NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
418082 |
2dw3   |
10024 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2dw3
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 471
_Distance_constraint_stats_list.Viol_count 66
_Distance_constraint_stats_list.Viol_total 20.872
_Distance_constraint_stats_list.Viol_max 0.160
_Distance_constraint_stats_list.Viol_rms 0.0079
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0009
_Distance_constraint_stats_list.Viol_average_violations_only 0.0452
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 3 LYS 0.000 0.000 . 0 "[ . ]"
1 4 THR 0.019 0.019 6 0 "[ . ]"
1 5 ILE 0.000 0.000 . 0 "[ . ]"
1 6 PHE 0.019 0.019 6 0 "[ . ]"
1 7 ASN 0.000 0.000 . 0 "[ . ]"
1 8 ASP 0.000 0.000 . 0 "[ . ]"
1 9 HIS 0.000 0.000 . 0 "[ . ]"
1 10 LEU 0.000 0.000 . 0 "[ . ]"
1 11 ASN 0.000 0.000 . 0 "[ . ]"
1 12 THR 0.000 0.000 . 0 "[ . ]"
1 13 ASN 0.082 0.037 4 0 "[ . ]"
1 14 PRO 0.000 0.000 . 0 "[ . ]"
1 15 LYS 0.201 0.105 7 0 "[ . ]"
1 16 THR 0.082 0.037 4 0 "[ . ]"
1 17 ASN 0.037 0.037 7 0 "[ . ]"
1 18 LEU 0.164 0.105 7 0 "[ . ]"
1 19 ARG 0.000 0.000 . 0 "[ . ]"
1 20 LEU 0.000 0.000 . 0 "[ . ]"
1 21 TRP 0.000 0.000 . 0 "[ . ]"
1 22 VAL 0.082 0.040 5 0 "[ . ]"
1 23 ALA 0.000 0.000 . 0 "[ . ]"
1 24 PHE 0.040 0.040 5 0 "[ . ]"
1 25 GLN 0.012 0.012 5 0 "[ . ]"
1 26 MET 0.082 0.042 5 0 "[ . ]"
1 27 MET 0.095 0.054 7 0 "[ . ]"
1 28 LYS 0.297 0.073 3 0 "[ . ]"
1 29 GLY 0.000 0.000 . 0 "[ . ]"
1 30 ALA 0.151 0.063 7 0 "[ . ]"
1 31 GLY 0.000 0.000 . 0 "[ . ]"
1 32 TRP 0.619 0.117 5 0 "[ . ]"
1 33 ALA 0.165 0.071 5 0 "[ . ]"
1 34 GLY 0.114 0.057 5 0 "[ . ]"
1 35 GLY 0.430 0.117 5 0 "[ . ]"
1 36 VAL 0.150 0.071 5 0 "[ . ]"
1 37 PHE 0.030 0.018 2 0 "[ . ]"
1 38 PHE 0.132 0.057 5 0 "[ . ]"
1 39 GLY 0.000 0.000 . 0 "[ . ]"
1 40 THR 0.013 0.013 4 0 "[ . ]"
1 41 LEU 0.000 0.000 . 0 "[ . ]"
1 42 LEU 0.000 0.000 . 0 "[ . ]"
1 43 LEU 0.000 0.000 . 0 "[ . ]"
1 44 ILE 0.000 0.000 . 0 "[ . ]"
1 45 GLY 0.000 0.000 . 0 "[ . ]"
1 46 PHE 0.000 0.000 . 0 "[ . ]"
1 47 PHE 0.000 0.000 . 0 "[ . ]"
1 48 ARG 0.293 0.127 5 0 "[ . ]"
1 49 VAL 0.215 0.107 3 0 "[ . ]"
1 50 VAL 0.135 0.125 5 0 "[ . ]"
1 51 GLY 0.340 0.160 7 0 "[ . ]"
1 52 ARG 0.401 0.127 5 0 "[ . ]"
1 53 MET 0.287 0.125 5 0 "[ . ]"
1 54 LEU 0.340 0.160 7 0 "[ . ]"
1 55 PRO 0.119 0.043 7 0 "[ . ]"
1 56 ILE 0.108 0.066 4 0 "[ . ]"
1 57 GLN 0.101 0.066 4 0 "[ . ]"
1 58 GLU 0.096 0.060 6 0 "[ . ]"
1 59 ASN 0.028 0.028 4 0 "[ . ]"
1 60 GLN 0.088 0.060 6 0 "[ . ]"
1 61 ALA 0.057 0.036 6 0 "[ . ]"
1 62 PRO 0.000 0.000 . 0 "[ . ]"
1 63 ALA 0.057 0.036 6 0 "[ . ]"
1 64 PRO 0.000 0.000 . 0 "[ . ]"
1 65 ASN 0.000 0.000 . 0 "[ . ]"
1 66 ILE 0.049 0.049 3 0 "[ . ]"
1 67 THR 0.049 0.049 3 0 "[ . ]"
1 68 GLY 0.000 0.000 . 0 "[ . ]"
1 69 ALA 0.000 0.000 . 0 "[ . ]"
1 70 LEU 0.000 0.000 . 0 "[ . ]"
1 71 GLU 0.000 0.000 . 0 "[ . ]"
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 3 LYS H 1 4 THR H 4.000 . 5.500 3.484 2.258 4.476 . 0 0 "[ . ]" 1
2 1 4 THR H 1 4 THR HB 4.000 . 5.500 3.402 2.637 3.818 . 0 0 "[ . ]" 1
3 1 4 THR H 1 5 ILE H 4.000 . 5.500 3.456 1.971 4.583 . 0 0 "[ . ]" 1
4 1 4 THR HA 1 5 ILE H 4.000 . 5.500 2.758 2.130 3.555 . 0 0 "[ . ]" 1
5 1 4 THR HB 1 5 ILE H 3.000 . 4.500 3.477 2.240 4.247 . 0 0 "[ . ]" 1
6 1 4 THR HB 1 6 PHE H 4.500 . 6.000 5.165 3.372 6.019 0.019 6 0 "[ . ]" 1
7 1 5 ILE H 1 5 ILE HB 4.000 . 5.500 3.139 2.771 3.949 . 0 0 "[ . ]" 1
8 1 5 ILE H 1 5 ILE QG 4.000 . 5.500 3.454 2.076 4.386 . 0 0 "[ . ]" 1
9 1 5 ILE H 1 5 ILE MG 4.000 . 5.500 3.428 2.336 4.023 . 0 0 "[ . ]" 1
10 1 5 ILE H 1 6 PHE H 4.000 . 5.500 3.289 2.011 4.703 . 0 0 "[ . ]" 1
11 1 5 ILE HA 1 6 PHE H 4.000 . 5.500 3.026 2.619 3.573 . 0 0 "[ . ]" 1
12 1 6 PHE H 1 6 PHE HB2 4.000 . 5.500 3.253 2.885 3.642 . 0 0 "[ . ]" 1
13 1 6 PHE H 1 6 PHE HB3 4.000 . 5.500 3.670 2.811 4.102 . 0 0 "[ . ]" 1
14 1 6 PHE H 1 7 ASN H 4.000 . 5.500 3.546 2.616 4.583 . 0 0 "[ . ]" 1
15 1 6 PHE HA 1 7 ASN H 4.000 . 5.500 2.995 2.223 3.584 . 0 0 "[ . ]" 1
16 1 6 PHE HB3 1 7 ASN H 4.000 . 5.500 3.031 2.130 4.363 . 0 0 "[ . ]" 1
17 1 7 ASN H 1 8 ASP H 4.000 . 5.500 3.335 2.492 4.465 . 0 0 "[ . ]" 1
18 1 7 ASN HA 1 8 ASP H 4.000 . 5.500 3.276 2.450 3.564 . 0 0 "[ . ]" 1
19 1 8 ASP H 1 9 HIS H 4.000 . 5.500 3.415 2.659 4.232 . 0 0 "[ . ]" 1
20 1 8 ASP HA 1 9 HIS H 4.000 . 5.500 2.462 2.123 3.557 . 0 0 "[ . ]" 1
21 1 8 ASP QB 1 9 HIS H 4.000 . 5.500 3.509 2.537 3.861 . 0 0 "[ . ]" 1
22 1 9 HIS H 1 9 HIS HA 3.000 . 4.500 2.441 2.273 2.841 . 0 0 "[ . ]" 1
23 1 9 HIS H 1 10 LEU H 4.000 . 5.500 3.661 2.656 4.578 . 0 0 "[ . ]" 1
24 1 9 HIS HA 1 10 LEU H 4.000 . 5.500 3.072 2.302 3.559 . 0 0 "[ . ]" 1
25 1 10 LEU H 1 10 LEU QB 3.000 . 4.500 3.024 2.072 3.464 . 0 0 "[ . ]" 1
26 1 10 LEU H 1 11 ASN H 4.000 . 4.500 3.230 2.452 3.855 . 0 0 "[ . ]" 1
