NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | program | type | subtype | subsubtype |
|
|
382999 |
1jr6   |
4791 | cing | recoord | 4-filtered-FRED | Wattos | check | violation | distance |
data_1jr6
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 1302
_Distance_constraint_stats_list.Viol_count 872
_Distance_constraint_stats_list.Viol_total 1398.026
_Distance_constraint_stats_list.Viol_max 0.298
_Distance_constraint_stats_list.Viol_rms 0.0142
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0017
_Distance_constraint_stats_list.Viol_average_violations_only 0.0641
_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 7 VAL 0.892 0.298 4 0 "[ . 1 . 2 .]"
1 8 THR 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 9 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 10 PRO 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 11 HIS 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 12 PRO 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 13 ASN 0.703 0.068 13 0 "[ . 1 . 2 .]"
1 14 ILE 1.242 0.063 9 0 "[ . 1 . 2 .]"
1 15 GLU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 16 GLU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 17 VAL 0.007 0.004 5 0 "[ . 1 . 2 .]"
1 18 ALA 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 19 LEU 0.683 0.122 22 0 "[ . 1 . 2 .]"
1 20 SER 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 21 THR 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 22 THR 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 23 GLY 1.044 0.054 19 0 "[ . 1 . 2 .]"
1 24 GLU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 25 ILE 0.945 0.119 20 0 "[ . 1 . 2 .]"
1 26 PRO 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 27 PHE 0.161 0.040 19 0 "[ . 1 . 2 .]"
1 28 TYR 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 29 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 30 LYS 0.683 0.122 22 0 "[ . 1 . 2 .]"
1 31 ALA 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 32 ILE 2.544 0.158 12 0 "[ . 1 . 2 .]"
1 33 PRO 1.611 0.054 19 0 "[ . 1 . 2 .]"
1 34 LEU 0.017 0.017 25 0 "[ . 1 . 2 .]"
1 35 GLU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 36 VAL 1.446 0.065 5 0 "[ . 1 . 2 .]"
1 37 ILE 6.443 0.253 2 0 "[ . 1 . 2 .]"
1 38 LYS 0.210 0.035 25 0 "[ . 1 . 2 .]"
1 39 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 40 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 41 ARG 0.481 0.062 4 0 "[ . 1 . 2 .]"
1 42 HIS 1.049 0.065 6 0 "[ . 1 . 2 .]"
1 43 LEU 0.130 0.065 7 0 "[ . 1 . 2 .]"
1 44 ILE 2.085 0.137 9 0 "[ . 1 . 2 .]"
1 45 PHE 0.178 0.031 19 0 "[ . 1 . 2 .]"
1 46 CYS 2.249 0.139 17 0 "[ . 1 . 2 .]"
1 47 HIS 0.005 0.005 14 0 "[ . 1 . 2 .]"
1 48 SER 1.954 0.139 17 0 "[ . 1 . 2 .]"
1 49 LYS 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 50 LYS 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 51 LYS 0.045 0.016 17 0 "[ . 1 . 2 .]"
1 52 CYS 0.137 0.028 16 0 "[ . 1 . 2 .]"
1 53 ASP 0.563 0.051 5 0 "[ . 1 . 2 .]"
1 54 GLU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 55 LEU 0.742 0.076 3 0 "[ . 1 . 2 .]"
1 56 ALA 0.552 0.051 5 0 "[ . 1 . 2 .]"
1 57 ALA 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 58 LYS 0.024 0.024 21 0 "[ . 1 . 2 .]"
1 59 LEU 6.508 0.175 2 0 "[ . 1 . 2 .]"
1 60 VAL 2.858 0.143 25 0 "[ . 1 . 2 .]"
1 61 ALA 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 62 LEU 0.017 0.017 25 0 "[ . 1 . 2 .]"
1 63 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 64 ILE 5.283 0.222 24 0 "[ . 1 . 2 .]"
1 65 ASN 3.009 0.143 25 0 "[ . 1 . 2 .]"
1 66 ALA 6.800 0.175 2 0 "[ . 1 . 2 .]"
1 67 VAL 0.285 0.018 2 0 "[ . 1 . 2 .]"
1 68 ALA 2.588 0.145 14 0 "[ . 1 . 2 .]"
1 69 TYR 0.434 0.036 11 0 "[ . 1 . 2 .]"
1 70 TYR 0.067 0.026 6 0 "[ . 1 . 2 .]"
1 71 ARG 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 72 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 73 LEU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 74 ASP 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 75 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 76 SER 0.004 0.004 10 0 "[ . 1 . 2 .]"
1 77 VAL 4.356 0.186 11 0 "[ . 1 . 2 .]"
1 78 ILE 0.580 0.045 11 0 "[ . 1 . 2 .]"
1 79 PRO 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 80 THR 0.432 0.045 11 0 "[ . 1 . 2 .]"
1 81 ASN 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 82 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 83 ASP 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 84 VAL 0.481 0.062 4 0 "[ . 1 . 2 .]"
1 85 VAL 9.986 0.253 2 0 "[ . 1 . 2 .]"
1 86 VAL 4.299 0.186 11 0 "[ . 1 . 2 .]"
1 87 VAL 5.029 0.145 14 0 "[ . 1 . 2 .]"
1 88 ALA 0.434 0.036 11 0 "[ . 1 . 2 .]"
1 89 THR 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 90 ASP 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 91 ALA 0.067 0.026 6 0 "[ . 1 . 2 .]"
1 92 LEU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 93 MET 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 94 THR 1.460 0.119 23 0 "[ . 1 . 2 .]"
1 95 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 96 PHE 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 97 THR 1.460 0.119 23 0 "[ . 1 . 2 .]"
1 98 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 99 ASP 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 100 PHE 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 101 ASP 0.063 0.036 18 0 "[ . 1 . 2 .]"
1 102 SER 1.087 0.081 23 0 "[ . 1 . 2 .]"
1 103 VAL 0.228 0.061 15 0 "[ . 1 . 2 .]"
1 104 ILE 4.174 0.158 12 0 "[ . 1 . 2 .]"
1 105 ASP 2.259 0.134 17 0 "[ . 1 . 2 .]"
1 106 CYS 0.570 0.053 18 0 "[ . 1 . 2 .]"
1 107 ASN 0.567 0.063 10 0 "[ . 1 . 2 .]"
1 108 THR 2.213 0.271 3 0 "[ . 1 . 2 .]"
1 109 SER 0.023 0.014 4 0 "[ . 1 . 2 .]"
1 110 ASP 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 111 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 112 LYS 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 113 PRO 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 114 GLN 0.074 0.055 20 0 "[ . 1 . 2 .]"
1 115 ASP 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 116 ALA 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 117 VAL 2.020 0.182 21 0 "[ . 1 . 2 .]"
1 118 SER 1.418 0.182 21 0 "[ . 1 . 2 .]"
1 119 ARG 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 120 THR 0.699 0.061 17 0 "[ . 1 . 2 .]"
1 121 GLN 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 122 ARG 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 123 ARG 0.647 0.061 15 0 "[ . 1 . 2 .]"
1 124 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 125 ARG 0.130 0.065 7 0 "[ . 1 . 2 .]"
1 126 THR 2.163 0.081 23 0 "[ . 1 . 2 .]"
1 127 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 128 ARG 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 129 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 130 LYS 0.007 0.007 1 0 "[ . 1 . 2 .]"
1 131 PRO 0.710 0.068 13 0 "[ . 1 . 2 .]"
1 132 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 133 ILE 0.063 0.036 18 0 "[ . 1 . 2 .]"
1 134 TYR 0.449 0.054 17 0 "[ . 1 . 2 .]"
1 135 ARG 0.007 0.004 5 0 "[ . 1 . 2 .]"
1 136 PHE 2.259 0.134 17 0 "[ . 1 . 2 .]"
1 137 VAL 0.567 0.063 10 0 "[ . 1 . 2 .]"
1 138 ALA 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 139 PRO 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 141 GLU 0.000 0.000 . 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 7 VAL HA 1 7 VAL HB 1.800 . 2.700 2.556 2.432 2.998 0.298 4 0 "[ . 1 . 2 .]" 1
2 1 7 VAL HA 1 7 VAL MG1 1.800 . 4.360 2.573 2.146 3.196 . 0 0 "[ . 1 . 2 .]" 1
3 1 7 VAL HB 1 8 THR H 1.800 . 5.000 4.157 3.887 4.528 . 0 0 "[ . 1 . 2 .]" 1
4 1 8 THR HA 1 8 THR HB 1.800 . 2.700 2.538 2.455 2.599 . 0 0 "[ . 1 . 2 .]" 1
5 1 8 THR HA 1 8 THR MG 1.800 . 3.640 2.252 2.089 2.395 . 0 0 "[ . 1 . 2 .]" 1
6 1 8 THR HB 1 9 VAL MG2 1.800 . 6.400 5.296 5.248 5.339 . 0 0 "[ . 1 . 2 .]" 1
7 1 9 VAL HA 1 9 VAL MG1 1.800 . 3.640 3.136 3.112 3.151 . 0 0 "[ . 1 . 2 .]" 1
8 1 9 VAL MG2 1 10 PRO HA 1.800 . 6.400 3.840 3.766 3.948 . 0 0 "[ . 1 . 2 .]" 1
9 1 9 VAL HB 1 10 PRO QB 1.800 . 6.300 5.853 5.820 5.881 . 0 0 "[ . 1 . 2 .]" 1
10 1 9 VAL MG2 1 10 PRO QB 1.800 . 5.555 3.899 3.800 4.042 . 0 0 "[ . 1 . 2 .]" 1
11 1 9 VAL HA 1 10 PRO QD 1.800 . 3.724 2.019 1.942 2.063 . 0 0 "[ . 1 . 2 .]" 1
12 1 9 VAL HB 1 10 PRO QD 1.800 . 3.724 2.884 2.829 2.937 . 0 0 "[ . 1 . 2 .]" 1
13 1 9 VAL MG2 1 10 PRO QD 1.800 . 5.555 1.875 1.848 1.902 . 0 0 "[ . 1 . 2 .]" 1
14 1 9 VAL MG1 1 10 PRO QD 1.800 . 5.555 3.907 3.882 3.938 . 0 0 "[ . 1 . 2 .]" 1
15 1 10 PRO HA 1 10 PRO QD 1.800 . 6.300 3.404 3.336 3.487 . 0 0 "[ . 1 . 2 .]" 1
16 1 10 PRO QD 1 10 PRO QG 1.800 . 4.802 1.955 1.936 1.968 . 0 0 "[ . 1 . 2 .]" 1
17 1 10 PRO QB 1 11 HIS HA 1.800 . 6.300 3.913 3.753 4.717 . 0 0 "[ . 1 . 2 .]" 1
18 1 10 PRO QG 1 11 HIS HA 1.800 . 7.420 4.233 3.772 4.402 . 0 0 "[ . 1 . 2 .]" 1
19 1 10 PRO QB 1 11 HIS HB2 1.800 . 6.300 5.535 5.449 5.711 . 0 0 "[ . 1 . 2 .]" 1
20 1 10 PRO QB 1 12 PRO QD 1.800 . 7.700 2.759 2.525 3.107 . 0 0 "[ . 1 . 2 .]" 1
21 1 10 PRO QD 1 12 PRO QD 1.800 . 7.700 4.986 3.690 5.250 . 0 0 "[ . 1 . 2 .]" 1
22 1 10 PRO QG 1 12 PRO QD 1.800 . 4.802 3.441 2.264 3.734 . 0 0 "[ . 1 . 2 .]" 1
23 1 10 PRO QB 1 12 PRO QG 1.800 . 6.058 4.409 4.159 4.532 . 0 0 "[ . 1 . 2 .]" 1
24 1 11 HIS HA 1 12 PRO HA 1.800 . 5.000 4.608 4.552 4.639 . 0 0 "[ . 1 . 2 .]" 1
25 1 11 HIS HA 1 12 PRO QB 1.800 . 6.300 4.786 4.706 4.840 . 0 0 "[ . 1 . 2 .]" 1
26 1 11 HIS HA 1 12 PRO QD 1.800 . 3.724 2.022 1.957 2.120 . 0 0 "[ . 1 . 2 .]" 1
27 1 11 HIS HB3 1 12 PRO QD 1.800 . 6.300 4.158 4.078 4.220 . 0 0 "[ . 1 . 2 .]" 1
28 1 11 HIS HB2 1 12 PRO QD 1.800 . 6.300 4.055 3.817 4.193 . 0 0 "[ . 1 . 2 .]" 1
29 1 11 HIS HA 1 12 PRO QG 1.800 . 4.396 3.916 3.851 4.017 . 0 0 "[ . 1 . 2 .]" 1
30 1 12 PRO QD 1 12 PRO QG 1.800 . 4.802 1.959 1.949 1.970 . 0 0 "[ . 1 . 2 .]" 1
31 1 11 HIS HB2 1 14 ILE QG 1.800 . 6.400 4.265 3.562 5.279 . 0 0 "[ . 1 . 2 .]" 1
32 1 12 PRO QB 1 14 ILE H 1.800 . 6.300 4.965 4.223 5.625 . 0 0 "[ . 1 . 2 .]" 1
33 1 14 ILE HA 1 14 ILE MD 1.800 . 4.360 3.727 3.667 3.768 . 0 0 "[ . 1 . 2 .]" 1
34 1 14 ILE HB 1 14 ILE MD 1.800 . 3.640 2.399 2.293 2.493 . 0 0 "[ . 1 . 2 .]" 1
35 1 14 ILE HA 1 14 ILE QG 1.800 . 6.400 2.264 2.110 2.322 . 0 0 "[ . 1 . 2 .]" 1
36 1 14 ILE MD 1 14 ILE QG 1.800 . 4.688 1.908 1.881 1.922 . 0 0 "[ . 1 . 2 .]" 1
37 1 14 ILE HA 1 14 ILE MG 1.800 . 3.640 2.498 2.404 2.789 . 0 0 "[ . 1 . 2 .]" 1
38 1 14 ILE HA 1 15 GLU HA 1.800 . 5.000 4.473 4.462 4.492 . 0 0 "[ . 1 . 2 .]" 1
39 1 14 ILE MG 1 15 GLU HA 1.800 . 6.400 3.949 3.796 4.059 . 0 0 "[ . 1 . 2 .]" 1
40 1 15 GLU HA 1 15 GLU QG 1.800 . 4.396 2.322 2.034 2.852 . 0 0 "[ . 1 . 2 .]" 1
41 1 15 GLU QB 1 15 GLU QG 1.800 . 5.558 2.074 2.039 2.105 . 0 0 "[ . 1 . 2 .]" 1
42 1 14 ILE MG 1 16 GLU HA 1.800 . 6.400 3.644 3.441 3.775 . 0 0 "[ . 1 . 2 .]" 1
43 1 14 ILE MG 1 16 GLU QG 1.800 . 5.555 3.166 2.585 3.454 . 0 0 "[ . 1 . 2 .]" 1
44 1 16 GLU HA 1 16 GLU QG 1.800 . 4.396 2.260 1.986 2.400 . 0 0 "[ . 1 . 2 .]" 1
45 1 16 GLU QB 1 16 GLU QG 1.800 . 5.558 2.091 2.060 2.109 . 0 0 "[ . 1 . 2 .]" 1
46 1 15 GLU HA 1 17 VAL MG2 1.800 . 6.400 4.731 4.587 4.899 . 0 0 "[ . 1 . 2 .]" 1
47 1 15 GLU QG 1 17 VAL MG2 1.800 . 5.555 3.014 2.455 3.865 . 0 0 "[ . 1 . 2 .]" 1
48 1 16 GLU HA 1 17 VAL HA 1.800 . 5.000 4.493 4.482 4.511 . 0 0 "[ . 1 . 2 .]" 1
49 1 16 GLU HA 1 17 VAL MG2 1.800 . 6.400 3.301 3.091 3.422 . 0 0 "[ . 1 . 2 .]" 1
50 1 17 VAL HA 1 17 VAL MG2 1.800 . 3.640 2.445 2.314 2.526 . 0 0 "[ . 1 . 2 .]" 1
51 1 17 VAL HA 1 18 ALA HA 1.800 . 5.000 4.467 4.455 4.486 . 0 0 "[ . 1 . 2 .]" 1
52 1 17 VAL HA 1 18 ALA MB 1.800 . 6.300 3.867 3.799 3.921 . 0 0 "[ . 1 . 2 .]" 1
53 1 17 VAL MG1 1 18 ALA MB 1.800 . 5.555 3.635 3.543 3.707 . 0 0 "[ . 1 . 2 .]" 1
54 1 18 ALA MB 1 19 LEU HA 1.800 . 6.300 4.587 4.520 4.631 . 0 0 "[ . 1 . 2 .]" 1
55 1 19 LEU HA 1 19 LEU MD1 1.800 . 4.360 2.100 1.902 2.332 . 0 0 "[ . 1 . 2 .]" 1
56 1 19 LEU QB 1 19 LEU MD1 1.800 . 7.850 2.176 2.045 2.276 . 0 0 "[ . 1 . 2 .]" 1
57 1 19 LEU HA 1 19 LEU MD2 1.800 . 5.000 3.789 3.754 3.832 . 0 0 "[ . 1 . 2 .]" 1
58 1 19 LEU QB 1 19 LEU MD2 1.800 . 7.850 2.060 2.004 2.112 . 0 0 "[ . 1 . 2 .]" 1
59 1 19 LEU MD1 1 19 LEU MD2 1.800 . 4.688 2.004 1.898 2.078 . 0 0 "[ . 1 . 2 .]" 1
60 1 18 ALA MB 1 20 SER HA 1.800 . 6.300 5.079 5.014 5.139 . 0 0 "[ . 1 . 2 .]" 1
61 1 19 LEU QB 1 20 SER HA 1.800 . 6.300 4.341 4.196 4.444 . 0 0 "[ . 1 . 2 .]" 1
62 1 20 SER HA 1 20 SER HB3 1.800 . 2.700 2.583 2.530 2.631 . 0 0 "[ . 1 . 2 .]" 1
63 1 20 SER HA 1 20 SER HB2 1.800 . 2.700 2.380 2.343 2.417 . 0 0 "[ . 1 . 2 .]" 1
64 1 20 SER QB 1 21 THR HA 1.800 . 6.000 4.811 4.684 4.896 . 0 0 "[ . 1 . 2 .]" 1
65 1 20 SER HA 1 21 THR MG 1.800 . 6.400 3.861 3.450 4.140 . 0 0 "[ . 1 . 2 .]" 1
66 1 20 SER HB2 1 21 THR MG 1.800 . 6.400 4.514 4.045 4.897 . 0 0 "[ . 1 . 2 .]" 1
67 1 21 THR HA 1 21 THR HB 1.800 . 2.700 2.587 2.468 2.662 . 0 0 "[ . 1 . 2 .]" 1
68 1 21 THR HA 1 21 THR MG 1.800 . 3.640 2.200 2.033 2.423 . 0 0 "[ . 1 . 2 .]" 1
69 1 21 THR HB 1 22 THR HA 1.800 . 5.000 4.658 4.539 4.875 . 0 0 "[ . 1 . 2 .]" 1
70 1 22 THR HA 1 22 THR MG 1.800 . 3.640 2.248 2.121 2.371 . 0 0 "[ . 1 . 2 .]" 1
71 1 22 THR HA 1 23 GLY QA 1.800 . 6.300 3.978 3.974 3.983 . 0 0 "[ . 1 . 2 .]" 1
72 1 22 THR HB 1 23 GLY QA 1.800 . 5.500 4.331 4.246 4.391 . 0 0 "[ . 1 . 2 .]" 1
73 1 22 THR MG 1 23 GLY QA 1.800 . 7.850 3.511 3.372 3.632 . 0 0 "[ . 1 . 2 .]" 1
74 1 23 GLY QA 1 24 GLU HA 1.800 . 6.300 3.992 3.987 3.999 . 0 0 "[ . 1 . 2 .]" 1
75 1 23 GLY QA 1 24 GLU QB 1.800 . 7.700 4.056 3.680 4.179 . 0 0 "[ . 1 . 2 .]" 1
76 1 24 GLU HA 1 24 GLU QG 1.800 . 6.300 2.543 2.012 2.999 . 0 0 "[ . 1 . 2 .]" 1
77 1 24 GLU QB 1 24 GLU QG 1.800 . 5.558 2.048 2.020 2.071 . 0 0 "[ . 1 . 2 .]" 1
78 1 24 GLU QB 1 25 ILE HA 1.800 . 6.300 3.998 3.875 4.066 . 0 0 "[ . 1 . 2 .]" 1
79 1 24 GLU QG 1 25 ILE HB 1.800 . 6.300 5.684 5.636 5.730 . 0 0 "[ . 1 . 2 .]" 1
80 1 25 ILE HA 1 25 ILE MD 1.800 . 4.360 3.753 3.720 3.783 . 0 0 "[ . 1 . 2 .]" 1
81 1 25 ILE HB 1 25 ILE MD 1.800 . 6.400 2.313 2.194 2.368 . 0 0 "[ . 1 . 2 .]" 1
82 1 25 ILE HA 1 25 ILE QG 1.800 . 6.400 2.450 2.428 2.480 . 0 0 "[ . 1 . 2 .]" 1
83 1 25 ILE MD 1 25 ILE QG 1.800 . 4.688 1.887 1.875 1.901 . 0 0 "[ . 1 . 2 .]" 1
84 1 25 ILE HA 1 25 ILE MG 1.800 . 4.360 3.184 3.177 3.188 . 0 0 "[ . 1 . 2 .]" 1
85 1 25 ILE MD 1 25 ILE MG 1.800 . 4.688 1.806 1.681 1.988 0.119 20 0 "[ . 1 . 2 .]" 1
86 1 24 GLU QB 1 26 PRO QD 1.800 . 5.558 4.516 4.428 4.569 . 0 0 "[ . 1 . 2 .]" 1
87 1 25 ILE HA 1 26 PRO QD 1.800 . 4.396 1.865 1.840 1.881 . 0 0 "[ . 1 . 2 .]" 1
88 1 25 ILE HB 1 26 PRO QD 1.800 . 6.300 3.921 3.814 3.993 . 0 0 "[ . 1 . 2 .]" 1
89 1 25 ILE MD 1 26 PRO QD 1.800 . 7.850 4.409 4.198 4.555 . 0 0 "[ . 1 . 2 .]" 1
90 1 25 ILE MG 1 26 PRO QD 1.800 . 7.850 4.120 4.081 4.138 . 0 0 "[ . 1 . 2 .]" 1
91 1 25 ILE QG 1 26 PRO QD 1.800 . 7.850 2.896 2.657 3.081 . 0 0 "[ . 1 . 2 .]" 1
92 1 26 PRO HA 1 26 PRO QD 1.800 . 6.300 3.311 3.282 3.336 . 0 0 "[ . 1 . 2 .]" 1
93 1 19 LEU MD2 1 27 PHE HA 1.800 . 6.400 5.019 4.643 5.325 . 0 0 "[ . 1 . 2 .]" 1
94 1 19 LEU MD1 1 27 PHE HB3 1.800 . 6.400 4.450 4.183 4.849 . 0 0 "[ . 1 . 2 .]" 1
95 1 19 LEU MD2 1 27 PHE HB3 1.800 . 4.360 2.621 2.243 3.127 . 0 0 "[ . 1 . 2 .]" 1
96 1 19 LEU MD1 1 27 PHE QD 1.800 . 7.850 3.839 3.584 4.573 . 0 0 "[ . 1 . 2 .]" 1
97 1 25 ILE QG 1 27 PHE HA 1.800 . 6.400 4.436 3.982 4.748 . 0 0 "[ . 1 . 2 .]" 1
98 1 26 PRO QB 1 27 PHE HA 1.800 . 6.300 4.229 4.033 4.499 . 0 0 "[ . 1 . 2 .]" 1
99 1 27 PHE HA 1 28 TYR HA 1.800 . 5.000 4.495 4.411 4.580 . 0 0 "[ . 1 . 2 .]" 1
100 1 27 PHE HB3 1 28 TYR QD 1.800 . 6.300 4.641 3.807 5.056 . 0 0 "[ . 1 . 2 .]" 1
101 1 28 TYR HA 1 28 TYR QD 1.800 . 6.300 2.206 1.928 3.115 . 0 0 "[ . 1 . 2 .]" 1
102 1 19 LEU QB 1 30 LYS QB 1.800 . 7.700 3.076 2.651 3.525 . 0 0 "[ . 1 . 2 .]" 1
103 1 19 LEU MD2 1 30 LYS QB 1.800 . 7.850 1.813 1.678 2.125 0.122 22 0 "[ . 1 . 2 .]" 1
104 1 19 LEU MD1 1 30 LYS QB 1.800 . 7.850 3.582 3.361 3.852 . 0 0 "[ . 1 . 2 .]" 1
105 1 19 LEU QB 1 30 LYS QD 1.800 . 7.700 2.883 1.918 3.608 . 0 0 "[ . 1 . 2 .]" 1
106 1 19 LEU HG 1 30 LYS QD 1.800 . 6.300 3.251 2.548 3.983 . 0 0 "[ . 1 . 2 .]" 1
107 1 20 SER HA 1 30 LYS HA 1.800 . 5.000 4.255 3.760 4.600 . 0 0 "[ . 1 . 2 .]" 1
108 1 20 SER HA 1 30 LYS QD 1.800 . 7.420 2.194 1.863 2.650 . 0 0 "[ . 1 . 2 .]" 1
109 1 20 SER HB3 1 30 LYS QD 1.800 . 6.300 4.318 3.973 4.897 . 0 0 "[ . 1 . 2 .]" 1
110 1 20 SER HA 1 30 LYS QE 1.800 . 6.300 2.994 1.937 4.044 . 0 0 "[ . 1 . 2 .]" 1
111 1 21 THR HA 1 30 LYS HA 1.800 . 3.300 3.130 2.997 3.282 . 0 0 "[ . 1 . 2 .]" 1
112 1 21 THR MG 1 30 LYS HA 1.800 . 3.640 2.650 2.459 2.841 . 0 0 "[ . 1 . 2 .]" 1
113 1 21 THR MG 1 30 LYS QB 1.800 . 7.850 4.294 4.148 4.456 . 0 0 "[ . 1 . 2 .]" 1
114 1 21 THR HA 1 30 LYS QD 1.800 . 6.300 3.872 3.401 4.964 . 0 0 "[ . 1 . 2 .]" 1
115 1 21 THR HA 1 30 LYS QE 1.800 . 6.300 5.219 3.923 5.675 . 0 0 "[ . 1 . 2 .]" 1
116 1 21 THR MG 1 30 LYS QE 1.800 . 7.850 3.581 2.396 4.444 . 0 0 "[ . 1 . 2 .]" 1
117 1 21 THR HA 1 30 LYS QG 1.800 . 6.300 5.332 4.790 5.598 . 0 0 "[ . 1 . 2 .]" 1
118 1 29 GLY QA 1 30 LYS HA 1.800 . 6.300 4.055 4.047 4.063 . 0 0 "[ . 1 . 2 .]" 1
119 1 29 GLY QA 1 30 LYS QB 1.800 . 7.700 4.441 4.345 4.514 . 0 0 "[ . 1 . 2 .]" 1
120 1 29 GLY QA 1 30 LYS QD 1.800 . 7.700 4.687 3.599 5.546 . 0 0 "[ . 1 . 2 .]" 1
121 1 29 GLY QA 1 30 LYS QG 1.800 . 7.700 3.362 3.101 3.624 . 0 0 "[ . 1 . 2 .]" 1
122 1 30 LYS HA 1 30 LYS QD 1.800 . 4.396 2.160 1.886 3.353 . 0 0 "[ . 1 . 2 .]" 1
123 1 30 LYS QB 1 30 LYS QD 1.800 . 7.700 2.222 1.995 2.326 . 0 0 "[ . 1 . 2 .]" 1
124 1 30 LYS QB 1 30 LYS QE 1.800 . 7.700 3.603 3.197 3.802 . 0 0 "[ . 1 . 2 .]" 1
125 1 30 LYS QD 1 30 LYS QE 1.800 . 7.700 2.074 2.049 2.113 . 0 0 "[ . 1 . 2 .]" 1
126 1 30 LYS HA 1 30 LYS QE 1.800 . 6.300 3.487 2.451 4.063 . 0 0 "[ . 1 . 2 .]" 1
127 1 30 LYS QB 1 30 LYS QG 1.800 . 5.558 2.040 2.020 2.063 . 0 0 "[ . 1 . 2 .]" 1
128 1 30 LYS QD 1 30 LYS QG 1.800 . 5.558 2.087 2.053 2.108 . 0 0 "[ . 1 . 2 .]" 1
129 1 30 LYS QE 1 30 LYS QG 1.800 . 5.558 2.083 1.908 2.216 . 0 0 "[ . 1 . 2 .]" 1
130 1 30 LYS HA 1 30 LYS QG 1.800 . 6.300 2.664 2.155 2.922 . 0 0 "[ . 1 . 2 .]" 1
131 1 21 THR HA 1 31 ALA MB 1.800 . 4.396 1.997 1.906 2.334 . 0 0 "[ . 1 . 2 .]" 1
132 1 21 THR HB 1 31 ALA MB 1.800 . 6.300 3.421 3.195 3.635 . 0 0 "[ . 1 . 2 .]" 1
133 1 21 THR MG 1 31 ALA MB 1.800 . 7.850 3.292 2.945 3.631 . 0 0 "[ . 1 . 2 .]" 1
134 1 22 THR HA 1 31 ALA MB 1.800 . 4.396 3.224 3.047 3.398 . 0 0 "[ . 1 . 2 .]" 1
135 1 23 GLY QA 1 31 ALA MB 1.800 . 4.802 3.108 2.985 3.228 . 0 0 "[ . 1 . 2 .]" 1
136 1 26 PRO HA 1 31 ALA HA 1.800 . 3.300 2.324 2.030 2.510 . 0 0 "[ . 1 . 2 .]" 1
137 1 26 PRO QB 1 31 ALA HA 1.800 . 6.300 4.137 3.803 4.347 . 0 0 "[ . 1 . 2 .]" 1
138 1 26 PRO QG 1 31 ALA HA 1.800 . 6.300 5.478 5.217 5.658 . 0 0 "[ . 1 . 2 .]" 1
139 1 26 PRO HA 1 31 ALA MB 1.800 . 4.396 3.310 3.172 3.579 . 0 0 "[ . 1 . 2 .]" 1
140 1 27 PHE HB3 1 31 ALA HA 1.800 . 5.000 4.107 4.012 4.170 . 0 0 "[ . 1 . 2 .]" 1
141 1 27 PHE HB3 1 31 ALA MB 1.800 . 6.300 5.342 5.255 5.398 . 0 0 "[ . 1 . 2 .]" 1
142 1 30 LYS HA 1 31 ALA MB 1.800 . 6.300 3.842 3.772 3.924 . 0 0 "[ . 1 . 2 .]" 1
143 1 30 LYS QB 1 31 ALA MB 1.800 . 7.700 4.353 4.281 4.396 . 0 0 "[ . 1 . 2 .]" 1
144 1 19 LEU QB 1 32 ILE HA 1.800 . 6.300 5.417 5.235 5.573 . 0 0 "[ . 1 . 2 .]" 1
145 1 19 LEU MD1 1 32 ILE HA 1.800 . 6.400 2.451 2.045 2.829 . 0 0 "[ . 1 . 2 .]" 1
146 1 19 LEU MD2 1 32 ILE HA 1.800 . 6.400 3.731 3.366 3.983 . 0 0 "[ . 1 . 2 .]" 1
147 1 19 LEU MD1 1 32 ILE MD 1.800 . 8.000 3.223 3.022 3.379 . 0 0 "[ . 1 . 2 .]" 1
148 1 19 LEU MD2 1 32 ILE QG 1.800 . 5.552 2.320 1.906 2.659 . 0 0 "[ . 1 . 2 .]" 1
149 1 19 LEU MD1 1 32 ILE QG 1.800 . 8.000 1.974 1.827 2.227 . 0 0 "[ . 1 . 2 .]" 1
150 1 19 LEU MD1 1 32 ILE MG 1.800 . 5.552 3.520 3.405 3.645 . 0 0 "[ . 1 . 2 .]" 1
151 1 25 ILE HB 1 32 ILE HB 1.800 . 5.000 4.380 4.362 4.410 . 0 0 "[ . 1 . 2 .]" 1
152 1 25 ILE MD 1 32 ILE HB 1.800 . 4.360 3.405 3.296 3.478 . 0 0 "[ . 1 . 2 .]" 1
153 1 25 ILE HB 1 32 ILE MD 1.800 . 6.400 5.123 5.068 5.172 . 0 0 "[ . 1 . 2 .]" 1
