 . 3]" 3
910 1 72 MET QG 1 78 PHE QE 5.000 . 5.000 4.566 4.118 4.991 . 0 0 "[ . 1 . 2 . 3]" 3
911 1 73 THR HA 1 74 ALA H 5.000 . 5.000 3.606 3.599 3.608 . 0 0 "[ . 1 . 2 . 3]" 3
912 1 73 THR HB 1 74 ALA H 5.000 . 5.000 2.879 2.653 3.173 . 0 0 "[ . 1 . 2 . 3]" 3
913 1 73 THR H 1 74 ALA H 2.800 . 2.800 2.783 2.701 2.828 0.028 29 0 "[ . 1 . 2 . 3]" 3
914 1 73 THR MG 1 74 ALA H 5.000 . 5.000 3.118 2.662 3.447 . 0 0 "[ . 1 . 2 . 3]" 3
915 1 73 THR HA 1 75 LYS H 5.000 . 5.000 4.316 4.142 4.457 . 0 0 "[ . 1 . 2 . 3]" 3
916 1 73 THR HA 1 76 GLU H 5.000 . 5.000 3.251 3.139 3.554 . 0 0 "[ . 1 . 2 . 3]" 3
917 1 73 THR HB 1 78 PHE H 6.000 . 6.000 5.745 5.544 6.085 0.085 18 0 "[ . 1 . 2 . 3]" 3
918 1 73 THR HB 1 78 PHE QB 5.000 . 5.000 4.741 4.086 4.985 . 0 0 "[ . 1 . 2 . 3]" 3
919 1 73 THR HB 1 78 PHE QD 5.000 . 5.000 3.739 3.546 3.981 . 0 0 "[ . 1 . 2 . 3]" 3
920 1 73 THR HB 1 78 PHE QE 6.000 . 6.000 4.917 4.515 5.573 . 0 0 "[ . 1 . 2 . 3]" 3
921 1 73 THR H 1 78 PHE QD 6.000 . 6.000 4.343 4.152 4.586 . 0 0 "[ . 1 . 2 . 3]" 3
922 1 73 THR MG 1 78 PHE HA 5.000 . 5.000 4.733 4.454 5.008 0.008 26 0 "[ . 1 . 2 . 3]" 3
923 1 73 THR MG 1 78 PHE H 6.000 . 6.000 3.059 2.766 3.438 . 0 0 "[ . 1 . 2 . 3]" 3
924 1 73 THR MG 1 78 PHE QB 5.000 . 5.000 2.167 1.940 2.436 . 0 0 "[ . 1 . 2 . 3]" 3
925 1 73 THR MG 1 78 PHE QD 5.000 . 5.000 2.437 1.934 3.119 . 0 0 "[ . 1 . 2 . 3]" 3
926 1 73 THR MG 1 78 PHE QE 5.000 . 5.000 4.304 3.873 5.033 0.033 4 0 "[ . 1 . 2 . 3]" 3
927 1 73 THR MG 1 82 THR MG 6.000 . 6.000 4.964 4.556 5.253 . 0 0 "[ . 1 . 2 . 3]" 3
928 1 73 THR HB 1 83 SER HA 6.000 . 6.000 5.010 4.535 5.725 . 0 0 "[ . 1 . 2 . 3]" 3
929 1 73 THR MG 1 83 SER HA 5.000 . 5.000 2.991 2.547 3.590 . 0 0 "[ . 1 . 2 . 3]" 3
930 1 73 THR MG 1 83 SER QB 6.000 . 6.000 2.472 1.837 3.501 . 0 0 "[ . 1 . 2 . 3]" 3
931 1 73 THR HB 1 86 ILE MD 6.000 . 6.000 4.246 3.652 6.047 0.047 26 0 "[ . 1 . 2 . 3]" 3
932 1 73 THR MG 1 86 ILE HB 5.000 . 5.000 4.916 4.543 5.018 0.018 28 0 "[ . 1 . 2 . 3]" 3
933 1 73 THR MG 1 86 ILE MD 5.000 . 5.000 3.630 2.997 4.781 . 0 0 "[ . 1 . 2 . 3]" 3
934 1 74 ALA HA 1 75 LYS H 5.000 . 5.000 3.594 3.589 3.598 . 0 0 "[ . 1 . 2 . 3]" 3
935 1 74 ALA H 1 75 LYS H 3.500 . 3.500 2.782 2.698 2.842 . 0 0 "[ . 1 . 2 . 3]" 3
936 1 74 ALA MB 1 75 LYS H 5.000 . 5.000 2.582 2.490 2.668 . 0 0 "[ . 1 . 2 . 3]" 3
937 1 74 ALA HA 1 77 LYS H 5.000 . 5.000 4.244 3.819 5.072 0.072 4 0 "[ . 1 . 2 . 3]" 3
938 1 75 LYS H 1 75 LYS QD 5.000 . 5.000 4.048 3.251 4.556 . 0 0 "[ . 1 . 2 . 3]" 3
939 1 75 LYS H 1 75 LYS QG 5.000 . 5.000 3.241 2.280 4.057 . 0 0 "[ . 1 . 2 . 3]" 3
940 1 75 LYS HA 1 76 GLU H 5.000 . 5.000 3.508 3.057 3.591 . 0 0 "[ . 1 . 2 . 3]" 3
941 1 75 LYS H 1 76 GLU H 3.500 . 3.500 2.456 2.345 2.863 . 0 0 "[ . 1 . 2 . 3]" 3
942 1 75 LYS QB 1 76 GLU H 5.000 . 5.000 2.899 2.656 3.800 . 0 0 "[ . 1 . 2 . 3]" 3
943 1 75 LYS QG 1 76 GLU H 5.000 . 5.000 4.209 3.815 4.543 . 0 0 "[ . 1 . 2 . 3]" 3
944 1 75 LYS HA 1 77 LYS H 5.000 . 5.000 3.834 3.728 3.903 . 0 0 "[ . 1 . 2 . 3]" 3
945 1 75 LYS H 1 77 LYS H 5.000 . 5.000 4.146 3.969 4.987 . 0 0 "[ . 1 . 2 . 3]" 3
946 1 76 GLU H 1 76 GLU QG 5.000 . 5.000 3.567 2.158 4.114 . 0 0 "[ . 1 . 2 . 3]" 3
947 1 76 GLU HA 1 77 LYS H 5.000 . 5.000 3.481 3.159 3.545 . 0 0 "[ . 1 . 2 . 3]" 3
948 1 76 GLU H 1 77 LYS H 2.800 . 2.800 2.700 2.303 2.816 0.016 25 0 "[ . 1 . 2 . 3]" 3
949 1 76 GLU QB 1 77 LYS H 5.000 . 5.000 3.193 3.002 3.708 . 0 0 "[ . 1 . 2 . 3]" 3
950 1 76 GLU QG 1 77 LYS H 5.000 . 5.000 4.408 4.195 4.807 . 0 0 "[ . 1 . 2 . 3]" 3
951 1 76 GLU HA 1 78 PHE H 5.000 . 5.000 5.008 4.779 5.068 0.068 25 0 "[ . 1 . 2 . 3]" 3
952 1 76 GLU H 1 78 PHE H 5.000 . 5.000 4.388 3.197 4.692 . 0 0 "[ . 1 . 2 . 3]" 3
953 1 76 GLU H 1 78 PHE QD 5.000 . 5.000 4.954 4.453 5.036 0.036 14 0 "[ . 1 . 2 . 3]" 3
954 1 76 GLU QB 1 78 PHE H 5.000 . 5.000 3.151 2.968 3.479 . 0 0 "[ . 1 . 2 . 3]" 3
955 1 76 GLU QB 1 78 PHE HZ 6.000 . 6.000 4.570 3.249 5.348 . 0 0 "[ . 1 . 2 . 3]" 3
956 1 76 GLU QB 1 78 PHE QE 5.000 . 5.000 3.408 2.470 3.845 . 0 0 "[ . 1 . 2 . 3]" 3
957 1 77 LYS H 1 77 LYS QD 5.000 . 5.000 4.378 2.297 5.011 0.011 10 0 "[ . 1 . 2 . 3]" 3
958 1 77 LYS H 1 77 LYS QG 5.000 . 5.000 3.592 2.598 4.334 . 0 0 "[ . 1 . 2 . 3]" 3
959 1 77 LYS HA 1 78 PHE H 5.000 . 5.000 2.838 2.788 3.044 . 0 0 "[ . 1 . 2 . 3]" 3
960 1 77 LYS H 1 78 PHE H 2.800 . 2.800 2.806 2.700 2.884 0.084 24 0 "[ . 1 . 2 . 3]" 3
961 1 77 LYS QB 1 78 PHE H 5.000 . 5.000 3.911 3.838 3.943 . 0 0 "[ . 1 . 2 . 3]" 3