27 1 11 ASN H 1 12 THR H 4.000 . 5.500 3.491 2.530 4.658 . 0 0 "[ . ]" 1
28 1 11 ASN QB 1 12 THR H 4.000 . 5.500 2.937 2.197 3.805 . 0 0 "[ . ]" 1
29 1 12 THR H 1 12 THR HB 3.000 . 4.500 3.488 2.687 3.856 . 0 0 "[ . ]" 1
30 1 12 THR H 1 12 THR HG1 4.000 . 5.500 3.468 2.767 4.494 . 0 0 "[ . ]" 1
31 1 12 THR H 1 12 THR MG 4.000 . 5.500 3.417 1.937 4.024 . 0 0 "[ . ]" 1
32 1 12 THR H 1 13 ASN H 4.000 . 5.500 3.903 2.616 4.640 . 0 0 "[ . ]" 1
33 1 12 THR HA 1 13 ASN H 4.000 . 5.500 2.979 2.146 3.566 . 0 0 "[ . ]" 1
34 1 12 THR HB 1 13 ASN H 3.000 . 4.500 3.036 1.859 4.358 . 0 0 "[ . ]" 1
35 1 13 ASN H 1 13 ASN HB2 4.000 . 5.500 3.132 2.625 3.468 . 0 0 "[ . ]" 1
36 1 13 ASN H 1 13 ASN HB3 4.000 . 5.500 3.818 3.176 4.142 . 0 0 "[ . ]" 1
37 1 13 ASN H 1 16 THR H 4.500 . 6.000 5.461 2.984 6.037 0.037 4 0 "[ . ]" 1
38 1 13 ASN HB3 1 16 THR H 4.000 . 5.500 4.060 2.531 5.534 0.034 7 0 "[ . ]" 1
39 1 14 PRO HA 1 15 LYS H 4.000 . 5.500 3.524 3.453 3.570 . 0 0 "[ . ]" 1
40 1 14 PRO QB 1 15 LYS H 4.000 . 5.500 2.846 2.467 3.286 . 0 0 "[ . ]" 1
41 1 14 PRO QD 1 15 LYS H 4.000 . 5.500 2.756 2.293 3.124 . 0 0 "[ . ]" 1
42 1 14 PRO QG 1 15 LYS H 4.000 . 5.500 3.228 1.942 4.042 . 0 0 "[ . ]" 1
43 1 15 LYS H 1 15 LYS HA 3.000 . 4.500 2.813 2.728 2.927 . 0 0 "[ . ]" 1
44 1 15 LYS H 1 15 LYS QB 3.000 . 4.500 2.342 2.065 2.935 . 0 0 "[ . ]" 1
45 1 15 LYS H 1 15 LYS QG 4.000 . 5.500 3.394 2.329 3.903 . 0 0 "[ . ]" 1
46 1 15 LYS H 1 16 THR H 4.000 . 5.500 2.573 1.855 2.922 . 0 0 "[ . ]" 1
47 1 15 LYS H 1 17 ASN H 4.000 . 5.500 4.626 4.061 5.537 0.037 7 0 "[ . ]" 1
48 1 15 LYS H 1 18 LEU H 4.000 . 5.500 5.079 4.682 5.605 0.105 7 0 "[ . ]" 1
49 1 15 LYS HA 1 16 THR H 4.000 . 5.500 3.537 3.481 3.573 . 0 0 "[ . ]" 1
50 1 15 LYS HA 1 18 LEU H 4.000 . 5.500 3.821 3.633 4.113 . 0 0 "[ . ]" 1
51 1 15 LYS QB 1 16 THR H 4.000 . 5.500 2.750 2.526 3.248 . 0 0 "[ . ]" 1
52 1 16 THR H 1 16 THR HB 4.000 . 5.500 3.156 2.447 3.941 . 0 0 "[ . ]" 1
53 1 16 THR H 1 16 THR HG1 4.000 . 5.500 3.489 2.148 4.482 . 0 0 "[ . ]" 1
54 1 16 THR H 1 16 THR MG 4.000 . 5.500 3.101 2.357 3.903 . 0 0 "[ . ]" 1
55 1 16 THR H 1 17 ASN H 4.000 . 5.500 3.054 2.526 4.245 . 0 0 "[ . ]" 1
56 1 16 THR H 1 18 LEU H 4.000 . 5.500 4.383 4.038 4.782 . 0 0 "[ . ]" 1
57 1 16 THR HA 1 17 ASN H 4.000 . 5.500 3.522 3.485 3.558 . 0 0 "[ . ]" 1
58 1 16 THR HB 1 17 ASN H 4.000 . 5.500 2.881 1.804 3.945 . 0 0 "[ . ]" 1
59 1 16 THR MG 1 17 ASN H 4.000 . 5.500 3.304 2.147 4.146 . 0 0 "[ . ]" 1
60 1 17 ASN H 1 17 ASN HA 3.000 . 4.500 2.817 2.805 2.829 . 0 0 "[ . ]" 1
61 1 17 ASN H 1 17 ASN QB 3.000 . 4.500 2.257 2.156 2.390 . 0 0 "[ . ]" 1
62 1 17 ASN H 1 18 LEU H 4.000 . 4.500 2.701 2.623 2.839 . 0 0 "[ . ]" 1
63 1 17 ASN H 1 18 LEU QB 4.000 . 5.500 4.453 4.353 4.677 . 0 0 "[ . ]" 1
64 1 17 ASN H 1 19 ARG H 4.000 . 5.500 4.158 3.973 4.530 . 0 0 "[ . ]" 1
65 1 17 ASN HA 1 18 LEU H 4.000 . 5.500 3.546 3.535 3.569 . 0 0 "[ . ]" 1
66 1 17 ASN HA 1 20 LEU H 4.000 . 5.500 3.741 3.491 3.866 . 0 0 "[ . ]" 1
67 1 17 ASN HA 1 21 TRP H 4.000 . 5.500 3.961 3.736 4.188 . 0 0 "[ . ]" 1
68 1 17 ASN QB 1 18 LEU H 4.000 . 5.500 2.519 2.316 2.746 . 0 0 "[ . ]" 1
69 1 18 LEU H 1 18 LEU HA 3.000 . 4.500 2.814 2.795 2.835 . 0 0 "[ . ]" 1
70 1 18 LEU H 1 18 LEU QB 3.000 . 4.500 2.170 2.045 2.404 . 0 0 "[ . ]" 1
71 1 18 LEU H 1 18 LEU MD1 4.000 . 5.500 3.871 3.247 4.178 . 0 0 "[ . ]" 1
72 1 18 LEU H 1 18 LEU MD2 4.000 . 5.500 3.926 3.168 4.389 . 0 0 "[ . ]" 1
73 1 18 LEU H 1 19 ARG H 4.000 . 5.500 2.694 2.554 2.805 . 0 0 "[ . ]" 1
74 1 18 LEU H 1 21 TRP H 4.000 . 5.500 4.700 4.586 4.789 . 0 0 "[ . ]" 1
75 1 18 LEU HA 1 19 ARG H 4.000 . 5.500 3.540 3.512 3.567 . 0 0 "[ . ]" 1
76 1 18 LEU QB 1 19 ARG H 3.000 . 4.500 2.541 2.286 2.717 . 0 0 "[ . ]" 1
77 1 18 LEU QB 1 22 VAL H 4.000 . 5.500 4.887 4.531 5.157 . 0 0 "[ . ]" 1
78 1 18 LEU MD1 1 19 ARG H 4.000 . 5.500 4.522 3.957 4.789 . 0 0 "[ . ]" 1
79 1 18 LEU MD2 1 22 VAL H 4.000 . 5.500 4.399 3.446 5.145 . 0 0 "[ . ]" 1
80 1 19 ARG H 1 19 ARG QB 3.000 . 4.500 2.187 2.052 2.250 . 0 0 "[ . ]" 1
81 1 19 ARG H 1 20 LEU H 4.000 . 5.500 2.782 2.654 2.894 . 0 0 "[ . ]" 1
82 1 19 ARG H 1 21 TRP H 4.000 . 5.500 4.071 3.806 4.234 . 0 0 "[ . ]" 1
83 1 19 ARG HA 1 20 LEU H 3.000 . 4.500 3.557 3.533 3.580 . 0 0 "[ . ]" 1
84 1 19 ARG HA 1 22 VAL H 4.000 . 5.500 3.820 3.733 4.085 . 0 0 "[ . ]" 1
85 1 19 ARG QB 1 20 LEU H 3.000 . 4.500 2.368 1.938 2.705 . 0 0 "[ . ]" 1
86 1 20 LEU H 1 20 LEU HA 3.000 . 4.500 2.805 2.785 2.819 . 0 0 "[ . ]" 1
87 1 20 LEU H 1 20 LEU QB 3.000 . 4.500 2.260 2.032 2.531 . 0 0 "[ . ]" 1
88 1 20 LEU H 1 20 LEU MD1 4.000 . 5.500 3.467 2.961 3.841 . 0 0 "[ . ]" 1
89 1 20 LEU H 1 20 LEU MD2 4.000 . 5.500 3.805 2.967 4.311 . 0 0 "[ . ]" 1
90 1 20 LEU H 1 21 TRP H 4.000 . 5.500 2.692 2.676 2.705 . 0 0 "[ . ]" 1
91 1 20 LEU H 1 22 VAL H 4.000 . 5.500 4.529 4.359 4.828 . 0 0 "[ . ]" 1