154 1 25 ILE MD 1 32 ILE MD 1.800 . 8.000 2.904 2.775 2.999 . 0 0 "[ . 1 . 2 .]" 1
155 1 25 ILE MG 1 32 ILE MD 1.800 . 5.552 2.828 2.727 2.991 . 0 0 "[ . 1 . 2 .]" 1
156 1 25 ILE HB 1 32 ILE MG 1.800 . 5.000 4.011 3.992 4.042 . 0 0 "[ . 1 . 2 .]" 1
157 1 25 ILE MD 1 32 ILE MG 1.800 . 4.688 2.825 2.714 2.929 . 0 0 "[ . 1 . 2 .]" 1
158 1 25 ILE QG 1 32 ILE MG 1.800 . 8.000 3.639 3.486 3.708 . 0 0 "[ . 1 . 2 .]" 1
159 1 25 ILE MG 1 32 ILE MG 1.800 . 5.552 1.785 1.767 1.797 0.033 20 0 "[ . 1 . 2 .]" 1
160 1 27 PHE HB3 1 32 ILE MD 1.800 . 6.400 3.524 3.025 4.177 . 0 0 "[ . 1 . 2 .]" 1
161 1 27 PHE QE 1 32 ILE MD 1.800 . 7.850 3.311 2.880 3.818 . 0 0 "[ . 1 . 2 .]" 1
162 1 27 PHE HA 1 32 ILE QG 1.800 . 6.400 4.807 4.303 5.284 . 0 0 "[ . 1 . 2 .]" 1
163 1 32 ILE HA 1 32 ILE MD 1.800 . 6.400 3.717 3.700 3.729 . 0 0 "[ . 1 . 2 .]" 1
164 1 32 ILE HB 1 32 ILE MD 1.800 . 4.360 2.337 2.295 2.384 . 0 0 "[ . 1 . 2 .]" 1
165 1 32 ILE HA 1 32 ILE QG 1.800 . 4.360 2.200 2.179 2.212 . 0 0 "[ . 1 . 2 .]" 1
166 1 32 ILE MD 1 32 ILE QG 1.800 . 8.000 1.906 1.894 1.918 . 0 0 "[ . 1 . 2 .]" 1
167 1 32 ILE HA 1 32 ILE MG 1.800 . 4.360 2.676 2.642 2.703 . 0 0 "[ . 1 . 2 .]" 1
168 1 32 ILE MD 1 32 ILE MG 1.800 . 4.688 1.902 1.825 1.944 . 0 0 "[ . 1 . 2 .]" 1
169 1 32 ILE QG 1 32 ILE MG 1.800 . 5.552 2.347 2.316 2.387 . 0 0 "[ . 1 . 2 .]" 1
170 1 19 LEU MD1 1 33 PRO QD 1.800 . 7.850 2.599 2.224 2.856 . 0 0 "[ . 1 . 2 .]" 1
171 1 19 LEU HG 1 33 PRO QG 1.800 . 6.300 5.568 5.411 5.658 . 0 0 "[ . 1 . 2 .]" 1
172 1 22 THR HB 1 33 PRO QD 1.800 . 3.724 3.013 2.994 3.040 . 0 0 "[ . 1 . 2 .]" 1
173 1 23 GLY QA 1 33 PRO HA 1.800 . 5.000 1.758 1.746 1.785 0.054 19 0 "[ . 1 . 2 .]" 1
174 1 23 GLY QA 1 33 PRO QB 1.800 . 7.700 2.781 2.729 2.829 . 0 0 "[ . 1 . 2 .]" 1
175 1 23 GLY QA 1 33 PRO QD 1.800 . 7.700 3.419 3.378 3.448 . 0 0 "[ . 1 . 2 .]" 1
176 1 23 GLY QA 1 33 PRO QG 1.800 . 7.700 4.121 4.080 4.158 . 0 0 "[ . 1 . 2 .]" 1
177 1 31 ALA MB 1 33 PRO HA 1.800 . 6.300 4.708 4.621 4.796 . 0 0 "[ . 1 . 2 .]" 1
178 1 31 ALA MB 1 33 PRO QB 1.800 . 7.700 4.886 4.772 5.020 . 0 0 "[ . 1 . 2 .]" 1
179 1 32 ILE MG 1 33 PRO HA 1.800 . 6.400 4.019 3.989 4.053 . 0 0 "[ . 1 . 2 .]" 1
180 1 32 ILE HA 1 33 PRO QD 1.800 . 4.396 1.912 1.891 1.942 . 0 0 "[ . 1 . 2 .]" 1
181 1 32 ILE MG 1 33 PRO QD 1.800 . 7.850 3.054 3.005 3.082 . 0 0 "[ . 1 . 2 .]" 1
182 1 32 ILE HA 1 33 PRO QG 1.800 . 6.300 3.821 3.798 3.849 . 0 0 "[ . 1 . 2 .]" 1
183 1 33 PRO HA 1 33 PRO QD 1.800 . 6.300 3.383 3.363 3.408 . 0 0 "[ . 1 . 2 .]" 1
184 1 33 PRO QD 1 33 PRO QG 1.800 . 5.558 1.968 1.961 1.973 . 0 0 "[ . 1 . 2 .]" 1
185 1 24 GLU QB 1 34 LEU QB 1.800 . 7.700 4.573 4.185 5.002 . 0 0 "[ . 1 . 2 .]" 1
186 1 24 GLU QG 1 34 LEU QB 1.800 . 7.700 4.508 3.789 5.965 . 0 0 "[ . 1 . 2 .]" 1
187 1 24 GLU QG 1 34 LEU MD1 1.800 . 7.850 3.470 3.014 4.333 . 0 0 "[ . 1 . 2 .]" 1
188 1 24 GLU QG 1 34 LEU MD2 1.800 . 7.850 4.426 4.043 5.186 . 0 0 "[ . 1 . 2 .]" 1
189 1 25 ILE MG 1 34 LEU HA 1.800 . 4.360 3.521 3.470 3.606 . 0 0 "[ . 1 . 2 .]" 1
190 1 25 ILE HB 1 34 LEU MD2 1.800 . 6.400 2.834 2.647 3.027 . 0 0 "[ . 1 . 2 .]" 1
191 1 25 ILE MD 1 34 LEU MD2 1.800 . 4.688 3.109 3.012 3.184 . 0 0 "[ . 1 . 2 .]" 1
192 1 25 ILE MG 1 34 LEU MD2 1.800 . 4.688 1.862 1.836 1.933 . 0 0 "[ . 1 . 2 .]" 1
193 1 32 ILE MG 1 34 LEU HA 1.800 . 6.400 3.188 3.117 3.258 . 0 0 "[ . 1 . 2 .]" 1
194 1 34 LEU HA 1 34 LEU MD1 1.800 . 4.360 3.644 3.576 3.683 . 0 0 "[ . 1 . 2 .]" 1
195 1 34 LEU QB 1 34 LEU MD1 1.800 . 4.745 2.032 1.965 2.093 . 0 0 "[ . 1 . 2 .]" 1
196 1 34 LEU HA 1 34 LEU MD2 1.800 . 3.640 1.876 1.829 1.925 . 0 0 "[ . 1 . 2 .]" 1
197 1 34 LEU QB 1 34 LEU MD2 1.800 . 4.745 2.454 2.385 2.528 . 0 0 "[ . 1 . 2 .]" 1
198 1 34 LEU MD1 1 34 LEU MD2 1.800 . 4.688 1.992 1.882 2.064 . 0 0 "[ . 1 . 2 .]" 1
199 1 34 LEU QB 1 35 GLU HA 1.800 . 6.300 4.025 3.998 4.054 . 0 0 "[ . 1 . 2 .]" 1
200 1 35 GLU HA 1 35 GLU QG 1.800 . 4.396 3.327 3.306 3.371 . 0 0 "[ . 1 . 2 .]" 1
201 1 35 GLU QB 1 35 GLU QG 1.800 . 4.802 2.075 2.048 2.108 . 0 0 "[ . 1 . 2 .]" 1
202 1 19 LEU MD1 1 36 VAL MG2 1.800 . 5.188 3.496 3.425 3.570 . 0 0 "[ . 1 . 2 .]" 1
203 1 32 ILE HA 1 36 VAL MG2 1.800 . 6.400 3.394 3.300 3.467 . 0 0 "[ . 1 . 2 .]" 1
204 1 32 ILE MG 1 36 VAL MG2 1.800 . 4.688 1.845 1.782 1.961 0.018 16 0 "[ . 1 . 2 .]" 1
205 1 33 PRO QD 1 36 VAL HB 1.800 . 6.300 4.714 4.556 4.908 . 0 0 "[ . 1 . 2 .]" 1
206 1 33 PRO QD 1 36 VAL MG1 1.800 . 7.850 2.592 2.407 2.821 . 0 0 "[ . 1 . 2 .]" 1
207 1 33 PRO QG 1 36 VAL MG1 1.800 . 5.555 1.783 1.751 1.838 0.049 19 0 "[ . 1 . 2 .]" 1
208 1 33 PRO QB 1 36 VAL MG2 1.800 . 7.850 4.012 3.875 4.099 . 0 0 "[ . 1 . 2 .]" 1
209 1 33 PRO QD 1 36 VAL MG2 1.800 . 5.555 2.646 2.478 2.765 . 0 0 "[ . 1 . 2 .]" 1
210 1 33 PRO QG 1 36 VAL MG2 1.800 . 5.555 2.861 2.696 2.967 . 0 0 "[ . 1 . 2 .]" 1
211 1 35 GLU HA 1 36 VAL HA 1.800 . 5.000 4.702 4.683 4.720 . 0 0 "[ . 1 . 2 .]" 1
212 1 35 GLU QB 1 36 VAL HA 1.800 . 6.300 4.548 4.474 4.633 . 0 0 "[ . 1 . 2 .]" 1
213 1 35 GLU QG 1 36 VAL MG1 1.800 . 4.745 1.930 1.890 1.986 . 0 0 "[ . 1 . 2 .]" 1
214 1 35 GLU HA 1 36 VAL MG2 1.800 . 6.400 4.933 4.857 5.011 . 0 0 "[ . 1 . 2 .]" 1
215 1 35 GLU QG 1 36 VAL MG2 1.800 . 7.850 3.467 3.393 3.542 . 0 0 "[ . 1 . 2 .]" 1
216 1 36 VAL HA 1 36 VAL HB 1.800 . 2.700 2.436 2.422 2.446 . 0 0 "[ . 1 . 2 .]" 1
217 1 36 VAL HA 1 36 VAL MG1 1.800 . 3.640 2.463 2.426 2.490 . 0 0 "[ . 1 . 2 .]" 1
218 1 36 VAL HA 1 36 VAL MG2 1.800 . 4.360 3.194 3.189 3.198 . 0 0 "[ . 1 . 2 .]" 1
219 1 32 ILE MD 1 37 ILE HB 1.800 . 6.400 5.246 5.167 5.304 . 0 0 "[ . 1 . 2 .]" 1
220 1 32 ILE HB 1 37 ILE MD 1.800 . 6.400 4.416 3.954 4.874 . 0 0 "[ . 1 . 2 .]" 1
221 1 32 ILE MD 1 37 ILE MD 1.800 . 8.000 3.586 3.292 3.948 . 0 0 "[ . 1 . 2 .]" 1
222 1 32 ILE MG 1 37 ILE MD 1.800 . 4.688 2.492 2.104 2.956 . 0 0 "[ . 1 . 2 .]" 1
223 1 32 ILE MD 1 37 ILE MG 1.800 . 8.000 2.946 2.863 3.038 . 0 0 "[ . 1 . 2 .]" 1
224 1 32 ILE MG 1 37 ILE MG 1.800 . 8.000 2.232 2.116 2.376 . 0 0 "[ . 1 . 2 .]" 1
225 1 34 LEU HA 1 37 ILE MD 1.800 . 4.360 3.004 2.697 3.206 . 0 0 "[ . 1 . 2 .]" 1
226 1 34 LEU HA 1 37 ILE QG 1.800 . 6.400 2.107 1.914 2.251 . 0 0 "[ . 1 . 2 .]" 1
227 1 34 LEU QB 1 37 ILE QG 1.800 . 7.850 3.412 3.239 3.566 . 0 0 "[ . 1 . 2 .]" 1
228 1 34 LEU HA 1 37 ILE H 1.800 . 5.000 3.063 2.953 3.207 . 0 0 "[ . 1 . 2 .]" 1
229 1 36 VAL MG2 1 37 ILE HA 1.800 . 6.400 3.673 3.638 3.699 . 0 0 "[ . 1 . 2 .]" 1
230 1 36 VAL MG2 1 37 ILE HB 1.800 . 4.860 4.016 4.000 4.030 . 0 0 "[ . 1 . 2 .]" 1
231 1 36 VAL MG2 1 37 ILE MD 1.800 . 5.552 3.503 3.227 3.783 . 0 0 "[ . 1 . 2 .]" 1
232 1 36 VAL HA 1 37 ILE MG 1.800 . 6.400 4.170 4.082 4.254 . 0 0 "[ . 1 . 2 .]" 1
233 1 36 VAL HB 1 37 ILE MG 1.800 . 6.400 3.286 3.153 3.394 . 0 0 "[ . 1 . 2 .]" 1
234 1 36 VAL MG2 1 37 ILE MG 1.800 . 4.688 1.769 1.735 1.823 0.065 5 0 "[ . 1 . 2 .]" 1
235 1 36 VAL HA 1 37 ILE H 1.800 . 5.000 3.516 3.503 3.524 . 0 0 "[ . 1 . 2 .]" 1
236 1 36 VAL MG2 1 37 ILE H 1.800 . 6.400 1.914 1.898 1.925 . 0 0 "[ . 1 . 2 .]" 1
237 1 37 ILE HB 1 37 ILE MD 1.800 . 4.360 2.228 2.117 2.328 . 0 0 "[ . 1 . 2 .]" 1
238 1 37 ILE MD 1 37 ILE QG 1.800 . 4.688 1.904 1.880 1.915 . 0 0 "[ . 1 . 2 .]" 1
239 1 37 ILE HA 1 37 ILE MG 1.800 . 3.640 2.331 2.259 2.398 . 0 0 "[ . 1 . 2 .]" 1
240 1 37 ILE MD 1 37 ILE MG 1.800 . 8.000 2.180 1.977 2.385 . 0 0 "[ . 1 . 2 .]" 1
241 1 37 ILE QG 1 37 ILE MG 1.800 . 5.552 2.098 1.968 2.285 . 0 0 "[ . 1 . 2 .]" 1
242 1 37 ILE H 1 37 ILE MD 1.800 . 6.400 3.767 3.621 3.883 . 0 0 "[ . 1 . 2 .]" 1
243 1 37 ILE H 1 37 ILE MG 1.800 . 6.400 2.640 2.592 2.697 . 0 0 "[ . 1 . 2 .]" 1
244 1 34 LEU MD1 1 38 LYS HA 1.800 . 6.400 5.183 5.122 5.248 . 0 0 "[ . 1 . 2 .]" 1
245 1 34 LEU QB 1 38 LYS QB 1.800 . 8.960 2.064 1.888 2.196 . 0 0 "[ . 1 . 2 .]" 1
246 1 34 LEU MD1 1 38 LYS QB 1.800 . 7.850 3.019 2.914 3.156 . 0 0 "[ . 1 . 2 .]" 1
247 1 34 LEU MD1 1 38 LYS QD 1.800 . 5.555 3.663 2.547 3.905 . 0 0 "[ . 1 . 2 .]" 1
248 1 34 LEU MD1 1 38 LYS QG 1.800 . 7.850 3.315 2.743 3.872 . 0 0 "[ . 1 . 2 .]" 1
249 1 35 GLU HA 1 38 LYS QB 1.800 . 4.396 3.375 3.190 3.529 . 0 0 "[ . 1 . 2 .]" 1
250 1 37 ILE QG 1 38 LYS HA 1.800 . 4.360 3.471 3.375 3.553 . 0 0 "[ . 1 . 2 .]" 1
251 1 37 ILE QG 1 38 LYS QB 1.800 . 7.850 2.736 2.511 2.861 . 0 0 "[ . 1 . 2 .]" 1
252 1 37 ILE HB 1 38 LYS QB 1.800 . 5.500 4.913 4.808 4.973 . 0 0 "[ . 1 . 2 .]" 1
253 1 37 ILE MD 1 38 LYS QB 1.800 . 7.850 3.821 3.630 4.011 . 0 0 "[ . 1 . 2 .]" 1
254 1 38 LYS HA 1 38 LYS QD 1.800 . 6.300 2.460 1.912 3.966 . 0 0 "[ . 1 . 2 .]" 1
255 1 38 LYS QB 1 38 LYS QD 1.800 . 5.558 2.225 1.886 2.370 . 0 0 "[ . 1 . 2 .]" 1
256 1 38 LYS QB 1 38 LYS QE 1.800 . 7.700 3.581 2.849 3.744 . 0 0 "[ . 1 . 2 .]" 1
257 1 38 LYS QD 1 38 LYS QE 1.800 . 4.802 2.073 2.058 2.113 . 0 0 "[ . 1 . 2 .]" 1
258 1 38 LYS HA 1 38 LYS QG 1.800 . 4.396 2.728 2.100 3.035 . 0 0 "[ . 1 . 2 .]" 1
259 1 38 LYS QB 1 38 LYS QG 1.800 . 4.802 2.038 2.026 2.056 . 0 0 "[ . 1 . 2 .]" 1
260 1 38 LYS QD 1 38 LYS QG 1.800 . 4.802 2.076 2.048 2.092 . 0 0 "[ . 1 . 2 .]" 1
261 1 38 LYS QE 1 38 LYS QG 1.800 . 5.558 2.002 1.916 2.136 . 0 0 "[ . 1 . 2 .]" 1
262 1 39 GLY QA 1 40 GLY QA 1.800 . 7.700 3.706 3.701 3.710 . 0 0 "[ . 1 . 2 .]" 1
263 1 41 ARG QB 1 41 ARG QD 1.800 . 7.700 2.060 1.909 2.154 . 0 0 "[ . 1 . 2 .]" 1
264 1 41 ARG QD 1 41 ARG QG 1.800 . 7.700 2.092 2.063 2.114 . 0 0 "[ . 1 . 2 .]" 1
265 1 37 ILE MG 1 42 HIS HB3 1.800 . 6.400 3.059 2.916 3.235 . 0 0 "[ . 1 . 2 .]" 1
266 1 37 ILE MG 1 42 HIS HB2 1.800 . 6.400 3.183 2.977 3.343 . 0 0 "[ . 1 . 2 .]" 1
267 1 37 ILE HA 1 42 HIS HD1 1.800 . 6.300 2.614 2.218 2.940 . 0 0 "[ . 1 . 2 .]" 1
268 1 37 ILE MG 1 42 HIS HD1 1.800 . 7.850 3.923 3.801 4.116 . 0 0 "[ . 1 . 2 .]" 1
269 1 41 ARG HA 1 42 HIS H 1.800 . 3.000 2.235 2.222 2.248 . 0 0 "[ . 1 . 2 .]" 1
270 1 42 HIS HA 1 43 LEU H 1.800 . 3.000 2.296 2.263 2.331 . 0 0 "[ . 1 . 2 .]" 1
271 1 43 LEU HA 1 43 LEU MD1 1.800 . 6.400 2.165 1.929 2.401 . 0 0 "[ . 1 . 2 .]" 1
272 1 43 LEU QB 1 43 LEU MD1 1.800 . 5.555 2.173 2.040 2.294 . 0 0 "[ . 1 . 2 .]" 1
273 1 43 LEU HA 1 43 LEU MD2 1.800 . 6.400 3.863 3.817 3.904 . 0 0 "[ . 1 . 2 .]" 1
274 1 43 LEU QB 1 43 LEU MD2 1.800 . 5.555 2.088 2.035 2.110 . 0 0 "[ . 1 . 2 .]" 1
275 1 43 LEU MD1 1 43 LEU MD2 1.800 . 5.552 2.036 1.926 2.078 . 0 0 "[ . 1 . 2 .]" 1
276 1 43 LEU H 1 43 LEU MD1 1.800 . 7.600 4.252 4.188 4.342 . 0 0 "[ . 1 . 2 .]" 1
277 1 27 PHE QD 1 44 ILE MG 1.800 . 7.850 4.025 3.502 4.556 . 0 0 "[ . 1 . 2 .]" 1
278 1 27 PHE HZ 1 44 ILE MG 1.800 . 6.400 2.930 2.425 3.755 . 0 0 "[ . 1 . 2 .]" 1
279 1 28 TYR QE 1 44 ILE MG 1.800 . 7.850 4.694 4.239 5.268 . 0 0 "[ . 1 . 2 .]" 1
280 1 32 ILE MD 1 44 ILE MD 1.800 . 5.552 2.740 2.493 2.909 . 0 0 "[ . 1 . 2 .]" 1
281 1 32 ILE MD 1 44 ILE MG 1.800 . 5.552 2.674 2.483 2.861 . 0 0 "[ . 1 . 2 .]" 1
282 1 37 ILE HB 1 44 ILE MD 1.800 . 6.400 3.220 3.054 3.432 . 0 0 "[ . 1 . 2 .]" 1
283 1 37 ILE MG 1 44 ILE QG 1.800 . 8.000 2.674 2.352 3.280 . 0 0 "[ . 1 . 2 .]" 1
284 1 43 LEU HG 1 44 ILE HA 1.800 . 5.000 4.087 3.911 4.206 . 0 0 "[ . 1 . 2 .]" 1
285 1 43 LEU QB 1 44 ILE QG 1.800 . 7.850 4.850 4.716 5.023 . 0 0 "[ . 1 . 2 .]" 1
286 1 43 LEU HA 1 44 ILE H 1.800 . 3.000 2.218 2.203 2.231 . 0 0 "[ . 1 . 2 .]" 1
287 1 43 LEU MD1 1 44 ILE H 1.800 . 4.000 2.857 2.415 3.117 . 0 0 "[ . 1 . 2 .]" 1
288 1 44 ILE HA 1 44 ILE MD 1.800 . 6.400 3.373 1.928 3.829 . 0 0 "[ . 1 . 2 .]" 1
289 1 44 ILE HB 1 44 ILE MD 1.800 . 6.400 2.583 2.330 3.204 . 0 0 "[ . 1 . 2 .]" 1
290 1 44 ILE HA 1 44 ILE QG 1.800 . 6.400 2.600 2.413 3.131 . 0 0 "[ . 1 . 2 .]" 1
291 1 44 ILE MD 1 44 ILE QG 1.800 . 5.552 1.884 1.878 1.908 . 0 0 "[ . 1 . 2 .]" 1
292 1 44 ILE HA 1 44 ILE MG 1.800 . 4.360 2.293 2.107 2.408 . 0 0 "[ . 1 . 2 .]" 1
293 1 44 ILE MD 1 44 ILE MG 1.800 . 4.688 1.908 1.683 2.026 0.117 18 0 "[ . 1 . 2 .]" 1
294 1 44 ILE H 1 44 ILE HA 1.800 . 3.000 2.981 2.971 2.995 . 0 0 "[ . 1 . 2 .]" 1
295 1 44 ILE H 1 44 ILE HB 1.800 . 3.000 2.518 2.434 2.667 . 0 0 "[ . 1 . 2 .]" 1
296 1 44 ILE H 1 44 ILE MD 1.800 . 5.200 3.572 3.088 3.794 . 0 0 "[ . 1 . 2 .]" 1
297 1 44 ILE H 1 44 ILE MG 1.800 . 5.000 3.781 3.759 3.808 . 0 0 "[ . 1 . 2 .]" 1
298 1 43 LEU MD1 1 45 PHE QE 1.800 . 7.850 4.012 3.574 4.272 . 0 0 "[ . 1 . 2 .]" 1
299 1 43 LEU MD2 1 45 PHE QE 1.800 . 5.555 2.376 1.874 2.675 . 0 0 "[ . 1 . 2 .]" 1
300 1 44 ILE HA 1 45 PHE H 1.800 . 3.000 2.189 2.171 2.222 . 0 0 "[ . 1 . 2 .]" 1
301 1 44 ILE MG 1 45 PHE H 1.800 . 4.000 2.696 2.513 2.929 . 0 0 "[ . 1 . 2 .]" 1
302 1 45 PHE HA 1 45 PHE QD 1.800 . 6.300 2.295 2.022 2.731 . 0 0 "[ . 1 . 2 .]" 1
303 1 28 TYR QE 1 46 CYS HA 1.800 . 6.300 2.895 1.951 4.502 . 0 0 "[ . 1 . 2 .]" 1
304 1 45 PHE HB3 1 46 CYS HA 1.800 . 5.000 4.559 4.473 4.673 . 0 0 "[ . 1 . 2 .]" 1
305 1 45 PHE HA 1 46 CYS H 1.800 . 3.000 2.211 2.198 2.219 . 0 0 "[ . 1 . 2 .]" 1
306 1 46 CYS H 1 46 CYS HB2 1.800 . 4.000 2.277 2.257 2.303 . 0 0 "[ . 1 . 2 .]" 1
307 1 47 HIS HA 1 47 HIS HD1 1.800 . 6.300 3.848 3.613 3.940 . 0 0 "[ . 1 . 2 .]" 1
308 1 46 CYS HB3 1 48 SER HA 1.800 . 5.000 5.078 5.031 5.139 0.139 17 0 "[ . 1 . 2 .]" 1
309 1 47 HIS HD1 1 48 SER HB3 1.800 . 6.300 2.685 1.962 3.541 . 0 0 "[ . 1 . 2 .]" 1
310 1 48 SER HB3 1 49 LYS QB 1.800 . 6.300 5.591 5.466 5.670 . 0 0 "[ . 1 . 2 .]" 1
311 1 48 SER HA 1 49 LYS QB 1.800 . 4.396 3.959 3.858 4.026 . 0 0 "[ . 1 . 2 .]" 1
312 1 49 LYS HA 1 49 LYS QD 1.800 . 6.300 3.844 3.022 4.055 . 0 0 "[ . 1 . 2 .]" 1
313 1 49 LYS QB 1 49 LYS QD 1.800 . 5.558 2.111 1.917 2.325 . 0 0 "[ . 1 . 2 .]" 1
314 1 49 LYS QB 1 49 LYS QE 1.800 . 5.558 2.808 2.096 3.529 . 0 0 "[ . 1 . 2 .]" 1
315 1 49 LYS QD 1 49 LYS QE 1.800 . 5.558 2.088 2.060 2.114 . 0 0 "[ . 1 . 2 .]" 1
316 1 49 LYS HA 1 49 LYS QG 1.800 . 4.396 2.242 2.043 2.482 . 0 0 "[ . 1 . 2 .]" 1
317 1 49 LYS QB 1 49 LYS QG 1.800 . 5.558 2.095 2.048 2.109 . 0 0 "[ . 1 . 2 .]" 1
318 1 49 LYS QD 1 49 LYS QG 1.800 . 5.558 2.055 2.038 2.077 . 0 0 "[ . 1 . 2 .]" 1
319 1 49 LYS QE 1 49 LYS QG 1.800 . 4.802 2.089 1.911 2.244 . 0 0 "[ . 1 . 2 .]" 1
320 1 48 SER HA 1 50 LYS QB 1.800 . 6.300 5.097 4.956 5.235 . 0 0 "[ . 1 . 2 .]" 1
321 1 48 SER HB3 1 50 LYS QD 1.800 . 6.300 4.933 4.385 5.367 . 0 0 "[ . 1 . 2 .]" 1
322 1 49 LYS QG 1 50 LYS HA 1.800 . 6.300 4.243 3.426 5.178 . 0 0 "[ . 1 . 2 .]" 1
323 1 50 LYS HA 1 50 LYS QD 1.800 . 6.300 3.774 3.329 4.036 . 0 0 "[ . 1 . 2 .]" 1
324 1 50 LYS HA 1 50 LYS QE 1.800 . 6.300 4.496 3.677 4.795 . 0 0 "[ . 1 . 2 .]" 1
325 1 50 LYS QD 1 50 LYS QE 1.800 . 4.802 2.078 2.057 2.113 . 0 0 "[ . 1 . 2 .]" 1
326 1 50 LYS HA 1 50 LYS QG 1.800 . 4.396 2.203 2.036 2.429 . 0 0 "[ . 1 . 2 .]" 1
327 1 50 LYS QB 1 50 LYS QG 1.800 . 5.558 2.068 2.051 2.107 . 0 0 "[ . 1 . 2 .]" 1
328 1 50 LYS QD 1 50 LYS QG 1.800 . 4.802 2.082 2.040 2.108 . 0 0 "[ . 1 . 2 .]" 1
329 1 50 LYS QE 1 50 LYS QG 1.800 . 4.802 2.078 1.913 2.298 . 0 0 "[ . 1 . 2 .]" 1
330 1 46 CYS HA 1 51 LYS QB 1.800 . 6.300 5.176 4.900 5.415 . 0 0 "[ . 1 . 2 .]" 1
331 1 46 CYS HB3 1 51 LYS QB 1.800 . 6.300 3.358 2.993 3.618 . 0 0 "[ . 1 . 2 .]" 1
332 1 46 CYS HB2 1 51 LYS QB 1.800 . 6.300 4.668 4.145 4.997 . 0 0 "[ . 1 . 2 .]" 1
333 1 50 LYS QB 1 51 LYS QB 1.800 . 4.802 3.787 3.665 3.883 . 0 0 "[ . 1 . 2 .]" 1
334 1 50 LYS QB 1 51 LYS QE 1.800 . 7.700 5.476 4.216 6.195 . 0 0 "[ . 1 . 2 .]" 1
335 1 51 LYS HA 1 51 LYS QD 1.800 . 6.300 2.846 1.906 3.910 . 0 0 "[ . 1 . 2 .]" 1
336 1 51 LYS QB 1 51 LYS QD 1.800 . 5.558 2.145 1.894 2.592 . 0 0 "[ . 1 . 2 .]" 1
337 1 51 LYS QD 1 51 LYS QE 1.800 . 7.700 2.086 2.062 2.113 . 0 0 "[ . 1 . 2 .]" 1
338 1 51 LYS HA 1 51 LYS QE 1.800 . 6.300 3.143 1.938 4.145 . 0 0 "[ . 1 . 2 .]" 1
339 1 51 LYS QB 1 51 LYS QE 1.800 . 7.700 2.888 1.905 3.708 . 0 0 "[ . 1 . 2 .]" 1
340 1 51 LYS HA 1 51 LYS QG 1.800 . 3.724 2.537 2.299 3.048 . 0 0 "[ . 1 . 2 .]" 1
341 1 51 LYS QD 1 51 LYS QG 1.800 . 4.802 2.054 2.025 2.078 . 0 0 "[ . 1 . 2 .]" 1
342 1 51 LYS QB 1 51 LYS QG 1.800 . 4.802 2.050 2.027 2.073 . 0 0 "[ . 1 . 2 .]" 1
343 1 49 LYS HA 1 52 CYS HB3 1.800 . 5.000 4.171 3.830 4.574 . 0 0 "[ . 1 . 2 .]" 1
344 1 49 LYS HA 1 52 CYS HB2 1.800 . 5.000 2.760 2.366 3.176 . 0 0 "[ . 1 . 2 .]" 1
345 1 51 LYS HA 1 52 CYS HA 1.800 . 5.000 4.878 4.860 4.889 . 0 0 "[ . 1 . 2 .]" 1
346 1 50 LYS HA 1 53 ASP HB3 1.800 . 5.000 4.415 4.192 4.656 . 0 0 "[ . 1 . 2 .]" 1
347 1 50 LYS HA 1 53 ASP HB2 1.800 . 3.300 2.940 2.732 3.116 . 0 0 "[ . 1 . 2 .]" 1
348 1 51 LYS HA 1 53 ASP HB2 1.800 . 5.000 4.876 4.737 5.016 0.016 17 0 "[ . 1 . 2 .]" 1
349 1 50 LYS QB 1 54 GLU QG 1.800 . 7.700 3.999 3.836 4.125 . 0 0 "[ . 1 . 2 .]" 1
350 1 51 LYS HA 1 54 GLU QB 1.800 . 6.300 3.067 2.953 3.295 . 0 0 "[ . 1 . 2 .]" 1
351 1 51 LYS HA 1 54 GLU QG 1.800 . 6.300 3.153 2.849 3.398 . 0 0 "[ . 1 . 2 .]" 1
352 1 53 ASP HA 1 54 GLU HA 1.800 . 5.000 4.779 4.770 4.791 . 0 0 "[ . 1 . 2 .]" 1
353 1 53 ASP HB3 1 54 GLU HA 1.800 . 5.000 4.069 3.955 4.255 . 0 0 "[ . 1 . 2 .]" 1
354 1 54 GLU HA 1 54 GLU QG 1.800 . 4.396 2.469 2.403 2.548 . 0 0 "[ . 1 . 2 .]" 1
355 1 54 GLU QB 1 54 GLU QG 1.800 . 5.558 2.063 2.050 2.089 . 0 0 "[ . 1 . 2 .]" 1
356 1 25 ILE MD 1 55 LEU HA 1.800 . 6.400 3.528 3.118 3.882 . 0 0 "[ . 1 . 2 .]" 1
357 1 25 ILE HB 1 55 LEU MD2 1.800 . 6.400 4.295 3.844 4.656 . 0 0 "[ . 1 . 2 .]" 1
358 1 25 ILE MD 1 55 LEU HG 1.800 . 6.400 3.682 3.398 4.121 . 0 0 "[ . 1 . 2 .]" 1
359 1 26 PRO QD 1 55 LEU MD2 1.800 . 7.850 4.499 3.754 4.932 . 0 0 "[ . 1 . 2 .]" 1
360 1 27 PHE QD 1 55 LEU MD2 1.800 . 7.850 2.665 2.217 3.011 . 0 0 "[ . 1 . 2 .]" 1
361 1 32 ILE MD 1 55 LEU MD1 1.800 . 8.000 3.797 3.608 4.050 . 0 0 "[ . 1 . 2 .]" 1
362 1 44 ILE MG 1 55 LEU QB 1.800 . 7.850 4.503 4.209 4.713 . 0 0 "[ . 1 . 2 .]" 1
363 1 44 ILE MD 1 55 LEU MD1 1.800 . 5.552 2.363 1.851 3.695 . 0 0 "[ . 1 . 2 .]" 1
364 1 44 ILE MG 1 55 LEU MD1 1.800 . 4.688 2.738 2.607 2.908 . 0 0 "[ . 1 . 2 .]" 1
365 1 51 LYS QG 1 55 LEU HG 1.800 . 4.396 3.608 3.239 3.938 . 0 0 "[ . 1 . 2 .]" 1
366 1 51 LYS QD 1 55 LEU H 1.800 . 6.300 4.899 3.565 5.621 . 0 0 "[ . 1 . 2 .]" 1
367 1 52 CYS HA 1 55 LEU QB 1.800 . 7.420 2.534 2.373 2.675 . 0 0 "[ . 1 . 2 .]" 1
368 1 52 CYS HA 1 55 LEU MD1 1.800 . 6.400 4.037 3.356 4.586 . 0 0 "[ . 1 . 2 .]" 1
369 1 52 CYS HA 1 55 LEU H 1.800 . 5.000 3.779 3.605 3.967 . 0 0 "[ . 1 . 2 .]" 1
370 1 53 ASP HA 1 55 LEU QB 1.800 . 6.300 5.311 5.182 5.417 . 0 0 "[ . 1 . 2 .]" 1
371 1 54 GLU QB 1 55 LEU HA 1.800 . 6.300 3.851 3.834 3.867 . 0 0 "[ . 1 . 2 .]" 1
372 1 54 GLU QB 1 55 LEU QB 1.800 . 7.700 3.683 3.615 3.751 . 0 0 "[ . 1 . 2 .]" 1
373 1 54 GLU HA 1 55 LEU H 1.800 . 5.000 3.561 3.544 3.570 . 0 0 "[ . 1 . 2 .]" 1
374 1 54 GLU QB 1 55 LEU H 1.800 . 6.300 2.357 2.280 2.460 . 0 0 "[ . 1 . 2 .]" 1
375 1 54 GLU QG 1 55 LEU H 1.800 . 4.060 3.724 3.667 3.761 . 0 0 "[ . 1 . 2 .]" 1
376 1 55 LEU HA 1 55 LEU MD1 1.800 . 4.140 2.840 2.497 3.170 . 0 0 "[ . 1 . 2 .]" 1
377 1 55 LEU QB 1 55 LEU MD1 1.800 . 4.745 2.152 2.071 2.212 . 0 0 "[ . 1 . 2 .]" 1
378 1 55 LEU HA 1 55 LEU MD2 1.800 . 6.400 1.916 1.849 1.960 . 0 0 "[ . 1 . 2 .]" 1
379 1 55 LEU QB 1 55 LEU MD2 1.800 . 4.745 2.333 2.254 2.454 . 0 0 "[ . 1 . 2 .]" 1
380 1 55 LEU H 1 55 LEU HA 1.800 . 3.000 2.824 2.817 2.841 . 0 0 "[ . 1 . 2 .]" 1
381 1 55 LEU H 1 55 LEU QB 1.800 . 4.060 2.076 1.991 2.133 . 0 0 "[ . 1 . 2 .]" 1
382 1 55 LEU H 1 55 LEU MD2 1.800 . 6.400 3.672 3.400 3.894 . 0 0 "[ . 1 . 2 .]" 1
383 1 53 ASP HA 1 56 ALA H 1.800 . 4.000 4.017 3.970 4.051 0.051 5 0 "[ . 1 . 2 .]" 1
384 1 55 LEU MD1 1 56 ALA HA 1.800 . 6.400 2.974 2.718 3.236 . 0 0 "[ . 1 . 2 .]" 1
385 1 55 LEU QB 1 56 ALA H 1.800 . 4.060 2.479 2.386 2.584 . 0 0 "[ . 1 . 2 .]" 1
386 1 56 ALA H 1 56 ALA HA 1.800 . 3.000 2.906 2.881 2.916 . 0 0 "[ . 1 . 2 .]" 1
387 1 56 ALA H 1 56 ALA MB 1.800 . 3.724 2.088 1.943 2.176 . 0 0 "[ . 1 . 2 .]" 1
388 1 54 GLU HA 1 57 ALA MB 1.800 . 4.396 2.779 2.615 3.062 . 0 0 "[ . 1 . 2 .]" 1
389 1 56 ALA MB 1 57 ALA HA 1.800 . 6.300 3.797 3.708 3.863 . 0 0 "[ . 1 . 2 .]" 1
390 1 56 ALA MB 1 57 ALA H 1.800 . 4.396 2.293 2.210 2.456 . 0 0 "[ . 1 . 2 .]" 1
391 1 57 ALA H 1 57 ALA MB 1.800 . 3.724 2.071 1.948 2.156 . 0 0 "[ . 1 . 2 .]" 1
