NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
398048 |
1t4z   |
5141 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1t4z
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 1723
_Distance_constraint_stats_list.Viol_count 3088
_Distance_constraint_stats_list.Viol_total 4349.622
_Distance_constraint_stats_list.Viol_max 0.275
_Distance_constraint_stats_list.Viol_rms 0.0179
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0040
_Distance_constraint_stats_list.Viol_average_violations_only 0.0563
_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 10 ALA 0.421 0.106 3 0 "[ . 1 . 2 .]"
1 11 GLN 1.411 0.106 3 0 "[ . 1 . 2 .]"
1 12 PRO 0.019 0.019 23 0 "[ . 1 . 2 .]"
1 13 LEU 6.578 0.183 24 0 "[ . 1 . 2 .]"
1 14 LEU 9.804 0.160 12 0 "[ . 1 . 2 .]"
1 15 LEU 3.502 0.129 1 0 "[ . 1 . 2 .]"
1 16 GLN 5.471 0.158 6 0 "[ . 1 . 2 .]"
1 17 LEU 1.801 0.103 6 0 "[ . 1 . 2 .]"
1 18 PHE 3.451 0.186 3 0 "[ . 1 . 2 .]"
1 19 VAL 3.115 0.131 8 0 "[ . 1 . 2 .]"
1 20 ASP 0.012 0.007 6 0 "[ . 1 . 2 .]"
1 21 THR 0.056 0.026 6 0 "[ . 1 . 2 .]"
1 22 ARG 1.903 0.134 3 0 "[ . 1 . 2 .]"
1 23 PRO 3.374 0.111 6 0 "[ . 1 . 2 .]"
1 24 LEU 4.278 0.139 3 0 "[ . 1 . 2 .]"
1 25 SER 3.137 0.127 22 0 "[ . 1 . 2 .]"
1 26 GLN 0.740 0.065 3 0 "[ . 1 . 2 .]"
1 27 HIS 4.501 0.139 3 0 "[ . 1 . 2 .]"
1 28 ILE 1.711 0.127 22 0 "[ . 1 . 2 .]"
1 29 VAL 2.457 0.073 23 0 "[ . 1 . 2 .]"
1 30 GLN 3.996 0.123 3 0 "[ . 1 . 2 .]"
1 31 ARG 4.513 0.275 24 0 "[ . 1 . 2 .]"
1 32 VAL 1.070 0.130 10 0 "[ . 1 . 2 .]"
1 33 LYS 4.571 0.085 23 0 "[ . 1 . 2 .]"
1 34 ASN 6.346 0.123 3 0 "[ . 1 . 2 .]"
1 35 ILE 3.906 0.115 15 0 "[ . 1 . 2 .]"
1 36 LEU 0.098 0.028 5 0 "[ . 1 . 2 .]"
1 37 ALA 1.528 0.115 8 0 "[ . 1 . 2 .]"
1 38 ALA 6.198 0.142 18 0 "[ . 1 . 2 .]"
1 39 VAL 2.328 0.142 18 0 "[ . 1 . 2 .]"
1 40 GLU 0.808 0.187 13 0 "[ . 1 . 2 .]"
1 41 ALA 0.042 0.028 6 0 "[ . 1 . 2 .]"
1 42 THR 0.007 0.007 19 0 "[ . 1 . 2 .]"
1 43 VAL 3.246 0.144 11 0 "[ . 1 . 2 .]"
1 44 PRO 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 45 ILE 8.600 0.183 24 0 "[ . 1 . 2 .]"
1 46 SER 0.543 0.105 12 0 "[ . 1 . 2 .]"
1 47 LEU 2.364 0.099 14 0 "[ . 1 . 2 .]"
1 48 GLN 1.892 0.180 23 0 "[ . 1 . 2 .]"
1 49 VAL 6.709 0.158 6 0 "[ . 1 . 2 .]"
1 50 ILE 3.821 0.131 8 0 "[ . 1 . 2 .]"
1 51 ASN 5.584 0.129 15 0 "[ . 1 . 2 .]"
1 52 VAL 1.362 0.110 1 0 "[ . 1 . 2 .]"
1 53 ALA 2.802 0.141 21 0 "[ . 1 . 2 .]"
1 54 ASP 4.695 0.187 6 0 "[ . 1 . 2 .]"
1 55 GLN 2.963 0.187 6 0 "[ . 1 . 2 .]"
1 56 PRO 1.674 0.146 23 0 "[ . 1 . 2 .]"
1 57 GLN 3.436 0.187 25 0 "[ . 1 . 2 .]"
1 58 LEU 8.861 0.187 25 0 "[ . 1 . 2 .]"
1 59 VAL 7.597 0.229 16 0 "[ . 1 . 2 .]"
1 60 GLU 2.214 0.274 7 0 "[ . 1 . 2 .]"
1 61 TYR 1.729 0.176 9 0 "[ . 1 . 2 .]"
1 62 TYR 6.984 0.105 20 0 "[ . 1 . 2 .]"
1 63 ARG 3.428 0.205 25 0 "[ . 1 . 2 .]"
1 64 LEU 11.879 0.229 16 0 "[ . 1 . 2 .]"
1 65 VAL 2.866 0.145 15 0 "[ . 1 . 2 .]"
1 66 VAL 10.496 0.215 21 0 "[ . 1 . 2 .]"
1 67 THR 3.385 0.125 10 0 "[ . 1 . 2 .]"
1 68 PRO 1.466 0.096 21 0 "[ . 1 . 2 .]"
1 69 ALA 3.313 0.169 10 0 "[ . 1 . 2 .]"
1 70 LEU 2.895 0.103 6 0 "[ . 1 . 2 .]"
1 71 VAL 5.511 0.159 8 0 "[ . 1 . 2 .]"
1 72 LYS 3.268 0.099 12 0 "[ . 1 . 2 .]"
1 73 ILE 2.989 0.097 2 0 "[ . 1 . 2 .]"
1 74 GLY 3.913 0.160 12 0 "[ . 1 . 2 .]"
1 75 PRO 0.580 0.075 20 0 "[ . 1 . 2 .]"
1 76 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 77 SER 1.866 0.125 5 0 "[ . 1 . 2 .]"
1 78 ARG 3.220 0.125 5 0 "[ . 1 . 2 .]"
1 79 GLN 0.252 0.045 24 0 "[ . 1 . 2 .]"
1 80 VAL 0.005 0.005 6 0 "[ . 1 . 2 .]"
1 81 LEU 4.417 0.164 10 0 "[ . 1 . 2 .]"
1 82 SER 3.122 0.129 13 0 "[ . 1 . 2 .]"
1 83 GLY 9.822 0.169 10 0 "[ . 1 . 2 .]"
1 84 ILE 3.032 0.108 6 0 "[ . 1 . 2 .]"
1 85 ASP 2.011 0.108 6 0 "[ . 1 . 2 .]"
1 86 LEU 3.285 0.256 15 0 "[ . 1 . 2 .]"
1 87 THR 4.238 0.169 14 0 "[ . 1 . 2 .]"
1 88 ASP 1.926 0.077 23 0 "[ . 1 . 2 .]"
1 89 GLN 2.833 0.256 15 0 "[ . 1 . 2 .]"
1 90 LEU 6.272 0.169 14 0 "[ . 1 . 2 .]"
1 91 ALA 1.047 0.130 10 0 "[ . 1 . 2 .]"
1 92 ASN 4.931 0.099 10 0 "[ . 1 . 2 .]"
1 93 GLN 10.087 0.177 15 0 "[ . 1 . 2 .]"
1 94 LEU 2.774 0.091 19 0 "[ . 1 . 2 .]"
1 95 PRO 0.507 0.047 14 0 "[ . 1 . 2 .]"
1 96 GLN 1.752 0.069 7 0 "[ . 1 . 2 .]"
1 97 TRP 4.640 0.134 8 0 "[ . 1 . 2 .]"
1 98 LEU 2.291 0.113 18 0 "[ . 1 . 2 .]"
1 99 VAL 1.500 0.069 15 0 "[ . 1 . 2 .]"
1 100 GLN 1.176 0.125 22 0 "[ . 1 . 2 .]"
1 101 GLN 0.282 0.125 22 0 "[ . 1 . 2 .]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 10 ALA HA 1 11 GLN QG 4.000 . 5.500 3.484 3.163 4.029 . 0 0 "[ . 1 . 2 .]" 1
2 1 10 ALA MB 1 11 GLN QG 3.000 . 4.300 4.175 3.430 4.406 0.106 3 0 "[ . 1 . 2 .]" 1
3 1 10 ALA MB 1 43 VAL MG1 2.500 . 3.700 2.865 2.412 3.258 . 0 0 "[ . 1 . 2 .]" 1
4 1 10 ALA MB 1 43 VAL HA 4.000 . 5.500 5.008 4.112 5.529 0.029 19 0 "[ . 1 . 2 .]" 1
5 1 11 GLN HA 1 11 GLN QG 3.000 . 3.800 2.600 2.180 3.071 . 0 0 "[ . 1 . 2 .]" 1
6 1 11 GLN HA 1 12 PRO HD3 2.500 . 2.700 2.315 2.069 2.566 . 0 0 "[ . 1 . 2 .]" 1
7 1 11 GLN QG 1 12 PRO HD2 4.000 . 5.500 3.872 2.808 4.615 . 0 0 "[ . 1 . 2 .]" 1
8 1 11 GLN QG 1 14 LEU MD1 4.000 . 6.000 6.002 5.796 6.083 0.083 20 0 "[ . 1 . 2 .]" 1
9 1 11 GLN QG 1 75 PRO HG3 4.000 . 5.500 4.619 3.804 5.481 . 0 0 "[ . 1 . 2 .]" 1
10 1 12 PRO HB3 1 14 LEU MD2 4.000 . 5.500 4.588 4.271 4.922 . 0 0 "[ . 1 . 2 .]" 1
11 1 12 PRO HB2 1 14 LEU MD2 4.000 . 5.500 3.085 2.804 3.553 . 0 0 "[ . 1 . 2 .]" 1
12 1 12 PRO QG 1 14 LEU MD2 4.000 . 6.000 3.512 3.215 3.848 . 0 0 "[ . 1 . 2 .]" 1
13 1 13 LEU HA 1 13 LEU MD1 4.000 . 5.500 3.689 3.636 3.727 . 0 0 "[ . 1 . 2 .]" 1
14 1 13 LEU HB3 1 13 LEU MD1 3.000 . 3.800 2.355 2.286 2.426 . 0 0 "[ . 1 . 2 .]" 1
15 1 13 LEU HB2 1 13 LEU MD1 3.000 . 3.800 2.275 2.155 2.333 . 0 0 "[ . 1 . 2 .]" 1
16 1 13 LEU HA 1 13 LEU MD2 2.500 . 3.200 2.829 2.685 2.957 . 0 0 "[ . 1 . 2 .]" 1
17 1 13 LEU HA 1 13 LEU HG 4.000 . 5.000 2.322 2.275 2.373 . 0 0 "[ . 1 . 2 .]" 1
18 1 13 LEU MD1 1 45 ILE HA 3.000 . 3.800 3.916 3.862 3.983 0.183 24 0 "[ . 1 . 2 .]" 1
19 1 13 LEU HB3 1 45 ILE MG 4.000 . 5.500 2.102 1.940 2.322 . 0 0 "[ . 1 . 2 .]" 1
20 1 13 LEU HB3 1 45 ILE HA 4.000 . 5.000 2.156 2.108 2.225 . 0 0 "[ . 1 . 2 .]" 1
21 1 13 LEU HB2 1 45 ILE MD 4.000 . 5.500 4.441 4.060 4.645 . 0 0 "[ . 1 . 2 .]" 1
22 1 13 LEU HB2 1 45 ILE HA 4.000 . 5.000 3.352 3.047 3.535 . 0 0 "[ . 1 . 2 .]" 1
23 1 13 LEU HB2 1 45 ILE MG 4.000 . 5.500 3.516 3.336 3.725 . 0 0 "[ . 1 . 2 .]" 1
24 1 13 LEU HG 1 45 ILE MG 4.000 . 5.500 3.959 3.862 4.170 . 0 0 "[ . 1 . 2 .]" 1
25 1 13 LEU MD1 1 72 LYS HG3 2.500 . 3.200 3.202 2.965 3.286 0.086 5 0 "[ . 1 . 2 .]" 1
26 1 13 LEU MD2 1 72 LYS HG2 3.000 . 3.800 2.815 2.292 3.093 . 0 0 "[ . 1 . 2 .]" 1
27 1 13 LEU MD2 1 72 LYS HD2 4.000 . 5.500 4.259 3.972 4.631 . 0 0 "[ . 1 . 2 .]" 1
28 1 13 LEU MD2 1 72 LYS HD3 4.000 . 5.500 3.832 2.807 4.451 . 0 0 "[ . 1 . 2 .]" 1
29 1 13 LEU HA 1 75 PRO HD3 3.000 . 3.300 2.215 2.046 3.325 0.025 1 0 "[ . 1 . 2 .]" 1
30 1 13 LEU MD2 1 75 PRO HD3 4.000 . 5.500 4.061 3.649 4.528 . 0 0 "[ . 1 . 2 .]" 1
31 1 13 LEU MD2 1 75 PRO HD2 3.000 . 3.800 3.780 3.648 3.868 0.068 2 0 "[ . 1 . 2 .]" 1
32 1 13 LEU HA 1 75 PRO HD2 3.000 . 3.300 2.222 2.132 3.375 0.075 20 0 "[ . 1 . 2 .]" 1
33 1 13 LEU MD1 1 97 TRP HE3 4.000 . 5.500 2.472 2.052 2.925 . 0 0 "[ . 1 . 2 .]" 1
34 1 13 LEU MD1 1 97 TRP HZ3 4.000 . 5.500 3.379 2.685 3.900 . 0 0 "[ . 1 . 2 .]" 1
35 1 13 LEU MD2 1 97 TRP HZ3 4.000 . 5.500 3.788 3.239 4.322 . 0 0 "[ . 1 . 2 .]" 1
36 1 14 LEU HA 1 14 LEU HG 4.000 . 5.000 3.267 3.146 3.733 . 0 0 "[ . 1 . 2 .]" 1
37 1 14 LEU HA 1 14 LEU MD1 4.000 . 5.500 3.581 2.154 3.729 . 0 0 "[ . 1 . 2 .]" 1
38 1 14 LEU HB2 1 14 LEU MD1 3.000 . 3.800 2.503 2.385 3.164 . 0 0 "[ . 1 . 2 .]" 1
39 1 14 LEU HB3 1 14 LEU MD1 3.000 . 3.800 2.273 2.145 2.359 . 0 0 "[ . 1 . 2 .]" 1
40 1 14 LEU HB2 1 14 LEU MD2 3.000 . 3.800 3.142 2.589 3.192 . 0 0 "[ . 1 . 2 .]" 1
41 1 14 LEU HA 1 14 LEU MD2 2.500 . 3.200 1.955 1.931 2.123 . 0 0 "[ . 1 . 2 .]" 1
42 1 14 LEU HB3 1 14 LEU MD2 3.000 . 3.800 2.479 2.350 3.174 . 0 0 "[ . 1 . 2 .]" 1
43 1 14 LEU MD2 1 45 ILE MG 3.000 . 4.300 4.411 4.369 4.447 0.147 5 0 "[ . 1 . 2 .]" 1
44 1 14 LEU MD2 1 46 SER HA 4.000 . 5.500 5.164 4.685 5.540 0.040 8 0 "[ . 1 . 2 .]" 1
45 1 14 LEU MD2 1 46 SER HB3 3.000 . 3.800 2.721 2.242 3.215 . 0 0 "[ . 1 . 2 .]" 1
46 1 14 LEU MD2 1 46 SER HB2 3.000 . 3.800 3.541 2.959 3.765 . 0 0 "[ . 1 . 2 .]" 1
47 1 14 LEU HA 1 46 SER HB3 3.000 . 3.300 2.859 2.336 3.238 . 0 0 "[ . 1 . 2 .]" 1
48 1 14 LEU HA 1 46 SER HB2 4.000 . 5.000 4.365 3.818 4.624 . 0 0 "[ . 1 . 2 .]" 1
49 1 14 LEU MD1 1 73 ILE HG13 4.000 . 5.500 3.093 2.851 3.705 . 0 0 "[ . 1 . 2 .]" 1
50 1 14 LEU HB2 1 73 ILE HB 4.000 . 5.000 3.713 3.536 4.088 . 0 0 "[ . 1 . 2 .]" 1
51 1 14 LEU HB3 1 73 ILE MG 4.000 . 5.500 4.659 4.403 4.883 . 0 0 "[ . 1 . 2 .]" 1
52 1 14 LEU HB3 1 73 ILE MD 4.000 . 5.500 3.238 3.032 3.394 . 0 0 "[ . 1 . 2 .]" 1
53 1 14 LEU HB2 1 73 ILE MG 4.000 . 5.500 4.616 4.471 4.885 . 0 0 "[ . 1 . 2 .]" 1
54 1 14 LEU HB2 1 73 ILE MD 4.000 . 5.500 3.615 3.396 3.802 . 0 0 "[ . 1 . 2 .]" 1
55 1 14 LEU HB3 1 73 ILE HB 4.000 . 5.000 4.360 3.976 4.808 . 0 0 "[ . 1 . 2 .]" 1
56 1 14 LEU MD1 1 73 ILE HB 4.000 . 5.500 3.933 3.559 5.272 . 0 0 "[ . 1 . 2 .]" 1
57 1 14 LEU MD1 1 73 ILE MG 4.000 . 6.000 4.615 4.424 5.277 . 0 0 "[ . 1 . 2 .]" 1
58 1 14 LEU MD1 1 73 ILE MD 3.000 . 4.300 4.233 4.073 4.345 0.045 14 0 "[ . 1 . 2 .]" 1
59 1 15 LEU HA 1 15 LEU MD2 3.000 . 3.800 1.967 1.937 1.979 . 0 0 "[ . 1 . 2 .]" 1
60 1 15 LEU HA 1 15 LEU MD1 4.000 . 5.500 2.733 2.635 2.851 . 0 0 "[ . 1 . 2 .]" 1
61 1 15 LEU MD1 1 45 ILE MG 2.500 . 3.700 3.786 3.723 3.829 0.129 1 0 "[ . 1 . 2 .]" 1
62 1 15 LEU HB3 1 47 LEU HA 4.000 . 5.000 2.525 2.252 2.790 . 0 0 "[ . 1 . 2 .]" 1
63 1 15 LEU MD1 1 47 LEU MD2 3.000 . 4.300 2.222 2.092 2.366 . 0 0 "[ . 1 . 2 .]" 1
64 1 15 LEU HB3 1 47 LEU MD2 3.000 . 3.800 3.450 2.908 3.697 . 0 0 "[ . 1 . 2 .]" 1
65 1 15 LEU HA 1 47 LEU MD2 4.000 . 5.500 4.848 4.721 4.994 . 0 0 "[ . 1 . 2 .]" 1
66 1 15 LEU MD2 1 70 LEU MD1 2.500 . 3.700 3.123 2.914 3.478 . 0 0 "[ . 1 . 2 .]" 1
67 1 15 LEU HA 1 72 LYS HA 3.000 . 3.300 2.611 2.447 2.803 . 0 0 "[ . 1 . 2 .]" 1
68 1 15 LEU MD2 1 72 LYS HD2 4.000 . 5.500 4.349 3.935 4.808 . 0 0 "[ . 1 . 2 .]" 1
69 1 15 LEU MD2 1 72 LYS HG2 3.000 . 3.800 3.077 2.339 3.590 . 0 0 "[ . 1 . 2 .]" 1
70 1 15 LEU MD2 1 72 LYS HA 2.500 . 3.200 2.223 1.928 2.460 . 0 0 "[ . 1 . 2 .]" 1
71 1 15 LEU MD2 1 72 LYS HB2 4.000 . 6.500 2.466 2.146 2.819 . 0 0 "[ . 1 . 2 .]" 1
72 1 15 LEU MD2 1 97 TRP HZ3 3.000 . 3.800 2.631 2.133 3.453 . 0 0 "[ . 1 . 2 .]" 1
73 1 15 LEU MD2 1 97 TRP HH2 3.000 . 3.800 2.501 2.159 2.971 . 0 0 "[ . 1 . 2 .]" 1
74 1 16 GLN HA 1 16 GLN HG2 4.000 . 5.000 2.351 2.273 2.419 . 0 0 "[ . 1 . 2 .]" 1
75 1 16 GLN HA 1 16 GLN HG3 4.000 . 5.000 2.785 2.651 2.940 . 0 0 "[ . 1 . 2 .]" 1
76 1 16 GLN HB3 1 18 PHE QE 4.000 . 5.000 3.547 2.416 4.375 . 0 0 "[ . 1 . 2 .]" 1
77 1 16 GLN HA 1 48 GLN QG 4.000 . 5.500 4.972 4.557 5.353 . 0 0 "[ . 1 . 2 .]" 1
78 1 16 GLN HA 1 48 GLN HB3 4.000 . 5.000 3.985 3.561 4.448 . 0 0 "[ . 1 . 2 .]" 1
79 1 16 GLN HB2 1 50 ILE MD 4.000 . 5.500 3.636 3.095 4.255 . 0 0 "[ . 1 . 2 .]" 1
80 1 16 GLN HB3 1 50 ILE MD 4.000 . 5.500 2.706 2.140 3.248 . 0 0 "[ . 1 . 2 .]" 1
81 1 16 GLN HG3 1 50 ILE MD 4.000 . 5.500 4.330 3.901 4.619 . 0 0 "[ . 1 . 2 .]" 1
82 1 16 GLN HG2 1 50 ILE MD 4.000 . 5.500 3.575 3.120 3.963 . 0 0 "[ . 1 . 2 .]" 1
83 1 16 GLN HA 1 50 ILE MD 4.000 . 5.500 4.751 4.190 5.079 . 0 0 "[ . 1 . 2 .]" 1
84 1 16 GLN HB2 1 73 ILE MD 4.000 . 6.500 2.551 2.261 2.878 . 0 0 "[ . 1 . 2 .]" 1
85 1 16 GLN HG2 1 73 ILE MD 3.000 . 3.800 3.766 3.530 3.855 0.055 19 0 "[ . 1 . 2 .]" 1
86 1 17 LEU HA 1 17 LEU HG 4.000 . 6.000 2.809 2.717 2.892 . 0 0 "[ . 1 . 2 .]" 1
87 1 17 LEU HA 1 17 LEU MD2 4.000 . 5.500 3.856 3.827 3.885 . 0 0 "[ . 1 . 2 .]" 1
88 1 17 LEU HA 1 17 LEU MD1 3.000 . 3.800 2.201 2.103 2.343 . 0 0 "[ . 1 . 2 .]" 1
89 1 17 LEU MD1 1 18 PHE HA 4.000 . 5.500 4.984 4.842 5.134 . 0 0 "[ . 1 . 2 .]" 1
90 1 17 LEU HG 1 19 VAL MG1 3.000 . 3.800 2.237 2.032 2.504 . 0 0 "[ . 1 . 2 .]" 1
91 1 17 LEU MD2 1 28 ILE MG 3.000 . 4.300 3.367 3.048 3.625 . 0 0 "[ . 1 . 2 .]" 1
92 1 17 LEU MD2 1 29 VAL MG2 2.500 . 3.700 1.801 1.740 1.912 0.060 3 0 "[ . 1 . 2 .]" 1
93 1 17 LEU MD2 1 29 VAL HA 3.000 . 3.800 2.781 2.664 2.919 . 0 0 "[ . 1 . 2 .]" 1
94 1 17 LEU MD1 1 29 VAL HA 4.000 . 5.500 4.283 3.922 4.495 . 0 0 "[ . 1 . 2 .]" 1
95 1 17 LEU MD2 1 29 VAL MG1 2.500 . 3.700 3.245 2.948 3.412 . 0 0 "[ . 1 . 2 .]" 1
96 1 17 LEU MD2 1 32 VAL HB 3.000 . 3.800 3.802 3.684 3.860 0.060 3 0 "[ . 1 . 2 .]" 1
97 1 17 LEU HB3 1 47 LEU MD2 4.000 . 5.500 2.684 2.371 3.253 . 0 0 "[ . 1 . 2 .]" 1
98 1 17 LEU HB2 1 47 LEU MD2 3.000 . 3.800 2.425 2.178 2.892 . 0 0 "[ . 1 . 2 .]" 1
99 1 17 LEU MD2 1 49 VAL HA 4.000 . 6.500 4.160 4.005 4.412 . 0 0 "[ . 1 . 2 .]" 1
100 1 17 LEU HB3 1 49 VAL HA 4.000 . 5.000 2.826 2.649 2.993 . 0 0 "[ . 1 . 2 .]" 1
101 1 17 LEU MD2 1 49 VAL QG 2.500 . 3.700 2.528 2.244 2.840 . 0 0 "[ . 1 . 2 .]" 1
102 1 17 LEU HB3 1 49 VAL QG 4.000 . 5.500 2.418 2.041 2.801 . 0 0 "[ . 1 . 2 .]" 1
103 1 17 LEU HB2 1 49 VAL HA 4.000 . 5.000 4.315 4.116 4.494 . 0 0 "[ . 1 . 2 .]" 1
104 1 17 LEU MD1 1 68 PRO HB3 4.000 . 5.500 3.978 3.731 4.234 . 0 0 "[ . 1 . 2 .]" 1
105 1 17 LEU HA 1 70 LEU HA 3.000 . 3.300 2.133 2.099 2.177 . 0 0 "[ . 1 . 2 .]" 1
106 1 17 LEU MD1 1 70 LEU HA 3.000 . 3.800 2.172 2.115 2.340 . 0 0 "[ . 1 . 2 .]" 1
107 1 17 LEU HA 1 70 LEU HB3 4.000 . 5.000 4.863 4.682 5.022 0.022 21 0 "[ . 1 . 2 .]" 1
108 1 17 LEU HA 1 70 LEU HG 4.000 . 6.000 2.730 2.340 3.039 . 0 0 "[ . 1 . 2 .]" 1
109 1 17 LEU HA 1 70 LEU MD2 4.000 . 5.500 3.847 3.666 4.019 . 0 0 "[ . 1 . 2 .]" 1
110 1 17 LEU HB3 1 70 LEU MD2 4.000 . 5.500 5.530 5.413 5.603 0.103 6 0 "[ . 1 . 2 .]" 1
111 1 17 LEU MD1 1 70 LEU HB2 3.000 . 3.800 2.049 1.930 2.196 . 0 0 "[ . 1 . 2 .]" 1
112 1 17 LEU MD1 1 70 LEU MD2 2.500 . 3.700 3.565 3.462 3.694 . 0 0 "[ . 1 . 2 .]" 1
113 1 17 LEU HG 1 86 LEU QD 4.000 . 5.500 3.997 3.835 4.245 . 0 0 "[ . 1 . 2 .]" 1
114 1 17 LEU MD1 1 86 LEU QD 2.500 . 3.700 2.017 1.837 2.233 . 0 0 "[ . 1 . 2 .]" 1
115 1 18 PHE HA 1 18 PHE QD 4.000 . 5.000 2.928 2.655 3.059 . 0 0 "[ . 1 . 2 .]" 1
116 1 18 PHE HA 1 19 VAL MG1 4.000 . 5.500 3.427 3.255 3.636 . 0 0 "[ . 1 . 2 .]" 1
117 1 18 PHE HA 1 19 VAL MG2 4.000 . 5.500 3.848 3.666 4.017 . 0 0 "[ . 1 . 2 .]" 1
118 1 18 PHE QD 1 50 ILE MG 4.000 . 5.500 3.338 2.782 4.163 . 0 0 "[ . 1 . 2 .]" 1
119 1 18 PHE QD 1 50 ILE MD 4.000 . 6.500 3.636 3.283 3.868 . 0 0 "[ . 1 . 2 .]" 1
120 1 18 PHE QE 1 50 ILE MG 4.000 . 5.500 2.585 2.168 3.604 . 0 0 "[ . 1 . 2 .]" 1
121 1 18 PHE HA 1 50 ILE HB 3.000 . 3.300 2.874 2.526 3.177 . 0 0 "[ . 1 . 2 .]" 1
122 1 18 PHE HA 1 50 ILE MG 4.000 . 5.500 4.257 3.943 4.587 . 0 0 "[ . 1 . 2 .]" 1
123 1 18 PHE HA 1 50 ILE MD 4.000 . 5.500 4.508 3.939 4.752 . 0 0 "[ . 1 . 2 .]" 1
124 1 18 PHE QE 1 50 ILE MD 4.000 . 6.500 2.391 2.129 2.708 . 0 0 "[ . 1 . 2 .]" 1
125 1 18 PHE HZ 1 50 ILE MD 4.000 . 5.500 2.368 1.979 2.771 . 0 0 "[ . 1 . 2 .]" 1
126 1 18 PHE QD 1 52 VAL MG1 3.000 . 3.800 2.028 1.937 2.134 . 0 0 "[ . 1 . 2 .]" 1
127 1 18 PHE QD 1 52 VAL HA 4.000 . 5.000 3.487 2.914 3.885 . 0 0 "[ . 1 . 2 .]" 1
128 1 18 PHE HA 1 52 VAL MG1 4.000 . 5.500 3.207 2.966 3.504 . 0 0 "[ . 1 . 2 .]" 1
129 1 18 PHE HB3 1 52 VAL MG1 3.000 . 3.800 2.092 1.912 2.447 . 0 0 "[ . 1 . 2 .]" 1
130 1 18 PHE QE 1 52 VAL MG1 3.000 . 3.800 3.841 3.746 3.910 0.110 1 0 "[ . 1 . 2 .]" 1
131 1 18 PHE HB2 1 52 VAL MG1 4.000 . 5.500 3.465 3.262 3.858 . 0 0 "[ . 1 . 2 .]" 1
132 1 18 PHE HB3 1 52 VAL MG2 4.000 . 5.500 4.127 3.815 4.496 . 0 0 "[ . 1 . 2 .]" 1
133 1 18 PHE HA 1 52 VAL MG2 4.000 . 6.500 5.093 4.694 5.417 . 0 0 "[ . 1 . 2 .]" 1
134 1 18 PHE QD 1 52 VAL MG2 4.000 . 6.500 4.522 4.375 4.741 . 0 0 "[ . 1 . 2 .]" 1
135 1 18 PHE HB2 1 52 VAL MG2 4.000 . 6.500 5.478 5.048 5.877 . 0 0 "[ . 1 . 2 .]" 1
136 1 18 PHE QE 1 58 LEU MD1 4.000 . 6.500 2.102 1.867 2.699 . 0 0 "[ . 1 . 2 .]" 1
137 1 18 PHE QE 1 58 LEU MD2 4.000 . 5.500 2.705 2.098 4.317 . 0 0 "[ . 1 . 2 .]" 1
138 1 18 PHE HZ 1 58 LEU MD1 4.000 . 5.500 2.668 1.948 3.699 . 0 0 "[ . 1 . 2 .]" 1
139 1 18 PHE QD 1 59 VAL MG2 3.000 . 3.800 2.337 2.117 2.813 . 0 0 "[ . 1 . 2 .]" 1
140 1 18 PHE QE 1 59 VAL MG2 4.000 . 5.500 2.504 2.071 3.497 . 0 0 "[ . 1 . 2 .]" 1
141 1 18 PHE HZ 1 62 TYR QE 4.000 . 5.000 3.041 2.191 4.177 . 0 0 "[ . 1 . 2 .]" 1
142 1 18 PHE QD 1 64 LEU MD1 4.000 . 5.500 4.120 3.546 4.651 . 0 0 "[ . 1 . 2 .]" 1
143 1 18 PHE HB3 1 64 LEU MD1 4.000 . 5.500 3.744 2.874 4.217 . 0 0 "[ . 1 . 2 .]" 1
144 1 18 PHE QD 1 64 LEU MD2 4.000 . 6.500 4.450 3.266 5.535 . 0 0 "[ . 1 . 2 .]" 1
145 1 18 PHE HB2 1 64 LEU MD1 4.000 . 5.500 3.521 2.591 3.859 . 0 0 "[ . 1 . 2 .]" 1
146 1 18 PHE HA 1 67 THR MG 4.000 . 6.500 4.686 4.243 5.107 . 0 0 "[ . 1 . 2 .]" 1
147 1 18 PHE HB3 1 67 THR MG 3.000 . 3.800 2.830 2.312 3.339 . 0 0 "[ . 1 . 2 .]" 1
148 1 18 PHE HB2 1 67 THR MG 4.000 . 5.500 3.386 2.974 3.956 . 0 0 "[ . 1 . 2 .]" 1
149 1 18 PHE QD 1 69 ALA MB 4.000 . 5.500 3.614 2.967 4.231 . 0 0 "[ . 1 . 2 .]" 1
150 1 18 PHE HB2 1 69 ALA MB 4.000 . 5.500 2.462 2.177 2.745 . 0 0 "[ . 1 . 2 .]" 1
151 1 18 PHE HB3 1 69 ALA MB 4.000 . 6.500 3.704 3.322 3.946 . 0 0 "[ . 1 . 2 .]" 1
152 1 18 PHE QE 1 71 VAL MG2 4.000 . 5.500 2.899 2.173 3.873 . 0 0 "[ . 1 . 2 .]" 1
153 1 18 PHE QD 1 71 VAL MG2 4.000 . 5.500 2.765 2.220 3.563 . 0 0 "[ . 1 . 2 .]" 1
154 1 19 VAL HA 1 19 VAL MG1 2.500 . 3.200 2.420 2.332 2.511 . 0 0 "[ . 1 . 2 .]" 1
155 1 19 VAL HA 1 19 VAL MG2 3.000 . 3.800 3.183 3.170 3.194 . 0 0 "[ . 1 . 2 .]" 1
156 1 19 VAL HB 1 25 SER HA 4.000 . 5.000 4.547 4.428 4.957 . 0 0 "[ . 1 . 2 .]" 1
157 1 19 VAL MG2 1 25 SER HA 4.000 . 6.500 5.565 5.381 5.790 . 0 0 "[ . 1 . 2 .]" 1
158 1 19 VAL HB 1 25 SER QB 4.000 . 5.500 2.125 1.981 2.555 . 0 0 "[ . 1 . 2 .]" 1
159 1 19 VAL HB 1 26 GLN HA 4.000 . 6.000 5.750 5.320 5.989 . 0 0 "[ . 1 . 2 .]" 1
160 1 19 VAL MG2 1 29 VAL MG2 3.000 . 4.300 3.810 3.537 3.959 . 0 0 "[ . 1 . 2 .]" 1
161 1 19 VAL MG2 1 49 VAL HA 4.000 . 5.500 4.427 4.264 4.762 . 0 0 "[ . 1 . 2 .]" 1
162 1 19 VAL MG2 1 51 ASN HA 2.500 . 3.200 2.927 2.745 3.109 . 0 0 "[ . 1 . 2 .]" 1
163 1 19 VAL MG2 1 51 ASN HB3 4.000 . 5.500 4.774 4.188 5.257 . 0 0 "[ . 1 . 2 .]" 1
164 1 19 VAL MG2 1 51 ASN HB2 4.000 . 5.500 4.731 3.769 5.275 . 0 0 "[ . 1 . 2 .]" 1
165 1 19 VAL MG2 1 52 VAL MG1 4.000 . 6.000 4.299 4.095 4.501 . 0 0 "[ . 1 . 2 .]" 1
166 1 19 VAL HA 1 52 VAL MG1 4.000 . 5.500 3.848 3.526 4.221 . 0 0 "[ . 1 . 2 .]" 1
167 1 19 VAL HA 1 67 THR HB 3.000 . 3.300 3.325 3.241 3.379 0.079 3 0 "[ . 1 . 2 .]" 1
168 1 19 VAL HA 1 67 THR MG 3.000 . 3.800 3.617 3.277 3.814 0.014 7 0 "[ . 1 . 2 .]" 1
169 1 19 VAL MG1 1 68 PRO QG 4.000 . 6.000 4.027 3.783 4.189 . 0 0 "[ . 1 . 2 .]" 1
170 1 19 VAL MG1 1 68 PRO HB3 3.000 . 3.800 2.629 2.447 2.776 . 0 0 "[ . 1 . 2 .]" 1
171 1 19 VAL MG1 1 68 PRO HA 4.000 . 5.500 3.796 3.631 3.916 . 0 0 "[ . 1 . 2 .]" 1
172 1 19 VAL MG1 1 68 PRO HB2 3.000 . 3.800 3.726 3.513 3.855 0.055 13 0 "[ . 1 . 2 .]" 1
173 1 19 VAL HA 1 68 PRO HA 3.000 . 3.300 3.015 2.816 3.191 . 0 0 "[ . 1 . 2 .]" 1
174 1 19 VAL HA 1 68 PRO QG 4.000 . 6.500 4.331 4.004 4.665 . 0 0 "[ . 1 . 2 .]" 1
175 1 19 VAL HA 1 68 PRO HB2 4.000 . 5.000 4.657 4.405 4.993 . 0 0 "[ . 1 . 2 .]" 1
176 1 19 VAL HA 1 68 PRO HB3 4.000 . 5.000 3.073 2.827 3.447 . 0 0 "[ . 1 . 2 .]" 1
177 1 20 ASP HA 1 21 THR MG 4.000 . 5.500 3.061 2.968 3.446 . 0 0 "[ . 1 . 2 .]" 1
178 1 20 ASP HA 1 52 VAL MG1 4.000 . 5.500 4.101 3.768 4.682 . 0 0 "[ . 1 . 2 .]" 1
179 1 20 ASP HA 1 52 VAL MG2 2.500 . 3.200 2.337 2.117 2.881 . 0 0 "[ . 1 . 2 .]" 1
180 1 20 ASP HB2 1 52 VAL MG2 4.000 . 5.500 3.350 3.031 3.647 . 0 0 "[ . 1 . 2 .]" 1
181 1 20 ASP HB3 1 52 VAL MG2 3.000 . 3.800 2.649 1.936 3.178 . 0 0 "[ . 1 . 2 .]" 1
182 1 20 ASP HA 1 67 THR MG 4.000 . 5.500 4.794 4.298 5.436 . 0 0 "[ . 1 . 2 .]" 1
183 1 21 THR HA 1 21 THR MG 2.500 . 3.200 2.485 2.273 2.565 . 0 0 "[ . 1 . 2 .]" 1
184 1 21 THR MG 1 53 ALA MB 3.000 . 4.300 3.157 2.592 3.506 . 0 0 "[ . 1 . 2 .]" 1
185 1 22 ARG HA 1 22 ARG HD2 4.000 . 5.000 4.830 4.499 5.096 0.096 9 0 "[ . 1 . 2 .]" 1
186 1 22 ARG HA 1 22 ARG HD3 4.000 . 6.000 5.146 3.846 5.513 . 0 0 "[ . 1 . 2 .]" 1
187 1 22 ARG QG 1 23 PRO HD2 4.000 . 5.500 3.764 3.390 4.182 . 0 0 "[ . 1 . 2 .]" 1
188 1 22 ARG HA 1 23 PRO HD2 3.000 . 3.300 2.219 2.177 2.308 . 0 0 "[ . 1 . 2 .]" 1
189 1 22 ARG HA 1 23 PRO HD3 3.000 . 3.300 2.328 2.193 2.385 . 0 0 "[ . 1 . 2 .]" 1
190 1 22 ARG QB 1 23 PRO HD3 3.000 . 3.800 3.604 3.465 3.816 0.016 3 0 "[ . 1 . 2 .]" 1