92 1 20 LEU QB 1 21 TRP H 4.000 . 5.500 2.860 2.543 3.547 . 0 0 "[ . ]" 1
93 1 20 LEU MD2 1 21 TRP H 4.000 . 5.500 4.346 3.824 4.806 . 0 0 "[ . ]" 1
94 1 21 TRP H 1 21 TRP HA 3.000 . 4.500 2.807 2.799 2.814 . 0 0 "[ . ]" 1
95 1 21 TRP H 1 21 TRP HB2 4.000 . 5.500 2.224 2.076 2.419 . 0 0 "[ . ]" 1
96 1 21 TRP H 1 21 TRP HB3 3.000 . 4.500 2.972 2.663 3.315 . 0 0 "[ . ]" 1
97 1 21 TRP H 1 22 VAL H 4.000 . 4.500 2.833 2.763 2.913 . 0 0 "[ . ]" 1
98 1 21 TRP H 1 24 PHE H 4.000 . 5.500 4.743 4.655 4.812 . 0 0 "[ . ]" 1
99 1 21 TRP HA 1 22 VAL H 4.000 . 5.500 3.569 3.562 3.576 . 0 0 "[ . ]" 1
100 1 21 TRP HB3 1 22 VAL H 4.000 . 5.500 2.388 2.118 2.717 . 0 0 "[ . ]" 1
101 1 21 TRP HD1 1 22 VAL H 4.000 . 5.500 4.659 4.019 5.298 . 0 0 "[ . ]" 1
102 1 22 VAL H 1 22 VAL HA 3.000 . 4.500 2.804 2.795 2.814 . 0 0 "[ . ]" 1
103 1 22 VAL H 1 22 VAL HB 3.000 . 4.500 2.788 2.621 3.617 . 0 0 "[ . ]" 1
104 1 22 VAL H 1 22 VAL MG1 3.000 . 4.500 3.557 2.284 3.776 . 0 0 "[ . ]" 1
105 1 22 VAL H 1 22 VAL MG2 4.000 . 5.500 2.102 1.921 2.218 . 0 0 "[ . ]" 1
106 1 22 VAL H 1 23 ALA H 3.000 . 4.500 2.757 2.693 2.818 . 0 0 "[ . ]" 1
107 1 22 VAL H 1 25 GLN HB2 4.000 . 5.500 5.073 4.821 5.334 . 0 0 "[ . ]" 1
108 1 22 VAL H 1 25 GLN HB3 4.000 . 5.500 5.371 5.180 5.512 0.012 5 0 "[ . ]" 1
109 1 22 VAL HA 1 23 ALA H 4.000 . 5.500 3.555 3.531 3.570 . 0 0 "[ . ]" 1
110 1 22 VAL HA 1 25 GLN H 4.000 . 5.500 3.688 3.543 3.983 . 0 0 "[ . ]" 1
111 1 22 VAL HB 1 23 ALA H 3.000 . 4.500 2.651 2.398 3.475 . 0 0 "[ . ]" 1
112 1 22 VAL HB 1 24 PHE H 4.000 . 5.500 5.264 5.141 5.540 0.040 5 0 "[ . ]" 1
113 1 22 VAL MG1 1 23 ALA H 4.000 . 5.500 3.579 3.403 3.890 . 0 0 "[ . ]" 1
114 1 22 VAL MG2 1 23 ALA H 4.000 . 5.500 3.457 1.880 3.767 . 0 0 "[ . ]" 1
115 1 22 VAL MG2 1 26 MET H 4.000 . 5.500 5.418 5.061 5.523 0.023 3 0 "[ . ]" 1
116 1 23 ALA H 1 23 ALA MB 3.000 . 4.500 2.096 2.026 2.228 . 0 0 "[ . ]" 1
117 1 23 ALA H 1 24 PHE H 4.000 . 5.500 2.839 2.742 2.911 . 0 0 "[ . ]" 1
118 1 23 ALA H 1 24 PHE QB 4.000 . 5.500 4.558 4.447 4.747 . 0 0 "[ . ]" 1
119 1 23 ALA HA 1 24 PHE H 4.000 . 5.500 3.566 3.542 3.579 . 0 0 "[ . ]" 1
120 1 23 ALA HA 1 25 GLN H 4.000 . 5.500 4.604 4.382 4.867 . 0 0 "[ . ]" 1
121 1 23 ALA MB 1 24 PHE H 3.000 . 4.500 2.405 2.236 2.692 . 0 0 "[ . ]" 1
122 1 24 PHE H 1 24 PHE HB2 4.000 . 5.500 2.156 2.090 2.340 . 0 0 "[ . ]" 1
123 1 24 PHE H 1 24 PHE HB3 3.000 . 4.500 3.301 3.043 3.570 . 0 0 "[ . ]" 1
124 1 24 PHE H 1 24 PHE QD 4.000 . 5.500 3.189 1.892 3.886 . 0 0 "[ . ]" 1
125 1 24 PHE H 1 25 GLN H 4.000 . 5.500 2.710 2.644 2.786 . 0 0 "[ . ]" 1
126 1 24 PHE H 1 25 GLN QB 4.000 . 5.500 4.438 4.389 4.500 . 0 0 "[ . ]" 1
127 1 24 PHE HA 1 25 GLN H 4.000 . 5.500 3.543 3.525 3.561 . 0 0 "[ . ]" 1
128 1 24 PHE HA 1 27 MET H 4.000 . 5.500 3.793 3.564 4.161 . 0 0 "[ . ]" 1
129 1 24 PHE HA 1 28 LYS H 4.000 . 5.500 3.257 2.369 3.968 . 0 0 "[ . ]" 1
130 1 24 PHE HB2 1 25 GLN H 4.000 . 5.500 3.095 2.691 3.432 . 0 0 "[ . ]" 1
131 1 24 PHE HB3 1 25 GLN H 4.000 . 5.500 2.983 2.689 3.604 . 0 0 "[ . ]" 1
132 1 25 GLN H 1 25 GLN HA 3.000 . 4.500 2.808 2.796 2.820 . 0 0 "[ . ]" 1
133 1 25 GLN H 1 25 GLN HB2 3.000 . 4.500 2.284 2.171 2.408 . 0 0 "[ . ]" 1
134 1 25 GLN H 1 25 GLN HB3 2.000 . 3.500 2.800 2.621 2.958 . 0 0 "[ . ]" 1
135 1 25 GLN H 1 26 MET H 4.000 . 5.500 2.770 2.640 2.964 . 0 0 "[ . ]" 1
136 1 25 GLN H 1 28 LYS QB 4.000 . 5.500 4.838 4.454 5.212 . 0 0 "[ . ]" 1
137 1 25 GLN HA 1 26 MET H 4.000 . 5.500 3.554 3.530 3.575 . 0 0 "[ . ]" 1
138 1 25 GLN HB2 1 26 MET H 4.000 . 5.500 3.580 3.368 3.736 . 0 0 "[ . ]" 1
139 1 26 MET H 1 26 MET HA 3.000 . 4.500 2.827 2.819 2.834 . 0 0 "[ . ]" 1
140 1 26 MET H 1 26 MET HB2 4.000 . 5.500 2.261 2.072 2.515 . 0 0 "[ . ]" 1
141 1 26 MET H 1 26 MET HB3 4.000 . 5.500 3.144 2.502 3.581 . 0 0 "[ . ]" 1
142 1 26 MET H 1 26 MET HG2 3.000 . 4.500 3.854 2.377 4.542 0.042 5 0 "[ . ]" 1
143 1 26 MET H 1 26 MET HG3 3.000 . 4.500 4.066 3.513 4.489 . 0 0 "[ . ]" 1
144 1 26 MET H 1 27 MET H 4.000 . 5.500 2.708 2.607 2.781 . 0 0 "[ . ]" 1
145 1 26 MET H 1 28 LYS H 4.000 . 5.500 4.533 4.349 4.682 . 0 0 "[ . ]" 1
146 1 26 MET H 1 28 LYS QB 4.000 . 5.500 5.375 5.170 5.497 . 0 0 "[ . ]" 1
147 1 26 MET H 1 30 ALA H 4.000 . 5.500 5.263 5.100 5.435 . 0 0 "[ . ]" 1
148 1 26 MET HA 1 29 GLY H 4.000 . 5.500 4.145 3.907 4.372 . 0 0 "[ . ]" 1
149 1 27 MET H 1 27 MET HA 3.000 . 4.500 2.819 2.811 2.827 . 0 0 "[ . ]" 1
150 1 27 MET H 1 27 MET HB2 4.000 . 5.500 2.187 2.063 2.345 . 0 0 "[ . ]" 1
151 1 27 MET H 1 27 MET HB3 4.000 . 5.500 3.296 2.932 3.569 . 0 0 "[ . ]" 1
152 1 27 MET H 1 27 MET HG2 3.000 . 4.500 4.100 3.337 4.554 0.054 7 0 "[ . ]" 1
153 1 27 MET H 1 27 MET HG3 3.000 . 4.500 3.467 2.599 4.494 . 0 0 "[ . ]" 1
154 1 27 MET H 1 28 LYS H 4.000 . 5.500 2.862 2.753 2.973 . 0 0 "[ . ]" 1