962 1 77 LYS QG 1 78 PHE H 5.000 . 5.000 4.475 4.303 4.705 . 0 0 "[ . 1 . 2 . 3]" 3
963 1 78 PHE H 1 78 PHE QD 5.000 . 5.000 3.357 3.166 3.670 . 0 0 "[ . 1 . 2 . 3]" 3
964 1 78 PHE HA 1 79 SER H 5.000 . 5.000 2.714 2.293 2.773 . 0 0 "[ . 1 . 2 . 3]" 3
965 1 78 PHE H 1 79 SER H 5.000 . 5.000 4.657 4.571 4.678 . 0 0 "[ . 1 . 2 . 3]" 3
966 1 78 PHE QB 1 79 SER H 5.000 . 5.000 2.164 2.112 3.073 . 0 0 "[ . 1 . 2 . 3]" 3
967 1 78 PHE QD 1 79 SER H 5.000 . 5.000 2.585 2.279 3.918 . 0 0 "[ . 1 . 2 . 3]" 3
968 1 78 PHE QE 1 79 SER H 6.000 . 6.000 4.886 4.607 6.138 0.138 4 0 "[ . 1 . 2 . 3]" 3
969 1 78 PHE QD 1 81 LEU H 6.000 . 6.000 6.085 6.036 6.133 0.133 7 0 "[ . 1 . 2 . 3]" 3
970 1 78 PHE HA 1 82 THR MG 5.000 . 5.000 4.295 3.616 4.414 . 0 0 "[ . 1 . 2 . 3]" 3
971 1 78 PHE H 1 82 THR MG 6.000 . 6.000 5.863 5.458 6.044 0.044 24 0 "[ . 1 . 2 . 3]" 3
972 1 78 PHE HZ 1 82 THR MG 6.000 . 6.000 3.500 3.173 3.910 . 0 0 "[ . 1 . 2 . 3]" 3
973 1 78 PHE QB 1 82 THR MG 5.000 . 5.000 3.419 3.153 3.586 . 0 0 "[ . 1 . 2 . 3]" 3
974 1 78 PHE QD 1 82 THR MG 5.000 . 5.000 2.542 2.457 2.635 . 0 0 "[ . 1 . 2 . 3]" 3
975 1 78 PHE QE 1 82 THR MG 5.000 . 5.000 2.481 2.172 2.901 . 0 0 "[ . 1 . 2 . 3]" 3
976 1 78 PHE QB 1 83 SER HA 5.000 . 5.000 4.159 3.811 4.545 . 0 0 "[ . 1 . 2 . 3]" 3
977 1 78 PHE QD 1 83 SER HA 6.000 . 6.000 4.610 4.285 5.536 . 0 0 "[ . 1 . 2 . 3]" 3
978 1 78 PHE QD 1 86 ILE MD 5.000 . 5.000 3.031 2.519 4.169 . 0 0 "[ . 1 . 2 . 3]" 3
979 1 78 PHE QD 1 86 ILE QG 5.000 . 5.000 4.824 3.846 5.060 0.060 19 0 "[ . 1 . 2 . 3]" 3
980 1 78 PHE QE 1 86 ILE MD 5.000 . 5.000 2.406 2.101 3.661 . 0 0 "[ . 1 . 2 . 3]" 3
981 1 78 PHE QE 1 86 ILE MG 5.000 . 5.000 4.393 3.643 5.003 0.003 4 0 "[ . 1 . 2 . 3]" 3
982 1 79 SER HA 1 80 PRO HA 5.000 . 5.000 4.393 4.368 4.735 . 0 0 "[ . 1 . 2 . 3]" 3
983 1 79 SER HA 1 80 PRO QD 3.500 . 3.500 2.515 2.390 3.563 0.063 4 0 "[ . 1 . 2 . 3]" 3
984 1 79 SER H 1 80 PRO QB 6.000 . 6.000 6.199 4.877 6.313 0.313 27 0 "[ . 1 . 2 . 3]" 3
985 1 79 SER H 1 80 PRO QD 6.000 . 6.000 4.269 2.078 4.390 . 0 0 "[ . 1 . 2 . 3]" 3
986 1 79 SER QB 1 80 PRO HA 5.000 . 5.000 4.577 4.345 5.025 0.025 30 0 "[ . 1 . 2 . 3]" 3
987 1 79 SER QB 1 80 PRO QG 5.000 . 5.000 3.534 3.254 3.891 . 0 0 "[ . 1 . 2 . 3]" 3
988 1 79 SER HA 1 82 THR HB 5.000 . 5.000 5.132 5.014 5.207 0.207 21 0 "[ . 1 . 2 . 3]" 3
989 1 79 SER H 1 82 THR HA 5.000 . 5.000 4.955 4.844 5.050 0.050 25 0 "[ . 1 . 2 . 3]" 3
990 1 79 SER H 1 82 THR H 5.000 . 5.000 3.519 2.635 3.734 . 0 0 "[ . 1 . 2 . 3]" 3
991 1 79 SER H 1 82 THR MG 6.000 . 6.000 3.698 3.468 4.382 . 0 0 "[ . 1 . 2 . 3]" 3
992 1 79 SER H 1 83 SER H 6.000 . 6.000 5.135 3.762 5.605 . 0 0 "[ . 1 . 2 . 3]" 3
993 1 80 PRO HA 1 83 SER H 5.000 . 5.000 4.811 4.390 5.166 0.166 4 0 "[ . 1 . 2 . 3]" 3
994 1 80 PRO HA 1 83 SER QB 5.000 . 5.000 4.640 4.238 5.003 0.003 26 0 "[ . 1 . 2 . 3]" 3
995 1 81 LEU H 1 81 LEU QD 5.000 . 5.000 3.237 2.414 3.718 . 0 0 "[ . 1 . 2 . 3]" 3
996 1 81 LEU HA 1 82 THR H 5.000 . 5.000 3.183 3.061 3.332 . 0 0 "[ . 1 . 2 . 3]" 3
997 1 81 LEU H 1 82 THR H 5.000 . 5.000 2.497 2.316 2.726 . 0 0 "[ . 1 . 2 . 3]" 3
998 1 81 LEU H 1 82 THR HB 5.000 . 5.000 4.619 4.422 4.941 . 0 0 "[ . 1 . 2 . 3]" 3
999 1 81 LEU H 1 82 THR MG 5.000 . 5.000 5.107 5.012 5.199 0.199 28 0 "[ . 1 . 2 . 3]" 3
1000 1 81 LEU QB 1 82 THR H 5.000 . 5.000 3.677 3.515 3.783 . 0 0 "[ . 1 . 2 . 3]" 3
1001 1 81 LEU QD 1 82 THR H 5.000 . 5.000 4.501 3.925 4.655 . 0 0 "[ . 1 . 2 . 3]" 3
1002 1 81 LEU H 1 83 SER H 6.000 . 6.000 4.606 4.321 4.930 . 0 0 "[ . 1 . 2 . 3]" 3
1003 1 81 LEU HA 1 84 ASN QB 5.000 . 5.000 4.359 3.873 4.790 . 0 0 "[ . 1 . 2 . 3]" 3
1004 1 81 LEU QB 1 85 LEU QB 5.000 . 5.000 5.138 5.080 5.180 0.180 20 0 "[ . 1 . 2 . 3]" 3
1005 1 82 THR HA 1 83 SER H 5.000 . 5.000 3.229 3.047 3.409 . 0 0 "[ . 1 . 2 . 3]" 3
1006 1 82 THR HB 1 83 SER H 5.000 . 5.000 3.925 3.618 4.140 . 0 0 "[ . 1 . 2 . 3]" 3
1007 1 82 THR H 1 83 SER H 2.800 . 2.800 2.316 2.270 2.379 . 0 0 "[ . 1 . 2 . 3]" 3
1008 1 82 THR MG 1 83 SER HA 5.000 . 5.000 4.521 4.242 4.738 . 0 0 "[ . 1 . 2 . 3]" 3
1009 1 82 THR MG 1 83 SER H 5.000 . 5.000 4.363 4.258 4.469 . 0 0 "[ . 1 . 2 . 3]" 3
1010 1 82 THR HA 1 85 LEU H 5.000 . 5.000 3.930 3.758 4.100 . 0 0 "[ . 1 . 2 . 3]" 3
1011 1 82 THR HA 1 85 LEU QB 3.500 . 3.500 3.341 3.081 3.518 0.018 19 0 "[ . 1 . 2 . 3]" 3
1012 1 82 THR HA 1 85 LEU QD 5.000 . 5.000 4.147 3.880 4.387 . 0 0 "[ . 1 . 2 . 3]" 3
1013 1 82 THR MG 1 85 LEU HG 5.000 . 5.000 5.029 5.009 5.054 0.054 22 0 "[ . 1 . 2 . 3]" 3