392 1 25 ILE MD 1 58 LYS QB 1.800 . 5.555 3.602 3.360 3.932 . 0 0 "[ . 1 . 2 .]" 1
393 1 25 ILE HA 1 58 LYS QD 1.800 . 6.300 3.065 2.412 3.545 . 0 0 "[ . 1 . 2 .]" 1
394 1 25 ILE HB 1 58 LYS QD 1.800 . 6.300 2.786 2.149 3.172 . 0 0 "[ . 1 . 2 .]" 1
395 1 25 ILE MD 1 58 LYS QD 1.800 . 5.555 2.456 1.910 3.252 . 0 0 "[ . 1 . 2 .]" 1
396 1 25 ILE QG 1 58 LYS QD 1.800 . 5.555 2.372 1.902 3.211 . 0 0 "[ . 1 . 2 .]" 1
397 1 25 ILE MG 1 58 LYS QD 1.800 . 5.555 4.068 3.608 4.228 . 0 0 "[ . 1 . 2 .]" 1
398 1 25 ILE HB 1 58 LYS QE 1.800 . 6.300 3.254 1.905 4.205 . 0 0 "[ . 1 . 2 .]" 1
399 1 25 ILE MD 1 58 LYS QE 1.800 . 7.850 3.453 1.841 4.607 . 0 0 "[ . 1 . 2 .]" 1
400 1 25 ILE HB 1 58 LYS QZ 1.800 . 5.000 3.803 1.840 4.577 . 0 0 "[ . 1 . 2 .]" 1
401 1 26 PRO QD 1 58 LYS QD 1.800 . 7.700 3.471 2.639 4.048 . 0 0 "[ . 1 . 2 .]" 1
402 1 26 PRO QD 1 58 LYS QE 1.800 . 7.700 2.209 1.823 4.273 . 0 0 "[ . 1 . 2 .]" 1
403 1 34 LEU MD2 1 58 LYS QE 1.800 . 7.850 5.088 3.068 5.683 . 0 0 "[ . 1 . 2 .]" 1
404 1 54 GLU QB 1 58 LYS QB 1.800 . 5.558 3.666 3.373 4.138 . 0 0 "[ . 1 . 2 .]" 1
405 1 55 LEU HA 1 58 LYS QB 1.800 . 4.396 2.661 2.394 2.857 . 0 0 "[ . 1 . 2 .]" 1
406 1 55 LEU QB 1 58 LYS QB 1.800 . 5.558 4.457 4.304 4.577 . 0 0 "[ . 1 . 2 .]" 1
407 1 55 LEU HA 1 58 LYS QD 1.800 . 6.300 3.553 2.842 4.995 . 0 0 "[ . 1 . 2 .]" 1
408 1 55 LEU HA 1 58 LYS QG 1.800 . 6.300 4.171 2.429 4.632 . 0 0 "[ . 1 . 2 .]" 1
409 1 55 LEU HA 1 58 LYS H 1.800 . 5.000 3.909 3.548 4.035 . 0 0 "[ . 1 . 2 .]" 1
410 1 55 LEU MD2 1 58 LYS QZ 1.800 . 6.400 3.208 1.776 4.737 0.024 21 0 "[ . 1 . 2 .]" 1
411 1 57 ALA MB 1 58 LYS H 1.800 . 4.396 2.509 2.377 2.687 . 0 0 "[ . 1 . 2 .]" 1
412 1 58 LYS HA 1 58 LYS QD 1.800 . 6.300 3.680 2.601 4.083 . 0 0 "[ . 1 . 2 .]" 1
413 1 58 LYS QB 1 58 LYS QD 1.800 . 5.558 2.097 1.887 2.805 . 0 0 "[ . 1 . 2 .]" 1
414 1 58 LYS QB 1 58 LYS QE 1.800 . 7.700 3.073 1.909 3.753 . 0 0 "[ . 1 . 2 .]" 1
415 1 58 LYS QD 1 58 LYS QE 1.800 . 5.558 2.059 2.020 2.100 . 0 0 "[ . 1 . 2 .]" 1
416 1 58 LYS HA 1 58 LYS QG 1.800 . 4.396 2.569 2.116 3.441 . 0 0 "[ . 1 . 2 .]" 1
417 1 58 LYS QB 1 58 LYS QG 1.800 . 5.558 2.056 2.022 2.075 . 0 0 "[ . 1 . 2 .]" 1
418 1 58 LYS QD 1 58 LYS QG 1.800 . 4.802 2.059 2.007 2.108 . 0 0 "[ . 1 . 2 .]" 1
419 1 58 LYS QE 1 58 LYS QG 1.800 . 7.700 2.151 1.950 2.901 . 0 0 "[ . 1 . 2 .]" 1
420 1 58 LYS H 1 58 LYS QG 1.800 . 4.560 3.799 3.159 3.948 . 0 0 "[ . 1 . 2 .]" 1
421 1 25 ILE MD 1 59 LEU HA 1.800 . 6.400 3.730 3.573 3.909 . 0 0 "[ . 1 . 2 .]" 1
422 1 25 ILE MD 1 59 LEU QB 1.800 . 5.555 3.772 3.459 4.000 . 0 0 "[ . 1 . 2 .]" 1
423 1 34 LEU MD2 1 59 LEU HA 1.800 . 6.400 4.022 3.777 4.218 . 0 0 "[ . 1 . 2 .]" 1
424 1 34 LEU MD2 1 59 LEU MD1 1.800 . 4.688 2.458 2.151 2.756 . 0 0 "[ . 1 . 2 .]" 1
425 1 37 ILE MD 1 59 LEU HA 1.800 . 6.400 4.116 3.955 4.265 . 0 0 "[ . 1 . 2 .]" 1
426 1 37 ILE QG 1 59 LEU MD2 1.800 . 5.552 3.991 3.861 4.057 . 0 0 "[ . 1 . 2 .]" 1
427 1 37 ILE MD 1 59 LEU HG 1.800 . 4.360 2.357 2.095 2.723 . 0 0 "[ . 1 . 2 .]" 1
428 1 55 LEU MD1 1 59 LEU H 1.800 . 6.400 3.942 3.719 4.104 . 0 0 "[ . 1 . 2 .]" 1
429 1 56 ALA HA 1 59 LEU QB 1.800 . 6.300 2.729 2.649 2.807 . 0 0 "[ . 1 . 2 .]" 1
430 1 56 ALA MB 1 59 LEU QB 1.800 . 5.558 4.063 4.018 4.102 . 0 0 "[ . 1 . 2 .]" 1
431 1 56 ALA HA 1 59 LEU MD2 1.800 . 6.400 2.815 2.709 2.915 . 0 0 "[ . 1 . 2 .]" 1
432 1 56 ALA MB 1 59 LEU MD2 1.800 . 6.000 4.054 4.009 4.100 . 0 0 "[ . 1 . 2 .]" 1
433 1 56 ALA HA 1 59 LEU H 1.800 . 5.000 3.604 3.418 3.753 . 0 0 "[ . 1 . 2 .]" 1
434 1 57 ALA HA 1 59 LEU QB 1.800 . 6.300 4.775 4.668 4.926 . 0 0 "[ . 1 . 2 .]" 1
435 1 57 ALA MB 1 59 LEU H 1.800 . 6.300 4.558 4.437 4.670 . 0 0 "[ . 1 . 2 .]" 1
436 1 58 LYS QB 1 59 LEU HA 1.800 . 6.300 4.244 3.956 4.825 . 0 0 "[ . 1 . 2 .]" 1
437 1 58 LYS QB 1 59 LEU QB 1.800 . 7.700 3.954 3.771 4.581 . 0 0 "[ . 1 . 2 .]" 1
438 1 58 LYS QD 1 59 LEU QB 1.800 . 5.558 4.251 3.532 4.464 . 0 0 "[ . 1 . 2 .]" 1
439 1 58 LYS QB 1 59 LEU MD1 1.800 . 7.850 3.536 3.156 4.111 . 0 0 "[ . 1 . 2 .]" 1
440 1 58 LYS QD 1 59 LEU MD1 1.800 . 5.555 2.609 2.100 2.856 . 0 0 "[ . 1 . 2 .]" 1
441 1 58 LYS QZ 1 59 LEU MD1 1.800 . 6.400 4.081 2.814 4.699 . 0 0 "[ . 1 . 2 .]" 1
442 1 58 LYS HA 1 59 LEU H 1.800 . 5.000 3.564 3.527 3.576 . 0 0 "[ . 1 . 2 .]" 1
443 1 58 LYS QB 1 59 LEU H 1.800 . 6.300 2.467 2.283 3.243 . 0 0 "[ . 1 . 2 .]" 1
444 1 59 LEU HA 1 59 LEU MD1 1.800 . 6.400 1.822 1.794 1.849 0.006 18 0 "[ . 1 . 2 .]" 1
445 1 59 LEU QB 1 59 LEU MD1 1.800 . 4.745 2.549 2.474 2.605 . 0 0 "[ . 1 . 2 .]" 1
446 1 59 LEU HA 1 59 LEU MD2 1.800 . 5.000 3.642 3.605 3.692 . 0 0 "[ . 1 . 2 .]" 1
447 1 59 LEU QB 1 59 LEU MD2 1.800 . 7.850 2.021 1.962 2.115 . 0 0 "[ . 1 . 2 .]" 1
448 1 59 LEU H 1 59 LEU HA 1.800 . 3.000 2.830 2.822 2.907 . 0 0 "[ . 1 . 2 .]" 1
449 1 59 LEU H 1 59 LEU QB 1.800 . 4.060 1.912 1.896 1.934 . 0 0 "[ . 1 . 2 .]" 1
450 1 59 LEU H 1 59 LEU MD1 1.800 . 4.000 2.826 2.643 3.027 . 0 0 "[ . 1 . 2 .]" 1
451 1 59 LEU H 1 59 LEU MD2 1.800 . 4.360 3.328 3.057 3.465 . 0 0 "[ . 1 . 2 .]" 1
452 1 56 ALA MB 1 60 VAL H 1.800 . 6.300 4.994 4.824 5.116 . 0 0 "[ . 1 . 2 .]" 1
453 1 57 ALA HA 1 60 VAL HB 1.800 . 3.300 2.940 2.759 3.038 . 0 0 "[ . 1 . 2 .]" 1
454 1 57 ALA MB 1 60 VAL HB 1.800 . 4.896 4.059 3.971 4.103 . 0 0 "[ . 1 . 2 .]" 1
455 1 57 ALA HA 1 60 VAL MG1 1.800 . 6.400 4.122 4.011 4.233 . 0 0 "[ . 1 . 2 .]" 1
456 1 57 ALA HA 1 60 VAL MG2 1.800 . 4.360 2.635 2.432 2.804 . 0 0 "[ . 1 . 2 .]" 1
457 1 57 ALA HA 1 60 VAL H 1.800 . 4.000 3.435 3.303 3.492 . 0 0 "[ . 1 . 2 .]" 1
458 1 57 ALA MB 1 60 VAL H 1.800 . 6.300 4.584 4.538 4.664 . 0 0 "[ . 1 . 2 .]" 1
459 1 59 LEU HA 1 60 VAL HA 1.800 . 5.000 4.874 4.853 4.886 . 0 0 "[ . 1 . 2 .]" 1
460 1 59 LEU QB 1 60 VAL HB 1.800 . 6.300 4.600 4.514 4.670 . 0 0 "[ . 1 . 2 .]" 1
461 1 59 LEU HA 1 60 VAL H 1.800 . 5.000 3.572 3.559 3.580 . 0 0 "[ . 1 . 2 .]" 1
462 1 59 LEU MD1 1 60 VAL H 1.800 . 6.400 4.449 4.403 4.475 . 0 0 "[ . 1 . 2 .]" 1
463 1 59 LEU MD2 1 60 VAL H 1.800 . 6.400 4.628 4.565 4.693 . 0 0 "[ . 1 . 2 .]" 1
464 1 60 VAL HA 1 60 VAL MG1 1.800 . 3.640 2.434 2.344 2.504 . 0 0 "[ . 1 . 2 .]" 1
465 1 60 VAL HA 1 60 VAL MG2 1.800 . 3.640 2.273 2.120 2.366 . 0 0 "[ . 1 . 2 .]" 1
466 1 60 VAL MG1 1 60 VAL MG2 1.800 . 4.688 2.002 1.842 2.072 . 0 0 "[ . 1 . 2 .]" 1
467 1 60 VAL H 1 60 VAL HA 1.800 . 3.000 2.840 2.830 2.852 . 0 0 "[ . 1 . 2 .]" 1
468 1 60 VAL H 1 60 VAL HB 1.800 . 3.000 2.336 2.279 2.386 . 0 0 "[ . 1 . 2 .]" 1
469 1 60 VAL H 1 60 VAL MG1 1.800 . 4.360 3.699 3.687 3.707 . 0 0 "[ . 1 . 2 .]" 1
470 1 60 VAL H 1 60 VAL MG2 1.800 . 3.640 2.143 1.992 2.379 . 0 0 "[ . 1 . 2 .]" 1
471 1 58 LYS HA 1 61 ALA MB 1.800 . 3.724 2.739 2.500 2.994 . 0 0 "[ . 1 . 2 .]" 1
472 1 60 VAL MG1 1 61 ALA HA 1.800 . 6.400 3.597 3.410 3.724 . 0 0 "[ . 1 . 2 .]" 1
473 1 24 GLU HA 1 62 LEU MD1 1.800 . 6.400 4.557 4.185 4.853 . 0 0 "[ . 1 . 2 .]" 1
474 1 24 GLU QG 1 62 LEU MD1 1.800 . 7.850 3.146 2.079 3.625 . 0 0 "[ . 1 . 2 .]" 1
475 1 24 GLU QB 1 62 LEU HG 1.800 . 6.300 3.588 2.796 4.026 . 0 0 "[ . 1 . 2 .]" 1
476 1 24 GLU QG 1 62 LEU HG 1.800 . 6.300 5.167 4.155 5.598 . 0 0 "[ . 1 . 2 .]" 1
477 1 26 PRO QD 1 62 LEU HG 1.800 . 6.300 5.663 5.624 5.728 . 0 0 "[ . 1 . 2 .]" 1
478 1 34 LEU MD2 1 62 LEU HA 1.800 . 6.400 5.116 5.021 5.210 . 0 0 "[ . 1 . 2 .]" 1
479 1 34 LEU MD1 1 62 LEU QB 1.800 . 5.555 1.971 1.783 2.205 0.017 25 0 "[ . 1 . 2 .]" 1
480 1 34 LEU HG 1 62 LEU QB 1.800 . 6.300 4.381 4.014 4.636 . 0 0 "[ . 1 . 2 .]" 1
481 1 34 LEU HG 1 62 LEU MD1 1.800 . 4.360 3.464 3.206 3.541 . 0 0 "[ . 1 . 2 .]" 1
482 1 34 LEU MD2 1 62 LEU HG 1.800 . 3.640 2.612 2.378 2.718 . 0 0 "[ . 1 . 2 .]" 1
483 1 58 LYS QE 1 62 LEU MD1 1.800 . 7.850 4.527 2.962 5.862 . 0 0 "[ . 1 . 2 .]" 1
484 1 58 LYS HA 1 62 LEU MD2 1.800 . 4.360 3.592 3.461 3.703 . 0 0 "[ . 1 . 2 .]" 1
485 1 58 LYS QG 1 62 LEU MD2 1.800 . 7.850 2.441 1.892 3.766 . 0 0 "[ . 1 . 2 .]" 1
486 1 59 LEU HG 1 62 LEU QB 1.800 . 6.300 4.113 3.859 4.342 . 0 0 "[ . 1 . 2 .]" 1
487 1 59 LEU HA 1 62 LEU MD2 1.800 . 6.400 2.887 2.621 3.382 . 0 0 "[ . 1 . 2 .]" 1
488 1 59 LEU HA 1 62 LEU HG 1.800 . 5.000 3.332 3.196 3.477 . 0 0 "[ . 1 . 2 .]" 1
489 1 59 LEU MD1 1 62 LEU HG 1.800 . 3.640 2.925 2.773 3.041 . 0 0 "[ . 1 . 2 .]" 1
490 1 59 LEU HA 1 62 LEU H 1.800 . 4.000 3.077 3.017 3.129 . 0 0 "[ . 1 . 2 .]" 1
491 1 61 ALA HA 1 62 LEU HA 1.800 . 5.000 4.856 4.841 4.869 . 0 0 "[ . 1 . 2 .]" 1
492 1 61 ALA MB 1 62 LEU HA 1.800 . 6.300 3.856 3.786 3.941 . 0 0 "[ . 1 . 2 .]" 1
493 1 61 ALA MB 1 62 LEU MD2 1.800 . 5.555 2.407 2.166 2.624 . 0 0 "[ . 1 . 2 .]" 1
494 1 61 ALA HA 1 62 LEU H 1.800 . 4.000 3.535 3.522 3.557 . 0 0 "[ . 1 . 2 .]" 1
495 1 61 ALA MB 1 62 LEU H 1.800 . 4.060 2.679 2.564 2.773 . 0 0 "[ . 1 . 2 .]" 1
496 1 62 LEU HA 1 62 LEU MD1 1.800 . 4.360 1.974 1.888 2.126 . 0 0 "[ . 1 . 2 .]" 1
497 1 62 LEU QB 1 62 LEU MD1 1.800 . 5.555 2.201 2.116 2.257 . 0 0 "[ . 1 . 2 .]" 1
498 1 62 LEU HA 1 62 LEU MD2 1.800 . 3.640 2.287 2.155 2.377 . 0 0 "[ . 1 . 2 .]" 1
499 1 62 LEU QB 1 62 LEU MD2 1.800 . 4.745 2.351 2.303 2.420 . 0 0 "[ . 1 . 2 .]" 1
500 1 62 LEU H 1 62 LEU HA 1.800 . 3.000 2.887 2.880 2.897 . 0 0 "[ . 1 . 2 .]" 1
501 1 62 LEU H 1 62 LEU QB 1.800 . 4.060 1.981 1.918 2.077 . 0 0 "[ . 1 . 2 .]" 1
502 1 62 LEU H 1 62 LEU MD1 1.800 . 4.360 3.802 3.723 3.868 . 0 0 "[ . 1 . 2 .]" 1
503 1 62 LEU H 1 62 LEU MD2 1.800 . 4.360 2.128 1.898 2.208 . 0 0 "[ . 1 . 2 .]" 1
504 1 62 LEU H 1 62 LEU HG 1.800 . 5.000 3.812 3.713 3.874 . 0 0 "[ . 1 . 2 .]" 1
505 1 60 VAL HA 1 63 GLY QA 1.800 . 6.300 4.455 4.340 4.544 . 0 0 "[ . 1 . 2 .]" 1
506 1 34 LEU MD1 1 64 ILE HB 1.800 . 6.400 4.465 4.102 4.737 . 0 0 "[ . 1 . 2 .]" 1
507 1 34 LEU HA 1 64 ILE MD 1.800 . 6.400 3.086 2.941 3.253 . 0 0 "[ . 1 . 2 .]" 1
508 1 34 LEU MD1 1 64 ILE MD 1.800 . 4.688 2.162 1.913 2.377 . 0 0 "[ . 1 . 2 .]" 1
509 1 34 LEU MD1 1 64 ILE QG 1.800 . 5.552 2.719 2.228 3.009 . 0 0 "[ . 1 . 2 .]" 1
510 1 34 LEU MD2 1 64 ILE QG 1.800 . 5.552 3.359 3.147 3.520 . 0 0 "[ . 1 . 2 .]" 1
511 1 37 ILE HA 1 64 ILE MD 1.800 . 6.400 4.604 4.482 4.732 . 0 0 "[ . 1 . 2 .]" 1
512 1 37 ILE HB 1 64 ILE MD 1.800 . 4.360 3.424 3.265 3.566 . 0 0 "[ . 1 . 2 .]" 1
513 1 37 ILE QG 1 64 ILE MD 1.800 . 4.688 1.838 1.806 1.883 . 0 0 "[ . 1 . 2 .]" 1
514 1 37 ILE HB 1 64 ILE MG 1.800 . 4.360 3.389 3.220 3.466 . 0 0 "[ . 1 . 2 .]" 1
515 1 38 LYS QD 1 64 ILE HA 1.800 . 6.300 3.789 2.826 5.628 . 0 0 "[ . 1 . 2 .]" 1
516 1 38 LYS HA 1 64 ILE MD 1.800 . 3.640 2.754 2.601 2.861 . 0 0 "[ . 1 . 2 .]" 1
517 1 38 LYS QB 1 64 ILE MD 1.800 . 5.555 1.809 1.777 1.854 0.023 16 0 "[ . 1 . 2 .]" 1
518 1 38 LYS QD 1 64 ILE MD 1.800 . 5.555 3.175 2.292 3.996 . 0 0 "[ . 1 . 2 .]" 1
519 1 38 LYS QE 1 64 ILE MD 1.800 . 7.850 4.537 3.461 4.827 . 0 0 "[ . 1 . 2 .]" 1
520 1 38 LYS QG 1 64 ILE MD 1.800 . 5.555 3.220 2.354 3.593 . 0 0 "[ . 1 . 2 .]" 1
521 1 38 LYS QD 1 64 ILE QG 1.800 . 7.850 2.348 1.765 3.769 0.035 25 0 "[ . 1 . 2 .]" 1
522 1 38 LYS QG 1 64 ILE QG 1.800 . 4.745 2.898 1.801 3.395 . 0 0 "[ . 1 . 2 .]" 1
523 1 38 LYS HA 1 64 ILE MG 1.800 . 6.400 2.713 2.544 2.868 . 0 0 "[ . 1 . 2 .]" 1
524 1 38 LYS QE 1 64 ILE MG 1.800 . 7.850 4.313 3.315 4.942 . 0 0 "[ . 1 . 2 .]" 1
525 1 59 LEU QB 1 64 ILE HA 1.800 . 6.300 4.973 4.656 5.139 . 0 0 "[ . 1 . 2 .]" 1
526 1 59 LEU QB 1 64 ILE HB 1.800 . 6.300 2.643 2.315 2.845 . 0 0 "[ . 1 . 2 .]" 1
527 1 59 LEU HG 1 64 ILE MD 1.800 . 4.360 2.319 2.164 2.519 . 0 0 "[ . 1 . 2 .]" 1
528 1 59 LEU HA 1 64 ILE QG 1.800 . 6.400 4.245 3.918 4.436 . 0 0 "[ . 1 . 2 .]" 1
529 1 59 LEU HG 1 64 ILE QG 1.800 . 6.400 3.761 3.693 3.817 . 0 0 "[ . 1 . 2 .]" 1
530 1 59 LEU QB 1 64 ILE MG 1.800 . 7.850 3.184 2.923 3.365 . 0 0 "[ . 1 . 2 .]" 1
531 1 59 LEU MD2 1 64 ILE MG 1.800 . 4.688 2.966 2.929 3.005 . 0 0 "[ . 1 . 2 .]" 1
532 1 60 VAL HA 1 64 ILE HB 1.800 . 5.000 4.439 4.368 4.499 . 0 0 "[ . 1 . 2 .]" 1
533 1 60 VAL HA 1 64 ILE QG 1.800 . 6.400 5.401 5.332 5.461 . 0 0 "[ . 1 . 2 .]" 1
534 1 60 VAL HA 1 64 ILE MG 1.800 . 6.400 4.989 4.948 5.081 . 0 0 "[ . 1 . 2 .]" 1
535 1 60 VAL HA 1 64 ILE H 1.800 . 5.000 3.462 3.371 3.550 . 0 0 "[ . 1 . 2 .]" 1
536 1 60 VAL MG1 1 64 ILE H 1.800 . 6.400 5.132 5.028 5.243 . 0 0 "[ . 1 . 2 .]" 1
537 1 60 VAL MG2 1 64 ILE H 1.800 . 6.400 4.936 4.788 5.024 . 0 0 "[ . 1 . 2 .]" 1
538 1 62 LEU QB 1 64 ILE QG 1.800 . 9.200 2.705 2.617 2.840 . 0 0 "[ . 1 . 2 .]" 1
539 1 63 GLY QA 1 64 ILE H 1.800 . 6.300 2.933 2.925 2.939 . 0 0 "[ . 1 . 2 .]" 1
540 1 64 ILE HA 1 64 ILE MD 1.800 . 5.000 3.782 3.732 3.827 . 0 0 "[ . 1 . 2 .]" 1
541 1 64 ILE HB 1 64 ILE MD 1.800 . 6.400 2.347 2.210 2.428 . 0 0 "[ . 1 . 2 .]" 1
542 1 64 ILE HA 1 64 ILE QG 1.800 . 4.360 2.408 2.366 2.441 . 0 0 "[ . 1 . 2 .]" 1
543 1 64 ILE MD 1 64 ILE QG 1.800 . 4.688 1.908 1.895 1.913 . 0 0 "[ . 1 . 2 .]" 1
544 1 64 ILE HA 1 64 ILE MG 1.800 . 3.640 2.400 2.385 2.414 . 0 0 "[ . 1 . 2 .]" 1
545 1 64 ILE MD 1 64 ILE MG 1.800 . 4.688 2.004 1.943 2.111 . 0 0 "[ . 1 . 2 .]" 1
546 1 64 ILE QG 1 64 ILE MG 1.800 . 4.688 2.270 2.183 2.328 . 0 0 "[ . 1 . 2 .]" 1
547 1 64 ILE H 1 64 ILE HA 1.800 . 3.000 2.984 2.978 2.986 . 0 0 "[ . 1 . 2 .]" 1
548 1 64 ILE H 1 64 ILE HB 1.800 . 3.000 2.421 2.404 2.442 . 0 0 "[ . 1 . 2 .]" 1
549 1 64 ILE H 1 64 ILE MD 1.800 . 6.400 3.727 3.620 3.832 . 0 0 "[ . 1 . 2 .]" 1
550 1 60 VAL MG1 1 65 ASN HA 1.800 . 6.400 4.122 3.953 4.330 . 0 0 "[ . 1 . 2 .]" 1
551 1 60 VAL MG2 1 65 ASN HA 1.800 . 6.400 2.635 2.500 2.800 . 0 0 "[ . 1 . 2 .]" 1
552 1 60 VAL HA 1 65 ASN HB3 1.800 . 6.000 6.114 6.060 6.143 0.143 25 0 "[ . 1 . 2 .]" 1
553 1 60 VAL MG2 1 65 ASN HB3 1.800 . 6.400 5.198 5.125 5.275 . 0 0 "[ . 1 . 2 .]" 1
554 1 64 ILE MG 1 65 ASN HA 1.800 . 7.600 3.979 3.952 4.012 . 0 0 "[ . 1 . 2 .]" 1
555 1 64 ILE MG 1 65 ASN HB3 1.800 . 6.400 3.899 3.804 3.985 . 0 0 "[ . 1 . 2 .]" 1
556 1 64 ILE QG 1 65 ASN H 1.800 . 6.400 4.233 4.207 4.266 . 0 0 "[ . 1 . 2 .]" 1
557 1 56 ALA HA 1 66 ALA MB 1.800 . 4.396 1.988 1.785 2.172 0.015 3 0 "[ . 1 . 2 .]" 1
558 1 59 LEU MD2 1 66 ALA HA 1.800 . 6.400 3.427 3.389 3.477 . 0 0 "[ . 1 . 2 .]" 1
559 1 59 LEU QB 1 66 ALA MB 1.800 . 7.700 1.642 1.625 1.662 0.175 2 0 "[ . 1 . 2 .]" 1
560 1 59 LEU MD1 1 66 ALA MB 1.800 . 4.745 3.465 3.436 3.495 . 0 0 "[ . 1 . 2 .]" 1
561 1 59 LEU MD2 1 66 ALA MB 1.800 . 4.745 1.698 1.683 1.720 0.117 16 0 "[ . 1 . 2 .]" 1
562 1 59 LEU HG 1 66 ALA MB 1.800 . 6.300 2.619 2.513 2.864 . 0 0 "[ . 1 . 2 .]" 1
563 1 59 LEU H 1 66 ALA MB 1.800 . 4.396 3.342 3.149 3.437 . 0 0 "[ . 1 . 2 .]" 1
564 1 64 ILE MG 1 66 ALA HA 1.800 . 6.400 3.828 3.735 3.904 . 0 0 "[ . 1 . 2 .]" 1
565 1 64 ILE HB 1 66 ALA MB 1.800 . 4.396 3.462 3.410 3.501 . 0 0 "[ . 1 . 2 .]" 1
566 1 64 ILE MG 1 66 ALA MB 1.800 . 4.745 2.898 2.871 2.926 . 0 0 "[ . 1 . 2 .]" 1
567 1 56 ALA MB 1 67 VAL HA 1.800 . 4.396 2.463 2.144 2.801 . 0 0 "[ . 1 . 2 .]" 1
568 1 66 ALA HA 1 67 VAL MG2 1.800 . 6.400 3.441 3.158 3.702 . 0 0 "[ . 1 . 2 .]" 1
569 1 66 ALA HA 1 67 VAL H 1.800 . 3.000 2.239 2.216 2.263 . 0 0 "[ . 1 . 2 .]" 1
570 1 66 ALA MB 1 67 VAL H 1.800 . 4.060 2.921 2.829 2.982 . 0 0 "[ . 1 . 2 .]" 1
571 1 67 VAL HA 1 67 VAL MG1 1.800 . 4.360 2.209 2.086 2.324 . 0 0 "[ . 1 . 2 .]" 1
572 1 67 VAL HA 1 67 VAL MG2 1.800 . 3.640 2.434 2.275 2.573 . 0 0 "[ . 1 . 2 .]" 1
573 1 67 VAL H 1 67 VAL HA 1.800 . 3.000 3.009 3.002 3.015 0.015 21 0 "[ . 1 . 2 .]" 1
574 1 67 VAL H 1 67 VAL HB 1.800 . 4.000 2.728 2.506 2.900 . 0 0 "[ . 1 . 2 .]" 1
575 1 67 VAL H 1 67 VAL MG2 1.800 . 4.000 2.767 2.613 2.921 . 0 0 "[ . 1 . 2 .]" 1
576 1 52 CYS HA 1 68 ALA MB 1.800 . 3.724 2.817 2.755 2.880 . 0 0 "[ . 1 . 2 .]" 1
577 1 52 CYS HB3 1 68 ALA MB 1.800 . 4.396 1.812 1.772 1.853 0.028 16 0 "[ . 1 . 2 .]" 1
578 1 52 CYS HB2 1 68 ALA MB 1.800 . 4.396 2.919 2.563 3.230 . 0 0 "[ . 1 . 2 .]" 1
579 1 53 ASP HA 1 68 ALA MB 1.800 . 4.396 2.825 2.661 3.006 . 0 0 "[ . 1 . 2 .]" 1
580 1 56 ALA MB 1 68 ALA HA 1.800 . 6.300 3.280 3.068 3.493 . 0 0 "[ . 1 . 2 .]" 1
581 1 56 ALA MB 1 68 ALA MB 1.800 . 4.802 2.108 1.928 2.339 . 0 0 "[ . 1 . 2 .]" 1
582 1 56 ALA H 1 68 ALA MB 1.800 . 6.300 3.403 3.278 3.536 . 0 0 "[ . 1 . 2 .]" 1
583 1 67 VAL MG1 1 68 ALA MB 1.800 . 6.055 3.815 3.704 3.937 . 0 0 "[ . 1 . 2 .]" 1
584 1 67 VAL MG1 1 68 ALA H 1.800 . 4.000 2.256 1.973 2.519 . 0 0 "[ . 1 . 2 .]" 1
585 1 43 LEU MD1 1 69 TYR HB3 1.800 . 6.400 5.116 4.963 5.275 . 0 0 "[ . 1 . 2 .]" 1
586 1 68 ALA MB 1 69 TYR HA 1.800 . 6.300 4.145 4.038 4.229 . 0 0 "[ . 1 . 2 .]" 1
587 1 68 ALA HA 1 69 TYR H 1.800 . 3.000 2.219 2.207 2.253 . 0 0 "[ . 1 . 2 .]" 1
588 1 69 TYR HA 1 69 TYR QD 1.800 . 6.300 2.784 2.381 3.028 . 0 0 "[ . 1 . 2 .]" 1
589 1 69 TYR HA 1 69 TYR QE 1.800 . 6.300 4.371 4.223 4.488 . 0 0 "[ . 1 . 2 .]" 1
590 1 49 LYS QD 1 70 TYR HA 1.800 . 6.300 5.293 4.886 5.570 . 0 0 "[ . 1 . 2 .]" 1
591 1 49 LYS QB 1 70 TYR HB3 1.800 . 6.300 4.428 3.665 5.093 . 0 0 "[ . 1 . 2 .]" 1
592 1 49 LYS HA 1 70 TYR HB2 1.800 . 5.000 3.947 3.651 4.441 . 0 0 "[ . 1 . 2 .]" 1
593 1 49 LYS QB 1 70 TYR HB2 1.800 . 6.300 3.755 2.927 4.371 . 0 0 "[ . 1 . 2 .]" 1
594 1 49 LYS QG 1 70 TYR HB2 1.800 . 6.300 2.633 1.857 3.488 . 0 0 "[ . 1 . 2 .]" 1
595 1 49 LYS QD 1 70 TYR QD 1.800 . 7.700 2.342 1.933 2.833 . 0 0 "[ . 1 . 2 .]" 1
596 1 49 LYS QE 1 70 TYR QD 1.800 . 7.700 3.227 1.926 4.143 . 0 0 "[ . 1 . 2 .]" 1
597 1 49 LYS HA 1 70 TYR QD 1.800 . 6.300 3.451 2.940 3.997 . 0 0 "[ . 1 . 2 .]" 1
598 1 49 LYS QB 1 70 TYR QD 1.800 . 7.700 4.245 3.716 4.491 . 0 0 "[ . 1 . 2 .]" 1
599 1 49 LYS QD 1 70 TYR QE 1.800 . 7.700 3.061 2.374 3.696 . 0 0 "[ . 1 . 2 .]" 1
600 1 49 LYS QE 1 70 TYR QE 1.800 . 5.558 2.940 2.005 4.434 . 0 0 "[ . 1 . 2 .]" 1
601 1 49 LYS HA 1 70 TYR QE 1.800 . 6.300 4.488 3.870 5.184 . 0 0 "[ . 1 . 2 .]" 1
602 1 49 LYS QB 1 70 TYR QE 1.800 . 7.700 4.860 4.492 5.267 . 0 0 "[ . 1 . 2 .]" 1
603 1 49 LYS QG 1 70 TYR QE 1.800 . 7.700 3.205 2.772 3.901 . 0 0 "[ . 1 . 2 .]" 1
604 1 52 CYS HB2 1 70 TYR QD 1.800 . 6.300 2.725 2.369 3.254 . 0 0 "[ . 1 . 2 .]" 1
605 1 52 CYS HB3 1 70 TYR QE 1.800 . 6.300 2.989 2.218 3.660 . 0 0 "[ . 1 . 2 .]" 1
606 1 52 CYS HB2 1 70 TYR QE 1.800 . 6.300 3.028 2.629 3.762 . 0 0 "[ . 1 . 2 .]" 1
607 1 53 ASP HA 1 70 TYR QE 1.800 . 6.300 3.648 3.421 4.146 . 0 0 "[ . 1 . 2 .]" 1
608 1 68 ALA MB 1 70 TYR QD 1.800 . 5.558 2.821 2.513 3.090 . 0 0 "[ . 1 . 2 .]" 1
609 1 68 ALA MB 1 70 TYR QE 1.800 . 4.802 1.935 1.875 2.111 . 0 0 "[ . 1 . 2 .]" 1
610 1 69 TYR QD 1 70 TYR HA 1.800 . 6.300 3.684 2.890 4.473 . 0 0 "[ . 1 . 2 .]" 1
611 1 70 TYR HA 1 70 TYR QD 1.800 . 6.300 3.699 3.684 3.714 . 0 0 "[ . 1 . 2 .]" 1
612 1 70 TYR HB2 1 71 ARG QG 1.800 . 6.300 5.533 5.273 5.664 . 0 0 "[ . 1 . 2 .]" 1
613 1 71 ARG HA 1 71 ARG QD 1.800 . 4.396 3.566 2.642 4.022 . 0 0 "[ . 1 . 2 .]" 1
614 1 71 ARG QB 1 71 ARG QD 1.800 . 5.558 2.097 1.907 2.321 . 0 0 "[ . 1 . 2 .]" 1
615 1 71 ARG HA 1 71 ARG QG 1.800 . 4.396 2.216 1.979 2.490 . 0 0 "[ . 1 . 2 .]" 1
616 1 71 ARG QB 1 71 ARG QG 1.800 . 7.700 2.076 2.043 2.108 . 0 0 "[ . 1 . 2 .]" 1
617 1 71 ARG QD 1 71 ARG QG 1.800 . 4.802 2.078 2.037 2.113 . 0 0 "[ . 1 . 2 .]" 1
618 1 71 ARG HA 1 72 GLY QA 1.800 . 5.000 3.993 3.980 4.007 . 0 0 "[ . 1 . 2 .]" 1
619 1 49 LYS QE 1 73 LEU QB 1.800 . 7.700 5.091 4.282 5.855 . 0 0 "[ . 1 . 2 .]" 1
620 1 49 LYS QE 1 73 LEU MD2 1.800 . 7.850 4.615 3.870 5.670 . 0 0 "[ . 1 . 2 .]" 1
621 1 69 TYR HA 1 73 LEU QB 1.800 . 6.300 2.875 2.707 3.039 . 0 0 "[ . 1 . 2 .]" 1
622 1 69 TYR HA 1 73 LEU MD1 1.800 . 4.360 2.333 2.143 2.522 . 0 0 "[ . 1 . 2 .]" 1
623 1 69 TYR HB2 1 73 LEU MD1 1.800 . 6.400 3.775 3.457 4.090 . 0 0 "[ . 1 . 2 .]" 1
624 1 69 TYR QD 1 73 LEU MD1 1.800 . 5.555 2.679 1.922 3.436 . 0 0 "[ . 1 . 2 .]" 1
625 1 69 TYR QE 1 73 LEU MD1 1.800 . 7.850 3.162 2.635 3.806 . 0 0 "[ . 1 . 2 .]" 1
626 1 69 TYR HA 1 73 LEU MD2 1.800 . 6.400 3.665 3.608 3.813 . 0 0 "[ . 1 . 2 .]" 1
627 1 69 TYR HA 1 73 LEU HG 1.800 . 5.000 1.937 1.895 2.127 . 0 0 "[ . 1 . 2 .]" 1
628 1 70 TYR HA 1 73 LEU QB 1.800 . 6.300 4.097 4.057 4.178 . 0 0 "[ . 1 . 2 .]" 1
629 1 70 TYR QD 1 73 LEU MD1 1.800 . 7.850 4.701 4.509 4.800 . 0 0 "[ . 1 . 2 .]" 1
630 1 70 TYR QD 1 73 LEU MD2 1.800 . 7.850 3.503 3.360 3.720 . 0 0 "[ . 1 . 2 .]" 1