191 1 22 ARG QG 1 23 PRO HD3 4.000 . 5.500 4.662 4.389 4.998 . 0 0 "[ . 1 . 2 .]" 1
192 1 22 ARG HD2 1 24 LEU MD2 4.000 . 5.500 4.079 2.812 5.212 . 0 0 "[ . 1 . 2 .]" 1
193 1 23 PRO HD3 1 26 GLN QB 4.000 . 5.500 5.526 5.453 5.565 0.065 3 0 "[ . 1 . 2 .]" 1
194 1 23 PRO HA 1 26 GLN QB 4.000 . 5.500 2.414 2.234 2.523 . 0 0 "[ . 1 . 2 .]" 1
195 1 23 PRO HA 1 26 GLN QG 3.000 . 3.800 2.990 2.577 3.440 . 0 0 "[ . 1 . 2 .]" 1
196 1 23 PRO HG2 1 27 HIS HD2 4.000 . 6.000 6.076 6.038 6.111 0.111 6 0 "[ . 1 . 2 .]" 1
197 1 24 LEU HA 1 24 LEU HG 4.000 . 5.000 2.767 2.549 2.873 . 0 0 "[ . 1 . 2 .]" 1
198 1 24 LEU HB3 1 24 LEU MD2 2.500 . 3.200 2.192 2.105 2.276 . 0 0 "[ . 1 . 2 .]" 1
199 1 24 LEU HB2 1 24 LEU MD2 3.000 . 3.800 2.535 2.465 2.692 . 0 0 "[ . 1 . 2 .]" 1
200 1 24 LEU HA 1 24 LEU MD1 2.500 . 3.200 2.195 2.133 2.377 . 0 0 "[ . 1 . 2 .]" 1
201 1 24 LEU HB2 1 24 LEU MD1 2.500 . 3.200 2.172 2.117 2.242 . 0 0 "[ . 1 . 2 .]" 1
202 1 24 LEU HB3 1 24 LEU MD1 3.000 . 3.800 3.161 3.122 3.176 . 0 0 "[ . 1 . 2 .]" 1
203 1 24 LEU HA 1 24 LEU MD2 3.000 . 3.800 3.840 3.810 3.855 0.055 24 0 "[ . 1 . 2 .]" 1
204 1 24 LEU HA 1 27 HIS QB 3.000 . 3.800 2.090 2.049 2.183 . 0 0 "[ . 1 . 2 .]" 1
205 1 24 LEU MD1 1 27 HIS HD2 4.000 . 5.500 3.514 3.380 3.657 . 0 0 "[ . 1 . 2 .]" 1
206 1 24 LEU MD1 1 27 HIS QB 4.000 . 6.000 2.883 2.632 3.230 . 0 0 "[ . 1 . 2 .]" 1
207 1 24 LEU HA 1 27 HIS HD2 3.000 . 3.300 3.404 3.374 3.439 0.139 3 0 "[ . 1 . 2 .]" 1
208 1 24 LEU HG 1 28 ILE MD 3.000 . 3.800 2.275 2.098 2.557 . 0 0 "[ . 1 . 2 .]" 1
209 1 24 LEU MD1 1 28 ILE MD 3.000 . 4.300 3.257 2.823 3.591 . 0 0 "[ . 1 . 2 .]" 1
210 1 24 LEU MD1 1 28 ILE HG13 3.000 . 3.800 3.210 2.802 3.687 . 0 0 "[ . 1 . 2 .]" 1
211 1 24 LEU HB3 1 28 ILE MD 4.000 . 5.500 4.110 3.881 4.337 . 0 0 "[ . 1 . 2 .]" 1
212 1 24 LEU MD2 1 68 PRO QD 4.000 . 6.000 2.548 2.225 2.920 . 0 0 "[ . 1 . 2 .]" 1
213 1 24 LEU MD2 1 84 ILE HB 4.000 . 5.500 3.364 2.769 4.021 . 0 0 "[ . 1 . 2 .]" 1
214 1 24 LEU MD1 1 84 ILE HA 4.000 . 5.500 5.244 4.574 5.510 0.010 18 0 "[ . 1 . 2 .]" 1
215 1 24 LEU MD2 1 84 ILE HA 4.000 . 5.500 3.926 3.251 4.405 . 0 0 "[ . 1 . 2 .]" 1
216 1 25 SER HA 1 28 ILE MG 4.000 . 5.500 4.016 3.930 4.082 . 0 0 "[ . 1 . 2 .]" 1
217 1 25 SER HA 1 28 ILE MD 4.000 . 5.500 2.981 2.614 3.376 . 0 0 "[ . 1 . 2 .]" 1
218 1 25 SER HA 1 28 ILE HG13 4.000 . 5.000 3.678 3.391 4.052 . 0 0 "[ . 1 . 2 .]" 1
219 1 25 SER HA 1 28 ILE HB 3.000 . 3.300 2.550 2.406 2.684 . 0 0 "[ . 1 . 2 .]" 1
220 1 25 SER HA 1 29 VAL MG2 4.000 . 5.500 3.677 3.353 4.015 . 0 0 "[ . 1 . 2 .]" 1
221 1 25 SER HA 1 68 PRO QG 4.000 . 5.500 2.646 2.349 3.002 . 0 0 "[ . 1 . 2 .]" 1
222 1 25 SER HA 1 68 PRO HB3 4.000 . 6.000 3.236 2.798 3.502 . 0 0 "[ . 1 . 2 .]" 1
223 1 26 GLN HA 1 26 GLN QG 2.500 . 3.200 2.660 2.312 3.058 . 0 0 "[ . 1 . 2 .]" 1
224 1 26 GLN QB 1 27 HIS HA 4.000 . 6.500 3.951 3.926 3.986 . 0 0 "[ . 1 . 2 .]" 1
225 1 26 GLN QB 1 27 HIS HD2 4.000 . 6.500 6.039 5.837 6.175 . 0 0 "[ . 1 . 2 .]" 1
226 1 26 GLN HA 1 29 VAL HB 3.000 . 3.300 2.249 2.181 2.366 . 0 0 "[ . 1 . 2 .]" 1
227 1 26 GLN HA 1 29 VAL MG2 3.000 . 3.800 2.167 2.135 2.433 . 0 0 "[ . 1 . 2 .]" 1
228 1 26 GLN QB 1 29 VAL MG2 4.000 . 6.000 4.054 3.947 4.259 . 0 0 "[ . 1 . 2 .]" 1
229 1 26 GLN HA 1 29 VAL MG1 3.000 . 3.800 3.537 3.430 3.673 . 0 0 "[ . 1 . 2 .]" 1
230 1 26 GLN QG 1 29 VAL MG2 4.000 . 7.000 3.742 3.327 4.206 . 0 0 "[ . 1 . 2 .]" 1
231 1 27 HIS QB 1 28 ILE HA 4.000 . 6.500 3.768 3.739 3.795 . 0 0 "[ . 1 . 2 .]" 1
232 1 27 HIS HA 1 30 GLN QB 3.000 . 3.800 3.594 3.458 3.736 . 0 0 "[ . 1 . 2 .]" 1
233 1 27 HIS HA 1 30 GLN QG 3.000 . 3.800 3.360 2.922 3.712 . 0 0 "[ . 1 . 2 .]" 1
234 1 28 ILE HA 1 28 ILE HG13 3.000 . 3.300 2.909 2.779 2.994 . 0 0 "[ . 1 . 2 .]" 1
235 1 28 ILE HA 1 28 ILE HG12 3.000 . 3.300 2.479 2.433 2.549 . 0 0 "[ . 1 . 2 .]" 1
236 1 28 ILE HA 1 28 ILE MG 2.500 . 3.200 2.358 2.309 2.453 . 0 0 "[ . 1 . 2 .]" 1
237 1 28 ILE HA 1 28 ILE MD 3.000 . 3.800 3.788 3.766 3.805 0.005 24 0 "[ . 1 . 2 .]" 1
238 1 28 ILE HB 1 28 ILE MD 3.000 . 3.800 2.274 2.162 2.407 . 0 0 "[ . 1 . 2 .]" 1
239 1 28 ILE MG 1 29 VAL HA 4.000 . 5.500 3.586 3.415 3.742 . 0 0 "[ . 1 . 2 .]" 1
240 1 28 ILE MG 1 29 VAL MG2 4.000 . 6.000 3.798 3.590 3.941 . 0 0 "[ . 1 . 2 .]" 1
241 1 28 ILE HB 1 29 VAL MG2 4.000 . 5.500 3.625 3.446 3.802 . 0 0 "[ . 1 . 2 .]" 1
242 1 28 ILE HA 1 31 ARG QB 3.000 . 3.800 2.432 2.288 2.676 . 0 0 "[ . 1 . 2 .]" 1
243 1 28 ILE HA 1 31 ARG HG3 4.000 . 5.000 2.883 2.542 3.103 . 0 0 "[ . 1 . 2 .]" 1
244 1 28 ILE HA 1 31 ARG QD 3.000 . 3.800 2.792 2.403 3.822 0.022 5 0 "[ . 1 . 2 .]" 1
245 1 28 ILE MG 1 31 ARG QD 4.000 . 6.000 3.564 3.078 4.533 . 0 0 "[ . 1 . 2 .]" 1
246 1 28 ILE MD 1 31 ARG QD 4.000 . 6.000 4.713 4.314 5.614 . 0 0 "[ . 1 . 2 .]" 1
247 1 28 ILE HA 1 32 VAL MG2 4.000 . 5.500 4.066 3.837 4.377 . 0 0 "[ . 1 . 2 .]" 1
248 1 28 ILE MG 1 68 PRO QG 3.000 . 4.300 3.949 3.607 4.312 0.012 1 0 "[ . 1 . 2 .]" 1
249 1 28 ILE MD 1 68 PRO QG 3.000 . 4.300 2.036 1.908 2.231 . 0 0 "[ . 1 . 2 .]" 1
250 1 28 ILE MG 1 68 PRO HB2 4.000 . 5.500 3.943 3.677 4.273 . 0 0 "[ . 1 . 2 .]" 1
251 1 28 ILE MG 1 68 PRO HB3 4.000 . 5.500 4.932 4.667 5.232 . 0 0 "[ . 1 . 2 .]" 1
252 1 28 ILE HB 1 68 PRO QG 4.000 . 6.500 3.693 3.356 4.166 . 0 0 "[ . 1 . 2 .]" 1
253 1 28 ILE MD 1 68 PRO QD 4.000 . 6.000 3.218 2.986 3.488 . 0 0 "[ . 1 . 2 .]" 1
254 1 28 ILE MD 1 84 ILE HA 3.000 . 3.800 2.238 2.106 2.551 . 0 0 "[ . 1 . 2 .]" 1
255 1 28 ILE MG 1 86 LEU QD 2.500 . 3.700 2.244 1.992 2.445 . 0 0 "[ . 1 . 2 .]" 1
256 1 28 ILE MD 1 86 LEU QD 3.000 . 4.300 2.285 1.941 2.763 . 0 0 "[ . 1 . 2 .]" 1
257 1 28 ILE MD 1 86 LEU HB3 4.000 . 6.500 4.778 4.293 5.368 . 0 0 "[ . 1 . 2 .]" 1
258 1 28 ILE MG 1 87 THR MG 2.500 . 3.700 2.257 1.969 2.683 . 0 0 "[ . 1 . 2 .]" 1
259 1 28 ILE MD 1 87 THR MG 3.000 . 4.300 3.785 3.286 4.119 . 0 0 "[ . 1 . 2 .]" 1
260 1 28 ILE HG13 1 87 THR MG 4.000 . 5.500 4.727 4.365 5.031 . 0 0 "[ . 1 . 2 .]" 1
261 1 28 ILE HA 1 87 THR MG 3.000 . 3.800 3.351 3.162 3.781 . 0 0 "[ . 1 . 2 .]" 1
262 1 28 ILE HG12 1 87 THR MG 3.000 . 3.800 3.337 2.941 3.717 . 0 0 "[ . 1 . 2 .]" 1
263 1 29 VAL HA 1 29 VAL MG2 2.500 . 3.200 2.240 2.201 2.292 . 0 0 "[ . 1 . 2 .]" 1
264 1 29 VAL HA 1 29 VAL MG1 2.500 . 3.200 2.417 2.347 2.460 . 0 0 "[ . 1 . 2 .]" 1
265 1 29 VAL MG1 1 30 GLN QG 3.000 . 4.300 3.647 3.210 4.184 . 0 0 "[ . 1 . 2 .]" 1
266 1 29 VAL MG1 1 30 GLN HA 3.000 . 3.800 3.277 3.173 3.493 . 0 0 "[ . 1 . 2 .]" 1
267 1 29 VAL HA 1 32 VAL HB 3.000 . 3.300 2.408 2.348 2.494 . 0 0 "[ . 1 . 2 .]" 1
268 1 29 VAL HA 1 32 VAL MG2 3.000 . 3.800 2.705 2.435 3.061 . 0 0 "[ . 1 . 2 .]" 1
269 1 29 VAL HA 1 32 VAL MG1 3.000 . 3.800 3.812 3.751 3.868 0.068 12 0 "[ . 1 . 2 .]" 1
270 1 29 VAL MG1 1 33 LYS QD 3.000 . 4.300 2.646 2.349 2.891 . 0 0 "[ . 1 . 2 .]" 1
271 1 29 VAL MG1 1 33 LYS HE2 2.500 . 3.200 2.420 1.949 3.273 0.073 23 0 "[ . 1 . 2 .]" 1
272 1 29 VAL MG1 1 33 LYS HE3 2.500 . 3.200 2.268 1.894 3.106 . 0 0 "[ . 1 . 2 .]" 1
273 1 29 VAL MG1 1 47 LEU MD1 2.500 . 3.700 2.738 2.516 2.934 . 0 0 "[ . 1 . 2 .]" 1
274 1 29 VAL MG1 1 47 LEU MD2 3.000 . 4.300 3.998 3.736 4.196 . 0 0 "[ . 1 . 2 .]" 1
275 1 29 VAL MG1 1 47 LEU HG 4.000 . 5.500 5.336 4.151 5.544 0.044 4 0 "[ . 1 . 2 .]" 1
276 1 29 VAL MG2 1 49 VAL HB 4.000 . 5.500 5.134 4.847 5.486 . 0 0 "[ . 1 . 2 .]" 1
277 1 30 GLN HA 1 30 GLN QG 2.500 . 3.200 2.843 2.171 3.112 . 0 0 "[ . 1 . 2 .]" 1
278 1 30 GLN QG 1 31 ARG HG3 4.000 . 5.500 5.091 4.856 5.299 . 0 0 "[ . 1 . 2 .]" 1
279 1 30 GLN QG 1 31 ARG HA 4.000 . 6.500 5.772 5.735 5.792 . 0 0 "[ . 1 . 2 .]" 1
280 1 30 GLN HA 1 33 LYS HB2 3.000 . 3.300 2.556 2.266 2.789 . 0 0 "[ . 1 . 2 .]" 1
281 1 30 GLN HA 1 33 LYS HB3 4.000 . 5.000 4.210 3.938 4.461 . 0 0 "[ . 1 . 2 .]" 1
282 1 30 GLN HA 1 33 LYS QD 3.000 . 3.800 3.227 2.938 3.539 . 0 0 "[ . 1 . 2 .]" 1
283 1 31 ARG QB 1 31 ARG QD 3.000 . 4.300 2.163 2.094 2.330 . 0 0 "[ . 1 . 2 .]" 1
284 1 31 ARG HA 1 31 ARG HG3 3.000 . 3.300 3.063 2.951 3.157 . 0 0 "[ . 1 . 2 .]" 1
285 1 31 ARG HA 1 31 ARG HG2 3.000 . 3.300 2.354 2.294 2.396 . 0 0 "[ . 1 . 2 .]" 1
286 1 31 ARG HA 1 31 ARG QD 3.000 . 3.800 3.887 3.843 4.075 0.275 24 0 "[ . 1 . 2 .]" 1
287 1 31 ARG HA 1 34 ASN HB2 3.000 . 3.300 2.419 2.290 2.530 . 0 0 "[ . 1 . 2 .]" 1
288 1 31 ARG HA 1 34 ASN HB3 4.000 . 5.000 3.995 3.847 4.136 . 0 0 "[ . 1 . 2 .]" 1
289 1 31 ARG QB 1 35 ILE MD 4.000 . 6.000 2.753 2.503 2.907 . 0 0 "[ . 1 . 2 .]" 1
290 1 31 ARG HG3 1 35 ILE MD 4.000 . 5.500 5.389 5.131 5.516 0.016 14 0 "[ . 1 . 2 .]" 1
291 1 31 ARG QD 1 35 ILE MD 4.000 . 6.000 4.104 3.760 4.834 . 0 0 "[ . 1 . 2 .]" 1
292 1 31 ARG QB 1 87 THR MG 2.500 . 3.700 1.953 1.854 2.059 . 0 0 "[ . 1 . 2 .]" 1
293 1 31 ARG HG3 1 87 THR MG 3.000 . 3.800 3.813 3.692 3.878 0.078 24 0 "[ . 1 . 2 .]" 1
294 1 31 ARG HG2 1 87 THR MG 3.000 . 3.800 3.816 3.725 3.929 0.129 15 0 "[ . 1 . 2 .]" 1
295 1 31 ARG QD 1 87 THR MG 3.000 . 4.300 2.103 1.911 2.445 . 0 0 "[ . 1 . 2 .]" 1
296 1 31 ARG HA 1 87 THR MG 4.000 . 5.500 4.167 3.925 4.402 . 0 0 "[ . 1 . 2 .]" 1
297 1 32 VAL HA 1 32 VAL MG1 3.000 . 3.800 2.433 2.319 2.493 . 0 0 "[ . 1 . 2 .]" 1
298 1 32 VAL HA 1 32 VAL MG2 2.500 . 3.200 2.283 2.141 2.377 . 0 0 "[ . 1 . 2 .]" 1
299 1 32 VAL MG1 1 33 LYS HA 4.000 . 5.500 3.243 3.036 3.539 . 0 0 "[ . 1 . 2 .]" 1
300 1 32 VAL HA 1 35 ILE MD 3.000 . 3.800 3.066 2.769 3.400 . 0 0 "[ . 1 . 2 .]" 1
301 1 32 VAL HA 1 35 ILE HB 3.000 . 3.300 3.122 2.986 3.297 . 0 0 "[ . 1 . 2 .]" 1
302 1 32 VAL HA 1 35 ILE MG 4.000 . 5.500 4.449 4.298 4.631 . 0 0 "[ . 1 . 2 .]" 1
303 1 32 VAL HA 1 36 LEU HG 4.000 . 5.000 3.584 3.246 3.837 . 0 0 "[ . 1 . 2 .]" 1
304 1 32 VAL MG1 1 36 LEU MD1 2.500 . 3.700 2.004 1.838 2.399 . 0 0 "[ . 1 . 2 .]" 1
305 1 32 VAL HB 1 47 LEU MD1 4.000 . 5.500 2.916 2.632 3.784 . 0 0 "[ . 1 . 2 .]" 1
306 1 32 VAL MG1 1 47 LEU MD1 2.500 . 3.700 1.983 1.832 3.167 . 0 0 "[ . 1 . 2 .]" 1
307 1 32 VAL MG1 1 47 LEU MD2 3.000 . 4.300 3.277 2.095 3.606 . 0 0 "[ . 1 . 2 .]" 1
308 1 32 VAL MG1 1 70 LEU MD1 4.000 . 6.000 2.041 1.882 2.328 . 0 0 "[ . 1 . 2 .]" 1
309 1 32 VAL MG1 1 70 LEU MD2 3.000 . 4.300 3.916 3.687 4.215 . 0 0 "[ . 1 . 2 .]" 1
310 1 32 VAL MG2 1 86 LEU QD 3.000 . 4.300 3.196 2.870 3.470 . 0 0 "[ . 1 . 2 .]" 1
311 1 32 VAL HA 1 87 THR MG 4.000 . 5.500 3.800 3.199 4.705 . 0 0 "[ . 1 . 2 .]" 1
312 1 32 VAL MG2 1 87 THR MG 2.500 . 3.700 2.875 2.407 3.415 . 0 0 "[ . 1 . 2 .]" 1
313 1 32 VAL HA 1 90 LEU MD2 3.000 . 3.800 2.653 2.306 3.930 0.130 10 0 "[ . 1 . 2 .]" 1
314 1 32 VAL MG1 1 90 LEU MD2 2.500 . 3.700 2.272 2.054 2.801 . 0 0 "[ . 1 . 2 .]" 1
315 1 32 VAL MG2 1 90 LEU HB2 4.000 . 5.500 4.083 3.375 4.427 . 0 0 "[ . 1 . 2 .]" 1
316 1 33 LYS HA 1 33 LYS QD 3.000 . 3.800 3.867 3.853 3.885 0.085 23 0 "[ . 1 . 2 .]" 1
317 1 33 LYS HE3 1 33 LYS HG3 4.000 . 5.000 3.140 2.307 3.685 . 0 0 "[ . 1 . 2 .]" 1
318 1 33 LYS HE2 1 33 LYS HG3 4.000 . 5.000 2.523 2.253 3.516 . 0 0 "[ . 1 . 2 .]" 1
319 1 33 LYS HA 1 33 LYS HG3 4.000 . 5.000 3.031 2.982 3.083 . 0 0 "[ . 1 . 2 .]" 1
320 1 33 LYS HE3 1 33 LYS HG2 4.000 . 5.000 3.563 2.579 3.807 . 0 0 "[ . 1 . 2 .]" 1
321 1 33 LYS HA 1 33 LYS HG2 3.000 . 3.300 2.350 2.318 2.386 . 0 0 "[ . 1 . 2 .]" 1
322 1 33 LYS HE2 1 33 LYS HG2 4.000 . 5.000 2.646 2.340 3.018 . 0 0 "[ . 1 . 2 .]" 1
323 1 33 LYS HA 1 36 LEU MD1 3.000 . 3.800 3.138 2.471 3.602 . 0 0 "[ . 1 . 2 .]" 1
324 1 33 LYS HA 1 36 LEU HB2 4.000 . 5.000 2.853 2.649 3.145 . 0 0 "[ . 1 . 2 .]" 1
325 1 33 LYS HA 1 36 LEU HB3 4.000 . 5.000 4.508 4.280 4.834 . 0 0 "[ . 1 . 2 .]" 1
326 1 33 LYS QD 1 47 LEU MD1 3.000 . 4.300 3.609 3.355 3.839 . 0 0 "[ . 1 . 2 .]" 1
327 1 33 LYS HE2 1 47 LEU MD1 3.000 . 3.800 2.341 2.133 3.435 . 0 0 "[ . 1 . 2 .]" 1
328 1 33 LYS HA 1 47 LEU MD1 3.000 . 3.800 3.165 2.854 3.848 0.048 23 0 "[ . 1 . 2 .]" 1
329 1 33 LYS HE3 1 47 LEU MD1 3.000 . 3.800 3.470 2.144 3.800 . 0 0 "[ . 1 . 2 .]" 1
330 1 34 ASN HB3 1 35 ILE HA 4.000 . 6.000 4.382 4.336 4.425 . 0 0 "[ . 1 . 2 .]" 1
331 1 34 ASN HB3 1 37 ALA MB 4.000 . 6.500 4.677 4.327 4.873 . 0 0 "[ . 1 . 2 .]" 1
332 1 34 ASN HA 1 37 ALA MB 2.500 . 3.200 2.733 2.349 2.986 . 0 0 "[ . 1 . 2 .]" 1
333 1 34 ASN HB2 1 37 ALA MB 4.000 . 6.500 5.197 4.830 5.442 . 0 0 "[ . 1 . 2 .]" 1
334 1 35 ILE HA 1 35 ILE HG13 3.000 . 3.300 2.837 2.761 2.893 . 0 0 "[ . 1 . 2 .]" 1
335 1 35 ILE HA 1 35 ILE HG12 3.000 . 3.300 2.547 2.492 2.595 . 0 0 "[ . 1 . 2 .]" 1
336 1 35 ILE HA 1 35 ILE MG 3.000 . 3.800 2.338 2.267 2.408 . 0 0 "[ . 1 . 2 .]" 1
337 1 35 ILE HA 1 35 ILE MD 3.000 . 3.800 3.811 3.792 3.829 0.029 17 0 "[ . 1 . 2 .]" 1
338 1 35 ILE HB 1 35 ILE MD 3.000 . 3.800 2.266 2.164 2.353 . 0 0 "[ . 1 . 2 .]" 1
339 1 35 ILE HB 1 36 LEU HG 4.000 . 5.000 3.294 3.119 3.489 . 0 0 "[ . 1 . 2 .]" 1
340 1 35 ILE MG 1 36 LEU HA 4.000 . 5.500 3.365 3.170 3.527 . 0 0 "[ . 1 . 2 .]" 1
341 1 35 ILE HA 1 38 ALA MB 3.000 . 3.800 2.240 2.093 2.423 . 0 0 "[ . 1 . 2 .]" 1
342 1 35 ILE MG 1 38 ALA MB 4.000 . 6.000 3.093 2.775 3.464 . 0 0 "[ . 1 . 2 .]" 1
343 1 35 ILE MD 1 87 THR HB 2.500 . 3.200 2.488 2.085 3.040 . 0 0 "[ . 1 . 2 .]" 1
344 1 35 ILE MD 1 87 THR HA 4.000 . 5.500 2.856 2.645 3.198 . 0 0 "[ . 1 . 2 .]" 1
345 1 35 ILE MD 1 87 THR MG 3.000 . 4.300 2.742 2.187 3.494 . 0 0 "[ . 1 . 2 .]" 1
346 1 35 ILE MD 1 90 LEU MD2 3.000 . 4.300 2.796 2.012 4.217 . 0 0 "[ . 1 . 2 .]" 1
347 1 35 ILE MG 1 90 LEU MD2 3.000 . 4.300 2.987 2.288 4.038 . 0 0 "[ . 1 . 2 .]" 1
348 1 35 ILE HB 1 90 LEU MD2 4.000 . 5.500 2.973 2.455 4.486 . 0 0 "[ . 1 . 2 .]" 1
349 1 35 ILE MG 1 90 LEU HG 3.000 . 3.800 3.471 2.938 3.813 0.013 10 0 "[ . 1 . 2 .]" 1
350 1 35 ILE MG 1 91 ALA MB 3.000 . 4.300 3.072 2.564 3.630 . 0 0 "[ . 1 . 2 .]" 1
351 1 35 ILE MD 1 91 ALA MB 3.000 . 4.300 2.944 2.581 3.520 . 0 0 "[ . 1 . 2 .]" 1
352 1 35 ILE MG 1 91 ALA HA 3.000 . 3.800 3.141 2.809 3.500 . 0 0 "[ . 1 . 2 .]" 1
353 1 35 ILE MD 1 91 ALA HA 4.000 . 5.500 4.018 3.624 4.349 . 0 0 "[ . 1 . 2 .]" 1
354 1 35 ILE MG 1 94 LEU MD2 3.000 . 4.300 2.639 2.085 3.129 . 0 0 "[ . 1 . 2 .]" 1
355 1 36 LEU HB3 1 36 LEU MD1 3.000 . 3.800 2.403 2.267 2.498 . 0 0 "[ . 1 . 2 .]" 1
356 1 36 LEU HB2 1 36 LEU MD1 3.000 . 3.800 2.307 2.198 2.445 . 0 0 "[ . 1 . 2 .]" 1
357 1 36 LEU HA 1 36 LEU HG 4.000 . 6.000 2.975 2.859 3.151 . 0 0 "[ . 1 . 2 .]" 1
358 1 36 LEU HA 1 36 LEU MD2 2.500 . 3.200 2.035 1.957 2.114 . 0 0 "[ . 1 . 2 .]" 1
359 1 36 LEU HA 1 39 VAL QG 2.500 . 3.200 2.641 2.128 3.133 . 0 0 "[ . 1 . 2 .]" 1
360 1 36 LEU MD1 1 45 ILE MG 3.000 . 4.300 2.567 2.202 2.936 . 0 0 "[ . 1 . 2 .]" 1
361 1 36 LEU MD2 1 45 ILE MD 2.500 . 3.700 2.311 2.128 2.846 . 0 0 "[ . 1 . 2 .]" 1
362 1 36 LEU HA 1 45 ILE MD 4.000 . 5.500 3.245 3.034 3.389 . 0 0 "[ . 1 . 2 .]" 1
363 1 36 LEU MD1 1 47 LEU MD2 3.000 . 4.300 4.122 2.745 4.328 0.028 5 0 "[ . 1 . 2 .]" 1
364 1 36 LEU HA 1 94 LEU MD2 3.000 . 3.800 3.018 2.619 3.562 . 0 0 "[ . 1 . 2 .]" 1
365 1 36 LEU MD2 1 94 LEU HA 4.000 . 5.500 4.557 4.167 5.038 . 0 0 "[ . 1 . 2 .]" 1
366 1 37 ALA HA 1 40 GLU QG 4.000 . 5.500 4.160 2.040 5.526 0.026 25 0 "[ . 1 . 2 .]" 1
367 1 38 ALA MB 1 39 VAL HA 4.000 . 5.500 4.037 3.834 4.312 . 0 0 "[ . 1 . 2 .]" 1
368 1 39 VAL HA 1 39 VAL QG 2.500 . 3.200 2.196 2.082 2.337 . 0 0 "[ . 1 . 2 .]" 1
369 1 39 VAL QG 1 40 GLU QG 4.000 . 6.000 4.156 3.715 4.694 . 0 0 "[ . 1 . 2 .]" 1
370 1 39 VAL QG 1 41 ALA HA 4.000 . 5.500 4.316 3.890 4.655 . 0 0 "[ . 1 . 2 .]" 1
371 1 39 VAL QG 1 41 ALA MB 2.500 . 3.700 2.463 2.135 2.704 . 0 0 "[ . 1 . 2 .]" 1
372 1 39 VAL HB 1 45 ILE MD 4.000 . 5.500 4.662 3.797 5.471 . 0 0 "[ . 1 . 2 .]" 1
373 1 39 VAL QG 1 45 ILE MD 2.500 . 3.700 2.383 1.936 2.911 . 0 0 "[ . 1 . 2 .]" 1
374 1 39 VAL QG 1 94 LEU MD2 2.500 . 3.700 2.218 1.913 2.526 . 0 0 "[ . 1 . 2 .]" 1
375 1 39 VAL QG 1 94 LEU HG 4.000 . 5.500 3.477 2.953 3.976 . 0 0 "[ . 1 . 2 .]" 1
376 1 39 VAL HB 1 98 LEU MD1 4.000 . 5.500 4.278 3.587 4.963 . 0 0 "[ . 1 . 2 .]" 1
377 1 39 VAL QG 1 98 LEU MD1 2.500 . 3.700 2.201 1.935 2.865 . 0 0 "[ . 1 . 2 .]" 1
378 1 40 GLU HA 1 40 GLU QG 2.500 . 3.200 2.479 2.193 3.013 . 0 0 "[ . 1 . 2 .]" 1
379 1 40 GLU QB 1 41 ALA MB 4.000 . 6.000 3.862 3.657 4.059 . 0 0 "[ . 1 . 2 .]" 1
380 1 40 GLU HA 1 41 ALA MB 4.000 . 5.500 4.161 4.021 4.403 . 0 0 "[ . 1 . 2 .]" 1
381 1 40 GLU HA 1 45 ILE MD 4.000 . 5.500 4.285 2.752 5.456 . 0 0 "[ . 1 . 2 .]" 1
382 1 41 ALA MB 1 42 THR HA 4.000 . 6.500 4.268 4.139 5.068 . 0 0 "[ . 1 . 2 .]" 1
383 1 41 ALA MB 1 45 ILE MD 3.000 . 4.300 4.026 3.621 4.328 0.028 6 0 "[ . 1 . 2 .]" 1
384 1 41 ALA MB 1 98 LEU MD1 3.000 . 4.300 3.501 2.773 4.154 . 0 0 "[ . 1 . 2 .]" 1
385 1 41 ALA MB 1 98 LEU MD2 3.000 . 4.300 3.485 2.868 4.066 . 0 0 "[ . 1 . 2 .]" 1
386 1 42 THR HA 1 42 THR MG 2.500 . 3.200 2.349 2.185 2.526 . 0 0 "[ . 1 . 2 .]" 1
387 1 42 THR HB 1 43 VAL MG2 4.000 . 5.500 4.664 4.432 4.948 . 0 0 "[ . 1 . 2 .]" 1
388 1 43 VAL HA 1 43 VAL MG1 2.500 . 3.200 2.205 2.113 2.267 . 0 0 "[ . 1 . 2 .]" 1
389 1 43 VAL HA 1 43 VAL MG2 3.000 . 3.800 3.155 3.146 3.164 . 0 0 "[ . 1 . 2 .]" 1
390 1 43 VAL HA 1 44 PRO HD2 3.000 . 3.300 2.195 2.114 2.395 . 0 0 "[ . 1 . 2 .]" 1
391 1 43 VAL MG2 1 44 PRO HD2 4.000 . 6.500 4.684 4.523 4.867 . 0 0 "[ . 1 . 2 .]" 1
392 1 43 VAL HA 1 44 PRO QG 4.000 . 5.500 3.992 3.923 4.029 . 0 0 "[ . 1 . 2 .]" 1
393 1 43 VAL HA 1 44 PRO HD3 3.000 . 3.300 2.641 2.209 3.129 . 0 0 "[ . 1 . 2 .]" 1
394 1 43 VAL MG2 1 98 LEU HA 4.000 . 5.500 4.914 4.210 5.463 . 0 0 "[ . 1 . 2 .]" 1
395 1 45 ILE HA 1 45 ILE HG13 4.000 . 5.000 2.428 2.335 2.527 . 0 0 "[ . 1 . 2 .]" 1
396 1 45 ILE HA 1 45 ILE HG12 4.000 . 5.000 3.461 3.167 3.571 . 0 0 "[ . 1 . 2 .]" 1
397 1 45 ILE HB 1 45 ILE MD 3.000 . 3.800 2.135 2.088 2.200 . 0 0 "[ . 1 . 2 .]" 1
398 1 45 ILE HA 1 45 ILE MG 3.000 . 3.800 2.205 2.144 2.280 . 0 0 "[ . 1 . 2 .]" 1
399 1 45 ILE HA 1 45 ILE MD 4.000 . 5.500 3.503 3.371 3.786 . 0 0 "[ . 1 . 2 .]" 1
400 1 45 ILE MG 1 47 LEU MD2 4.000 . 6.000 4.789 4.135 4.982 . 0 0 "[ . 1 . 2 .]" 1
401 1 45 ILE MG 1 72 LYS HG3 4.000 . 5.500 4.604 4.330 4.881 . 0 0 "[ . 1 . 2 .]" 1
402 1 45 ILE MD 1 94 LEU MD2 3.000 . 4.300 3.862 3.353 4.306 0.006 18 0 "[ . 1 . 2 .]" 1
403 1 47 LEU HA 1 47 LEU MD1 3.000 . 3.800 3.733 3.401 3.796 . 0 0 "[ . 1 . 2 .]" 1
404 1 47 LEU HA 1 47 LEU MD2 3.000 . 3.800 2.112 1.904 2.279 . 0 0 "[ . 1 . 2 .]" 1
405 1 47 LEU HA 1 47 LEU HG 4.000 . 5.000 2.565 2.365 3.505 . 0 0 "[ . 1 . 2 .]" 1
406 1 47 LEU HB3 1 47 LEU MD1 3.000 . 3.800 2.226 2.137 2.295 . 0 0 "[ . 1 . 2 .]" 1
407 1 47 LEU HB3 1 47 LEU MD2 3.000 . 3.800 2.484 2.309 3.144 . 0 0 "[ . 1 . 2 .]" 1
408 1 47 LEU MD1 1 49 VAL HA 4.000 . 6.500 5.345 4.448 5.673 . 0 0 "[ . 1 . 2 .]" 1
409 1 47 LEU MD2 1 49 VAL HA 4.000 . 6.500 3.612 3.454 4.228 . 0 0 "[ . 1 . 2 .]" 1
410 1 47 LEU MD2 1 70 LEU MD1 3.000 . 4.300 3.676 3.234 3.974 . 0 0 "[ . 1 . 2 .]" 1
411 1 47 LEU MD2 1 70 LEU MD2 3.000 . 4.300 4.354 4.243 4.399 0.099 14 0 "[ . 1 . 2 .]" 1
412 1 48 GLN HA 1 48 GLN QG 3.000 . 3.800 2.232 2.128 2.568 . 0 0 "[ . 1 . 2 .]" 1
413 1 48 GLN HB2 1 50 ILE MD 4.000 . 5.500 5.124 4.702 5.529 0.029 16 0 "[ . 1 . 2 .]" 1
414 1 49 VAL HA 1 49 VAL QG 2.500 . 3.200 2.046 1.993 2.109 . 0 0 "[ . 1 . 2 .]" 1
415 1 49 VAL HB 1 51 ASN HA 4.000 . 6.000 6.094 6.068 6.126 0.126 5 0 "[ . 1 . 2 .]" 1
416 1 49 VAL QG 1 51 ASN HA 3.000 . 3.800 3.858 3.802 3.929 0.129 15 0 "[ . 1 . 2 .]" 1
417 1 50 ILE HA 1 50 ILE HG13 3.000 . 3.300 3.229 3.154 3.303 0.003 10 0 "[ . 1 . 2 .]" 1
418 1 50 ILE HA 1 50 ILE HG12 3.000 . 3.300 2.526 2.453 2.634 . 0 0 "[ . 1 . 2 .]" 1
419 1 50 ILE HB 1 50 ILE MD 3.000 . 3.800 2.408 2.307 2.494 . 0 0 "[ . 1 . 2 .]" 1
420 1 50 ILE HA 1 50 ILE MG 2.500 . 3.200 2.262 2.108 2.363 . 0 0 "[ . 1 . 2 .]" 1
421 1 50 ILE HA 1 50 ILE MD 3.000 . 3.800 3.775 3.701 3.847 0.047 20 0 "[ . 1 . 2 .]" 1
422 1 50 ILE MG 1 52 VAL HA 4.000 . 5.500 3.781 3.584 4.062 . 0 0 "[ . 1 . 2 .]" 1
423 1 50 ILE MG 1 55 GLN HB2 4.000 . 5.500 4.307 3.662 5.096 . 0 0 "[ . 1 . 2 .]" 1
424 1 50 ILE MG 1 55 GLN HB3 4.000 . 5.500 4.214 3.853 4.906 . 0 0 "[ . 1 . 2 .]" 1
425 1 50 ILE MG 1 55 GLN QG 3.000 . 4.300 2.348 1.849 2.952 . 0 0 "[ . 1 . 2 .]" 1
426 1 50 ILE MD 1 58 LEU MD2 3.000 . 4.300 2.594 1.982 4.225 . 0 0 "[ . 1 . 2 .]" 1
427 1 50 ILE MD 1 58 LEU MD1 3.000 . 4.300 3.132 2.018 3.702 . 0 0 "[ . 1 . 2 .]" 1
428 1 50 ILE MG 1 58 LEU MD1 4.000 . 6.000 2.885 1.925 4.229 . 0 0 "[ . 1 . 2 .]" 1
429 1 50 ILE MG 1 58 LEU HB2 4.000 . 6.500 5.065 4.322 5.994 . 0 0 "[ . 1 . 2 .]" 1
430 1 50 ILE MD 1 71 VAL HB 4.000 . 5.500 5.041 4.134 5.528 0.028 20 0 "[ . 1 . 2 .]" 1
431 1 51 ASN HB3 1 53 ALA MB 4.000 . 5.500 3.403 2.699 4.655 . 0 0 "[ . 1 . 2 .]" 1