155 1 27 MET H 1 28 LYS HA 4.000 . 5.500 5.398 5.335 5.463 . 0 0 "[ . ]" 1
156 1 27 MET H 1 28 LYS QB 4.000 . 5.500 4.586 4.494 4.707 . 0 0 "[ . ]" 1
157 1 27 MET H 1 30 ALA MB 4.000 . 5.500 4.830 4.660 4.945 . 0 0 "[ . ]" 1
158 1 27 MET HA 1 28 LYS H 4.000 . 5.500 3.571 3.562 3.579 . 0 0 "[ . ]" 1
159 1 27 MET HA 1 31 GLY H 4.000 . 5.500 3.585 3.335 3.894 . 0 0 "[ . ]" 1
160 1 27 MET HG2 1 28 LYS H 4.000 . 5.500 4.677 4.393 4.938 . 0 0 "[ . ]" 1
161 1 27 MET HG3 1 28 LYS H 4.000 . 5.500 4.563 4.031 4.939 . 0 0 "[ . ]" 1
162 1 28 LYS H 1 28 LYS QB 3.000 . 4.500 2.160 2.052 2.288 . 0 0 "[ . ]" 1
163 1 28 LYS H 1 28 LYS QD 4.000 . 5.500 4.185 3.608 4.515 . 0 0 "[ . ]" 1
164 1 28 LYS H 1 28 LYS QG 4.000 . 5.500 3.607 2.601 3.984 . 0 0 "[ . ]" 1
165 1 28 LYS H 1 29 GLY H 4.000 . 5.500 2.717 2.673 2.785 . 0 0 "[ . ]" 1
166 1 28 LYS H 1 30 ALA MB 4.000 . 5.500 5.476 5.293 5.563 0.063 7 0 "[ . ]" 1
167 1 28 LYS H 1 32 TRP H 4.000 . 5.500 5.470 5.261 5.573 0.073 3 0 "[ . ]" 1
168 1 28 LYS QB 1 29 GLY H 4.000 . 5.500 2.537 2.206 2.754 . 0 0 "[ . ]" 1
169 1 28 LYS QD 1 29 GLY H 4.000 . 5.500 4.720 4.195 5.162 . 0 0 "[ . ]" 1
170 1 29 GLY H 1 30 ALA H 4.000 . 5.500 3.038 2.990 3.173 . 0 0 "[ . ]" 1
171 1 29 GLY H 1 30 ALA MB 4.000 . 5.500 4.589 4.527 4.716 . 0 0 "[ . ]" 1
172 1 29 GLY QA 1 30 ALA H 4.000 . 5.500 2.456 2.392 2.482 . 0 0 "[ . ]" 1
173 1 30 ALA H 1 30 ALA HA 3.000 . 4.500 2.802 2.793 2.813 . 0 0 "[ . ]" 1
174 1 30 ALA H 1 30 ALA MB 3.000 . 4.500 2.140 2.025 2.229 . 0 0 "[ . ]" 1
175 1 30 ALA H 1 31 GLY H 4.000 . 5.500 2.715 2.652 2.787 . 0 0 "[ . ]" 1
176 1 30 ALA HA 1 31 GLY H 4.000 . 5.500 3.531 3.490 3.563 . 0 0 "[ . ]" 1
177 1 30 ALA HA 1 33 ALA H 4.000 . 5.500 4.418 3.872 5.099 . 0 0 "[ . ]" 1
178 1 30 ALA HA 1 34 GLY H 4.000 . 5.500 3.150 2.871 3.615 . 0 0 "[ . ]" 1
179 1 30 ALA MB 1 31 GLY H 4.000 . 5.500 2.671 2.507 2.821 . 0 0 "[ . ]" 1
180 1 31 GLY H 1 32 TRP H 4.000 . 5.500 2.996 2.711 3.166 . 0 0 "[ . ]" 1
181 1 31 GLY QA 1 32 TRP H 3.000 . 4.500 2.485 2.337 2.740 . 0 0 "[ . ]" 1
182 1 31 GLY QA 1 34 GLY H 4.000 . 5.500 4.175 3.835 4.540 . 0 0 "[ . ]" 1
183 1 32 TRP H 1 32 TRP HB2 2.000 . 3.500 2.757 2.198 3.527 0.027 5 0 "[ . ]" 1
184 1 32 TRP H 1 32 TRP HB3 3.000 . 4.500 2.526 2.070 2.902 . 0 0 "[ . ]" 1
185 1 32 TRP H 1 33 ALA H 4.000 . 5.500 2.904 2.671 3.104 . 0 0 "[ . ]" 1
186 1 32 TRP H 1 35 GLY H 4.000 . 5.500 4.518 4.218 4.746 . 0 0 "[ . ]" 1
187 1 32 TRP HA 1 33 ALA H 4.000 . 5.500 3.575 3.566 3.584 . 0 0 "[ . ]" 1
188 1 32 TRP HA 1 35 GLY H 4.000 . 5.500 3.801 3.324 4.189 . 0 0 "[ . ]" 1
189 1 32 TRP HA 1 36 VAL H 4.000 . 5.500 3.686 3.170 4.069 . 0 0 "[ . ]" 1
190 1 32 TRP HB2 1 33 ALA H 4.000 . 5.500 3.630 3.333 3.949 . 0 0 "[ . ]" 1
191 1 32 TRP HB3 1 33 ALA H 3.000 . 4.500 2.593 1.992 3.587 . 0 0 "[ . ]" 1
192 1 32 TRP HB3 1 35 GLY H 4.000 . 5.500 5.561 5.532 5.617 0.117 5 0 "[ . ]" 1
193 1 32 TRP HE1 1 33 ALA H 4.000 . 5.500 3.280 2.540 3.936 . 0 0 "[ . ]" 1
194 1 32 TRP HZ2 1 33 ALA H 4.000 . 5.500 5.159 4.571 5.516 0.016 6 0 "[ . ]" 1
195 1 33 ALA H 1 33 ALA MB 3.000 . 4.500 2.128 2.029 2.234 . 0 0 "[ . ]" 1
196 1 33 ALA H 1 34 GLY H 4.000 . 5.500 2.907 2.698 3.115 . 0 0 "[ . ]" 1
197 1 33 ALA H 1 35 GLY H 4.000 . 5.500 4.207 4.026 4.536 . 0 0 "[ . ]" 1
198 1 33 ALA H 1 36 VAL HB 4.000 . 5.500 5.492 5.344 5.571 0.071 5 0 "[ . ]" 1
199 1 33 ALA H 1 36 VAL MG2 4.000 . 5.500 4.594 4.479 4.707 . 0 0 "[ . ]" 1
200 1 33 ALA MB 1 34 GLY H 3.000 . 4.500 2.324 1.953 2.707 . 0 0 "[ . ]" 1
201 1 33 ALA MB 1 35 GLY H 4.000 . 5.500 4.448 4.164 4.786 . 0 0 "[ . ]" 1
202 1 33 ALA MB 1 37 PHE H 4.000 . 5.500 4.462 4.074 4.666 . 0 0 "[ . ]" 1
203 1 34 GLY H 1 35 GLY H 4.000 . 5.500 2.740 2.657 2.809 . 0 0 "[ . ]" 1
204 1 34 GLY H 1 37 PHE QB 4.000 . 5.500 4.582 4.493 4.692 . 0 0 "[ . ]" 1
205 1 34 GLY H 1 38 PHE H 4.000 . 5.500 5.467 5.337 5.557 0.057 5 0 "[ . ]" 1
206 1 34 GLY QA 1 35 GLY H 4.000 . 5.500 2.697 2.610 2.751 . 0 0 "[ . ]" 1
207 1 34 GLY QA 1 37 PHE H 4.000 . 5.500 3.875 3.617 4.142 . 0 0 "[ . ]" 1
208 1 34 GLY QA 1 38 PHE H 4.000 . 5.500 3.156 2.966 3.290 . 0 0 "[ . ]" 1
209 1 35 GLY H 1 36 VAL H 4.000 . 5.500 2.875 2.744 3.030 . 0 0 "[ . ]" 1
210 1 35 GLY H 1 36 VAL HB 4.000 . 5.500 5.163 5.033 5.283 . 0 0 "[ . ]" 1
211 1 35 GLY H 1 38 PHE H 4.000 . 5.500 4.787 4.630 4.968 . 0 0 "[ . ]" 1
212 1 35 GLY H 1 38 PHE QB 4.000 . 5.500 4.821 4.674 5.044 . 0 0 "[ . ]" 1
213 1 35 GLY QA 1 36 VAL H 3.000 . 4.500 2.561 2.445 2.644 . 0 0 "[ . ]" 1
214 1 36 VAL H 1 36 VAL HA 3.000 . 4.500 2.816 2.795 2.834 . 0 0 "[ . ]" 1
215 1 36 VAL H 1 36 VAL HB 3.000 . 4.500 2.637 2.578 2.699 . 0 0 "[ . ]" 1
216 1 36 VAL H 1 36 VAL MG1 4.000 . 5.500 3.762 3.754 3.775 . 0 0 "[ . ]" 1
217 1 36 VAL H 1 36 VAL MG2 3.000 . 4.500 2.014 1.875 2.127 . 0 0 "[ . ]" 1
218 1 36 VAL H 1 37 PHE H 4.000 . 5.500 2.773 2.698 2.886 . 0 0 "[ . ]" 1