631 1 70 TYR QE 1 73 LEU MD2 1.800 . 5.555 2.253 1.999 2.507 . 0 0 "[ . 1 . 2 .]" 1
632 1 73 LEU HA 1 73 LEU MD1 1.800 . 6.400 3.078 2.974 3.148 . 0 0 "[ . 1 . 2 .]" 1
633 1 73 LEU QB 1 73 LEU MD1 1.800 . 5.555 2.088 2.050 2.116 . 0 0 "[ . 1 . 2 .]" 1
634 1 73 LEU HA 1 73 LEU MD2 1.800 . 3.640 1.842 1.822 1.866 . 0 0 "[ . 1 . 2 .]" 1
635 1 73 LEU QB 1 73 LEU MD2 1.800 . 4.745 2.429 2.396 2.461 . 0 0 "[ . 1 . 2 .]" 1
636 1 73 LEU MD1 1 73 LEU MD2 1.800 . 4.688 1.917 1.890 1.944 . 0 0 "[ . 1 . 2 .]" 1
637 1 73 LEU HA 1 73 LEU HG 1.800 . 4.000 3.604 3.587 3.618 . 0 0 "[ . 1 . 2 .]" 1
638 1 69 TYR QE 1 74 ASP HA 1.800 . 6.300 5.142 3.832 5.855 . 0 0 "[ . 1 . 2 .]" 1
639 1 69 TYR QD 1 75 VAL HA 1.800 . 6.300 4.039 3.309 4.959 . 0 0 "[ . 1 . 2 .]" 1
640 1 69 TYR QE 1 75 VAL HA 1.800 . 4.396 2.391 1.934 3.353 . 0 0 "[ . 1 . 2 .]" 1
641 1 69 TYR QE 1 75 VAL HB 1.800 . 6.300 4.364 3.988 4.933 . 0 0 "[ . 1 . 2 .]" 1
642 1 69 TYR QE 1 75 VAL MG1 1.800 . 7.850 3.156 2.562 3.966 . 0 0 "[ . 1 . 2 .]" 1
643 1 69 TYR QE 1 75 VAL MG2 1.800 . 7.850 4.883 4.406 5.607 . 0 0 "[ . 1 . 2 .]" 1
644 1 74 ASP HA 1 75 VAL HA 1.800 . 5.000 4.422 4.411 4.431 . 0 0 "[ . 1 . 2 .]" 1
645 1 74 ASP HA 1 75 VAL MG1 1.800 . 6.400 3.628 3.532 3.762 . 0 0 "[ . 1 . 2 .]" 1
646 1 74 ASP HA 1 75 VAL MG2 1.800 . 6.400 3.777 3.751 3.802 . 0 0 "[ . 1 . 2 .]" 1
647 1 74 ASP HB3 1 75 VAL MG2 1.800 . 4.360 3.333 3.311 3.357 . 0 0 "[ . 1 . 2 .]" 1
648 1 75 VAL HA 1 75 VAL HB 1.800 . 2.700 2.498 2.489 2.514 . 0 0 "[ . 1 . 2 .]" 1
649 1 75 VAL HA 1 75 VAL MG1 1.800 . 4.360 2.314 2.234 2.406 . 0 0 "[ . 1 . 2 .]" 1
650 1 75 VAL HA 1 75 VAL MG2 1.800 . 3.640 3.163 3.161 3.168 . 0 0 "[ . 1 . 2 .]" 1
651 1 67 VAL MG2 1 76 SER HB3 1.800 . 4.000 3.061 2.830 3.227 . 0 0 "[ . 1 . 2 .]" 1
652 1 75 VAL HA 1 76 SER HA 1.800 . 5.000 4.489 4.480 4.494 . 0 0 "[ . 1 . 2 .]" 1
653 1 75 VAL MG2 1 76 SER HA 1.800 . 6.400 4.012 3.969 4.073 . 0 0 "[ . 1 . 2 .]" 1
654 1 75 VAL MG2 1 76 SER HG 1.800 . 4.860 3.839 3.797 3.882 . 0 0 "[ . 1 . 2 .]" 1
655 1 76 SER HA 1 76 SER HB3 1.800 . 2.700 2.565 2.432 2.635 . 0 0 "[ . 1 . 2 .]" 1
656 1 67 VAL HB 1 77 VAL HA 1.800 . 5.000 2.780 2.629 3.099 . 0 0 "[ . 1 . 2 .]" 1
657 1 67 VAL MG2 1 77 VAL HA 1.800 . 4.360 1.835 1.815 1.974 . 0 0 "[ . 1 . 2 .]" 1
658 1 67 VAL MG2 1 77 VAL HB 1.800 . 5.000 4.236 4.127 4.281 . 0 0 "[ . 1 . 2 .]" 1
659 1 67 VAL HB 1 77 VAL MG2 1.800 . 6.400 1.845 1.782 1.910 0.018 2 0 "[ . 1 . 2 .]" 1
660 1 67 VAL MG2 1 77 VAL MG2 1.800 . 5.552 2.813 2.681 2.939 . 0 0 "[ . 1 . 2 .]" 1
661 1 69 TYR QD 1 77 VAL MG2 1.800 . 7.850 2.309 1.824 3.288 . 0 0 "[ . 1 . 2 .]" 1
662 1 69 TYR QE 1 77 VAL MG2 1.800 . 7.850 3.733 2.718 4.647 . 0 0 "[ . 1 . 2 .]" 1
663 1 73 LEU MD1 1 77 VAL MG2 1.800 . 5.552 3.653 3.538 3.770 . 0 0 "[ . 1 . 2 .]" 1
664 1 75 VAL HA 1 77 VAL MG2 1.800 . 6.400 4.443 4.081 4.786 . 0 0 "[ . 1 . 2 .]" 1
665 1 76 SER HA 1 77 VAL HA 1.800 . 5.000 4.924 4.643 5.004 0.004 10 0 "[ . 1 . 2 .]" 1
666 1 76 SER HA 1 77 VAL MG2 1.800 . 6.400 4.846 4.481 5.001 . 0 0 "[ . 1 . 2 .]" 1
667 1 76 SER HB2 1 77 VAL MG2 1.800 . 4.360 3.356 3.207 3.493 . 0 0 "[ . 1 . 2 .]" 1
668 1 77 VAL HA 1 77 VAL MG2 1.800 . 3.640 2.456 2.336 2.837 . 0 0 "[ . 1 . 2 .]" 1
669 1 65 ASN QD 1 78 ILE MD 1.800 . 8.000 2.088 1.761 3.372 0.039 4 0 "[ . 1 . 2 .]" 1
670 1 65 ASN QD 1 78 ILE MG 1.800 . 8.000 4.007 3.149 5.430 . 0 0 "[ . 1 . 2 .]" 1
671 1 77 VAL HA 1 78 ILE HA 1.800 . 5.000 4.500 4.473 4.519 . 0 0 "[ . 1 . 2 .]" 1
672 1 77 VAL MG1 1 78 ILE QG 1.800 . 8.000 3.995 3.553 4.382 . 0 0 "[ . 1 . 2 .]" 1
673 1 78 ILE HA 1 78 ILE MD 1.800 . 6.400 3.834 3.576 4.114 . 0 0 "[ . 1 . 2 .]" 1
674 1 78 ILE HB 1 78 ILE MD 1.800 . 4.360 2.004 1.901 2.268 . 0 0 "[ . 1 . 2 .]" 1
675 1 78 ILE HA 1 78 ILE QG 1.800 . 6.400 3.323 3.298 3.374 . 0 0 "[ . 1 . 2 .]" 1
676 1 78 ILE MD 1 78 ILE QG 1.800 . 5.552 1.888 1.874 1.911 . 0 0 "[ . 1 . 2 .]" 1
677 1 78 ILE HA 1 78 ILE MG 1.800 . 4.360 2.227 1.976 2.368 . 0 0 "[ . 1 . 2 .]" 1
678 1 78 ILE MD 1 78 ILE MG 1.800 . 4.688 2.914 2.306 3.225 . 0 0 "[ . 1 . 2 .]" 1
679 1 78 ILE QG 1 78 ILE MG 1.800 . 4.688 1.956 1.858 2.177 . 0 0 "[ . 1 . 2 .]" 1
680 1 77 VAL MG1 1 79 PRO HA 1.800 . 6.400 4.453 4.130 4.848 . 0 0 "[ . 1 . 2 .]" 1
681 1 78 ILE HA 1 79 PRO QB 1.800 . 6.300 4.714 4.615 4.760 . 0 0 "[ . 1 . 2 .]" 1
682 1 78 ILE HA 1 79 PRO QD 1.800 . 4.396 2.036 1.935 2.098 . 0 0 "[ . 1 . 2 .]" 1
683 1 78 ILE MG 1 79 PRO QD 1.800 . 7.850 3.602 3.324 3.732 . 0 0 "[ . 1 . 2 .]" 1
684 1 78 ILE HB 1 79 PRO QD 1.800 . 6.300 3.832 3.487 4.007 . 0 0 "[ . 1 . 2 .]" 1
685 1 78 ILE HA 1 79 PRO QG 1.800 . 4.396 3.945 3.862 4.005 . 0 0 "[ . 1 . 2 .]" 1
686 1 79 PRO HA 1 79 PRO QD 1.800 . 6.300 3.509 3.459 3.537 . 0 0 "[ . 1 . 2 .]" 1
687 1 79 PRO QD 1 79 PRO QG 1.800 . 7.700 1.940 1.937 1.947 . 0 0 "[ . 1 . 2 .]" 1
688 1 41 ARG HE 1 80 THR MG 1.800 . 6.400 5.080 4.701 5.235 . 0 0 "[ . 1 . 2 .]" 1
689 1 78 ILE HB 1 80 THR HB 1.800 . 5.000 4.963 4.240 5.045 0.045 11 0 "[ . 1 . 2 .]" 1
690 1 78 ILE MG 1 80 THR MG 1.800 . 8.000 4.384 3.360 5.324 . 0 0 "[ . 1 . 2 .]" 1
691 1 79 PRO HA 1 80 THR HA 1.800 . 5.000 4.492 4.429 4.547 . 0 0 "[ . 1 . 2 .]" 1
692 1 80 THR HA 1 80 THR HB 1.800 . 2.700 2.569 2.438 2.703 0.003 6 0 "[ . 1 . 2 .]" 1
693 1 80 THR HA 1 80 THR MG 1.800 . 4.040 2.528 2.066 3.204 . 0 0 "[ . 1 . 2 .]" 1
694 1 81 ASN HA 1 81 ASN HB3 1.800 . 2.700 2.606 2.428 2.686 . 0 0 "[ . 1 . 2 .]" 1
695 1 78 ILE MD 1 82 GLY QA 1.800 . 7.850 5.126 3.422 5.783 . 0 0 "[ . 1 . 2 .]" 1
696 1 41 ARG HA 1 83 ASP HA 1.800 . 5.000 3.986 3.833 4.119 . 0 0 "[ . 1 . 2 .]" 1
697 1 41 ARG QB 1 83 ASP HA 1.800 . 6.300 4.940 4.766 5.202 . 0 0 "[ . 1 . 2 .]" 1
698 1 41 ARG QG 1 83 ASP HA 1.800 . 6.300 2.919 2.570 3.272 . 0 0 "[ . 1 . 2 .]" 1
699 1 82 GLY QA 1 83 ASP HA 1.800 . 6.300 4.057 4.004 4.120 . 0 0 "[ . 1 . 2 .]" 1
700 1 41 ARG HA 1 84 VAL MG1 1.800 . 6.400 2.937 2.768 3.238 . 0 0 "[ . 1 . 2 .]" 1
701 1 41 ARG QB 1 84 VAL MG1 1.800 . 5.555 3.085 2.836 3.308 . 0 0 "[ . 1 . 2 .]" 1
702 1 41 ARG QD 1 84 VAL MG1 1.800 . 7.850 3.284 1.873 3.821 . 0 0 "[ . 1 . 2 .]" 1
703 1 41 ARG QG 1 84 VAL MG1 1.800 . 7.850 1.926 1.761 2.313 0.039 14 0 "[ . 1 . 2 .]" 1
704 1 41 ARG HA 1 84 VAL H 1.800 . 3.000 3.014 2.974 3.062 0.062 4 0 "[ . 1 . 2 .]" 1
705 1 42 HIS H 1 84 VAL MG1 1.800 . 5.200 4.085 4.031 4.124 . 0 0 "[ . 1 . 2 .]" 1
706 1 64 ILE MG 1 84 VAL HA 1.800 . 6.400 3.533 3.432 3.662 . 0 0 "[ . 1 . 2 .]" 1
707 1 65 ASN HB3 1 84 VAL HA 1.800 . 5.000 2.012 1.925 2.290 . 0 0 "[ . 1 . 2 .]" 1
708 1 66 ALA HA 1 84 VAL HA 1.800 . 5.000 4.136 4.066 4.186 . 0 0 "[ . 1 . 2 .]" 1
709 1 66 ALA HA 1 84 VAL MG2 1.800 . 6.400 3.252 3.066 3.497 . 0 0 "[ . 1 . 2 .]" 1
710 1 67 VAL H 1 84 VAL MG2 1.800 . 6.400 3.787 3.660 3.954 . 0 0 "[ . 1 . 2 .]" 1
711 1 77 VAL MG1 1 84 VAL MG1 1.800 . 5.552 3.535 3.361 3.689 . 0 0 "[ . 1 . 2 .]" 1
712 1 78 ILE MD 1 84 VAL HB 1.800 . 6.400 2.674 2.200 3.143 . 0 0 "[ . 1 . 2 .]" 1
713 1 78 ILE MD 1 84 VAL MG1 1.800 . 8.000 3.280 2.720 3.714 . 0 0 "[ . 1 . 2 .]" 1
714 1 78 ILE QG 1 84 VAL MG1 1.800 . 8.000 3.594 2.923 4.878 . 0 0 "[ . 1 . 2 .]" 1
715 1 78 ILE MG 1 84 VAL MG1 1.800 . 8.000 5.108 4.834 5.486 . 0 0 "[ . 1 . 2 .]" 1
716 1 78 ILE MD 1 84 VAL MG2 1.800 . 4.688 2.878 2.034 3.065 . 0 0 "[ . 1 . 2 .]" 1
717 1 78 ILE QG 1 84 VAL MG2 1.800 . 8.000 2.280 1.891 3.715 . 0 0 "[ . 1 . 2 .]" 1
718 1 83 ASP HB3 1 84 VAL HA 1.800 . 5.000 4.852 4.665 4.932 . 0 0 "[ . 1 . 2 .]" 1
719 1 83 ASP HA 1 84 VAL HB 1.800 . 5.000 4.606 4.507 4.810 . 0 0 "[ . 1 . 2 .]" 1
720 1 83 ASP HA 1 84 VAL MG1 1.800 . 4.360 3.605 3.510 3.673 . 0 0 "[ . 1 . 2 .]" 1
721 1 83 ASP HA 1 84 VAL H 1.800 . 3.000 2.147 2.115 2.203 . 0 0 "[ . 1 . 2 .]" 1
722 1 84 VAL HA 1 84 VAL MG1 1.800 . 4.360 3.177 3.170 3.197 . 0 0 "[ . 1 . 2 .]" 1
723 1 84 VAL HA 1 84 VAL MG2 1.800 . 4.360 2.378 2.266 2.469 . 0 0 "[ . 1 . 2 .]" 1
724 1 84 VAL H 1 84 VAL MG1 1.800 . 4.000 1.865 1.844 1.952 . 0 0 "[ . 1 . 2 .]" 1
725 1 37 ILE HB 1 85 VAL HB 1.800 . 2.700 2.884 2.807 2.953 0.253 2 0 "[ . 1 . 2 .]" 1
726 1 37 ILE HA 1 85 VAL MG1 1.800 . 6.400 2.547 2.282 2.908 . 0 0 "[ . 1 . 2 .]" 1
727 1 37 ILE HB 1 85 VAL MG1 1.800 . 4.360 1.885 1.806 2.157 . 0 0 "[ . 1 . 2 .]" 1
728 1 37 ILE HB 1 85 VAL MG2 1.800 . 6.400 3.130 2.948 3.309 . 0 0 "[ . 1 . 2 .]" 1
729 1 38 LYS QE 1 85 VAL MG1 1.800 . 7.850 5.536 5.003 5.800 . 0 0 "[ . 1 . 2 .]" 1
730 1 42 HIS HB2 1 85 VAL HA 1.800 . 5.000 3.234 3.149 3.329 . 0 0 "[ . 1 . 2 .]" 1
731 1 42 HIS HB2 1 85 VAL MG1 1.800 . 6.400 1.880 1.854 1.904 . 0 0 "[ . 1 . 2 .]" 1
732 1 42 HIS HB2 1 85 VAL MG2 1.800 . 5.000 4.311 4.243 4.358 . 0 0 "[ . 1 . 2 .]" 1
733 1 42 HIS H 1 85 VAL MG2 1.800 . 6.400 4.476 4.371 4.583 . 0 0 "[ . 1 . 2 .]" 1
734 1 44 ILE MD 1 85 VAL HA 1.800 . 6.400 4.928 4.746 5.078 . 0 0 "[ . 1 . 2 .]" 1
735 1 44 ILE MD 1 85 VAL HB 1.800 . 4.360 2.952 2.717 3.386 . 0 0 "[ . 1 . 2 .]" 1
736 1 59 LEU MD2 1 85 VAL HB 1.800 . 6.400 3.076 2.971 3.169 . 0 0 "[ . 1 . 2 .]" 1
737 1 59 LEU HG 1 85 VAL HB 1.800 . 5.000 4.651 4.358 4.894 . 0 0 "[ . 1 . 2 .]" 1
738 1 64 ILE MG 1 85 VAL HB 1.800 . 6.400 3.598 3.492 3.675 . 0 0 "[ . 1 . 2 .]" 1
739 1 64 ILE MG 1 85 VAL MG1 1.800 . 4.688 1.987 1.857 2.128 . 0 0 "[ . 1 . 2 .]" 1
740 1 64 ILE HA 1 85 VAL MG2 1.800 . 6.400 4.252 4.230 4.284 . 0 0 "[ . 1 . 2 .]" 1
741 1 64 ILE MG 1 85 VAL MG2 1.800 . 4.688 1.597 1.578 1.619 0.222 24 0 "[ . 1 . 2 .]" 1
742 1 65 ASN H 1 85 VAL MG2 1.800 . 4.360 3.489 3.470 3.522 . 0 0 "[ . 1 . 2 .]" 1
743 1 66 ALA HA 1 85 VAL HB 1.800 . 5.000 4.206 4.155 4.267 . 0 0 "[ . 1 . 2 .]" 1
744 1 66 ALA HA 1 85 VAL MG1 1.800 . 6.400 4.400 4.290 4.487 . 0 0 "[ . 1 . 2 .]" 1
745 1 66 ALA HA 1 85 VAL MG2 1.800 . 6.400 1.902 1.865 1.959 . 0 0 "[ . 1 . 2 .]" 1
746 1 66 ALA MB 1 85 VAL MG2 1.800 . 5.555 1.799 1.755 1.833 0.045 20 0 "[ . 1 . 2 .]" 1
747 1 66 ALA H 1 85 VAL MG2 1.800 . 6.400 3.611 3.540 3.664 . 0 0 "[ . 1 . 2 .]" 1
748 1 66 ALA HA 1 85 VAL H 1.800 . 3.000 2.488 2.428 2.523 . 0 0 "[ . 1 . 2 .]" 1
749 1 66 ALA MB 1 85 VAL H 1.800 . 6.300 3.574 3.514 3.656 . 0 0 "[ . 1 . 2 .]" 1
750 1 84 VAL HA 1 85 VAL H 1.800 . 3.000 2.172 2.156 2.183 . 0 0 "[ . 1 . 2 .]" 1
751 1 84 VAL MG2 1 85 VAL H 1.800 . 3.640 2.468 2.313 2.712 . 0 0 "[ . 1 . 2 .]" 1
752 1 85 VAL HA 1 85 VAL MG1 1.800 . 4.360 2.195 2.101 2.314 . 0 0 "[ . 1 . 2 .]" 1
753 1 85 VAL HA 1 85 VAL MG2 1.800 . 4.360 3.187 3.177 3.198 . 0 0 "[ . 1 . 2 .]" 1
754 1 85 VAL MG1 1 85 VAL MG2 1.800 . 4.688 2.027 2.014 2.056 . 0 0 "[ . 1 . 2 .]" 1
755 1 85 VAL H 1 85 VAL HB 1.800 . 4.000 3.661 3.651 3.673 . 0 0 "[ . 1 . 2 .]" 1
756 1 85 VAL H 1 85 VAL MG1 1.800 . 6.400 2.917 2.693 3.018 . 0 0 "[ . 1 . 2 .]" 1
757 1 85 VAL H 1 85 VAL MG2 1.800 . 4.360 1.821 1.773 1.842 0.027 3 0 "[ . 1 . 2 .]" 1
758 1 43 LEU HA 1 86 VAL HB 1.800 . 5.000 2.603 2.447 2.797 . 0 0 "[ . 1 . 2 .]" 1
759 1 43 LEU MD1 1 86 VAL HB 1.800 . 4.360 1.910 1.825 2.029 . 0 0 "[ . 1 . 2 .]" 1
760 1 43 LEU HA 1 86 VAL MG1 1.800 . 6.400 4.027 3.815 4.191 . 0 0 "[ . 1 . 2 .]" 1
761 1 43 LEU MD1 1 86 VAL MG1 1.800 . 4.688 2.432 2.288 2.714 . 0 0 "[ . 1 . 2 .]" 1
762 1 43 LEU HA 1 86 VAL MG2 1.800 . 6.400 3.721 3.543 3.895 . 0 0 "[ . 1 . 2 .]" 1
763 1 43 LEU MD1 1 86 VAL MG2 1.800 . 5.552 3.258 3.057 3.436 . 0 0 "[ . 1 . 2 .]" 1
764 1 43 LEU HA 1 86 VAL H 1.800 . 4.000 2.815 2.633 2.926 . 0 0 "[ . 1 . 2 .]" 1
765 1 43 LEU MD1 1 86 VAL H 1.800 . 6.400 3.687 3.594 3.793 . 0 0 "[ . 1 . 2 .]" 1
766 1 67 VAL MG2 1 86 VAL HA 1.800 . 4.860 3.761 3.536 3.924 . 0 0 "[ . 1 . 2 .]" 1
767 1 67 VAL H 1 86 VAL HA 1.800 . 5.000 2.558 2.365 2.708 . 0 0 "[ . 1 . 2 .]" 1
768 1 67 VAL H 1 86 VAL MG1 1.800 . 5.200 4.003 3.748 4.130 . 0 0 "[ . 1 . 2 .]" 1
769 1 67 VAL HB 1 86 VAL MG2 1.800 . 6.400 3.549 2.994 4.050 . 0 0 "[ . 1 . 2 .]" 1
770 1 67 VAL H 1 86 VAL MG2 1.800 . 6.400 4.014 3.812 4.242 . 0 0 "[ . 1 . 2 .]" 1
771 1 68 ALA HA 1 86 VAL MG1 1.800 . 6.400 4.241 4.097 4.431 . 0 0 "[ . 1 . 2 .]" 1
772 1 69 TYR HB3 1 86 VAL MG1 1.800 . 6.400 3.897 3.656 4.099 . 0 0 "[ . 1 . 2 .]" 1
773 1 69 TYR HB2 1 86 VAL MG1 1.800 . 6.400 3.153 2.794 3.448 . 0 0 "[ . 1 . 2 .]" 1
774 1 77 VAL HA 1 86 VAL MG1 1.800 . 6.400 4.025 3.624 4.357 . 0 0 "[ . 1 . 2 .]" 1
775 1 77 VAL MG1 1 86 VAL MG1 1.800 . 8.000 1.843 1.716 1.986 0.084 14 0 "[ . 1 . 2 .]" 1
776 1 77 VAL HA 1 86 VAL MG2 1.800 . 6.400 3.704 3.182 4.050 . 0 0 "[ . 1 . 2 .]" 1
777 1 77 VAL MG1 1 86 VAL MG2 1.800 . 5.552 1.638 1.614 1.671 0.186 11 0 "[ . 1 . 2 .]" 1
778 1 84 VAL MG2 1 86 VAL HA 1.800 . 6.400 3.968 3.853 4.097 . 0 0 "[ . 1 . 2 .]" 1
779 1 84 VAL MG1 1 86 VAL MG2 1.800 . 4.688 3.163 3.123 3.208 . 0 0 "[ . 1 . 2 .]" 1
780 1 84 VAL MG1 1 86 VAL H 1.800 . 6.400 4.615 4.445 4.669 . 0 0 "[ . 1 . 2 .]" 1
781 1 84 VAL MG2 1 86 VAL H 1.800 . 6.400 4.083 3.804 4.286 . 0 0 "[ . 1 . 2 .]" 1
782 1 85 VAL HA 1 86 VAL MG2 1.800 . 6.400 3.338 3.264 3.401 . 0 0 "[ . 1 . 2 .]" 1
783 1 85 VAL H 1 86 VAL MG2 1.800 . 6.400 4.320 4.203 4.412 . 0 0 "[ . 1 . 2 .]" 1
784 1 85 VAL HA 1 86 VAL H 1.800 . 3.000 2.196 2.180 2.212 . 0 0 "[ . 1 . 2 .]" 1
785 1 85 VAL MG2 1 86 VAL H 1.800 . 6.400 4.176 4.121 4.222 . 0 0 "[ . 1 . 2 .]" 1
786 1 86 VAL HA 1 86 VAL MG1 1.800 . 4.360 2.178 2.120 2.315 . 0 0 "[ . 1 . 2 .]" 1
787 1 86 VAL HA 1 86 VAL MG2 1.800 . 4.360 2.457 2.402 2.509 . 0 0 "[ . 1 . 2 .]" 1
788 1 86 VAL MG1 1 86 VAL MG2 1.800 . 4.688 1.990 1.840 2.080 . 0 0 "[ . 1 . 2 .]" 1
789 1 86 VAL H 1 86 VAL MG1 1.800 . 4.360 3.753 3.735 3.760 . 0 0 "[ . 1 . 2 .]" 1
790 1 86 VAL H 1 86 VAL MG2 1.800 . 4.000 2.100 1.991 2.206 . 0 0 "[ . 1 . 2 .]" 1
791 1 43 LEU MD1 1 87 VAL HA 1.800 . 6.400 3.407 3.128 3.744 . 0 0 "[ . 1 . 2 .]" 1
792 1 44 ILE HB 1 87 VAL HA 1.800 . 5.000 1.959 1.907 2.084 . 0 0 "[ . 1 . 2 .]" 1
793 1 44 ILE QG 1 87 VAL HA 1.800 . 6.400 3.332 2.941 3.520 . 0 0 "[ . 1 . 2 .]" 1
794 1 44 ILE HB 1 87 VAL HB 1.800 . 3.300 2.114 1.972 2.259 . 0 0 "[ . 1 . 2 .]" 1
795 1 44 ILE HB 1 87 VAL MG1 1.800 . 6.400 2.010 1.894 2.305 . 0 0 "[ . 1 . 2 .]" 1
796 1 44 ILE MD 1 87 VAL MG1 1.800 . 8.000 2.060 1.663 3.234 0.137 9 0 "[ . 1 . 2 .]" 1
797 1 44 ILE H 1 87 VAL MG1 1.800 . 4.360 2.779 2.707 2.866 . 0 0 "[ . 1 . 2 .]" 1
798 1 44 ILE HB 1 87 VAL MG2 1.800 . 4.360 3.683 3.639 3.751 . 0 0 "[ . 1 . 2 .]" 1
799 1 52 CYS HA 1 87 VAL MG2 1.800 . 3.640 2.428 2.087 2.676 . 0 0 "[ . 1 . 2 .]" 1
800 1 52 CYS HB3 1 87 VAL MG2 1.800 . 4.360 3.085 2.747 3.513 . 0 0 "[ . 1 . 2 .]" 1
801 1 52 CYS HB2 1 87 VAL MG2 1.800 . 6.400 4.354 4.049 4.601 . 0 0 "[ . 1 . 2 .]" 1
802 1 55 LEU QB 1 87 VAL MG1 1.800 . 7.850 3.704 3.102 4.137 . 0 0 "[ . 1 . 2 .]" 1
803 1 55 LEU MD1 1 87 VAL MG1 1.800 . 5.552 1.777 1.724 1.853 0.076 3 0 "[ . 1 . 2 .]" 1
804 1 55 LEU HA 1 87 VAL MG2 1.800 . 6.400 4.799 4.564 5.089 . 0 0 "[ . 1 . 2 .]" 1
805 1 55 LEU QB 1 87 VAL MG2 1.800 . 5.555 2.598 2.109 3.004 . 0 0 "[ . 1 . 2 .]" 1
806 1 55 LEU MD1 1 87 VAL MG2 1.800 . 5.552 2.129 1.899 2.552 . 0 0 "[ . 1 . 2 .]" 1
807 1 55 LEU MD2 1 87 VAL MG2 1.800 . 6.400 4.371 4.327 4.406 . 0 0 "[ . 1 . 2 .]" 1
808 1 56 ALA HA 1 87 VAL MG2 1.800 . 4.360 2.863 2.588 3.142 . 0 0 "[ . 1 . 2 .]" 1
809 1 56 ALA MB 1 87 VAL MG2 1.800 . 4.745 2.229 1.987 2.375 . 0 0 "[ . 1 . 2 .]" 1
810 1 56 ALA H 1 87 VAL MG2 1.800 . 4.360 3.027 2.764 3.285 . 0 0 "[ . 1 . 2 .]" 1
811 1 56 ALA MB 1 87 VAL H 1.800 . 6.300 3.968 3.759 4.223 . 0 0 "[ . 1 . 2 .]" 1
812 1 67 VAL H 1 87 VAL MG1 1.800 . 4.360 3.389 3.307 3.484 . 0 0 "[ . 1 . 2 .]" 1
813 1 68 ALA HA 1 87 VAL HB 1.800 . 5.000 4.600 4.391 4.708 . 0 0 "[ . 1 . 2 .]" 1
814 1 68 ALA HA 1 87 VAL MG1 1.800 . 6.400 4.277 4.161 4.388 . 0 0 "[ . 1 . 2 .]" 1
815 1 68 ALA HA 1 87 VAL MG2 1.800 . 6.400 1.978 1.865 2.090 . 0 0 "[ . 1 . 2 .]" 1
816 1 68 ALA MB 1 87 VAL MG2 1.800 . 7.850 2.305 2.218 2.461 . 0 0 "[ . 1 . 2 .]" 1
817 1 68 ALA HA 1 87 VAL H 1.800 . 3.000 3.098 3.023 3.145 0.145 14 0 "[ . 1 . 2 .]" 1
818 1 68 ALA MB 1 87 VAL H 1.800 . 6.300 4.346 4.222 4.415 . 0 0 "[ . 1 . 2 .]" 1
819 1 86 VAL HA 1 87 VAL HA 1.800 . 5.000 4.472 4.458 4.484 . 0 0 "[ . 1 . 2 .]" 1
820 1 86 VAL HA 1 87 VAL MG1 1.800 . 6.400 3.540 3.452 3.591 . 0 0 "[ . 1 . 2 .]" 1
821 1 86 VAL HA 1 87 VAL MG2 1.800 . 6.400 4.008 3.938 4.086 . 0 0 "[ . 1 . 2 .]" 1
822 1 86 VAL HA 1 87 VAL H 1.800 . 3.000 2.236 2.221 2.251 . 0 0 "[ . 1 . 2 .]" 1
823 1 86 VAL MG1 1 87 VAL H 1.800 . 4.360 2.990 2.866 3.122 . 0 0 "[ . 1 . 2 .]" 1
824 1 86 VAL MG2 1 87 VAL H 1.800 . 5.200 4.322 4.258 4.356 . 0 0 "[ . 1 . 2 .]" 1
825 1 87 VAL HA 1 87 VAL MG1 1.800 . 4.360 2.413 2.375 2.452 . 0 0 "[ . 1 . 2 .]" 1
826 1 87 VAL HA 1 87 VAL MG2 1.800 . 4.360 3.213 3.206 3.220 . 0 0 "[ . 1 . 2 .]" 1
827 1 87 VAL MG1 1 87 VAL MG2 1.800 . 4.688 2.010 1.931 2.058 . 0 0 "[ . 1 . 2 .]" 1
828 1 87 VAL H 1 87 VAL HB 1.800 . 4.000 3.730 3.714 3.758 . 0 0 "[ . 1 . 2 .]" 1
829 1 87 VAL H 1 87 VAL MG1 1.800 . 5.200 2.421 2.333 2.502 . 0 0 "[ . 1 . 2 .]" 1
830 1 87 VAL H 1 87 VAL MG2 1.800 . 4.000 2.082 2.004 2.176 . 0 0 "[ . 1 . 2 .]" 1
831 1 43 LEU MD1 1 88 ALA MB 1.800 . 4.745 2.897 2.751 3.001 . 0 0 "[ . 1 . 2 .]" 1
832 1 45 PHE QD 1 88 ALA MB 1.800 . 7.700 4.617 4.232 5.010 . 0 0 "[ . 1 . 2 .]" 1
833 1 45 PHE QE 1 88 ALA MB 1.800 . 7.700 4.519 3.845 4.999 . 0 0 "[ . 1 . 2 .]" 1
834 1 45 PHE HA 1 88 ALA H 1.800 . 4.000 3.375 3.269 3.551 . 0 0 "[ . 1 . 2 .]" 1
835 1 68 ALA HA 1 88 ALA MB 1.800 . 6.300 3.591 3.385 3.860 . 0 0 "[ . 1 . 2 .]" 1
836 1 69 TYR HA 1 88 ALA MB 1.800 . 6.300 3.694 3.631 3.750 . 0 0 "[ . 1 . 2 .]" 1
837 1 69 TYR HB3 1 88 ALA MB 1.800 . 4.396 1.784 1.764 1.817 0.036 11 0 "[ . 1 . 2 .]" 1
838 1 69 TYR QD 1 88 ALA MB 1.800 . 7.700 3.313 3.053 3.527 . 0 0 "[ . 1 . 2 .]" 1
839 1 69 TYR H 1 88 ALA MB 1.800 . 6.300 1.950 1.881 2.161 . 0 0 "[ . 1 . 2 .]" 1
840 1 70 TYR QD 1 88 ALA MB 1.800 . 7.700 4.543 4.258 4.913 . 0 0 "[ . 1 . 2 .]" 1
841 1 77 VAL MG2 1 88 ALA MB 1.800 . 5.555 3.812 3.763 3.859 . 0 0 "[ . 1 . 2 .]" 1
842 1 86 VAL HA 1 88 ALA MB 1.800 . 6.300 4.821 4.748 4.928 . 0 0 "[ . 1 . 2 .]" 1
843 1 86 VAL MG1 1 88 ALA MB 1.800 . 4.745 2.718 2.625 2.818 . 0 0 "[ . 1 . 2 .]" 1
844 1 87 VAL MG2 1 88 ALA HA 1.800 . 6.400 3.878 3.826 3.927 . 0 0 "[ . 1 . 2 .]" 1
845 1 87 VAL HA 1 88 ALA MB 1.800 . 6.300 4.046 4.022 4.074 . 0 0 "[ . 1 . 2 .]" 1
846 1 87 VAL H 1 88 ALA MB 1.800 . 6.300 4.079 3.936 4.211 . 0 0 "[ . 1 . 2 .]" 1
847 1 87 VAL HA 1 88 ALA H 1.800 . 3.000 2.246 2.232 2.258 . 0 0 "[ . 1 . 2 .]" 1
848 1 88 ALA H 1 88 ALA MB 1.800 . 4.060 2.456 2.390 2.503 . 0 0 "[ . 1 . 2 .]" 1
849 1 45 PHE HA 1 89 THR HA 1.800 . 5.000 3.431 3.288 3.614 . 0 0 "[ . 1 . 2 .]" 1
850 1 45 PHE QD 1 89 THR HA 1.800 . 6.300 2.792 2.302 3.177 . 0 0 "[ . 1 . 2 .]" 1
851 1 70 TYR HB3 1 89 THR MG 1.800 . 3.640 2.483 2.208 2.807 . 0 0 "[ . 1 . 2 .]" 1
852 1 70 TYR HB2 1 89 THR MG 1.800 . 4.360 3.002 2.613 3.446 . 0 0 "[ . 1 . 2 .]" 1
853 1 89 THR HA 1 89 THR MG 1.800 . 4.040 3.191 3.180 3.210 . 0 0 "[ . 1 . 2 .]" 1
854 1 45 PHE QD 1 90 ASP HA 1.800 . 6.300 4.595 4.406 4.788 . 0 0 "[ . 1 . 2 .]" 1
855 1 45 PHE QE 1 90 ASP HA 1.800 . 6.300 3.579 2.817 4.118 . 0 0 "[ . 1 . 2 .]" 1
856 1 89 THR HA 1 90 ASP H 1.800 . 5.000 3.266 3.012 3.582 . 0 0 "[ . 1 . 2 .]" 1
857 1 69 TYR QD 1 91 ALA MB 1.800 . 7.700 2.120 1.801 2.511 . 0 0 "[ . 1 . 2 .]" 1
858 1 69 TYR QE 1 91 ALA MB 1.800 . 5.558 3.027 2.707 3.436 . 0 0 "[ . 1 . 2 .]" 1
859 1 70 TYR HA 1 91 ALA MB 1.800 . 4.396 1.847 1.774 2.057 0.026 6 0 "[ . 1 . 2 .]" 1
860 1 70 TYR HB3 1 91 ALA MB 1.800 . 6.300 3.694 3.629 3.897 . 0 0 "[ . 1 . 2 .]" 1
861 1 70 TYR HB2 1 91 ALA MB 1.800 . 6.300 3.798 3.664 4.024 . 0 0 "[ . 1 . 2 .]" 1
862 1 71 ARG HA 1 91 ALA MB 1.800 . 4.396 3.407 2.980 3.605 . 0 0 "[ . 1 . 2 .]" 1
863 1 71 ARG QB 1 91 ALA MB 1.800 . 5.558 3.838 3.685 3.935 . 0 0 "[ . 1 . 2 .]" 1
864 1 89 THR MG 1 91 ALA HA 1.800 . 6.400 4.206 3.813 4.855 . 0 0 "[ . 1 . 2 .]" 1
865 1 89 THR MG 1 91 ALA MB 1.800 . 5.555 2.551 2.063 3.472 . 0 0 "[ . 1 . 2 .]" 1
866 1 90 ASP HB2 1 91 ALA MB 1.800 . 6.300 5.085 4.712 5.279 . 0 0 "[ . 1 . 2 .]" 1
867 1 43 LEU MD2 1 92 LEU MD1 1.800 . 8.000 4.779 4.400 5.303 . 0 0 "[ . 1 . 2 .]" 1