432 1 52 VAL HA 1 52 VAL MG2 3.000 . 3.800 3.181 3.170 3.192 . 0 0 "[ . 1 . 2 .]" 1
433 1 52 VAL HA 1 52 VAL MG1 2.500 . 3.200 2.360 2.161 2.453 . 0 0 "[ . 1 . 2 .]" 1
434 1 52 VAL MG1 1 53 ALA HA 4.000 . 5.500 5.436 5.379 5.476 . 0 0 "[ . 1 . 2 .]" 1
435 1 52 VAL MG2 1 53 ALA HA 4.000 . 5.500 3.355 3.019 3.609 . 0 0 "[ . 1 . 2 .]" 1
436 1 52 VAL HA 1 59 VAL MG2 2.500 . 3.200 2.564 2.244 2.894 . 0 0 "[ . 1 . 2 .]" 1
437 1 52 VAL MG1 1 64 LEU MD1 4.000 . 6.000 3.509 2.833 3.912 . 0 0 "[ . 1 . 2 .]" 1
438 1 52 VAL MG1 1 67 THR HB 4.000 . 5.500 3.876 3.570 4.227 . 0 0 "[ . 1 . 2 .]" 1
439 1 52 VAL MG1 1 68 PRO HA 4.000 . 6.500 4.718 4.398 4.986 . 0 0 "[ . 1 . 2 .]" 1
440 1 53 ALA MB 1 54 ASP HA 4.000 . 5.500 3.902 3.821 3.995 . 0 0 "[ . 1 . 2 .]" 1
441 1 54 ASP HA 1 55 GLN HA 4.000 . 5.000 4.522 4.499 4.548 . 0 0 "[ . 1 . 2 .]" 1
442 1 54 ASP QB 1 55 GLN QG 4.000 . 6.000 3.558 2.560 3.996 . 0 0 "[ . 1 . 2 .]" 1
443 1 55 GLN HA 1 55 GLN QG 3.000 . 3.800 3.360 3.284 3.581 . 0 0 "[ . 1 . 2 .]" 1
444 1 55 GLN HA 1 56 PRO HD3 3.000 . 3.300 2.349 2.168 2.616 . 0 0 "[ . 1 . 2 .]" 1
445 1 55 GLN HA 1 56 PRO HD2 3.000 . 3.300 2.515 2.361 2.658 . 0 0 "[ . 1 . 2 .]" 1
446 1 55 GLN HA 1 57 GLN HB3 4.000 . 5.000 4.335 3.997 4.774 . 0 0 "[ . 1 . 2 .]" 1
447 1 55 GLN QG 1 58 LEU MD1 3.000 . 4.300 2.820 2.058 3.944 . 0 0 "[ . 1 . 2 .]" 1
448 1 56 PRO HA 1 59 VAL HB 3.000 . 3.300 2.691 2.427 2.910 . 0 0 "[ . 1 . 2 .]" 1
449 1 56 PRO HA 1 59 VAL MG2 3.000 . 3.800 2.112 2.009 2.291 . 0 0 "[ . 1 . 2 .]" 1
450 1 56 PRO HA 1 59 VAL MG1 4.000 . 5.500 3.749 3.529 3.905 . 0 0 "[ . 1 . 2 .]" 1
451 1 57 GLN HA 1 57 GLN HG3 3.000 . 3.300 2.550 2.426 2.652 . 0 0 "[ . 1 . 2 .]" 1
452 1 57 GLN HA 1 57 GLN HG2 3.000 . 3.300 3.104 2.855 3.315 0.015 15 0 "[ . 1 . 2 .]" 1
453 1 57 GLN HG2 1 58 LEU MD1 4.000 . 5.500 5.412 4.951 5.687 0.187 25 0 "[ . 1 . 2 .]" 1
454 1 57 GLN HA 1 60 GLU QB 3.000 . 3.800 3.403 3.164 3.735 . 0 0 "[ . 1 . 2 .]" 1
455 1 58 LEU HB3 1 58 LEU MD2 3.000 . 3.800 2.236 2.074 2.444 . 0 0 "[ . 1 . 2 .]" 1
456 1 58 LEU HA 1 58 LEU MD2 4.000 . 5.500 4.052 3.689 4.132 . 0 0 "[ . 1 . 2 .]" 1
457 1 58 LEU HB3 1 58 LEU MD1 3.000 . 3.800 3.126 2.868 3.183 . 0 0 "[ . 1 . 2 .]" 1
458 1 58 LEU HB2 1 58 LEU MD1 3.000 . 3.800 2.198 2.052 2.332 . 0 0 "[ . 1 . 2 .]" 1
459 1 58 LEU HA 1 58 LEU HG 4.000 . 5.000 3.572 3.480 3.688 . 0 0 "[ . 1 . 2 .]" 1
460 1 58 LEU HA 1 58 LEU MD1 3.000 . 3.800 3.357 3.065 3.921 0.121 6 0 "[ . 1 . 2 .]" 1
461 1 58 LEU HG 1 59 VAL MG2 4.000 . 5.500 3.286 2.259 4.274 . 0 0 "[ . 1 . 2 .]" 1
462 1 58 LEU MD1 1 61 TYR QD 4.000 . 5.500 5.052 3.793 5.676 0.176 9 0 "[ . 1 . 2 .]" 1
463 1 58 LEU MD1 1 61 TYR HB3 4.000 . 5.500 4.175 3.238 4.684 . 0 0 "[ . 1 . 2 .]" 1
464 1 58 LEU MD1 1 61 TYR HB2 4.000 . 5.500 5.100 4.352 5.543 0.043 19 0 "[ . 1 . 2 .]" 1
465 1 58 LEU HA 1 61 TYR HB2 4.000 . 5.000 2.516 2.188 2.758 . 0 0 "[ . 1 . 2 .]" 1
466 1 58 LEU HA 1 61 TYR HB3 4.000 . 5.000 2.399 2.154 2.805 . 0 0 "[ . 1 . 2 .]" 1
467 1 58 LEU MD2 1 62 TYR QE 4.000 . 5.500 3.518 2.870 4.659 . 0 0 "[ . 1 . 2 .]" 1
468 1 58 LEU MD1 1 62 TYR QE 3.000 . 3.800 2.880 2.056 3.810 0.010 21 0 "[ . 1 . 2 .]" 1
469 1 58 LEU HG 1 62 TYR QE 4.000 . 5.000 4.955 4.739 5.053 0.053 23 0 "[ . 1 . 2 .]" 1
470 1 59 VAL HA 1 59 VAL MG2 3.000 . 3.800 2.371 2.220 2.502 . 0 0 "[ . 1 . 2 .]" 1
471 1 59 VAL HA 1 59 VAL MG1 3.000 . 3.800 2.359 2.232 2.498 . 0 0 "[ . 1 . 2 .]" 1
472 1 59 VAL MG1 1 60 GLU HA 3.000 . 3.800 3.584 3.172 3.801 0.001 8 0 "[ . 1 . 2 .]" 1
473 1 59 VAL MG1 1 60 GLU HG3 4.000 . 5.500 3.904 3.133 5.174 . 0 0 "[ . 1 . 2 .]" 1
474 1 59 VAL MG1 1 60 GLU HG2 4.000 . 5.500 4.149 3.572 4.505 . 0 0 "[ . 1 . 2 .]" 1
475 1 59 VAL MG1 1 62 TYR HB3 4.000 . 5.500 5.535 5.370 5.605 0.105 20 0 "[ . 1 . 2 .]" 1
476 1 59 VAL HA 1 64 LEU MD2 4.000 . 5.500 5.003 4.749 5.215 . 0 0 "[ . 1 . 2 .]" 1
477 1 59 VAL HA 1 64 LEU HG 4.000 . 6.000 3.976 3.674 4.172 . 0 0 "[ . 1 . 2 .]" 1
478 1 59 VAL HA 1 64 LEU MD1 3.000 . 3.800 3.922 3.831 3.971 0.171 12 0 "[ . 1 . 2 .]" 1
479 1 59 VAL HA 1 64 LEU HB3 4.000 . 6.000 2.558 2.277 2.792 . 0 0 "[ . 1 . 2 .]" 1
480 1 59 VAL MG1 1 64 LEU MD1 2.500 . 3.700 1.940 1.850 2.085 . 0 0 "[ . 1 . 2 .]" 1
481 1 59 VAL MG2 1 64 LEU MD1 3.000 . 4.300 3.646 3.115 3.864 . 0 0 "[ . 1 . 2 .]" 1
482 1 59 VAL MG2 1 64 LEU HB3 4.000 . 5.500 3.785 3.267 4.059 . 0 0 "[ . 1 . 2 .]" 1
483 1 59 VAL HB 1 64 LEU MD2 4.000 . 6.500 6.548 6.403 6.729 0.229 16 0 "[ . 1 . 2 .]" 1
484 1 59 VAL MG1 1 64 LEU HB3 3.000 . 3.800 1.991 1.934 2.074 . 0 0 "[ . 1 . 2 .]" 1
485 1 59 VAL MG1 1 64 LEU HA 4.000 . 5.500 4.012 3.904 4.063 . 0 0 "[ . 1 . 2 .]" 1
486 1 59 VAL MG1 1 65 VAL HA 2.500 . 3.200 3.033 2.684 3.203 0.003 18 0 "[ . 1 . 2 .]" 1
487 1 59 VAL MG1 1 67 THR MG 2.500 . 3.700 3.393 3.169 3.572 . 0 0 "[ . 1 . 2 .]" 1
488 1 60 GLU HA 1 60 GLU HG3 3.000 . 3.300 3.034 2.931 3.574 0.274 7 0 "[ . 1 . 2 .]" 1
489 1 60 GLU HA 1 60 GLU HG2 3.000 . 3.300 2.427 2.381 2.833 . 0 0 "[ . 1 . 2 .]" 1
490 1 60 GLU HA 1 63 ARG HA 3.000 . 3.300 3.335 3.020 3.431 0.131 15 0 "[ . 1 . 2 .]" 1
491 1 60 GLU QB 1 65 VAL MG2 4.000 . 7.000 4.798 4.215 5.439 . 0 0 "[ . 1 . 2 .]" 1
492 1 60 GLU HG3 1 65 VAL MG1 4.000 . 5.500 5.302 4.853 5.547 0.047 13 0 "[ . 1 . 2 .]" 1
493 1 60 GLU HG2 1 65 VAL MG2 4.000 . 5.500 3.945 3.052 5.439 . 0 0 "[ . 1 . 2 .]" 1
494 1 61 TYR HA 1 61 TYR QD 3.000 . 3.300 2.684 2.415 2.913 . 0 0 "[ . 1 . 2 .]" 1
495 1 61 TYR HA 1 61 TYR QE 4.000 . 5.000 4.525 4.443 4.611 . 0 0 "[ . 1 . 2 .]" 1
496 1 61 TYR QD 1 62 TYR HA 4.000 . 6.000 3.516 3.256 3.847 . 0 0 "[ . 1 . 2 .]" 1
497 1 61 TYR HB3 1 62 TYR HA 4.000 . 5.000 4.368 4.262 4.447 . 0 0 "[ . 1 . 2 .]" 1
498 1 62 TYR HA 1 62 TYR QD 3.000 . 3.300 2.252 2.127 2.448 . 0 0 "[ . 1 . 2 .]" 1
499 1 62 TYR HA 1 62 TYR QE 4.000 . 5.000 4.331 4.279 4.407 . 0 0 "[ . 1 . 2 .]" 1
500 1 62 TYR QD 1 64 LEU MD1 4.000 . 5.500 5.481 5.364 5.581 0.081 21 0 "[ . 1 . 2 .]" 1
501 1 62 TYR QD 1 64 LEU MD2 4.000 . 5.500 4.967 4.735 5.080 . 0 0 "[ . 1 . 2 .]" 1
502 1 62 TYR HB3 1 64 LEU MD1 4.000 . 6.500 5.450 5.309 5.566 . 0 0 "[ . 1 . 2 .]" 1
503 1 62 TYR HB2 1 64 LEU MD1 4.000 . 6.500 4.783 4.718 4.891 . 0 0 "[ . 1 . 2 .]" 1
504 1 62 TYR HB2 1 64 LEU MD2 4.000 . 5.500 3.954 3.796 4.067 . 0 0 "[ . 1 . 2 .]" 1
505 1 62 TYR HB3 1 64 LEU MD2 3.000 . 3.800 3.731 3.403 3.833 0.033 22 0 "[ . 1 . 2 .]" 1
506 1 62 TYR HB3 1 64 LEU HG 4.000 . 5.000 4.704 4.479 4.827 . 0 0 "[ . 1 . 2 .]" 1
507 1 62 TYR HB2 1 64 LEU HG 4.000 . 5.000 4.099 4.012 4.160 . 0 0 "[ . 1 . 2 .]" 1
508 1 62 TYR QE 1 64 LEU MD2 4.000 . 6.500 6.526 6.303 6.604 0.104 10 0 "[ . 1 . 2 .]" 1
509 1 62 TYR QD 1 71 VAL MG2 4.000 . 5.500 4.175 3.823 4.495 . 0 0 "[ . 1 . 2 .]" 1
510 1 62 TYR QE 1 71 VAL MG2 4.000 . 5.500 4.975 4.389 5.366 . 0 0 "[ . 1 . 2 .]" 1
511 1 62 TYR QE 1 71 VAL MG1 4.000 . 5.500 4.099 3.556 4.513 . 0 0 "[ . 1 . 2 .]" 1
512 1 62 TYR QE 1 73 ILE MG 4.000 . 6.500 3.881 3.063 4.466 . 0 0 "[ . 1 . 2 .]" 1
513 1 62 TYR QE 1 73 ILE MD 4.000 . 5.500 5.268 4.631 5.568 0.068 25 0 "[ . 1 . 2 .]" 1
514 1 62 TYR QD 1 78 ARG HD3 4.000 . 6.000 4.507 3.050 5.844 . 0 0 "[ . 1 . 2 .]" 1
515 1 62 TYR QD 1 78 ARG HD2 4.000 . 6.000 3.718 2.705 5.496 . 0 0 "[ . 1 . 2 .]" 1
516 1 62 TYR QE 1 78 ARG HD2 4.000 . 5.000 3.251 2.284 4.906 . 0 0 "[ . 1 . 2 .]" 1
517 1 63 ARG HA 1 63 ARG QG 2.500 . 3.200 2.431 2.166 2.940 . 0 0 "[ . 1 . 2 .]" 1
518 1 63 ARG HB2 1 63 ARG QD 3.000 . 3.800 2.881 2.147 3.552 . 0 0 "[ . 1 . 2 .]" 1
519 1 63 ARG HB3 1 63 ARG QD 3.000 . 3.800 2.525 2.250 3.385 . 0 0 "[ . 1 . 2 .]" 1
520 1 63 ARG HA 1 63 ARG QD 3.000 . 3.800 3.363 2.099 4.005 0.205 25 0 "[ . 1 . 2 .]" 1
521 1 64 LEU HB2 1 64 LEU MD1 3.000 . 3.800 3.181 3.163 3.204 . 0 0 "[ . 1 . 2 .]" 1
522 1 64 LEU HB3 1 64 LEU MD1 3.000 . 3.800 2.265 2.185 2.472 . 0 0 "[ . 1 . 2 .]" 1
523 1 64 LEU HA 1 64 LEU MD1 4.000 . 5.500 2.636 2.352 2.792 . 0 0 "[ . 1 . 2 .]" 1
524 1 64 LEU HA 1 64 LEU MD2 2.500 . 3.200 1.994 1.926 2.254 . 0 0 "[ . 1 . 2 .]" 1
525 1 64 LEU HB3 1 64 LEU MD2 3.000 . 3.800 3.177 3.151 3.189 . 0 0 "[ . 1 . 2 .]" 1
526 1 64 LEU HB2 1 64 LEU MD2 3.000 . 3.800 2.280 2.128 2.338 . 0 0 "[ . 1 . 2 .]" 1
527 1 64 LEU HA 1 64 LEU HG 4.000 . 5.000 3.636 3.602 3.710 . 0 0 "[ . 1 . 2 .]" 1
528 1 64 LEU HA 1 65 VAL MG2 4.000 . 5.500 3.428 3.037 4.079 . 0 0 "[ . 1 . 2 .]" 1
529 1 64 LEU MD1 1 67 THR MG 3.000 . 4.300 2.483 2.132 2.704 . 0 0 "[ . 1 . 2 .]" 1
530 1 64 LEU MD2 1 67 THR MG 3.000 . 4.300 4.327 3.929 4.425 0.125 10 0 "[ . 1 . 2 .]" 1
531 1 64 LEU MD1 1 69 ALA MB 3.000 . 4.300 2.388 1.963 2.590 . 0 0 "[ . 1 . 2 .]" 1
532 1 64 LEU MD2 1 69 ALA MB 2.500 . 3.700 2.087 1.832 2.303 . 0 0 "[ . 1 . 2 .]" 1
533 1 64 LEU HA 1 69 ALA MB 4.000 . 6.500 4.719 4.075 4.993 . 0 0 "[ . 1 . 2 .]" 1
534 1 64 LEU MD1 1 71 VAL MG2 3.000 . 4.300 4.394 4.319 4.459 0.159 8 0 "[ . 1 . 2 .]" 1
535 1 64 LEU MD2 1 80 VAL QG 2.500 . 3.700 2.149 1.896 2.464 . 0 0 "[ . 1 . 2 .]" 1
536 1 64 LEU HA 1 80 VAL QG 4.000 . 5.500 3.886 3.376 4.348 . 0 0 "[ . 1 . 2 .]" 1
537 1 64 LEU MD2 1 80 VAL HB 4.000 . 5.500 4.452 4.134 5.011 . 0 0 "[ . 1 . 2 .]" 1
538 1 65 VAL HA 1 65 VAL MG2 2.500 . 3.200 2.519 2.235 2.749 . 0 0 "[ . 1 . 2 .]" 1
539 1 65 VAL HB 1 66 VAL QG 2.500 . 3.200 2.982 2.732 3.159 . 0 0 "[ . 1 . 2 .]" 1
540 1 66 VAL HA 1 66 VAL QG 2.500 . 3.200 2.193 2.126 2.294 . 0 0 "[ . 1 . 2 .]" 1
541 1 66 VAL HA 1 67 THR MG 4.000 . 5.500 3.800 3.620 4.035 . 0 0 "[ . 1 . 2 .]" 1
542 1 66 VAL QG 1 67 THR HA 3.000 . 3.800 3.833 3.781 3.887 0.087 8 0 "[ . 1 . 2 .]" 1
543 1 66 VAL QG 1 69 ALA MB 4.000 . 6.000 2.626 2.378 2.839 . 0 0 "[ . 1 . 2 .]" 1
544 1 66 VAL QG 1 82 SER HB3 3.000 . 3.800 2.416 2.217 2.604 . 0 0 "[ . 1 . 2 .]" 1
545 1 66 VAL HB 1 82 SER HB3 4.000 . 5.000 4.604 4.238 4.834 . 0 0 "[ . 1 . 2 .]" 1
546 1 66 VAL HB 1 82 SER HB2 4.000 . 5.000 5.008 4.769 5.069 0.069 3 0 "[ . 1 . 2 .]" 1
547 1 66 VAL QG 1 82 SER HB2 3.000 . 3.800 2.825 2.712 2.978 . 0 0 "[ . 1 . 2 .]" 1
548 1 66 VAL QG 1 82 SER HA 4.000 . 5.500 4.087 3.995 4.219 . 0 0 "[ . 1 . 2 .]" 1
549 1 66 VAL QG 1 83 GLY HA3 4.000 . 5.500 4.135 3.955 4.293 . 0 0 "[ . 1 . 2 .]" 1
550 1 66 VAL QG 1 83 GLY HA2 3.000 . 3.800 3.876 3.785 3.941 0.141 22 0 "[ . 1 . 2 .]" 1
551 1 67 THR HA 1 67 THR MG 2.500 . 3.200 2.243 2.140 2.346 . 0 0 "[ . 1 . 2 .]" 1
552 1 67 THR HB 1 68 PRO HA 2.500 . 2.700 2.230 2.178 2.315 . 0 0 "[ . 1 . 2 .]" 1
553 1 67 THR HB 1 68 PRO HB2 4.000 . 5.000 4.993 4.957 5.053 0.053 23 0 "[ . 1 . 2 .]" 1
554 1 67 THR HB 1 68 PRO QG 4.000 . 5.500 4.352 4.252 4.475 . 0 0 "[ . 1 . 2 .]" 1
555 1 67 THR HB 1 68 PRO HB3 4.000 . 5.000 4.040 3.976 4.103 . 0 0 "[ . 1 . 2 .]" 1
556 1 67 THR MG 1 68 PRO HA 3.000 . 3.800 2.988 2.797 3.181 . 0 0 "[ . 1 . 2 .]" 1
557 1 67 THR MG 1 68 PRO HB3 4.000 . 5.500 4.776 4.599 4.963 . 0 0 "[ . 1 . 2 .]" 1
558 1 67 THR HA 1 68 PRO HA 3.000 . 3.300 2.281 2.207 2.351 . 0 0 "[ . 1 . 2 .]" 1
559 1 67 THR HA 1 68 PRO HB3 4.000 . 5.000 4.439 4.379 4.489 . 0 0 "[ . 1 . 2 .]" 1
560 1 67 THR HA 1 68 PRO HB2 4.000 . 5.000 4.454 4.422 4.472 . 0 0 "[ . 1 . 2 .]" 1
561 1 67 THR HB 1 69 ALA MB 4.000 . 5.500 4.711 4.517 4.956 . 0 0 "[ . 1 . 2 .]" 1
562 1 67 THR MG 1 69 ALA MB 3.000 . 4.300 3.117 2.799 3.356 . 0 0 "[ . 1 . 2 .]" 1
563 1 67 THR HA 1 69 ALA MB 3.000 . 3.800 2.885 2.791 3.012 . 0 0 "[ . 1 . 2 .]" 1
564 1 68 PRO HA 1 69 ALA MB 4.000 . 6.500 3.860 3.834 3.875 . 0 0 "[ . 1 . 2 .]" 1
565 1 68 PRO QG 1 84 ILE HA 4.000 . 5.500 3.870 3.518 4.367 . 0 0 "[ . 1 . 2 .]" 1
566 1 68 PRO QD 1 84 ILE HA 4.000 . 5.500 3.638 3.187 4.208 . 0 0 "[ . 1 . 2 .]" 1
567 1 68 PRO QD 1 84 ILE MG 4.000 . 6.000 2.452 2.082 3.014 . 0 0 "[ . 1 . 2 .]" 1
568 1 68 PRO QD 1 86 LEU QD 4.000 . 7.000 3.530 2.878 4.267 . 0 0 "[ . 1 . 2 .]" 1
569 1 68 PRO HB3 1 86 LEU QD 4.000 . 5.500 3.708 3.418 3.937 . 0 0 "[ . 1 . 2 .]" 1
570 1 68 PRO QG 1 86 LEU QD 3.000 . 4.300 3.183 2.718 3.504 . 0 0 "[ . 1 . 2 .]" 1
571 1 68 PRO HB2 1 86 LEU MD1 3.000 . 3.800 2.727 2.174 3.404 . 0 0 "[ . 1 . 2 .]" 1
572 1 69 ALA MB 1 80 VAL QG 2.500 . 3.700 3.145 2.858 3.398 . 0 0 "[ . 1 . 2 .]" 1
573 1 69 ALA MB 1 80 VAL HB 4.000 . 6.500 5.854 5.495 6.183 . 0 0 "[ . 1 . 2 .]" 1
574 1 69 ALA HA 1 82 SER HA 2.500 . 2.700 2.194 2.150 2.316 . 0 0 "[ . 1 . 2 .]" 1
575 1 69 ALA HA 1 82 SER HB2 3.000 . 3.300 2.774 2.420 3.134 . 0 0 "[ . 1 . 2 .]" 1
576 1 69 ALA HA 1 82 SER HB3 4.000 . 5.000 4.251 3.973 4.518 . 0 0 "[ . 1 . 2 .]" 1
577 1 69 ALA MB 1 82 SER HB3 3.000 . 3.800 3.317 3.178 3.445 . 0 0 "[ . 1 . 2 .]" 1
578 1 69 ALA MB 1 82 SER HB2 3.000 . 3.800 1.963 1.932 2.047 . 0 0 "[ . 1 . 2 .]" 1
579 1 69 ALA MB 1 82 SER HA 3.000 . 3.800 3.152 2.834 3.386 . 0 0 "[ . 1 . 2 .]" 1
580 1 69 ALA HA 1 86 LEU QD 3.000 . 3.800 2.085 1.932 2.277 . 0 0 "[ . 1 . 2 .]" 1
581 1 70 LEU HA 1 70 LEU HG 4.000 . 5.000 2.240 2.178 2.336 . 0 0 "[ . 1 . 2 .]" 1
582 1 70 LEU HA 1 70 LEU MD2 3.000 . 3.800 2.881 2.767 3.115 . 0 0 "[ . 1 . 2 .]" 1
583 1 70 LEU HA 1 70 LEU MD1 4.000 . 5.500 3.635 3.521 3.713 . 0 0 "[ . 1 . 2 .]" 1
584 1 70 LEU HB2 1 70 LEU MD1 3.000 . 3.800 2.178 2.114 2.291 . 0 0 "[ . 1 . 2 .]" 1
585 1 70 LEU HB3 1 70 LEU MD1 3.000 . 3.800 2.468 2.381 2.556 . 0 0 "[ . 1 . 2 .]" 1
586 1 70 LEU HB3 1 70 LEU MD2 3.000 . 3.800 2.124 2.052 2.188 . 0 0 "[ . 1 . 2 .]" 1
587 1 70 LEU HB2 1 70 LEU MD2 3.000 . 3.800 3.164 3.134 3.177 . 0 0 "[ . 1 . 2 .]" 1
588 1 70 LEU HA 1 86 LEU QD 4.000 . 5.500 3.420 3.304 3.528 . 0 0 "[ . 1 . 2 .]" 1
589 1 70 LEU MD1 1 86 LEU QD 3.000 . 4.300 3.046 2.682 3.459 . 0 0 "[ . 1 . 2 .]" 1
590 1 70 LEU HB3 1 86 LEU QD 3.000 . 3.800 2.707 2.143 3.163 . 0 0 "[ . 1 . 2 .]" 1
591 1 70 LEU MD1 1 97 TRP HZ3 4.000 . 5.500 4.647 4.055 5.494 . 0 0 "[ . 1 . 2 .]" 1
592 1 70 LEU MD1 1 97 TRP HH2 4.000 . 5.500 3.840 3.217 4.611 . 0 0 "[ . 1 . 2 .]" 1
593 1 71 VAL HA 1 71 VAL MG2 3.000 . 3.800 2.348 2.263 2.448 . 0 0 "[ . 1 . 2 .]" 1
594 1 71 VAL HA 1 71 VAL MG1 3.000 . 3.800 2.298 2.198 2.395 . 0 0 "[ . 1 . 2 .]" 1
595 1 71 VAL MG1 1 73 ILE HA 4.000 . 5.500 3.871 3.615 4.087 . 0 0 "[ . 1 . 2 .]" 1
596 1 71 VAL MG1 1 73 ILE MD 3.000 . 4.300 3.253 2.911 3.615 . 0 0 "[ . 1 . 2 .]" 1
597 1 71 VAL MG1 1 73 ILE MG 3.000 . 4.300 2.907 2.570 3.227 . 0 0 "[ . 1 . 2 .]" 1
598 1 71 VAL HB 1 73 ILE MG 4.000 . 5.500 4.156 3.700 4.338 . 0 0 "[ . 1 . 2 .]" 1
599 1 71 VAL HB 1 73 ILE MD 3.000 . 3.800 3.776 3.584 3.852 0.052 20 0 "[ . 1 . 2 .]" 1
600 1 71 VAL MG1 1 78 ARG HG2 4.000 . 5.500 3.087 2.719 3.476 . 0 0 "[ . 1 . 2 .]" 1
601 1 71 VAL MG1 1 78 ARG HG3 4.000 . 5.500 3.090 2.643 3.582 . 0 0 "[ . 1 . 2 .]" 1
602 1 71 VAL MG1 1 78 ARG HD3 4.000 . 5.500 4.137 2.660 4.844 . 0 0 "[ . 1 . 2 .]" 1
603 1 71 VAL MG1 1 78 ARG HD2 3.000 . 3.800 3.241 2.641 3.847 0.047 16 0 "[ . 1 . 2 .]" 1
604 1 71 VAL MG1 1 78 ARG HB3 4.000 . 5.500 5.070 4.729 5.497 . 0 0 "[ . 1 . 2 .]" 1
605 1 71 VAL HA 1 80 VAL HA 2.500 . 2.700 2.366 2.188 2.616 . 0 0 "[ . 1 . 2 .]" 1
606 1 71 VAL MG1 1 80 VAL HA 4.000 . 5.500 2.719 2.288 3.535 . 0 0 "[ . 1 . 2 .]" 1
607 1 72 LYS HA 1 72 LYS HG3 4.000 . 5.000 2.976 2.683 3.486 . 0 0 "[ . 1 . 2 .]" 1
608 1 72 LYS HE2 1 72 LYS HG3 4.000 . 5.000 2.555 2.162 3.657 . 0 0 "[ . 1 . 2 .]" 1
609 1 72 LYS HE3 1 72 LYS HG3 4.000 . 5.000 2.881 2.268 3.591 . 0 0 "[ . 1 . 2 .]" 1
610 1 72 LYS HE2 1 72 LYS HG2 4.000 . 5.000 3.193 2.562 4.238 . 0 0 "[ . 1 . 2 .]" 1
611 1 72 LYS HA 1 72 LYS HG2 4.000 . 5.000 2.430 2.174 2.667 . 0 0 "[ . 1 . 2 .]" 1
612 1 72 LYS HE3 1 72 LYS HG2 4.000 . 5.000 3.719 3.252 4.230 . 0 0 "[ . 1 . 2 .]" 1
613 1 72 LYS HG3 1 73 ILE MD 4.000 . 5.500 5.022 4.618 5.526 0.026 25 0 "[ . 1 . 2 .]" 1
614 1 72 LYS HG3 1 78 ARG HA 4.000 . 6.000 5.886 5.454 6.037 0.037 20 0 "[ . 1 . 2 .]" 1
615 1 72 LYS HE3 1 79 GLN QG 4.000 . 5.500 4.954 2.673 5.545 0.045 24 0 "[ . 1 . 2 .]" 1
616 1 72 LYS HE3 1 97 TRP HZ2 4.000 . 6.000 4.936 3.415 6.009 0.009 25 0 "[ . 1 . 2 .]" 1
617 1 73 ILE HA 1 73 ILE HG13 4.000 . 5.000 4.215 4.208 4.229 . 0 0 "[ . 1 . 2 .]" 1
618 1 73 ILE HA 1 73 ILE HG12 4.000 . 5.000 3.552 3.523 3.612 . 0 0 "[ . 1 . 2 .]" 1
619 1 73 ILE HA 1 73 ILE MG 3.000 . 3.800 2.168 2.117 2.213 . 0 0 "[ . 1 . 2 .]" 1
620 1 73 ILE HA 1 73 ILE MD 3.000 . 3.800 3.189 3.100 3.263 . 0 0 "[ . 1 . 2 .]" 1
621 1 73 ILE HB 1 73 ILE MD 3.000 . 3.800 3.145 3.131 3.169 . 0 0 "[ . 1 . 2 .]" 1
622 1 73 ILE MG 1 78 ARG HG3 3.000 . 3.800 3.227 2.867 3.528 . 0 0 "[ . 1 . 2 .]" 1
623 1 73 ILE HA 1 78 ARG HG3 4.000 . 5.000 2.496 2.172 2.942 . 0 0 "[ . 1 . 2 .]" 1
624 1 73 ILE HA 1 78 ARG HB2 4.000 . 6.000 3.669 3.280 3.967 . 0 0 "[ . 1 . 2 .]" 1
625 1 73 ILE HA 1 78 ARG HA 3.000 . 3.300 3.321 3.149 3.387 0.087 5 0 "[ . 1 . 2 .]" 1
626 1 73 ILE MG 1 78 ARG HA 4.000 . 5.500 4.726 4.549 4.814 . 0 0 "[ . 1 . 2 .]" 1
627 1 74 GLY HA3 1 75 PRO HA 3.000 . 3.300 2.182 2.117 2.369 . 0 0 "[ . 1 . 2 .]" 1
628 1 74 GLY HA2 1 75 PRO HA 3.000 . 3.300 3.008 2.539 3.348 0.048 2 0 "[ . 1 . 2 .]" 1
629 1 78 ARG HB2 1 78 ARG HD2 4.000 . 5.000 3.514 2.474 3.766 . 0 0 "[ . 1 . 2 .]" 1
630 1 78 ARG HB3 1 78 ARG HD2 4.000 . 5.000 3.522 2.464 3.784 . 0 0 "[ . 1 . 2 .]" 1
631 1 78 ARG HB3 1 78 ARG HD3 4.000 . 5.000 2.974 2.425 3.696 . 0 0 "[ . 1 . 2 .]" 1
632 1 78 ARG HA 1 78 ARG HG2 4.000 . 5.000 2.958 2.719 3.280 . 0 0 "[ . 1 . 2 .]" 1
633 1 78 ARG HA 1 78 ARG HG3 3.000 . 3.300 2.474 2.368 2.643 . 0 0 "[ . 1 . 2 .]" 1
634 1 78 ARG HB2 1 78 ARG HD3 4.000 . 5.000 2.651 2.348 3.760 . 0 0 "[ . 1 . 2 .]" 1
635 1 78 ARG HA 1 78 ARG HD3 4.000 . 6.000 4.376 4.064 4.735 . 0 0 "[ . 1 . 2 .]" 1
636 1 78 ARG HA 1 78 ARG HD2 4.000 . 5.000 4.667 4.255 4.830 . 0 0 "[ . 1 . 2 .]" 1
637 1 78 ARG HA 1 79 GLN QG 4.000 . 5.500 3.552 3.268 3.759 . 0 0 "[ . 1 . 2 .]" 1
638 1 79 GLN HA 1 79 GLN QG 2.500 . 3.200 2.454 2.305 2.903 . 0 0 "[ . 1 . 2 .]" 1
639 1 79 GLN HA 1 80 VAL HB 4.000 . 5.000 4.566 4.502 4.658 . 0 0 "[ . 1 . 2 .]" 1
640 1 80 VAL HA 1 80 VAL QG 2.500 . 3.200 2.075 2.016 2.134 . 0 0 "[ . 1 . 2 .]" 1
641 1 80 VAL QG 1 81 LEU HA 4.000 . 5.500 3.733 3.597 3.863 . 0 0 "[ . 1 . 2 .]" 1
642 1 80 VAL QG 1 82 SER HB3 3.000 . 3.800 3.676 3.534 3.805 0.005 6 0 "[ . 1 . 2 .]" 1
643 1 80 VAL QG 1 82 SER HB2 3.000 . 3.800 3.353 3.121 3.552 . 0 0 "[ . 1 . 2 .]" 1
644 1 80 VAL QG 1 82 SER HA 4.000 . 5.500 4.819 4.643 5.035 . 0 0 "[ . 1 . 2 .]" 1
645 1 81 LEU HA 1 81 LEU MD2 2.500 . 3.200 2.100 2.055 2.132 . 0 0 "[ . 1 . 2 .]" 1
646 1 81 LEU HA 1 81 LEU MD1 3.000 . 3.800 3.883 3.841 3.910 0.110 6 0 "[ . 1 . 2 .]" 1
647 1 81 LEU HA 1 81 LEU HG 3.000 . 3.300 3.177 2.997 3.323 0.023 18 0 "[ . 1 . 2 .]" 1
648 1 81 LEU MD1 1 86 LEU HA 4.000 . 5.500 3.429 3.143 3.710 . 0 0 "[ . 1 . 2 .]" 1
649 1 81 LEU MD2 1 86 LEU HA 4.000 . 6.500 4.291 3.982 4.497 . 0 0 "[ . 1 . 2 .]" 1
650 1 81 LEU HB3 1 86 LEU HA 4.000 . 5.000 2.608 2.348 2.920 . 0 0 "[ . 1 . 2 .]" 1
651 1 81 LEU MD1 1 89 GLN HB2 4.000 . 5.500 4.149 3.033 4.499 . 0 0 "[ . 1 . 2 .]" 1
652 1 81 LEU MD2 1 89 GLN HA 4.000 . 5.500 3.986 3.548 4.235 . 0 0 "[ . 1 . 2 .]" 1
653 1 81 LEU MD1 1 90 LEU HA 3.000 . 3.800 2.214 2.035 2.605 . 0 0 "[ . 1 . 2 .]" 1
654 1 81 LEU MD2 1 90 LEU HA 4.000 . 5.500 3.707 3.347 3.879 . 0 0 "[ . 1 . 2 .]" 1
655 1 81 LEU MD2 1 93 GLN HG3 3.000 . 3.800 1.970 1.909 2.229 . 0 0 "[ . 1 . 2 .]" 1
656 1 81 LEU MD2 1 93 GLN HG2 4.000 . 5.500 2.923 2.100 3.316 . 0 0 "[ . 1 . 2 .]" 1
657 1 81 LEU MD1 1 93 GLN HG3 4.000 . 5.500 2.729 2.164 3.324 . 0 0 "[ . 1 . 2 .]" 1
658 1 81 LEU MD2 1 97 TRP HZ2 4.000 . 5.500 3.319 2.481 4.238 . 0 0 "[ . 1 . 2 .]" 1
659 1 81 LEU MD1 1 97 TRP HZ2 3.000 . 3.800 2.411 2.095 2.907 . 0 0 "[ . 1 . 2 .]" 1
660 1 81 LEU HG 1 97 TRP HH2 4.000 . 6.000 4.458 3.490 5.387 . 0 0 "[ . 1 . 2 .]" 1
661 1 81 LEU MD1 1 97 TRP HH2 3.000 . 3.800 2.529 1.972 3.231 . 0 0 "[ . 1 . 2 .]" 1
662 1 81 LEU MD2 1 97 TRP HH2 4.000 . 5.500 4.638 3.754 5.489 . 0 0 "[ . 1 . 2 .]" 1
663 1 82 SER HA 1 86 LEU QD 3.000 . 3.800 2.320 1.938 2.919 . 0 0 "[ . 1 . 2 .]" 1
664 1 82 SER HB2 1 86 LEU QD 4.000 . 5.500 3.781 3.485 4.390 . 0 0 "[ . 1 . 2 .]" 1
665 1 82 SER HB3 1 86 LEU QD 4.000 . 5.500 4.496 4.135 5.057 . 0 0 "[ . 1 . 2 .]" 1
666 1 83 GLY HA3 1 84 ILE HG13 4.000 . 6.000 4.964 4.640 5.132 . 0 0 "[ . 1 . 2 .]" 1
667 1 84 ILE HA 1 84 ILE HG13 4.000 . 5.000 3.630 3.617 3.647 . 0 0 "[ . 1 . 2 .]" 1
668 1 84 ILE HA 1 84 ILE HG12 4.000 . 5.000 3.809 3.786 3.832 . 0 0 "[ . 1 . 2 .]" 1
669 1 84 ILE HA 1 84 ILE MG 2.500 . 3.200 2.419 2.305 2.536 . 0 0 "[ . 1 . 2 .]" 1
670 1 84 ILE HA 1 84 ILE MD 4.000 . 5.500 4.092 4.073 4.106 . 0 0 "[ . 1 . 2 .]" 1
671 1 84 ILE HB 1 84 ILE MD 3.000 . 3.800 2.260 2.164 2.347 . 0 0 "[ . 1 . 2 .]" 1