1014 1 82 THR MG 1 85 LEU QD 5.000 . 5.000 3.877 3.471 4.277 . 0 0 "[ . 1 . 2 . 3]" 3
1015 1 82 THR MG 1 86 ILE HB 5.000 . 5.000 3.999 3.198 4.896 . 0 0 "[ . 1 . 2 . 3]" 3
1016 1 82 THR MG 1 86 ILE H 6.000 . 6.000 4.231 4.049 4.382 . 0 0 "[ . 1 . 2 . 3]" 3
1017 1 82 THR MG 1 86 ILE MD 5.000 . 5.000 2.870 1.816 3.625 . 0 0 "[ . 1 . 2 . 3]" 3
1018 1 82 THR MG 1 86 ILE QG 5.000 . 5.000 3.897 2.529 5.001 0.001 8 0 "[ . 1 . 2 . 3]" 3
1019 1 83 SER HA 1 84 ASN H 5.000 . 5.000 2.765 2.553 2.912 . 0 0 "[ . 1 . 2 . 3]" 3
1020 1 83 SER H 1 84 ASN H 2.800 . 2.800 2.756 2.564 2.907 0.107 4 0 "[ . 1 . 2 . 3]" 3
1021 1 83 SER QB 1 84 ASN H 5.000 . 5.000 3.923 3.822 4.060 . 0 0 "[ . 1 . 2 . 3]" 3
1022 1 83 SER HA 1 86 ILE HB 3.500 . 3.500 3.312 2.987 3.512 0.012 25 0 "[ . 1 . 2 . 3]" 3
1023 1 83 SER HA 1 86 ILE H 3.500 . 3.500 3.835 3.747 3.940 0.440 24 0 "[ . 1 . 2 . 3]" 3
1024 1 83 SER HA 1 86 ILE MD 3.500 . 3.500 3.315 2.718 3.575 0.075 7 0 "[ . 1 . 2 . 3]" 3
1025 1 83 SER HA 1 86 ILE QG 5.000 . 5.000 4.167 3.616 4.703 . 0 0 "[ . 1 . 2 . 3]" 3
1026 1 83 SER HA 1 86 ILE MG 5.000 . 5.000 3.033 1.864 4.698 . 0 0 "[ . 1 . 2 . 3]" 3
1027 1 84 ASN HA 1 85 LEU H 5.000 . 5.000 3.609 3.605 3.618 . 0 0 "[ . 1 . 2 . 3]" 3
1028 1 84 ASN H 1 85 LEU H 3.500 . 3.500 2.227 2.213 2.244 . 0 0 "[ . 1 . 2 . 3]" 3
1029 1 84 ASN QB 1 85 LEU H 5.000 . 5.000 2.231 2.125 2.400 . 0 0 "[ . 1 . 2 . 3]" 3
1030 1 84 ASN H 1 86 ILE HA 5.000 . 5.000 5.121 5.091 5.154 0.154 4 0 "[ . 1 . 2 . 3]" 3
1031 1 84 ASN HA 1 87 ASN H 3.500 . 3.500 3.518 3.378 3.590 0.090 5 0 "[ . 1 . 2 . 3]" 3
1032 1 84 ASN HA 1 87 ASN QB 3.500 . 3.500 3.302 2.897 3.506 0.006 16 0 "[ . 1 . 2 . 3]" 3
1033 1 84 ASN HA 1 87 ASN QD 5.000 . 5.000 4.251 2.163 5.005 0.005 3 0 "[ . 1 . 2 . 3]" 3
1034 1 84 ASN HA 1 88 LEU QD 5.000 . 5.000 4.888 4.114 5.045 0.045 3 0 "[ . 1 . 2 . 3]" 3
1035 1 85 LEU H 1 85 LEU QD 5.000 . 5.000 3.688 3.652 3.718 . 0 0 "[ . 1 . 2 . 3]" 3
1036 1 85 LEU HA 1 86 ILE H 5.000 . 5.000 3.603 3.592 3.621 . 0 0 "[ . 1 . 2 . 3]" 3
1037 1 85 LEU HG 1 86 ILE H 5.000 . 5.000 3.896 3.760 4.020 . 0 0 "[ . 1 . 2 . 3]" 3
1038 1 85 LEU H 1 86 ILE H 5.000 . 5.000 2.719 2.670 2.755 . 0 0 "[ . 1 . 2 . 3]" 3
1039 1 85 LEU QB 1 86 ILE H 5.000 . 5.000 2.891 2.818 2.951 . 0 0 "[ . 1 . 2 . 3]" 3
1040 1 85 LEU QD 1 86 ILE H 5.000 . 5.000 4.062 4.011 4.126 . 0 0 "[ . 1 . 2 . 3]" 3
1041 1 85 LEU HA 1 88 LEU H 3.500 . 3.500 3.362 3.142 3.516 0.016 23 0 "[ . 1 . 2 . 3]" 3
1042 1 85 LEU HA 1 88 LEU QB 3.500 . 3.500 2.544 2.214 3.281 . 0 0 "[ . 1 . 2 . 3]" 3
1043 1 85 LEU HG 1 89 LEU QD 5.000 . 5.000 2.705 2.180 3.222 . 0 0 "[ . 1 . 2 . 3]" 3
1044 1 85 LEU QD 1 89 LEU QD 5.000 . 5.000 2.835 2.499 3.299 . 0 0 "[ . 1 . 2 . 3]" 3
1045 1 85 LEU QD 1 102 ILE HA 5.000 . 5.000 4.994 4.568 5.088 0.088 29 0 "[ . 1 . 2 . 3]" 3
1046 1 86 ILE H 1 86 ILE MD 5.000 . 5.000 3.830 2.035 4.185 . 0 0 "[ . 1 . 2 . 3]" 3
1047 1 86 ILE H 1 86 ILE QG 5.000 . 5.000 3.306 2.148 4.003 . 0 0 "[ . 1 . 2 . 3]" 3
1048 1 86 ILE HA 1 87 ASN H 5.000 . 5.000 3.592 3.587 3.600 . 0 0 "[ . 1 . 2 . 3]" 3
1049 1 86 ILE HB 1 87 ASN H 5.000 . 5.000 3.397 2.567 3.952 . 0 0 "[ . 1 . 2 . 3]" 3
1050 1 86 ILE H 1 87 ASN H 2.800 . 2.800 2.737 2.587 2.804 0.004 5 0 "[ . 1 . 2 . 3]" 3
1051 1 86 ILE MD 1 87 ASN H 5.000 . 5.000 4.757 4.041 4.957 . 0 0 "[ . 1 . 2 . 3]" 3
1052 1 86 ILE QG 1 87 ASN H 5.000 . 5.000 3.982 3.787 4.584 . 0 0 "[ . 1 . 2 . 3]" 3
1053 1 86 ILE MG 1 87 ASN HA 5.000 . 5.000 3.351 3.215 3.668 . 0 0 "[ . 1 . 2 . 3]" 3
1054 1 86 ILE MG 1 87 ASN H 5.000 . 5.000 2.590 2.022 3.466 . 0 0 "[ . 1 . 2 . 3]" 3
1055 1 86 ILE MG 1 87 ASN QB 5.000 . 5.000 3.787 2.829 4.803 . 0 0 "[ . 1 . 2 . 3]" 3
1056 1 86 ILE HA 1 89 LEU H 3.500 . 3.500 3.489 3.243 3.584 0.084 16 0 "[ . 1 . 2 . 3]" 3
1057 1 86 ILE HA 1 89 LEU QB 3.500 . 3.500 2.714 2.321 2.975 . 0 0 "[ . 1 . 2 . 3]" 3
1058 1 86 ILE HA 1 89 LEU QD 6.000 . 6.000 2.411 2.061 2.895 . 0 0 "[ . 1 . 2 . 3]" 3
1059 1 86 ILE HA 1 90 ALA H 6.000 . 6.000 4.548 4.330 4.685 . 0 0 "[ . 1 . 2 . 3]" 3
1060 1 86 ILE HA 1 90 ALA MB 5.000 . 5.000 4.992 4.798 5.038 0.038 6 0 "[ . 1 . 2 . 3]" 3
1061 1 86 ILE MD 1 95 LEU QD 5.000 . 5.000 5.080 5.028 5.148 0.148 24 0 "[ . 1 . 2 . 3]" 3
1062 1 87 ASN H 1 87 ASN QD 5.000 . 5.000 4.018 2.328 4.692 . 0 0 "[ . 1 . 2 . 3]" 3
1063 1 87 ASN HA 1 88 LEU H 5.000 . 5.000 3.607 3.590 3.620 . 0 0 "[ . 1 . 2 . 3]" 3
1064 1 87 ASN H 1 88 LEU H 3.500 . 3.500 2.775 2.549 2.973 . 0 0 "[ . 1 . 2 . 3]" 3
1065 1 87 ASN QB 1 88 LEU H 5.000 . 5.000 2.409 2.230 2.575 . 0 0 "[ . 1 . 2 . 3]" 3