868 1 43 LEU QB 1 92 LEU MD2 1.800 . 5.555 4.048 3.943 4.110 . 0 0 "[ . 1 . 2 .]" 1
869 1 43 LEU MD1 1 92 LEU MD2 1.800 . 5.552 2.030 1.860 2.493 . 0 0 "[ . 1 . 2 .]" 1
870 1 43 LEU MD2 1 92 LEU MD2 1.800 . 5.552 2.832 2.693 3.196 . 0 0 "[ . 1 . 2 .]" 1
871 1 43 LEU HG 1 92 LEU MD2 1.800 . 6.400 4.382 4.069 4.786 . 0 0 "[ . 1 . 2 .]" 1
872 1 45 PHE QE 1 92 LEU MD2 1.800 . 7.850 4.570 4.079 4.994 . 0 0 "[ . 1 . 2 .]" 1
873 1 69 TYR QD 1 92 LEU HA 1.800 . 6.300 3.134 2.393 3.920 . 0 0 "[ . 1 . 2 .]" 1
874 1 69 TYR QE 1 92 LEU HA 1.800 . 4.396 3.497 2.756 4.192 . 0 0 "[ . 1 . 2 .]" 1
875 1 69 TYR QD 1 92 LEU MD1 1.800 . 7.850 2.736 1.892 3.518 . 0 0 "[ . 1 . 2 .]" 1
876 1 69 TYR QE 1 92 LEU MD1 1.800 . 7.850 3.595 2.692 4.080 . 0 0 "[ . 1 . 2 .]" 1
877 1 69 TYR QD 1 92 LEU MD2 1.800 . 7.850 4.764 4.118 5.178 . 0 0 "[ . 1 . 2 .]" 1
878 1 77 VAL HB 1 92 LEU MD1 1.800 . 6.400 3.598 3.000 4.324 . 0 0 "[ . 1 . 2 .]" 1
879 1 86 VAL MG2 1 92 LEU MD1 1.800 . 8.000 3.643 2.578 4.141 . 0 0 "[ . 1 . 2 .]" 1
880 1 86 VAL MG2 1 92 LEU MD2 1.800 . 5.552 3.603 3.501 3.703 . 0 0 "[ . 1 . 2 .]" 1
881 1 88 ALA MB 1 92 LEU QB 1.800 . 5.558 2.324 2.055 2.911 . 0 0 "[ . 1 . 2 .]" 1
882 1 91 ALA MB 1 92 LEU HA 1.800 . 6.300 3.896 3.745 3.959 . 0 0 "[ . 1 . 2 .]" 1
883 1 92 LEU HA 1 92 LEU MD1 1.800 . 4.360 2.490 1.965 3.017 . 0 0 "[ . 1 . 2 .]" 1
884 1 92 LEU QB 1 92 LEU MD1 1.800 . 4.745 2.050 1.880 2.246 . 0 0 "[ . 1 . 2 .]" 1
885 1 92 LEU HA 1 92 LEU MD2 1.800 . 4.360 3.730 3.619 3.822 . 0 0 "[ . 1 . 2 .]" 1
886 1 92 LEU QB 1 92 LEU MD2 1.800 . 5.555 2.007 1.885 2.117 . 0 0 "[ . 1 . 2 .]" 1
887 1 92 LEU MD1 1 92 LEU MD2 1.800 . 4.688 2.017 1.870 2.079 . 0 0 "[ . 1 . 2 .]" 1
888 1 90 ASP HA 1 93 MET ME 1.800 . 4.396 3.397 3.110 3.638 . 0 0 "[ . 1 . 2 .]" 1
889 1 93 MET HA 1 93 MET ME 1.800 . 4.396 1.894 1.832 2.006 . 0 0 "[ . 1 . 2 .]" 1
890 1 93 MET QB 1 93 MET ME 1.800 . 4.802 3.148 2.469 3.313 . 0 0 "[ . 1 . 2 .]" 1
891 1 93 MET HA 1 93 MET QG 1.800 . 6.300 2.378 2.214 2.751 . 0 0 "[ . 1 . 2 .]" 1
892 1 93 MET QB 1 93 MET QG 1.800 . 7.700 2.041 2.013 2.052 . 0 0 "[ . 1 . 2 .]" 1
893 1 93 MET ME 1 93 MET QG 1.800 . 5.558 1.997 1.918 2.255 . 0 0 "[ . 1 . 2 .]" 1
894 1 92 LEU MD2 1 94 THR HA 1.800 . 4.360 3.239 2.497 3.587 . 0 0 "[ . 1 . 2 .]" 1
895 1 93 MET ME 1 94 THR HB 1.800 . 6.300 4.986 4.409 5.200 . 0 0 "[ . 1 . 2 .]" 1
896 1 93 MET HA 1 94 THR MG 1.800 . 6.400 3.682 2.865 5.394 . 0 0 "[ . 1 . 2 .]" 1
897 1 93 MET ME 1 94 THR MG 1.800 . 7.850 3.814 2.837 5.360 . 0 0 "[ . 1 . 2 .]" 1
898 1 94 THR HA 1 94 THR MG 1.800 . 3.640 2.816 1.972 3.190 . 0 0 "[ . 1 . 2 .]" 1
899 1 92 LEU MD1 1 96 PHE QD 1.800 . 7.850 5.217 4.467 5.918 . 0 0 "[ . 1 . 2 .]" 1
900 1 95 GLY QA 1 96 PHE HA 1.800 . 6.300 4.044 3.993 4.104 . 0 0 "[ . 1 . 2 .]" 1
901 1 95 GLY QA 1 96 PHE HB3 1.800 . 6.300 4.091 3.871 4.364 . 0 0 "[ . 1 . 2 .]" 1
902 1 95 GLY QA 1 96 PHE H 1.800 . 6.300 2.558 2.218 2.829 . 0 0 "[ . 1 . 2 .]" 1
903 1 96 PHE HA 1 96 PHE QD 1.800 . 4.396 3.710 3.681 3.742 . 0 0 "[ . 1 . 2 .]" 1
904 1 92 LEU MD2 1 97 THR HB 1.800 . 4.360 3.010 2.527 3.533 . 0 0 "[ . 1 . 2 .]" 1
905 1 94 THR HB 1 97 THR HB 1.800 . 4.000 4.058 4.003 4.119 0.119 23 0 "[ . 1 . 2 .]" 1
906 1 94 THR MG 1 97 THR MG 1.800 . 4.688 3.074 1.890 3.313 . 0 0 "[ . 1 . 2 .]" 1
907 1 95 GLY QA 1 97 THR MG 1.800 . 7.850 4.794 3.722 5.898 . 0 0 "[ . 1 . 2 .]" 1
908 1 96 PHE HA 1 97 THR MG 1.800 . 6.400 4.843 4.291 5.406 . 0 0 "[ . 1 . 2 .]" 1
909 1 97 THR HA 1 97 THR MG 1.800 . 6.400 2.932 2.054 3.211 . 0 0 "[ . 1 . 2 .]" 1
910 1 92 LEU MD2 1 98 GLY H 1.800 . 6.400 5.093 4.596 5.317 . 0 0 "[ . 1 . 2 .]" 1
911 1 97 THR HA 1 98 GLY QA 1.800 . 6.300 4.220 4.099 4.284 . 0 0 "[ . 1 . 2 .]" 1
912 1 41 ARG QB 1 100 PHE HA 1.800 . 6.300 3.090 2.681 3.393 . 0 0 "[ . 1 . 2 .]" 1
913 1 41 ARG QD 1 100 PHE HA 1.800 . 6.300 4.584 4.053 5.057 . 0 0 "[ . 1 . 2 .]" 1
914 1 41 ARG QB 1 100 PHE HB3 1.800 . 6.300 4.697 4.336 4.859 . 0 0 "[ . 1 . 2 .]" 1
915 1 41 ARG QB 1 100 PHE HB2 1.800 . 6.300 5.548 5.189 5.704 . 0 0 "[ . 1 . 2 .]" 1
916 1 42 HIS HA 1 100 PHE HB3 1.800 . 5.000 2.881 2.624 3.271 . 0 0 "[ . 1 . 2 .]" 1
917 1 42 HIS HA 1 100 PHE QD 1.800 . 6.300 2.822 1.971 4.120 . 0 0 "[ . 1 . 2 .]" 1
918 1 43 LEU MD2 1 100 PHE HB3 1.800 . 6.400 4.872 4.545 5.030 . 0 0 "[ . 1 . 2 .]" 1
919 1 43 LEU MD1 1 100 PHE QE 1.800 . 5.555 3.166 2.454 4.020 . 0 0 "[ . 1 . 2 .]" 1
920 1 43 LEU MD2 1 100 PHE QE 1.800 . 5.555 3.102 2.035 4.138 . 0 0 "[ . 1 . 2 .]" 1
921 1 43 LEU MD1 1 100 PHE HZ 1.800 . 6.400 3.388 2.882 4.089 . 0 0 "[ . 1 . 2 .]" 1
922 1 84 VAL MG1 1 100 PHE QE 1.800 . 7.850 4.367 3.751 5.118 . 0 0 "[ . 1 . 2 .]" 1
923 1 86 VAL MG1 1 100 PHE QE 1.800 . 7.850 4.211 3.654 4.796 . 0 0 "[ . 1 . 2 .]" 1
924 1 86 VAL MG2 1 100 PHE QE 1.800 . 5.555 2.425 1.906 3.130 . 0 0 "[ . 1 . 2 .]" 1
925 1 86 VAL MG1 1 100 PHE HZ 1.800 . 6.400 3.919 3.508 4.653 . 0 0 "[ . 1 . 2 .]" 1
926 1 86 VAL MG2 1 100 PHE HZ 1.800 . 6.400 2.911 2.289 3.617 . 0 0 "[ . 1 . 2 .]" 1
927 1 92 LEU MD2 1 100 PHE QE 1.800 . 5.555 3.443 2.834 4.020 . 0 0 "[ . 1 . 2 .]" 1
928 1 92 LEU MD1 1 100 PHE HZ 1.800 . 6.400 4.591 3.481 5.138 . 0 0 "[ . 1 . 2 .]" 1
929 1 92 LEU MD2 1 100 PHE HZ 1.800 . 6.400 3.220 2.571 3.703 . 0 0 "[ . 1 . 2 .]" 1
930 1 98 GLY QA 1 100 PHE QD 1.800 . 7.700 3.592 3.067 4.265 . 0 0 "[ . 1 . 2 .]" 1
931 1 98 GLY QA 1 100 PHE QE 1.800 . 7.700 4.355 3.669 5.091 . 0 0 "[ . 1 . 2 .]" 1
932 1 99 ASP HA 1 100 PHE QD 1.800 . 6.300 4.673 3.700 5.275 . 0 0 "[ . 1 . 2 .]" 1
933 1 100 PHE HA 1 100 PHE QD 1.800 . 4.396 2.459 1.880 3.106 . 0 0 "[ . 1 . 2 .]" 1
934 1 42 HIS HA 1 103 VAL MG1 1.800 . 6.400 4.580 4.231 4.907 . 0 0 "[ . 1 . 2 .]" 1
935 1 43 LEU HG 1 103 VAL HA 1.800 . 5.000 4.544 4.240 4.868 . 0 0 "[ . 1 . 2 .]" 1
936 1 43 LEU H 1 103 VAL HA 1.800 . 4.000 2.853 2.683 3.050 . 0 0 "[ . 1 . 2 .]" 1
937 1 43 LEU HA 1 103 VAL MG1 1.800 . 6.400 4.304 4.125 4.673 . 0 0 "[ . 1 . 2 .]" 1
938 1 43 LEU MD2 1 103 VAL MG1 1.800 . 5.552 2.310 1.938 2.578 . 0 0 "[ . 1 . 2 .]" 1
939 1 45 PHE HB2 1 103 VAL HB 1.800 . 5.000 4.868 4.552 5.031 0.031 19 0 "[ . 1 . 2 .]" 1
940 1 45 PHE QD 1 103 VAL MG1 1.800 . 5.555 3.210 2.776 3.556 . 0 0 "[ . 1 . 2 .]" 1
941 1 45 PHE QE 1 103 VAL MG1 1.800 . 5.555 2.457 1.925 2.724 . 0 0 "[ . 1 . 2 .]" 1
942 1 45 PHE QD 1 103 VAL MG2 1.800 . 7.850 4.421 4.025 4.712 . 0 0 "[ . 1 . 2 .]" 1
943 1 45 PHE QE 1 103 VAL MG2 1.800 . 7.850 4.054 3.429 4.693 . 0 0 "[ . 1 . 2 .]" 1
944 1 100 PHE HB2 1 103 VAL MG1 1.800 . 6.400 3.525 3.070 3.819 . 0 0 "[ . 1 . 2 .]" 1
945 1 100 PHE QD 1 103 VAL MG1 1.800 . 5.555 3.789 2.997 4.311 . 0 0 "[ . 1 . 2 .]" 1
946 1 102 SER HA 1 103 VAL MG1 1.800 . 6.400 4.233 3.796 4.498 . 0 0 "[ . 1 . 2 .]" 1
947 1 103 VAL HA 1 103 VAL MG1 1.800 . 4.360 2.126 1.922 2.242 . 0 0 "[ . 1 . 2 .]" 1
948 1 103 VAL HA 1 103 VAL MG2 1.800 . 4.360 3.132 3.088 3.181 . 0 0 "[ . 1 . 2 .]" 1
949 1 19 LEU QB 1 104 ILE MG 1.800 . 7.850 3.982 3.622 4.262 . 0 0 "[ . 1 . 2 .]" 1
950 1 19 LEU MD1 1 104 ILE MG 1.800 . 4.688 2.343 2.053 2.623 . 0 0 "[ . 1 . 2 .]" 1
951 1 19 LEU MD2 1 104 ILE MG 1.800 . 5.552 2.765 2.414 3.165 . 0 0 "[ . 1 . 2 .]" 1
952 1 27 PHE HB3 1 104 ILE MG 1.800 . 6.400 4.647 4.210 5.206 . 0 0 "[ . 1 . 2 .]" 1
953 1 27 PHE QD 1 104 ILE MG 1.800 . 7.850 3.471 3.009 3.998 . 0 0 "[ . 1 . 2 .]" 1
954 1 27 PHE HZ 1 104 ILE MG 1.800 . 6.400 3.535 2.916 4.161 . 0 0 "[ . 1 . 2 .]" 1
955 1 32 ILE MD 1 104 ILE MD 1.800 . 5.552 3.471 3.125 3.613 . 0 0 "[ . 1 . 2 .]" 1
956 1 32 ILE MD 1 104 ILE QG 1.800 . 8.000 2.680 2.187 3.118 . 0 0 "[ . 1 . 2 .]" 1
957 1 32 ILE MG 1 104 ILE QG 1.800 . 8.000 3.112 2.867 3.435 . 0 0 "[ . 1 . 2 .]" 1
958 1 32 ILE HA 1 104 ILE MG 1.800 . 6.400 4.277 4.133 4.441 . 0 0 "[ . 1 . 2 .]" 1
959 1 32 ILE MD 1 104 ILE MG 1.800 . 5.552 1.721 1.642 1.892 0.158 12 0 "[ . 1 . 2 .]" 1
960 1 32 ILE QG 1 104 ILE MG 1.800 . 8.000 2.211 2.065 2.380 . 0 0 "[ . 1 . 2 .]" 1
961 1 36 VAL MG2 1 104 ILE MD 1.800 . 5.552 2.218 1.961 2.447 . 0 0 "[ . 1 . 2 .]" 1
962 1 37 ILE MG 1 104 ILE HB 1.800 . 6.400 3.486 3.238 3.699 . 0 0 "[ . 1 . 2 .]" 1
963 1 37 ILE HA 1 104 ILE MD 1.800 . 6.400 3.450 3.192 4.447 . 0 0 "[ . 1 . 2 .]" 1
964 1 37 ILE HB 1 104 ILE MD 1.800 . 6.400 3.986 3.753 5.212 . 0 0 "[ . 1 . 2 .]" 1
965 1 37 ILE MG 1 104 ILE MD 1.800 . 4.688 1.811 1.674 2.629 0.126 17 0 "[ . 1 . 2 .]" 1
966 1 37 ILE MG 1 104 ILE QG 1.800 . 4.688 2.775 1.879 3.218 . 0 0 "[ . 1 . 2 .]" 1
967 1 42 HIS HB3 1 104 ILE HB 1.800 . 5.000 5.042 5.016 5.065 0.065 6 0 "[ . 1 . 2 .]" 1
968 1 42 HIS HB2 1 104 ILE MD 1.800 . 6.400 3.782 3.445 5.219 . 0 0 "[ . 1 . 2 .]" 1
969 1 42 HIS HB3 1 104 ILE QG 1.800 . 6.400 4.798 3.012 5.033 . 0 0 "[ . 1 . 2 .]" 1
970 1 44 ILE HA 1 104 ILE HB 1.800 . 5.000 2.620 2.211 2.919 . 0 0 "[ . 1 . 2 .]" 1
971 1 44 ILE QG 1 104 ILE HB 1.800 . 6.400 2.621 1.960 4.149 . 0 0 "[ . 1 . 2 .]" 1
972 1 44 ILE HA 1 104 ILE MD 1.800 . 6.400 3.570 3.272 4.678 . 0 0 "[ . 1 . 2 .]" 1
973 1 44 ILE QG 1 104 ILE MD 1.800 . 5.552 2.678 1.999 3.978 . 0 0 "[ . 1 . 2 .]" 1
974 1 44 ILE MD 1 104 ILE QG 1.800 . 8.000 3.801 2.810 4.299 . 0 0 "[ . 1 . 2 .]" 1
975 1 44 ILE HA 1 104 ILE MG 1.800 . 6.400 3.749 3.564 3.925 . 0 0 "[ . 1 . 2 .]" 1
976 1 44 ILE MD 1 104 ILE MG 1.800 . 5.552 3.350 2.701 3.620 . 0 0 "[ . 1 . 2 .]" 1
977 1 44 ILE MG 1 104 ILE MG 1.800 . 5.552 2.236 1.889 2.493 . 0 0 "[ . 1 . 2 .]" 1
978 1 103 VAL MG2 1 104 ILE HA 1.800 . 6.400 4.776 4.448 4.974 . 0 0 "[ . 1 . 2 .]" 1
979 1 104 ILE HA 1 104 ILE MD 1.800 . 6.400 3.161 2.117 3.423 . 0 0 "[ . 1 . 2 .]" 1
980 1 104 ILE HA 1 104 ILE QG 1.800 . 6.400 2.233 2.141 3.051 . 0 0 "[ . 1 . 2 .]" 1
981 1 104 ILE MD 1 104 ILE QG 1.800 . 5.552 1.904 1.877 1.915 . 0 0 "[ . 1 . 2 .]" 1
982 1 104 ILE HA 1 104 ILE MG 1.800 . 4.360 2.443 2.223 2.529 . 0 0 "[ . 1 . 2 .]" 1
983 1 104 ILE MD 1 104 ILE MG 1.800 . 4.688 3.064 1.926 3.192 . 0 0 "[ . 1 . 2 .]" 1
984 1 104 ILE QG 1 104 ILE MG 1.800 . 8.000 1.949 1.885 2.206 . 0 0 "[ . 1 . 2 .]" 1
985 1 45 PHE HB2 1 105 ASP HA 1.800 . 3.300 2.247 1.931 2.670 . 0 0 "[ . 1 . 2 .]" 1
986 1 45 PHE QD 1 105 ASP HA 1.800 . 6.300 3.920 3.450 4.255 . 0 0 "[ . 1 . 2 .]" 1
987 1 45 PHE H 1 105 ASP HA 1.800 . 4.000 2.743 2.442 3.020 . 0 0 "[ . 1 . 2 .]" 1
988 1 103 VAL MG2 1 105 ASP HB2 1.800 . 6.400 4.664 4.044 4.911 . 0 0 "[ . 1 . 2 .]" 1
989 1 27 PHE HZ 1 106 CYS HA 1.800 . 5.000 4.622 3.585 5.040 0.040 19 0 "[ . 1 . 2 .]" 1
990 1 28 TYR QD 1 106 CYS HA 1.800 . 6.300 3.616 2.922 4.576 . 0 0 "[ . 1 . 2 .]" 1
991 1 28 TYR QE 1 106 CYS HB3 1.800 . 6.300 3.389 1.971 4.599 . 0 0 "[ . 1 . 2 .]" 1
992 1 28 TYR QE 1 106 CYS HB2 1.800 . 6.300 3.099 2.350 5.023 . 0 0 "[ . 1 . 2 .]" 1
993 1 45 PHE HB2 1 106 CYS H 1.800 . 4.000 3.758 3.430 4.031 0.031 3 0 "[ . 1 . 2 .]" 1
994 1 46 CYS HA 1 106 CYS HB3 1.800 . 5.000 4.302 3.638 5.033 0.033 5 0 "[ . 1 . 2 .]" 1
995 1 46 CYS HA 1 106 CYS HB2 1.800 . 5.000 4.406 3.607 5.053 0.053 18 0 "[ . 1 . 2 .]" 1
996 1 47 HIS HB3 1 106 CYS HB3 1.800 . 5.000 4.278 3.289 5.005 0.005 14 0 "[ . 1 . 2 .]" 1
997 1 105 ASP HB2 1 107 ASN HA 1.800 . 6.000 5.466 5.347 5.555 . 0 0 "[ . 1 . 2 .]" 1
998 1 47 HIS HB3 1 108 THR MG 1.800 . 6.400 5.078 3.698 5.416 . 0 0 "[ . 1 . 2 .]" 1
999 1 108 THR HA 1 108 THR HB 1.800 . 2.700 2.747 2.606 2.971 0.271 3 0 "[ . 1 . 2 .]" 1
1000 1 108 THR HA 1 108 THR MG 1.800 . 4.360 2.343 2.017 2.824 . 0 0 "[ . 1 . 2 .]" 1
1001 1 47 HIS HA 1 109 SER HA 1.800 . 5.000 3.551 2.948 4.410 . 0 0 "[ . 1 . 2 .]" 1
1002 1 47 HIS HB3 1 109 SER HA 1.800 . 5.000 2.828 2.096 3.259 . 0 0 "[ . 1 . 2 .]" 1
1003 1 47 HIS HB2 1 109 SER HA 1.800 . 5.000 2.553 2.081 3.089 . 0 0 "[ . 1 . 2 .]" 1
1004 1 47 HIS HA 1 109 SER HB2 1.800 . 5.000 4.759 4.335 4.992 . 0 0 "[ . 1 . 2 .]" 1
1005 1 110 ASP HB2 1 111 GLY QA 1.800 . 6.300 5.233 4.189 5.594 . 0 0 "[ . 1 . 2 .]" 1
1006 1 111 GLY QA 1 112 LYS QG 1.800 . 7.700 3.859 3.305 4.681 . 0 0 "[ . 1 . 2 .]" 1
1007 1 112 LYS HA 1 112 LYS QG 1.800 . 4.396 2.410 2.039 3.010 . 0 0 "[ . 1 . 2 .]" 1
1008 1 112 LYS QB 1 112 LYS QG 1.800 . 4.802 2.054 2.025 2.094 . 0 0 "[ . 1 . 2 .]" 1
1009 1 112 LYS QE 1 112 LYS QG 1.800 . 5.558 2.110 1.953 2.429 . 0 0 "[ . 1 . 2 .]" 1
1010 1 108 THR HA 1 113 PRO HA 1.800 . 3.300 2.243 1.931 2.740 . 0 0 "[ . 1 . 2 .]" 1
1011 1 108 THR HB 1 113 PRO HA 1.800 . 5.000 3.840 3.224 4.411 . 0 0 "[ . 1 . 2 .]" 1
1012 1 108 THR MG 1 113 PRO HA 1.800 . 6.400 2.477 1.830 3.636 . 0 0 "[ . 1 . 2 .]" 1
1013 1 108 THR MG 1 113 PRO QD 1.800 . 5.555 3.906 3.780 4.056 . 0 0 "[ . 1 . 2 .]" 1
1014 1 112 LYS QB 1 113 PRO HA 1.800 . 6.300 4.587 4.568 4.606 . 0 0 "[ . 1 . 2 .]" 1
1015 1 112 LYS HA 1 113 PRO QD 1.800 . 4.396 2.138 2.112 2.157 . 0 0 "[ . 1 . 2 .]" 1
1016 1 112 LYS QB 1 113 PRO QD 1.800 . 7.700 2.163 2.050 2.354 . 0 0 "[ . 1 . 2 .]" 1
1017 1 112 LYS QG 1 113 PRO QD 1.800 . 7.700 3.194 2.649 3.928 . 0 0 "[ . 1 . 2 .]" 1
1018 1 112 LYS HA 1 113 PRO QG 1.800 . 6.300 4.037 4.013 4.056 . 0 0 "[ . 1 . 2 .]" 1
1019 1 113 PRO HA 1 113 PRO QD 1.800 . 6.300 3.318 3.290 3.350 . 0 0 "[ . 1 . 2 .]" 1
1020 1 113 PRO QD 1 113 PRO QG 1.800 . 5.558 1.975 1.967 1.981 . 0 0 "[ . 1 . 2 .]" 1
1021 1 107 ASN HB3 1 114 GLN QB 1.800 . 6.300 4.048 3.345 4.521 . 0 0 "[ . 1 . 2 .]" 1
1022 1 108 THR HA 1 114 GLN HA 1.800 . 5.000 3.626 3.269 3.865 . 0 0 "[ . 1 . 2 .]" 1
1023 1 108 THR HA 1 114 GLN QB 1.800 . 6.300 3.097 2.754 3.356 . 0 0 "[ . 1 . 2 .]" 1
1024 1 108 THR HB 1 114 GLN QB 1.800 . 6.300 5.271 4.968 5.451 . 0 0 "[ . 1 . 2 .]" 1
1025 1 109 SER HB3 1 114 GLN HA 1.800 . 5.000 2.852 2.451 3.306 . 0 0 "[ . 1 . 2 .]" 1
1026 1 109 SER HB2 1 114 GLN HA 1.800 . 5.000 4.491 4.036 4.862 . 0 0 "[ . 1 . 2 .]" 1
1027 1 109 SER HB3 1 114 GLN QB 1.800 . 6.300 3.793 3.306 4.118 . 0 0 "[ . 1 . 2 .]" 1
1028 1 109 SER HB2 1 114 GLN QB 1.800 . 6.300 5.328 4.802 5.649 . 0 0 "[ . 1 . 2 .]" 1
1029 1 113 PRO HA 1 114 GLN QB 1.800 . 6.300 4.217 3.950 4.400 . 0 0 "[ . 1 . 2 .]" 1
1030 1 114 GLN HA 1 114 GLN QG 1.800 . 4.396 3.029 1.934 3.460 . 0 0 "[ . 1 . 2 .]" 1
1031 1 114 GLN QB 1 114 GLN QG 1.800 . 7.700 2.072 2.009 2.109 . 0 0 "[ . 1 . 2 .]" 1
1032 1 114 GLN QB 1 115 ASP HA 1.800 . 6.300 4.713 4.410 4.998 . 0 0 "[ . 1 . 2 .]" 1
1033 1 115 ASP HA 1 115 ASP HB3 1.800 . 2.700 2.418 2.396 2.435 . 0 0 "[ . 1 . 2 .]" 1
1034 1 115 ASP HA 1 115 ASP HB2 1.800 . 2.700 2.531 2.515 2.555 . 0 0 "[ . 1 . 2 .]" 1
1035 1 7 VAL HA 1 116 ALA MB 1.800 . 6.300 4.810 4.518 5.133 . 0 0 "[ . 1 . 2 .]" 1
1036 1 8 THR HB 1 116 ALA MB 1.800 . 6.300 4.670 4.064 5.116 . 0 0 "[ . 1 . 2 .]" 1
1037 1 116 ALA HA 1 117 VAL HA 1.800 . 5.000 4.748 4.707 4.792 . 0 0 "[ . 1 . 2 .]" 1
1038 1 116 ALA MB 1 117 VAL HA 1.800 . 6.300 3.731 3.640 3.844 . 0 0 "[ . 1 . 2 .]" 1
1039 1 117 VAL HA 1 117 VAL MG1 1.800 . 4.360 2.374 2.329 2.461 . 0 0 "[ . 1 . 2 .]" 1
1040 1 117 VAL HA 1 117 VAL MG2 1.800 . 3.640 3.182 3.174 3.187 . 0 0 "[ . 1 . 2 .]" 1
1041 1 109 SER HB3 1 118 SER HB2 1.800 . 6.000 5.577 5.044 6.014 0.014 4 0 "[ . 1 . 2 .]" 1
1042 1 114 GLN HA 1 118 SER HB3 1.800 . 5.000 4.172 3.746 5.055 0.055 20 0 "[ . 1 . 2 .]" 1
1043 1 114 GLN QB 1 118 SER HB3 1.800 . 6.300 2.574 1.895 4.823 . 0 0 "[ . 1 . 2 .]" 1
1044 1 114 GLN QG 1 118 SER HB3 1.800 . 6.300 2.997 1.797 3.998 0.003 6 0 "[ . 1 . 2 .]" 1
1045 1 114 GLN QG 1 118 SER HB2 1.800 . 6.300 3.442 1.924 4.728 . 0 0 "[ . 1 . 2 .]" 1
1046 1 117 VAL MG2 1 118 SER HA 1.800 . 6.400 2.997 2.976 3.022 . 0 0 "[ . 1 . 2 .]" 1
1047 1 117 VAL HA 1 118 SER HB3 1.800 . 6.000 6.051 5.950 6.182 0.182 21 0 "[ . 1 . 2 .]" 1
1048 1 8 THR HB 1 119 ARG QB 1.800 . 6.300 5.580 5.311 5.694 . 0 0 "[ . 1 . 2 .]" 1
1049 1 107 ASN QB 1 119 ARG QB 1.800 . 6.800 5.313 5.168 5.375 . 0 0 "[ . 1 . 2 .]" 1
1050 1 116 ALA HA 1 119 ARG QB 1.800 . 6.300 5.056 4.876 5.175 . 0 0 "[ . 1 . 2 .]" 1
1051 1 119 ARG QB 1 119 ARG QD 1.800 . 7.700 2.310 2.062 2.391 . 0 0 "[ . 1 . 2 .]" 1
1052 1 119 ARG HA 1 119 ARG QG 1.800 . 4.396 3.311 3.297 3.341 . 0 0 "[ . 1 . 2 .]" 1
1053 1 119 ARG QB 1 119 ARG QG 1.800 . 7.700 2.084 2.057 2.098 . 0 0 "[ . 1 . 2 .]" 1
1054 1 119 ARG H 1 119 ARG QG 1.800 . 6.300 2.001 1.913 2.299 . 0 0 "[ . 1 . 2 .]" 1
1055 1 117 VAL HA 1 120 THR HB 1.800 . 5.000 1.974 1.902 2.115 . 0 0 "[ . 1 . 2 .]" 1
1056 1 117 VAL HB 1 120 THR HB 1.800 . 3.300 3.327 3.283 3.361 0.061 17 0 "[ . 1 . 2 .]" 1
1057 1 117 VAL MG2 1 120 THR HB 1.800 . 6.400 4.262 4.218 4.297 . 0 0 "[ . 1 . 2 .]" 1
1058 1 119 ARG HA 1 120 THR HA 1.800 . 5.000 4.871 4.853 4.884 . 0 0 "[ . 1 . 2 .]" 1
1059 1 119 ARG QG 1 120 THR HA 1.800 . 3.724 3.366 3.261 3.446 . 0 0 "[ . 1 . 2 .]" 1
1060 1 120 THR HA 1 120 THR MG 1.800 . 3.640 2.296 2.165 2.392 . 0 0 "[ . 1 . 2 .]" 1
1061 1 93 MET ME 1 121 GLN QG 1.800 . 7.700 3.649 1.888 5.254 . 0 0 "[ . 1 . 2 .]" 1
1062 1 94 THR HB 1 121 GLN QG 1.800 . 6.300 5.351 4.664 5.702 . 0 0 "[ . 1 . 2 .]" 1
1063 1 117 VAL MG2 1 121 GLN QB 1.800 . 5.555 3.721 3.634 3.774 . 0 0 "[ . 1 . 2 .]" 1
1064 1 117 VAL HB 1 121 GLN QG 1.800 . 6.300 5.511 5.033 5.690 . 0 0 "[ . 1 . 2 .]" 1
1065 1 118 SER HA 1 121 GLN QB 1.800 . 4.396 3.110 2.880 3.289 . 0 0 "[ . 1 . 2 .]" 1
1066 1 118 SER HB2 1 121 GLN QB 1.800 . 6.300 5.474 4.953 5.641 . 0 0 "[ . 1 . 2 .]" 1
1067 1 118 SER HA 1 121 GLN QG 1.800 . 6.300 4.980 4.531 5.302 . 0 0 "[ . 1 . 2 .]" 1
1068 1 119 ARG HA 1 121 GLN QB 1.800 . 6.300 5.203 5.048 5.339 . 0 0 "[ . 1 . 2 .]" 1
1069 1 120 THR MG 1 121 GLN HA 1.800 . 6.400 3.768 3.490 3.935 . 0 0 "[ . 1 . 2 .]" 1
1070 1 120 THR MG 1 121 GLN QB 1.800 . 7.850 4.067 3.802 4.257 . 0 0 "[ . 1 . 2 .]" 1
1071 1 121 GLN HA 1 121 GLN QG 1.800 . 4.396 2.254 2.032 2.750 . 0 0 "[ . 1 . 2 .]" 1
1072 1 121 GLN QB 1 121 GLN QG 1.800 . 5.558 2.072 2.037 2.107 . 0 0 "[ . 1 . 2 .]" 1
1073 1 103 VAL MG2 1 122 ARG QB 1.800 . 7.700 4.502 3.865 4.840 . 0 0 "[ . 1 . 2 .]" 1
1074 1 107 ASN HA 1 122 ARG QD 1.800 . 6.300 4.653 4.155 5.363 . 0 0 "[ . 1 . 2 .]" 1
1075 1 118 SER HA 1 122 ARG QG 1.800 . 6.300 3.620 2.830 4.728 . 0 0 "[ . 1 . 2 .]" 1
1076 1 119 ARG QB 1 122 ARG QB 1.800 . 5.558 3.739 3.648 3.910 . 0 0 "[ . 1 . 2 .]" 1
1077 1 121 GLN QG 1 122 ARG QG 1.800 . 7.700 4.169 3.619 5.039 . 0 0 "[ . 1 . 2 .]" 1
1078 1 121 GLN QB 1 122 ARG QG 1.800 . 7.700 3.265 2.953 4.035 . 0 0 "[ . 1 . 2 .]" 1
1079 1 122 ARG HA 1 122 ARG QD 1.800 . 6.300 3.939 3.337 4.028 . 0 0 "[ . 1 . 2 .]" 1
1080 1 122 ARG QB 1 122 ARG QD 1.800 . 7.700 2.105 2.007 2.163 . 0 0 "[ . 1 . 2 .]" 1
1081 1 122 ARG HA 1 122 ARG QG 1.800 . 6.300 2.248 1.998 2.323 . 0 0 "[ . 1 . 2 .]" 1
1082 1 122 ARG QB 1 122 ARG QG 1.800 . 7.700 2.095 2.050 2.110 . 0 0 "[ . 1 . 2 .]" 1
1083 1 122 ARG QD 1 122 ARG QG 1.800 . 7.700 2.092 2.071 2.113 . 0 0 "[ . 1 . 2 .]" 1
1084 1 10 PRO QB 1 123 ARG QD 1.800 . 7.700 6.171 6.002 6.240 . 0 0 "[ . 1 . 2 .]" 1
1085 1 14 ILE MG 1 123 ARG HA 1.800 . 6.400 3.923 3.631 4.220 . 0 0 "[ . 1 . 2 .]" 1
1086 1 14 ILE MD 1 123 ARG QB 1.800 . 4.745 3.494 3.341 3.675 . 0 0 "[ . 1 . 2 .]" 1
1087 1 14 ILE MD 1 123 ARG QD 1.800 . 7.850 3.296 2.170 3.973 . 0 0 "[ . 1 . 2 .]" 1
1088 1 14 ILE MG 1 123 ARG QD 1.800 . 7.850 3.491 2.829 4.568 . 0 0 "[ . 1 . 2 .]" 1
1089 1 14 ILE MD 1 123 ARG QG 1.800 . 5.555 1.927 1.746 2.275 0.054 11 0 "[ . 1 . 2 .]" 1
1090 1 14 ILE MG 1 123 ARG QG 1.800 . 5.555 2.467 1.954 2.930 . 0 0 "[ . 1 . 2 .]" 1
1091 1 16 GLU QG 1 123 ARG QD 1.800 . 7.700 3.736 2.557 5.806 . 0 0 "[ . 1 . 2 .]" 1
1092 1 103 VAL HB 1 123 ARG HA 1.800 . 5.000 4.561 3.829 5.061 0.061 15 0 "[ . 1 . 2 .]" 1
1093 1 103 VAL MG1 1 123 ARG HA 1.800 . 6.400 4.245 3.754 4.494 . 0 0 "[ . 1 . 2 .]" 1
1094 1 103 VAL MG2 1 123 ARG HA 1.800 . 6.400 2.774 2.122 2.969 . 0 0 "[ . 1 . 2 .]" 1
1095 1 103 VAL MG2 1 123 ARG QB 1.800 . 7.850 4.517 3.910 4.750 . 0 0 "[ . 1 . 2 .]" 1
1096 1 103 VAL MG2 1 123 ARG QG 1.800 . 7.850 3.734 3.340 4.210 . 0 0 "[ . 1 . 2 .]" 1
1097 1 103 VAL MG2 1 123 ARG H 1.800 . 6.400 4.976 4.540 5.149 . 0 0 "[ . 1 . 2 .]" 1
1098 1 119 ARG QG 1 123 ARG QB 1.800 . 5.558 4.063 3.887 4.355 . 0 0 "[ . 1 . 2 .]" 1
1099 1 119 ARG QB 1 123 ARG QD 1.800 . 7.700 4.432 3.361 5.345 . 0 0 "[ . 1 . 2 .]" 1
1100 1 119 ARG QG 1 123 ARG QD 1.800 . 7.700 4.560 3.866 5.232 . 0 0 "[ . 1 . 2 .]" 1