672 1 84 ILE MG 1 85 ASP HA 4.000 . 5.500 5.499 5.478 5.515 0.015 23 0 "[ . 1 . 2 .]" 1
673 1 86 LEU HA 1 86 LEU HG 4.000 . 5.000 2.617 2.276 3.131 . 0 0 "[ . 1 . 2 .]" 1
674 1 86 LEU HA 1 86 LEU QD 3.000 . 3.800 2.711 2.010 3.154 . 0 0 "[ . 1 . 2 .]" 1
675 1 86 LEU HB3 1 86 LEU QD 3.000 . 3.800 2.078 2.005 2.155 . 0 0 "[ . 1 . 2 .]" 1
676 1 86 LEU HB2 1 86 LEU QD 2.500 . 3.200 2.105 1.998 2.354 . 0 0 "[ . 1 . 2 .]" 1
677 1 86 LEU QD 1 87 THR MG 4.000 . 6.000 3.733 3.316 4.196 . 0 0 "[ . 1 . 2 .]" 1
678 1 86 LEU HB3 1 87 THR HA 4.000 . 6.000 4.434 4.132 4.738 . 0 0 "[ . 1 . 2 .]" 1
679 1 86 LEU HA 1 89 GLN HB3 3.000 . 3.300 3.231 2.996 3.556 0.256 15 0 "[ . 1 . 2 .]" 1
680 1 86 LEU HA 1 89 GLN HB2 4.000 . 6.000 3.417 2.118 3.807 . 0 0 "[ . 1 . 2 .]" 1
681 1 86 LEU HA 1 89 GLN QG 4.000 . 5.500 4.992 3.744 5.241 . 0 0 "[ . 1 . 2 .]" 1
682 1 86 LEU HA 1 90 LEU HB2 4.000 . 6.000 3.876 3.696 4.068 . 0 0 "[ . 1 . 2 .]" 1
683 1 87 THR HA 1 87 THR MG 2.500 . 3.200 2.377 2.235 2.480 . 0 0 "[ . 1 . 2 .]" 1
684 1 87 THR HA 1 90 LEU MD2 4.000 . 5.500 3.282 2.897 4.995 . 0 0 "[ . 1 . 2 .]" 1
685 1 87 THR HA 1 90 LEU HB2 4.000 . 5.000 3.612 3.298 3.919 . 0 0 "[ . 1 . 2 .]" 1
686 1 87 THR HA 1 90 LEU HB3 4.000 . 5.000 2.474 2.322 2.685 . 0 0 "[ . 1 . 2 .]" 1
687 1 88 ASP HA 1 91 ALA MB 2.500 . 3.200 2.906 2.630 3.080 . 0 0 "[ . 1 . 2 .]" 1
688 1 89 GLN HA 1 89 GLN QG 3.000 . 3.800 2.163 2.092 2.260 . 0 0 "[ . 1 . 2 .]" 1
689 1 89 GLN HA 1 92 ASN HB2 3.000 . 3.300 2.556 2.285 2.846 . 0 0 "[ . 1 . 2 .]" 1
690 1 89 GLN HA 1 92 ASN HB3 4.000 . 5.000 4.162 3.840 4.477 . 0 0 "[ . 1 . 2 .]" 1
691 1 90 LEU HA 1 90 LEU MD2 4.000 . 5.500 3.761 2.008 3.848 . 0 0 "[ . 1 . 2 .]" 1
692 1 90 LEU HB3 1 90 LEU MD2 3.000 . 3.800 2.295 2.143 3.179 . 0 0 "[ . 1 . 2 .]" 1
693 1 90 LEU HB2 1 90 LEU MD2 3.000 . 3.800 2.434 2.333 2.503 . 0 0 "[ . 1 . 2 .]" 1
694 1 90 LEU HA 1 90 LEU HG 4.000 . 6.000 2.998 2.871 3.704 . 0 0 "[ . 1 . 2 .]" 1
695 1 90 LEU HA 1 90 LEU MD1 2.500 . 3.200 2.186 2.098 3.036 . 0 0 "[ . 1 . 2 .]" 1
696 1 90 LEU HB2 1 90 LEU MD1 3.000 . 3.800 2.233 2.145 3.198 . 0 0 "[ . 1 . 2 .]" 1
697 1 90 LEU HB3 1 90 LEU MD1 3.000 . 3.800 3.142 2.230 3.190 . 0 0 "[ . 1 . 2 .]" 1
698 1 90 LEU MD2 1 91 ALA MB 4.000 . 7.000 4.525 4.442 4.947 . 0 0 "[ . 1 . 2 .]" 1
699 1 90 LEU MD1 1 91 ALA HA 4.000 . 5.500 4.657 2.341 4.929 . 0 0 "[ . 1 . 2 .]" 1
700 1 90 LEU HA 1 93 GLN HB3 4.000 . 5.000 4.044 3.782 4.527 . 0 0 "[ . 1 . 2 .]" 1
701 1 90 LEU HA 1 93 GLN HB2 4.000 . 6.000 2.388 2.198 2.834 . 0 0 "[ . 1 . 2 .]" 1
702 1 90 LEU MD1 1 97 TRP HZ3 3.000 . 3.800 2.555 2.027 3.889 0.089 10 0 "[ . 1 . 2 .]" 1
703 1 90 LEU MD1 1 97 TRP HH2 4.000 . 5.500 2.197 1.934 3.945 . 0 0 "[ . 1 . 2 .]" 1
704 1 91 ALA MB 1 92 ASN HB3 4.000 . 5.500 5.219 5.123 5.357 . 0 0 "[ . 1 . 2 .]" 1
705 1 91 ALA MB 1 92 ASN HA 4.000 . 5.500 3.860 3.774 3.915 . 0 0 "[ . 1 . 2 .]" 1
706 1 91 ALA HA 1 94 LEU HB2 4.000 . 5.000 3.828 3.352 4.004 . 0 0 "[ . 1 . 2 .]" 1
707 1 92 ASN HB3 1 93 GLN HG2 4.000 . 5.000 4.058 3.779 4.586 . 0 0 "[ . 1 . 2 .]" 1
708 1 92 ASN HA 1 95 PRO HD2 4.000 . 5.000 3.402 3.310 3.516 . 0 0 "[ . 1 . 2 .]" 1
709 1 92 ASN HA 1 95 PRO HD3 4.000 . 6.000 4.414 4.271 4.568 . 0 0 "[ . 1 . 2 .]" 1
710 1 93 GLN HA 1 93 GLN HG2 3.000 . 3.300 2.906 2.607 3.477 0.177 15 0 "[ . 1 . 2 .]" 1
711 1 93 GLN HA 1 93 GLN HG3 4.000 . 5.000 3.645 3.491 3.713 . 0 0 "[ . 1 . 2 .]" 1
712 1 93 GLN HA 1 96 GLN QB 3.000 . 3.800 2.680 2.517 2.956 . 0 0 "[ . 1 . 2 .]" 1
713 1 93 GLN HA 1 96 GLN QG 3.000 . 3.800 3.202 2.868 3.428 . 0 0 "[ . 1 . 2 .]" 1
714 1 93 GLN HA 1 97 TRP HZ2 4.000 . 5.000 4.870 4.644 5.014 0.014 7 0 "[ . 1 . 2 .]" 1
715 1 94 LEU HB3 1 94 LEU MD2 3.000 . 3.800 2.366 2.284 2.464 . 0 0 "[ . 1 . 2 .]" 1
716 1 94 LEU HB2 1 94 LEU MD2 3.000 . 3.800 2.309 2.198 2.415 . 0 0 "[ . 1 . 2 .]" 1
717 1 94 LEU HA 1 94 LEU MD2 3.000 . 3.800 3.810 3.776 3.856 0.056 9 0 "[ . 1 . 2 .]" 1
718 1 94 LEU HA 1 94 LEU MD1 2.500 . 3.200 2.128 2.093 2.196 . 0 0 "[ . 1 . 2 .]" 1
719 1 94 LEU HB2 1 94 LEU MD1 3.000 . 3.800 2.336 2.293 2.399 . 0 0 "[ . 1 . 2 .]" 1
720 1 94 LEU HA 1 94 LEU HG 4.000 . 5.000 3.325 3.249 3.454 . 0 0 "[ . 1 . 2 .]" 1
721 1 94 LEU HB3 1 95 PRO HD2 3.000 . 3.300 2.282 2.219 2.424 . 0 0 "[ . 1 . 2 .]" 1
722 1 94 LEU MD2 1 95 PRO HD2 4.000 . 5.500 4.161 3.996 4.331 . 0 0 "[ . 1 . 2 .]" 1
723 1 94 LEU HB2 1 95 PRO HD2 4.000 . 5.000 3.710 3.646 3.799 . 0 0 "[ . 1 . 2 .]" 1
724 1 94 LEU MD1 1 95 PRO HD2 4.000 . 6.500 4.364 4.243 4.460 . 0 0 "[ . 1 . 2 .]" 1
725 1 94 LEU HB2 1 95 PRO HD3 4.000 . 5.000 3.779 3.723 3.827 . 0 0 "[ . 1 . 2 .]" 1
726 1 94 LEU HB3 1 95 PRO HD3 3.000 . 3.300 2.102 2.081 2.140 . 0 0 "[ . 1 . 2 .]" 1
727 1 94 LEU HB3 1 95 PRO HG3 4.000 . 5.000 4.246 4.207 4.317 . 0 0 "[ . 1 . 2 .]" 1
728 1 94 LEU HA 1 95 PRO HD2 4.000 . 6.000 3.710 3.693 3.742 . 0 0 "[ . 1 . 2 .]" 1
729 1 94 LEU MD1 1 97 TRP HB2 4.000 . 5.500 2.627 2.414 2.882 . 0 0 "[ . 1 . 2 .]" 1
730 1 94 LEU HA 1 97 TRP HB2 4.000 . 5.000 2.969 2.648 3.275 . 0 0 "[ . 1 . 2 .]" 1
731 1 94 LEU MD1 1 97 TRP HB3 4.000 . 5.500 3.951 3.675 4.257 . 0 0 "[ . 1 . 2 .]" 1
732 1 94 LEU HA 1 97 TRP HB3 4.000 . 5.000 4.348 4.051 4.663 . 0 0 "[ . 1 . 2 .]" 1
733 1 94 LEU MD2 1 97 TRP HE3 4.000 . 5.500 4.890 4.639 5.124 . 0 0 "[ . 1 . 2 .]" 1
734 1 94 LEU MD1 1 97 TRP HZ3 3.000 . 3.800 3.639 3.331 3.820 0.020 13 0 "[ . 1 . 2 .]" 1
735 1 94 LEU MD1 1 97 TRP HD1 4.000 . 6.500 5.423 5.284 5.629 . 0 0 "[ . 1 . 2 .]" 1
736 1 94 LEU MD1 1 97 TRP HE3 3.000 . 3.800 2.639 2.405 2.816 . 0 0 "[ . 1 . 2 .]" 1
737 1 94 LEU HA 1 97 TRP HE3 4.000 . 5.000 2.909 2.672 3.143 . 0 0 "[ . 1 . 2 .]" 1
738 1 94 LEU MD2 1 97 TRP HZ3 4.000 . 6.500 5.110 4.759 5.439 . 0 0 "[ . 1 . 2 .]" 1
739 1 94 LEU HB3 1 98 LEU MD1 4.000 . 5.500 5.071 4.634 5.448 . 0 0 "[ . 1 . 2 .]" 1
740 1 95 PRO HA 1 98 LEU MD1 3.000 . 3.800 3.011 2.399 3.692 . 0 0 "[ . 1 . 2 .]" 1
741 1 95 PRO HA 1 98 LEU HB3 4.000 . 5.000 4.745 4.430 5.021 0.021 3 0 "[ . 1 . 2 .]" 1
742 1 95 PRO HA 1 98 LEU HB2 4.000 . 5.000 3.127 2.764 3.342 . 0 0 "[ . 1 . 2 .]" 1
743 1 96 GLN HA 1 96 GLN QG 2.500 . 3.200 2.364 2.293 2.875 . 0 0 "[ . 1 . 2 .]" 1
744 1 96 GLN QB 1 97 TRP HD1 4.000 . 5.500 2.751 2.596 2.905 . 0 0 "[ . 1 . 2 .]" 1
745 1 96 GLN HA 1 99 VAL HB 3.000 . 3.300 2.357 2.229 2.599 . 0 0 "[ . 1 . 2 .]" 1
746 1 96 GLN QB 1 99 VAL MG1 4.000 . 7.000 4.924 4.690 5.123 . 0 0 "[ . 1 . 2 .]" 1
747 1 96 GLN QG 1 99 VAL MG2 3.000 . 4.300 4.071 3.547 4.341 0.041 1 0 "[ . 1 . 2 .]" 1
748 1 96 GLN HA 1 99 VAL MG2 4.000 . 5.500 2.939 2.261 3.491 . 0 0 "[ . 1 . 2 .]" 1
749 1 96 GLN HA 1 99 VAL MG1 3.000 . 3.800 3.758 3.547 3.861 0.061 23 0 "[ . 1 . 2 .]" 1
750 1 97 TRP HB3 1 97 TRP HE3 4.000 . 6.000 3.137 3.019 3.226 . 0 0 "[ . 1 . 2 .]" 1
751 1 97 TRP HA 1 97 TRP HD1 2.500 . 2.700 2.204 2.143 2.288 . 0 0 "[ . 1 . 2 .]" 1
752 1 97 TRP HA 1 100 GLN QB 4.000 . 5.500 5.014 3.747 5.515 0.015 18 0 "[ . 1 . 2 .]" 1
753 1 97 TRP HD1 1 100 GLN QG 4.000 . 5.500 4.987 3.652 5.612 0.112 24 0 "[ . 1 . 2 .]" 1
754 1 98 LEU HA 1 98 LEU HG 4.000 . 5.000 3.059 2.723 3.277 . 0 0 "[ . 1 . 2 .]" 1
755 1 98 LEU HB2 1 98 LEU MD1 3.000 . 3.800 2.347 2.206 2.459 . 0 0 "[ . 1 . 2 .]" 1
756 1 98 LEU HA 1 98 LEU MD1 4.000 . 5.500 3.788 3.742 3.841 . 0 0 "[ . 1 . 2 .]" 1
757 1 98 LEU HA 1 98 LEU MD2 2.500 . 3.200 2.052 1.982 2.148 . 0 0 "[ . 1 . 2 .]" 1
758 1 98 LEU HA 1 99 VAL MG2 4.000 . 5.500 4.840 4.392 5.046 . 0 0 "[ . 1 . 2 .]" 1
759 1 99 VAL HA 1 99 VAL MG1 2.500 . 3.200 2.351 2.176 2.448 . 0 0 "[ . 1 . 2 .]" 1
760 1 99 VAL MG1 1 100 GLN QG 4.000 . 6.000 4.784 4.247 5.376 . 0 0 "[ . 1 . 2 .]" 1
761 1 99 VAL MG1 1 101 GLN HB2 4.000 . 5.500 3.777 1.995 5.472 . 0 0 "[ . 1 . 2 .]" 1
762 1 101 GLN HA 1 101 GLN QG 2.500 . 3.200 2.428 2.297 2.969 . 0 0 "[ . 1 . 2 .]" 1
763 1 10 ALA H 1 10 ALA MB 2.500 . 3.400 2.144 2.042 2.226 . 0 0 "[ . 1 . 2 .]" 1
764 1 10 ALA MB 1 11 GLN H 2.500 . 3.400 2.579 1.767 3.052 0.033 2 0 "[ . 1 . 2 .]" 1
765 1 10 ALA HA 1 11 GLN H 2.500 . 2.900 2.377 2.158 2.790 . 0 0 "[ . 1 . 2 .]" 1
766 1 11 GLN H 1 11 GLN HB3 4.000 . 5.000 3.641 3.550 3.886 . 0 0 "[ . 1 . 2 .]" 1
767 1 12 PRO HA 1 13 LEU H 3.000 . 3.500 2.367 2.297 2.499 . 0 0 "[ . 1 . 2 .]" 1
768 1 13 LEU H 1 13 LEU HB2 4.000 . 6.000 2.483 2.421 2.582 . 0 0 "[ . 1 . 2 .]" 1
769 1 13 LEU H 1 13 LEU HB3 4.000 . 6.000 2.650 2.604 2.704 . 0 0 "[ . 1 . 2 .]" 1
770 1 13 LEU HA 1 14 LEU H 3.000 . 3.500 2.194 2.160 2.229 . 0 0 "[ . 1 . 2 .]" 1
771 1 13 LEU MD2 1 14 LEU H 3.000 . 4.000 2.069 1.901 2.147 . 0 0 "[ . 1 . 2 .]" 1
772 1 14 LEU H 1 14 LEU HB2 4.000 . 5.000 2.486 2.346 2.547 . 0 0 "[ . 1 . 2 .]" 1
773 1 14 LEU H 1 14 LEU HG 4.000 . 5.000 2.505 2.271 3.719 . 0 0 "[ . 1 . 2 .]" 1
774 1 14 LEU HA 1 15 LEU H 3.000 . 3.500 2.105 2.083 2.140 . 0 0 "[ . 1 . 2 .]" 1
775 1 14 LEU HB3 1 15 LEU H 4.000 . 6.000 3.628 3.546 3.785 . 0 0 "[ . 1 . 2 .]" 1
776 1 14 LEU MD2 1 15 LEU H 3.000 . 4.000 3.581 3.464 3.935 . 0 0 "[ . 1 . 2 .]" 1
777 1 14 LEU HB2 1 74 GLY H 4.000 . 5.000 3.126 2.648 3.445 . 0 0 "[ . 1 . 2 .]" 1
778 1 15 LEU HA 1 16 GLN H 3.000 . 3.500 2.215 2.193 2.234 . 0 0 "[ . 1 . 2 .]" 1
779 1 15 LEU MD2 1 16 GLN H 4.000 . 5.500 2.479 2.296 2.613 . 0 0 "[ . 1 . 2 .]" 1
780 1 15 LEU MD2 1 73 ILE H 4.000 . 5.500 3.710 3.426 3.970 . 0 0 "[ . 1 . 2 .]" 1
781 1 16 GLN H 1 16 GLN HG2 4.000 . 5.000 4.290 4.123 4.393 . 0 0 "[ . 1 . 2 .]" 1
782 1 16 GLN HA 1 17 LEU H 3.000 . 3.500 2.276 2.138 2.324 . 0 0 "[ . 1 . 2 .]" 1
783 1 17 LEU H 1 17 LEU HB2 4.000 . 5.000 3.160 2.936 3.242 . 0 0 "[ . 1 . 2 .]" 1
784 1 17 LEU H 1 17 LEU HB3 4.000 . 5.000 2.723 2.509 2.793 . 0 0 "[ . 1 . 2 .]" 1
785 1 17 LEU MD1 1 18 PHE H 3.000 . 4.000 2.814 2.556 3.033 . 0 0 "[ . 1 . 2 .]" 1
786 1 17 LEU HA 1 18 PHE H 3.000 . 3.500 2.163 2.146 2.183 . 0 0 "[ . 1 . 2 .]" 1
787 1 17 LEU H 1 47 LEU MD2 4.000 . 5.500 3.011 2.377 3.848 . 0 0 "[ . 1 . 2 .]" 1
788 1 17 LEU MD1 1 69 ALA H 4.000 . 5.500 3.125 2.688 3.483 . 0 0 "[ . 1 . 2 .]" 1
789 1 18 PHE H 1 18 PHE QD 4.000 . 5.000 2.456 2.108 2.846 . 0 0 "[ . 1 . 2 .]" 1
790 1 18 PHE H 1 18 PHE HB3 4.000 . 5.000 3.609 3.580 3.649 . 0 0 "[ . 1 . 2 .]" 1
791 1 18 PHE H 1 18 PHE HB2 4.000 . 5.000 2.359 2.313 2.424 . 0 0 "[ . 1 . 2 .]" 1
792 1 18 PHE QD 1 19 VAL H 4.000 . 5.000 4.242 3.817 4.524 . 0 0 "[ . 1 . 2 .]" 1
793 1 18 PHE HA 1 19 VAL H 2.500 . 2.900 2.158 2.114 2.183 . 0 0 "[ . 1 . 2 .]" 1
794 1 18 PHE HA 1 50 ILE H 4.000 . 5.000 2.779 2.601 2.927 . 0 0 "[ . 1 . 2 .]" 1
795 1 18 PHE H 1 69 ALA MB 4.000 . 6.500 3.591 3.184 3.909 . 0 0 "[ . 1 . 2 .]" 1
796 1 18 PHE HB2 1 69 ALA H 4.000 . 5.000 3.099 2.662 3.401 . 0 0 "[ . 1 . 2 .]" 1
797 1 18 PHE HB3 1 69 ALA H 4.000 . 5.000 4.126 3.761 4.491 . 0 0 "[ . 1 . 2 .]" 1
798 1 19 VAL H 1 19 VAL MG1 3.000 . 4.000 2.647 2.502 2.818 . 0 0 "[ . 1 . 2 .]" 1
799 1 19 VAL H 1 19 VAL MG2 2.500 . 3.400 2.180 2.064 2.283 . 0 0 "[ . 1 . 2 .]" 1
800 1 19 VAL HA 1 20 ASP H 3.000 . 3.500 2.297 2.250 2.479 . 0 0 "[ . 1 . 2 .]" 1
801 1 19 VAL HB 1 20 ASP H 3.000 . 3.500 2.662 2.443 2.826 . 0 0 "[ . 1 . 2 .]" 1
802 1 19 VAL MG2 1 20 ASP H 3.000 . 4.000 3.366 3.131 3.499 . 0 0 "[ . 1 . 2 .]" 1
803 1 19 VAL MG1 1 29 VAL H 4.000 . 5.500 4.921 4.671 5.130 . 0 0 "[ . 1 . 2 .]" 1
804 1 19 VAL H 1 51 ASN HA 4.000 . 5.000 3.229 3.032 3.339 . 0 0 "[ . 1 . 2 .]" 1
805 1 19 VAL MG2 1 52 VAL H 3.000 . 4.000 3.911 3.772 4.054 0.054 1 0 "[ . 1 . 2 .]" 1
806 1 19 VAL H 1 52 VAL MG1 4.000 . 5.500 3.081 2.850 3.379 . 0 0 "[ . 1 . 2 .]" 1
807 1 19 VAL H 1 52 VAL MG2 4.000 . 5.500 4.086 3.615 4.416 . 0 0 "[ . 1 . 2 .]" 1
808 1 19 VAL MG1 1 69 ALA H 4.000 . 5.500 3.726 3.491 3.958 . 0 0 "[ . 1 . 2 .]" 1
809 1 20 ASP HA 1 21 THR H 4.000 . 5.000 3.045 2.443 3.118 . 0 0 "[ . 1 . 2 .]" 1
810 1 20 ASP HB2 1 21 THR H 4.000 . 5.000 4.451 4.256 4.504 . 0 0 "[ . 1 . 2 .]" 1
811 1 21 THR H 1 21 THR MG 3.000 . 4.000 2.597 2.457 2.740 . 0 0 "[ . 1 . 2 .]" 1
812 1 21 THR HA 1 22 ARG H 3.000 . 3.500 3.229 3.178 3.329 . 0 0 "[ . 1 . 2 .]" 1
813 1 21 THR MG 1 22 ARG H 4.000 . 5.500 4.038 3.968 4.165 . 0 0 "[ . 1 . 2 .]" 1
814 1 22 ARG H 1 22 ARG QB 3.000 . 4.000 2.490 2.340 2.632 . 0 0 "[ . 1 . 2 .]" 1
815 1 22 ARG H 1 22 ARG HD3 4.000 . 5.000 4.127 1.666 4.704 0.134 3 0 "[ . 1 . 2 .]" 1
816 1 22 ARG H 1 23 PRO HD3 4.000 . 5.000 5.009 4.679 5.057 0.057 2 0 "[ . 1 . 2 .]" 1
817 1 23 PRO HA 1 26 GLN H 4.000 . 5.000 3.250 3.110 3.352 . 0 0 "[ . 1 . 2 .]" 1
818 1 24 LEU H 1 24 LEU HB2 4.000 . 6.000 2.463 2.412 2.509 . 0 0 "[ . 1 . 2 .]" 1
819 1 24 LEU H 1 24 LEU HB3 4.000 . 6.000 2.614 2.571 2.717 . 0 0 "[ . 1 . 2 .]" 1
820 1 24 LEU HA 1 25 SER H 4.000 . 5.000 3.556 3.544 3.569 . 0 0 "[ . 1 . 2 .]" 1
821 1 24 LEU HB3 1 25 SER H 3.000 . 3.500 2.532 2.469 2.669 . 0 0 "[ . 1 . 2 .]" 1
822 1 25 SER H 1 25 SER QB 3.000 . 4.000 2.459 2.257 2.559 . 0 0 "[ . 1 . 2 .]" 1
823 1 26 GLN H 1 26 GLN QB 2.500 . 3.400 2.418 2.331 2.528 . 0 0 "[ . 1 . 2 .]" 1
824 1 26 GLN H 1 26 GLN QG 2.500 . 3.400 2.225 2.007 3.187 . 0 0 "[ . 1 . 2 .]" 1
825 1 27 HIS QB 1 28 ILE H 3.000 . 4.000 2.148 2.056 2.245 . 0 0 "[ . 1 . 2 .]" 1
826 1 27 HIS HA 1 28 ILE H 4.000 . 5.000 3.545 3.530 3.559 . 0 0 "[ . 1 . 2 .]" 1
827 1 28 ILE H 1 28 ILE HG13 3.000 . 3.500 2.181 2.115 2.329 . 0 0 "[ . 1 . 2 .]" 1
828 1 28 ILE H 1 28 ILE HG12 4.000 . 5.000 3.473 3.392 3.605 . 0 0 "[ . 1 . 2 .]" 1
829 1 28 ILE H 1 28 ILE HB 3.000 . 3.500 2.417 2.360 2.461 . 0 0 "[ . 1 . 2 .]" 1
830 1 28 ILE H 1 28 ILE MG 4.000 . 5.500 3.727 3.715 3.742 . 0 0 "[ . 1 . 2 .]" 1
831 1 28 ILE MG 1 29 VAL H 3.000 . 4.000 3.564 3.443 3.662 . 0 0 "[ . 1 . 2 .]" 1
832 1 28 ILE H 1 29 VAL MG2 4.000 . 5.500 4.273 4.165 4.337 . 0 0 "[ . 1 . 2 .]" 1
833 1 28 ILE HB 1 29 VAL H 3.000 . 3.500 2.812 2.723 2.890 . 0 0 "[ . 1 . 2 .]" 1
834 1 28 ILE HA 1 31 ARG H 3.000 . 3.500 3.130 2.974 3.240 . 0 0 "[ . 1 . 2 .]" 1
835 1 29 VAL H 1 29 VAL HB 3.000 . 3.500 2.415 2.375 2.464 . 0 0 "[ . 1 . 2 .]" 1
836 1 29 VAL H 1 29 VAL MG2 2.500 . 3.400 2.395 2.287 2.478 . 0 0 "[ . 1 . 2 .]" 1
837 1 29 VAL MG2 1 30 GLN H 3.000 . 4.000 3.948 3.912 3.982 . 0 0 "[ . 1 . 2 .]" 1
838 1 29 VAL HB 1 30 GLN H 3.000 . 3.500 2.584 2.534 2.643 . 0 0 "[ . 1 . 2 .]" 1
839 1 30 GLN H 1 30 GLN QB 2.500 . 3.400 2.447 2.401 2.504 . 0 0 "[ . 1 . 2 .]" 1
840 1 30 GLN H 1 30 GLN QG 3.000 . 4.000 2.225 2.133 2.461 . 0 0 "[ . 1 . 2 .]" 1
841 1 30 GLN HA 1 31 ARG H 4.000 . 5.000 3.545 3.529 3.554 . 0 0 "[ . 1 . 2 .]" 1
842 1 30 GLN QG 1 31 ARG H 3.000 . 4.000 4.005 3.922 4.047 0.047 9 0 "[ . 1 . 2 .]" 1
843 1 30 GLN QB 1 31 ARG H 3.000 . 4.000 2.502 2.427 2.570 . 0 0 "[ . 1 . 2 .]" 1
844 1 30 GLN HA 1 33 LYS H 3.000 . 3.500 3.439 3.198 3.535 0.035 13 0 "[ . 1 . 2 .]" 1
845 1 30 GLN HA 1 34 ASN H 4.000 . 5.000 3.574 3.446 3.701 . 0 0 "[ . 1 . 2 .]" 1
846 1 31 ARG H 1 31 ARG QB 2.500 . 3.400 2.419 2.380 2.459 . 0 0 "[ . 1 . 2 .]" 1
847 1 31 ARG H 1 31 ARG HG2 3.000 . 3.500 3.336 3.250 3.413 . 0 0 "[ . 1 . 2 .]" 1
848 1 31 ARG H 1 31 ARG QD 4.000 . 5.500 3.960 3.768 4.302 . 0 0 "[ . 1 . 2 .]" 1
849 1 31 ARG HA 1 32 VAL H 4.000 . 5.000 3.538 3.526 3.549 . 0 0 "[ . 1 . 2 .]" 1
850 1 31 ARG QB 1 32 VAL H 3.000 . 4.000 2.583 2.499 2.677 . 0 0 "[ . 1 . 2 .]" 1
851 1 31 ARG HA 1 34 ASN H 3.000 . 3.500 3.524 3.483 3.570 0.070 12 0 "[ . 1 . 2 .]" 1
852 1 32 VAL H 1 32 VAL HB 3.000 . 3.500 2.407 2.319 2.471 . 0 0 "[ . 1 . 2 .]" 1
853 1 32 VAL H 1 32 VAL MG2 2.500 . 3.400 2.335 2.183 2.532 . 0 0 "[ . 1 . 2 .]" 1
854 1 32 VAL H 1 32 VAL MG1 3.000 . 4.000 3.731 3.700 3.745 . 0 0 "[ . 1 . 2 .]" 1
855 1 32 VAL HB 1 33 LYS H 3.000 . 3.500 2.387 2.295 2.466 . 0 0 "[ . 1 . 2 .]" 1
856 1 32 VAL MG2 1 33 LYS H 4.000 . 5.500 3.828 3.754 3.906 . 0 0 "[ . 1 . 2 .]" 1
857 1 32 VAL MG1 1 33 LYS H 3.000 . 4.000 3.095 2.839 3.308 . 0 0 "[ . 1 . 2 .]" 1
858 1 32 VAL HA 1 33 LYS H 4.000 . 6.000 3.565 3.556 3.572 . 0 0 "[ . 1 . 2 .]" 1
859 1 32 VAL HA 1 35 ILE H 4.000 . 5.000 3.737 3.669 3.853 . 0 0 "[ . 1 . 2 .]" 1
860 1 32 VAL HA 1 36 LEU H 4.000 . 5.000 3.901 3.627 4.127 . 0 0 "[ . 1 . 2 .]" 1
861 1 32 VAL H 1 87 THR MG 4.000 . 5.500 3.775 3.322 4.315 . 0 0 "[ . 1 . 2 .]" 1
862 1 33 LYS H 1 33 LYS QD 3.000 . 4.000 3.872 3.836 3.911 . 0 0 "[ . 1 . 2 .]" 1
863 1 33 LYS H 1 33 LYS HG2 4.000 . 5.500 3.360 3.292 3.436 . 0 0 "[ . 1 . 2 .]" 1
864 1 33 LYS H 1 33 LYS HB3 3.000 . 3.500 3.560 3.553 3.567 0.067 22 0 "[ . 1 . 2 .]" 1
865 1 33 LYS HA 1 34 ASN H 4.000 . 5.000 3.544 3.531 3.555 . 0 0 "[ . 1 . 2 .]" 1
866 1 33 LYS HB3 1 34 ASN H 3.000 . 3.500 3.536 3.470 3.562 0.062 13 0 "[ . 1 . 2 .]" 1
867 1 33 LYS HA 1 36 LEU H 4.000 . 5.000 3.766 3.594 3.979 . 0 0 "[ . 1 . 2 .]" 1
868 1 34 ASN H 1 34 ASN HB2 3.000 . 3.500 2.454 2.384 2.498 . 0 0 "[ . 1 . 2 .]" 1
869 1 34 ASN H 1 34 ASN HB3 3.000 . 3.500 3.558 3.545 3.566 0.066 9 0 "[ . 1 . 2 .]" 1
870 1 34 ASN HB2 1 35 ILE H 4.000 . 5.000 2.520 2.452 2.609 . 0 0 "[ . 1 . 2 .]" 1
871 1 34 ASN HA 1 37 ALA H 4.000 . 5.000 3.809 3.642 3.952 . 0 0 "[ . 1 . 2 .]" 1
872 1 34 ASN H 1 37 ALA MB 4.000 . 5.500 4.489 4.143 4.814 . 0 0 "[ . 1 . 2 .]" 1
873 1 35 ILE H 1 35 ILE MG 3.000 . 4.000 3.744 3.732 3.755 . 0 0 "[ . 1 . 2 .]" 1
874 1 35 ILE H 1 35 ILE HG13 3.000 . 3.500 2.213 2.110 2.290 . 0 0 "[ . 1 . 2 .]" 1
875 1 35 ILE H 1 35 ILE HG12 4.000 . 5.000 3.573 3.490 3.643 . 0 0 "[ . 1 . 2 .]" 1
876 1 35 ILE H 1 35 ILE HB 3.000 . 3.500 2.440 2.399 2.475 . 0 0 "[ . 1 . 2 .]" 1
877 1 35 ILE H 1 35 ILE MD 3.000 . 4.000 3.433 3.353 3.528 . 0 0 "[ . 1 . 2 .]" 1
878 1 35 ILE HA 1 36 LEU H 4.000 . 6.000 3.578 3.562 3.592 . 0 0 "[ . 1 . 2 .]" 1
879 1 35 ILE MG 1 36 LEU H 3.000 . 4.000 3.227 3.079 3.348 . 0 0 "[ . 1 . 2 .]" 1
880 1 35 ILE HB 1 36 LEU H 3.000 . 3.500 2.435 2.333 2.530 . 0 0 "[ . 1 . 2 .]" 1
881 1 35 ILE HA 1 38 ALA H 4.000 . 5.000 3.343 3.247 3.443 . 0 0 "[ . 1 . 2 .]" 1
882 1 36 LEU H 1 36 LEU MD2 3.000 . 4.000 3.249 2.920 3.464 . 0 0 "[ . 1 . 2 .]" 1
883 1 36 LEU H 1 36 LEU HB3 4.000 . 5.000 3.596 3.583 3.610 . 0 0 "[ . 1 . 2 .]" 1
884 1 36 LEU H 1 36 LEU MD1 3.000 . 4.000 3.548 3.231 3.675 . 0 0 "[ . 1 . 2 .]" 1
885 1 36 LEU H 1 36 LEU HG 3.000 . 3.500 2.123 2.002 2.212 . 0 0 "[ . 1 . 2 .]" 1
886 1 36 LEU H 1 36 LEU HB2 3.000 . 3.500 2.496 2.448 2.558 . 0 0 "[ . 1 . 2 .]" 1
887 1 36 LEU HG 1 37 ALA H 4.000 . 6.000 4.240 4.165 4.319 . 0 0 "[ . 1 . 2 .]" 1
888 1 36 LEU HA 1 37 ALA H 4.000 . 6.000 3.526 3.500 3.543 . 0 0 "[ . 1 . 2 .]" 1
889 1 36 LEU HB2 1 37 ALA H 4.000 . 5.000 2.598 2.513 2.698 . 0 0 "[ . 1 . 2 .]" 1
890 1 36 LEU HB3 1 37 ALA H 4.000 . 5.000 3.634 3.556 3.739 . 0 0 "[ . 1 . 2 .]" 1
891 1 36 LEU H 1 37 ALA MB 4.000 . 5.500 4.347 4.262 4.431 . 0 0 "[ . 1 . 2 .]" 1
892 1 36 LEU HA 1 38 ALA H 4.000 . 5.000 3.650 3.506 3.877 . 0 0 "[ . 1 . 2 .]" 1
893 1 36 LEU HA 1 39 VAL H 4.000 . 6.000 3.767 3.235 4.412 . 0 0 "[ . 1 . 2 .]" 1
894 1 37 ALA H 1 37 ALA MB 2.500 . 3.400 2.217 2.145 2.250 . 0 0 "[ . 1 . 2 .]" 1
895 1 37 ALA MB 1 38 ALA H 2.500 . 3.400 3.063 2.869 3.148 . 0 0 "[ . 1 . 2 .]" 1
896 1 38 ALA H 1 38 ALA MB 2.500 . 3.400 2.200 2.085 2.285 . 0 0 "[ . 1 . 2 .]" 1
897 1 38 ALA H 1 39 VAL QG 3.000 . 4.000 3.791 3.153 4.063 0.063 8 0 "[ . 1 . 2 .]" 1
898 1 38 ALA MB 1 39 VAL H 3.000 . 4.000 3.201 2.916 3.581 . 0 0 "[ . 1 . 2 .]" 1
899 1 38 ALA HA 1 39 VAL H 3.000 . 3.500 3.315 3.037 3.470 . 0 0 "[ . 1 . 2 .]" 1
900 1 39 VAL H 1 39 VAL QG 2.500 . 3.400 2.331 2.024 2.600 . 0 0 "[ . 1 . 2 .]" 1
901 1 39 VAL H 1 39 VAL HB 3.000 . 3.500 2.846 2.442 3.456 . 0 0 "[ . 1 . 2 .]" 1
902 1 39 VAL HB 1 40 GLU H 4.000 . 5.000 4.079 3.669 4.366 . 0 0 "[ . 1 . 2 .]" 1
903 1 39 VAL HA 1 40 GLU H 3.000 . 3.500 3.422 3.324 3.523 0.023 19 0 "[ . 1 . 2 .]" 1
904 1 39 VAL QG 1 40 GLU H 3.000 . 4.000 2.261 1.869 2.612 . 0 0 "[ . 1 . 2 .]" 1
905 1 40 GLU H 1 40 GLU QB 3.000 . 4.000 3.088 2.655 3.290 . 0 0 "[ . 1 . 2 .]" 1
906 1 40 GLU H 1 40 GLU QG 3.000 . 4.000 2.830 2.321 4.187 0.187 13 0 "[ . 1 . 2 .]" 1
907 1 41 ALA H 1 41 ALA MB 2.500 . 3.400 2.958 2.752 3.038 . 0 0 "[ . 1 . 2 .]" 1
908 1 41 ALA HA 1 42 THR H 3.000 . 3.500 2.500 2.293 2.743 . 0 0 "[ . 1 . 2 .]" 1
909 1 41 ALA MB 1 42 THR H 4.000 . 5.500 2.418 2.080 3.705 . 0 0 "[ . 1 . 2 .]" 1
910 1 41 ALA MB 1 43 VAL H 3.000 . 4.000 2.177 1.966 2.790 . 0 0 "[ . 1 . 2 .]" 1
911 1 41 ALA HA 1 43 VAL H 4.000 . 5.000 3.970 3.710 4.133 . 0 0 "[ . 1 . 2 .]" 1
912 1 42 THR H 1 42 THR MG 4.000 . 5.500 2.263 1.950 2.491 . 0 0 "[ . 1 . 2 .]" 1
913 1 42 THR HA 1 43 VAL H 3.000 . 3.500 3.339 3.281 3.507 0.007 19 0 "[ . 1 . 2 .]" 1
914 1 42 THR MG 1 43 VAL H 4.000 . 5.500 4.055 3.745 4.171 . 0 0 "[ . 1 . 2 .]" 1
915 1 43 VAL H 1 43 VAL MG1 3.000 . 4.000 3.112 3.017 3.219 . 0 0 "[ . 1 . 2 .]" 1