1066 1 87 ASN HA 1 90 ALA H 3.500 . 3.500 3.369 3.310 3.474 . 0 0 "[ . 1 . 2 . 3]" 3
1067 1 87 ASN HA 1 90 ALA MB 3.500 . 3.500 3.306 3.087 3.504 0.004 22 0 "[ . 1 . 2 . 3]" 3
1068 1 87 ASN QB 1 90 ALA MB 6.000 . 6.000 4.902 4.682 5.126 . 0 0 "[ . 1 . 2 . 3]" 3
1069 1 87 ASN HA 1 91 GLU H 5.000 . 5.000 4.902 4.755 5.019 0.019 23 0 "[ . 1 . 2 . 3]" 3
1070 1 88 LEU H 1 88 LEU HG 5.000 . 5.000 3.039 2.164 4.354 . 0 0 "[ . 1 . 2 . 3]" 3
1071 1 88 LEU H 1 88 LEU QD 5.000 . 5.000 2.963 2.100 3.285 . 0 0 "[ . 1 . 2 . 3]" 3
1072 1 88 LEU HA 1 89 LEU H 5.000 . 5.000 3.597 3.591 3.604 . 0 0 "[ . 1 . 2 . 3]" 3
1073 1 88 LEU H 1 89 LEU H 3.500 . 3.500 2.863 2.723 2.914 . 0 0 "[ . 1 . 2 . 3]" 3
1074 1 88 LEU H 1 89 LEU QD 6.000 . 6.000 5.059 4.823 5.397 . 0 0 "[ . 1 . 2 . 3]" 3
1075 1 88 LEU QB 1 89 LEU H 5.000 . 5.000 2.636 2.520 2.695 . 0 0 "[ . 1 . 2 . 3]" 3
1076 1 88 LEU QD 1 89 LEU H 5.000 . 5.000 4.065 3.907 4.141 . 0 0 "[ . 1 . 2 . 3]" 3
1077 1 88 LEU HA 1 91 GLU H 3.500 . 3.500 3.415 3.343 3.503 0.003 21 0 "[ . 1 . 2 . 3]" 3
1078 1 88 LEU HA 1 91 GLU QB 3.500 . 3.500 2.067 1.942 2.227 . 0 0 "[ . 1 . 2 . 3]" 3
1079 1 88 LEU HA 1 91 GLU QG 5.000 . 5.000 3.735 3.288 4.051 . 0 0 "[ . 1 . 2 . 3]" 3
1080 1 88 LEU H 1 91 GLU H 5.000 . 5.000 5.069 5.034 5.093 0.093 29 0 "[ . 1 . 2 . 3]" 3
1081 1 88 LEU QD 1 91 GLU H 5.000 . 5.000 4.792 4.471 5.038 0.038 30 0 "[ . 1 . 2 . 3]" 3
1082 1 88 LEU QD 1 91 GLU QG 5.000 . 5.000 4.087 3.295 4.651 . 0 0 "[ . 1 . 2 . 3]" 3
1083 1 88 LEU QD 1 92 ASN QD 5.000 . 5.000 3.910 2.889 5.010 0.010 3 0 "[ . 1 . 2 . 3]" 3
1084 1 88 LEU QD 1 101 VAL QG 5.000 . 5.000 5.043 5.015 5.085 0.085 25 0 "[ . 1 . 2 . 3]" 3
1085 1 89 LEU H 1 89 LEU HG 5.000 . 5.000 2.514 2.165 3.232 . 0 0 "[ . 1 . 2 . 3]" 3
1086 1 89 LEU H 1 89 LEU QD 5.000 . 5.000 3.212 3.036 3.455 . 0 0 "[ . 1 . 2 . 3]" 3
1087 1 89 LEU HA 1 90 ALA H 5.000 . 5.000 3.592 3.581 3.596 . 0 0 "[ . 1 . 2 . 3]" 3
1088 1 89 LEU HG 1 90 ALA H 5.000 . 5.000 4.589 4.331 4.944 . 0 0 "[ . 1 . 2 . 3]" 3
1089 1 89 LEU H 1 90 ALA H 5.000 . 5.000 2.753 2.685 2.807 . 0 0 "[ . 1 . 2 . 3]" 3
1090 1 89 LEU QB 1 90 ALA H 5.000 . 5.000 2.642 2.550 2.763 . 0 0 "[ . 1 . 2 . 3]" 3
1091 1 89 LEU QD 1 90 ALA H 5.000 . 5.000 4.110 4.079 4.151 . 0 0 "[ . 1 . 2 . 3]" 3
1092 1 89 LEU H 1 91 GLU H 5.000 . 5.000 4.141 4.112 4.184 . 0 0 "[ . 1 . 2 . 3]" 3
1093 1 89 LEU QD 1 91 GLU H 5.000 . 5.000 5.112 5.076 5.160 0.160 29 0 "[ . 1 . 2 . 3]" 3
1094 1 89 LEU HA 1 92 ASN H 5.000 . 5.000 5.027 4.947 5.067 0.067 1 0 "[ . 1 . 2 . 3]" 3
1095 1 89 LEU QD 1 92 ASN H 6.000 . 6.000 5.925 5.858 5.998 . 0 0 "[ . 1 . 2 . 3]" 3
1096 1 89 LEU HA 1 94 ARG H 5.000 . 5.000 3.900 3.018 4.281 . 0 0 "[ . 1 . 2 . 3]" 3
1097 1 89 LEU QD 1 94 ARG H 5.000 . 5.000 4.527 3.609 4.931 . 0 0 "[ . 1 . 2 . 3]" 3
1098 1 89 LEU QD 1 94 ARG QB 5.000 . 5.000 2.264 1.820 2.636 . 0 0 "[ . 1 . 2 . 3]" 3
1099 1 89 LEU QD 1 94 ARG QD 5.000 . 5.000 3.627 2.770 4.579 . 0 0 "[ . 1 . 2 . 3]" 3
1100 1 89 LEU QD 1 94 ARG QG 5.000 . 5.000 3.492 2.440 4.107 . 0 0 "[ . 1 . 2 . 3]" 3
1101 1 89 LEU QD 1 95 LEU HA 5.000 . 5.000 3.277 2.051 4.213 . 0 0 "[ . 1 . 2 . 3]" 3
1102 1 89 LEU QD 1 97 ASN QB 6.000 . 6.000 5.254 4.560 5.718 . 0 0 "[ . 1 . 2 . 3]" 3
1103 1 89 LEU QD 1 98 THR HA 6.000 . 6.000 2.722 2.306 3.172 . 0 0 "[ . 1 . 2 . 3]" 3
1104 1 89 LEU QD 1 98 THR HB 6.000 . 6.000 3.006 2.240 4.082 . 0 0 "[ . 1 . 2 . 3]" 3
1105 1 89 LEU QD 1 98 THR MG 5.000 . 5.000 2.750 1.530 4.016 . 0 0 "[ . 1 . 2 . 3]" 3
1106 1 89 LEU QD 1 101 VAL HB 6.000 . 6.000 3.402 3.091 3.783 . 0 0 "[ . 1 . 2 . 3]" 3
1107 1 89 LEU QD 1 101 VAL H 5.000 . 5.000 4.803 4.460 5.036 0.036 23 0 "[ . 1 . 2 . 3]" 3
1108 1 89 LEU QD 1 101 VAL QG 5.000 . 5.000 2.730 2.203 3.146 . 0 0 "[ . 1 . 2 . 3]" 3
1109 1 90 ALA HA 1 91 GLU H 5.000 . 5.000 3.081 3.059 3.126 . 0 0 "[ . 1 . 2 . 3]" 3
1110 1 90 ALA H 1 91 GLU H 2.800 . 2.800 2.772 2.713 2.798 . 0 0 "[ . 1 . 2 . 3]" 3
1111 1 90 ALA MB 1 91 GLU H 5.000 . 5.000 3.634 3.614 3.652 . 0 0 "[ . 1 . 2 . 3]" 3
1112 1 90 ALA HA 1 93 GLY H 5.000 . 5.000 3.802 3.477 4.646 . 0 0 "[ . 1 . 2 . 3]" 3
1113 1 90 ALA HA 1 94 ARG H 5.000 . 5.000 3.293 3.002 4.166 . 0 0 "[ . 1 . 2 . 3]" 3
1114 1 90 ALA HA 1 95 LEU H 5.000 . 5.000 4.405 3.232 5.009 0.009 7 0 "[ . 1 . 2 . 3]" 3
1115 1 90 ALA HA 1 95 LEU QD 5.000 . 5.000 2.425 1.954 3.083 . 0 0 "[ . 1 . 2 . 3]" 3
1116 1 90 ALA MB 1 95 LEU QD 5.000 . 5.000 2.057 1.746 2.729 . 0 0 "[ . 1 . 2 . 3]" 3
1117 1 91 GLU H 1 91 GLU QG 5.000 . 5.000 3.987 3.770 4.134 . 0 0 "[ . 1 . 2 . 3]" 3