1101 1 119 ARG QG 1 123 ARG QG 1.800 . 7.700 5.666 5.313 6.086 . 0 0 "[ . 1 . 2 .]" 1
1102 1 120 THR HA 1 123 ARG QB 1.800 . 4.396 3.106 2.791 3.268 . 0 0 "[ . 1 . 2 .]" 1
1103 1 120 THR HA 1 123 ARG QD 1.800 . 6.300 4.007 2.887 5.498 . 0 0 "[ . 1 . 2 .]" 1
1104 1 123 ARG HA 1 123 ARG QD 1.800 . 6.300 4.039 3.788 4.287 . 0 0 "[ . 1 . 2 .]" 1
1105 1 123 ARG QB 1 123 ARG QD 1.800 . 7.700 2.192 1.884 2.545 . 0 0 "[ . 1 . 2 .]" 1
1106 1 123 ARG HA 1 123 ARG QG 1.800 . 6.300 2.279 2.044 2.649 . 0 0 "[ . 1 . 2 .]" 1
1107 1 123 ARG QB 1 123 ARG QG 1.800 . 7.700 2.082 2.047 2.107 . 0 0 "[ . 1 . 2 .]" 1
1108 1 123 ARG QD 1 123 ARG QG 1.800 . 7.700 2.056 1.990 2.105 . 0 0 "[ . 1 . 2 .]" 1
1109 1 14 ILE MD 1 124 GLY QA 1.800 . 7.850 2.747 1.821 3.175 . 0 0 "[ . 1 . 2 .]" 1
1110 1 120 THR MG 1 124 GLY QA 1.800 . 7.850 5.058 4.622 5.348 . 0 0 "[ . 1 . 2 .]" 1
1111 1 121 GLN HA 1 124 GLY QA 1.800 . 6.300 4.131 3.786 4.338 . 0 0 "[ . 1 . 2 .]" 1
1112 1 123 ARG QG 1 124 GLY QA 1.800 . 7.700 3.819 3.192 4.224 . 0 0 "[ . 1 . 2 .]" 1
1113 1 43 LEU MD2 1 125 ARG QB 1.800 . 7.850 2.921 2.536 3.344 . 0 0 "[ . 1 . 2 .]" 1
1114 1 43 LEU MD2 1 125 ARG QD 1.800 . 7.850 2.720 1.889 4.183 . 0 0 "[ . 1 . 2 .]" 1
1115 1 43 LEU MD2 1 125 ARG QG 1.800 . 7.850 2.108 1.735 2.854 0.065 7 0 "[ . 1 . 2 .]" 1
1116 1 94 THR HA 1 125 ARG QG 1.800 . 6.300 5.055 4.091 5.702 . 0 0 "[ . 1 . 2 .]" 1
1117 1 103 VAL MG1 1 125 ARG HA 1.800 . 6.400 4.475 4.088 4.740 . 0 0 "[ . 1 . 2 .]" 1
1118 1 103 VAL HB 1 125 ARG QB 1.800 . 6.300 4.179 3.805 4.607 . 0 0 "[ . 1 . 2 .]" 1
1119 1 103 VAL MG2 1 125 ARG QB 1.800 . 5.555 2.952 2.553 3.638 . 0 0 "[ . 1 . 2 .]" 1
1120 1 122 ARG HA 1 125 ARG QG 1.800 . 6.300 4.134 2.365 5.472 . 0 0 "[ . 1 . 2 .]" 1
1121 1 125 ARG HA 1 125 ARG QD 1.800 . 4.396 2.851 1.905 3.720 . 0 0 "[ . 1 . 2 .]" 1
1122 1 125 ARG QB 1 125 ARG QD 1.800 . 7.700 2.163 1.927 2.581 . 0 0 "[ . 1 . 2 .]" 1
1123 1 125 ARG HA 1 125 ARG QG 1.800 . 4.396 2.229 1.933 2.807 . 0 0 "[ . 1 . 2 .]" 1
1124 1 125 ARG QD 1 125 ARG QG 1.800 . 7.700 2.078 2.047 2.113 . 0 0 "[ . 1 . 2 .]" 1
1125 1 14 ILE MD 1 126 THR HB 1.800 . 4.860 3.942 3.767 4.082 . 0 0 "[ . 1 . 2 .]" 1
1126 1 14 ILE MG 1 126 THR HB 1.800 . 6.400 4.315 3.594 5.158 . 0 0 "[ . 1 . 2 .]" 1
1127 1 14 ILE HA 1 126 THR MG 1.800 . 6.400 3.543 3.088 5.147 . 0 0 "[ . 1 . 2 .]" 1
1128 1 14 ILE MD 1 126 THR MG 1.800 . 4.688 1.764 1.737 1.871 0.063 9 0 "[ . 1 . 2 .]" 1
1129 1 14 ILE MG 1 126 THR MG 1.800 . 4.688 2.050 1.757 2.670 0.043 11 0 "[ . 1 . 2 .]" 1
1130 1 100 PHE HB2 1 126 THR HA 1.800 . 5.000 2.940 2.544 3.571 . 0 0 "[ . 1 . 2 .]" 1
1131 1 102 SER HB2 1 126 THR HB 1.800 . 5.000 5.035 4.793 5.081 0.081 23 0 "[ . 1 . 2 .]" 1
1132 1 102 SER HA 1 126 THR MG 1.800 . 4.360 2.915 2.459 3.607 . 0 0 "[ . 1 . 2 .]" 1
1133 1 103 VAL MG1 1 126 THR HB 1.800 . 4.360 3.129 2.826 3.498 . 0 0 "[ . 1 . 2 .]" 1
1134 1 103 VAL MG2 1 126 THR HB 1.800 . 4.360 2.317 1.940 2.873 . 0 0 "[ . 1 . 2 .]" 1
1135 1 123 ARG QG 1 126 THR MG 1.800 . 7.850 3.552 2.860 3.937 . 0 0 "[ . 1 . 2 .]" 1
1136 1 124 GLY QA 1 126 THR MG 1.800 . 7.850 4.479 3.871 4.777 . 0 0 "[ . 1 . 2 .]" 1
1137 1 126 THR HA 1 126 THR MG 1.800 . 4.360 3.193 3.052 3.219 . 0 0 "[ . 1 . 2 .]" 1
1138 1 13 ASN HB3 1 127 GLY QA 1.800 . 6.300 3.866 3.098 4.988 . 0 0 "[ . 1 . 2 .]" 1
1139 1 14 ILE HA 1 127 GLY QA 1.800 . 4.396 3.883 3.564 3.981 . 0 0 "[ . 1 . 2 .]" 1
1140 1 14 ILE MD 1 127 GLY QA 1.800 . 7.850 3.552 2.929 3.712 . 0 0 "[ . 1 . 2 .]" 1
1141 1 14 ILE QG 1 127 GLY QA 1.800 . 7.850 2.605 2.331 2.729 . 0 0 "[ . 1 . 2 .]" 1
1142 1 124 GLY QA 1 127 GLY QA 1.800 . 7.700 5.642 4.807 5.815 . 0 0 "[ . 1 . 2 .]" 1
1143 1 126 THR HA 1 127 GLY QA 1.800 . 6.300 4.030 4.012 4.042 . 0 0 "[ . 1 . 2 .]" 1
1144 1 126 THR MG 1 127 GLY QA 1.800 . 7.850 3.577 3.242 4.654 . 0 0 "[ . 1 . 2 .]" 1
1145 1 98 GLY QA 1 128 ARG QB 1.800 . 7.700 3.622 2.917 4.578 . 0 0 "[ . 1 . 2 .]" 1
1146 1 99 ASP HB2 1 128 ARG QB 1.800 . 6.300 4.379 2.796 5.080 . 0 0 "[ . 1 . 2 .]" 1
1147 1 125 ARG HA 1 128 ARG QD 1.800 . 6.300 3.994 2.545 5.493 . 0 0 "[ . 1 . 2 .]" 1
1148 1 128 ARG HA 1 128 ARG QD 1.800 . 4.396 2.527 1.875 3.601 . 0 0 "[ . 1 . 2 .]" 1
1149 1 128 ARG QB 1 128 ARG QD 1.800 . 5.558 2.257 1.965 2.487 . 0 0 "[ . 1 . 2 .]" 1
1150 1 128 ARG HA 1 128 ARG QG 1.800 . 4.396 2.479 1.924 3.112 . 0 0 "[ . 1 . 2 .]" 1
1151 1 128 ARG QB 1 128 ARG QG 1.800 . 4.802 2.036 2.014 2.070 . 0 0 "[ . 1 . 2 .]" 1
1152 1 128 ARG QD 1 128 ARG QG 1.800 . 4.802 2.094 2.060 2.116 . 0 0 "[ . 1 . 2 .]" 1
1153 1 128 ARG HA 1 129 GLY QA 1.800 . 5.000 4.017 3.972 4.290 . 0 0 "[ . 1 . 2 .]" 1
1154 1 127 GLY QA 1 130 LYS QG 1.800 . 7.700 3.009 1.967 5.894 . 0 0 "[ . 1 . 2 .]" 1
1155 1 130 LYS HA 1 130 LYS QD 1.800 . 6.300 4.187 3.486 4.465 . 0 0 "[ . 1 . 2 .]" 1
1156 1 130 LYS QB 1 130 LYS QD 1.800 . 5.558 2.097 1.944 2.308 . 0 0 "[ . 1 . 2 .]" 1
1157 1 130 LYS HA 1 130 LYS QE 1.800 . 7.420 4.872 3.576 5.594 . 0 0 "[ . 1 . 2 .]" 1
1158 1 130 LYS QB 1 130 LYS QE 1.800 . 5.558 2.925 1.968 3.678 . 0 0 "[ . 1 . 2 .]" 1
1159 1 130 LYS HA 1 130 LYS QG 1.800 . 6.300 3.162 1.951 3.381 . 0 0 "[ . 1 . 2 .]" 1
1160 1 130 LYS QB 1 130 LYS QG 1.800 . 5.558 2.088 2.047 2.111 . 0 0 "[ . 1 . 2 .]" 1
1161 1 130 LYS QD 1 130 LYS QG 1.800 . 4.802 2.066 2.038 2.109 . 0 0 "[ . 1 . 2 .]" 1
1162 1 130 LYS QE 1 130 LYS QG 1.800 . 5.558 2.103 1.920 2.350 . 0 0 "[ . 1 . 2 .]" 1
1163 1 13 ASN HB3 1 131 PRO HA 1.800 . 5.000 4.147 3.113 5.016 0.016 24 0 "[ . 1 . 2 .]" 1
1164 1 13 ASN HB2 1 131 PRO HA 1.800 . 5.000 4.939 3.915 5.068 0.068 13 0 "[ . 1 . 2 .]" 1
1165 1 13 ASN HA 1 131 PRO QB 1.800 . 6.300 4.026 3.447 4.394 . 0 0 "[ . 1 . 2 .]" 1
1166 1 14 ILE HA 1 131 PRO HA 1.800 . 5.000 3.742 3.455 3.951 . 0 0 "[ . 1 . 2 .]" 1
1167 1 127 GLY QA 1 131 PRO HA 1.800 . 6.300 3.168 3.022 3.327 . 0 0 "[ . 1 . 2 .]" 1
1168 1 130 LYS QG 1 131 PRO HA 1.800 . 6.300 4.265 3.921 5.500 . 0 0 "[ . 1 . 2 .]" 1
1169 1 130 LYS QG 1 131 PRO QB 1.800 . 7.700 4.578 4.124 5.394 . 0 0 "[ . 1 . 2 .]" 1
1170 1 130 LYS HA 1 131 PRO QD 1.800 . 4.396 2.347 2.232 2.494 . 0 0 "[ . 1 . 2 .]" 1
1171 1 130 LYS QG 1 131 PRO QD 1.800 . 7.700 2.438 1.873 3.753 . 0 0 "[ . 1 . 2 .]" 1
1172 1 130 LYS QB 1 131 PRO QD 1.800 . 5.558 1.825 1.793 1.913 0.007 1 0 "[ . 1 . 2 .]" 1
1173 1 130 LYS QD 1 131 PRO QD 1.800 . 7.700 3.445 1.981 4.158 . 0 0 "[ . 1 . 2 .]" 1
1174 1 130 LYS HA 1 131 PRO QG 1.800 . 6.300 4.228 4.100 4.392 . 0 0 "[ . 1 . 2 .]" 1
1175 1 130 LYS QG 1 131 PRO QG 1.800 . 7.700 3.963 3.413 5.033 . 0 0 "[ . 1 . 2 .]" 1
1176 1 131 PRO HA 1 131 PRO QD 1.800 . 4.396 3.499 3.307 3.535 . 0 0 "[ . 1 . 2 .]" 1
1177 1 131 PRO QD 1 131 PRO QG 1.800 . 5.558 1.942 1.936 1.977 . 0 0 "[ . 1 . 2 .]" 1
1178 1 14 ILE MG 1 132 GLY QA 1.800 . 7.850 3.289 2.929 4.199 . 0 0 "[ . 1 . 2 .]" 1
1179 1 15 GLU QB 1 132 GLY QA 1.800 . 7.700 4.927 4.756 5.115 . 0 0 "[ . 1 . 2 .]" 1
1180 1 126 THR HB 1 132 GLY QA 1.800 . 3.724 3.439 3.204 3.503 . 0 0 "[ . 1 . 2 .]" 1
1181 1 126 THR MG 1 132 GLY QA 1.800 . 5.555 2.110 1.838 3.895 . 0 0 "[ . 1 . 2 .]" 1
1182 1 127 GLY QA 1 132 GLY QA 1.800 . 7.700 2.606 2.475 2.857 . 0 0 "[ . 1 . 2 .]" 1
1183 1 130 LYS QG 1 132 GLY QA 1.800 . 7.700 3.835 3.309 6.100 . 0 0 "[ . 1 . 2 .]" 1
1184 1 14 ILE MG 1 133 ILE HA 1.800 . 6.400 2.777 2.446 3.556 . 0 0 "[ . 1 . 2 .]" 1
1185 1 14 ILE HA 1 133 ILE QG 1.800 . 6.400 4.688 4.328 5.061 . 0 0 "[ . 1 . 2 .]" 1
1186 1 15 GLU QB 1 133 ILE HA 1.800 . 6.300 2.469 2.173 2.707 . 0 0 "[ . 1 . 2 .]" 1
1187 1 15 GLU QB 1 133 ILE HB 1.800 . 6.300 4.464 4.166 4.785 . 0 0 "[ . 1 . 2 .]" 1
1188 1 15 GLU QB 1 133 ILE MD 1.800 . 7.850 3.621 3.277 4.025 . 0 0 "[ . 1 . 2 .]" 1
1189 1 15 GLU QG 1 133 ILE MD 1.800 . 7.850 4.811 4.094 5.447 . 0 0 "[ . 1 . 2 .]" 1
1190 1 15 GLU QG 1 133 ILE QG 1.800 . 7.850 3.633 3.020 4.134 . 0 0 "[ . 1 . 2 .]" 1
1191 1 15 GLU QB 1 133 ILE MG 1.800 . 5.555 3.080 2.797 3.457 . 0 0 "[ . 1 . 2 .]" 1
1192 1 17 VAL HB 1 133 ILE MG 1.800 . 4.360 3.387 3.306 3.545 . 0 0 "[ . 1 . 2 .]" 1
1193 1 17 VAL MG1 1 133 ILE MG 1.800 . 5.188 3.558 3.494 3.615 . 0 0 "[ . 1 . 2 .]" 1
1194 1 36 VAL HB 1 133 ILE MG 1.800 . 6.400 4.467 3.945 4.711 . 0 0 "[ . 1 . 2 .]" 1
1195 1 101 ASP HB3 1 133 ILE HB 1.800 . 5.000 4.919 4.648 5.036 0.036 18 0 "[ . 1 . 2 .]" 1
1196 1 102 SER HA 1 133 ILE HB 1.800 . 5.000 2.891 2.651 3.364 . 0 0 "[ . 1 . 2 .]" 1
1197 1 102 SER HB3 1 133 ILE HB 1.800 . 5.000 2.523 2.108 2.951 . 0 0 "[ . 1 . 2 .]" 1
1198 1 102 SER HB2 1 133 ILE HB 1.800 . 5.000 2.260 1.931 2.847 . 0 0 "[ . 1 . 2 .]" 1
1199 1 102 SER HB3 1 133 ILE MD 1.800 . 6.400 3.173 2.724 3.721 . 0 0 "[ . 1 . 2 .]" 1
1200 1 102 SER HB2 1 133 ILE MD 1.800 . 6.400 3.653 3.266 4.114 . 0 0 "[ . 1 . 2 .]" 1
1201 1 102 SER HA 1 133 ILE MG 1.800 . 6.400 3.740 3.591 4.037 . 0 0 "[ . 1 . 2 .]" 1
1202 1 102 SER HB3 1 133 ILE MG 1.800 . 6.400 3.369 3.133 3.627 . 0 0 "[ . 1 . 2 .]" 1
1203 1 102 SER HB2 1 133 ILE MG 1.800 . 6.400 2.256 1.996 2.582 . 0 0 "[ . 1 . 2 .]" 1
1204 1 126 THR MG 1 133 ILE HA 1.800 . 6.400 3.616 3.181 4.765 . 0 0 "[ . 1 . 2 .]" 1
1205 1 132 GLY QA 1 133 ILE HA 1.800 . 6.300 4.006 3.998 4.018 . 0 0 "[ . 1 . 2 .]" 1
1206 1 132 GLY QA 1 133 ILE QG 1.800 . 7.850 3.733 3.401 4.317 . 0 0 "[ . 1 . 2 .]" 1
1207 1 133 ILE HA 1 133 ILE MD 1.800 . 4.360 3.620 3.143 3.795 . 0 0 "[ . 1 . 2 .]" 1
1208 1 133 ILE HA 1 133 ILE QG 1.800 . 4.360 2.228 2.116 2.325 . 0 0 "[ . 1 . 2 .]" 1
1209 1 133 ILE MD 1 133 ILE QG 1.800 . 4.688 1.896 1.881 1.915 . 0 0 "[ . 1 . 2 .]" 1
1210 1 133 ILE HA 1 133 ILE MG 1.800 . 3.640 2.489 2.422 2.541 . 0 0 "[ . 1 . 2 .]" 1
1211 1 133 ILE QG 1 133 ILE MG 1.800 . 5.552 2.087 1.881 2.333 . 0 0 "[ . 1 . 2 .]" 1
1212 1 14 ILE MG 1 134 TYR HA 1.800 . 6.400 3.828 3.608 4.298 . 0 0 "[ . 1 . 2 .]" 1
1213 1 14 ILE MG 1 134 TYR HB3 1.800 . 6.400 2.803 2.472 3.046 . 0 0 "[ . 1 . 2 .]" 1
1214 1 14 ILE MD 1 134 TYR HB2 1.800 . 6.400 3.332 3.004 3.768 . 0 0 "[ . 1 . 2 .]" 1
1215 1 14 ILE MG 1 134 TYR HB2 1.800 . 6.400 2.062 1.859 2.318 . 0 0 "[ . 1 . 2 .]" 1
1216 1 16 GLU HA 1 134 TYR HB3 1.800 . 5.000 2.579 2.347 2.875 . 0 0 "[ . 1 . 2 .]" 1
1217 1 16 GLU QG 1 134 TYR HB2 1.800 . 6.300 4.147 3.623 4.666 . 0 0 "[ . 1 . 2 .]" 1
1218 1 103 VAL HB 1 134 TYR HA 1.800 . 5.000 4.016 3.600 4.482 . 0 0 "[ . 1 . 2 .]" 1
1219 1 103 VAL MG2 1 134 TYR HA 1.800 . 6.400 1.965 1.877 2.160 . 0 0 "[ . 1 . 2 .]" 1
1220 1 103 VAL MG1 1 134 TYR QD 1.800 . 6.055 3.923 3.648 4.626 . 0 0 "[ . 1 . 2 .]" 1
1221 1 103 VAL MG2 1 134 TYR QD 1.800 . 7.850 1.874 1.774 2.305 0.026 1 0 "[ . 1 . 2 .]" 1
1222 1 103 VAL HB 1 134 TYR QE 1.800 . 6.300 3.059 2.253 3.800 . 0 0 "[ . 1 . 2 .]" 1
1223 1 103 VAL MG2 1 134 TYR QE 1.800 . 7.850 3.001 2.621 3.381 . 0 0 "[ . 1 . 2 .]" 1
1224 1 103 VAL MG2 1 134 TYR HH 1.800 . 6.400 4.888 4.093 5.212 . 0 0 "[ . 1 . 2 .]" 1
1225 1 105 ASP HB3 1 134 TYR QD 1.800 . 6.300 4.838 4.439 5.397 . 0 0 "[ . 1 . 2 .]" 1
1226 1 105 ASP HB2 1 134 TYR QD 1.800 . 6.300 4.321 3.841 5.208 . 0 0 "[ . 1 . 2 .]" 1
1227 1 123 ARG QG 1 134 TYR HA 1.800 . 6.300 5.138 4.455 5.713 . 0 0 "[ . 1 . 2 .]" 1
1228 1 123 ARG HA 1 134 TYR HB3 1.800 . 5.000 4.940 4.590 5.054 0.054 17 0 "[ . 1 . 2 .]" 1
1229 1 123 ARG HA 1 134 TYR HB2 1.800 . 5.000 3.873 3.419 4.069 . 0 0 "[ . 1 . 2 .]" 1
1230 1 123 ARG QB 1 134 TYR HB2 1.800 . 6.300 4.810 3.891 5.259 . 0 0 "[ . 1 . 2 .]" 1
1231 1 123 ARG QG 1 134 TYR HB2 1.800 . 6.300 3.052 2.253 3.715 . 0 0 "[ . 1 . 2 .]" 1
1232 1 123 ARG HA 1 134 TYR QD 1.800 . 6.300 2.509 1.866 3.794 . 0 0 "[ . 1 . 2 .]" 1
1233 1 123 ARG HA 1 134 TYR QE 1.800 . 6.300 2.706 2.041 3.984 . 0 0 "[ . 1 . 2 .]" 1
1234 1 126 THR MG 1 134 TYR HB2 1.800 . 4.360 2.910 1.944 3.235 . 0 0 "[ . 1 . 2 .]" 1
1235 1 133 ILE MG 1 134 TYR HA 1.800 . 4.360 3.530 3.421 3.592 . 0 0 "[ . 1 . 2 .]" 1
1236 1 134 TYR HA 1 134 TYR QE 1.800 . 6.300 4.465 4.224 4.633 . 0 0 "[ . 1 . 2 .]" 1
1237 1 16 GLU QG 1 135 ARG HA 1.800 . 6.800 5.984 5.668 6.128 . 0 0 "[ . 1 . 2 .]" 1
1238 1 17 VAL HB 1 135 ARG HA 1.800 . 5.000 2.230 2.060 2.406 . 0 0 "[ . 1 . 2 .]" 1
1239 1 17 VAL MG2 1 135 ARG HA 1.800 . 4.360 3.617 3.577 3.670 . 0 0 "[ . 1 . 2 .]" 1
1240 1 17 VAL HB 1 135 ARG QG 1.800 . 6.300 1.928 1.796 2.406 0.004 5 0 "[ . 1 . 2 .]" 1
1241 1 19 LEU MD1 1 135 ARG QB 1.800 . 7.850 2.261 1.935 2.527 . 0 0 "[ . 1 . 2 .]" 1
1242 1 19 LEU HA 1 135 ARG QD 1.800 . 6.300 3.809 2.488 5.411 . 0 0 "[ . 1 . 2 .]" 1
1243 1 36 VAL MG2 1 135 ARG QD 1.800 . 7.850 3.279 2.898 4.450 . 0 0 "[ . 1 . 2 .]" 1
1244 1 36 VAL MG1 1 135 ARG QG 1.800 . 5.555 3.552 2.744 3.895 . 0 0 "[ . 1 . 2 .]" 1
1245 1 104 ILE QG 1 135 ARG QB 1.800 . 4.745 2.182 1.871 3.719 . 0 0 "[ . 1 . 2 .]" 1
1246 1 104 ILE MG 1 135 ARG QB 1.800 . 5.555 3.097 2.636 3.570 . 0 0 "[ . 1 . 2 .]" 1
1247 1 104 ILE HA 1 135 ARG QB 1.800 . 4.396 2.234 1.932 2.542 . 0 0 "[ . 1 . 2 .]" 1
1248 1 104 ILE MD 1 135 ARG QD 1.800 . 7.850 3.688 1.839 5.063 . 0 0 "[ . 1 . 2 .]" 1
1249 1 104 ILE MG 1 135 ARG QD 1.800 . 7.850 4.089 3.509 4.520 . 0 0 "[ . 1 . 2 .]" 1
1250 1 133 ILE MG 1 135 ARG HA 1.800 . 6.400 4.295 4.174 4.457 . 0 0 "[ . 1 . 2 .]" 1
1251 1 133 ILE MG 1 135 ARG QB 1.800 . 7.850 4.155 3.769 4.298 . 0 0 "[ . 1 . 2 .]" 1
1252 1 133 ILE MG 1 135 ARG QD 1.800 . 7.850 3.530 2.588 4.445 . 0 0 "[ . 1 . 2 .]" 1
1253 1 133 ILE MG 1 135 ARG QG 1.800 . 5.555 2.463 2.215 2.861 . 0 0 "[ . 1 . 2 .]" 1
1254 1 134 TYR HA 1 135 ARG QB 1.800 . 6.300 4.384 4.096 4.536 . 0 0 "[ . 1 . 2 .]" 1
1255 1 135 ARG HA 1 135 ARG QD 1.800 . 6.300 3.608 2.442 4.239 . 0 0 "[ . 1 . 2 .]" 1
1256 1 135 ARG QD 1 135 ARG QG 1.800 . 7.700 2.090 2.048 2.114 . 0 0 "[ . 1 . 2 .]" 1
1257 1 135 ARG QB 1 135 ARG QG 1.800 . 7.700 2.079 2.046 2.108 . 0 0 "[ . 1 . 2 .]" 1
1258 1 18 ALA MB 1 136 PHE QD 1.800 . 7.700 4.379 3.682 4.747 . 0 0 "[ . 1 . 2 .]" 1
1259 1 18 ALA HA 1 136 PHE QE 1.800 . 6.300 3.171 2.656 3.596 . 0 0 "[ . 1 . 2 .]" 1
1260 1 18 ALA MB 1 136 PHE QE 1.800 . 5.558 3.075 2.203 3.513 . 0 0 "[ . 1 . 2 .]" 1
1261 1 18 ALA MB 1 136 PHE HZ 1.800 . 4.396 2.817 2.170 3.395 . 0 0 "[ . 1 . 2 .]" 1
1262 1 105 ASP HB3 1 136 PHE HA 1.800 . 5.000 3.069 2.900 3.228 . 0 0 "[ . 1 . 2 .]" 1
1263 1 105 ASP HB2 1 136 PHE HA 1.800 . 4.000 4.090 4.055 4.134 0.134 17 0 "[ . 1 . 2 .]" 1
1264 1 107 ASN HB2 1 136 PHE HB2 1.800 . 5.000 3.296 2.771 3.664 . 0 0 "[ . 1 . 2 .]" 1
1265 1 134 TYR QD 1 136 PHE HA 1.800 . 6.300 4.618 3.943 5.636 . 0 0 "[ . 1 . 2 .]" 1
1266 1 136 PHE HA 1 136 PHE QD 1.800 . 6.300 3.697 3.681 3.715 . 0 0 "[ . 1 . 2 .]" 1
1267 1 19 LEU QB 1 137 VAL MG2 1.800 . 7.850 2.693 2.278 2.984 . 0 0 "[ . 1 . 2 .]" 1
1268 1 19 LEU MD1 1 137 VAL MG2 1.800 . 5.552 3.734 3.646 3.802 . 0 0 "[ . 1 . 2 .]" 1
1269 1 27 PHE HB3 1 137 VAL MG2 1.800 . 6.400 3.992 3.217 4.541 . 0 0 "[ . 1 . 2 .]" 1
1270 1 27 PHE QD 1 137 VAL MG2 1.800 . 7.850 2.470 1.967 3.006 . 0 0 "[ . 1 . 2 .]" 1
1271 1 27 PHE HZ 1 137 VAL MG2 1.800 . 6.400 4.360 3.801 4.860 . 0 0 "[ . 1 . 2 .]" 1
1272 1 28 TYR HA 1 137 VAL MG1 1.800 . 6.400 4.741 4.277 5.148 . 0 0 "[ . 1 . 2 .]" 1
1273 1 28 TYR HB3 1 137 VAL MG1 1.800 . 6.400 2.893 2.393 3.287 . 0 0 "[ . 1 . 2 .]" 1
1274 1 28 TYR HB2 1 137 VAL MG1 1.800 . 4.360 2.841 2.159 3.321 . 0 0 "[ . 1 . 2 .]" 1
1275 1 28 TYR HB3 1 137 VAL MG2 1.800 . 4.360 3.450 3.195 3.538 . 0 0 "[ . 1 . 2 .]" 1
1276 1 28 TYR HB2 1 137 VAL MG2 1.800 . 4.360 2.414 1.985 2.670 . 0 0 "[ . 1 . 2 .]" 1
1277 1 28 TYR QD 1 137 VAL MG2 1.800 . 7.850 2.830 2.079 3.899 . 0 0 "[ . 1 . 2 .]" 1
1278 1 30 LYS QE 1 137 VAL HA 1.800 . 6.300 4.087 2.889 5.051 . 0 0 "[ . 1 . 2 .]" 1
1279 1 30 LYS QG 1 137 VAL HB 1.800 . 6.300 4.422 4.104 4.975 . 0 0 "[ . 1 . 2 .]" 1
1280 1 30 LYS QB 1 137 VAL MG1 1.800 . 5.555 3.573 3.229 3.925 . 0 0 "[ . 1 . 2 .]" 1
1281 1 30 LYS QD 1 137 VAL MG1 1.800 . 7.850 3.705 2.721 4.472 . 0 0 "[ . 1 . 2 .]" 1
1282 1 30 LYS QE 1 137 VAL MG1 1.800 . 5.555 3.158 2.599 3.751 . 0 0 "[ . 1 . 2 .]" 1
1283 1 30 LYS QG 1 137 VAL MG1 1.800 . 4.745 2.241 1.884 2.750 . 0 0 "[ . 1 . 2 .]" 1
1284 1 30 LYS HA 1 137 VAL MG2 1.800 . 6.400 5.077 4.770 5.196 . 0 0 "[ . 1 . 2 .]" 1
1285 1 30 LYS QE 1 137 VAL MG2 1.800 . 7.850 4.237 3.706 4.666 . 0 0 "[ . 1 . 2 .]" 1
1286 1 30 LYS QG 1 137 VAL MG2 1.800 . 5.555 2.310 1.975 2.963 . 0 0 "[ . 1 . 2 .]" 1
1287 1 104 ILE MG 1 137 VAL MG2 1.800 . 8.000 3.749 3.445 4.021 . 0 0 "[ . 1 . 2 .]" 1
1288 1 107 ASN HB3 1 137 VAL HB 1.800 . 5.000 4.993 4.618 5.063 0.063 10 0 "[ . 1 . 2 .]" 1
1289 1 107 ASN HB2 1 137 VAL MG1 1.800 . 6.400 4.328 4.131 4.658 . 0 0 "[ . 1 . 2 .]" 1
1290 1 136 PHE HA 1 137 VAL MG2 1.800 . 6.400 3.717 3.540 3.882 . 0 0 "[ . 1 . 2 .]" 1
1291 1 137 VAL HA 1 137 VAL MG1 1.800 . 3.640 2.489 2.417 2.591 . 0 0 "[ . 1 . 2 .]" 1
1292 1 137 VAL HA 1 137 VAL MG2 1.800 . 3.640 2.291 2.204 2.357 . 0 0 "[ . 1 . 2 .]" 1
1293 1 107 ASN HB3 1 138 ALA MB 1.800 . 4.396 2.885 1.927 3.635 . 0 0 "[ . 1 . 2 .]" 1
1294 1 107 ASN HB2 1 138 ALA MB 1.800 . 4.396 2.835 2.015 3.632 . 0 0 "[ . 1 . 2 .]" 1
1295 1 136 PHE QD 1 138 ALA HA 1.800 . 6.300 3.847 3.197 4.430 . 0 0 "[ . 1 . 2 .]" 1
1296 1 136 PHE QD 1 138 ALA MB 1.800 . 7.700 3.545 1.801 4.571 . 0 0 "[ . 1 . 2 .]" 1
1297 1 137 VAL MG1 1 138 ALA MB 1.800 . 5.555 3.207 2.576 3.821 . 0 0 "[ . 1 . 2 .]" 1
1298 1 138 ALA HA 1 139 PRO QD 1.800 . 4.396 2.035 1.949 2.216 . 0 0 "[ . 1 . 2 .]" 1
1299 1 138 ALA MB 1 139 PRO QD 1.800 . 5.558 2.746 1.993 3.508 . 0 0 "[ . 1 . 2 .]" 1
1300 1 138 ALA HA 1 139 PRO QG 1.800 . 6.300 3.952 3.856 4.155 . 0 0 "[ . 1 . 2 .]" 1
1301 1 139 PRO QD 1 139 PRO QG 1.800 . 5.558 1.952 1.938 1.959 . 0 0 "[ . 1 . 2 .]" 1
1302 1 141 GLU HA 1 141 GLU QG 1.800 . 4.396 2.207 1.934 3.304 . 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 679
_Distance_constraint_stats_list.Viol_count 936
_Distance_constraint_stats_list.Viol_total 2137.131
_Distance_constraint_stats_list.Viol_max 1.614
_Distance_constraint_stats_list.Viol_rms 0.0440
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0050
_Distance_constraint_stats_list.Viol_average_violations_only 0.0913
_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 5 GLY 20.709 1.614 1 16 "[+*-** ***1** * *2****.]"
1 6 SER 20.709 1.614 1 16 "[+*-** ***1** * *2****.]"
1 7 VAL 3.084 0.135 7 0 "[ . 1 . 2 .]"
1 8 THR 3.084 0.135 7 0 "[ . 1 . 2 .]"
1 9 VAL 3.115 0.205 4 0 "[ . 1 . 2 .]"
1 10 PRO 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 11 HIS 0.255 0.081 22 0 "[ . 1 . 2 .]"
1 12 PRO 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 13 ASN 0.047 0.047 21 0 "[ . 1 . 2 .]"
1 14 ILE 2.707 0.123 13 0 "[ . 1 . 2 .]"
1 15 GLU 0.250 0.058 6 0 "[ . 1 . 2 .]"
1 16 GLU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 17 VAL 0.065 0.033 7 0 "[ . 1 . 2 .]"
1 18 ALA 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 19 LEU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 20 SER 0.044 0.015 19 0 "[ . 1 . 2 .]"
1 21 THR 0.098 0.026 3 0 "[ . 1 . 2 .]"
1 22 THR 0.098 0.026 3 0 "[ . 1 . 2 .]"
1 23 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 24 GLU 1.201 0.094 6 0 "[ . 1 . 2 .]"
1 25 ILE 0.734 0.061 10 0 "[ . 1 . 2 .]"
1 26 PRO 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 27 PHE 0.041 0.026 16 0 "[ . 1 . 2 .]"
1 28 TYR 0.893 0.093 14 0 "[ . 1 . 2 .]"
1 29 GLY 0.041 0.026 16 0 "[ . 1 . 2 .]"
1 30 LYS 0.893 0.093 14 0 "[ . 1 . 2 .]"
1 31 ALA 0.002 0.001 13 0 "[ . 1 . 2 .]"
1 32 ILE 0.734 0.061 10 0 "[ . 1 . 2 .]"
1 33 PRO 1.179 0.094 6 0 "[ . 1 . 2 .]"
1 34 LEU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 35 GLU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 36 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 37 ILE 1.584 0.092 6 0 "[ . 1 . 2 .]"
1 38 LYS 4.731 0.206 1 0 "[ . 1 . 2 .]"
1 39 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 40 GLY 4.731 0.206 1 0 "[ . 1 . 2 .]"
1 41 ARG 0.459 0.039 7 0 "[ . 1 . 2 .]"
1 42 HIS 1.967 0.092 6 0 "[ . 1 . 2 .]"
1 43 LEU 0.614 0.044 15 0 "[ . 1 . 2 .]"
1 44 ILE 3.707 0.181 2 0 "[ . 1 . 2 .]"
1 45 PHE 3.707 0.181 2 0 "[ . 1 . 2 .]"
1 46 CYS 0.155 0.025 19 0 "[ . 1 . 2 .]"
1 47 HIS 0.089 0.025 19 0 "[ . 1 . 2 .]"
1 48 SER 0.066 0.022 19 0 "[ . 1 . 2 .]"