916 1 43 VAL H 1 43 VAL MG2 2.500 . 3.400 1.899 1.822 1.972 . 0 0 "[ . 1 . 2 .]" 1
917 1 43 VAL H 1 43 VAL HB 3.000 . 3.500 3.621 3.595 3.644 0.144 11 0 "[ . 1 . 2 .]" 1
918 1 44 PRO HB2 1 45 ILE H 4.000 . 5.000 3.245 3.004 3.399 . 0 0 "[ . 1 . 2 .]" 1
919 1 44 PRO HA 1 45 ILE H 2.500 . 2.900 2.281 2.235 2.350 . 0 0 "[ . 1 . 2 .]" 1
920 1 44 PRO HB3 1 45 ILE H 4.000 . 5.000 3.352 3.136 3.506 . 0 0 "[ . 1 . 2 .]" 1
921 1 45 ILE H 1 45 ILE MG 4.000 . 5.500 3.825 3.800 3.859 . 0 0 "[ . 1 . 2 .]" 1
922 1 45 ILE H 1 45 ILE MD 4.000 . 5.500 1.940 1.750 2.633 0.050 12 0 "[ . 1 . 2 .]" 1
923 1 45 ILE H 1 45 ILE HB 3.000 . 3.500 2.604 2.527 2.694 . 0 0 "[ . 1 . 2 .]" 1
924 1 45 ILE H 1 45 ILE HG13 3.000 . 3.500 3.023 2.700 3.214 . 0 0 "[ . 1 . 2 .]" 1
925 1 45 ILE HA 1 46 SER H 3.000 . 3.500 2.225 2.200 2.272 . 0 0 "[ . 1 . 2 .]" 1
926 1 45 ILE MG 1 46 SER H 3.000 . 4.000 1.991 1.889 2.230 . 0 0 "[ . 1 . 2 .]" 1
927 1 46 SER H 1 46 SER HB3 4.000 . 5.000 2.570 2.446 2.704 . 0 0 "[ . 1 . 2 .]" 1
928 1 46 SER H 1 46 SER HB2 4.000 . 5.000 2.830 2.688 2.944 . 0 0 "[ . 1 . 2 .]" 1
929 1 46 SER HA 1 47 LEU H 2.500 . 2.900 2.165 2.153 2.193 . 0 0 "[ . 1 . 2 .]" 1
930 1 47 LEU H 1 47 LEU HB3 3.000 . 3.500 2.848 2.542 2.981 . 0 0 "[ . 1 . 2 .]" 1
931 1 47 LEU H 1 47 LEU HB2 4.000 . 5.000 2.508 2.439 2.715 . 0 0 "[ . 1 . 2 .]" 1
932 1 47 LEU H 1 47 LEU MD2 4.000 . 5.500 4.120 4.068 4.184 . 0 0 "[ . 1 . 2 .]" 1
933 1 47 LEU HA 1 48 GLN H 3.000 . 3.500 2.146 2.131 2.162 . 0 0 "[ . 1 . 2 .]" 1
934 1 47 LEU MD2 1 48 GLN H 3.000 . 4.000 1.859 1.770 2.259 0.030 7 0 "[ . 1 . 2 .]" 1
935 1 48 GLN H 1 48 GLN HB2 4.000 . 5.000 2.502 2.431 2.743 . 0 0 "[ . 1 . 2 .]" 1
936 1 48 GLN HA 1 49 VAL H 2.500 . 2.900 2.172 2.141 2.215 . 0 0 "[ . 1 . 2 .]" 1
937 1 48 GLN H 1 70 LEU MD1 4.000 . 6.500 6.127 5.850 6.468 . 0 0 "[ . 1 . 2 .]" 1
938 1 49 VAL H 1 49 VAL QG 3.000 . 4.000 2.302 2.138 2.558 . 0 0 "[ . 1 . 2 .]" 1
939 1 49 VAL H 1 49 VAL HB 3.000 . 3.500 2.640 2.589 2.679 . 0 0 "[ . 1 . 2 .]" 1
940 1 49 VAL HA 1 50 ILE H 2.500 . 2.900 2.167 2.143 2.208 . 0 0 "[ . 1 . 2 .]" 1
941 1 50 ILE H 1 50 ILE HB 4.000 . 5.000 2.679 2.622 2.759 . 0 0 "[ . 1 . 2 .]" 1
942 1 50 ILE H 1 50 ILE HG13 3.000 . 3.500 2.550 2.385 2.718 . 0 0 "[ . 1 . 2 .]" 1
943 1 50 ILE H 1 50 ILE MG 3.000 . 4.000 3.856 3.835 3.883 . 0 0 "[ . 1 . 2 .]" 1
944 1 50 ILE MG 1 51 ASN H 3.000 . 4.000 2.602 2.312 2.833 . 0 0 "[ . 1 . 2 .]" 1
945 1 50 ILE HA 1 51 ASN H 2.500 . 2.900 2.167 2.144 2.187 . 0 0 "[ . 1 . 2 .]" 1
946 1 51 ASN H 1 51 ASN HB2 3.000 . 3.500 2.364 2.109 2.743 . 0 0 "[ . 1 . 2 .]" 1
947 1 51 ASN H 1 51 ASN HB3 3.000 . 3.500 3.264 2.426 3.589 0.089 12 0 "[ . 1 . 2 .]" 1
948 1 51 ASN HA 1 52 VAL H 2.500 . 2.900 2.178 2.147 2.224 . 0 0 "[ . 1 . 2 .]" 1
949 1 51 ASN HB2 1 52 VAL H 4.000 . 5.000 4.503 4.369 4.661 . 0 0 "[ . 1 . 2 .]" 1
950 1 51 ASN HB3 1 53 ALA H 4.000 . 6.000 3.239 2.631 4.402 . 0 0 "[ . 1 . 2 .]" 1
951 1 51 ASN HB2 1 53 ALA H 4.000 . 5.000 4.402 3.542 4.934 . 0 0 "[ . 1 . 2 .]" 1
952 1 51 ASN HB2 1 54 ASP H 4.000 . 5.000 3.671 2.997 4.631 . 0 0 "[ . 1 . 2 .]" 1
953 1 52 VAL H 1 52 VAL MG2 2.500 . 3.400 2.158 1.871 2.355 . 0 0 "[ . 1 . 2 .]" 1
954 1 52 VAL H 1 52 VAL HB 4.000 . 5.000 3.587 3.564 3.605 . 0 0 "[ . 1 . 2 .]" 1
955 1 52 VAL H 1 52 VAL MG1 2.500 . 3.400 2.055 1.846 2.331 . 0 0 "[ . 1 . 2 .]" 1
956 1 52 VAL H 1 53 ALA MB 4.000 . 5.500 4.323 4.214 4.415 . 0 0 "[ . 1 . 2 .]" 1
957 1 52 VAL HB 1 53 ALA H 4.000 . 5.000 3.983 3.768 4.208 . 0 0 "[ . 1 . 2 .]" 1
958 1 52 VAL MG1 1 53 ALA H 4.000 . 5.500 3.934 3.763 4.042 . 0 0 "[ . 1 . 2 .]" 1
959 1 52 VAL MG2 1 53 ALA H 2.500 . 3.400 2.108 1.831 2.495 . 0 0 "[ . 1 . 2 .]" 1
960 1 52 VAL HA 1 53 ALA H 4.000 . 5.000 3.462 3.390 3.517 . 0 0 "[ . 1 . 2 .]" 1
961 1 52 VAL HA 1 55 GLN H 4.000 . 5.000 3.187 3.003 3.441 . 0 0 "[ . 1 . 2 .]" 1
962 1 53 ALA H 1 53 ALA MB 2.500 . 3.400 2.141 2.035 2.252 . 0 0 "[ . 1 . 2 .]" 1
963 1 53 ALA HA 1 54 ASP H 4.000 . 5.000 3.443 3.376 3.512 . 0 0 "[ . 1 . 2 .]" 1
964 1 53 ALA MB 1 54 ASP H 3.000 . 4.000 2.974 2.683 3.185 . 0 0 "[ . 1 . 2 .]" 1
965 1 53 ALA MB 1 55 GLN H 4.000 . 5.500 4.666 4.425 5.072 . 0 0 "[ . 1 . 2 .]" 1
966 1 54 ASP H 1 54 ASP QB 2.500 . 3.400 2.394 2.362 2.506 . 0 0 "[ . 1 . 2 .]" 1
967 1 54 ASP HA 1 55 GLN H 4.000 . 6.000 3.504 3.436 3.583 . 0 0 "[ . 1 . 2 .]" 1
968 1 54 ASP QB 1 55 GLN H 4.000 . 5.500 2.802 2.407 3.044 . 0 0 "[ . 1 . 2 .]" 1
969 1 55 GLN H 1 55 GLN HB3 4.000 . 5.000 3.265 2.989 3.478 . 0 0 "[ . 1 . 2 .]" 1
970 1 55 GLN H 1 55 GLN QG 4.000 . 5.500 2.433 1.972 3.591 . 0 0 "[ . 1 . 2 .]" 1
971 1 55 GLN H 1 56 PRO HD3 4.000 . 5.000 2.878 2.548 3.214 . 0 0 "[ . 1 . 2 .]" 1
972 1 55 GLN H 1 56 PRO HD2 4.000 . 6.000 4.304 4.011 4.623 . 0 0 "[ . 1 . 2 .]" 1
973 1 56 PRO HA 1 59 VAL H 4.000 . 6.000 3.354 3.242 3.504 . 0 0 "[ . 1 . 2 .]" 1
974 1 57 GLN H 1 57 GLN HB3 3.000 . 3.500 2.446 2.285 2.648 . 0 0 "[ . 1 . 2 .]" 1
975 1 57 GLN HA 1 58 LEU H 4.000 . 5.000 3.593 3.577 3.617 . 0 0 "[ . 1 . 2 .]" 1
976 1 57 GLN HB3 1 58 LEU H 4.000 . 5.000 2.540 2.342 2.691 . 0 0 "[ . 1 . 2 .]" 1
977 1 57 GLN HG2 1 58 LEU H 4.000 . 6.000 3.423 2.913 3.883 . 0 0 "[ . 1 . 2 .]" 1
978 1 58 LEU H 1 58 LEU MD2 4.000 . 5.500 3.297 2.150 3.578 . 0 0 "[ . 1 . 2 .]" 1
979 1 58 LEU H 1 58 LEU MD1 4.000 . 5.500 2.928 1.753 3.993 0.047 4 0 "[ . 1 . 2 .]" 1
980 1 58 LEU H 1 58 LEU HB2 3.000 . 3.500 3.544 3.517 3.595 0.095 18 0 "[ . 1 . 2 .]" 1
981 1 58 LEU H 1 58 LEU HG 4.000 . 5.000 2.116 1.636 2.750 0.164 18 0 "[ . 1 . 2 .]" 1
982 1 58 LEU H 1 59 VAL MG2 4.000 . 5.500 3.618 3.384 4.157 . 0 0 "[ . 1 . 2 .]" 1
983 1 58 LEU HB2 1 59 VAL H 4.000 . 5.000 3.954 3.736 4.251 . 0 0 "[ . 1 . 2 .]" 1
984 1 58 LEU HA 1 61 TYR H 4.000 . 5.000 3.013 2.800 3.170 . 0 0 "[ . 1 . 2 .]" 1
985 1 59 VAL H 1 59 VAL MG1 4.000 . 5.500 3.730 3.678 3.748 . 0 0 "[ . 1 . 2 .]" 1
986 1 59 VAL H 1 59 VAL MG2 2.500 . 3.400 2.013 1.777 2.527 0.023 11 0 "[ . 1 . 2 .]" 1
987 1 59 VAL H 1 59 VAL HB 3.000 . 3.500 2.531 2.285 2.667 . 0 0 "[ . 1 . 2 .]" 1
988 1 59 VAL HB 1 60 GLU H 4.000 . 5.000 2.469 2.379 2.599 . 0 0 "[ . 1 . 2 .]" 1
989 1 59 VAL HA 1 62 TYR H 4.000 . 6.000 3.672 3.519 3.772 . 0 0 "[ . 1 . 2 .]" 1
990 1 59 VAL MG1 1 65 VAL H 3.000 . 4.000 4.024 3.915 4.101 0.101 18 0 "[ . 1 . 2 .]" 1
991 1 60 GLU H 1 60 GLU QB 2.500 . 3.400 2.387 2.310 2.428 . 0 0 "[ . 1 . 2 .]" 1
992 1 60 GLU H 1 60 GLU HG2 4.000 . 5.000 3.423 2.465 3.585 . 0 0 "[ . 1 . 2 .]" 1
993 1 60 GLU HG2 1 61 TYR H 4.000 . 5.000 4.979 4.470 5.032 0.032 12 0 "[ . 1 . 2 .]" 1
994 1 60 GLU QB 1 61 TYR H 3.000 . 4.000 2.719 2.648 2.805 . 0 0 "[ . 1 . 2 .]" 1
995 1 60 GLU HA 1 63 ARG H 4.000 . 5.000 3.411 3.159 3.523 . 0 0 "[ . 1 . 2 .]" 1
996 1 61 TYR H 1 61 TYR QD 4.000 . 5.000 4.171 4.145 4.183 . 0 0 "[ . 1 . 2 .]" 1
997 1 61 TYR H 1 61 TYR HB3 3.000 . 3.500 2.569 2.465 2.700 . 0 0 "[ . 1 . 2 .]" 1
998 1 61 TYR H 1 61 TYR HB2 3.000 . 3.500 2.506 2.392 2.587 . 0 0 "[ . 1 . 2 .]" 1
999 1 61 TYR HB3 1 62 TYR H 4.000 . 5.000 2.543 2.482 2.594 . 0 0 "[ . 1 . 2 .]" 1
1000 1 61 TYR HB2 1 62 TYR H 4.000 . 5.000 3.833 3.756 3.890 . 0 0 "[ . 1 . 2 .]" 1
1001 1 62 TYR H 1 62 TYR HB2 3.000 . 3.500 2.347 2.312 2.388 . 0 0 "[ . 1 . 2 .]" 1
1002 1 63 ARG H 1 63 ARG QD 4.000 . 5.500 4.148 2.861 4.798 . 0 0 "[ . 1 . 2 .]" 1
1003 1 63 ARG H 1 63 ARG HB3 4.000 . 5.000 4.070 3.999 4.109 . 0 0 "[ . 1 . 2 .]" 1
1004 1 63 ARG H 1 63 ARG QG 3.000 . 4.000 2.698 2.476 2.842 . 0 0 "[ . 1 . 2 .]" 1
1005 1 63 ARG HA 1 64 LEU H 3.000 . 3.500 3.167 3.101 3.214 . 0 0 "[ . 1 . 2 .]" 1
1006 1 64 LEU H 1 64 LEU MD2 4.000 . 5.500 3.650 3.556 3.729 . 0 0 "[ . 1 . 2 .]" 1
1007 1 64 LEU H 1 64 LEU MD1 4.000 . 5.500 4.136 4.072 4.210 . 0 0 "[ . 1 . 2 .]" 1
1008 1 64 LEU H 1 64 LEU HB3 4.000 . 5.000 2.706 2.603 2.760 . 0 0 "[ . 1 . 2 .]" 1
1009 1 64 LEU H 1 64 LEU HG 4.000 . 5.000 4.524 4.488 4.557 . 0 0 "[ . 1 . 2 .]" 1
1010 1 64 LEU H 1 64 LEU HB2 4.000 . 6.000 2.247 2.204 2.296 . 0 0 "[ . 1 . 2 .]" 1
1011 1 64 LEU MD2 1 65 VAL H 3.000 . 4.000 2.881 2.445 4.005 0.005 21 0 "[ . 1 . 2 .]" 1
1012 1 64 LEU HA 1 65 VAL H 3.000 . 3.500 2.256 2.172 2.579 . 0 0 "[ . 1 . 2 .]" 1
1013 1 64 LEU MD2 1 66 VAL H 4.000 . 6.500 2.963 2.660 3.428 . 0 0 "[ . 1 . 2 .]" 1
1014 1 64 LEU HA 1 66 VAL H 4.000 . 5.000 3.509 2.968 3.705 . 0 0 "[ . 1 . 2 .]" 1
1015 1 64 LEU HB3 1 66 VAL H 4.000 . 5.000 4.929 4.616 5.061 0.061 18 0 "[ . 1 . 2 .]" 1
1016 1 65 VAL H 1 65 VAL MG2 2.500 . 3.400 2.542 2.038 3.068 . 0 0 "[ . 1 . 2 .]" 1
1017 1 65 VAL H 1 65 VAL HB 4.000 . 5.000 2.976 2.690 3.219 . 0 0 "[ . 1 . 2 .]" 1
1018 1 65 VAL HB 1 66 VAL H 3.000 . 3.500 3.456 3.353 3.596 0.096 14 0 "[ . 1 . 2 .]" 1
1019 1 65 VAL MG2 1 66 VAL H 3.000 . 4.500 3.828 3.427 4.154 . 0 0 "[ . 1 . 2 .]" 1
1020 1 65 VAL HA 1 66 VAL H 3.000 . 3.500 3.359 3.265 3.417 . 0 0 "[ . 1 . 2 .]" 1
1021 1 66 VAL H 1 66 VAL QG 2.500 . 3.400 1.957 1.851 2.048 . 0 0 "[ . 1 . 2 .]" 1
1022 1 66 VAL H 1 66 VAL HB 3.000 . 3.500 3.654 3.610 3.715 0.215 21 0 "[ . 1 . 2 .]" 1
1023 1 66 VAL HA 1 67 THR H 2.500 . 2.900 2.207 2.175 2.244 . 0 0 "[ . 1 . 2 .]" 1
1024 1 66 VAL HB 1 67 THR H 3.000 . 3.500 2.970 2.852 3.121 . 0 0 "[ . 1 . 2 .]" 1
1025 1 67 THR H 1 67 THR MG 3.000 . 4.000 3.155 3.022 3.319 . 0 0 "[ . 1 . 2 .]" 1
1026 1 67 THR H 1 67 THR HB 4.000 . 5.000 3.801 3.755 3.844 . 0 0 "[ . 1 . 2 .]" 1
1027 1 67 THR MG 1 69 ALA H 4.000 . 5.500 3.580 3.180 4.018 . 0 0 "[ . 1 . 2 .]" 1
1028 1 67 THR HB 1 69 ALA H 4.000 . 5.000 4.196 4.031 4.506 . 0 0 "[ . 1 . 2 .]" 1
1029 1 67 THR HA 1 69 ALA H 3.000 . 3.500 3.195 3.010 3.400 . 0 0 "[ . 1 . 2 .]" 1
1030 1 68 PRO HA 1 69 ALA H 2.500 . 2.900 2.342 2.262 2.432 . 0 0 "[ . 1 . 2 .]" 1
1031 1 68 PRO HB2 1 69 ALA H 4.000 . 5.000 3.063 2.853 3.216 . 0 0 "[ . 1 . 2 .]" 1
1032 1 68 PRO HB3 1 69 ALA H 4.000 . 5.000 3.239 3.131 3.329 . 0 0 "[ . 1 . 2 .]" 1
1033 1 69 ALA H 1 69 ALA MB 3.000 . 4.000 2.634 2.587 2.694 . 0 0 "[ . 1 . 2 .]" 1
1034 1 69 ALA MB 1 70 LEU H 3.000 . 4.000 2.719 2.535 2.928 . 0 0 "[ . 1 . 2 .]" 1
1035 1 69 ALA HA 1 70 LEU H 3.000 . 3.500 2.274 2.196 2.374 . 0 0 "[ . 1 . 2 .]" 1
1036 1 70 LEU H 1 70 LEU HB2 4.000 . 5.000 2.880 2.772 2.973 . 0 0 "[ . 1 . 2 .]" 1
1037 1 70 LEU H 1 70 LEU HB3 4.000 . 5.000 2.799 2.731 2.863 . 0 0 "[ . 1 . 2 .]" 1
1038 1 70 LEU HA 1 71 VAL H 3.000 . 3.500 2.195 2.171 2.219 . 0 0 "[ . 1 . 2 .]" 1
1039 1 70 LEU MD2 1 71 VAL H 4.000 . 5.500 2.144 2.023 2.629 . 0 0 "[ . 1 . 2 .]" 1
1040 1 70 LEU H 1 86 LEU QD 3.000 . 4.000 2.001 1.765 2.462 0.035 8 0 "[ . 1 . 2 .]" 1
1041 1 71 VAL H 1 71 VAL MG2 4.000 . 5.500 2.773 2.619 2.919 . 0 0 "[ . 1 . 2 .]" 1
1042 1 71 VAL MG1 1 72 LYS H 3.000 . 4.000 2.558 2.385 2.670 . 0 0 "[ . 1 . 2 .]" 1
1043 1 71 VAL HA 1 72 LYS H 3.000 . 3.500 2.131 2.114 2.159 . 0 0 "[ . 1 . 2 .]" 1
1044 1 72 LYS H 1 72 LYS HB3 3.000 . 3.500 2.602 2.499 2.742 . 0 0 "[ . 1 . 2 .]" 1
1045 1 72 LYS HA 1 73 ILE H 3.000 . 3.500 2.189 2.175 2.205 . 0 0 "[ . 1 . 2 .]" 1
1046 1 72 LYS HG3 1 74 GLY H 4.000 . 5.500 3.713 3.277 4.156 . 0 0 "[ . 1 . 2 .]" 1
1047 1 72 LYS H 1 80 VAL QG 4.000 . 5.500 4.030 3.463 4.287 . 0 0 "[ . 1 . 2 .]" 1
1048 1 73 ILE H 1 73 ILE MD 4.000 . 5.500 2.094 1.873 2.264 . 0 0 "[ . 1 . 2 .]" 1
1049 1 73 ILE H 1 73 ILE MG 3.000 . 4.000 3.168 3.009 3.255 . 0 0 "[ . 1 . 2 .]" 1
1050 1 73 ILE H 1 73 ILE HG12 4.000 . 5.000 1.766 1.703 2.028 0.097 2 0 "[ . 1 . 2 .]" 1
1051 1 73 ILE H 1 73 ILE HB 4.000 . 5.000 3.532 3.514 3.580 . 0 0 "[ . 1 . 2 .]" 1
1052 1 73 ILE HB 1 74 GLY H 4.000 . 5.000 3.755 3.663 3.942 . 0 0 "[ . 1 . 2 .]" 1
1053 1 73 ILE MD 1 74 GLY H 4.000 . 5.500 3.814 3.609 3.967 . 0 0 "[ . 1 . 2 .]" 1
1054 1 77 SER HB2 1 78 ARG H 3.000 . 3.500 3.575 3.536 3.625 0.125 5 0 "[ . 1 . 2 .]" 1
1055 1 77 SER HA 1 78 ARG H 3.000 . 3.500 2.323 2.263 2.436 . 0 0 "[ . 1 . 2 .]" 1
1056 1 78 ARG H 1 78 ARG HB3 4.000 . 5.000 2.545 2.440 2.628 . 0 0 "[ . 1 . 2 .]" 1
1057 1 78 ARG H 1 78 ARG HG3 4.000 . 5.000 4.520 4.450 4.602 . 0 0 "[ . 1 . 2 .]" 1
1058 1 78 ARG HA 1 79 GLN H 2.500 . 2.900 2.228 2.174 2.289 . 0 0 "[ . 1 . 2 .]" 1
1059 1 79 GLN H 1 79 GLN QG 4.000 . 5.500 3.002 2.812 3.179 . 0 0 "[ . 1 . 2 .]" 1
1060 1 79 GLN HA 1 80 VAL H 2.500 . 2.900 2.290 2.241 2.351 . 0 0 "[ . 1 . 2 .]" 1
1061 1 79 GLN QG 1 80 VAL H 4.000 . 5.500 4.062 3.783 4.544 . 0 0 "[ . 1 . 2 .]" 1
1062 1 80 VAL H 1 80 VAL QG 2.500 . 3.400 2.708 2.492 2.857 . 0 0 "[ . 1 . 2 .]" 1
1063 1 80 VAL H 1 80 VAL HB 3.000 . 3.500 2.671 2.563 2.721 . 0 0 "[ . 1 . 2 .]" 1
1064 1 80 VAL QG 1 81 LEU H 3.000 . 4.000 2.549 2.330 2.896 . 0 0 "[ . 1 . 2 .]" 1
1065 1 80 VAL HA 1 81 LEU H 3.000 . 3.500 2.145 2.125 2.163 . 0 0 "[ . 1 . 2 .]" 1
1066 1 80 VAL QG 1 82 SER H 4.000 . 5.500 4.209 4.031 4.374 . 0 0 "[ . 1 . 2 .]" 1
1067 1 81 LEU H 1 81 LEU MD1 4.000 . 5.500 3.758 3.608 3.887 . 0 0 "[ . 1 . 2 .]" 1
1068 1 81 LEU H 1 81 LEU HG 4.000 . 5.000 2.388 2.277 2.645 . 0 0 "[ . 1 . 2 .]" 1
1069 1 81 LEU MD2 1 82 SER H 3.000 . 4.000 3.864 3.598 3.999 . 0 0 "[ . 1 . 2 .]" 1
1070 1 81 LEU HG 1 82 SER H 4.000 . 6.000 5.171 5.056 5.266 . 0 0 "[ . 1 . 2 .]" 1
1071 1 81 LEU HB2 1 82 SER H 4.000 . 5.000 4.049 3.963 4.114 . 0 0 "[ . 1 . 2 .]" 1
1072 1 81 LEU HB3 1 82 SER H 4.000 . 5.000 3.361 3.274 3.483 . 0 0 "[ . 1 . 2 .]" 1
1073 1 81 LEU HA 1 82 SER H 2.500 . 2.900 2.198 2.171 2.220 . 0 0 "[ . 1 . 2 .]" 1
1074 1 81 LEU MD1 1 90 LEU H 3.000 . 4.000 3.014 2.708 3.430 . 0 0 "[ . 1 . 2 .]" 1
1075 1 81 LEU MD2 1 90 LEU H 3.000 . 4.000 4.045 3.809 4.164 0.164 10 0 "[ . 1 . 2 .]" 1
1076 1 82 SER H 1 82 SER HB3 3.000 . 3.500 2.944 2.900 2.982 . 0 0 "[ . 1 . 2 .]" 1
1077 1 82 SER HB3 1 83 GLY H 3.000 . 3.500 3.493 3.254 3.563 0.063 14 0 "[ . 1 . 2 .]" 1
1078 1 82 SER HA 1 83 GLY H 2.500 . 2.900 2.401 2.346 2.522 . 0 0 "[ . 1 . 2 .]" 1
1079 1 82 SER H 1 86 LEU QD 4.000 . 5.500 3.717 2.766 4.480 . 0 0 "[ . 1 . 2 .]" 1
1080 1 83 GLY HA2 1 84 ILE H 3.000 . 3.500 2.642 2.525 2.748 . 0 0 "[ . 1 . 2 .]" 1
1081 1 83 GLY HA3 1 84 ILE H 3.000 . 3.500 3.551 3.539 3.560 0.060 6 0 "[ . 1 . 2 .]" 1
1082 1 83 GLY H 1 86 LEU QD 4.000 . 5.500 3.105 2.525 3.619 . 0 0 "[ . 1 . 2 .]" 1
1083 1 84 ILE H 1 84 ILE HG12 4.000 . 5.000 3.546 3.385 3.642 . 0 0 "[ . 1 . 2 .]" 1
1084 1 84 ILE H 1 84 ILE MG 3.000 . 4.000 2.278 2.126 2.398 . 0 0 "[ . 1 . 2 .]" 1
1085 1 84 ILE H 1 84 ILE HB 4.000 . 5.000 3.908 3.885 3.952 . 0 0 "[ . 1 . 2 .]" 1
1086 1 84 ILE HG13 1 85 ASP H 3.000 . 3.500 3.408 3.265 3.524 0.024 3 0 "[ . 1 . 2 .]" 1
1087 1 84 ILE HA 1 85 ASP H 3.000 . 3.500 3.230 3.199 3.277 . 0 0 "[ . 1 . 2 .]" 1
1088 1 84 ILE MG 1 85 ASP H 3.000 . 4.000 4.063 4.028 4.108 0.108 6 0 "[ . 1 . 2 .]" 1
1089 1 84 ILE HB 1 85 ASP H 4.000 . 5.000 4.437 4.363 4.478 . 0 0 "[ . 1 . 2 .]" 1
1090 1 84 ILE HA 1 86 LEU H 4.000 . 5.000 3.260 3.103 3.437 . 0 0 "[ . 1 . 2 .]" 1
1091 1 85 ASP H 1 85 ASP HB3 3.000 . 3.500 2.795 2.677 2.876 . 0 0 "[ . 1 . 2 .]" 1
1092 1 85 ASP H 1 85 ASP HB2 4.000 . 5.000 3.686 3.661 3.710 . 0 0 "[ . 1 . 2 .]" 1
1093 1 85 ASP HA 1 86 LEU H 3.000 . 3.500 3.149 3.116 3.202 . 0 0 "[ . 1 . 2 .]" 1
1094 1 85 ASP H 1 86 LEU HB2 4.000 . 6.000 4.934 4.621 5.082 . 0 0 "[ . 1 . 2 .]" 1
1095 1 86 LEU H 1 86 LEU HG 3.000 . 3.500 2.335 1.763 3.380 0.037 14 0 "[ . 1 . 2 .]" 1
1096 1 86 LEU H 1 86 LEU QD 3.000 . 4.000 2.060 1.698 2.840 0.102 5 0 "[ . 1 . 2 .]" 1
1097 1 86 LEU H 1 86 LEU HB3 3.000 . 3.500 3.554 3.529 3.571 0.071 3 0 "[ . 1 . 2 .]" 1
1098 1 86 LEU H 1 86 LEU HB2 3.000 . 3.500 2.636 2.369 2.844 . 0 0 "[ . 1 . 2 .]" 1
1099 1 86 LEU HB3 1 87 THR H 4.000 . 6.000 3.607 3.331 3.925 . 0 0 "[ . 1 . 2 .]" 1
1100 1 86 LEU HB2 1 87 THR H 4.000 . 5.000 2.467 2.353 2.652 . 0 0 "[ . 1 . 2 .]" 1
1101 1 86 LEU HA 1 87 THR H 4.000 . 5.000 3.569 3.550 3.583 . 0 0 "[ . 1 . 2 .]" 1
1102 1 86 LEU QD 1 87 THR H 4.000 . 5.500 3.453 2.838 4.028 . 0 0 "[ . 1 . 2 .]" 1
1103 1 87 THR H 1 87 THR MG 2.500 . 3.400 2.042 1.798 2.268 0.002 21 0 "[ . 1 . 2 .]" 1
1104 1 87 THR MG 1 88 ASP H 4.000 . 5.500 3.822 3.687 3.933 . 0 0 "[ . 1 . 2 .]" 1
1105 1 87 THR HA 1 89 GLN H 4.000 . 6.000 4.656 4.540 4.736 . 0 0 "[ . 1 . 2 .]" 1
1106 1 88 ASP H 1 88 ASP HB3 3.000 . 3.500 3.573 3.567 3.577 0.077 23 0 "[ . 1 . 2 .]" 1
1107 1 88 ASP HA 1 89 GLN H 4.000 . 5.000 3.543 3.506 3.557 . 0 0 "[ . 1 . 2 .]" 1
1108 1 88 ASP HB2 1 89 GLN H 3.000 . 3.500 2.456 2.372 2.590 . 0 0 "[ . 1 . 2 .]" 1
1109 1 88 ASP HA 1 91 ALA H 4.000 . 5.000 3.814 3.608 3.916 . 0 0 "[ . 1 . 2 .]" 1
1110 1 89 GLN H 1 89 GLN HB3 3.000 . 3.500 3.024 2.841 3.515 0.015 15 0 "[ . 1 . 2 .]" 1
1111 1 89 GLN H 1 89 GLN QG 3.000 . 4.000 3.636 2.335 3.851 . 0 0 "[ . 1 . 2 .]" 1
1112 1 89 GLN QG 1 90 LEU H 4.000 . 5.500 4.171 4.007 4.393 . 0 0 "[ . 1 . 2 .]" 1
1113 1 90 LEU H 1 90 LEU HB2 4.000 . 5.000 2.538 2.496 2.586 . 0 0 "[ . 1 . 2 .]" 1
1114 1 90 LEU H 1 90 LEU MD2 4.000 . 5.500 4.253 3.930 4.295 . 0 0 "[ . 1 . 2 .]" 1
1115 1 90 LEU H 1 90 LEU HB3 4.000 . 5.000 2.533 2.498 2.579 . 0 0 "[ . 1 . 2 .]" 1
1116 1 90 LEU HB3 1 91 ALA H 4.000 . 5.000 2.437 2.202 2.506 . 0 0 "[ . 1 . 2 .]" 1
1117 1 90 LEU HB2 1 91 ALA H 4.000 . 5.000 3.808 3.648 3.853 . 0 0 "[ . 1 . 2 .]" 1
1118 1 91 ALA H 1 91 ALA MB 2.500 . 3.400 2.187 2.031 2.241 . 0 0 "[ . 1 . 2 .]" 1
1119 1 91 ALA MB 1 92 ASN H 3.000 . 4.000 2.664 2.531 2.814 . 0 0 "[ . 1 . 2 .]" 1
1120 1 91 ALA HA 1 92 ASN H 4.000 . 5.000 3.514 3.478 3.543 . 0 0 "[ . 1 . 2 .]" 1
1121 1 92 ASN H 1 92 ASN HB2 2.500 . 2.900 2.315 2.244 2.378 . 0 0 "[ . 1 . 2 .]" 1
1122 1 92 ASN HA 1 93 GLN H 4.000 . 5.000 3.518 3.506 3.542 . 0 0 "[ . 1 . 2 .]" 1
1123 1 92 ASN HB3 1 93 GLN H 3.000 . 3.500 3.579 3.539 3.599 0.099 25 0 "[ . 1 . 2 .]" 1
1124 1 92 ASN HA 1 94 LEU H 4.000 . 6.000 4.506 4.302 4.699 . 0 0 "[ . 1 . 2 .]" 1
1125 1 93 GLN H 1 93 GLN HB2 3.000 . 3.500 2.379 2.328 2.562 . 0 0 "[ . 1 . 2 .]" 1
1126 1 93 GLN H 1 93 GLN HG3 4.000 . 5.000 3.662 3.192 3.797 . 0 0 "[ . 1 . 2 .]" 1
1127 1 93 GLN H 1 93 GLN HG2 3.000 . 3.500 2.366 2.248 2.470 . 0 0 "[ . 1 . 2 .]" 1
1128 1 93 GLN HB2 1 94 LEU H 4.000 . 5.000 2.758 2.612 2.902 . 0 0 "[ . 1 . 2 .]" 1
1129 1 93 GLN HA 1 94 LEU H 4.000 . 5.000 3.525 3.502 3.547 . 0 0 "[ . 1 . 2 .]" 1
1130 1 93 GLN H 1 95 PRO HD2 4.000 . 5.000 3.504 3.402 3.623 . 0 0 "[ . 1 . 2 .]" 1
1131 1 93 GLN HB3 1 97 TRP HE1 4.000 . 5.000 2.080 1.851 2.356 . 0 0 "[ . 1 . 2 .]" 1
1132 1 94 LEU H 1 94 LEU HG 4.000 . 5.000 4.310 4.250 4.353 . 0 0 "[ . 1 . 2 .]" 1
1133 1 94 LEU H 1 94 LEU HB3 3.000 . 3.500 2.356 2.290 2.414 . 0 0 "[ . 1 . 2 .]" 1
1134 1 94 LEU H 1 94 LEU HB2 3.000 . 3.500 2.716 2.678 2.756 . 0 0 "[ . 1 . 2 .]" 1
1135 1 94 LEU H 1 95 PRO HD3 3.000 . 3.500 3.517 3.464 3.547 0.047 14 0 "[ . 1 . 2 .]" 1
1136 1 94 LEU H 1 95 PRO HD2 4.000 . 5.000 2.195 2.173 2.216 . 0 0 "[ . 1 . 2 .]" 1
1137 1 94 LEU HA 1 98 LEU H 4.000 . 6.000 4.533 4.263 4.994 . 0 0 "[ . 1 . 2 .]" 1
1138 1 95 PRO HA 1 96 GLN H 4.000 . 5.000 3.558 3.545 3.578 . 0 0 "[ . 1 . 2 .]" 1
1139 1 95 PRO HD3 1 96 GLN H 4.000 . 5.000 4.190 4.127 4.255 . 0 0 "[ . 1 . 2 .]" 1
1140 1 96 GLN H 1 96 GLN QB 2.500 . 3.400 2.433 2.403 2.455 . 0 0 "[ . 1 . 2 .]" 1
1141 1 96 GLN H 1 96 GLN QG 3.000 . 4.000 2.072 2.015 2.183 . 0 0 "[ . 1 . 2 .]" 1
1142 1 96 GLN QB 1 97 TRP H 3.000 . 4.000 2.668 2.581 2.721 . 0 0 "[ . 1 . 2 .]" 1
1143 1 96 GLN QG 1 97 TRP H 3.000 . 4.000 4.039 4.015 4.069 0.069 7 0 "[ . 1 . 2 .]" 1
1144 1 96 GLN HA 1 99 VAL H 4.000 . 5.000 3.307 2.983 3.530 . 0 0 "[ . 1 . 2 .]" 1
1145 1 97 TRP HA 1 97 TRP HE1 4.000 . 5.000 4.665 4.595 4.748 . 0 0 "[ . 1 . 2 .]" 1
1146 1 97 TRP H 1 97 TRP HB3 4.000 . 5.000 3.592 3.580 3.607 . 0 0 "[ . 1 . 2 .]" 1
1147 1 97 TRP H 1 97 TRP HB2 3.000 . 3.500 2.549 2.506 2.612 . 0 0 "[ . 1 . 2 .]" 1
1148 1 97 TRP H 1 97 TRP HD1 4.000 . 5.000 2.576 2.419 2.772 . 0 0 "[ . 1 . 2 .]" 1
1149 1 98 LEU H 1 98 LEU HG 3.000 . 3.500 2.129 1.896 2.396 . 0 0 "[ . 1 . 2 .]" 1
1150 1 98 LEU H 1 98 LEU MD2 4.000 . 5.500 3.197 2.683 3.705 . 0 0 "[ . 1 . 2 .]" 1
1151 1 98 LEU H 1 98 LEU HB2 3.000 . 3.500 2.482 2.363 2.588 . 0 0 "[ . 1 . 2 .]" 1
1152 1 98 LEU H 1 98 LEU HB3 3.000 . 3.500 3.576 3.559 3.613 0.113 18 0 "[ . 1 . 2 .]" 1
1153 1 98 LEU HA 1 99 VAL H 3.000 . 3.500 3.504 3.374 3.549 0.049 5 0 "[ . 1 . 2 .]" 1
1154 1 98 LEU HB2 1 99 VAL H 4.000 . 5.000 2.680 2.526 3.223 . 0 0 "[ . 1 . 2 .]" 1
1155 1 98 LEU HB3 1 99 VAL H 4.000 . 5.000 3.767 3.498 4.182 . 0 0 "[ . 1 . 2 .]" 1
1156 1 98 LEU H 1 99 VAL MG2 4.000 . 5.500 3.991 3.529 4.211 . 0 0 "[ . 1 . 2 .]" 1
1157 1 99 VAL H 1 99 VAL QG 2.500 . 3.400 2.275 2.083 2.564 . 0 0 "[ . 1 . 2 .]" 1
1158 1 99 VAL H 1 99 VAL HB 2.500 . 2.900 2.447 2.360 2.577 . 0 0 "[ . 1 . 2 .]" 1