1118 1 91 GLU HA 1 92 ASN H 5.000 . 5.000 3.622 3.608 3.635 . 0 0 "[ . 1 . 2 . 3]" 3
1119 1 91 GLU H 1 92 ASN HA 5.000 . 5.000 4.985 4.877 5.040 0.040 28 0 "[ . 1 . 2 . 3]" 3
1120 1 91 GLU H 1 92 ASN H 2.800 . 2.800 2.342 2.322 2.427 . 0 0 "[ . 1 . 2 . 3]" 3
1121 1 91 GLU QB 1 92 ASN HA 6.000 . 6.000 4.400 3.964 4.574 . 0 0 "[ . 1 . 2 . 3]" 3
1122 1 91 GLU QB 1 92 ASN H 5.000 . 5.000 2.415 2.164 2.548 . 0 0 "[ . 1 . 2 . 3]" 3
1123 1 91 GLU QG 1 92 ASN HA 5.000 . 5.000 4.052 3.537 5.026 0.026 28 0 "[ . 1 . 2 . 3]" 3
1124 1 91 GLU QG 1 92 ASN H 5.000 . 5.000 3.597 3.194 4.284 . 0 0 "[ . 1 . 2 . 3]" 3
1125 1 91 GLU HA 1 93 GLY H 5.000 . 5.000 4.471 4.254 5.028 0.028 18 0 "[ . 1 . 2 . 3]" 3
1126 1 91 GLU H 1 93 GLY H 5.000 . 5.000 3.580 3.121 3.739 . 0 0 "[ . 1 . 2 . 3]" 3
1127 1 92 ASN H 1 92 ASN QD 5.000 . 5.000 3.777 2.373 4.797 . 0 0 "[ . 1 . 2 . 3]" 3
1128 1 92 ASN HA 1 93 GLY H 5.000 . 5.000 3.130 3.016 3.597 . 0 0 "[ . 1 . 2 . 3]" 3
1129 1 92 ASN H 1 93 GLY H 5.000 . 5.000 2.663 2.317 2.804 . 0 0 "[ . 1 . 2 . 3]" 3
1130 1 92 ASN QB 1 93 GLY H 5.000 . 5.000 3.646 2.625 3.816 . 0 0 "[ . 1 . 2 . 3]" 3
1131 1 92 ASN HA 1 94 ARG H 6.000 . 6.000 5.258 5.058 5.929 . 0 0 "[ . 1 . 2 . 3]" 3
1132 1 92 ASN H 1 94 ARG H 5.000 . 5.000 3.555 3.271 4.393 . 0 0 "[ . 1 . 2 . 3]" 3
1133 1 92 ASN QB 1 94 ARG H 6.000 . 6.000 4.435 4.286 4.655 . 0 0 "[ . 1 . 2 . 3]" 3
1134 1 93 GLY H 1 94 ARG HA 5.000 . 5.000 5.046 4.549 5.146 0.146 6 0 "[ . 1 . 2 . 3]" 3
1135 1 93 GLY H 1 94 ARG H 2.800 . 2.800 2.550 2.341 2.635 . 0 0 "[ . 1 . 2 . 3]" 3
1136 1 93 GLY QA 1 94 ARG H 5.000 . 5.000 2.676 2.568 2.738 . 0 0 "[ . 1 . 2 . 3]" 3
1137 1 94 ARG H 1 94 ARG QG 5.000 . 5.000 3.436 2.561 4.125 . 0 0 "[ . 1 . 2 . 3]" 3
1138 1 94 ARG HA 1 95 LEU H 5.000 . 5.000 3.085 2.939 3.593 . 0 0 "[ . 1 . 2 . 3]" 3
1139 1 94 ARG H 1 95 LEU H 3.500 . 3.500 2.788 2.323 3.000 . 0 0 "[ . 1 . 2 . 3]" 3
1140 1 94 ARG HA 1 97 ASN H 5.000 . 5.000 4.330 4.158 5.085 0.085 13 0 "[ . 1 . 2 . 3]" 3
1141 1 94 ARG HA 1 97 ASN QB 5.000 . 5.000 5.045 4.936 5.089 0.089 23 0 "[ . 1 . 2 . 3]" 3
1142 1 94 ARG HA 1 97 ASN QD 5.000 . 5.000 5.003 4.861 5.015 0.015 23 0 "[ . 1 . 2 . 3]" 3
1143 1 95 LEU H 1 95 LEU HG 5.000 . 5.000 3.038 2.282 4.593 . 0 0 "[ . 1 . 2 . 3]" 3
1144 1 95 LEU H 1 95 LEU QD 5.000 . 5.000 3.396 2.975 3.602 . 0 0 "[ . 1 . 2 . 3]" 3
1145 1 95 LEU HA 1 96 THR H 3.500 . 3.500 2.857 2.180 3.057 . 0 0 "[ . 1 . 2 . 3]" 3
1146 1 95 LEU H 1 96 THR H 6.000 . 6.000 3.124 2.739 4.666 . 0 0 "[ . 1 . 2 . 3]" 3
1147 1 95 LEU QD 1 96 THR H 5.000 . 5.000 4.184 2.822 4.538 . 0 0 "[ . 1 . 2 . 3]" 3
1148 1 95 LEU HA 1 98 THR H 3.500 . 3.500 3.642 3.561 3.793 0.293 20 0 "[ . 1 . 2 . 3]" 3
1149 1 96 THR HA 1 97 ASN HA 5.000 . 5.000 4.651 4.615 4.676 . 0 0 "[ . 1 . 2 . 3]" 3
1150 1 96 THR HA 1 97 ASN H 5.000 . 5.000 3.620 3.604 3.641 . 0 0 "[ . 1 . 2 . 3]" 3
1151 1 96 THR HB 1 97 ASN HA 5.000 . 5.000 4.536 4.250 4.778 . 0 0 "[ . 1 . 2 . 3]" 3
1152 1 96 THR HB 1 97 ASN H 5.000 . 5.000 2.955 2.200 3.506 . 0 0 "[ . 1 . 2 . 3]" 3
1153 1 96 THR H 1 97 ASN H 3.500 . 3.500 2.346 2.172 3.542 0.042 7 0 "[ . 1 . 2 . 3]" 3
1154 1 96 THR H 1 98 THR HA 5.000 . 5.000 4.884 4.113 5.120 0.120 23 0 "[ . 1 . 2 . 3]" 3
1155 1 96 THR H 1 98 THR HB 5.000 . 5.000 4.360 3.828 5.138 0.138 24 0 "[ . 1 . 2 . 3]" 3
1156 1 96 THR H 1 98 THR H 3.500 . 3.500 3.103 2.254 3.458 . 0 0 "[ . 1 . 2 . 3]" 3
1157 1 96 THR H 1 98 THR MG 5.000 . 5.000 4.175 2.602 4.549 . 0 0 "[ . 1 . 2 . 3]" 3
1158 1 96 THR MG 1 98 THR H 5.000 . 5.000 5.019 4.811 5.141 0.141 20 0 "[ . 1 . 2 . 3]" 3
1159 1 96 THR H 1 99 PRO QD 5.000 . 5.000 4.875 4.371 5.121 0.121 26 0 "[ . 1 . 2 . 3]" 3
1160 1 97 ASN HA 1 98 THR H 3.500 . 3.500 3.051 2.976 3.242 . 0 0 "[ . 1 . 2 . 3]" 3
1161 1 97 ASN HA 1 98 THR MG 6.000 . 6.000 4.852 4.173 5.876 . 0 0 "[ . 1 . 2 . 3]" 3
1162 1 97 ASN H 1 98 THR H 3.500 . 3.500 2.837 2.636 2.925 . 0 0 "[ . 1 . 2 . 3]" 3
1163 1 97 ASN H 1 98 THR MG 5.000 . 5.000 4.721 4.024 5.091 0.091 24 0 "[ . 1 . 2 . 3]" 3
1164 1 97 ASN QB 1 98 THR H 5.000 . 5.000 3.803 3.621 3.858 . 0 0 "[ . 1 . 2 . 3]" 3
1165 1 97 ASN HA 1 99 PRO QD 5.000 . 5.000 2.636 2.471 2.932 . 0 0 "[ . 1 . 2 . 3]" 3
1166 1 97 ASN HA 1 100 ALA H 5.000 . 5.000 3.598 3.240 3.985 . 0 0 "[ . 1 . 2 . 3]" 3
1167 1 97 ASN HA 1 100 ALA MB 5.000 . 5.000 3.556 2.883 4.198 . 0 0 "[ . 1 . 2 . 3]" 3
1168 1 97 ASN QD 1 100 ALA MB 6.000 . 6.000 5.045 4.433 5.779 . 0 0 "[ . 1 . 2 . 3]" 3
1169 1 98 THR HA 1 99 PRO QD 3.500 . 3.500 3.589 3.561 3.622 0.122 28 0 "[ . 1 . 2 . 3]" 3