219 1 36 VAL HA 1 37 PHE H 4.000 . 5.500 3.569 3.561 3.583 . 0 0 "[ . ]" 1
220 1 36 VAL HB 1 37 PHE H 3.000 . 4.500 2.385 2.295 2.490 . 0 0 "[ . ]" 1
221 1 36 VAL HB 1 40 THR H 4.000 . 5.500 5.393 5.266 5.483 . 0 0 "[ . ]" 1
222 1 36 VAL MG1 1 37 PHE H 4.000 . 5.500 3.446 3.350 3.515 . 0 0 "[ . ]" 1
223 1 36 VAL MG1 1 40 THR H 4.000 . 5.500 3.763 3.636 3.847 . 0 0 "[ . ]" 1
224 1 36 VAL MG2 1 37 PHE H 4.000 . 5.500 3.665 3.591 3.752 . 0 0 "[ . ]" 1
225 1 36 VAL MG2 1 40 THR H 4.000 . 5.500 5.179 4.977 5.416 . 0 0 "[ . ]" 1
226 1 37 PHE H 1 37 PHE HA 3.000 . 4.500 2.793 2.784 2.803 . 0 0 "[ . ]" 1
227 1 37 PHE H 1 37 PHE QB 2.000 . 3.500 2.174 2.066 2.256 . 0 0 "[ . ]" 1
228 1 37 PHE H 1 37 PHE HD1 4.000 . 5.500 3.995 2.430 4.923 . 0 0 "[ . ]" 1
229 1 37 PHE H 1 38 PHE H 4.000 . 5.500 2.938 2.766 3.065 . 0 0 "[ . ]" 1
230 1 37 PHE H 1 38 PHE HA 4.000 . 5.500 5.453 5.352 5.518 0.018 2 0 "[ . ]" 1
231 1 37 PHE H 1 39 GLY H 4.000 . 5.500 4.105 3.978 4.258 . 0 0 "[ . ]" 1
232 1 37 PHE H 1 40 THR H 4.000 . 5.500 4.773 4.619 4.901 . 0 0 "[ . ]" 1
233 1 37 PHE HA 1 41 LEU H 3.000 . 4.500 3.781 3.559 3.928 . 0 0 "[ . ]" 1
234 1 37 PHE QB 1 38 PHE H 4.000 . 5.500 2.261 2.011 2.565 . 0 0 "[ . ]" 1
235 1 37 PHE QB 1 40 THR H 4.000 . 5.500 5.419 5.342 5.513 0.013 4 0 "[ . ]" 1
236 1 37 PHE QD 1 38 PHE H 4.000 . 5.500 3.908 3.055 4.510 . 0 0 "[ . ]" 1
237 1 38 PHE H 1 38 PHE HA 3.000 . 4.500 2.820 2.811 2.828 . 0 0 "[ . ]" 1
238 1 38 PHE H 1 38 PHE QB 3.000 . 4.500 2.171 2.052 2.415 . 0 0 "[ . ]" 1
239 1 38 PHE H 1 38 PHE QD 4.000 . 5.500 3.076 2.139 3.967 . 0 0 "[ . ]" 1
240 1 38 PHE H 1 39 GLY H 4.000 . 5.500 2.691 2.625 2.731 . 0 0 "[ . ]" 1
241 1 38 PHE H 1 40 THR H 4.000 . 5.500 4.674 4.460 4.817 . 0 0 "[ . ]" 1
242 1 38 PHE H 1 41 LEU QB 4.000 . 5.500 4.591 4.534 4.676 . 0 0 "[ . ]" 1
243 1 38 PHE H 1 41 LEU MD2 4.000 . 5.500 5.260 4.872 5.469 . 0 0 "[ . ]" 1
244 1 38 PHE HA 1 39 GLY H 4.000 . 5.500 3.545 3.517 3.562 . 0 0 "[ . ]" 1
245 1 38 PHE QB 1 39 GLY H 3.000 . 4.500 2.632 2.423 2.764 . 0 0 "[ . ]" 1
246 1 38 PHE QB 1 42 LEU H 4.000 . 5.500 4.811 4.470 5.302 . 0 0 "[ . ]" 1
247 1 39 GLY H 1 39 GLY HA2 3.000 . 4.500 2.805 2.796 2.814 . 0 0 "[ . ]" 1
248 1 39 GLY H 1 40 THR H 3.000 . 4.500 2.950 2.853 3.017 . 0 0 "[ . ]" 1
249 1 39 GLY H 1 41 LEU H 4.000 . 5.500 4.296 4.100 4.533 . 0 0 "[ . ]" 1
250 1 39 GLY H 1 42 LEU QB 4.000 . 5.500 4.739 4.515 4.992 . 0 0 "[ . ]" 1
251 1 39 GLY H 1 42 LEU QD 4.000 . 5.500 5.061 4.416 5.476 . 0 0 "[ . ]" 1
252 1 39 GLY QA 1 40 THR H 3.000 . 4.500 2.518 2.464 2.571 . 0 0 "[ . ]" 1
253 1 39 GLY QA 1 42 LEU H 4.000 . 5.500 3.757 3.389 3.916 . 0 0 "[ . ]" 1
254 1 39 GLY HA2 1 43 LEU H 3.000 . 4.500 4.093 3.833 4.193 . 0 0 "[ . ]" 1
255 1 39 GLY HA3 1 43 LEU H 4.000 . 5.500 4.995 4.829 5.069 . 0 0 "[ . ]" 1
256 1 40 THR H 1 40 THR HA 3.000 . 4.500 2.788 2.749 2.826 . 0 0 "[ . ]" 1
257 1 40 THR H 1 40 THR HB 3.000 . 4.500 2.802 2.496 3.576 . 0 0 "[ . ]" 1
258 1 40 THR H 1 40 THR HG1 3.000 . 4.500 3.009 1.893 4.349 . 0 0 "[ . ]" 1
259 1 40 THR H 1 40 THR MG 4.000 . 5.500 3.257 1.937 3.753 . 0 0 "[ . ]" 1
260 1 40 THR H 1 41 LEU H 3.000 . 4.500 2.837 2.650 3.005 . 0 0 "[ . ]" 1
261 1 40 THR H 1 41 LEU QB 4.000 . 5.500 4.501 4.370 4.648 . 0 0 "[ . ]" 1
262 1 40 THR H 1 43 LEU QB 4.000 . 5.500 4.691 4.387 4.862 . 0 0 "[ . ]" 1
263 1 40 THR HA 1 44 ILE H 4.000 . 5.500 3.555 2.812 3.951 . 0 0 "[ . ]" 1
264 1 40 THR HB 1 41 LEU H 3.000 . 4.500 2.775 2.222 3.851 . 0 0 "[ . ]" 1
265 1 40 THR HG1 1 43 LEU H 4.000 . 5.500 4.716 4.555 4.953 . 0 0 "[ . ]" 1
266 1 40 THR MG 1 41 LEU H 4.000 . 5.500 3.338 2.027 3.712 . 0 0 "[ . ]" 1
267 1 41 LEU H 1 41 LEU HA 3.000 . 4.500 2.781 2.737 2.816 . 0 0 "[ . ]" 1
268 1 41 LEU H 1 41 LEU QB 3.000 . 4.500 2.102 2.056 2.194 . 0 0 "[ . ]" 1
269 1 41 LEU H 1 41 LEU QD 4.000 . 5.500 3.103 2.595 3.547 . 0 0 "[ . ]" 1
270 1 41 LEU H 1 42 LEU H 3.000 . 4.500 2.821 2.625 2.949 . 0 0 "[ . ]" 1
271 1 41 LEU H 1 43 LEU H 4.000 . 5.500 4.251 4.061 4.445 . 0 0 "[ . ]" 1
272 1 41 LEU QB 1 45 GLY H 4.000 . 5.500 4.839 4.560 5.258 . 0 0 "[ . ]" 1
273 1 42 LEU H 1 42 LEU QB 2.000 . 3.500 2.123 2.079 2.226 . 0 0 "[ . ]" 1
274 1 42 LEU H 1 42 LEU QD 3.000 . 4.500 2.980 2.052 3.635 . 0 0 "[ . ]" 1
275 1 42 LEU H 1 43 LEU H 3.000 . 4.500 2.648 2.611 2.696 . 0 0 "[ . ]" 1
276 1 42 LEU H 1 44 ILE H 4.000 . 5.500 4.468 4.352 4.699 . 0 0 "[ . ]" 1
277 1 42 LEU H 1 45 GLY H 4.000 . 5.500 4.569 4.381 4.760 . 0 0 "[ . ]" 1
278 1 42 LEU QB 1 43 LEU H 3.000 . 4.500 2.627 2.456 2.773 . 0 0 "[ . ]" 1
279 1 42 LEU QB 1 45 GLY H 4.000 . 5.500 5.126 4.978 5.250 . 0 0 "[ . ]" 1
280 1 42 LEU QB 1 46 PHE H 4.000 . 5.500 4.838 4.608 5.062 . 0 0 "[ . ]" 1
281 1 42 LEU MD1 1 46 PHE H 4.000 . 5.500 4.798 3.623 5.348 . 0 0 "[ . ]" 1