1 49 LYS 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 50 LYS 0.605 0.051 21 0 "[ . 1 . 2 .]"
1 51 LYS 2.095 0.107 19 0 "[ . 1 . 2 .]"
1 52 CYS 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 53 ASP 2.701 0.107 19 0 "[ . 1 . 2 .]"
1 54 GLU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 55 LEU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 56 ALA 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 57 ALA 0.269 0.040 1 0 "[ . 1 . 2 .]"
1 58 LYS 0.209 0.036 15 0 "[ . 1 . 2 .]"
1 59 LEU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 60 VAL 0.269 0.040 1 0 "[ . 1 . 2 .]"
1 61 ALA 0.209 0.036 15 0 "[ . 1 . 2 .]"
1 62 LEU 4.723 0.201 18 0 "[ . 1 . 2 .]"
1 63 GLY 4.723 0.201 18 0 "[ . 1 . 2 .]"
1 64 ILE 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 65 ASN 5.473 0.263 24 0 "[ . 1 . 2 .]"
1 66 ALA 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 67 VAL 3.390 0.201 4 0 "[ . 1 . 2 .]"
1 68 ALA 0.009 0.009 10 0 "[ . 1 . 2 .]"
1 69 TYR 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 70 TYR 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 71 ARG 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 72 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 73 LEU 1.519 0.099 19 0 "[ . 1 . 2 .]"
1 74 ASP 4.022 0.120 12 0 "[ . 1 . 2 .]"
1 75 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 76 SER 2.510 0.120 12 0 "[ . 1 . 2 .]"
1 77 VAL 0.047 0.047 25 0 "[ . 1 . 2 .]"
1 78 ILE 0.005 0.003 20 0 "[ . 1 . 2 .]"
1 79 PRO 0.240 0.053 20 0 "[ . 1 . 2 .]"
1 80 THR 0.081 0.068 20 0 "[ . 1 . 2 .]"
1 81 ASN 0.641 0.068 20 0 "[ . 1 . 2 .]"
1 82 GLY 0.272 0.035 13 0 "[ . 1 . 2 .]"
1 83 ASP 0.013 0.013 20 0 "[ . 1 . 2 .]"
1 84 VAL 10.016 0.263 24 0 "[ . 1 . 2 .]"
1 85 VAL 7.907 0.229 22 0 "[ . 1 . 2 .]"
1 86 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 87 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 88 ALA 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 89 THR 0.085 0.059 7 0 "[ . 1 . 2 .]"
1 90 ASP 0.508 0.059 7 0 "[ . 1 . 2 .]"
1 91 ALA 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 92 LEU 0.424 0.052 14 0 "[ . 1 . 2 .]"
1 93 MET 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 94 THR 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 95 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 96 PHE 0.755 0.129 15 0 "[ . 1 . 2 .]"
1 97 THR 0.012 0.012 20 0 "[ . 1 . 2 .]"
1 98 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 99 ASP 0.059 0.038 12 0 "[ . 1 . 2 .]"
1 100 PHE 5.555 0.161 4 0 "[ . 1 . 2 .]"
1 101 ASP 0.685 0.039 7 0 "[ . 1 . 2 .]"
1 102 SER 3.211 0.161 4 0 "[ . 1 . 2 .]"
1 103 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 104 ILE 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 105 ASP 2.414 0.141 16 0 "[ . 1 . 2 .]"
1 106 CYS 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 107 ASN 2.414 0.141 16 0 "[ . 1 . 2 .]"
1 108 THR 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 109 SER 0.190 0.024 24 0 "[ . 1 . 2 .]"
1 110 ASP 0.682 0.070 6 0 "[ . 1 . 2 .]"
1 111 GLY 0.714 0.070 6 0 "[ . 1 . 2 .]"
1 112 LYS 0.219 0.024 24 0 "[ . 1 . 2 .]"
1 113 PRO 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 114 GLN 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 115 ASP 0.029 0.029 20 0 "[ . 1 . 2 .]"
1 116 ALA 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 117 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 118 SER 1.874 0.242 20 0 "[ . 1 . 2 .]"
1 119 ARG 0.046 0.029 20 0 "[ . 1 . 2 .]"
1 120 THR 0.102 0.041 22 0 "[ . 1 . 2 .]"
1 121 GLN 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 122 ARG 1.773 0.242 20 0 "[ . 1 . 2 .]"
1 123 ARG 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 124 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 125 ARG 0.676 0.099 20 0 "[ . 1 . 2 .]"
1 126 THR 0.514 0.077 12 0 "[ . 1 . 2 .]"
1 127 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 128 ARG 4.877 0.157 9 0 "[ . 1 . 2 .]"
1 129 GLY 0.088 0.046 8 0 "[ . 1 . 2 .]"
1 130 LYS 0.091 0.046 8 0 "[ . 1 . 2 .]"
1 131 PRO 0.250 0.058 6 0 "[ . 1 . 2 .]"
1 132 GLY 4.775 0.157 9 0 "[ . 1 . 2 .]"
1 133 ILE 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 134 TYR 0.065 0.033 7 0 "[ . 1 . 2 .]"
1 135 ARG 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 136 PHE 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 137 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 138 ALA 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 139 PRO 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 140 GLY 0.000 0.000 . 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 5 GLY H 1 6 SER H 1.800 . 3.000 3.717 2.114 4.614 1.614 1 16 "[+*-** ***1** * *2****.]" 2
2 1 7 VAL H 1 7 VAL HB 1.800 . 4.000 3.277 2.434 3.679 . 0 0 "[ . 1 . 2 .]" 2
3 1 7 VAL H 1 7 VAL MG2 1.800 . 5.200 2.558 1.860 3.806 . 0 0 "[ . 1 . 2 .]" 2
4 1 7 VAL MG1 1 8 THR H 1.800 . 6.400 4.035 3.146 4.240 . 0 0 "[ . 1 . 2 .]" 2
5 1 7 VAL H 1 8 THR H 1.800 . 4.000 4.123 4.115 4.135 0.135 7 0 "[ . 1 . 2 .]" 2
6 1 8 THR H 1 8 THR MG 1.800 . 6.400 2.328 1.928 2.625 . 0 0 "[ . 1 . 2 .]" 2
7 1 8 THR HA 1 9 VAL H 1.800 . 3.000 2.259 2.229 2.285 . 0 0 "[ . 1 . 2 .]" 2
8 1 8 THR HB 1 9 VAL H 1.800 . 4.000 3.138 3.050 3.282 . 0 0 "[ . 1 . 2 .]" 2
9 1 8 THR MG 1 9 VAL H 1.800 . 6.400 3.884 3.731 4.038 . 0 0 "[ . 1 . 2 .]" 2
10 1 9 VAL H 1 9 VAL HB 1.800 . 3.000 3.125 3.076 3.205 0.205 4 0 "[ . 1 . 2 .]" 2
11 1 9 VAL H 1 9 VAL MG2 1.800 . 4.000 3.522 3.455 3.563 . 0 0 "[ . 1 . 2 .]" 2
12 1 10 PRO QB 1 11 HIS H 1.800 . 6.300 2.189 1.915 3.352 . 0 0 "[ . 1 . 2 .]" 2
13 1 11 HIS H 1 11 HIS HB3 1.800 . 4.000 3.518 2.799 3.823 . 0 0 "[ . 1 . 2 .]" 2
14 1 11 HIS H 1 12 PRO QB 1.800 . 6.300 4.726 4.368 5.462 . 0 0 "[ . 1 . 2 .]" 2
15 1 13 ASN HA 1 13 ASN QD 1.800 . 4.000 2.677 1.943 3.647 . 0 0 "[ . 1 . 2 .]" 2
16 1 11 HIS HB2 1 14 ILE H 1.800 . 5.000 4.268 2.851 5.081 0.081 22 0 "[ . 1 . 2 .]" 2
17 1 13 ASN HA 1 14 ILE H 1.800 . 4.000 3.464 3.254 3.584 . 0 0 "[ . 1 . 2 .]" 2
18 1 13 ASN HB3 1 14 ILE H 1.800 . 5.000 3.634 2.688 4.560 . 0 0 "[ . 1 . 2 .]" 2
19 1 13 ASN HB2 1 14 ILE H 1.800 . 5.000 3.489 2.736 4.088 . 0 0 "[ . 1 . 2 .]" 2
20 1 13 ASN H 1 14 ILE H 1.800 . 4.000 2.297 1.753 3.245 0.047 21 0 "[ . 1 . 2 .]" 2
21 1 14 ILE H 1 14 ILE HB 1.800 . 3.000 2.347 2.219 2.486 . 0 0 "[ . 1 . 2 .]" 2
22 1 14 ILE H 1 14 ILE QG 1.800 . 5.200 2.813 2.479 3.420 . 0 0 "[ . 1 . 2 .]" 2
23 1 14 ILE H 1 14 ILE MG 1.800 . 4.500 3.702 3.458 3.760 . 0 0 "[ . 1 . 2 .]" 2
24 1 14 ILE HA 1 15 GLU H 1.800 . 3.000 2.235 2.206 2.267 . 0 0 "[ . 1 . 2 .]" 2
25 1 14 ILE HB 1 15 GLU H 1.800 . 5.000 4.288 4.206 4.533 . 0 0 "[ . 1 . 2 .]" 2
26 1 14 ILE QG 1 15 GLU H 1.800 . 6.400 3.997 3.662 4.154 . 0 0 "[ . 1 . 2 .]" 2
27 1 14 ILE MG 1 15 GLU H 1.800 . 4.000 2.621 2.293 3.031 . 0 0 "[ . 1 . 2 .]" 2
28 1 14 ILE H 1 15 GLU H 1.800 . 5.000 4.473 4.371 4.534 . 0 0 "[ . 1 . 2 .]" 2
29 1 15 GLU H 1 15 GLU QG 1.800 . 6.300 3.955 3.869 4.028 . 0 0 "[ . 1 . 2 .]" 2
30 1 14 ILE H 1 16 GLU QG 1.800 . 6.400 5.457 5.249 5.619 . 0 0 "[ . 1 . 2 .]" 2
31 1 14 ILE MG 1 16 GLU H 1.800 . 6.400 4.253 3.881 4.412 . 0 0 "[ . 1 . 2 .]" 2
32 1 15 GLU HA 1 16 GLU H 1.800 . 3.000 2.229 2.216 2.243 . 0 0 "[ . 1 . 2 .]" 2
33 1 15 GLU H 1 16 GLU H 1.800 . 5.000 4.550 4.518 4.563 . 0 0 "[ . 1 . 2 .]" 2
34 1 16 GLU H 1 16 GLU QG 1.800 . 4.060 2.737 2.451 3.142 . 0 0 "[ . 1 . 2 .]" 2
35 1 15 GLU H 1 17 VAL MG2 1.800 . 6.400 4.973 4.846 5.117 . 0 0 "[ . 1 . 2 .]" 2
36 1 16 GLU H 1 17 VAL MG2 1.800 . 6.400 4.140 3.969 4.255 . 0 0 "[ . 1 . 2 .]" 2
37 1 16 GLU HA 1 17 VAL H 1.800 . 3.000 2.220 2.184 2.259 . 0 0 "[ . 1 . 2 .]" 2
38 1 16 GLU QB 1 17 VAL H 1.800 . 5.180 3.259 3.063 3.456 . 0 0 "[ . 1 . 2 .]" 2
39 1 16 GLU QG 1 17 VAL H 1.800 . 6.300 3.930 3.673 4.264 . 0 0 "[ . 1 . 2 .]" 2
40 1 16 GLU H 1 17 VAL H 1.800 . 5.000 4.561 4.478 4.620 . 0 0 "[ . 1 . 2 .]" 2
41 1 17 VAL H 1 17 VAL HB 1.800 . 3.000 2.674 2.562 2.775 . 0 0 "[ . 1 . 2 .]" 2
42 1 17 VAL H 1 17 VAL MG2 1.800 . 4.000 2.497 2.263 2.754 . 0 0 "[ . 1 . 2 .]" 2
43 1 17 VAL HA 1 18 ALA H 1.800 . 5.000 2.359 2.303 2.385 . 0 0 "[ . 1 . 2 .]" 2
44 1 17 VAL HB 1 18 ALA H 1.800 . 5.000 3.708 3.637 3.837 . 0 0 "[ . 1 . 2 .]" 2
45 1 17 VAL MG1 1 18 ALA H 1.800 . 6.400 2.086 1.901 2.314 . 0 0 "[ . 1 . 2 .]" 2
46 1 18 ALA H 1 18 ALA MB 1.800 . 6.300 2.204 2.091 2.341 . 0 0 "[ . 1 . 2 .]" 2
47 1 18 ALA HA 1 19 LEU H 1.800 . 3.000 2.224 2.213 2.235 . 0 0 "[ . 1 . 2 .]" 2
48 1 18 ALA MB 1 19 LEU H 1.800 . 4.060 3.460 3.416 3.512 . 0 0 "[ . 1 . 2 .]" 2
49 1 19 LEU H 1 19 LEU MD1 1.800 . 6.400 3.599 3.384 3.860 . 0 0 "[ . 1 . 2 .]" 2
50 1 19 LEU H 1 19 LEU MD2 1.800 . 5.200 4.220 4.174 4.252 . 0 0 "[ . 1 . 2 .]" 2
51 1 19 LEU H 1 19 LEU HG 1.800 . 5.000 4.439 4.419 4.469 . 0 0 "[ . 1 . 2 .]" 2
52 1 19 LEU HA 1 20 SER H 1.800 . 3.000 2.248 2.219 2.315 . 0 0 "[ . 1 . 2 .]" 2
53 1 19 LEU QB 1 20 SER H 1.800 . 5.180 3.671 3.510 3.774 . 0 0 "[ . 1 . 2 .]" 2
54 1 19 LEU MD1 1 20 SER H 1.800 . 4.000 3.189 3.053 3.284 . 0 0 "[ . 1 . 2 .]" 2
55 1 19 LEU MD2 1 20 SER H 1.800 . 5.200 4.234 4.053 4.391 . 0 0 "[ . 1 . 2 .]" 2
56 1 19 LEU H 1 20 SER H 1.800 . 5.000 4.650 4.619 4.695 . 0 0 "[ . 1 . 2 .]" 2
57 1 20 SER H 1 20 SER HA 1.800 . 3.000 2.993 2.974 2.999 . 0 0 "[ . 1 . 2 .]" 2
58 1 20 SER H 1 20 SER HB3 1.800 . 3.000 2.934 2.858 3.015 0.015 19 0 "[ . 1 . 2 .]" 2
59 1 20 SER HA 1 21 THR H 1.800 . 3.000 2.582 2.457 2.743 . 0 0 "[ . 1 . 2 .]" 2
60 1 20 SER HB3 1 21 THR H 1.800 . 4.000 3.875 3.682 3.987 . 0 0 "[ . 1 . 2 .]" 2
61 1 21 THR H 1 21 THR HA 1.800 . 3.000 2.908 2.867 2.955 . 0 0 "[ . 1 . 2 .]" 2
62 1 21 THR H 1 21 THR MG 1.800 . 4.000 2.497 1.940 2.838 . 0 0 "[ . 1 . 2 .]" 2
63 1 21 THR HB 1 22 THR H 1.800 . 5.000 4.304 4.209 4.442 . 0 0 "[ . 1 . 2 .]" 2
64 1 21 THR MG 1 22 THR H 1.800 . 5.200 4.269 4.195 4.321 . 0 0 "[ . 1 . 2 .]" 2
65 1 21 THR H 1 22 THR H 1.800 . 4.000 3.873 3.586 4.026 0.026 3 0 "[ . 1 . 2 .]" 2
66 1 22 THR H 1 22 THR HB 1.800 . 3.000 2.838 2.671 2.984 . 0 0 "[ . 1 . 2 .]" 2
67 1 22 THR H 1 22 THR MG 1.800 . 5.200 3.940 3.878 3.994 . 0 0 "[ . 1 . 2 .]" 2
68 1 22 THR HA 1 23 GLY H 1.800 . 3.000 2.264 2.248 2.276 . 0 0 "[ . 1 . 2 .]" 2
69 1 22 THR HB 1 23 GLY H 1.800 . 5.000 4.325 4.243 4.376 . 0 0 "[ . 1 . 2 .]" 2
70 1 22 THR MG 1 23 GLY H 1.800 . 4.000 3.153 3.013 3.249 . 0 0 "[ . 1 . 2 .]" 2
71 1 23 GLY QA 1 24 GLU H 1.800 . 4.060 2.264 2.243 2.281 . 0 0 "[ . 1 . 2 .]" 2
72 1 24 GLU H 1 24 GLU HA 1.800 . 3.000 2.999 2.993 3.006 0.006 6 0 "[ . 1 . 2 .]" 2
73 1 24 GLU H 1 24 GLU QG 1.800 . 6.300 2.846 2.368 4.084 . 0 0 "[ . 1 . 2 .]" 2
74 1 24 GLU QB 1 25 ILE H 1.800 . 5.180 2.907 2.819 2.972 . 0 0 "[ . 1 . 2 .]" 2
75 1 24 GLU H 1 25 ILE H 1.800 . 3.000 1.988 1.928 2.076 . 0 0 "[ . 1 . 2 .]" 2
76 1 25 ILE H 1 25 ILE HA 1.800 . 3.000 2.971 2.961 2.983 . 0 0 "[ . 1 . 2 .]" 2
77 1 25 ILE H 1 25 ILE HB 1.800 . 3.000 2.872 2.822 2.919 . 0 0 "[ . 1 . 2 .]" 2
78 1 25 ILE H 1 25 ILE MD 1.800 . 5.200 4.266 4.242 4.287 . 0 0 "[ . 1 . 2 .]" 2
79 1 25 ILE H 1 25 ILE QG 1.800 . 5.000 3.920 3.907 3.930 . 0 0 "[ . 1 . 2 .]" 2
80 1 25 ILE H 1 25 ILE MG 1.800 . 4.000 1.944 1.920 1.956 . 0 0 "[ . 1 . 2 .]" 2
81 1 25 ILE H 1 26 PRO QD 1.800 . 4.560 4.068 3.964 4.155 . 0 0 "[ . 1 . 2 .]" 2
82 1 26 PRO HA 1 27 PHE H 1.800 . 3.000 2.266 2.169 2.379 . 0 0 "[ . 1 . 2 .]" 2
83 1 26 PRO QB 1 27 PHE H 1.800 . 5.180 3.157 2.845 3.525 . 0 0 "[ . 1 . 2 .]" 2
84 1 27 PHE H 1 27 PHE HB3 1.800 . 4.000 2.837 2.706 2.978 . 0 0 "[ . 1 . 2 .]" 2
85 1 27 PHE HA 1 28 TYR H 1.800 . 3.000 2.513 2.243 2.772 . 0 0 "[ . 1 . 2 .]" 2
86 1 27 PHE HB3 1 28 TYR H 1.800 . 5.000 3.629 2.583 4.520 . 0 0 "[ . 1 . 2 .]" 2
87 1 27 PHE H 1 28 TYR H 1.800 . 5.000 3.957 3.452 4.433 . 0 0 "[ . 1 . 2 .]" 2
88 1 28 TYR H 1 28 TYR HA 1.800 . 3.000 2.580 2.349 2.848 . 0 0 "[ . 1 . 2 .]" 2
89 1 26 PRO QB 1 29 GLY H 1.800 . 6.300 5.070 4.754 5.478 . 0 0 "[ . 1 . 2 .]" 2
90 1 27 PHE HA 1 29 GLY H 1.800 . 5.000 4.934 4.657 5.026 0.026 16 0 "[ . 1 . 2 .]" 2
91 1 28 TYR HB2 1 29 GLY H 1.800 . 5.000 4.477 4.414 4.548 . 0 0 "[ . 1 . 2 .]" 2
92 1 28 TYR H 1 29 GLY H 1.800 . 5.000 3.568 3.041 4.118 . 0 0 "[ . 1 . 2 .]" 2
93 1 28 TYR H 1 30 LYS QB 1.800 . 5.680 4.507 3.806 4.890 . 0 0 "[ . 1 . 2 .]" 2
94 1 28 TYR HA 1 30 LYS H 1.800 . 4.000 4.014 3.923 4.093 0.093 14 0 "[ . 1 . 2 .]" 2
95 1 29 GLY QA 1 30 LYS H 1.800 . 5.180 2.935 2.904 2.958 . 0 0 "[ . 1 . 2 .]" 2
96 1 29 GLY H 1 30 LYS H 1.800 . 3.000 2.732 2.641 2.784 . 0 0 "[ . 1 . 2 .]" 2
97 1 30 LYS H 1 30 LYS HA 1.800 . 3.000 2.993 2.986 2.997 . 0 0 "[ . 1 . 2 .]" 2
98 1 30 LYS H 1 30 LYS QD 1.800 . 5.180 4.270 3.788 4.707 . 0 0 "[ . 1 . 2 .]" 2
99 1 20 SER H 1 31 ALA H 1.800 . 5.000 4.323 3.880 4.627 . 0 0 "[ . 1 . 2 .]" 2
100 1 22 THR H 1 31 ALA MB 1.800 . 5.180 2.032 1.868 2.209 . 0 0 "[ . 1 . 2 .]" 2
101 1 23 GLY H 1 31 ALA MB 1.800 . 4.060 2.961 2.758 3.170 . 0 0 "[ . 1 . 2 .]" 2
102 1 24 GLU H 1 31 ALA MB 1.800 . 6.300 4.436 4.162 4.711 . 0 0 "[ . 1 . 2 .]" 2
103 1 30 LYS QB 1 31 ALA H 1.800 . 4.060 2.779 2.740 2.801 . 0 0 "[ . 1 . 2 .]" 2
104 1 30 LYS QD 1 31 ALA H 1.800 . 5.180 3.343 2.997 3.913 . 0 0 "[ . 1 . 2 .]" 2
105 1 30 LYS QG 1 31 ALA H 1.800 . 5.180 4.399 4.042 4.557 . 0 0 "[ . 1 . 2 .]" 2
106 1 30 LYS H 1 31 ALA H 1.800 . 5.000 4.484 4.473 4.494 . 0 0 "[ . 1 . 2 .]" 2
107 1 31 ALA H 1 31 ALA HA 1.800 . 3.000 2.996 2.989 3.001 0.001 13 0 "[ . 1 . 2 .]" 2
108 1 31 ALA H 1 31 ALA MB 1.800 . 4.060 2.250 2.100 2.391 . 0 0 "[ . 1 . 2 .]" 2
109 1 25 ILE H 1 32 ILE HB 1.800 . 4.000 4.029 4.007 4.061 0.061 10 0 "[ . 1 . 2 .]" 2
110 1 25 ILE H 1 32 ILE H 1.800 . 5.000 4.149 4.018 4.271 . 0 0 "[ . 1 . 2 .]" 2
111 1 30 LYS QB 1 32 ILE H 1.800 . 5.000 4.451 4.401 4.496 . 0 0 "[ . 1 . 2 .]" 2
112 1 31 ALA HA 1 32 ILE H 1.800 . 3.000 2.231 2.216 2.249 . 0 0 "[ . 1 . 2 .]" 2
113 1 31 ALA H 1 32 ILE H 1.800 . 5.000 4.179 4.111 4.226 . 0 0 "[ . 1 . 2 .]" 2
114 1 32 ILE H 1 32 ILE HB 1.800 . 3.000 2.080 2.042 2.107 . 0 0 "[ . 1 . 2 .]" 2
115 1 32 ILE H 1 32 ILE MD 1.800 . 6.400 3.735 3.685 3.796 . 0 0 "[ . 1 . 2 .]" 2
116 1 32 ILE H 1 32 ILE QG 1.800 . 5.200 2.627 2.557 2.702 . 0 0 "[ . 1 . 2 .]" 2
117 1 32 ILE H 1 32 ILE MG 1.800 . 6.400 3.592 3.567 3.610 . 0 0 "[ . 1 . 2 .]" 2
118 1 33 PRO HA 1 34 LEU H 1.800 . 3.000 2.261 2.239 2.277 . 0 0 "[ . 1 . 2 .]" 2
119 1 24 GLU H 1 33 PRO HA 1.800 . 3.000 3.047 3.017 3.094 0.094 6 0 "[ . 1 . 2 .]" 2
120 1 31 ALA H 1 33 PRO QD 1.800 . 5.180 4.611 4.574 4.658 . 0 0 "[ . 1 . 2 .]" 2
121 1 24 GLU H 1 34 LEU QB 1.800 . 6.300 4.749 4.551 5.023 . 0 0 "[ . 1 . 2 .]" 2
122 1 24 GLU H 1 34 LEU MD2 1.800 . 6.400 3.648 3.353 3.893 . 0 0 "[ . 1 . 2 .]" 2
123 1 24 GLU H 1 34 LEU H 1.800 . 5.000 3.226 3.090 3.434 . 0 0 "[ . 1 . 2 .]" 2
124 1 33 PRO QB 1 34 LEU H 1.800 . 5.180 3.404 3.350 3.443 . 0 0 "[ . 1 . 2 .]" 2
125 1 34 LEU H 1 34 LEU HA 1.800 . 3.000 2.817 2.810 2.822 . 0 0 "[ . 1 . 2 .]" 2
126 1 34 LEU H 1 34 LEU QB 1.800 . 4.060 2.335 2.291 2.385 . 0 0 "[ . 1 . 2 .]" 2
127 1 34 LEU H 1 34 LEU MD1 1.800 . 5.200 3.804 3.707 3.870 . 0 0 "[ . 1 . 2 .]" 2
128 1 34 LEU H 1 34 LEU HG 1.800 . 3.000 2.325 2.165 2.421 . 0 0 "[ . 1 . 2 .]" 2
129 1 33 PRO QB 1 35 GLU H 1.800 . 5.180 2.583 2.514 2.688 . 0 0 "[ . 1 . 2 .]" 2
130 1 34 LEU HA 1 35 GLU H 1.800 . 4.000 3.476 3.463 3.493 . 0 0 "[ . 1 . 2 .]" 2
131 1 34 LEU QB 1 35 GLU H 1.800 . 4.060 3.015 2.959 3.080 . 0 0 "[ . 1 . 2 .]" 2
132 1 34 LEU H 1 35 GLU H 1.800 . 3.000 2.825 2.799 2.851 . 0 0 "[ . 1 . 2 .]" 2
133 1 35 GLU H 1 35 GLU HA 1.800 . 3.000 2.848 2.839 2.862 . 0 0 "[ . 1 . 2 .]" 2
134 1 35 GLU H 1 35 GLU QG 1.800 . 4.060 2.131 2.008 2.249 . 0 0 "[ . 1 . 2 .]" 2
135 1 33 PRO QD 1 36 VAL H 1.800 . 6.300 4.538 4.430 4.622 . 0 0 "[ . 1 . 2 .]" 2
136 1 34 LEU HA 1 36 VAL H 1.800 . 5.000 3.451 3.420 3.538 . 0 0 "[ . 1 . 2 .]" 2
137 1 35 GLU HA 1 36 VAL H 1.800 . 5.000 3.466 3.460 3.474 . 0 0 "[ . 1 . 2 .]" 2
138 1 35 GLU QB 1 36 VAL H 1.800 . 5.180 3.686 3.675 3.695 . 0 0 "[ . 1 . 2 .]" 2
139 1 35 GLU H 1 36 VAL H 1.800 . 3.000 2.734 2.700 2.759 . 0 0 "[ . 1 . 2 .]" 2
140 1 36 VAL H 1 36 VAL HA 1.800 . 3.000 2.963 2.958 2.971 . 0 0 "[ . 1 . 2 .]" 2
141 1 36 VAL H 1 36 VAL HB 1.800 . 4.000 3.607 3.591 3.627 . 0 0 "[ . 1 . 2 .]" 2
142 1 36 VAL H 1 36 VAL MG2 1.800 . 4.000 2.003 1.914 2.082 . 0 0 "[ . 1 . 2 .]" 2
143 1 36 VAL MG1 1 37 ILE H 1.800 . 5.000 3.827 3.801 3.848 . 0 0 "[ . 1 . 2 .]" 2
144 1 37 ILE H 1 37 ILE QG 1.800 . 4.000 2.047 1.902 2.208 . 0 0 "[ . 1 . 2 .]" 2
145 1 37 ILE HA 1 38 LYS H 1.800 . 4.000 3.475 3.429 3.509 . 0 0 "[ . 1 . 2 .]" 2
146 1 37 ILE MD 1 38 LYS H 1.800 . 6.400 4.016 3.825 4.248 . 0 0 "[ . 1 . 2 .]" 2
147 1 37 ILE QG 1 38 LYS H 1.800 . 6.400 2.269 2.071 2.527 . 0 0 "[ . 1 . 2 .]" 2
148 1 37 ILE H 1 38 LYS H 1.800 . 3.000 1.967 1.926 2.023 . 0 0 "[ . 1 . 2 .]" 2
149 1 38 LYS H 1 38 LYS HA 1.800 . 3.000 2.969 2.953 2.986 . 0 0 "[ . 1 . 2 .]" 2
150 1 38 LYS H 1 38 LYS QD 1.800 . 5.000 4.301 4.214 4.442 . 0 0 "[ . 1 . 2 .]" 2
151 1 38 LYS H 1 38 LYS QG 1.800 . 5.180 3.932 3.892 3.978 . 0 0 "[ . 1 . 2 .]" 2
152 1 38 LYS QB 1 39 GLY H 1.800 . 6.300 3.576 3.521 3.598 . 0 0 "[ . 1 . 2 .]" 2
153 1 38 LYS QD 1 39 GLY H 1.800 . 6.300 2.660 2.123 4.070 . 0 0 "[ . 1 . 2 .]" 2
154 1 38 LYS QG 1 39 GLY H 1.800 . 4.060 2.469 1.953 2.610 . 0 0 "[ . 1 . 2 .]" 2
155 1 38 LYS H 1 39 GLY H 1.800 . 5.000 4.598 4.571 4.615 . 0 0 "[ . 1 . 2 .]" 2
156 1 38 LYS HA 1 40 GLY H 1.800 . 3.000 3.189 3.175 3.206 0.206 1 0 "[ . 1 . 2 .]" 2
157 1 38 LYS QE 1 40 GLY H 1.800 . 5.180 4.135 3.886 4.698 . 0 0 "[ . 1 . 2 .]" 2
158 1 39 GLY QA 1 40 GLY H 1.800 . 4.060 2.958 2.950 2.966 . 0 0 "[ . 1 . 2 .]" 2
159 1 40 GLY QA 1 41 ARG H 1.800 . 4.060 2.223 2.159 2.266 . 0 0 "[ . 1 . 2 .]" 2
160 1 40 GLY H 1 41 ARG H 1.800 . 5.000 4.270 4.126 4.363 . 0 0 "[ . 1 . 2 .]" 2
161 1 41 ARG H 1 41 ARG QG 1.800 . 6.300 2.835 2.301 3.358 . 0 0 "[ . 1 . 2 .]" 2
162 1 37 ILE HB 1 42 HIS H 1.800 . 5.000 5.063 5.031 5.092 0.092 6 0 "[ . 1 . 2 .]" 2
163 1 41 ARG QG 1 42 HIS H 1.800 . 5.180 4.125 3.916 4.329 . 0 0 "[ . 1 . 2 .]" 2
164 1 42 HIS H 1 42 HIS HB2 1.800 . 4.000 2.623 2.557 2.677 . 0 0 "[ . 1 . 2 .]" 2
165 1 42 HIS HB3 1 43 LEU H 1.800 . 5.000 2.968 2.875 3.081 . 0 0 "[ . 1 . 2 .]" 2
166 1 42 HIS HB2 1 43 LEU H 1.800 . 4.000 4.004 3.924 4.044 0.044 15 0 "[ . 1 . 2 .]" 2
167 1 43 LEU H 1 43 LEU QB 1.800 . 4.060 2.304 2.279 2.338 . 0 0 "[ . 1 . 2 .]" 2
168 1 43 LEU QB 1 44 ILE H 1.800 . 6.300 3.924 3.833 3.955 . 0 0 "[ . 1 . 2 .]" 2
169 1 44 ILE H 1 44 ILE QG 1.800 . 5.200 2.173 1.934 2.366 . 0 0 "[ . 1 . 2 .]" 2
170 1 43 LEU QB 1 45 PHE H 1.800 . 6.300 5.554 5.505 5.612 . 0 0 "[ . 1 . 2 .]" 2
171 1 44 ILE HB 1 45 PHE H 1.800 . 4.000 4.148 4.084 4.181 0.181 2 0 "[ . 1 . 2 .]" 2
172 1 45 PHE H 1 45 PHE HB3 1.800 . 4.000 3.458 3.401 3.533 . 0 0 "[ . 1 . 2 .]" 2
173 1 45 PHE H 1 45 PHE QD 1.800 . 5.180 3.250 2.926 3.556 . 0 0 "[ . 1 . 2 .]" 2
174 1 45 PHE HB2 1 46 CYS H 1.800 . 5.000 4.496 4.441 4.530 . 0 0 "[ . 1 . 2 .]" 2
175 1 45 PHE QD 1 46 CYS H 1.800 . 6.300 3.448 3.196 3.777 . 0 0 "[ . 1 . 2 .]" 2
176 1 28 TYR QE 1 47 HIS H 1.800 . 6.300 3.416 2.713 4.235 . 0 0 "[ . 1 . 2 .]" 2
177 1 46 CYS H 1 47 HIS HA 1.800 . 5.000 4.991 4.953 5.025 0.025 19 0 "[ . 1 . 2 .]" 2
178 1 46 CYS HA 1 47 HIS H 1.800 . 3.000 2.367 2.303 2.382 . 0 0 "[ . 1 . 2 .]" 2
179 1 46 CYS HB3 1 47 HIS H 1.800 . 3.000 2.785 2.736 2.990 . 0 0 "[ . 1 . 2 .]" 2
180 1 47 HIS H 1 47 HIS HB2 1.800 . 4.000 3.671 3.633 3.726 . 0 0 "[ . 1 . 2 .]" 2
181 1 46 CYS HA 1 48 SER H 1.800 . 5.000 3.911 3.770 3.958 . 0 0 "[ . 1 . 2 .]" 2
182 1 46 CYS HB3 1 48 SER H 1.800 . 4.000 2.347 2.256 2.431 . 0 0 "[ . 1 . 2 .]" 2
183 1 46 CYS HB2 1 48 SER H 1.800 . 4.000 3.936 3.797 4.022 0.022 19 0 "[ . 1 . 2 .]" 2
184 1 47 HIS HA 1 48 SER H 1.800 . 5.000 3.327 3.230 3.417 . 0 0 "[ . 1 . 2 .]" 2
185 1 47 HIS HD1 1 48 SER H 1.800 . 6.300 3.286 2.087 3.808 . 0 0 "[ . 1 . 2 .]" 2
186 1 47 HIS H 1 48 SER H 1.800 . 4.000 2.238 2.160 2.359 . 0 0 "[ . 1 . 2 .]" 2
187 1 48 SER H 1 48 SER HA 1.800 . 3.000 2.989 2.981 2.998 . 0 0 "[ . 1 . 2 .]" 2
188 1 48 SER H 1 48 SER HB3 1.800 . 4.000 3.343 3.162 3.476 . 0 0 "[ . 1 . 2 .]" 2
189 1 48 SER H 1 48 SER HB2 1.800 . 4.000 3.666 3.597 3.779 . 0 0 "[ . 1 . 2 .]" 2
190 1 48 SER HA 1 49 LYS H 1.800 . 4.000 2.211 2.184 2.247 . 0 0 "[ . 1 . 2 .]" 2
191 1 48 SER HB3 1 49 LYS H 1.800 . 5.000 4.022 3.905 4.103 . 0 0 "[ . 1 . 2 .]" 2