1170 1 98 THR HB 1 99 PRO QD 5.000 . 5.000 3.166 2.126 3.721 . 0 0 "[ . 1 . 2 . 3]" 3
1171 1 98 THR H 1 99 PRO QD 5.000 . 5.000 2.247 2.131 2.459 . 0 0 "[ . 1 . 2 . 3]" 3
1172 1 98 THR MG 1 99 PRO QD 5.000 . 5.000 2.442 1.722 3.654 . 0 0 "[ . 1 . 2 . 3]" 3
1173 1 98 THR HA 1 101 VAL HB 3.500 . 3.500 3.227 2.850 3.519 0.019 8 0 "[ . 1 . 2 . 3]" 3
1174 1 98 THR HA 1 101 VAL H 5.000 . 5.000 3.476 3.238 3.777 . 0 0 "[ . 1 . 2 . 3]" 3
1175 1 98 THR HA 1 101 VAL QG 5.000 . 5.000 2.620 2.168 3.309 . 0 0 "[ . 1 . 2 . 3]" 3
1176 1 98 THR MG 1 102 ILE MD 5.000 . 5.000 3.199 1.875 5.022 0.022 22 0 "[ . 1 . 2 . 3]" 3
1177 1 99 PRO HA 1 100 ALA H 5.000 . 5.000 3.595 3.589 3.601 . 0 0 "[ . 1 . 2 . 3]" 3
1178 1 99 PRO QD 1 100 ALA H 5.000 . 5.000 2.812 2.606 2.991 . 0 0 "[ . 1 . 2 . 3]" 3
1179 1 99 PRO QD 1 101 VAL H 5.000 . 5.000 4.454 4.311 4.622 . 0 0 "[ . 1 . 2 . 3]" 3
1180 1 99 PRO HA 1 102 ILE HB 3.500 . 3.500 2.850 2.235 3.521 0.021 29 0 "[ . 1 . 2 . 3]" 3
1181 1 99 PRO HA 1 102 ILE H 3.500 . 3.500 3.281 3.150 3.504 0.004 29 0 "[ . 1 . 2 . 3]" 3
1182 1 99 PRO HA 1 102 ILE MD 5.000 . 5.000 2.125 1.831 4.411 . 0 0 "[ . 1 . 2 . 3]" 3
1183 1 99 PRO QD 1 102 ILE H 6.000 . 6.000 5.320 4.942 5.604 . 0 0 "[ . 1 . 2 . 3]" 3
1184 1 100 ALA HA 1 101 VAL H 5.000 . 5.000 3.591 3.575 3.600 . 0 0 "[ . 1 . 2 . 3]" 3
1185 1 100 ALA H 1 101 VAL H 2.800 . 2.800 2.749 2.636 2.812 0.012 10 0 "[ . 1 . 2 . 3]" 3
1186 1 100 ALA H 1 101 VAL QG 5.000 . 5.000 4.065 3.992 4.132 . 0 0 "[ . 1 . 2 . 3]" 3
1187 1 100 ALA MB 1 101 VAL H 5.000 . 5.000 2.583 2.467 2.802 . 0 0 "[ . 1 . 2 . 3]" 3
1188 1 100 ALA H 1 102 ILE H 5.000 . 5.000 4.231 3.947 4.507 . 0 0 "[ . 1 . 2 . 3]" 3
1189 1 100 ALA HA 1 103 SER H 3.500 . 3.500 3.461 3.298 3.559 0.059 13 0 "[ . 1 . 2 . 3]" 3
1190 1 100 ALA HA 1 103 SER QB 3.500 . 3.500 2.840 2.333 3.286 . 0 0 "[ . 1 . 2 . 3]" 3
1191 1 101 VAL HA 1 102 ILE H 5.000 . 5.000 3.591 3.574 3.602 . 0 0 "[ . 1 . 2 . 3]" 3
1192 1 101 VAL HB 1 102 ILE H 5.000 . 5.000 2.668 2.522 2.857 . 0 0 "[ . 1 . 2 . 3]" 3
1193 1 101 VAL H 1 102 ILE H 2.800 . 2.800 2.689 2.558 2.810 0.010 29 0 "[ . 1 . 2 . 3]" 3
1194 1 101 VAL QG 1 102 ILE H 5.000 . 5.000 3.303 3.218 3.419 . 0 0 "[ . 1 . 2 . 3]" 3
1195 1 101 VAL H 1 103 SER H 5.000 . 5.000 4.214 3.981 4.458 . 0 0 "[ . 1 . 2 . 3]" 3
1196 1 101 VAL QG 1 103 SER H 5.000 . 5.000 4.700 4.551 4.923 . 0 0 "[ . 1 . 2 . 3]" 3
1197 1 101 VAL HA 1 104 ALA H 5.000 . 5.000 3.814 3.513 4.354 . 0 0 "[ . 1 . 2 . 3]" 3
1198 1 101 VAL HA 1 104 ALA MB 3.500 . 3.500 3.160 2.760 3.518 0.018 25 0 "[ . 1 . 2 . 3]" 3
1199 1 101 VAL HA 1 105 PHE H 6.000 . 6.000 4.851 4.164 5.420 . 0 0 "[ . 1 . 2 . 3]" 3
1200 1 102 ILE H 1 102 ILE MD 5.000 . 5.000 3.066 2.278 3.496 . 0 0 "[ . 1 . 2 . 3]" 3
1201 1 102 ILE H 1 102 ILE QG 5.000 . 5.000 2.154 2.112 2.510 . 0 0 "[ . 1 . 2 . 3]" 3
1202 1 102 ILE HA 1 103 SER H 5.000 . 5.000 3.597 3.585 3.614 . 0 0 "[ . 1 . 2 . 3]" 3
1203 1 102 ILE HB 1 103 SER H 5.000 . 5.000 2.703 2.465 2.872 . 0 0 "[ . 1 . 2 . 3]" 3
1204 1 102 ILE H 1 103 SER H 2.800 . 2.800 2.651 2.439 2.805 0.005 29 0 "[ . 1 . 2 . 3]" 3
1205 1 102 ILE MD 1 103 SER H 5.000 . 5.000 4.316 4.002 4.634 . 0 0 "[ . 1 . 2 . 3]" 3
1206 1 102 ILE MG 1 103 SER HA 5.000 . 5.000 3.643 3.502 3.759 . 0 0 "[ . 1 . 2 . 3]" 3
1207 1 102 ILE MG 1 103 SER H 5.000 . 5.000 3.558 3.427 3.680 . 0 0 "[ . 1 . 2 . 3]" 3
1208 1 102 ILE HA 1 105 PHE H 5.000 . 5.000 3.339 3.185 3.577 . 0 0 "[ . 1 . 2 . 3]" 3
1209 1 102 ILE HA 1 105 PHE QB 3.500 . 3.500 2.625 2.438 2.791 . 0 0 "[ . 1 . 2 . 3]" 3
1210 1 102 ILE HA 1 105 PHE QD 5.000 . 5.000 4.103 3.815 4.346 . 0 0 "[ . 1 . 2 . 3]" 3
1211 1 102 ILE HA 1 106 SER H 5.000 . 5.000 4.865 4.665 5.016 0.016 7 0 "[ . 1 . 2 . 3]" 3
1212 1 102 ILE MG 1 106 SER H 5.000 . 5.000 4.308 4.019 4.764 . 0 0 "[ . 1 . 2 . 3]" 3
1213 1 103 SER HA 1 104 ALA H 5.000 . 5.000 3.603 3.591 3.618 . 0 0 "[ . 1 . 2 . 3]" 3
1214 1 103 SER H 1 104 ALA H 2.800 . 2.800 2.831 2.804 2.867 0.067 29 0 "[ . 1 . 2 . 3]" 3
1215 1 103 SER H 1 104 ALA MB 5.000 . 5.000 4.397 4.312 4.452 . 0 0 "[ . 1 . 2 . 3]" 3
1216 1 103 SER QB 1 104 ALA H 5.000 . 5.000 2.556 2.340 3.323 . 0 0 "[ . 1 . 2 . 3]" 3
1217 1 103 SER HA 1 106 SER H 3.500 . 3.500 3.546 3.527 3.570 0.070 17 0 "[ . 1 . 2 . 3]" 3
1218 1 103 SER HA 1 106 SER QB 3.500 . 3.500 3.348 3.129 3.517 0.017 23 0 "[ . 1 . 2 . 3]" 3
1219 1 104 ALA HA 1 105 PHE H 5.000 . 5.000 3.580 3.572 3.587 . 0 0 "[ . 1 . 2 . 3]" 3