282 1 43 LEU H 1 43 LEU QB 2.000 . 3.500 2.126 2.044 2.340 . 0 0 "[ . ]" 1
283 1 43 LEU H 1 43 LEU QD 4.000 . 5.500 2.810 2.199 3.388 . 0 0 "[ . ]" 1
284 1 43 LEU H 1 44 ILE H 4.000 . 5.500 2.791 2.714 2.966 . 0 0 "[ . ]" 1
285 1 43 LEU H 1 45 GLY H 4.000 . 5.500 3.997 3.848 4.134 . 0 0 "[ . ]" 1
286 1 43 LEU H 1 46 PHE H 4.000 . 5.500 4.659 4.513 4.848 . 0 0 "[ . ]" 1
287 1 43 LEU H 1 46 PHE QB 4.000 . 5.500 4.860 4.582 5.139 . 0 0 "[ . ]" 1
288 1 43 LEU HA 1 44 ILE H 4.000 . 5.500 3.569 3.561 3.576 . 0 0 "[ . ]" 1
289 1 43 LEU HA 1 46 PHE H 4.000 . 5.500 3.943 3.647 4.272 . 0 0 "[ . ]" 1
290 1 43 LEU QB 1 44 ILE H 4.000 . 5.500 2.355 1.948 2.539 . 0 0 "[ . ]" 1
291 1 43 LEU QB 1 46 PHE H 4.000 . 5.500 5.164 4.943 5.348 . 0 0 "[ . ]" 1
292 1 43 LEU QB 1 47 PHE H 4.000 . 5.500 4.937 4.741 5.256 . 0 0 "[ . ]" 1
293 1 43 LEU QD 1 44 ILE H 4.000 . 5.500 3.741 2.969 3.945 . 0 0 "[ . ]" 1
294 1 43 LEU QD 1 47 PHE H 4.000 . 5.500 4.653 3.918 5.309 . 0 0 "[ . ]" 1
295 1 44 ILE H 1 44 ILE HA 3.000 . 4.500 2.815 2.809 2.822 . 0 0 "[ . ]" 1
296 1 44 ILE H 1 44 ILE HB 3.000 . 4.500 3.060 2.614 3.627 . 0 0 "[ . ]" 1
297 1 44 ILE H 1 44 ILE MD 4.000 . 5.500 3.311 2.909 3.932 . 0 0 "[ . ]" 1
298 1 44 ILE H 1 44 ILE QG 4.000 . 5.500 2.010 1.914 2.321 . 0 0 "[ . ]" 1
299 1 44 ILE H 1 44 ILE MG 3.000 . 4.500 3.190 2.118 3.774 . 0 0 "[ . ]" 1
300 1 44 ILE H 1 45 GLY H 4.000 . 5.500 2.687 2.649 2.721 . 0 0 "[ . ]" 1
301 1 44 ILE HB 1 45 GLY H 3.000 . 4.500 3.030 2.456 3.849 . 0 0 "[ . ]" 1
302 1 44 ILE MD 1 45 GLY H 4.000 . 5.500 3.810 2.255 4.604 . 0 0 "[ . ]" 1
303 1 44 ILE MD 1 48 ARG H 4.000 . 5.500 5.252 5.014 5.460 . 0 0 "[ . ]" 1
304 1 44 ILE QG 1 45 GLY H 4.000 . 5.500 3.002 1.834 3.932 . 0 0 "[ . ]" 1
305 1 44 ILE MG 1 45 GLY H 4.000 . 5.500 3.765 3.472 4.053 . 0 0 "[ . ]" 1
306 1 45 GLY H 1 46 PHE H 4.000 . 5.500 2.811 2.718 2.877 . 0 0 "[ . ]" 1
307 1 45 GLY H 1 48 ARG QD 4.000 . 5.500 5.046 3.970 5.468 . 0 0 "[ . ]" 1
308 1 45 GLY QA 1 46 PHE H 4.000 . 5.500 2.621 2.552 2.704 . 0 0 "[ . ]" 1
309 1 45 GLY QA 1 47 PHE H 4.000 . 5.500 4.257 4.104 4.402 . 0 0 "[ . ]" 1
310 1 45 GLY QA 1 48 ARG H 4.000 . 5.500 3.601 3.347 3.970 . 0 0 "[ . ]" 1
311 1 45 GLY QA 1 49 VAL H 4.000 . 5.500 3.774 3.177 4.014 . 0 0 "[ . ]" 1
312 1 46 PHE H 1 46 PHE HA 3.000 . 4.500 2.816 2.809 2.823 . 0 0 "[ . ]" 1
313 1 46 PHE H 1 46 PHE QB 3.000 . 4.500 2.147 2.067 2.237 . 0 0 "[ . ]" 1
314 1 46 PHE H 1 46 PHE QD 4.000 . 5.500 3.680 2.558 4.158 . 0 0 "[ . ]" 1
315 1 46 PHE H 1 47 PHE H 4.000 . 5.500 2.729 2.650 2.809 . 0 0 "[ . ]" 1
316 1 46 PHE H 1 47 PHE QB 4.000 . 5.500 4.467 4.390 4.579 . 0 0 "[ . ]" 1
317 1 46 PHE HA 1 47 PHE H 4.000 . 5.500 3.554 3.532 3.569 . 0 0 "[ . ]" 1
318 1 46 PHE HA 1 49 VAL H 4.000 . 5.500 3.770 3.612 4.248 . 0 0 "[ . ]" 1
319 1 46 PHE HA 1 50 VAL H 4.000 . 5.500 3.489 2.797 3.777 . 0 0 "[ . ]" 1
320 1 46 PHE QB 1 47 PHE H 4.000 . 5.500 2.510 2.351 2.688 . 0 0 "[ . ]" 1
321 1 46 PHE QD 1 47 PHE H 4.000 . 5.500 4.158 3.637 4.466 . 0 0 "[ . ]" 1
322 1 47 PHE H 1 47 PHE HA 3.000 . 4.500 2.825 2.807 2.842 . 0 0 "[ . ]" 1
323 1 47 PHE H 1 47 PHE QB 3.000 . 4.500 2.135 2.050 2.231 . 0 0 "[ . ]" 1
324 1 47 PHE H 1 47 PHE QD 4.000 . 5.500 3.258 2.119 4.077 . 0 0 "[ . ]" 1
325 1 47 PHE H 1 48 ARG H 4.000 . 5.500 2.643 2.562 2.851 . 0 0 "[ . ]" 1
326 1 47 PHE H 1 50 VAL HB 4.000 . 5.500 5.090 4.754 5.475 . 0 0 "[ . ]" 1
327 1 47 PHE H 1 50 VAL MG2 4.000 . 5.500 4.792 4.647 4.970 . 0 0 "[ . ]" 1
328 1 47 PHE HA 1 48 ARG H 4.000 . 5.500 3.519 3.463 3.588 . 0 0 "[ . ]" 1
329 1 47 PHE HA 1 50 VAL H 4.000 . 5.500 4.066 3.733 4.791 . 0 0 "[ . ]" 1
330 1 47 PHE HA 1 51 GLY H 4.000 . 5.500 2.932 2.266 3.382 . 0 0 "[ . ]" 1
331 1 47 PHE QB 1 51 GLY H 4.000 . 5.500 4.455 4.147 4.714 . 0 0 "[ . ]" 1
332 1 48 ARG H 1 48 ARG QB 3.000 . 4.500 2.207 2.079 2.490 . 0 0 "[ . ]" 1
333 1 48 ARG H 1 48 ARG QD 4.000 . 5.500 4.069 3.190 4.600 . 0 0 "[ . ]" 1
334 1 48 ARG H 1 48 ARG QG 4.000 . 5.500 3.160 2.233 3.969 . 0 0 "[ . ]" 1
335 1 48 ARG H 1 49 VAL H 4.000 . 5.500 2.707 2.640 2.758 . 0 0 "[ . ]" 1
336 1 48 ARG H 1 50 VAL H 4.000 . 5.500 4.349 4.128 4.644 . 0 0 "[ . ]" 1
337 1 48 ARG H 1 51 GLY H 4.000 . 5.500 4.329 3.941 4.597 . 0 0 "[ . ]" 1
338 1 48 ARG H 1 52 ARG H 4.000 . 5.500 5.400 4.987 5.627 0.127 5 0 "[ . ]" 1
339 1 48 ARG HA 1 49 VAL H 4.000 . 5.500 3.563 3.542 3.574 . 0 0 "[ . ]" 1
340 1 48 ARG HA 1 51 GLY H 4.000 . 5.500 4.193 3.880 4.566 . 0 0 "[ . ]" 1
341 1 48 ARG HA 1 52 ARG H 4.000 . 5.500 3.772 2.942 4.780 . 0 0 "[ . ]" 1
342 1 48 ARG QB 1 49 VAL H 4.000 . 5.500 2.639 2.299 3.457 . 0 0 "[ . ]" 1
343 1 48 ARG QD 1 49 VAL H 4.000 . 5.500 4.753 4.095 5.403 . 0 0 "[ . ]" 1
344 1 48 ARG QG 1 49 VAL H 4.000 . 5.500 3.882 2.151 4.461 . 0 0 "[ . ]" 1
345 1 49 VAL H 1 49 VAL HA 3.000 . 4.500 2.852 2.846 2.860 . 0 0 "[ . ]" 1