1159 1 99 VAL HB 1 100 GLN H 4.000 . 5.000 2.887 2.399 4.116 . 0 0 "[ . 1 . 2 .]" 1
1160 1 99 VAL HA 1 100 GLN H 3.000 . 3.500 3.445 2.939 3.569 0.069 15 0 "[ . 1 . 2 .]" 1
1161 1 99 VAL MG2 1 100 GLN H 4.000 . 5.500 3.958 3.820 4.259 . 0 0 "[ . 1 . 2 .]" 1
1162 1 100 GLN H 1 100 GLN QB 2.500 . 3.400 3.062 2.377 3.363 . 0 0 "[ . 1 . 2 .]" 1
1163 1 100 GLN H 1 100 GLN QG 3.000 . 4.000 2.467 1.858 2.791 . 0 0 "[ . 1 . 2 .]" 1
1164 1 100 GLN HA 1 101 GLN H 2.500 . 2.900 2.593 2.153 3.025 0.125 22 0 "[ . 1 . 2 .]" 1
1165 1 101 GLN H 1 101 GLN HB2 3.000 . 3.500 2.805 2.434 3.525 0.025 18 0 "[ . 1 . 2 .]" 1
1166 1 101 GLN H 1 101 GLN QG 2.500 . 3.400 2.589 1.862 3.248 . 0 0 "[ . 1 . 2 .]" 1
1167 1 10 ALA H 1 43 VAL MG1 4.000 . 5.500 4.801 3.456 5.522 0.022 24 0 "[ . 1 . 2 .]" 1
1168 1 11 GLN H 1 11 GLN HB2 3.000 . 3.500 2.571 2.263 2.842 . 0 0 "[ . 1 . 2 .]" 1
1169 1 11 GLN H 1 11 GLN QG 3.000 . 4.000 2.313 1.825 3.427 . 0 0 "[ . 1 . 2 .]" 1
1170 1 11 GLN HE21 1 14 LEU MD2 4.000 . 5.500 5.109 4.397 5.497 . 0 0 "[ . 1 . 2 .]" 1
1171 1 11 GLN H 1 43 VAL MG1 4.000 . 5.500 5.216 3.865 5.535 0.035 24 0 "[ . 1 . 2 .]" 1
1172 1 11 GLN H 1 75 PRO HB3 4.000 . 6.000 5.582 4.831 6.048 0.048 19 0 "[ . 1 . 2 .]" 1
1173 1 12 PRO HB3 1 13 LEU H 4.000 . 5.000 3.239 3.042 3.401 . 0 0 "[ . 1 . 2 .]" 1
1174 1 12 PRO HB3 1 46 SER H 4.000 . 5.000 4.798 4.302 5.019 0.019 23 0 "[ . 1 . 2 .]" 1
1175 1 13 LEU H 1 13 LEU MD2 3.000 . 4.000 4.070 4.040 4.105 0.105 1 0 "[ . 1 . 2 .]" 1
1176 1 13 LEU HB3 1 14 LEU H 4.000 . 5.000 4.025 3.947 4.123 . 0 0 "[ . 1 . 2 .]" 1
1177 1 13 LEU HB2 1 14 LEU H 4.000 . 5.000 4.334 4.259 4.404 . 0 0 "[ . 1 . 2 .]" 1
1178 1 13 LEU H 1 14 LEU H 4.000 . 6.000 4.549 4.489 4.595 . 0 0 "[ . 1 . 2 .]" 1
1179 1 13 LEU MD1 1 15 LEU H 4.000 . 5.500 5.534 5.439 5.599 0.099 22 0 "[ . 1 . 2 .]" 1
1180 1 13 LEU H 1 45 ILE HA 4.000 . 5.000 2.612 1.985 2.859 . 0 0 "[ . 1 . 2 .]" 1
1181 1 13 LEU MD2 1 46 SER H 3.000 . 4.000 3.448 3.305 3.755 . 0 0 "[ . 1 . 2 .]" 1
1182 1 13 LEU HB3 1 46 SER H 4.000 . 5.000 3.285 3.059 3.531 . 0 0 "[ . 1 . 2 .]" 1
1183 1 13 LEU MD1 1 46 SER H 4.000 . 5.500 4.992 4.874 5.178 . 0 0 "[ . 1 . 2 .]" 1
1184 1 13 LEU HB2 1 46 SER H 4.000 . 5.000 4.784 4.456 4.973 . 0 0 "[ . 1 . 2 .]" 1
1185 1 13 LEU MD2 1 74 GLY H 4.000 . 5.500 3.137 2.915 3.269 . 0 0 "[ . 1 . 2 .]" 1
1186 1 14 LEU H 1 14 LEU HB3 3.000 . 3.500 3.627 3.587 3.644 0.144 22 0 "[ . 1 . 2 .]" 1
1187 1 14 LEU H 1 14 LEU MD2 3.000 . 4.000 2.989 1.912 3.267 . 0 0 "[ . 1 . 2 .]" 1
1188 1 14 LEU H 1 14 LEU MD1 3.000 . 4.000 3.880 3.791 4.009 0.009 8 0 "[ . 1 . 2 .]" 1
1189 1 14 LEU H 1 15 LEU H 4.000 . 6.000 4.296 4.216 4.344 . 0 0 "[ . 1 . 2 .]" 1
1190 1 14 LEU HB2 1 15 LEU H 4.000 . 5.000 4.327 4.283 4.450 . 0 0 "[ . 1 . 2 .]" 1
1191 1 14 LEU HG 1 15 LEU H 4.000 . 6.000 5.260 5.155 5.721 . 0 0 "[ . 1 . 2 .]" 1
1192 1 14 LEU HA 1 46 SER H 3.000 . 3.500 3.455 3.133 3.605 0.105 12 0 "[ . 1 . 2 .]" 1
1193 1 14 LEU MD2 1 46 SER H 4.000 . 5.500 3.686 3.455 3.843 . 0 0 "[ . 1 . 2 .]" 1
1194 1 14 LEU H 1 73 ILE H 4.000 . 6.000 4.764 4.616 4.913 . 0 0 "[ . 1 . 2 .]" 1
1195 1 14 LEU HB2 1 73 ILE H 4.000 . 6.000 3.612 3.434 3.748 . 0 0 "[ . 1 . 2 .]" 1
1196 1 14 LEU H 1 74 GLY H 3.000 . 3.500 3.597 3.540 3.660 0.160 12 0 "[ . 1 . 2 .]" 1
1197 1 14 LEU HB3 1 74 GLY H 4.000 . 5.000 4.602 4.166 4.990 . 0 0 "[ . 1 . 2 .]" 1
1198 1 14 LEU HG 1 74 GLY H 4.000 . 6.000 4.923 4.489 5.347 . 0 0 "[ . 1 . 2 .]" 1
1199 1 14 LEU H 1 75 PRO HD2 4.000 . 5.000 3.444 3.019 4.409 . 0 0 "[ . 1 . 2 .]" 1
1200 1 14 LEU H 1 75 PRO HD3 4.000 . 5.000 2.852 2.390 3.275 . 0 0 "[ . 1 . 2 .]" 1
1201 1 15 LEU H 1 15 LEU HB3 4.000 . 5.000 2.755 2.722 2.813 . 0 0 "[ . 1 . 2 .]" 1
1202 1 15 LEU H 1 15 LEU HB2 4.000 . 5.000 2.859 2.757 2.969 . 0 0 "[ . 1 . 2 .]" 1
1203 1 15 LEU H 1 15 LEU MD1 3.000 . 4.000 4.008 3.949 4.032 0.032 13 0 "[ . 1 . 2 .]" 1
1204 1 15 LEU H 1 16 GLN H 4.000 . 5.000 4.383 4.338 4.423 . 0 0 "[ . 1 . 2 .]" 1
1205 1 15 LEU HB2 1 16 GLN H 4.000 . 5.000 4.375 4.338 4.400 . 0 0 "[ . 1 . 2 .]" 1
1206 1 15 LEU H 1 45 ILE HA 4.000 . 6.000 5.249 4.988 5.456 . 0 0 "[ . 1 . 2 .]" 1
1207 1 15 LEU H 1 45 ILE MG 3.000 . 4.000 3.182 3.117 3.326 . 0 0 "[ . 1 . 2 .]" 1
1208 1 15 LEU H 1 46 SER H 4.000 . 5.000 3.471 3.256 3.667 . 0 0 "[ . 1 . 2 .]" 1
1209 1 15 LEU H 1 46 SER HB3 4.000 . 5.000 3.328 2.976 3.615 . 0 0 "[ . 1 . 2 .]" 1
1210 1 15 LEU H 1 47 LEU HA 4.000 . 5.000 3.625 3.424 4.142 . 0 0 "[ . 1 . 2 .]" 1
1211 1 15 LEU H 1 48 GLN H 4.000 . 5.000 4.291 4.109 4.431 . 0 0 "[ . 1 . 2 .]" 1
1212 1 15 LEU MD1 1 48 GLN H 4.000 . 5.500 3.409 3.228 3.587 . 0 0 "[ . 1 . 2 .]" 1
1213 1 15 LEU H 1 48 GLN HB2 4.000 . 5.000 4.853 4.679 5.055 0.055 16 0 "[ . 1 . 2 .]" 1
1214 1 15 LEU MD2 1 72 LYS H 3.000 . 4.000 3.626 3.349 3.898 . 0 0 "[ . 1 . 2 .]" 1
1215 1 15 LEU HA 1 73 ILE H 4.000 . 5.000 3.341 3.046 3.560 . 0 0 "[ . 1 . 2 .]" 1
1216 1 16 GLN H 1 16 GLN HB2 3.000 . 3.500 2.593 2.535 2.667 . 0 0 "[ . 1 . 2 .]" 1
1217 1 16 GLN HB3 1 17 LEU H 4.000 . 5.000 2.682 2.540 3.214 . 0 0 "[ . 1 . 2 .]" 1
1218 1 16 GLN HB2 1 17 LEU H 4.000 . 5.000 3.948 3.817 4.280 . 0 0 "[ . 1 . 2 .]" 1
1219 1 16 GLN HG2 1 17 LEU H 4.000 . 5.000 3.654 3.524 3.824 . 0 0 "[ . 1 . 2 .]" 1
1220 1 16 GLN HA 1 48 GLN H 4.000 . 5.000 2.291 2.092 2.722 . 0 0 "[ . 1 . 2 .]" 1
1221 1 16 GLN HG2 1 48 GLN H 4.000 . 5.000 3.251 2.828 3.999 . 0 0 "[ . 1 . 2 .]" 1
1222 1 16 GLN H 1 48 GLN H 4.000 . 5.000 4.577 4.380 4.762 . 0 0 "[ . 1 . 2 .]" 1
1223 1 16 GLN HG2 1 49 VAL H 4.000 . 5.000 5.100 5.068 5.158 0.158 6 0 "[ . 1 . 2 .]" 1
1224 1 16 GLN H 1 70 LEU HG 4.000 . 5.000 4.247 4.107 4.473 . 0 0 "[ . 1 . 2 .]" 1
1225 1 16 GLN H 1 71 VAL H 3.000 . 3.500 3.497 3.409 3.541 0.041 22 0 "[ . 1 . 2 .]" 1
1226 1 16 GLN HA 1 71 VAL H 4.000 . 6.000 4.945 4.870 5.045 . 0 0 "[ . 1 . 2 .]" 1
1227 1 16 GLN H 1 71 VAL HA 4.000 . 5.000 5.093 5.061 5.133 0.133 17 0 "[ . 1 . 2 .]" 1
1228 1 16 GLN H 1 72 LYS HA 4.000 . 5.000 3.235 3.079 3.388 . 0 0 "[ . 1 . 2 .]" 1
1229 1 16 GLN H 1 73 ILE H 4.000 . 5.000 4.258 3.979 4.450 . 0 0 "[ . 1 . 2 .]" 1
1230 1 17 LEU H 1 17 LEU HG 4.000 . 6.000 4.400 4.350 4.446 . 0 0 "[ . 1 . 2 .]" 1
1231 1 17 LEU HG 1 18 PHE H 4.000 . 6.000 2.668 2.386 2.920 . 0 0 "[ . 1 . 2 .]" 1
1232 1 17 LEU HB3 1 18 PHE H 4.000 . 6.000 4.173 4.081 4.238 . 0 0 "[ . 1 . 2 .]" 1
1233 1 17 LEU HB2 1 18 PHE H 4.000 . 5.000 4.241 4.169 4.328 . 0 0 "[ . 1 . 2 .]" 1
1234 1 17 LEU H 1 48 GLN H 4.000 . 6.000 3.805 3.418 4.183 . 0 0 "[ . 1 . 2 .]" 1
1235 1 17 LEU H 1 49 VAL HA 4.000 . 5.000 2.502 2.183 2.638 . 0 0 "[ . 1 . 2 .]" 1
1236 1 17 LEU HB2 1 50 ILE H 4.000 . 6.000 5.559 5.316 5.801 . 0 0 "[ . 1 . 2 .]" 1
1237 1 17 LEU HB3 1 50 ILE H 4.000 . 5.000 4.167 3.883 4.425 . 0 0 "[ . 1 . 2 .]" 1
1238 1 17 LEU MD1 1 70 LEU H 4.000 . 5.500 3.457 3.256 3.663 . 0 0 "[ . 1 . 2 .]" 1
1239 1 17 LEU HA 1 71 VAL H 4.000 . 5.000 3.135 3.018 3.274 . 0 0 "[ . 1 . 2 .]" 1
1240 1 18 PHE HB2 1 19 VAL H 4.000 . 5.000 4.381 4.309 4.438 . 0 0 "[ . 1 . 2 .]" 1
1241 1 18 PHE HB3 1 19 VAL H 4.000 . 5.000 3.471 3.354 3.553 . 0 0 "[ . 1 . 2 .]" 1
1242 1 18 PHE QD 1 52 VAL H 4.000 . 5.000 4.053 3.718 4.538 . 0 0 "[ . 1 . 2 .]" 1
1243 1 18 PHE QE 1 58 LEU H 4.000 . 5.000 5.084 4.966 5.186 0.186 3 0 "[ . 1 . 2 .]" 1
1244 1 18 PHE H 1 64 LEU MD1 4.000 . 6.500 5.420 4.543 5.712 . 0 0 "[ . 1 . 2 .]" 1
1245 1 18 PHE H 1 69 ALA H 3.000 . 3.500 3.177 2.824 3.398 . 0 0 "[ . 1 . 2 .]" 1
1246 1 18 PHE QD 1 69 ALA H 4.000 . 5.000 4.752 4.274 5.082 0.082 12 0 "[ . 1 . 2 .]" 1
1247 1 18 PHE H 1 70 LEU HA 4.000 . 5.000 3.049 2.807 3.317 . 0 0 "[ . 1 . 2 .]" 1
1248 1 18 PHE H 1 70 LEU MD2 4.000 . 5.500 5.285 5.036 5.485 . 0 0 "[ . 1 . 2 .]" 1
1249 1 18 PHE H 1 71 VAL H 4.000 . 5.000 4.278 4.008 4.551 . 0 0 "[ . 1 . 2 .]" 1
1250 1 18 PHE H 1 86 LEU QD 4.000 . 5.500 4.354 4.114 4.634 . 0 0 "[ . 1 . 2 .]" 1
1251 1 19 VAL H 1 19 VAL HB 4.000 . 5.000 3.860 3.833 3.892 . 0 0 "[ . 1 . 2 .]" 1
1252 1 19 VAL MG1 1 20 ASP H 3.000 . 4.000 3.906 3.772 4.007 0.007 6 0 "[ . 1 . 2 .]" 1
1253 1 19 VAL H 1 20 ASP H 4.000 . 5.000 4.451 4.425 4.476 . 0 0 "[ . 1 . 2 .]" 1
1254 1 19 VAL MG2 1 25 SER H 4.000 . 6.500 5.752 5.476 6.082 . 0 0 "[ . 1 . 2 .]" 1
1255 1 19 VAL MG1 1 25 SER H 4.000 . 5.500 4.950 4.619 5.270 . 0 0 "[ . 1 . 2 .]" 1
1256 1 19 VAL HB 1 25 SER H 4.000 . 5.000 4.733 4.566 4.952 . 0 0 "[ . 1 . 2 .]" 1
1257 1 19 VAL MG1 1 26 GLN H 4.000 . 5.500 4.655 4.293 4.909 . 0 0 "[ . 1 . 2 .]" 1
1258 1 19 VAL H 1 50 ILE H 3.000 . 3.500 3.563 3.491 3.631 0.131 8 0 "[ . 1 . 2 .]" 1
1259 1 19 VAL H 1 51 ASN H 4.000 . 5.000 5.005 4.899 5.089 0.089 14 0 "[ . 1 . 2 .]" 1
1260 1 19 VAL MG2 1 51 ASN HD21 4.000 . 5.500 3.873 2.312 5.502 0.002 8 0 "[ . 1 . 2 .]" 1
1261 1 19 VAL MG2 1 51 ASN HD22 4.000 . 5.500 3.841 2.543 5.329 . 0 0 "[ . 1 . 2 .]" 1
1262 1 19 VAL H 1 52 VAL H 3.000 . 3.500 3.210 3.023 3.318 . 0 0 "[ . 1 . 2 .]" 1
1263 1 19 VAL MG2 1 53 ALA H 4.000 . 5.500 5.281 5.105 5.491 . 0 0 "[ . 1 . 2 .]" 1
1264 1 19 VAL H 1 53 ALA H 4.000 . 6.000 5.723 5.557 5.902 . 0 0 "[ . 1 . 2 .]" 1
1265 1 19 VAL HA 1 69 ALA H 4.000 . 5.000 4.008 3.699 4.298 . 0 0 "[ . 1 . 2 .]" 1
1266 1 20 ASP H 1 20 ASP HB3 4.000 . 5.000 2.846 2.731 3.492 . 0 0 "[ . 1 . 2 .]" 1
1267 1 20 ASP HB3 1 21 THR H 4.000 . 5.000 4.472 4.433 4.591 . 0 0 "[ . 1 . 2 .]" 1
1268 1 20 ASP H 1 22 ARG H 4.000 . 6.000 3.000 2.732 3.114 . 0 0 "[ . 1 . 2 .]" 1
1269 1 20 ASP HB3 1 22 ARG H 4.000 . 5.000 4.565 4.399 4.911 . 0 0 "[ . 1 . 2 .]" 1
1270 1 20 ASP HB2 1 22 ARG H 4.000 . 5.000 4.256 4.017 4.546 . 0 0 "[ . 1 . 2 .]" 1
1271 1 20 ASP H 1 25 SER QB 4.000 . 5.500 3.502 3.161 3.888 . 0 0 "[ . 1 . 2 .]" 1
1272 1 20 ASP H 1 52 VAL MG2 4.000 . 5.500 3.798 3.487 4.309 . 0 0 "[ . 1 . 2 .]" 1
1273 1 20 ASP H 1 67 THR MG 4.000 . 5.500 4.349 4.008 4.615 . 0 0 "[ . 1 . 2 .]" 1
1274 1 21 THR H 1 22 ARG H 4.000 . 6.000 2.596 2.477 2.980 . 0 0 "[ . 1 . 2 .]" 1
1275 1 21 THR MG 1 51 ASN HD21 3.000 . 3.800 2.876 1.795 3.823 0.023 8 0 "[ . 1 . 2 .]" 1
1276 1 21 THR MG 1 51 ASN HD22 3.000 . 3.800 2.581 1.774 3.518 0.026 6 0 "[ . 1 . 2 .]" 1
1277 1 21 THR H 1 52 VAL MG2 4.000 . 6.500 4.601 4.405 4.876 . 0 0 "[ . 1 . 2 .]" 1
1278 1 21 THR MG 1 52 VAL H 4.000 . 6.500 4.778 4.449 6.127 . 0 0 "[ . 1 . 2 .]" 1
1279 1 21 THR MG 1 53 ALA H 4.000 . 5.500 4.203 3.797 5.104 . 0 0 "[ . 1 . 2 .]" 1
1280 1 22 ARG H 1 22 ARG QG 3.000 . 4.000 2.138 1.798 3.289 0.002 5 0 "[ . 1 . 2 .]" 1
1281 1 22 ARG H 1 22 ARG HD2 4.000 . 5.000 3.952 3.300 4.950 . 0 0 "[ . 1 . 2 .]" 1
1282 1 22 ARG H 1 23 PRO HD2 4.000 . 5.000 4.791 4.741 4.920 . 0 0 "[ . 1 . 2 .]" 1
1283 1 22 ARG QB 1 25 SER H 3.000 . 4.000 3.772 3.524 3.940 . 0 0 "[ . 1 . 2 .]" 1
1284 1 22 ARG QG 1 25 SER H 3.000 . 3.500 1.817 1.711 2.665 0.089 4 0 "[ . 1 . 2 .]" 1
1285 1 22 ARG H 1 25 SER H 4.000 . 6.000 4.326 4.193 4.914 . 0 0 "[ . 1 . 2 .]" 1
1286 1 23 PRO HD2 1 25 SER H 4.000 . 5.000 4.961 4.845 5.083 0.083 3 0 "[ . 1 . 2 .]" 1
1287 1 24 LEU MD2 1 25 SER H 3.000 . 4.000 4.023 3.953 4.071 0.071 14 0 "[ . 1 . 2 .]" 1
1288 1 24 LEU H 1 25 SER H 4.000 . 6.000 2.793 2.733 2.833 . 0 0 "[ . 1 . 2 .]" 1
1289 1 25 SER QB 1 26 GLN H 3.000 . 4.000 2.887 2.417 3.389 . 0 0 "[ . 1 . 2 .]" 1
1290 1 25 SER HA 1 26 GLN H 4.000 . 5.000 3.544 3.534 3.557 . 0 0 "[ . 1 . 2 .]" 1
1291 1 25 SER H 1 26 GLN QG 4.000 . 5.500 4.272 3.973 5.255 . 0 0 "[ . 1 . 2 .]" 1
1292 1 25 SER HA 1 27 HIS H 4.000 . 5.000 4.078 3.961 4.143 . 0 0 "[ . 1 . 2 .]" 1
1293 1 25 SER HA 1 28 ILE H 4.000 . 5.000 3.243 3.069 3.374 . 0 0 "[ . 1 . 2 .]" 1
1294 1 25 SER H 1 28 ILE HB 4.000 . 5.000 5.064 5.007 5.127 0.127 22 0 "[ . 1 . 2 .]" 1
1295 1 25 SER HA 1 29 VAL H 4.000 . 5.000 3.787 3.609 4.067 . 0 0 "[ . 1 . 2 .]" 1
1296 1 26 GLN H 1 27 HIS H 4.000 . 5.000 2.422 2.392 2.454 . 0 0 "[ . 1 . 2 .]" 1
1297 1 26 GLN H 1 27 HIS QB 4.000 . 6.500 4.019 3.970 4.062 . 0 0 "[ . 1 . 2 .]" 1
1298 1 26 GLN HA 1 28 ILE H 4.000 . 5.000 4.656 4.462 4.774 . 0 0 "[ . 1 . 2 .]" 1
1299 1 26 GLN H 1 29 VAL H 4.000 . 6.000 4.397 4.354 4.443 . 0 0 "[ . 1 . 2 .]" 1
1300 1 26 GLN HA 1 29 VAL H 3.000 . 3.500 3.290 3.134 3.386 . 0 0 "[ . 1 . 2 .]" 1
1301 1 26 GLN H 1 29 VAL MG2 4.000 . 6.500 3.822 3.718 4.048 . 0 0 "[ . 1 . 2 .]" 1
1302 1 26 GLN HA 1 30 GLN H 4.000 . 5.000 4.233 3.965 4.359 . 0 0 "[ . 1 . 2 .]" 1
1303 1 27 HIS HA 1 29 VAL H 4.000 . 6.000 4.328 4.243 4.456 . 0 0 "[ . 1 . 2 .]" 1
1304 1 27 HIS H 1 29 VAL HB 4.000 . 6.000 4.591 4.474 4.743 . 0 0 "[ . 1 . 2 .]" 1
1305 1 27 HIS HA 1 30 GLN H 4.000 . 5.000 3.795 3.669 3.930 . 0 0 "[ . 1 . 2 .]" 1
1306 1 27 HIS HA 1 31 ARG H 4.000 . 5.000 4.821 4.750 4.907 . 0 0 "[ . 1 . 2 .]" 1
1307 1 28 ILE H 1 29 VAL H 3.000 . 3.500 2.592 2.565 2.622 . 0 0 "[ . 1 . 2 .]" 1
1308 1 28 ILE H 1 30 GLN H 4.000 . 5.000 4.340 4.265 4.438 . 0 0 "[ . 1 . 2 .]" 1
1309 1 28 ILE HA 1 32 VAL H 4.000 . 5.000 4.013 3.909 4.151 . 0 0 "[ . 1 . 2 .]" 1
1310 1 28 ILE H 1 68 PRO QG 4.000 . 5.500 4.836 4.525 5.172 . 0 0 "[ . 1 . 2 .]" 1
1311 1 28 ILE MG 1 84 ILE H 4.000 . 5.500 5.373 5.177 5.538 0.038 25 0 "[ . 1 . 2 .]" 1
1312 1 28 ILE MG 1 87 THR H 4.000 . 5.500 3.419 3.132 3.801 . 0 0 "[ . 1 . 2 .]" 1
1313 1 29 VAL H 1 30 GLN H 3.000 . 3.500 2.760 2.703 2.809 . 0 0 "[ . 1 . 2 .]" 1
1314 1 29 VAL MG1 1 30 GLN H 3.000 . 4.000 3.185 3.076 3.353 . 0 0 "[ . 1 . 2 .]" 1
1315 1 29 VAL HA 1 30 GLN H 3.000 . 3.500 3.553 3.540 3.564 0.064 11 0 "[ . 1 . 2 .]" 1
1316 1 29 VAL HA 1 31 ARG H 4.000 . 5.000 4.367 4.255 4.438 . 0 0 "[ . 1 . 2 .]" 1
1317 1 29 VAL H 1 32 VAL H 4.000 . 5.000 4.507 4.444 4.599 . 0 0 "[ . 1 . 2 .]" 1
1318 1 29 VAL MG2 1 32 VAL H 4.000 . 5.500 4.906 4.849 5.007 . 0 0 "[ . 1 . 2 .]" 1
1319 1 29 VAL HA 1 32 VAL H 3.000 . 3.500 3.220 3.104 3.354 . 0 0 "[ . 1 . 2 .]" 1
1320 1 29 VAL HA 1 33 LYS H 4.000 . 5.000 3.774 3.614 3.913 . 0 0 "[ . 1 . 2 .]" 1
1321 1 29 VAL MG2 1 33 LYS H 4.000 . 6.500 5.226 5.084 5.346 . 0 0 "[ . 1 . 2 .]" 1
1322 1 30 GLN HA 1 30 GLN HE22 4.000 . 6.000 3.718 2.922 4.857 . 0 0 "[ . 1 . 2 .]" 1
1323 1 30 GLN HA 1 30 GLN HE21 4.000 . 5.000 3.582 1.864 4.210 . 0 0 "[ . 1 . 2 .]" 1
1324 1 30 GLN H 1 31 ARG H 3.000 . 3.500 2.641 2.601 2.668 . 0 0 "[ . 1 . 2 .]" 1
1325 1 30 GLN H 1 31 ARG QB 4.000 . 5.500 4.618 4.559 4.672 . 0 0 "[ . 1 . 2 .]" 1
1326 1 30 GLN HA 1 32 VAL H 4.000 . 5.000 4.336 4.197 4.411 . 0 0 "[ . 1 . 2 .]" 1
1327 1 30 GLN H 1 32 VAL H 4.000 . 6.000 4.002 3.952 4.086 . 0 0 "[ . 1 . 2 .]" 1
1328 1 30 GLN H 1 33 LYS H 4.000 . 5.000 4.622 4.496 4.707 . 0 0 "[ . 1 . 2 .]" 1
1329 1 30 GLN HE22 1 33 LYS HB2 4.000 . 6.000 4.856 3.711 6.069 0.069 14 0 "[ . 1 . 2 .]" 1
1330 1 30 GLN HE21 1 33 LYS HB2 4.000 . 6.000 5.289 3.225 6.013 0.013 25 0 "[ . 1 . 2 .]" 1
1331 1 30 GLN HE22 1 33 LYS QD 4.000 . 5.500 3.743 2.654 5.443 . 0 0 "[ . 1 . 2 .]" 1
1332 1 30 GLN QG 1 34 ASN HD21 4.000 . 5.500 4.822 4.606 4.945 . 0 0 "[ . 1 . 2 .]" 1
1333 1 30 GLN QG 1 34 ASN HD22 3.000 . 3.800 3.883 3.851 3.923 0.123 3 0 "[ . 1 . 2 .]" 1
1334 1 31 ARG H 1 31 ARG HG3 3.000 . 3.500 2.251 2.145 2.371 . 0 0 "[ . 1 . 2 .]" 1
1335 1 31 ARG HG3 1 32 VAL H 4.000 . 5.000 4.303 4.229 4.422 . 0 0 "[ . 1 . 2 .]" 1
1336 1 31 ARG H 1 32 VAL H 3.000 . 3.500 2.630 2.591 2.667 . 0 0 "[ . 1 . 2 .]" 1
1337 1 31 ARG HG2 1 32 VAL H 4.000 . 5.000 4.916 4.870 4.949 . 0 0 "[ . 1 . 2 .]" 1
1338 1 31 ARG H 1 32 VAL HA 4.000 . 6.000 5.261 5.235 5.292 . 0 0 "[ . 1 . 2 .]" 1
1339 1 31 ARG H 1 33 LYS H 4.000 . 5.000 4.262 4.154 4.359 . 0 0 "[ . 1 . 2 .]" 1
1340 1 31 ARG H 1 34 ASN H 4.000 . 5.000 4.498 4.424 4.571 . 0 0 "[ . 1 . 2 .]" 1
1341 1 31 ARG H 1 34 ASN HB2 4.000 . 6.000 4.752 4.624 4.887 . 0 0 "[ . 1 . 2 .]" 1
1342 1 31 ARG HA 1 34 ASN HD21 4.000 . 5.000 2.351 2.085 4.634 . 0 0 "[ . 1 . 2 .]" 1
1343 1 31 ARG HA 1 34 ASN HD22 4.000 . 5.000 3.860 3.657 4.705 . 0 0 "[ . 1 . 2 .]" 1
1344 1 31 ARG HG2 1 35 ILE H 4.000 . 6.000 5.937 5.633 6.032 0.032 12 0 "[ . 1 . 2 .]" 1
1345 1 31 ARG H 1 35 ILE MD 4.000 . 6.500 5.461 5.188 5.599 . 0 0 "[ . 1 . 2 .]" 1
1346 1 31 ARG HA 1 35 ILE H 4.000 . 5.000 3.747 3.512 3.855 . 0 0 "[ . 1 . 2 .]" 1
1347 1 31 ARG H 1 87 THR MG 4.000 . 5.500 4.379 4.162 4.682 . 0 0 "[ . 1 . 2 .]" 1
1348 1 32 VAL H 1 33 LYS H 3.000 . 3.500 2.696 2.636 2.745 . 0 0 "[ . 1 . 2 .]" 1
1349 1 32 VAL H 1 34 ASN H 4.000 . 5.000 3.980 3.913 4.061 . 0 0 "[ . 1 . 2 .]" 1
1350 1 32 VAL MG1 1 34 ASN H 4.000 . 5.500 4.888 4.708 5.002 . 0 0 "[ . 1 . 2 .]" 1
1351 1 32 VAL HB 1 34 ASN H 4.000 . 5.000 4.857 4.765 4.928 . 0 0 "[ . 1 . 2 .]" 1
1352 1 32 VAL MG2 1 34 ASN H 4.000 . 5.500 5.382 5.299 5.449 . 0 0 "[ . 1 . 2 .]" 1
1353 1 32 VAL HA 1 34 ASN H 4.000 . 6.000 4.554 4.513 4.646 . 0 0 "[ . 1 . 2 .]" 1
1354 1 33 LYS H 1 33 LYS HG3 2.500 . 2.900 2.253 2.196 2.318 . 0 0 "[ . 1 . 2 .]" 1
1355 1 33 LYS H 1 33 LYS HB2 3.000 . 3.500 2.401 2.360 2.431 . 0 0 "[ . 1 . 2 .]" 1
1356 1 33 LYS H 1 33 LYS HE3 4.000 . 6.000 5.257 4.453 5.863 . 0 0 "[ . 1 . 2 .]" 1
1357 1 33 LYS HG2 1 34 ASN H 4.000 . 6.000 4.918 4.874 4.959 . 0 0 "[ . 1 . 2 .]" 1
1358 1 33 LYS H 1 34 ASN H 3.000 . 3.500 2.682 2.642 2.708 . 0 0 "[ . 1 . 2 .]" 1
1359 1 33 LYS HB2 1 34 ASN H 3.000 . 3.500 2.576 2.489 2.646 . 0 0 "[ . 1 . 2 .]" 1
1360 1 33 LYS HG3 1 34 ASN H 4.000 . 5.000 4.331 4.245 4.413 . 0 0 "[ . 1 . 2 .]" 1
1361 1 33 LYS H 1 35 ILE H 4.000 . 5.000 4.301 4.215 4.362 . 0 0 "[ . 1 . 2 .]" 1
1362 1 33 LYS HA 1 37 ALA H 4.000 . 5.000 3.747 3.485 4.007 . 0 0 "[ . 1 . 2 .]" 1
1363 1 33 LYS H 1 47 LEU MD1 3.000 . 4.000 3.499 3.242 4.071 0.071 23 0 "[ . 1 . 2 .]" 1
1364 1 34 ASN H 1 34 ASN HD21 4.000 . 6.000 3.345 2.015 3.755 . 0 0 "[ . 1 . 2 .]" 1
1365 1 34 ASN HA 1 34 ASN HD22 4.000 . 5.000 4.549 3.562 4.639 . 0 0 "[ . 1 . 2 .]" 1
1366 1 34 ASN HA 1 34 ASN HD21 4.000 . 5.000 4.343 2.154 4.474 . 0 0 "[ . 1 . 2 .]" 1
1367 1 34 ASN HB3 1 35 ILE H 3.000 . 3.500 3.548 3.519 3.582 0.082 3 0 "[ . 1 . 2 .]" 1
1368 1 34 ASN H 1 35 ILE H 3.000 . 3.500 2.752 2.708 2.784 . 0 0 "[ . 1 . 2 .]" 1
1369 1 34 ASN HA 1 35 ILE H 4.000 . 5.000 3.560 3.543 3.575 . 0 0 "[ . 1 . 2 .]" 1
1370 1 34 ASN H 1 35 ILE MD 4.000 . 5.500 5.206 5.051 5.327 . 0 0 "[ . 1 . 2 .]" 1
1371 1 34 ASN H 1 36 LEU H 4.000 . 5.000 4.350 4.253 4.460 . 0 0 "[ . 1 . 2 .]" 1
1372 1 34 ASN H 1 37 ALA H 4.000 . 5.000 4.650 4.415 4.837 . 0 0 "[ . 1 . 2 .]" 1
1373 1 34 ASN HA 1 38 ALA H 4.000 . 5.000 4.649 4.389 4.988 . 0 0 "[ . 1 . 2 .]" 1
1374 1 35 ILE HG12 1 36 LEU H 4.000 . 5.000 4.967 4.902 5.011 0.011 11 0 "[ . 1 . 2 .]" 1
1375 1 35 ILE H 1 37 ALA H 4.000 . 5.000 4.007 3.776 4.148 . 0 0 "[ . 1 . 2 .]" 1
1376 1 35 ILE HA 1 37 ALA H 4.000 . 5.000 4.400 4.218 4.554 . 0 0 "[ . 1 . 2 .]" 1
1377 1 35 ILE H 1 38 ALA MB 4.000 . 5.500 4.317 4.186 4.548 . 0 0 "[ . 1 . 2 .]" 1
1378 1 35 ILE MG 1 38 ALA H 4.000 . 5.500 4.120 3.964 4.311 . 0 0 "[ . 1 . 2 .]" 1
1379 1 35 ILE HB 1 38 ALA H 4.000 . 5.000 5.088 5.057 5.115 0.115 15 0 "[ . 1 . 2 .]" 1
1380 1 35 ILE MG 1 39 VAL H 4.000 . 5.500 4.895 4.373 5.520 0.020 2 0 "[ . 1 . 2 .]" 1
1381 1 35 ILE MD 1 88 ASP H 4.000 . 6.500 5.176 4.890 5.578 . 0 0 "[ . 1 . 2 .]" 1
1382 1 35 ILE MG 1 92 ASN H 4.000 . 6.500 5.881 5.556 6.366 . 0 0 "[ . 1 . 2 .]" 1
1383 1 36 LEU H 1 37 ALA H 3.000 . 3.500 2.674 2.597 2.739 . 0 0 "[ . 1 . 2 .]" 1
1384 1 36 LEU H 1 37 ALA HA 4.000 . 6.000 5.305 5.238 5.357 . 0 0 "[ . 1 . 2 .]" 1
1385 1 36 LEU HB2 1 38 ALA H 4.000 . 5.000 4.598 4.496 4.805 . 0 0 "[ . 1 . 2 .]" 1
1386 1 36 LEU H 1 38 ALA H 4.000 . 5.000 3.746 3.686 3.878 . 0 0 "[ . 1 . 2 .]" 1
1387 1 36 LEU HB3 1 45 ILE H 4.000 . 5.000 4.524 4.242 4.841 . 0 0 "[ . 1 . 2 .]" 1
1388 1 36 LEU MD1 1 47 LEU H 4.000 . 5.500 4.983 4.425 5.450 . 0 0 "[ . 1 . 2 .]" 1
1389 1 37 ALA H 1 38 ALA HA 4.000 . 5.000 5.060 5.031 5.115 0.115 8 0 "[ . 1 . 2 .]" 1
1390 1 37 ALA H 1 38 ALA H 2.500 . 2.900 2.492 2.467 2.520 . 0 0 "[ . 1 . 2 .]" 1
1391 1 37 ALA HA 1 38 ALA H 3.000 . 3.500 3.380 3.333 3.466 . 0 0 "[ . 1 . 2 .]" 1
1392 1 37 ALA H 1 39 VAL H 4.000 . 5.000 4.219 3.988 4.437 . 0 0 "[ . 1 . 2 .]" 1
1393 1 37 ALA HA 1 39 VAL H 4.000 . 5.000 3.609 3.225 3.985 . 0 0 "[ . 1 . 2 .]" 1
1394 1 37 ALA HA 1 40 GLU H 4.000 . 5.000 3.399 2.936 3.841 . 0 0 "[ . 1 . 2 .]" 1
1395 1 38 ALA H 1 39 VAL HB 4.000 . 5.000 4.548 4.148 4.887 . 0 0 "[ . 1 . 2 .]" 1
1396 1 38 ALA H 1 39 VAL HA 4.000 . 5.000 5.059 4.966 5.142 0.142 18 0 "[ . 1 . 2 .]" 1
1397 1 38 ALA H 1 45 ILE MD 4.000 . 5.500 5.523 5.475 5.559 0.059 11 0 "[ . 1 . 2 .]" 1
1398 1 38 ALA H 1 94 LEU MD2 4.000 . 5.500 5.100 4.778 5.546 0.046 9 0 "[ . 1 . 2 .]" 1
1399 1 39 VAL H 1 40 GLU H 3.000 . 3.500 2.115 1.714 2.415 0.086 11 0 "[ . 1 . 2 .]" 1