1220 1 104 ALA H 1 105 PHE H 2.800 . 2.800 2.774 2.728 2.809 0.009 23 0 "[ . 1 . 2 . 3]" 3
1221 1 104 ALA H 1 105 PHE QB 6.000 . 6.000 4.453 4.388 4.496 . 0 0 "[ . 1 . 2 . 3]" 3
1222 1 104 ALA MB 1 105 PHE H 5.000 . 5.000 2.685 2.605 2.767 . 0 0 "[ . 1 . 2 . 3]" 3
1223 1 104 ALA H 1 106 SER H 5.000 . 5.000 4.501 4.412 4.628 . 0 0 "[ . 1 . 2 . 3]" 3
1224 1 104 ALA MB 1 106 SER H 5.000 . 5.000 4.665 4.586 4.798 . 0 0 "[ . 1 . 2 . 3]" 3
1225 1 104 ALA HA 1 107 THR HB 3.500 . 3.500 2.999 2.631 3.386 . 0 0 "[ . 1 . 2 . 3]" 3
1226 1 104 ALA HA 1 107 THR H 3.500 . 3.500 3.276 3.087 3.353 . 0 0 "[ . 1 . 2 . 3]" 3
1227 1 104 ALA MB 1 107 THR HB 5.000 . 5.000 4.128 3.893 4.381 . 0 0 "[ . 1 . 2 . 3]" 3
1228 1 105 PHE H 1 105 PHE QD 5.000 . 5.000 4.112 3.966 4.157 . 0 0 "[ . 1 . 2 . 3]" 3
1229 1 105 PHE HA 1 106 SER H 5.000 . 5.000 3.601 3.594 3.609 . 0 0 "[ . 1 . 2 . 3]" 3
1230 1 105 PHE H 1 106 SER H 2.800 . 2.800 2.842 2.827 2.864 0.064 13 0 "[ . 1 . 2 . 3]" 3
1231 1 105 PHE QB 1 106 SER H 5.000 . 5.000 2.432 2.254 2.570 . 0 0 "[ . 1 . 2 . 3]" 3
1232 1 105 PHE QD 1 106 SER HA 5.000 . 5.000 3.084 2.887 3.558 . 0 0 "[ . 1 . 2 . 3]" 3
1233 1 105 PHE QD 1 106 SER H 5.000 . 5.000 3.591 3.425 3.905 . 0 0 "[ . 1 . 2 . 3]" 3
1234 1 105 PHE QD 1 106 SER QB 5.000 . 5.000 4.424 3.965 4.863 . 0 0 "[ . 1 . 2 . 3]" 3
1235 1 105 PHE QE 1 106 SER HA 6.000 . 6.000 4.930 4.632 5.459 . 0 0 "[ . 1 . 2 . 3]" 3
1236 1 105 PHE H 1 107 THR H 5.000 . 5.000 4.234 4.039 4.341 . 0 0 "[ . 1 . 2 . 3]" 3
1237 1 105 PHE HA 1 108 MET H 3.500 . 3.500 3.544 3.447 3.663 0.163 28 0 "[ . 1 . 2 . 3]" 3
1238 1 105 PHE HA 1 108 MET QB 3.500 . 3.500 2.761 2.499 3.398 . 0 0 "[ . 1 . 2 . 3]" 3
1239 1 105 PHE QD 1 108 MET QB 6.000 . 6.000 4.613 4.398 5.032 . 0 0 "[ . 1 . 2 . 3]" 3
1240 1 105 PHE QE 1 108 MET QB 6.000 . 6.000 5.477 5.213 5.868 . 0 0 "[ . 1 . 2 . 3]" 3
1241 1 105 PHE QD 1 109 MET H 5.000 . 5.000 4.013 3.756 4.576 . 0 0 "[ . 1 . 2 . 3]" 3
1242 1 105 PHE QD 1 109 MET QB 5.000 . 5.000 2.835 2.237 3.278 . 0 0 "[ . 1 . 2 . 3]" 3
1243 1 105 PHE QE 1 109 MET H 6.000 . 6.000 5.118 4.845 5.670 . 0 0 "[ . 1 . 2 . 3]" 3
1244 1 106 SER HA 1 107 THR H 5.000 . 5.000 3.587 3.521 3.595 . 0 0 "[ . 1 . 2 . 3]" 3
1245 1 106 SER H 1 107 THR HA 6.000 . 6.000 5.371 5.289 5.431 . 0 0 "[ . 1 . 2 . 3]" 3
1246 1 106 SER H 1 107 THR HB 6.000 . 6.000 5.272 4.975 5.546 . 0 0 "[ . 1 . 2 . 3]" 3
1247 1 106 SER H 1 107 THR H 2.800 . 2.800 2.696 2.601 2.763 . 0 0 "[ . 1 . 2 . 3]" 3
1248 1 106 SER H 1 107 THR MG 6.000 . 6.000 5.890 5.744 6.010 0.010 1 0 "[ . 1 . 2 . 3]" 3
1249 1 106 SER H 1 108 MET H 5.000 . 5.000 4.165 3.999 4.507 . 0 0 "[ . 1 . 2 . 3]" 3
1250 1 106 SER HA 1 109 MET H 3.500 . 3.500 3.554 3.528 3.648 0.148 14 0 "[ . 1 . 2 . 3]" 3
1251 1 107 THR HA 1 108 MET H 5.000 . 5.000 3.598 3.572 3.631 . 0 0 "[ . 1 . 2 . 3]" 3
1252 1 107 THR HB 1 108 MET H 5.000 . 5.000 2.746 2.547 2.997 . 0 0 "[ . 1 . 2 . 3]" 3
1253 1 107 THR H 1 108 MET H 2.800 . 2.800 2.599 2.338 2.694 . 0 0 "[ . 1 . 2 . 3]" 3
1254 1 107 THR MG 1 108 MET H 5.000 . 5.000 3.939 3.552 4.213 . 0 0 "[ . 1 . 2 . 3]" 3
1255 1 107 THR HA 1 110 SER H 3.500 . 3.500 3.619 3.570 3.699 0.199 28 0 "[ . 1 . 2 . 3]" 3
1256 1 107 THR HA 1 110 SER QB 3.500 . 3.500 3.391 3.044 3.511 0.011 17 0 "[ . 1 . 2 . 3]" 3
1257 1 108 MET H 1 108 MET QG 5.000 . 5.000 2.673 2.155 4.060 . 0 0 "[ . 1 . 2 . 3]" 3
1258 1 108 MET HA 1 109 MET H 5.000 . 5.000 3.589 3.568 3.605 . 0 0 "[ . 1 . 2 . 3]" 3
1259 1 108 MET H 1 109 MET H 2.800 . 2.800 2.562 2.444 2.648 . 0 0 "[ . 1 . 2 . 3]" 3
1260 1 108 MET QB 1 109 MET H 5.000 . 5.000 2.713 2.623 2.913 . 0 0 "[ . 1 . 2 . 3]" 3
1261 1 108 MET QG 1 109 MET H 5.000 . 5.000 4.192 3.905 4.663 . 0 0 "[ . 1 . 2 . 3]" 3
1262 1 108 MET HA 1 111 VAL HB 3.500 . 3.500 3.252 2.925 3.503 0.003 23 0 "[ . 1 . 2 . 3]" 3
1263 1 108 MET HA 1 111 VAL H 3.500 . 3.500 3.359 3.147 3.485 . 0 0 "[ . 1 . 2 . 3]" 3
1264 1 108 MET HA 1 111 VAL QG 5.000 . 5.000 2.752 2.474 3.032 . 0 0 "[ . 1 . 2 . 3]" 3
1265 1 109 MET H 1 109 MET QG 5.000 . 5.000 3.856 2.110 4.017 . 0 0 "[ . 1 . 2 . 3]" 3
1266 1 109 MET HA 1 110 SER H 5.000 . 5.000 3.621 3.601 3.629 . 0 0 "[ . 1 . 2 . 3]" 3
1267 1 109 MET H 1 110 SER H 2.800 . 2.800 2.812 2.770 2.832 0.032 23 0 "[ . 1 . 2 . 3]" 3
1268 1 109 MET QB 1 110 SER H 5.000 . 5.000 2.650 2.517 3.584 . 0 0 "[ . 1 . 2 . 3]" 3
1269 1 109 MET QG 1 110 SER H 5.000 . 5.000 3.748 2.107 4.273 . 0 0 "[ . 1 . 2 . 3]" 3
1270 1 109 MET HA 1 111 VAL H 5.000 . 5.000 4.092 4.008 4.217 . 0 0 "[ . 1 . 2 . 3]" 3