346 1 49 VAL H 1 49 VAL HB 3.000 . 4.500 2.929 2.629 3.637 . 0 0 "[ . ]" 1
347 1 49 VAL H 1 49 VAL MG1 3.000 . 4.500 2.642 1.935 3.782 . 0 0 "[ . ]" 1
348 1 49 VAL H 1 49 VAL MG2 4.000 . 5.500 2.750 1.787 3.785 0.013 7 0 "[ . ]" 1
349 1 49 VAL H 1 50 VAL H 4.000 . 5.500 2.725 2.653 2.879 . 0 0 "[ . ]" 1
350 1 49 VAL H 1 50 VAL HB 4.000 . 5.500 5.016 4.961 5.188 . 0 0 "[ . ]" 1
351 1 49 VAL H 1 50 VAL MG2 4.000 . 5.500 4.139 4.018 4.309 . 0 0 "[ . ]" 1
352 1 49 VAL H 1 51 GLY H 4.000 . 5.500 3.978 3.749 4.140 . 0 0 "[ . ]" 1
353 1 49 VAL H 1 52 ARG H 4.000 . 5.500 4.604 4.436 4.855 . 0 0 "[ . ]" 1
354 1 49 VAL HA 1 50 VAL H 4.000 . 5.500 3.577 3.570 3.588 . 0 0 "[ . ]" 1
355 1 49 VAL HB 1 50 VAL H 4.000 . 5.500 3.209 2.090 3.825 . 0 0 "[ . ]" 1
356 1 49 VAL MG1 1 50 VAL H 4.000 . 5.500 2.861 1.790 3.970 0.010 5 0 "[ . ]" 1
357 1 49 VAL MG2 1 50 VAL H 4.000 . 5.500 2.999 1.819 3.634 . 0 0 "[ . ]" 1
358 1 49 VAL MG2 1 52 ARG H 4.000 . 5.500 5.085 4.722 5.607 0.107 3 0 "[ . ]" 1
359 1 49 VAL MG2 1 53 MET H 4.000 . 5.500 5.043 4.228 5.577 0.077 6 0 "[ . ]" 1
360 1 50 VAL H 1 50 VAL HA 3.000 . 4.500 2.835 2.824 2.848 . 0 0 "[ . ]" 1
361 1 50 VAL H 1 50 VAL HB 3.000 . 4.500 2.626 2.590 2.693 . 0 0 "[ . ]" 1
362 1 50 VAL H 1 50 VAL MG1 4.000 . 5.500 3.773 3.763 3.777 . 0 0 "[ . ]" 1
363 1 50 VAL H 1 50 VAL MG2 3.000 . 4.500 2.024 1.939 2.128 . 0 0 "[ . ]" 1
364 1 50 VAL H 1 51 GLY H 4.000 . 5.500 2.627 2.535 2.706 . 0 0 "[ . ]" 1
365 1 50 VAL H 1 52 ARG H 4.000 . 5.500 4.188 3.848 4.834 . 0 0 "[ . ]" 1
366 1 50 VAL HA 1 51 GLY H 4.000 . 5.500 3.538 3.481 3.564 . 0 0 "[ . ]" 1
367 1 50 VAL HA 1 53 MET H 4.000 . 5.500 4.051 3.329 5.625 0.125 5 0 "[ . ]" 1
368 1 50 VAL HB 1 51 GLY H 4.000 . 5.500 2.539 2.378 2.693 . 0 0 "[ . ]" 1
369 1 50 VAL MG1 1 51 GLY H 4.000 . 5.500 3.558 3.389 3.666 . 0 0 "[ . ]" 1
370 1 50 VAL MG2 1 51 GLY H 4.000 . 5.500 3.700 3.670 3.766 . 0 0 "[ . ]" 1
371 1 51 GLY H 1 51 GLY HA3 3.000 . 4.500 2.297 2.293 2.301 . 0 0 "[ . ]" 1
372 1 51 GLY H 1 52 ARG H 4.000 . 5.500 2.750 2.581 2.958 . 0 0 "[ . ]" 1
373 1 51 GLY H 1 53 MET H 4.000 . 5.500 4.056 3.668 4.571 . 0 0 "[ . ]" 1
374 1 51 GLY H 1 54 LEU H 4.000 . 5.500 5.247 4.663 5.660 0.160 7 0 "[ . ]" 1
375 1 51 GLY HA2 1 52 ARG H 4.000 . 5.500 3.495 3.347 3.559 . 0 0 "[ . ]" 1
376 1 51 GLY HA2 1 53 MET H 4.000 . 5.500 4.587 3.926 5.240 . 0 0 "[ . ]" 1
377 1 51 GLY HA3 1 52 ARG H 4.000 . 5.500 2.858 2.445 3.220 . 0 0 "[ . ]" 1
378 1 51 GLY HA3 1 53 MET H 4.000 . 5.500 4.560 4.081 5.324 . 0 0 "[ . ]" 1
379 1 52 ARG H 1 52 ARG QB 3.000 . 4.500 2.336 2.136 3.103 . 0 0 "[ . ]" 1
380 1 52 ARG H 1 53 MET H 4.000 . 5.500 2.457 2.366 2.672 . 0 0 "[ . ]" 1
381 1 52 ARG HA 1 53 MET H 4.000 . 5.500 3.380 2.723 3.578 . 0 0 "[ . ]" 1
382 1 52 ARG QB 1 53 MET H 4.000 . 5.500 2.974 2.144 3.874 . 0 0 "[ . ]" 1
383 1 53 MET H 1 53 MET HA 3.000 . 4.500 2.626 2.282 2.904 . 0 0 "[ . ]" 1
384 1 53 MET H 1 53 MET QB 3.000 . 4.500 2.736 2.271 3.139 . 0 0 "[ . ]" 1
385 1 53 MET H 1 53 MET QG 4.000 . 5.500 3.873 3.348 4.496 . 0 0 "[ . ]" 1
386 1 53 MET H 1 54 LEU H 4.000 . 5.500 2.460 1.941 2.872 . 0 0 "[ . ]" 1
387 1 53 MET H 1 54 LEU QB 4.000 . 5.500 4.388 3.716 5.010 . 0 0 "[ . ]" 1
388 1 53 MET H 1 55 PRO QG 4.000 . 5.500 5.254 4.915 5.540 0.040 6 0 "[ . ]" 1
389 1 53 MET HA 1 54 LEU H 4.000 . 5.500 3.143 2.759 3.586 . 0 0 "[ . ]" 1
390 1 53 MET QB 1 54 LEU H 4.000 . 5.500 3.336 2.227 4.046 . 0 0 "[ . ]" 1
391 1 54 LEU H 1 54 LEU HA 3.000 . 4.500 2.724 2.275 2.880 . 0 0 "[ . ]" 1
392 1 54 LEU H 1 54 LEU QD 4.000 . 5.500 3.532 3.130 3.790 . 0 0 "[ . ]" 1
393 1 54 LEU H 1 54 LEU HG 4.000 . 5.500 3.753 2.287 4.577 . 0 0 "[ . ]" 1
394 1 54 LEU H 1 55 PRO QD 4.000 . 5.500 2.636 1.926 3.902 . 0 0 "[ . ]" 1
395 1 54 LEU H 1 55 PRO QG 4.000 . 5.500 4.382 3.880 5.193 . 0 0 "[ . ]" 1
396 1 54 LEU HA 1 56 ILE H 4.000 . 5.500 4.579 3.493 5.402 . 0 0 "[ . ]" 1
397 1 54 LEU HA 1 58 GLU H 4.000 . 5.500 4.984 4.620 5.414 . 0 0 "[ . ]" 1
398 1 54 LEU QB 1 56 ILE H 4.000 . 5.500 4.674 4.118 5.336 . 0 0 "[ . ]" 1
399 1 55 PRO QD 1 56 ILE H 4.000 . 5.500 3.596 1.757 4.838 0.043 7 0 "[ . ]" 1
400 1 55 PRO QG 1 56 ILE H 4.000 . 5.500 3.809 2.303 4.910 . 0 0 "[ . ]" 1
401 1 56 ILE H 1 56 ILE QG 4.000 . 5.500 2.871 1.991 4.288 . 0 0 "[ . ]" 1
402 1 56 ILE H 1 56 ILE MG 4.000 . 5.500 3.423 2.441 3.989 . 0 0 "[ . ]" 1
403 1 56 ILE H 1 57 GLN H 4.000 . 5.500 2.965 1.734 4.413 0.066 4 0 "[ . ]" 1
404 1 56 ILE HA 1 57 GLN H 4.000 . 5.500 2.959 2.342 3.533 . 0 0 "[ . ]" 1
405 1 56 ILE HA 1 58 GLU H 4.000 . 5.500 4.638 3.575 5.366 . 0 0 "[ . ]" 1
406 1 56 ILE QG 1 57 GLN H 4.000 . 5.500 3.888 1.911 4.591 . 0 0 "[ . ]" 1
407 1 56 ILE MG 1 57 GLN H 4.000 . 5.500 3.191 1.850 4.324 . 0 0 "[ . ]" 1
408 1 56 ILE MG 1 58 GLU H 4.000 . 5.500 4.224 3.157 4.737 . 0 0 "[ . ]" 1