1400 1 39 VAL H 1 40 GLU QB 4.000 . 5.500 4.609 3.580 5.195 . 0 0 "[ . 1 . 2 .]" 1
1401 1 39 VAL H 1 94 LEU MD2 4.000 . 5.500 4.457 3.926 5.288 . 0 0 "[ . 1 . 2 .]" 1
1402 1 40 GLU H 1 45 ILE MD 4.000 . 5.500 4.401 3.572 5.140 . 0 0 "[ . 1 . 2 .]" 1
1403 1 41 ALA H 1 42 THR H 4.000 . 5.000 4.397 2.440 4.589 . 0 0 "[ . 1 . 2 .]" 1
1404 1 42 THR H 1 43 VAL H 4.000 . 5.000 2.532 2.388 3.175 . 0 0 "[ . 1 . 2 .]" 1
1405 1 43 VAL H 1 44 PRO HD3 4.000 . 6.000 3.407 3.199 3.817 . 0 0 "[ . 1 . 2 .]" 1
1406 1 44 PRO HB2 1 46 SER H 4.000 . 6.000 5.526 5.307 5.670 . 0 0 "[ . 1 . 2 .]" 1
1407 1 45 ILE H 1 45 ILE HG12 4.000 . 5.000 4.042 3.979 4.105 . 0 0 "[ . 1 . 2 .]" 1
1408 1 45 ILE HB 1 46 SER H 4.000 . 5.000 3.909 3.811 4.023 . 0 0 "[ . 1 . 2 .]" 1
1409 1 45 ILE H 1 46 SER H 4.000 . 5.000 4.529 4.466 4.558 . 0 0 "[ . 1 . 2 .]" 1
1410 1 45 ILE MG 1 47 LEU H 4.000 . 5.500 4.288 4.025 4.520 . 0 0 "[ . 1 . 2 .]" 1
1411 1 46 SER HB3 1 47 LEU H 4.000 . 5.000 4.261 4.083 4.391 . 0 0 "[ . 1 . 2 .]" 1
1412 1 46 SER HB2 1 47 LEU H 4.000 . 5.000 4.382 4.208 4.485 . 0 0 "[ . 1 . 2 .]" 1
1413 1 46 SER H 1 47 LEU H 4.000 . 5.000 4.354 4.240 4.468 . 0 0 "[ . 1 . 2 .]" 1
1414 1 47 LEU H 1 47 LEU HG 4.000 . 5.000 4.423 4.300 4.733 . 0 0 "[ . 1 . 2 .]" 1
1415 1 47 LEU H 1 48 GLN H 4.000 . 5.000 4.412 4.328 4.469 . 0 0 "[ . 1 . 2 .]" 1
1416 1 47 LEU HG 1 48 GLN H 4.000 . 5.000 3.913 3.778 4.782 . 0 0 "[ . 1 . 2 .]" 1
1417 1 47 LEU HB2 1 48 GLN H 4.000 . 5.000 4.454 4.406 4.540 . 0 0 "[ . 1 . 2 .]" 1
1418 1 47 LEU MD1 1 49 VAL H 4.000 . 5.500 5.431 4.099 5.555 0.055 18 0 "[ . 1 . 2 .]" 1
1419 1 48 GLN H 1 48 GLN HB3 3.000 . 3.500 3.524 3.236 3.680 0.180 23 0 "[ . 1 . 2 .]" 1
1420 1 48 GLN H 1 49 VAL H 4.000 . 6.000 4.325 4.199 4.422 . 0 0 "[ . 1 . 2 .]" 1
1421 1 48 GLN QG 1 49 VAL H 4.000 . 5.500 3.619 2.788 4.345 . 0 0 "[ . 1 . 2 .]" 1
1422 1 49 VAL HB 1 50 ILE H 4.000 . 5.000 3.964 3.912 4.013 . 0 0 "[ . 1 . 2 .]" 1
1423 1 49 VAL H 1 50 ILE H 4.000 . 5.000 4.502 4.479 4.549 . 0 0 "[ . 1 . 2 .]" 1
1424 1 50 ILE H 1 50 ILE HG12 3.000 . 3.500 3.563 3.522 3.606 0.106 9 0 "[ . 1 . 2 .]" 1
1425 1 50 ILE H 1 51 ASN HA 4.000 . 6.000 4.800 4.747 4.853 . 0 0 "[ . 1 . 2 .]" 1
1426 1 50 ILE H 1 51 ASN H 4.000 . 5.000 4.326 4.264 4.367 . 0 0 "[ . 1 . 2 .]" 1
1427 1 50 ILE HB 1 52 VAL H 4.000 . 5.000 4.903 4.716 5.050 0.050 12 0 "[ . 1 . 2 .]" 1
1428 1 50 ILE MG 1 54 ASP H 4.000 . 6.500 4.914 4.409 5.389 . 0 0 "[ . 1 . 2 .]" 1
1429 1 50 ILE MG 1 55 GLN H 4.000 . 5.500 4.178 3.702 4.623 . 0 0 "[ . 1 . 2 .]" 1
1430 1 50 ILE HB 1 55 GLN HE21 4.000 . 5.000 4.639 3.845 5.005 0.005 8 0 "[ . 1 . 2 .]" 1
1431 1 50 ILE HB 1 55 GLN HE22 4.000 . 5.000 4.759 3.437 5.052 0.052 7 0 "[ . 1 . 2 .]" 1
1432 1 50 ILE MG 1 55 GLN HE21 4.000 . 5.500 2.235 1.777 2.849 0.023 7 0 "[ . 1 . 2 .]" 1
1433 1 50 ILE MG 1 55 GLN HE22 4.000 . 5.500 2.275 1.792 2.738 0.008 16 0 "[ . 1 . 2 .]" 1
1434 1 51 ASN H 1 51 ASN HD21 4.000 . 5.000 4.361 3.208 4.923 . 0 0 "[ . 1 . 2 .]" 1
1435 1 51 ASN HA 1 51 ASN HD21 4.000 . 5.000 3.184 1.776 4.453 0.024 10 0 "[ . 1 . 2 .]" 1
1436 1 51 ASN HA 1 51 ASN HD22 4.000 . 5.000 3.928 3.153 4.605 . 0 0 "[ . 1 . 2 .]" 1
1437 1 51 ASN H 1 52 VAL HA 4.000 . 6.000 5.226 5.149 5.311 . 0 0 "[ . 1 . 2 .]" 1
1438 1 51 ASN HB3 1 52 VAL H 4.000 . 5.000 3.943 3.659 4.429 . 0 0 "[ . 1 . 2 .]" 1
1439 1 51 ASN HD22 1 53 ALA MB 4.000 . 5.500 4.593 1.832 5.552 0.052 1 0 "[ . 1 . 2 .]" 1
1440 1 51 ASN HD21 1 53 ALA MB 4.000 . 5.500 4.241 1.970 5.502 0.002 15 0 "[ . 1 . 2 .]" 1
1441 1 51 ASN HA 1 54 ASP H 4.000 . 6.000 4.303 4.053 4.467 . 0 0 "[ . 1 . 2 .]" 1
1442 1 52 VAL H 1 53 ALA H 3.000 . 3.500 2.707 2.636 2.759 . 0 0 "[ . 1 . 2 .]" 1
1443 1 52 VAL H 1 54 ASP H 4.000 . 6.000 4.153 4.013 4.419 . 0 0 "[ . 1 . 2 .]" 1
1444 1 52 VAL HA 1 54 ASP H 4.000 . 5.000 3.781 3.506 4.063 . 0 0 "[ . 1 . 2 .]" 1
1445 1 52 VAL MG2 1 54 ASP H 4.000 . 5.500 4.166 3.968 4.477 . 0 0 "[ . 1 . 2 .]" 1
1446 1 52 VAL MG1 1 69 ALA H 4.000 . 6.500 4.927 4.650 5.260 . 0 0 "[ . 1 . 2 .]" 1
1447 1 53 ALA H 1 54 ASP H 3.000 . 3.500 2.491 2.461 2.526 . 0 0 "[ . 1 . 2 .]" 1
1448 1 53 ALA H 1 54 ASP HA 4.000 . 5.000 5.105 5.066 5.141 0.141 21 0 "[ . 1 . 2 .]" 1
1449 1 53 ALA H 1 55 GLN H 4.000 . 5.000 4.048 3.769 4.511 . 0 0 "[ . 1 . 2 .]" 1
1450 1 53 ALA HA 1 55 GLN H 4.000 . 5.000 4.474 4.096 4.978 . 0 0 "[ . 1 . 2 .]" 1
1451 1 54 ASP H 1 55 GLN H 2.500 . 2.900 2.239 2.098 2.393 . 0 0 "[ . 1 . 2 .]" 1
1452 1 54 ASP H 1 55 GLN QG 4.000 . 5.500 4.077 3.347 5.248 . 0 0 "[ . 1 . 2 .]" 1
1453 1 54 ASP H 1 55 GLN HB3 4.000 . 5.000 5.082 5.008 5.187 0.187 6 0 "[ . 1 . 2 .]" 1
1454 1 54 ASP QB 1 55 GLN HE22 4.000 . 6.500 3.891 1.933 5.352 . 0 0 "[ . 1 . 2 .]" 1
1455 1 54 ASP QB 1 55 GLN HE21 4.000 . 5.500 3.752 1.924 5.519 0.019 5 0 "[ . 1 . 2 .]" 1
1456 1 54 ASP H 1 56 PRO HD3 4.000 . 6.000 4.163 3.507 4.696 . 0 0 "[ . 1 . 2 .]" 1
1457 1 55 GLN H 1 55 GLN HB2 4.000 . 5.000 3.901 3.776 4.053 . 0 0 "[ . 1 . 2 .]" 1
1458 1 55 GLN H 1 56 PRO QG 4.000 . 6.500 4.145 3.873 4.443 . 0 0 "[ . 1 . 2 .]" 1
1459 1 55 GLN QG 1 58 LEU H 4.000 . 5.500 3.765 3.108 5.083 . 0 0 "[ . 1 . 2 .]" 1
1460 1 55 GLN H 1 58 LEU MD1 4.000 . 6.500 5.417 4.401 6.618 0.118 10 0 "[ . 1 . 2 .]" 1
1461 1 56 PRO HB2 1 57 GLN H 3.000 . 3.500 3.567 3.518 3.646 0.146 23 0 "[ . 1 . 2 .]" 1
1462 1 56 PRO HA 1 58 LEU H 4.000 . 5.000 4.439 4.211 4.785 . 0 0 "[ . 1 . 2 .]" 1
1463 1 56 PRO HA 1 60 GLU H 4.000 . 6.000 4.408 4.220 4.641 . 0 0 "[ . 1 . 2 .]" 1
1464 1 57 GLN H 1 57 GLN HB2 4.000 . 5.000 2.621 2.393 2.791 . 0 0 "[ . 1 . 2 .]" 1
1465 1 57 GLN H 1 57 GLN HG3 4.000 . 5.000 4.459 4.346 4.521 . 0 0 "[ . 1 . 2 .]" 1
1466 1 57 GLN HG3 1 58 LEU H 4.000 . 5.000 4.526 4.189 4.846 . 0 0 "[ . 1 . 2 .]" 1
1467 1 57 GLN H 1 58 LEU H 4.000 . 5.000 2.761 2.663 2.928 . 0 0 "[ . 1 . 2 .]" 1
1468 1 57 GLN HB3 1 59 VAL H 4.000 . 5.000 4.663 4.467 4.766 . 0 0 "[ . 1 . 2 .]" 1
1469 1 57 GLN HA 1 59 VAL H 4.000 . 6.000 4.136 4.025 4.236 . 0 0 "[ . 1 . 2 .]" 1
1470 1 57 GLN HA 1 60 GLU H 4.000 . 5.000 3.683 3.507 3.897 . 0 0 "[ . 1 . 2 .]" 1
1471 1 57 GLN HA 1 61 TYR H 4.000 . 5.000 4.513 4.286 4.654 . 0 0 "[ . 1 . 2 .]" 1
1472 1 58 LEU H 1 58 LEU HB3 3.000 . 3.500 2.744 2.257 3.107 . 0 0 "[ . 1 . 2 .]" 1
1473 1 58 LEU H 1 59 VAL HB 4.000 . 5.000 4.750 4.443 4.912 . 0 0 "[ . 1 . 2 .]" 1
1474 1 58 LEU H 1 59 VAL H 3.000 . 3.500 2.454 2.392 2.525 . 0 0 "[ . 1 . 2 .]" 1
1475 1 58 LEU MD1 1 59 VAL H 3.000 . 4.000 2.474 1.638 3.524 0.162 5 0 "[ . 1 . 2 .]" 1
1476 1 58 LEU HA 1 59 VAL H 4.000 . 5.000 3.450 3.422 3.472 . 0 0 "[ . 1 . 2 .]" 1
1477 1 58 LEU HB3 1 59 VAL H 4.000 . 5.000 4.138 3.738 4.394 . 0 0 "[ . 1 . 2 .]" 1
1478 1 58 LEU HB2 1 62 TYR H 4.000 . 6.000 4.958 4.510 5.580 . 0 0 "[ . 1 . 2 .]" 1
1479 1 58 LEU MD1 1 62 TYR H 4.000 . 5.500 4.444 3.512 5.180 . 0 0 "[ . 1 . 2 .]" 1
1480 1 58 LEU HA 1 62 TYR H 4.000 . 5.000 4.206 3.926 4.575 . 0 0 "[ . 1 . 2 .]" 1
1481 1 59 VAL H 1 60 GLU H 3.000 . 3.500 2.655 2.582 2.725 . 0 0 "[ . 1 . 2 .]" 1
1482 1 59 VAL HA 1 60 GLU H 4.000 . 5.000 3.562 3.544 3.575 . 0 0 "[ . 1 . 2 .]" 1
1483 1 59 VAL MG1 1 60 GLU H 3.000 . 4.000 3.435 3.005 3.641 . 0 0 "[ . 1 . 2 .]" 1
1484 1 59 VAL MG2 1 60 GLU H 4.000 . 5.500 3.722 3.543 3.961 . 0 0 "[ . 1 . 2 .]" 1
1485 1 59 VAL HB 1 61 TYR H 4.000 . 5.000 4.744 4.630 4.866 . 0 0 "[ . 1 . 2 .]" 1
1486 1 59 VAL H 1 61 TYR H 4.000 . 6.000 3.813 3.726 3.918 . 0 0 "[ . 1 . 2 .]" 1
1487 1 59 VAL MG1 1 63 ARG H 4.000 . 5.500 5.290 4.784 5.463 . 0 0 "[ . 1 . 2 .]" 1
1488 1 59 VAL MG1 1 64 LEU H 3.000 . 4.000 3.810 3.394 3.957 . 0 0 "[ . 1 . 2 .]" 1
1489 1 60 GLU H 1 60 GLU HG3 4.000 . 5.000 2.352 2.207 3.754 . 0 0 "[ . 1 . 2 .]" 1
1490 1 60 GLU H 1 61 TYR H 3.000 . 3.500 2.510 2.432 2.575 . 0 0 "[ . 1 . 2 .]" 1
1491 1 60 GLU HG3 1 61 TYR H 4.000 . 6.000 4.378 4.255 5.127 . 0 0 "[ . 1 . 2 .]" 1
1492 1 60 GLU H 1 64 LEU HB3 4.000 . 6.000 4.838 4.703 5.149 . 0 0 "[ . 1 . 2 .]" 1
1493 1 60 GLU HA 1 64 LEU H 4.000 . 5.000 3.709 3.465 4.035 . 0 0 "[ . 1 . 2 .]" 1
1494 1 61 TYR H 1 62 TYR H 3.000 . 3.500 2.718 2.664 2.758 . 0 0 "[ . 1 . 2 .]" 1
1495 1 61 TYR QD 1 62 TYR H 4.000 . 5.000 3.476 3.240 3.630 . 0 0 "[ . 1 . 2 .]" 1
1496 1 61 TYR HA 1 62 TYR H 3.000 . 3.500 3.529 3.522 3.543 0.043 25 0 "[ . 1 . 2 .]" 1
1497 1 61 TYR H 1 63 ARG H 4.000 . 5.000 3.871 3.751 3.966 . 0 0 "[ . 1 . 2 .]" 1
1498 1 62 TYR H 1 62 TYR QD 3.000 . 3.500 3.035 2.807 3.287 . 0 0 "[ . 1 . 2 .]" 1
1499 1 62 TYR H 1 62 TYR HB3 3.000 . 3.500 3.574 3.561 3.587 0.087 14 0 "[ . 1 . 2 .]" 1
1500 1 62 TYR HB2 1 63 ARG H 4.000 . 5.000 3.799 3.706 3.943 . 0 0 "[ . 1 . 2 .]" 1
1501 1 62 TYR QD 1 63 ARG H 4.000 . 6.000 4.821 4.780 4.864 . 0 0 "[ . 1 . 2 .]" 1
1502 1 62 TYR HA 1 63 ARG H 4.000 . 5.000 3.135 3.072 3.201 . 0 0 "[ . 1 . 2 .]" 1
1503 1 62 TYR H 1 63 ARG QG 4.000 . 5.500 4.877 4.681 5.206 . 0 0 "[ . 1 . 2 .]" 1
1504 1 62 TYR H 1 63 ARG HA 4.000 . 5.000 4.749 4.690 4.772 . 0 0 "[ . 1 . 2 .]" 1
1505 1 62 TYR HB2 1 64 LEU H 4.000 . 5.000 2.622 2.575 2.733 . 0 0 "[ . 1 . 2 .]" 1
1506 1 62 TYR HB3 1 64 LEU H 4.000 . 5.000 3.296 3.172 3.384 . 0 0 "[ . 1 . 2 .]" 1
1507 1 62 TYR H 1 64 LEU H 4.000 . 5.000 3.180 3.106 3.235 . 0 0 "[ . 1 . 2 .]" 1
1508 1 62 TYR H 1 64 LEU HG 4.000 . 6.000 6.039 5.993 6.102 0.102 25 0 "[ . 1 . 2 .]" 1
1509 1 63 ARG H 1 63 ARG HB2 3.000 . 3.500 3.515 3.395 3.591 0.091 2 0 "[ . 1 . 2 .]" 1
1510 1 63 ARG H 1 64 LEU H 3.000 . 3.500 2.587 2.537 2.691 . 0 0 "[ . 1 . 2 .]" 1
1511 1 63 ARG HB2 1 64 LEU H 4.000 . 5.000 3.615 3.512 3.746 . 0 0 "[ . 1 . 2 .]" 1
1512 1 63 ARG HB3 1 64 LEU H 4.000 . 6.000 4.293 4.163 4.403 . 0 0 "[ . 1 . 2 .]" 1
1513 1 64 LEU HB3 1 65 VAL H 4.000 . 6.000 4.085 3.919 4.380 . 0 0 "[ . 1 . 2 .]" 1
1514 1 64 LEU HB2 1 65 VAL H 4.000 . 5.000 4.437 4.343 4.663 . 0 0 "[ . 1 . 2 .]" 1
1515 1 64 LEU MD1 1 65 VAL H 4.000 . 5.500 2.257 1.859 3.627 . 0 0 "[ . 1 . 2 .]" 1
1516 1 64 LEU H 1 65 VAL H 4.000 . 5.000 4.433 3.688 4.607 . 0 0 "[ . 1 . 2 .]" 1
1517 1 64 LEU MD1 1 66 VAL H 4.000 . 5.500 1.907 1.746 2.275 0.054 5 0 "[ . 1 . 2 .]" 1
1518 1 64 LEU HG 1 66 VAL H 4.000 . 5.000 4.851 4.702 5.146 0.146 21 0 "[ . 1 . 2 .]" 1
1519 1 65 VAL H 1 66 VAL H 3.000 . 3.500 1.857 1.655 2.553 0.145 15 0 "[ . 1 . 2 .]" 1
1520 1 66 VAL H 1 67 THR H 4.000 . 5.000 4.471 4.425 4.495 . 0 0 "[ . 1 . 2 .]" 1
1521 1 66 VAL QG 1 67 THR H 2.500 . 3.400 3.412 3.373 3.446 0.046 23 0 "[ . 1 . 2 .]" 1
1522 1 66 VAL QG 1 83 GLY H 3.000 . 4.000 3.426 3.331 3.517 . 0 0 "[ . 1 . 2 .]" 1
1523 1 66 VAL HB 1 83 GLY H 4.000 . 5.000 4.026 3.597 4.207 . 0 0 "[ . 1 . 2 .]" 1
1524 1 67 THR H 1 69 ALA MB 4.000 . 5.500 4.724 4.588 4.905 . 0 0 "[ . 1 . 2 .]" 1
1525 1 68 PRO QD 1 69 ALA H 4.000 . 6.500 4.899 4.831 4.949 . 0 0 "[ . 1 . 2 .]" 1
1526 1 68 PRO QD 1 83 GLY H 4.000 . 5.500 4.206 4.032 4.432 . 0 0 "[ . 1 . 2 .]" 1
1527 1 68 PRO QG 1 83 GLY H 4.000 . 5.500 5.549 5.519 5.596 0.096 21 0 "[ . 1 . 2 .]" 1
1528 1 69 ALA H 1 70 LEU H 4.000 . 6.000 4.342 4.263 4.389 . 0 0 "[ . 1 . 2 .]" 1
1529 1 69 ALA HA 1 81 LEU H 4.000 . 6.000 5.194 4.935 5.424 . 0 0 "[ . 1 . 2 .]" 1
1530 1 69 ALA HA 1 83 GLY H 3.000 . 3.500 3.623 3.563 3.669 0.169 10 0 "[ . 1 . 2 .]" 1
1531 1 69 ALA MB 1 83 GLY H 4.000 . 5.500 3.808 3.541 3.989 . 0 0 "[ . 1 . 2 .]" 1
1532 1 69 ALA H 1 86 LEU QD 4.000 . 5.500 3.192 2.878 3.489 . 0 0 "[ . 1 . 2 .]" 1
1533 1 70 LEU H 1 70 LEU HG 4.000 . 5.000 4.560 4.518 4.608 . 0 0 "[ . 1 . 2 .]" 1
1534 1 70 LEU H 1 70 LEU MD2 4.000 . 5.500 4.074 4.013 4.184 . 0 0 "[ . 1 . 2 .]" 1
1535 1 70 LEU H 1 70 LEU MD1 4.000 . 5.500 4.517 4.431 4.589 . 0 0 "[ . 1 . 2 .]" 1
1536 1 70 LEU MD1 1 71 VAL H 4.000 . 5.500 4.384 4.234 4.506 . 0 0 "[ . 1 . 2 .]" 1
1537 1 70 LEU HG 1 71 VAL H 4.000 . 5.000 3.006 2.765 3.216 . 0 0 "[ . 1 . 2 .]" 1
1538 1 70 LEU H 1 71 VAL H 4.000 . 6.000 4.383 4.272 4.439 . 0 0 "[ . 1 . 2 .]" 1
1539 1 70 LEU MD1 1 81 LEU H 4.000 . 5.500 5.469 5.052 5.553 0.053 2 0 "[ . 1 . 2 .]" 1
1540 1 70 LEU HB3 1 81 LEU H 4.000 . 5.000 3.649 2.982 3.850 . 0 0 "[ . 1 . 2 .]" 1
1541 1 70 LEU H 1 81 LEU HB2 4.000 . 5.000 3.045 2.770 3.388 . 0 0 "[ . 1 . 2 .]" 1
1542 1 70 LEU H 1 82 SER HA 4.000 . 5.000 3.168 3.027 3.417 . 0 0 "[ . 1 . 2 .]" 1
1543 1 70 LEU H 1 83 GLY H 4.000 . 6.000 5.378 5.222 5.595 . 0 0 "[ . 1 . 2 .]" 1
1544 1 71 VAL H 1 71 VAL HB 3.000 . 3.500 2.728 2.657 2.826 . 0 0 "[ . 1 . 2 .]" 1
1545 1 71 VAL H 1 71 VAL MG1 4.000 . 5.500 3.891 3.860 3.927 . 0 0 "[ . 1 . 2 .]" 1
1546 1 71 VAL MG2 1 81 LEU H 3.000 . 4.000 3.013 2.654 3.601 . 0 0 "[ . 1 . 2 .]" 1
1547 1 71 VAL HA 1 81 LEU H 4.000 . 5.000 2.951 2.675 3.462 . 0 0 "[ . 1 . 2 .]" 1
1548 1 72 LYS H 1 72 LYS HG2 4.000 . 6.000 4.416 4.373 4.452 . 0 0 "[ . 1 . 2 .]" 1
1549 1 72 LYS H 1 72 LYS HD2 4.000 . 5.000 4.708 4.362 4.959 . 0 0 "[ . 1 . 2 .]" 1
1550 1 72 LYS H 1 73 ILE H 4.000 . 6.000 4.493 4.452 4.527 . 0 0 "[ . 1 . 2 .]" 1
1551 1 72 LYS HD3 1 73 ILE H 4.000 . 5.000 4.309 3.096 4.813 . 0 0 "[ . 1 . 2 .]" 1
1552 1 72 LYS HD2 1 74 GLY H 4.000 . 5.000 4.107 2.665 4.857 . 0 0 "[ . 1 . 2 .]" 1
1553 1 72 LYS HE2 1 74 GLY H 4.000 . 5.000 4.182 2.856 5.098 0.098 3 0 "[ . 1 . 2 .]" 1
1554 1 72 LYS HD3 1 74 GLY H 3.000 . 3.500 3.155 2.024 3.599 0.099 12 0 "[ . 1 . 2 .]" 1
1555 1 72 LYS H 1 79 GLN HB2 4.000 . 6.000 3.429 2.839 3.775 . 0 0 "[ . 1 . 2 .]" 1
1556 1 72 LYS H 1 79 GLN H 4.000 . 5.000 3.040 2.719 3.297 . 0 0 "[ . 1 . 2 .]" 1
1557 1 72 LYS HB3 1 79 GLN H 4.000 . 5.000 2.723 2.452 3.055 . 0 0 "[ . 1 . 2 .]" 1
1558 1 72 LYS HD2 1 79 GLN H 4.000 . 6.000 4.162 3.390 4.849 . 0 0 "[ . 1 . 2 .]" 1
1559 1 72 LYS H 1 80 VAL HA 4.000 . 5.000 3.561 3.246 3.887 . 0 0 "[ . 1 . 2 .]" 1
1560 1 72 LYS H 1 80 VAL H 4.000 . 6.000 4.945 4.752 5.204 . 0 0 "[ . 1 . 2 .]" 1
1561 1 72 LYS HB3 1 97 TRP HE1 4.000 . 5.000 5.040 4.872 5.082 0.082 5 0 "[ . 1 . 2 .]" 1
1562 1 73 ILE H 1 73 ILE HG13 4.000 . 5.000 3.316 3.279 3.391 . 0 0 "[ . 1 . 2 .]" 1
1563 1 73 ILE H 1 74 GLY H 3.000 . 3.500 2.191 2.099 2.271 . 0 0 "[ . 1 . 2 .]" 1
1564 1 73 ILE HA 1 74 GLY H 3.000 . 3.500 3.472 3.422 3.494 . 0 0 "[ . 1 . 2 .]" 1
1565 1 73 ILE HG12 1 74 GLY H 4.000 . 5.000 2.548 2.398 2.768 . 0 0 "[ . 1 . 2 .]" 1
1566 1 73 ILE MG 1 74 GLY H 4.000 . 5.500 4.350 4.304 4.400 . 0 0 "[ . 1 . 2 .]" 1
1567 1 73 ILE HG13 1 74 GLY H 4.000 . 5.000 4.131 4.003 4.352 . 0 0 "[ . 1 . 2 .]" 1
1568 1 73 ILE H 1 78 ARG HA 4.000 . 6.000 5.070 4.849 5.238 . 0 0 "[ . 1 . 2 .]" 1
1569 1 73 ILE MG 1 79 GLN H 4.000 . 5.500 5.048 4.900 5.250 . 0 0 "[ . 1 . 2 .]" 1
1570 1 73 ILE H 1 79 GLN H 4.000 . 6.000 5.208 5.008 5.388 . 0 0 "[ . 1 . 2 .]" 1
1571 1 73 ILE HA 1 79 GLN H 4.000 . 6.000 4.232 4.016 4.462 . 0 0 "[ . 1 . 2 .]" 1
1572 1 74 GLY H 1 78 ARG HA 4.000 . 5.000 4.896 4.340 5.057 0.057 6 0 "[ . 1 . 2 .]" 1
1573 1 76 GLY HA2 1 77 SER H 4.000 . 5.000 2.771 2.625 3.213 . 0 0 "[ . 1 . 2 .]" 1
1574 1 76 GLY HA3 1 77 SER H 4.000 . 6.000 2.418 2.135 2.578 . 0 0 "[ . 1 . 2 .]" 1
1575 1 77 SER HB3 1 78 ARG H 4.000 . 5.000 3.871 3.711 3.975 . 0 0 "[ . 1 . 2 .]" 1
1576 1 78 ARG H 1 78 ARG HB2 3.000 . 3.500 2.684 2.531 2.868 . 0 0 "[ . 1 . 2 .]" 1
1577 1 78 ARG HB2 1 79 GLN H 4.000 . 5.000 4.140 3.997 4.321 . 0 0 "[ . 1 . 2 .]" 1
1578 1 78 ARG HG3 1 79 GLN H 3.000 . 3.500 2.856 2.479 3.112 . 0 0 "[ . 1 . 2 .]" 1
1579 1 79 GLN H 1 79 GLN HB3 4.000 . 5.000 3.869 3.835 3.912 . 0 0 "[ . 1 . 2 .]" 1
1580 1 79 GLN H 1 79 GLN HB2 3.000 . 3.500 2.792 2.725 2.882 . 0 0 "[ . 1 . 2 .]" 1
1581 1 79 GLN H 1 80 VAL H 4.000 . 5.000 4.399 4.356 4.439 . 0 0 "[ . 1 . 2 .]" 1
1582 1 79 GLN HB3 1 80 VAL H 3.000 . 3.500 2.759 2.584 2.959 . 0 0 "[ . 1 . 2 .]" 1
1583 1 79 GLN HB2 1 80 VAL H 4.000 . 5.000 3.851 3.687 3.976 . 0 0 "[ . 1 . 2 .]" 1
1584 1 79 GLN HE22 1 81 LEU MD2 4.000 . 5.500 4.857 3.796 5.436 . 0 0 "[ . 1 . 2 .]" 1
1585 1 79 GLN HE21 1 81 LEU MD2 4.000 . 5.500 4.574 2.903 5.530 0.030 25 0 "[ . 1 . 2 .]" 1
1586 1 79 GLN HB3 1 97 TRP HE1 4.000 . 5.000 4.179 3.309 4.821 . 0 0 "[ . 1 . 2 .]" 1
1587 1 79 GLN QG 1 97 TRP HE1 4.000 . 5.500 3.569 1.879 4.350 . 0 0 "[ . 1 . 2 .]" 1
1588 1 80 VAL H 1 81 LEU H 4.000 . 6.000 4.272 4.139 4.358 . 0 0 "[ . 1 . 2 .]" 1
1589 1 80 VAL H 1 81 LEU MD2 4.000 . 5.500 3.675 3.257 4.032 . 0 0 "[ . 1 . 2 .]" 1
1590 1 81 LEU H 1 81 LEU HB3 4.000 . 5.000 3.771 3.723 3.795 . 0 0 "[ . 1 . 2 .]" 1
1591 1 81 LEU H 1 81 LEU MD2 4.000 . 5.500 3.455 3.114 3.734 . 0 0 "[ . 1 . 2 .]" 1
1592 1 81 LEU H 1 82 SER H 4.000 . 5.000 4.379 4.321 4.427 . 0 0 "[ . 1 . 2 .]" 1
1593 1 81 LEU H 1 89 GLN HB3 4.000 . 6.000 5.942 5.580 6.045 0.045 20 0 "[ . 1 . 2 .]" 1
1594 1 81 LEU MD1 1 89 GLN H 4.000 . 5.500 4.779 4.387 5.083 . 0 0 "[ . 1 . 2 .]" 1
1595 1 81 LEU MD1 1 93 GLN H 4.000 . 5.500 4.169 3.654 4.658 . 0 0 "[ . 1 . 2 .]" 1
1596 1 81 LEU MD2 1 93 GLN HE21 4.000 . 5.500 4.101 3.184 4.554 . 0 0 "[ . 1 . 2 .]" 1
1597 1 81 LEU MD2 1 93 GLN HE22 4.000 . 5.500 4.677 3.869 5.110 . 0 0 "[ . 1 . 2 .]" 1
1598 1 81 LEU MD1 1 97 TRP HE1 4.000 . 5.500 4.621 4.203 4.958 . 0 0 "[ . 1 . 2 .]" 1
1599 1 82 SER H 1 82 SER HB2 4.000 . 5.000 3.477 3.419 3.522 . 0 0 "[ . 1 . 2 .]" 1
1600 1 82 SER H 1 83 GLY H 4.000 . 5.000 4.378 4.364 4.391 . 0 0 "[ . 1 . 2 .]" 1
1601 1 82 SER HB2 1 83 GLY H 3.000 . 3.500 3.576 3.528 3.629 0.129 13 0 "[ . 1 . 2 .]" 1
1602 1 82 SER H 1 89 GLN HB2 4.000 . 5.000 4.756 4.538 5.019 0.019 23 0 "[ . 1 . 2 .]" 1
1603 1 82 SER H 1 89 GLN HE22 3.000 . 3.500 2.119 1.750 2.769 0.050 14 0 "[ . 1 . 2 .]" 1
1604 1 82 SER H 1 89 GLN HE21 4.000 . 5.000 3.043 2.765 4.125 . 0 0 "[ . 1 . 2 .]" 1
1605 1 83 GLY HA3 1 85 ASP H 3.000 . 3.500 3.292 3.235 3.385 . 0 0 "[ . 1 . 2 .]" 1
1606 1 83 GLY HA2 1 85 ASP H 4.000 . 5.000 3.881 3.859 3.908 . 0 0 "[ . 1 . 2 .]" 1
1607 1 83 GLY HA2 1 86 LEU H 4.000 . 6.000 5.747 5.618 5.874 . 0 0 "[ . 1 . 2 .]" 1
1608 1 84 ILE H 1 84 ILE MD 4.000 . 5.500 4.588 4.543 4.626 . 0 0 "[ . 1 . 2 .]" 1
1609 1 84 ILE H 1 84 ILE HG13 4.000 . 5.000 4.274 4.102 4.357 . 0 0 "[ . 1 . 2 .]" 1
1610 1 84 ILE MD 1 85 ASP H 4.000 . 5.500 4.778 4.716 4.841 . 0 0 "[ . 1 . 2 .]" 1
1611 1 84 ILE H 1 85 ASP H 3.000 . 3.500 2.957 2.914 3.003 . 0 0 "[ . 1 . 2 .]" 1
1612 1 84 ILE HG12 1 85 ASP H 4.000 . 5.000 3.623 3.552 3.682 . 0 0 "[ . 1 . 2 .]" 1
1613 1 84 ILE H 1 86 LEU H 4.000 . 5.000 3.945 3.877 4.014 . 0 0 "[ . 1 . 2 .]" 1
1614 1 85 ASP HB2 1 86 LEU H 4.000 . 5.000 4.408 4.357 4.464 . 0 0 "[ . 1 . 2 .]" 1
1615 1 85 ASP H 1 86 LEU H 2.500 . 2.900 2.360 2.291 2.435 . 0 0 "[ . 1 . 2 .]" 1
1616 1 85 ASP HB3 1 86 LEU H 4.000 . 5.000 4.388 4.324 4.417 . 0 0 "[ . 1 . 2 .]" 1
1617 1 85 ASP H 1 86 LEU HA 4.000 . 5.000 4.481 4.419 4.547 . 0 0 "[ . 1 . 2 .]" 1
1618 1 85 ASP HA 1 87 THR H 4.000 . 5.000 3.821 3.548 4.007 . 0 0 "[ . 1 . 2 .]" 1
1619 1 85 ASP H 1 87 THR H 4.000 . 6.000 4.972 4.707 5.128 . 0 0 "[ . 1 . 2 .]" 1
1620 1 85 ASP HA 1 88 ASP H 4.000 . 5.000 3.219 3.035 3.414 . 0 0 "[ . 1 . 2 .]" 1
1621 1 85 ASP HB2 1 88 ASP H 4.000 . 6.000 4.093 3.897 4.356 . 0 0 "[ . 1 . 2 .]" 1
1622 1 85 ASP H 1 89 GLN HE21 4.000 . 5.000 4.922 4.201 5.048 0.048 25 0 "[ . 1 . 2 .]" 1
1623 1 85 ASP H 1 89 GLN HE22 4.000 . 6.000 5.593 4.691 5.855 . 0 0 "[ . 1 . 2 .]" 1
1624 1 86 LEU H 1 87 THR H 3.000 . 3.500 2.932 2.832 3.015 . 0 0 "[ . 1 . 2 .]" 1
1625 1 86 LEU H 1 87 THR MG 4.000 . 6.500 4.270 4.061 4.430 . 0 0 "[ . 1 . 2 .]" 1
1626 1 86 LEU HG 1 87 THR H 4.000 . 5.000 4.451 4.028 4.940 . 0 0 "[ . 1 . 2 .]" 1
1627 1 86 LEU HA 1 88 ASP H 4.000 . 5.000 4.537 4.437 4.668 . 0 0 "[ . 1 . 2 .]" 1
1628 1 86 LEU H 1 89 GLN HB2 4.000 . 5.000 4.818 4.234 5.017 0.017 18 0 "[ . 1 . 2 .]" 1
1629 1 86 LEU H 1 89 GLN HE22 4.000 . 6.000 5.868 5.050 6.034 0.034 22 0 "[ . 1 . 2 .]" 1
1630 1 86 LEU QD 1 89 GLN H 4.000 . 6.500 5.133 4.809 5.348 . 0 0 "[ . 1 . 2 .]" 1
1631 1 86 LEU HA 1 89 GLN H 4.000 . 5.000 3.716 3.449 3.884 . 0 0 "[ . 1 . 2 .]" 1
1632 1 86 LEU QD 1 90 LEU H 4.000 . 5.500 4.953 4.201 5.336 . 0 0 "[ . 1 . 2 .]" 1
1633 1 87 THR H 1 87 THR HB 4.000 . 5.000 3.599 3.583 3.613 . 0 0 "[ . 1 . 2 .]" 1
1634 1 87 THR HB 1 88 ASP H 4.000 . 5.000 3.775 3.647 3.875 . 0 0 "[ . 1 . 2 .]" 1
1635 1 87 THR H 1 88 ASP H 3.000 . 3.500 2.680 2.630 2.790 . 0 0 "[ . 1 . 2 .]" 1
1636 1 87 THR HA 1 88 ASP H 4.000 . 5.000 3.548 3.534 3.569 . 0 0 "[ . 1 . 2 .]" 1
1637 1 87 THR H 1 89 GLN H 4.000 . 5.000 4.181 3.938 4.308 . 0 0 "[ . 1 . 2 .]" 1
1638 1 87 THR HA 1 90 LEU H 3.000 . 3.500 3.623 3.585 3.669 0.169 14 0 "[ . 1 . 2 .]" 1
1639 1 87 THR HA 1 91 ALA H 4.000 . 5.000 3.570 3.348 3.937 . 0 0 "[ . 1 . 2 .]" 1
1640 1 88 ASP H 1 88 ASP HB2 3.000 . 3.500 2.400 2.345 2.457 . 0 0 "[ . 1 . 2 .]" 1