1271 1 109 MET HA 1 112 HIS H 5.000 . 5.000 3.284 3.212 3.345 . 0 0 "[ . 1 . 2 . 3]" 3
1272 1 109 MET HA 1 112 HIS QB 3.500 . 3.500 2.589 2.491 2.691 . 0 0 "[ . 1 . 2 . 3]" 3
1273 1 109 MET HA 1 112 HIS HD2 5.000 . 5.000 5.155 5.118 5.192 0.192 18 0 "[ . 1 . 2 . 3]" 3
1274 1 109 MET HA 1 112 HIS HE1 6.000 . 6.000 4.792 4.622 4.989 . 0 0 "[ . 1 . 2 . 3]" 3
1275 1 110 SER HA 1 111 VAL H 5.000 . 5.000 3.575 3.567 3.583 . 0 0 "[ . 1 . 2 . 3]" 3
1276 1 110 SER H 1 111 VAL H 2.800 . 2.800 2.807 2.706 2.845 0.045 25 0 "[ . 1 . 2 . 3]" 3
1277 1 110 SER QB 1 111 VAL H 5.000 . 5.000 2.872 2.701 3.544 . 0 0 "[ . 1 . 2 . 3]" 3
1278 1 110 SER H 1 112 HIS H 5.000 . 5.000 4.174 4.087 4.215 . 0 0 "[ . 1 . 2 . 3]" 3
1279 1 110 SER HA 1 113 ARG H 3.500 . 3.500 3.640 3.572 3.678 0.178 20 0 "[ . 1 . 2 . 3]" 3
1280 1 110 SER HA 1 113 ARG QB 3.500 . 3.500 3.498 3.327 3.545 0.045 18 0 "[ . 1 . 2 . 3]" 3
1281 1 110 SER HA 1 113 ARG QD 5.000 . 5.000 4.743 4.474 5.009 0.009 27 0 "[ . 1 . 2 . 3]" 3
1282 1 110 SER QB 1 113 ARG H 5.000 . 5.000 5.025 4.991 5.143 0.143 11 0 "[ . 1 . 2 . 3]" 3
1283 1 111 VAL HA 1 112 HIS H 5.000 . 5.000 3.478 3.445 3.524 . 0 0 "[ . 1 . 2 . 3]" 3
1284 1 111 VAL HB 1 112 HIS H 5.000 . 5.000 3.367 3.218 3.456 . 0 0 "[ . 1 . 2 . 3]" 3
1285 1 111 VAL H 1 112 HIS H 2.800 . 2.800 2.652 2.599 2.698 . 0 0 "[ . 1 . 2 . 3]" 3
1286 1 111 VAL QG 1 112 HIS H 5.000 . 5.000 3.622 3.568 3.660 . 0 0 "[ . 1 . 2 . 3]" 3
1287 1 111 VAL HA 1 114 GLY H 3.500 . 3.500 3.549 3.517 3.611 0.111 20 0 "[ . 1 . 2 . 3]" 3
1288 1 111 VAL QG 1 115 GLU H 5.000 . 5.000 4.371 3.182 5.022 0.022 5 0 "[ . 1 . 2 . 3]" 3
1289 1 112 HIS H 1 112 HIS HD2 5.000 . 5.000 5.269 5.254 5.286 0.286 14 0 "[ . 1 . 2 . 3]" 3
1290 1 112 HIS H 1 112 HIS HE1 5.000 . 5.000 5.077 5.045 5.118 0.118 14 0 "[ . 1 . 2 . 3]" 3
1291 1 112 HIS HA 1 113 ARG H 5.000 . 5.000 3.552 3.541 3.564 . 0 0 "[ . 1 . 2 . 3]" 3
1292 1 112 HIS H 1 113 ARG H 5.000 . 5.000 2.374 2.341 2.449 . 0 0 "[ . 1 . 2 . 3]" 3
1293 1 112 HIS QB 1 113 ARG H 5.000 . 5.000 3.560 3.517 3.606 . 0 0 "[ . 1 . 2 . 3]" 3
1294 1 112 HIS HD2 1 113 ARG HA 5.000 . 5.000 5.064 5.016 5.106 0.106 1 0 "[ . 1 . 2 . 3]" 3
1295 1 112 HIS HD2 1 113 ARG QD 6.000 . 6.000 5.764 5.147 6.008 0.008 23 0 "[ . 1 . 2 . 3]" 3
1296 1 112 HIS HE1 1 113 ARG HA 6.000 . 6.000 4.335 4.047 4.448 . 0 0 "[ . 1 . 2 . 3]" 3
1297 1 112 HIS HA 1 115 GLU H 5.000 . 5.000 4.434 3.997 5.048 0.048 4 0 "[ . 1 . 2 . 3]" 3
1298 1 113 ARG H 1 113 ARG QG 5.000 . 5.000 3.934 3.671 4.046 . 0 0 "[ . 1 . 2 . 3]" 3
1299 1 113 ARG HA 1 114 GLY H 5.000 . 5.000 3.589 3.535 3.600 . 0 0 "[ . 1 . 2 . 3]" 3
1300 1 113 ARG H 1 114 GLY H 3.500 . 3.500 2.372 2.310 2.717 . 0 0 "[ . 1 . 2 . 3]" 3
1301 1 113 ARG QB 1 114 GLY H 5.000 . 5.000 2.794 2.661 3.068 . 0 0 "[ . 1 . 2 . 3]" 3
1302 1 113 ARG QG 1 114 GLY H 5.000 . 5.000 4.258 3.928 4.601 . 0 0 "[ . 1 . 2 . 3]" 3
1303 1 113 ARG HA 1 116 VAL HB 5.000 . 5.000 4.243 2.381 5.051 0.051 20 0 "[ . 1 . 2 . 3]" 3
1304 1 114 GLY H 1 115 GLU H 3.500 . 3.500 2.880 2.343 3.280 . 0 0 "[ . 1 . 2 . 3]" 3
1305 1 114 GLY QA 1 115 GLU H 5.000 . 5.000 2.730 2.455 2.858 . 0 0 "[ . 1 . 2 . 3]" 3
1306 1 115 GLU H 1 115 GLU QG 5.000 . 5.000 3.580 2.168 4.297 . 0 0 "[ . 1 . 2 . 3]" 3
1307 1 115 GLU HA 1 116 VAL H 5.000 . 5.000 2.885 2.419 3.630 . 0 0 "[ . 1 . 2 . 3]" 3
1308 1 115 GLU H 1 116 VAL H 3.500 . 3.500 3.006 2.319 3.552 0.052 8 0 "[ . 1 . 2 . 3]" 3
1309 1 115 GLU QB 1 116 VAL H 5.000 . 5.000 3.660 2.302 4.101 . 0 0 "[ . 1 . 2 . 3]" 3
1310 1 115 GLU QG 1 116 VAL H 5.000 . 5.000 4.283 3.771 4.785 . 0 0 "[ . 1 . 2 . 3]" 3
1311 1 116 VAL HA 1 117 PRO QD 3.500 . 3.500 2.168 1.999 3.564 0.064 14 0 "[ . 1 . 2 . 3]" 3
1312 1 116 VAL H 1 117 PRO QD 5.000 . 5.000 3.466 2.036 4.420 . 0 0 "[ . 1 . 2 . 3]" 3
1313 1 116 VAL QG 1 117 PRO QD 5.000 . 5.000 2.860 1.848 3.467 . 0 0 "[ . 1 . 2 . 3]" 3
1314 1 117 PRO HA 1 118 CYS H 5.000 . 5.000 2.609 2.262 3.618 . 0 0 "[ . 1 . 2 . 3]" 3
1315 1 117 PRO QB 1 118 CYS H 5.000 . 5.000 3.026 2.148 3.921 . 0 0 "[ . 1 . 2 . 3]" 3
1316 1 118 CYS HA 1 119 THR H 5.000 . 5.000 2.517 2.254 3.627 . 0 0 "[ . 1 . 2 . 3]" 3
1317 1 118 CYS QB 1 119 THR H 5.000 . 5.000 3.492 2.140 4.100 . 0 0 "[ . 1 . 2 . 3]" 3
1318 1 119 THR HA 1 120 VAL H 5.000 . 5.000 2.573 2.252 3.633 . 0 0 "[ . 1 . 2 . 3]" 3
1319 1 119 THR HB 1 120 VAL H 5.000 . 5.000 3.772 2.162 4.676 . 0 0 "[ . 1 . 2 . 3]" 3
1320 1 119 THR MG 1 120 VAL H 5.000 . 5.000 3.487 2.107 4.410 . 0 0 "[ . 1 . 2 . 3]" 3
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