409 1 57 GLN H 1 57 GLN HA 3.000 . 4.500 2.362 2.263 2.862 . 0 0 "[ . ]" 1
410 1 57 GLN H 1 57 GLN QB 3.000 . 4.500 3.093 2.803 3.305 . 0 0 "[ . ]" 1
411 1 57 GLN H 1 57 GLN QG 4.000 . 5.500 3.599 3.033 4.405 . 0 0 "[ . ]" 1
412 1 57 GLN H 1 58 GLU H 4.000 . 5.500 2.894 1.764 3.980 0.036 4 0 "[ . ]" 1
413 1 58 GLU H 1 58 GLU HA 3.000 . 4.500 2.517 2.283 2.836 . 0 0 "[ . ]" 1
414 1 58 GLU H 1 58 GLU QB 3.000 . 4.500 2.730 2.039 3.344 . 0 0 "[ . ]" 1
415 1 58 GLU H 1 58 GLU QG 4.000 . 5.500 3.349 2.321 4.191 . 0 0 "[ . ]" 1
416 1 58 GLU H 1 59 ASN H 4.000 . 5.500 3.676 2.631 4.590 . 0 0 "[ . ]" 1
417 1 58 GLU HA 1 59 ASN H 4.000 . 5.500 2.819 2.163 3.571 . 0 0 "[ . ]" 1
418 1 58 GLU HA 1 60 GLN H 4.000 . 5.500 4.586 3.896 5.560 0.060 6 0 "[ . ]" 1
419 1 58 GLU QB 1 59 ASN H 4.000 . 5.500 2.972 2.057 3.798 . 0 0 "[ . ]" 1
420 1 58 GLU QG 1 59 ASN H 4.000 . 5.500 3.778 2.408 4.738 . 0 0 "[ . ]" 1
421 1 59 ASN H 1 59 ASN HA 3.000 . 4.500 2.811 2.276 2.932 . 0 0 "[ . ]" 1
422 1 59 ASN H 1 60 GLN H 4.000 . 5.500 2.565 1.772 4.309 0.028 4 0 "[ . ]" 1
423 1 59 ASN H 1 60 GLN HA 4.000 . 5.500 4.838 4.236 5.454 . 0 0 "[ . ]" 1
424 1 59 ASN HA 1 60 GLN H 4.000 . 5.500 3.264 2.138 3.560 . 0 0 "[ . ]" 1
425 1 59 ASN QB 1 60 GLN H 4.000 . 5.500 2.944 2.495 3.557 . 0 0 "[ . ]" 1
426 1 60 GLN H 1 60 GLN HG2 4.000 . 5.500 3.834 3.226 4.502 . 0 0 "[ . ]" 1
427 1 60 GLN H 1 60 GLN HG3 4.000 . 5.500 3.980 2.401 4.723 . 0 0 "[ . ]" 1
428 1 60 GLN H 1 61 ALA H 4.000 . 5.500 3.559 2.731 4.458 . 0 0 "[ . ]" 1
429 1 61 ALA H 1 61 ALA MB 3.000 . 4.500 2.769 2.113 3.000 . 0 0 "[ . ]" 1
430 1 61 ALA H 1 62 PRO QD 4.000 . 5.500 3.472 2.180 4.247 . 0 0 "[ . ]" 1
431 1 61 ALA H 1 63 ALA H 4.000 . 5.500 5.236 4.684 5.536 0.036 6 0 "[ . ]" 1
432 1 62 PRO QD 1 63 ALA H 4.000 . 5.500 3.073 2.471 4.662 . 0 0 "[ . ]" 1
433 1 62 PRO QG 1 63 ALA H 4.000 . 5.500 3.715 2.509 4.842 . 0 0 "[ . ]" 1
434 1 63 ALA H 1 63 ALA MB 3.000 . 4.500 2.491 2.081 3.102 . 0 0 "[ . ]" 1
435 1 63 ALA H 1 64 PRO QD 4.000 . 5.500 3.072 1.938 4.376 . 0 0 "[ . ]" 1
436 1 64 PRO HA 1 66 ILE H 4.000 . 5.500 4.257 3.355 5.268 . 0 0 "[ . ]" 1
437 1 65 ASN H 1 65 ASN HB2 4.000 . 5.500 2.651 2.158 3.239 . 0 0 "[ . ]" 1
438 1 65 ASN H 1 65 ASN HB3 4.000 . 5.500 3.532 2.780 4.093 . 0 0 "[ . ]" 1
439 1 65 ASN H 1 66 ILE H 4.000 . 5.500 3.085 2.282 4.293 . 0 0 "[ . ]" 1
440 1 65 ASN HA 1 66 ILE H 4.000 . 5.500 3.246 2.152 3.571 . 0 0 "[ . ]" 1
441 1 65 ASN QB 1 66 ILE H 4.000 . 5.500 2.854 2.056 3.857 . 0 0 "[ . ]" 1
442 1 66 ILE H 1 66 ILE HA 3.000 . 4.500 2.601 2.284 2.855 . 0 0 "[ . ]" 1
443 1 66 ILE H 1 66 ILE HB 3.000 . 4.500 3.437 2.637 3.785 . 0 0 "[ . ]" 1
444 1 66 ILE H 1 66 ILE HG12 4.000 . 5.500 3.915 1.945 5.282 . 0 0 "[ . ]" 1
445 1 66 ILE H 1 66 ILE HG13 4.000 . 5.500 3.549 2.342 4.603 . 0 0 "[ . ]" 1
446 1 66 ILE H 1 66 ILE MG 4.000 . 5.500 3.357 2.615 4.044 . 0 0 "[ . ]" 1
447 1 66 ILE H 1 67 THR H 4.000 . 5.500 2.996 1.821 4.128 . 0 0 "[ . ]" 1
448 1 66 ILE H 1 67 THR MG 4.000 . 5.500 5.046 3.470 5.549 0.049 3 0 "[ . ]" 1
449 1 66 ILE HB 1 67 THR H 4.000 . 5.500 3.522 2.332 4.521 . 0 0 "[ . ]" 1
450 1 66 ILE MG 1 67 THR H 4.000 . 5.500 3.083 1.858 4.152 . 0 0 "[ . ]" 1
451 1 67 THR H 1 67 THR HA 3.000 . 4.500 2.582 2.277 2.808 . 0 0 "[ . ]" 1
452 1 67 THR H 1 67 THR HB 4.000 . 5.500 3.679 2.710 4.074 . 0 0 "[ . ]" 1
453 1 67 THR H 1 67 THR HG1 4.000 . 5.500 4.227 3.970 4.625 . 0 0 "[ . ]" 1
454 1 67 THR H 1 67 THR MG 4.000 . 5.500 2.989 1.837 3.933 . 0 0 "[ . ]" 1
455 1 67 THR H 1 68 GLY H 4.000 . 5.500 3.362 2.229 4.673 . 0 0 "[ . ]" 1
456 1 67 THR HB 1 68 GLY H 4.000 . 5.500 3.086 1.882 4.655 . 0 0 "[ . ]" 1
457 1 67 THR MG 1 68 GLY H 4.000 . 5.500 3.376 2.177 4.391 . 0 0 "[ . ]" 1
458 1 68 GLY H 1 69 ALA H 4.000 . 5.500 4.308 3.809 4.561 . 0 0 "[ . ]" 1
459 1 68 GLY QA 1 69 ALA H 4.000 . 5.500 2.229 2.104 2.465 . 0 0 "[ . ]" 1
460 1 69 ALA H 1 69 ALA HA 3.000 . 4.500 2.663 2.289 2.819 . 0 0 "[ . ]" 1
461 1 69 ALA H 1 69 ALA MB 3.000 . 4.500 2.816 2.140 3.050 . 0 0 "[ . ]" 1
462 1 69 ALA H 1 70 LEU H 4.000 . 5.500 3.109 1.901 4.370 . 0 0 "[ . ]" 1
463 1 70 LEU H 1 70 LEU HA 3.000 . 4.500 2.593 2.270 2.830 . 0 0 "[ . ]" 1
464 1 70 LEU H 1 70 LEU HB2 3.000 . 4.500 3.140 2.067 4.057 . 0 0 "[ . ]" 1
465 1 70 LEU H 1 70 LEU HB3 4.000 . 5.500 3.581 2.808 4.142 . 0 0 "[ . ]" 1
466 1 70 LEU H 1 70 LEU QD 4.000 . 5.500 3.478 2.236 4.136 . 0 0 "[ . ]" 1
467 1 70 LEU H 1 70 LEU HG 4.000 . 5.500 3.944 2.965 4.736 . 0 0 "[ . ]" 1
468 1 70 LEU H 1 71 GLU H 4.000 . 5.500 3.080 2.529 3.813 . 0 0 "[ . ]" 1
469 1 70 LEU HB2 1 71 GLU H 4.000 . 5.500 3.704 3.036 4.624 . 0 0 "[ . ]" 1
470 1 70 LEU HB3 1 71 GLU H 4.000 . 5.500 3.438 1.873 4.429 . 0 0 "[ . ]" 1
471 1 71 GLU H 1 71 GLU QG 4.000 . 5.500 3.238 2.044 4.284 . 0 0 "[ . ]" 1
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