1641 1 88 ASP H 1 89 GLN H 3.000 . 3.500 2.541 2.412 2.591 . 0 0 "[ . 1 . 2 .]" 1
1642 1 88 ASP HB3 1 89 GLN H 3.000 . 3.500 3.473 3.413 3.540 0.040 15 0 "[ . 1 . 2 .]" 1
1643 1 88 ASP H 1 90 LEU H 4.000 . 5.000 3.951 3.834 4.058 . 0 0 "[ . 1 . 2 .]" 1
1644 1 88 ASP H 1 91 ALA MB 4.000 . 5.500 4.701 4.502 5.017 . 0 0 "[ . 1 . 2 .]" 1
1645 1 89 GLN H 1 89 GLN HB2 3.000 . 3.500 2.167 2.031 2.271 . 0 0 "[ . 1 . 2 .]" 1
1646 1 89 GLN H 1 89 GLN HE22 4.000 . 6.000 5.531 5.254 5.773 . 0 0 "[ . 1 . 2 .]" 1
1647 1 89 GLN HA 1 90 LEU H 4.000 . 5.000 3.574 3.549 3.588 . 0 0 "[ . 1 . 2 .]" 1
1648 1 89 GLN H 1 90 LEU H 3.000 . 3.500 2.628 2.600 2.699 . 0 0 "[ . 1 . 2 .]" 1
1649 1 89 GLN HB3 1 90 LEU H 4.000 . 5.000 2.660 2.466 3.301 . 0 0 "[ . 1 . 2 .]" 1
1650 1 89 GLN HB2 1 90 LEU H 3.000 . 3.500 3.334 2.441 3.518 0.018 18 0 "[ . 1 . 2 .]" 1
1651 1 89 GLN H 1 90 LEU HA 4.000 . 6.000 5.240 5.215 5.293 . 0 0 "[ . 1 . 2 .]" 1
1652 1 89 GLN HA 1 92 ASN H 4.000 . 5.000 3.407 3.292 3.513 . 0 0 "[ . 1 . 2 .]" 1
1653 1 89 GLN HA 1 93 GLN HE22 4.000 . 6.000 6.054 6.017 6.094 0.094 5 0 "[ . 1 . 2 .]" 1
1654 1 90 LEU H 1 90 LEU HG 4.000 . 5.000 4.429 4.409 4.620 . 0 0 "[ . 1 . 2 .]" 1
1655 1 90 LEU MD1 1 91 ALA H 4.000 . 5.500 4.344 2.427 4.498 . 0 0 "[ . 1 . 2 .]" 1
1656 1 90 LEU H 1 91 ALA H 3.000 . 3.500 2.798 2.714 2.875 . 0 0 "[ . 1 . 2 .]" 1
1657 1 90 LEU MD2 1 91 ALA H 3.000 . 4.000 4.042 3.996 4.130 0.130 10 0 "[ . 1 . 2 .]" 1
1658 1 90 LEU HA 1 91 ALA H 4.000 . 5.000 3.557 3.539 3.573 . 0 0 "[ . 1 . 2 .]" 1
1659 1 90 LEU MD1 1 92 ASN H 4.000 . 5.500 5.318 4.162 5.525 0.025 21 0 "[ . 1 . 2 .]" 1
1660 1 90 LEU H 1 92 ASN H 4.000 . 6.000 4.044 3.891 4.193 . 0 0 "[ . 1 . 2 .]" 1
1661 1 90 LEU HA 1 93 GLN H 4.000 . 5.000 3.254 3.074 3.492 . 0 0 "[ . 1 . 2 .]" 1
1662 1 90 LEU MD1 1 94 LEU H 2.500 . 3.400 3.390 3.144 3.436 0.036 12 0 "[ . 1 . 2 .]" 1
1663 1 91 ALA H 1 92 ASN H 3.000 . 3.500 2.678 2.603 2.748 . 0 0 "[ . 1 . 2 .]" 1
1664 1 91 ALA H 1 92 ASN HB2 4.000 . 5.000 4.760 4.660 4.843 . 0 0 "[ . 1 . 2 .]" 1
1665 1 91 ALA HA 1 94 LEU H 4.000 . 5.000 3.744 3.464 3.867 . 0 0 "[ . 1 . 2 .]" 1
1666 1 92 ASN H 1 92 ASN HB3 3.000 . 3.500 3.551 3.527 3.566 0.066 15 0 "[ . 1 . 2 .]" 1
1667 1 92 ASN H 1 93 GLN H 3.000 . 3.500 2.392 2.363 2.455 . 0 0 "[ . 1 . 2 .]" 1
1668 1 92 ASN HB2 1 93 GLN H 3.000 . 3.500 2.682 2.536 2.808 . 0 0 "[ . 1 . 2 .]" 1
1669 1 92 ASN H 1 93 GLN HA 4.000 . 5.000 5.062 5.038 5.099 0.099 10 0 "[ . 1 . 2 .]" 1
1670 1 92 ASN H 1 93 GLN HB2 4.000 . 6.000 4.505 4.411 4.775 . 0 0 "[ . 1 . 2 .]" 1
1671 1 92 ASN HB3 1 93 GLN HE21 4.000 . 5.000 3.705 3.077 5.015 0.015 15 0 "[ . 1 . 2 .]" 1
1672 1 92 ASN HB2 1 93 GLN HE21 4.000 . 5.000 3.722 3.242 5.063 0.063 15 0 "[ . 1 . 2 .]" 1
1673 1 92 ASN HB3 1 93 GLN HE22 4.000 . 6.000 4.819 3.845 5.814 . 0 0 "[ . 1 . 2 .]" 1
1674 1 92 ASN H 1 94 LEU H 4.000 . 5.000 3.882 3.787 3.986 . 0 0 "[ . 1 . 2 .]" 1
1675 1 92 ASN H 1 95 PRO HD2 4.000 . 6.000 4.166 4.039 4.385 . 0 0 "[ . 1 . 2 .]" 1
1676 1 93 GLN H 1 93 GLN HB3 3.000 . 3.500 3.568 3.555 3.588 0.088 15 0 "[ . 1 . 2 .]" 1
1677 1 93 GLN HA 1 93 GLN HE21 4.000 . 5.000 3.272 2.235 3.682 . 0 0 "[ . 1 . 2 .]" 1
1678 1 93 GLN HA 1 93 GLN HE22 4.000 . 5.000 3.502 2.768 4.159 . 0 0 "[ . 1 . 2 .]" 1
1679 1 93 GLN H 1 94 LEU H 2.500 . 2.900 2.496 2.464 2.532 . 0 0 "[ . 1 . 2 .]" 1
1680 1 93 GLN H 1 94 LEU HA 4.000 . 6.000 5.085 5.049 5.120 . 0 0 "[ . 1 . 2 .]" 1
1681 1 93 GLN H 1 94 LEU HB2 4.000 . 5.000 5.061 5.003 5.091 0.091 19 0 "[ . 1 . 2 .]" 1
1682 1 93 GLN H 1 95 PRO HD3 4.000 . 6.000 5.134 5.028 5.237 . 0 0 "[ . 1 . 2 .]" 1
1683 1 93 GLN H 1 95 PRO HG2 4.000 . 6.000 4.617 4.473 4.836 . 0 0 "[ . 1 . 2 .]" 1
1684 1 93 GLN HA 1 96 GLN H 4.000 . 5.000 3.520 3.389 3.641 . 0 0 "[ . 1 . 2 .]" 1
1685 1 93 GLN HG3 1 97 TRP HE1 4.000 . 5.000 4.037 3.698 4.722 . 0 0 "[ . 1 . 2 .]" 1
1686 1 93 GLN HB2 1 97 TRP HE1 4.000 . 5.000 3.783 3.432 4.092 . 0 0 "[ . 1 . 2 .]" 1
1687 1 93 GLN HB2 1 97 TRP H 4.000 . 6.000 5.727 5.418 5.926 . 0 0 "[ . 1 . 2 .]" 1
1688 1 93 GLN HE22 1 97 TRP HE1 4.000 . 5.000 5.069 5.027 5.134 0.134 8 0 "[ . 1 . 2 .]" 1
1689 1 94 LEU H 1 95 PRO HG3 4.000 . 5.000 4.912 4.886 4.943 . 0 0 "[ . 1 . 2 .]" 1
1690 1 94 LEU HA 1 96 GLN H 4.000 . 6.000 4.441 4.323 4.587 . 0 0 "[ . 1 . 2 .]" 1
1691 1 94 LEU MD1 1 97 TRP H 3.000 . 4.000 3.901 3.792 4.011 0.011 14 0 "[ . 1 . 2 .]" 1
1692 1 94 LEU HA 1 97 TRP H 3.000 . 3.500 3.407 3.282 3.514 0.014 16 0 "[ . 1 . 2 .]" 1
1693 1 95 PRO HG3 1 96 GLN H 4.000 . 5.000 4.170 4.095 4.229 . 0 0 "[ . 1 . 2 .]" 1
1694 1 95 PRO HB2 1 96 GLN H 3.000 . 3.500 2.725 2.603 2.835 . 0 0 "[ . 1 . 2 .]" 1
1695 1 95 PRO HG2 1 96 GLN H 4.000 . 5.000 2.800 2.703 2.886 . 0 0 "[ . 1 . 2 .]" 1
1696 1 95 PRO HB3 1 96 GLN H 4.000 . 5.000 3.978 3.899 4.045 . 0 0 "[ . 1 . 2 .]" 1
1697 1 95 PRO HD2 1 96 GLN H 4.000 . 5.000 3.242 3.150 3.338 . 0 0 "[ . 1 . 2 .]" 1
1698 1 95 PRO HA 1 98 LEU H 4.000 . 5.000 3.561 3.448 3.644 . 0 0 "[ . 1 . 2 .]" 1
1699 1 96 GLN QB 1 97 TRP HE1 4.000 . 5.500 3.659 3.421 3.830 . 0 0 "[ . 1 . 2 .]" 1
1700 1 96 GLN HA 1 97 TRP H 3.000 . 3.500 3.515 3.501 3.528 0.028 12 0 "[ . 1 . 2 .]" 1
1701 1 96 GLN H 1 97 TRP H 2.500 . 2.900 2.651 2.611 2.691 . 0 0 "[ . 1 . 2 .]" 1
1702 1 96 GLN H 1 97 TRP HB2 4.000 . 6.000 4.927 4.862 5.017 . 0 0 "[ . 1 . 2 .]" 1
1703 1 96 GLN H 1 97 TRP HA 4.000 . 6.000 5.267 5.242 5.307 . 0 0 "[ . 1 . 2 .]" 1
1704 1 96 GLN H 1 98 LEU H 4.000 . 5.000 4.242 4.042 4.435 . 0 0 "[ . 1 . 2 .]" 1
1705 1 96 GLN H 1 99 VAL H 4.000 . 5.000 4.635 4.469 4.880 . 0 0 "[ . 1 . 2 .]" 1
1706 1 96 GLN H 1 99 VAL MG2 4.000 . 5.500 4.249 3.939 4.562 . 0 0 "[ . 1 . 2 .]" 1
1707 1 97 TRP H 1 97 TRP HE1 4.000 . 5.000 4.341 4.234 4.475 . 0 0 "[ . 1 . 2 .]" 1
1708 1 97 TRP H 1 98 LEU HB2 4.000 . 5.000 4.846 4.686 4.928 . 0 0 "[ . 1 . 2 .]" 1
1709 1 97 TRP H 1 98 LEU H 3.000 . 3.500 2.643 2.581 2.715 . 0 0 "[ . 1 . 2 .]" 1
1710 1 97 TRP H 1 98 LEU HG 4.000 . 5.000 4.190 3.924 4.489 . 0 0 "[ . 1 . 2 .]" 1
1711 1 97 TRP HB2 1 98 LEU H 4.000 . 5.000 2.583 2.336 3.087 . 0 0 "[ . 1 . 2 .]" 1
1712 1 97 TRP HB3 1 98 LEU H 4.000 . 5.000 3.708 3.528 4.068 . 0 0 "[ . 1 . 2 .]" 1
1713 1 97 TRP HA 1 98 LEU H 4.000 . 5.000 3.537 3.439 3.568 . 0 0 "[ . 1 . 2 .]" 1
1714 1 97 TRP H 1 99 VAL H 4.000 . 5.000 3.928 3.761 4.048 . 0 0 "[ . 1 . 2 .]" 1
1715 1 98 LEU HG 1 99 VAL H 4.000 . 5.000 4.140 3.976 4.334 . 0 0 "[ . 1 . 2 .]" 1
1716 1 98 LEU H 1 99 VAL H 3.000 . 3.500 2.453 2.147 2.561 . 0 0 "[ . 1 . 2 .]" 1
1717 1 99 VAL H 1 99 VAL MG2 3.000 . 4.000 2.296 2.093 2.606 . 0 0 "[ . 1 . 2 .]" 1
1718 1 99 VAL H 1 99 VAL MG1 3.000 . 4.000 3.743 3.708 3.815 . 0 0 "[ . 1 . 2 .]" 1
1719 1 99 VAL H 1 100 GLN H 4.000 . 5.000 2.647 2.283 3.046 . 0 0 "[ . 1 . 2 .]" 1
1720 1 99 VAL H 1 100 GLN QG 4.000 . 6.500 3.938 3.651 4.261 . 0 0 "[ . 1 . 2 .]" 1
1721 1 100 GLN H 1 101 GLN H 4.000 . 5.000 3.371 2.647 4.656 . 0 0 "[ . 1 . 2 .]" 1
1722 1 100 GLN QB 1 101 GLN H 4.000 . 5.500 3.626 1.797 3.923 0.003 25 0 "[ . 1 . 2 .]" 1
1723 1 101 GLN H 1 101 GLN HB3 4.000 . 5.000 3.786 3.582 4.095 . 0 0 "[ . 1 . 2 .]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 23
_Distance_constraint_stats_list.Viol_count 72
_Distance_constraint_stats_list.Viol_total 98.110
_Distance_constraint_stats_list.Viol_max 0.119
_Distance_constraint_stats_list.Viol_rms 0.0205
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0068
_Distance_constraint_stats_list.Viol_average_violations_only 0.0545
_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 13 LEU 1.734 0.118 6 0 "[ . 1 . 2 .]"
1 15 LEU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 16 GLN 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 17 LEU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 20 ASP 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 28 ILE 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 29 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 31 ARG 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 32 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 33 LYS 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 36 LEU 1.055 0.081 8 0 "[ . 1 . 2 .]"
1 37 ALA 1.055 0.081 8 0 "[ . 1 . 2 .]"
1 42 THR 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 43 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 44 PRO 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 47 LEU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 50 ILE 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 51 ASN 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 53 ALA 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 55 GLN 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 56 PRO 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 57 GLN 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 58 LEU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 59 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 60 GLU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 61 TYR 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 62 TYR 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 63 ARG 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 64 LEU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 65 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 66 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 67 THR 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 70 LEU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 71 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 72 LYS 1.734 0.118 6 0 "[ . 1 . 2 .]"
1 74 GLY 1.734 0.118 6 0 "[ . 1 . 2 .]"
1 75 PRO 1.734 0.118 6 0 "[ . 1 . 2 .]"
1 86 LEU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 89 GLN 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 91 ALA 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 92 ASN 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 93 GLN 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 96 GLN 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 97 TRP 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 98 LEU 1.135 0.119 4 0 "[ . 1 . 2 .]"
1 99 VAL 1.135 0.119 4 0 "[ . 1 . 2 .]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 15 LEU MD1 1 17 LEU H 3.000 . 4.000 3.243 3.149 3.348 . 0 0 "[ . 1 . 2 .]" 2
2 1 16 GLN H 1 16 GLN HB3 3.000 . 3.500 3.209 3.166 3.243 . 0 0 "[ . 1 . 2 .]" 2
3 1 20 ASP HA 1 53 ALA H 3.000 . 3.500 3.127 2.881 3.396 . 0 0 "[ . 1 . 2 .]" 2
4 1 28 ILE H 1 28 ILE MD 3.000 . 4.000 3.221 3.118 3.267 . 0 0 "[ . 1 . 2 .]" 2
5 1 28 ILE MG 1 31 ARG H 3.000 . 4.000 3.752 3.630 3.832 . 0 0 "[ . 1 . 2 .]" 2
6 1 28 ILE MD 1 86 LEU H 4.000 . 5.500 3.535 3.333 3.865 . 0 0 "[ . 1 . 2 .]" 2
7 1 28 ILE MG 1 29 VAL H 2.500 . 3.400 3.246 3.179 3.294 . 0 0 "[ . 1 . 2 .]" 2
8 1 29 VAL MG1 1 33 LYS H 3.000 . 4.000 3.260 3.176 3.367 . 0 0 "[ . 1 . 2 .]" 2
9 1 36 LEU QD 1 37 ALA H 3.000 . 4.000 4.041 3.984 4.081 0.081 8 0 "[ . 1 . 2 .]" 2
10 1 42 THR HB 1 43 VAL H 4.000 . 5.000 3.919 3.813 4.018 . 0 0 "[ . 1 . 2 .]" 2
11 1 47 LEU H 1 47 LEU QD 3.000 . 4.000 3.783 3.625 3.820 . 0 0 "[ . 1 . 2 .]" 2
12 1 50 ILE H 1 51 ASN H 4.000 . 5.000 3.767 3.717 3.797 . 0 0 "[ . 1 . 2 .]" 2
13 1 56 PRO HB3 1 57 GLN H 4.000 . 5.000 3.926 3.859 4.002 . 0 0 "[ . 1 . 2 .]" 2
14 1 55 GLN HB2 1 58 LEU H 4.000 . 5.000 3.074 2.748 3.471 . 0 0 "[ . 1 . 2 .]" 2
15 1 60 GLU HA 1 63 ARG H 3.000 . 3.500 3.080 2.977 3.126 . 0 0 "[ . 1 . 2 .]" 2
16 1 59 VAL HA 1 62 TYR H 3.000 . 3.500 3.337 3.265 3.381 . 0 0 "[ . 1 . 2 .]" 2
17 1 64 LEU HB2 1 66 VAL H 3.000 . 4.000 3.609 3.488 3.716 . 0 0 "[ . 1 . 2 .]" 2
18 1 70 LEU HB3 1 72 LYS H 4.000 . 6.000 5.619 5.419 5.758 . 0 0 "[ . 1 . 2 .]" 2
19 1 13 LEU HA 1 74 GLY H 3.000 . 3.500 3.569 3.501 3.618 0.118 6 0 "[ . 1 . 2 .]" 2
20 1 89 GLN HB3 1 92 ASN H 4.000 . 5.000 4.011 3.923 4.096 . 0 0 "[ . 1 . 2 .]" 2
21 1 91 ALA H 1 92 ASN H 2.500 . 2.900 2.233 2.201 2.268 . 0 0 "[ . 1 . 2 .]" 2
22 1 96 GLN H 1 97 TRP H 2.500 . 2.900 2.324 2.243 2.414 . 0 0 "[ . 1 . 2 .]" 2
23 1 98 LEU QD 1 99 VAL H 3.000 . 4.000 4.045 3.996 4.119 0.119 4 0 "[ . 1 . 2 .]" 2
stop_
save_
save_distance_constraint_statistics_3
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 3
_Distance_constraint_stats_list.Constraint_count 66
_Distance_constraint_stats_list.Viol_count 233
_Distance_constraint_stats_list.Viol_total 234.987
_Distance_constraint_stats_list.Viol_max 0.132
_Distance_constraint_stats_list.Viol_rms 0.0183
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0057
_Distance_constraint_stats_list.Viol_average_violations_only 0.0403
_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 13 LEU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 14 LEU 0.708 0.055 18 0 "[ . 1 . 2 .]"
1 15 LEU 0.001 0.001 23 0 "[ . 1 . 2 .]"
1 16 GLN 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 17 LEU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 18 PHE 0.020 0.020 21 0 "[ . 1 . 2 .]"
1 19 VAL 0.868 0.103 23 0 "[ . 1 . 2 .]"
1 23 PRO 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 24 LEU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 25 SER 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 26 GLN 0.076 0.020 12 0 "[ . 1 . 2 .]"
1 27 HIS 3.318 0.132 18 0 "[ . 1 . 2 .]"
1 28 ILE 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 29 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 30 GLN 0.076 0.020 12 0 "[ . 1 . 2 .]"
1 31 ARG 3.318 0.132 18 0 "[ . 1 . 2 .]"
1 32 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 33 LYS 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 34 ASN 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 35 ILE 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 36 LEU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 37 ALA 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 46 SER 0.001 0.001 23 0 "[ . 1 . 2 .]"
1 48 GLN 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 50 ILE 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 52 VAL 0.868 0.103 23 0 "[ . 1 . 2 .]"
1 56 PRO 1.564 0.110 20 0 "[ . 1 . 2 .]"
1 57 GLN 0.360 0.085 14 0 "[ . 1 . 2 .]"
1 60 GLU 1.564 0.110 20 0 "[ . 1 . 2 .]"
1 61 TYR 0.360 0.085 14 0 "[ . 1 . 2 .]"
1 69 ALA 0.020 0.020 21 0 "[ . 1 . 2 .]"
1 70 LEU 0.982 0.071 7 0 "[ . 1 . 2 .]"
1 71 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 72 LYS 0.147 0.049 20 0 "[ . 1 . 2 .]"
1 73 ILE 0.708 0.055 18 0 "[ . 1 . 2 .]"
1 79 GLN 0.147 0.049 20 0 "[ . 1 . 2 .]"
1 81 LEU 0.982 0.071 7 0 "[ . 1 . 2 .]"
1 86 LEU 0.403 0.096 14 0 "[ . 1 . 2 .]"
1 87 THR 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 88 ASP 0.821 0.071 1 0 "[ . 1 . 2 .]"
1 89 GLN 0.028 0.010 9 0 "[ . 1 . 2 .]"
1 90 LEU 0.507 0.096 14 0 "[ . 1 . 2 .]"
1 91 ALA 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 92 ASN 0.821 0.071 1 0 "[ . 1 . 2 .]"
1 93 GLN 0.028 0.010 9 0 "[ . 1 . 2 .]"
1 94 LEU 0.104 0.023 20 0 "[ . 1 . 2 .]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 23 PRO O 1 27 HIS H 2.000 . 2.300 1.655 1.595 1.734 . 0 0 "[ . 1 . 2 .]" 3
2 1 23 PRO O 1 27 HIS N 3.000 2.400 3.300 2.496 2.438 2.557 . 0 0 "[ . 1 . 2 .]" 3
3 1 24 LEU O 1 28 ILE H 2.000 . 2.300 1.660 1.548 1.788 . 0 0 "[ . 1 . 2 .]" 3
4 1 24 LEU O 1 28 ILE N 3.000 2.400 3.300 2.616 2.513 2.731 . 0 0 "[ . 1 . 2 .]" 3
5 1 25 SER O 1 29 VAL H 2.000 . 2.300 1.681 1.557 1.846 . 0 0 "[ . 1 . 2 .]" 3
6 1 25 SER O 1 29 VAL N 3.000 2.400 3.300 2.533 2.424 2.670 . 0 0 "[ . 1 . 2 .]" 3
7 1 26 GLN O 1 30 GLN H 2.000 . 2.300 2.256 2.149 2.320 0.020 12 0 "[ . 1 . 2 .]" 3
8 1 26 GLN O 1 30 GLN N 3.000 2.400 3.300 3.156 3.065 3.237 . 0 0 "[ . 1 . 2 .]" 3
9 1 27 HIS O 1 31 ARG H 2.000 . 2.300 2.400 2.378 2.432 0.132 18 0 "[ . 1 . 2 .]" 3
10 1 27 HIS O 1 31 ARG N 3.000 2.400 3.300 3.333 3.305 3.363 0.063 15 0 "[ . 1 . 2 .]" 3
11 1 28 ILE O 1 32 VAL H 2.000 . 2.300 1.720 1.617 1.835 . 0 0 "[ . 1 . 2 .]" 3
12 1 28 ILE O 1 32 VAL N 3.000 2.400 3.300 2.626 2.528 2.754 . 0 0 "[ . 1 . 2 .]" 3
13 1 29 VAL O 1 33 LYS H 2.000 . 2.300 1.678 1.584 1.766 . 0 0 "[ . 1 . 2 .]" 3
14 1 29 VAL O 1 33 LYS N 3.000 2.400 3.300 2.654 2.561 2.744 . 0 0 "[ . 1 . 2 .]" 3
15 1 30 GLN O 1 34 ASN H 2.000 . 2.300 1.611 1.510 1.700 . 0 0 "[ . 1 . 2 .]" 3
16 1 30 GLN O 1 34 ASN N 3.000 2.400 3.300 2.537 2.442 2.626 . 0 0 "[ . 1 . 2 .]" 3
17 1 31 ARG O 1 35 ILE H 2.000 . 2.300 1.927 1.742 2.047 . 0 0 "[ . 1 . 2 .]" 3
18 1 31 ARG O 1 35 ILE N 3.000 2.400 3.300 2.862 2.686 2.991 . 0 0 "[ . 1 . 2 .]" 3
19 1 32 VAL O 1 36 LEU H 2.000 . 2.300 1.934 1.833 2.054 . 0 0 "[ . 1 . 2 .]" 3
20 1 32 VAL O 1 36 LEU N 3.000 2.400 3.300 2.899 2.787 3.026 . 0 0 "[ . 1 . 2 .]" 3
21 1 33 LYS O 1 37 ALA H 2.000 . 2.300 1.913 1.699 2.170 . 0 0 "[ . 1 . 2 .]" 3
22 1 33 LYS O 1 37 ALA N 3.000 2.400 3.300 2.800 2.564 3.025 . 0 0 "[ . 1 . 2 .]" 3
23 1 56 PRO O 1 60 GLU H 2.000 . 2.300 2.354 2.182 2.410 0.110 20 0 "[ . 1 . 2 .]" 3
24 1 56 PRO O 1 60 GLU N 3.000 2.400 3.300 3.265 3.114 3.322 0.022 20 0 "[ . 1 . 2 .]" 3
25 1 57 GLN O 1 61 TYR H 2.000 . 2.300 2.292 2.147 2.385 0.085 14 0 "[ . 1 . 2 .]" 3
26 1 57 GLN O 1 61 TYR N 3.000 2.400 3.300 3.166 3.021 3.280 . 0 0 "[ . 1 . 2 .]" 3
27 1 86 LEU O 1 90 LEU H 2.000 . 2.300 1.558 1.415 1.686 0.085 14 0 "[ . 1 . 2 .]" 3
28 1 86 LEU O 1 90 LEU N 3.000 2.400 3.300 2.445 2.304 2.564 0.096 14 0 "[ . 1 . 2 .]" 3
29 1 87 THR O 1 91 ALA H 2.000 . 2.300 2.037 1.925 2.256 . 0 0 "[ . 1 . 2 .]" 3
30 1 87 THR O 1 91 ALA N 3.000 2.400 3.300 2.953 2.837 3.225 . 0 0 "[ . 1 . 2 .]" 3
31 1 88 ASP O 1 92 ASN H 2.000 . 2.300 2.331 2.267 2.371 0.071 1 0 "[ . 1 . 2 .]" 3
32 1 88 ASP O 1 92 ASN N 3.000 2.400 3.300 3.156 3.078 3.232 . 0 0 "[ . 1 . 2 .]" 3
33 1 89 GLN O 1 93 GLN H 2.000 . 2.300 1.613 1.490 1.803 0.010 9 0 "[ . 1 . 2 .]" 3
34 1 89 GLN O 1 93 GLN N 3.000 2.400 3.300 2.518 2.394 2.695 0.006 25 0 "[ . 1 . 2 .]" 3
35 1 90 LEU O 1 94 LEU H 2.000 . 2.300 1.571 1.477 1.955 0.023 20 0 "[ . 1 . 2 .]" 3
36 1 90 LEU O 1 94 LEU N 3.000 2.400 3.300 2.501 2.385 2.824 0.015 9 0 "[ . 1 . 2 .]" 3
37 1 70 LEU H 1 81 LEU O 2.000 . 2.300 1.469 1.429 1.559 0.071 7 0 "[ . 1 . 2 .]" 3
38 1 70 LEU N 1 81 LEU O 3.000 2.400 3.300 2.417 2.383 2.495 0.017 7 0 "[ . 1 . 2 .]" 3
39 1 70 LEU O 1 81 LEU H 2.000 . 2.300 1.567 1.481 1.720 0.019 18 0 "[ . 1 . 2 .]" 3
40 1 70 LEU O 1 81 LEU N 3.000 2.400 3.300 2.511 2.445 2.641 . 0 0 "[ . 1 . 2 .]" 3
41 1 72 LYS H 1 79 GLN O 2.000 . 2.300 2.022 1.740 2.202 . 0 0 "[ . 1 . 2 .]" 3
42 1 72 LYS N 1 79 GLN O 3.000 2.400 3.300 2.901 2.705 3.047 . 0 0 "[ . 1 . 2 .]" 3
43 1 72 LYS O 1 79 GLN H 2.000 . 2.300 2.243 2.063 2.349 0.049 20 0 "[ . 1 . 2 .]" 3
44 1 72 LYS O 1 79 GLN N 3.000 2.400 3.300 3.183 3.007 3.278 . 0 0 "[ . 1 . 2 .]" 3
45 1 18 PHE O 1 69 ALA H 2.000 . 2.300 2.123 1.925 2.320 0.020 21 0 "[ . 1 . 2 .]" 3
46 1 18 PHE O 1 69 ALA N 3.000 2.400 3.300 3.074 2.900 3.246 . 0 0 "[ . 1 . 2 .]" 3
47 1 18 PHE H 1 69 ALA O 2.000 . 2.300 1.714 1.555 1.887 . 0 0 "[ . 1 . 2 .]" 3
48 1 18 PHE N 1 69 ALA O 3.000 2.400 3.300 2.648 2.504 2.777 . 0 0 "[ . 1 . 2 .]" 3
49 1 16 GLN O 1 71 VAL H 2.000 . 2.300 1.959 1.809 2.078 . 0 0 "[ . 1 . 2 .]" 3
50 1 16 GLN O 1 71 VAL N 3.000 2.400 3.300 2.875 2.753 2.976 . 0 0 "[ . 1 . 2 .]" 3
51 1 16 GLN H 1 71 VAL O 2.000 . 2.300 2.184 2.035 2.299 . 0 0 "[ . 1 . 2 .]" 3
52 1 16 GLN N 1 71 VAL O 3.000 2.400 3.300 3.097 2.990 3.205 . 0 0 "[ . 1 . 2 .]" 3
53 1 14 LEU O 1 73 ILE H 2.000 . 2.300 2.319 2.205 2.355 0.055 18 0 "[ . 1 . 2 .]" 3
54 1 14 LEU O 1 73 ILE N 3.000 2.400 3.300 3.256 3.112 3.325 0.025 18 0 "[ . 1 . 2 .]" 3
55 1 19 VAL O 1 52 VAL H 2.000 . 2.300 2.318 2.148 2.403 0.103 23 0 "[ . 1 . 2 .]" 3
56 1 19 VAL O 1 52 VAL N 3.000 2.400 3.300 3.214 3.025 3.357 0.057 23 0 "[ . 1 . 2 .]" 3
57 1 19 VAL H 1 50 ILE O 2.000 . 2.300 2.156 1.977 2.259 . 0 0 "[ . 1 . 2 .]" 3
58 1 19 VAL N 1 50 ILE O 3.000 2.400 3.300 3.101 2.942 3.202 . 0 0 "[ . 1 . 2 .]" 3
59 1 17 LEU O 1 50 ILE H 2.000 . 2.300 1.781 1.559 1.975 . 0 0 "[ . 1 . 2 .]" 3
60 1 17 LEU O 1 50 ILE N 3.000 2.400 3.300 2.735 2.518 2.908 . 0 0 "[ . 1 . 2 .]" 3
61 1 17 LEU H 1 48 GLN O 2.000 . 2.300 1.857 1.687 2.106 . 0 0 "[ . 1 . 2 .]" 3
62 1 17 LEU N 1 48 GLN O 3.000 2.400 3.300 2.759 2.608 3.002 . 0 0 "[ . 1 . 2 .]" 3
63 1 15 LEU O 1 48 GLN H 2.000 . 2.300 1.971 1.806 2.134 . 0 0 "[ . 1 . 2 .]" 3
64 1 15 LEU O 1 48 GLN N 3.000 2.400 3.300 2.858 2.709 3.005 . 0 0 "[ . 1 . 2 .]" 3
65 1 15 LEU H 1 46 SER O 2.000 . 2.300 1.990 1.654 2.301 0.001 23 0 "[ . 1 . 2 .]" 3
66 1 13 LEU O 1 46 SER N 3.000 2.400 3.300 2.761 2.500 2.920 . 0 0 "[ . 1 . 2 .]" 3
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