192 1 48 SER HB3 1 50 LYS H 1.800 . 5.000 4.699 4.457 4.858 . 0 0 "[ . 1 . 2 .]" 2
193 1 49 LYS HA 1 50 LYS H 1.800 . 4.000 3.560 3.530 3.576 . 0 0 "[ . 1 . 2 .]" 2
194 1 49 LYS QB 1 50 LYS H 1.800 . 4.060 2.523 2.410 2.705 . 0 0 "[ . 1 . 2 .]" 2
195 1 49 LYS QD 1 50 LYS H 1.800 . 6.300 4.751 3.546 5.212 . 0 0 "[ . 1 . 2 .]" 2
196 1 49 LYS QG 1 50 LYS H 1.800 . 5.180 3.912 3.358 4.396 . 0 0 "[ . 1 . 2 .]" 2
197 1 49 LYS H 1 50 LYS H 1.800 . 4.000 2.600 2.551 2.633 . 0 0 "[ . 1 . 2 .]" 2
198 1 50 LYS H 1 50 LYS HA 1.800 . 3.000 2.850 2.833 2.892 . 0 0 "[ . 1 . 2 .]" 2
199 1 50 LYS H 1 50 LYS QG 1.800 . 6.300 2.642 1.996 3.097 . 0 0 "[ . 1 . 2 .]" 2
200 1 47 HIS H 1 51 LYS QB 1.800 . 6.300 4.529 4.355 4.706 . 0 0 "[ . 1 . 2 .]" 2
201 1 48 SER H 1 51 LYS QB 1.800 . 4.060 3.431 3.269 3.587 . 0 0 "[ . 1 . 2 .]" 2
202 1 48 SER H 1 51 LYS H 1.800 . 5.000 4.690 4.510 4.799 . 0 0 "[ . 1 . 2 .]" 2
203 1 49 LYS HA 1 51 LYS H 1.800 . 5.000 4.283 4.175 4.597 . 0 0 "[ . 1 . 2 .]" 2
204 1 49 LYS QB 1 51 LYS H 1.800 . 6.300 4.652 4.551 4.858 . 0 0 "[ . 1 . 2 .]" 2
205 1 50 LYS HA 1 51 LYS H 1.800 . 4.000 3.543 3.516 3.568 . 0 0 "[ . 1 . 2 .]" 2
206 1 50 LYS H 1 51 LYS H 1.800 . 3.000 2.707 2.540 2.764 . 0 0 "[ . 1 . 2 .]" 2
207 1 51 LYS H 1 51 LYS HA 1.800 . 3.000 2.892 2.848 2.905 . 0 0 "[ . 1 . 2 .]" 2
208 1 48 SER H 1 52 CYS H 1.800 . 5.000 4.716 4.552 4.897 . 0 0 "[ . 1 . 2 .]" 2
209 1 50 LYS H 1 52 CYS H 1.800 . 5.000 4.169 4.082 4.331 . 0 0 "[ . 1 . 2 .]" 2
210 1 51 LYS QB 1 52 CYS H 1.800 . 4.060 2.561 2.491 2.637 . 0 0 "[ . 1 . 2 .]" 2
211 1 51 LYS H 1 52 CYS H 1.800 . 3.000 2.545 2.489 2.679 . 0 0 "[ . 1 . 2 .]" 2
212 1 52 CYS H 1 52 CYS HA 1.800 . 3.000 2.853 2.847 2.858 . 0 0 "[ . 1 . 2 .]" 2
213 1 52 CYS H 1 52 CYS HB2 1.800 . 3.000 2.302 2.054 2.477 . 0 0 "[ . 1 . 2 .]" 2
214 1 50 LYS H 1 53 ASP H 1.800 . 5.000 5.014 4.880 5.051 0.051 21 0 "[ . 1 . 2 .]" 2
215 1 51 LYS H 1 53 ASP HB2 1.800 . 5.000 4.965 4.864 5.035 0.035 8 0 "[ . 1 . 2 .]" 2
216 1 51 LYS H 1 53 ASP H 1.800 . 4.000 4.079 4.054 4.107 0.107 19 0 "[ . 1 . 2 .]" 2
217 1 52 CYS HB3 1 53 ASP H 1.800 . 4.000 3.627 3.381 3.790 . 0 0 "[ . 1 . 2 .]" 2
218 1 52 CYS H 1 53 ASP H 1.800 . 3.000 2.674 2.653 2.712 . 0 0 "[ . 1 . 2 .]" 2
219 1 53 ASP H 1 53 ASP HA 1.800 . 3.000 2.882 2.855 2.896 . 0 0 "[ . 1 . 2 .]" 2
220 1 53 ASP H 1 53 ASP HB3 1.800 . 4.000 3.394 3.276 3.490 . 0 0 "[ . 1 . 2 .]" 2
221 1 50 LYS QB 1 54 GLU H 1.800 . 6.300 5.124 4.965 5.209 . 0 0 "[ . 1 . 2 .]" 2
222 1 51 LYS HA 1 54 GLU H 1.800 . 4.000 3.473 3.337 3.661 . 0 0 "[ . 1 . 2 .]" 2
223 1 52 CYS HA 1 54 GLU H 1.800 . 5.000 4.753 4.606 4.836 . 0 0 "[ . 1 . 2 .]" 2
224 1 53 ASP HB2 1 54 GLU H 1.800 . 3.000 2.655 2.431 2.860 . 0 0 "[ . 1 . 2 .]" 2
225 1 54 GLU H 1 54 GLU HA 1.800 . 3.000 2.899 2.893 2.905 . 0 0 "[ . 1 . 2 .]" 2
226 1 54 GLU H 1 54 GLU QG 1.800 . 4.060 2.068 1.961 2.129 . 0 0 "[ . 1 . 2 .]" 2
227 1 53 ASP HA 1 55 LEU H 1.800 . 5.000 4.830 4.706 4.934 . 0 0 "[ . 1 . 2 .]" 2
228 1 54 GLU H 1 55 LEU QB 1.800 . 6.300 4.195 4.155 4.251 . 0 0 "[ . 1 . 2 .]" 2
229 1 54 GLU H 1 55 LEU H 1.800 . 4.000 2.613 2.568 2.645 . 0 0 "[ . 1 . 2 .]" 2
230 1 55 LEU H 1 55 LEU MD1 1.800 . 6.400 4.165 4.053 4.207 . 0 0 "[ . 1 . 2 .]" 2
231 1 55 LEU H 1 55 LEU HG 1.800 . 5.000 4.462 4.409 4.498 . 0 0 "[ . 1 . 2 .]" 2
232 1 54 GLU QB 1 56 ALA H 1.800 . 5.500 4.703 4.607 4.805 . 0 0 "[ . 1 . 2 .]" 2
233 1 55 LEU HA 1 56 ALA H 1.800 . 4.000 3.585 3.573 3.598 . 0 0 "[ . 1 . 2 .]" 2
234 1 53 ASP HA 1 57 ALA H 1.800 . 5.000 4.154 3.911 4.400 . 0 0 "[ . 1 . 2 .]" 2
235 1 54 GLU HA 1 57 ALA H 1.800 . 5.000 3.752 3.667 3.890 . 0 0 "[ . 1 . 2 .]" 2
236 1 56 ALA HA 1 57 ALA H 1.800 . 4.000 3.594 3.587 3.601 . 0 0 "[ . 1 . 2 .]" 2
237 1 56 ALA H 1 57 ALA H 1.800 . 3.000 2.694 2.655 2.758 . 0 0 "[ . 1 . 2 .]" 2
238 1 57 ALA H 1 58 LYS QB 1.800 . 6.300 4.295 4.181 4.362 . 0 0 "[ . 1 . 2 .]" 2
239 1 57 ALA HA 1 58 LYS H 1.800 . 4.000 3.554 3.514 3.574 . 0 0 "[ . 1 . 2 .]" 2
240 1 57 ALA H 1 58 LYS H 1.800 . 3.000 2.706 2.663 2.748 . 0 0 "[ . 1 . 2 .]" 2
241 1 57 ALA H 1 59 LEU H 1.800 . 5.000 4.315 4.207 4.427 . 0 0 "[ . 1 . 2 .]" 2
242 1 58 LYS H 1 59 LEU QB 1.800 . 6.300 4.246 4.205 4.275 . 0 0 "[ . 1 . 2 .]" 2
243 1 58 LYS H 1 59 LEU H 1.800 . 4.000 2.772 2.652 2.798 . 0 0 "[ . 1 . 2 .]" 2
244 1 59 LEU H 1 59 LEU HG 1.800 . 5.000 4.423 4.349 4.503 . 0 0 "[ . 1 . 2 .]" 2
245 1 57 ALA H 1 60 VAL H 1.800 . 5.000 4.992 4.915 5.040 0.040 1 0 "[ . 1 . 2 .]" 2
246 1 58 LYS QG 1 60 VAL H 1.800 . 6.300 5.178 4.614 5.560 . 0 0 "[ . 1 . 2 .]" 2
247 1 58 LYS H 1 60 VAL H 1.800 . 5.000 4.253 4.198 4.292 . 0 0 "[ . 1 . 2 .]" 2
248 1 59 LEU QB 1 60 VAL H 1.800 . 4.060 2.602 2.549 2.656 . 0 0 "[ . 1 . 2 .]" 2
249 1 59 LEU H 1 60 VAL H 1.800 . 3.000 2.814 2.595 2.852 . 0 0 "[ . 1 . 2 .]" 2
250 1 58 LYS HA 1 61 ALA H 1.800 . 5.000 3.475 3.341 3.739 . 0 0 "[ . 1 . 2 .]" 2
251 1 58 LYS H 1 61 ALA H 1.800 . 5.000 4.996 4.916 5.036 0.036 15 0 "[ . 1 . 2 .]" 2
252 1 59 LEU QB 1 61 ALA H 1.800 . 5.180 4.464 4.380 4.532 . 0 0 "[ . 1 . 2 .]" 2
253 1 59 LEU H 1 61 ALA H 1.800 . 5.000 4.120 3.986 4.195 . 0 0 "[ . 1 . 2 .]" 2
254 1 60 VAL HA 1 61 ALA H 1.800 . 5.000 3.542 3.523 3.557 . 0 0 "[ . 1 . 2 .]" 2
255 1 60 VAL HB 1 61 ALA H 1.800 . 3.000 2.722 2.670 2.826 . 0 0 "[ . 1 . 2 .]" 2
256 1 60 VAL MG2 1 61 ALA H 1.800 . 5.200 3.942 3.895 4.005 . 0 0 "[ . 1 . 2 .]" 2
257 1 60 VAL H 1 61 ALA H 1.800 . 3.000 2.702 2.658 2.746 . 0 0 "[ . 1 . 2 .]" 2
258 1 61 ALA H 1 61 ALA HA 1.800 . 3.000 2.916 2.913 2.919 . 0 0 "[ . 1 . 2 .]" 2
259 1 61 ALA H 1 61 ALA MB 1.800 . 4.060 2.037 1.928 2.168 . 0 0 "[ . 1 . 2 .]" 2
260 1 61 ALA H 1 62 LEU H 1.800 . 3.000 2.490 2.454 2.525 . 0 0 "[ . 1 . 2 .]" 2
261 1 60 VAL MG1 1 63 GLY H 1.800 . 6.400 4.636 4.554 4.747 . 0 0 "[ . 1 . 2 .]" 2
262 1 62 LEU HA 1 63 GLY H 1.800 . 4.000 3.480 3.474 3.485 . 0 0 "[ . 1 . 2 .]" 2
263 1 62 LEU QB 1 63 GLY H 1.800 . 5.180 2.749 2.732 2.764 . 0 0 "[ . 1 . 2 .]" 2
264 1 62 LEU MD2 1 63 GLY H 1.800 . 6.400 4.014 3.893 4.049 . 0 0 "[ . 1 . 2 .]" 2
265 1 62 LEU HG 1 63 GLY H 1.800 . 5.000 5.189 5.164 5.201 0.201 18 0 "[ . 1 . 2 .]" 2
266 1 62 LEU H 1 63 GLY H 1.800 . 3.000 2.469 2.452 2.490 . 0 0 "[ . 1 . 2 .]" 2
267 1 59 LEU QB 1 64 ILE H 1.800 . 5.180 4.007 3.819 4.122 . 0 0 "[ . 1 . 2 .]" 2
268 1 62 LEU HA 1 64 ILE H 1.800 . 5.000 4.772 4.732 4.813 . 0 0 "[ . 1 . 2 .]" 2
269 1 62 LEU QB 1 64 ILE H 1.800 . 6.300 2.889 2.835 2.944 . 0 0 "[ . 1 . 2 .]" 2
270 1 62 LEU H 1 64 ILE H 1.800 . 5.000 3.599 3.570 3.629 . 0 0 "[ . 1 . 2 .]" 2
271 1 63 GLY H 1 64 ILE H 1.800 . 4.000 1.913 1.897 1.924 . 0 0 "[ . 1 . 2 .]" 2
272 1 64 ILE H 1 64 ILE QG 1.800 . 4.000 2.346 2.302 2.397 . 0 0 "[ . 1 . 2 .]" 2
273 1 64 ILE H 1 64 ILE MG 1.800 . 5.200 3.744 3.734 3.754 . 0 0 "[ . 1 . 2 .]" 2
274 1 60 VAL H 1 65 ASN HA 1.800 . 5.000 4.876 4.797 5.000 0.000 22 0 "[ . 1 . 2 .]" 2
275 1 64 ILE HA 1 65 ASN H 1.800 . 3.000 2.317 2.307 2.326 . 0 0 "[ . 1 . 2 .]" 2
276 1 64 ILE HB 1 65 ASN H 1.800 . 5.000 4.045 4.028 4.059 . 0 0 "[ . 1 . 2 .]" 2
277 1 64 ILE MG 1 65 ASN H 1.800 . 4.000 2.296 2.250 2.389 . 0 0 "[ . 1 . 2 .]" 2
278 1 64 ILE H 1 65 ASN H 1.800 . 5.000 4.566 4.558 4.579 . 0 0 "[ . 1 . 2 .]" 2
279 1 65 ASN HA 1 65 ASN QD 1.800 . 5.200 3.884 2.339 4.174 . 0 0 "[ . 1 . 2 .]" 2
280 1 65 ASN H 1 65 ASN HA 1.800 . 3.000 2.971 2.965 2.977 . 0 0 "[ . 1 . 2 .]" 2
281 1 65 ASN H 1 65 ASN HB3 1.800 . 3.000 2.348 2.097 2.517 . 0 0 "[ . 1 . 2 .]" 2
282 1 65 ASN H 1 65 ASN HB2 1.800 . 4.000 2.720 2.547 3.017 . 0 0 "[ . 1 . 2 .]" 2
283 1 59 LEU QB 1 66 ALA H 1.800 . 5.180 3.015 2.935 3.162 . 0 0 "[ . 1 . 2 .]" 2
284 1 60 VAL HA 1 66 ALA H 1.800 . 5.000 3.668 3.558 3.781 . 0 0 "[ . 1 . 2 .]" 2
285 1 64 ILE HB 1 66 ALA H 1.800 . 5.000 4.721 4.663 4.783 . 0 0 "[ . 1 . 2 .]" 2
286 1 64 ILE MG 1 66 ALA H 1.800 . 5.200 4.024 3.928 4.100 . 0 0 "[ . 1 . 2 .]" 2
287 1 65 ASN H 1 66 ALA MB 1.800 . 6.300 4.598 4.567 4.628 . 0 0 "[ . 1 . 2 .]" 2
288 1 65 ASN HA 1 66 ALA H 1.800 . 3.000 2.239 2.222 2.255 . 0 0 "[ . 1 . 2 .]" 2
289 1 65 ASN HB2 1 66 ALA H 1.800 . 5.000 4.522 4.392 4.593 . 0 0 "[ . 1 . 2 .]" 2
290 1 65 ASN H 1 66 ALA H 1.800 . 5.000 4.282 4.264 4.303 . 0 0 "[ . 1 . 2 .]" 2
291 1 66 ALA H 1 66 ALA HA 1.800 . 3.000 2.982 2.974 2.988 . 0 0 "[ . 1 . 2 .]" 2
292 1 66 ALA H 1 66 ALA MB 1.800 . 4.060 2.310 2.288 2.355 . 0 0 "[ . 1 . 2 .]" 2
293 1 65 ASN QD 1 67 VAL MG2 1.800 . 6.560 3.222 2.437 3.684 . 0 0 "[ . 1 . 2 .]" 2
294 1 55 LEU H 1 68 ALA MB 1.800 . 6.300 4.893 4.657 5.102 . 0 0 "[ . 1 . 2 .]" 2
295 1 67 VAL HA 1 68 ALA H 1.800 . 3.000 2.301 2.253 2.339 . 0 0 "[ . 1 . 2 .]" 2
296 1 67 VAL HB 1 68 ALA H 1.800 . 4.000 3.846 3.660 4.009 0.009 10 0 "[ . 1 . 2 .]" 2
297 1 67 VAL H 1 68 ALA H 1.800 . 5.000 4.459 4.411 4.497 . 0 0 "[ . 1 . 2 .]" 2
298 1 68 ALA H 1 68 ALA MB 1.800 . 4.060 2.210 2.107 2.286 . 0 0 "[ . 1 . 2 .]" 2
299 1 68 ALA MB 1 69 TYR H 1.800 . 4.060 3.308 3.136 3.398 . 0 0 "[ . 1 . 2 .]" 2
300 1 69 TYR H 1 69 TYR HB3 1.800 . 4.000 2.848 2.717 3.042 . 0 0 "[ . 1 . 2 .]" 2
301 1 53 ASP H 1 70 TYR QE 1.800 . 6.300 3.899 3.562 4.574 . 0 0 "[ . 1 . 2 .]" 2
302 1 69 TYR HA 1 70 TYR H 1.800 . 5.000 2.196 2.174 2.247 . 0 0 "[ . 1 . 2 .]" 2
303 1 70 TYR HA 1 71 ARG H 1.800 . 3.000 2.611 2.504 2.736 . 0 0 "[ . 1 . 2 .]" 2
304 1 70 TYR HB3 1 71 ARG H 1.800 . 4.000 3.565 3.359 3.693 . 0 0 "[ . 1 . 2 .]" 2
305 1 70 TYR HB2 1 71 ARG H 1.800 . 3.000 2.218 1.945 2.445 . 0 0 "[ . 1 . 2 .]" 2
306 1 70 TYR QD 1 71 ARG H 1.800 . 5.180 3.278 3.086 3.502 . 0 0 "[ . 1 . 2 .]" 2
307 1 71 ARG H 1 71 ARG HA 1.800 . 3.000 2.810 2.796 2.861 . 0 0 "[ . 1 . 2 .]" 2
308 1 71 ARG HA 1 72 GLY H 1.800 . 3.000 2.207 2.198 2.223 . 0 0 "[ . 1 . 2 .]" 2
309 1 71 ARG QB 1 72 GLY H 1.800 . 5.180 3.816 3.694 3.907 . 0 0 "[ . 1 . 2 .]" 2
310 1 71 ARG QG 1 72 GLY H 1.800 . 6.300 2.959 2.613 3.540 . 0 0 "[ . 1 . 2 .]" 2
311 1 71 ARG H 1 72 GLY H 1.800 . 5.000 4.567 4.498 4.608 . 0 0 "[ . 1 . 2 .]" 2
312 1 69 TYR QE 1 73 LEU H 1.800 . 6.300 4.864 3.734 5.810 . 0 0 "[ . 1 . 2 .]" 2
313 1 70 TYR H 1 73 LEU H 1.800 . 5.000 4.116 3.885 4.366 . 0 0 "[ . 1 . 2 .]" 2
314 1 71 ARG HA 1 73 LEU H 1.800 . 5.000 3.996 3.799 4.420 . 0 0 "[ . 1 . 2 .]" 2
315 1 72 GLY QA 1 73 LEU H 1.800 . 5.180 2.732 2.570 2.816 . 0 0 "[ . 1 . 2 .]" 2
316 1 72 GLY H 1 73 LEU H 1.800 . 3.000 2.537 2.247 2.909 . 0 0 "[ . 1 . 2 .]" 2
317 1 73 LEU H 1 73 LEU HA 1.800 . 3.000 2.995 2.992 2.998 . 0 0 "[ . 1 . 2 .]" 2
318 1 73 LEU H 1 73 LEU QB 1.800 . 4.060 2.393 2.375 2.407 . 0 0 "[ . 1 . 2 .]" 2
319 1 73 LEU H 1 73 LEU MD1 1.800 . 6.400 4.052 4.001 4.096 . 0 0 "[ . 1 . 2 .]" 2
320 1 73 LEU H 1 73 LEU MD2 1.800 . 5.200 4.077 4.031 4.109 . 0 0 "[ . 1 . 2 .]" 2
321 1 73 LEU H 1 73 LEU HG 1.800 . 5.000 4.789 4.769 4.806 . 0 0 "[ . 1 . 2 .]" 2
322 1 73 LEU H 1 74 ASP HA 1.800 . 5.000 5.027 5.013 5.047 0.047 3 0 "[ . 1 . 2 .]" 2
323 1 73 LEU HA 1 74 ASP H 1.800 . 3.000 2.354 2.325 2.375 . 0 0 "[ . 1 . 2 .]" 2
324 1 73 LEU MD1 1 74 ASP H 1.800 . 6.400 1.996 1.871 2.123 . 0 0 "[ . 1 . 2 .]" 2
325 1 73 LEU MD2 1 74 ASP H 1.800 . 5.200 1.925 1.868 2.112 . 0 0 "[ . 1 . 2 .]" 2
326 1 73 LEU HG 1 74 ASP H 1.800 . 4.000 4.034 4.001 4.099 0.099 19 0 "[ . 1 . 2 .]" 2
327 1 74 ASP H 1 74 ASP HA 1.800 . 3.000 2.967 2.944 2.976 . 0 0 "[ . 1 . 2 .]" 2
328 1 74 ASP H 1 74 ASP HB3 1.800 . 4.000 3.613 3.583 3.630 . 0 0 "[ . 1 . 2 .]" 2
329 1 74 ASP H 1 74 ASP HB2 1.800 . 3.000 2.509 2.483 2.543 . 0 0 "[ . 1 . 2 .]" 2
330 1 69 TYR QE 1 75 VAL H 1.800 . 6.300 4.487 3.388 5.506 . 0 0 "[ . 1 . 2 .]" 2
331 1 74 ASP HA 1 75 VAL H 1.800 . 3.000 2.308 2.285 2.323 . 0 0 "[ . 1 . 2 .]" 2
332 1 74 ASP HB3 1 75 VAL H 1.800 . 5.000 2.982 2.963 3.001 . 0 0 "[ . 1 . 2 .]" 2
333 1 74 ASP HB2 1 75 VAL H 1.800 . 5.000 3.850 3.819 3.878 . 0 0 "[ . 1 . 2 .]" 2
334 1 74 ASP H 1 75 VAL H 1.800 . 5.000 4.624 4.601 4.644 . 0 0 "[ . 1 . 2 .]" 2
335 1 75 VAL H 1 75 VAL HA 1.800 . 3.000 2.858 2.851 2.864 . 0 0 "[ . 1 . 2 .]" 2
336 1 75 VAL H 1 75 VAL HB 1.800 . 4.000 3.519 3.508 3.527 . 0 0 "[ . 1 . 2 .]" 2
337 1 75 VAL H 1 75 VAL MG2 1.800 . 4.000 1.959 1.908 1.988 . 0 0 "[ . 1 . 2 .]" 2
338 1 74 ASP HB2 1 76 SER H 1.800 . 5.000 5.100 5.084 5.120 0.120 12 0 "[ . 1 . 2 .]" 2
339 1 75 VAL HA 1 76 SER H 1.800 . 5.000 2.217 2.206 2.238 . 0 0 "[ . 1 . 2 .]" 2
340 1 75 VAL MG1 1 76 SER H 1.800 . 6.000 4.184 4.158 4.223 . 0 0 "[ . 1 . 2 .]" 2
341 1 76 SER H 1 76 SER HA 1.800 . 3.000 2.999 2.996 3.002 0.002 21 0 "[ . 1 . 2 .]" 2
342 1 75 VAL HA 1 77 VAL H 1.800 . 4.000 3.786 3.501 3.917 . 0 0 "[ . 1 . 2 .]" 2
343 1 76 SER HA 1 77 VAL H 1.800 . 4.000 3.528 3.422 3.563 . 0 0 "[ . 1 . 2 .]" 2
344 1 76 SER H 1 77 VAL H 1.800 . 3.000 1.887 1.816 1.929 . 0 0 "[ . 1 . 2 .]" 2
345 1 77 VAL H 1 77 VAL HA 1.800 . 3.000 2.820 2.774 2.967 . 0 0 "[ . 1 . 2 .]" 2
346 1 77 VAL H 1 77 VAL HB 1.800 . 3.000 2.526 2.392 3.047 0.047 25 0 "[ . 1 . 2 .]" 2
347 1 77 VAL H 1 77 VAL MG2 1.800 . 4.000 1.876 1.816 2.018 . 0 0 "[ . 1 . 2 .]" 2
348 1 77 VAL HA 1 78 ILE H 1.800 . 4.000 2.240 2.216 2.361 . 0 0 "[ . 1 . 2 .]" 2
349 1 77 VAL HB 1 78 ILE H 1.800 . 5.000 4.123 3.652 4.305 . 0 0 "[ . 1 . 2 .]" 2
350 1 77 VAL MG1 1 78 ILE H 1.800 . 6.400 2.574 2.232 2.973 . 0 0 "[ . 1 . 2 .]" 2
351 1 77 VAL H 1 78 ILE H 1.800 . 5.000 4.625 4.538 4.723 . 0 0 "[ . 1 . 2 .]" 2
352 1 78 ILE H 1 78 ILE HA 1.800 . 3.000 2.994 2.981 3.003 0.003 20 0 "[ . 1 . 2 .]" 2
353 1 78 ILE H 1 78 ILE HB 1.800 . 4.000 3.768 3.670 3.807 . 0 0 "[ . 1 . 2 .]" 2
354 1 78 ILE H 1 78 ILE MD 1.800 . 5.200 3.442 1.998 3.778 . 0 0 "[ . 1 . 2 .]" 2
355 1 78 ILE H 1 78 ILE QG 1.800 . 5.200 1.903 1.845 2.167 . 0 0 "[ . 1 . 2 .]" 2
356 1 78 ILE H 1 78 ILE MG 1.800 . 5.200 3.050 2.727 3.475 . 0 0 "[ . 1 . 2 .]" 2
357 1 79 PRO HA 1 80 THR H 1.800 . 3.000 2.807 2.660 2.996 . 0 0 "[ . 1 . 2 .]" 2
358 1 79 PRO QB 1 80 THR H 1.800 . 5.180 4.017 3.997 4.029 . 0 0 "[ . 1 . 2 .]" 2
359 1 79 PRO QD 1 80 THR H 1.800 . 5.180 3.661 3.239 4.011 . 0 0 "[ . 1 . 2 .]" 2
360 1 79 PRO QG 1 80 THR H 1.800 . 5.180 4.433 4.242 4.559 . 0 0 "[ . 1 . 2 .]" 2
361 1 80 THR H 1 80 THR HA 1.800 . 3.000 2.981 2.929 3.004 0.004 25 0 "[ . 1 . 2 .]" 2
362 1 80 THR H 1 80 THR MG 1.800 . 4.000 2.825 1.902 3.326 . 0 0 "[ . 1 . 2 .]" 2
363 1 79 PRO HA 1 81 ASN H 1.800 . 4.000 3.895 3.615 4.053 0.053 20 0 "[ . 1 . 2 .]" 2
364 1 80 THR HA 1 81 ASN H 1.800 . 4.000 3.162 2.600 3.535 . 0 0 "[ . 1 . 2 .]" 2
365 1 80 THR HB 1 81 ASN H 1.800 . 5.000 4.241 3.577 4.655 . 0 0 "[ . 1 . 2 .]" 2
366 1 80 THR MG 1 81 ASN H 1.800 . 6.400 3.865 2.033 4.430 . 0 0 "[ . 1 . 2 .]" 2
367 1 80 THR H 1 81 ASN H 1.800 . 3.000 2.162 1.905 3.068 0.068 20 0 "[ . 1 . 2 .]" 2
368 1 81 ASN H 1 81 ASN HA 1.800 . 3.000 2.957 2.354 3.004 0.004 17 0 "[ . 1 . 2 .]" 2
369 1 81 ASN H 1 81 ASN HB3 1.800 . 4.000 3.691 3.432 4.051 0.051 20 0 "[ . 1 . 2 .]" 2
370 1 81 ASN HA 1 82 GLY H 1.800 . 3.000 2.748 2.298 3.031 0.031 2 0 "[ . 1 . 2 .]" 2
371 1 81 ASN HB2 1 82 GLY H 1.800 . 4.000 3.559 2.558 4.035 0.035 13 0 "[ . 1 . 2 .]" 2
372 1 81 ASN H 1 82 GLY H 1.800 . 5.000 3.960 2.127 4.694 . 0 0 "[ . 1 . 2 .]" 2
373 1 40 GLY H 1 83 ASP HB2 1.800 . 5.000 3.994 3.497 4.801 . 0 0 "[ . 1 . 2 .]" 2
374 1 82 GLY QA 1 83 ASP H 1.800 . 4.060 2.322 2.162 2.486 . 0 0 "[ . 1 . 2 .]" 2
375 1 82 GLY H 1 83 ASP H 1.800 . 5.000 3.928 3.119 4.675 . 0 0 "[ . 1 . 2 .]" 2
376 1 83 ASP H 1 83 ASP HB3 1.800 . 4.000 3.719 3.537 3.922 . 0 0 "[ . 1 . 2 .]" 2
377 1 83 ASP H 1 83 ASP HB2 1.800 . 3.000 2.576 2.314 2.866 . 0 0 "[ . 1 . 2 .]" 2
378 1 40 GLY QA 1 84 VAL H 1.800 . 5.180 4.524 4.362 4.562 . 0 0 "[ . 1 . 2 .]" 2
379 1 41 ARG QG 1 84 VAL H 1.800 . 5.180 2.240 2.036 2.587 . 0 0 "[ . 1 . 2 .]" 2
380 1 41 ARG H 1 84 VAL H 1.800 . 5.000 4.891 4.781 5.003 0.003 8 0 "[ . 1 . 2 .]" 2
381 1 42 HIS H 1 84 VAL H 1.800 . 5.000 4.797 4.751 4.848 . 0 0 "[ . 1 . 2 .]" 2
382 1 65 ASN QD 1 84 VAL HA 1.800 . 4.000 3.114 2.515 3.725 . 0 0 "[ . 1 . 2 .]" 2
383 1 65 ASN QD 1 84 VAL HB 1.800 . 5.200 2.303 1.925 3.927 . 0 0 "[ . 1 . 2 .]" 2
384 1 65 ASN QD 1 84 VAL MG1 1.800 . 6.560 3.693 3.450 4.750 . 0 0 "[ . 1 . 2 .]" 2
385 1 65 ASN QD 1 84 VAL MG2 1.800 . 6.560 2.111 1.788 2.565 0.012 23 0 "[ . 1 . 2 .]" 2
386 1 65 ASN H 1 84 VAL H 1.800 . 5.000 5.218 5.184 5.263 0.263 24 0 "[ . 1 . 2 .]" 2
387 1 83 ASP HB3 1 84 VAL H 1.800 . 4.000 3.763 3.662 4.013 0.013 20 0 "[ . 1 . 2 .]" 2
388 1 83 ASP HB2 1 84 VAL H 1.800 . 5.000 4.370 4.314 4.449 . 0 0 "[ . 1 . 2 .]" 2
389 1 84 VAL H 1 84 VAL MG2 1.800 . 5.200 3.770 3.745 3.800 . 0 0 "[ . 1 . 2 .]" 2
390 1 39 GLY H 1 85 VAL MG1 1.800 . 6.400 4.807 4.719 4.946 . 0 0 "[ . 1 . 2 .]" 2
391 1 42 HIS H 1 85 VAL HA 1.800 . 3.000 1.946 1.910 2.007 . 0 0 "[ . 1 . 2 .]" 2
392 1 42 HIS H 1 85 VAL MG1 1.800 . 6.400 2.369 2.095 2.603 . 0 0 "[ . 1 . 2 .]" 2
393 1 64 ILE MG 1 85 VAL H 1.800 . 6.400 3.028 2.943 3.119 . 0 0 "[ . 1 . 2 .]" 2
394 1 67 VAL H 1 85 VAL HB 1.800 . 5.000 5.135 5.065 5.201 0.201 4 0 "[ . 1 . 2 .]" 2
395 1 67 VAL H 1 85 VAL H 1.800 . 5.000 4.186 4.058 4.287 . 0 0 "[ . 1 . 2 .]" 2
396 1 84 VAL HB 1 85 VAL H 1.800 . 4.000 4.181 4.147 4.229 0.229 22 0 "[ . 1 . 2 .]" 2
397 1 42 HIS H 1 86 VAL MG2 1.800 . 5.200 4.020 3.932 4.118 . 0 0 "[ . 1 . 2 .]" 2
398 1 42 HIS HB2 1 86 VAL H 1.800 . 5.000 4.430 4.304 4.588 . 0 0 "[ . 1 . 2 .]" 2
399 1 44 ILE QG 1 86 VAL H 1.800 . 6.400 4.192 3.963 4.339 . 0 0 "[ . 1 . 2 .]" 2
400 1 69 TYR H 1 86 VAL MG1 1.800 . 5.200 3.875 3.598 4.246 . 0 0 "[ . 1 . 2 .]" 2
401 1 78 ILE H 1 86 VAL MG1 1.800 . 6.400 5.124 4.977 5.260 . 0 0 "[ . 1 . 2 .]" 2
402 1 85 VAL H 1 86 VAL HA 1.800 . 5.000 4.850 4.809 4.906 . 0 0 "[ . 1 . 2 .]" 2
403 1 86 VAL H 1 86 VAL HB 1.800 . 3.000 2.543 2.426 2.598 . 0 0 "[ . 1 . 2 .]" 2
404 1 67 VAL H 1 87 VAL H 1.800 . 5.000 3.015 2.974 3.064 . 0 0 "[ . 1 . 2 .]" 2
405 1 69 TYR H 1 87 VAL HB 1.800 . 6.000 5.743 5.473 5.854 . 0 0 "[ . 1 . 2 .]" 2
406 1 86 VAL H 1 87 VAL H 1.800 . 5.000 4.452 4.415 4.478 . 0 0 "[ . 1 . 2 .]" 2
407 1 44 ILE HB 1 88 ALA H 1.800 . 5.000 3.921 3.772 4.074 . 0 0 "[ . 1 . 2 .]" 2
408 1 87 VAL MG1 1 88 ALA H 1.800 . 5.200 4.314 4.299 4.331 . 0 0 "[ . 1 . 2 .]" 2
409 1 87 VAL H 1 88 ALA H 1.800 . 5.000 4.080 4.044 4.116 . 0 0 "[ . 1 . 2 .]" 2
410 1 70 TYR HA 1 89 THR H 1.800 . 5.000 3.624 3.285 3.809 . 0 0 "[ . 1 . 2 .]" 2
411 1 70 TYR HB3 1 89 THR H 1.800 . 5.000 3.353 2.953 3.825 . 0 0 "[ . 1 . 2 .]" 2
412 1 88 ALA HA 1 89 THR H 1.800 . 3.000 2.380 2.344 2.415 . 0 0 "[ . 1 . 2 .]" 2
413 1 88 ALA MB 1 89 THR H 1.800 . 4.060 2.604 2.525 2.756 . 0 0 "[ . 1 . 2 .]" 2
414 1 89 THR H 1 89 THR MG 1.800 . 5.200 1.932 1.870 2.029 . 0 0 "[ . 1 . 2 .]" 2
415 1 89 THR HB 1 90 ASP H 1.800 . 4.000 3.560 3.394 4.059 0.059 7 0 "[ . 1 . 2 .]" 2
416 1 89 THR H 1 90 ASP H 1.800 . 5.000 3.576 2.190 4.206 . 0 0 "[ . 1 . 2 .]" 2
417 1 71 ARG H 1 91 ALA MB 1.800 . 4.060 2.922 2.729 3.036 . 0 0 "[ . 1 . 2 .]" 2
418 1 90 ASP HA 1 91 ALA H 1.800 . 4.000 3.134 2.756 3.553 . 0 0 "[ . 1 . 2 .]" 2
419 1 90 ASP HB3 1 91 ALA H 1.800 . 5.000 4.143 2.931 4.677 . 0 0 "[ . 1 . 2 .]" 2
420 1 90 ASP H 1 91 ALA H 1.800 . 5.000 2.686 1.881 3.439 . 0 0 "[ . 1 . 2 .]" 2
421 1 91 ALA H 1 91 ALA MB 1.800 . 4.060 2.192 1.944 2.376 . 0 0 "[ . 1 . 2 .]" 2
422 1 69 TYR QD 1 92 LEU H 1.800 . 6.300 3.309 2.490 4.461 . 0 0 "[ . 1 . 2 .]" 2
423 1 90 ASP HA 1 92 LEU H 1.800 . 4.000 3.948 3.612 4.052 0.052 14 0 "[ . 1 . 2 .]" 2
424 1 92 LEU H 1 92 LEU HA 1.800 . 3.000 2.887 2.857 2.934 . 0 0 "[ . 1 . 2 .]" 2
425 1 92 LEU H 1 92 LEU QB 1.800 . 4.060 2.117 1.972 2.214 . 0 0 "[ . 1 . 2 .]" 2
426 1 92 LEU H 1 92 LEU MD1 1.800 . 6.400 3.751 3.088 4.135 . 0 0 "[ . 1 . 2 .]" 2
427 1 92 LEU H 1 92 LEU MD2 1.800 . 6.400 4.221 4.076 4.315 . 0 0 "[ . 1 . 2 .]" 2
428 1 92 LEU HA 1 93 MET H 1.800 . 4.000 3.524 3.455 3.581 . 0 0 "[ . 1 . 2 .]" 2
429 1 93 MET H 1 93 MET QG 1.800 . 5.180 3.268 2.322 4.288 . 0 0 "[ . 1 . 2 .]" 2
430 1 93 MET H 1 94 THR H 1.800 . 5.000 3.501 2.748 4.705 . 0 0 "[ . 1 . 2 .]" 2
431 1 94 THR H 1 94 THR MG 1.800 . 6.400 2.787 1.924 4.006 . 0 0 "[ . 1 . 2 .]" 2
432 1 94 THR HA 1 95 GLY H 1.800 . 4.000 3.069 2.688 3.594 . 0 0 "[ . 1 . 2 .]" 2
433 1 94 THR H 1 95 GLY H 1.800 . 5.000 3.263 2.000 4.671 . 0 0 "[ . 1 . 2 .]" 2
434 1 96 PHE H 1 96 PHE HB3 1.800 . 3.000 2.955 2.623 3.129 0.129 15 0 "[ . 1 . 2 .]" 2
435 1 96 PHE H 1 96 PHE QD 1.800 . 6.300 2.390 1.927 2.679 . 0 0 "[ . 1 . 2 .]" 2
436 1 97 THR HA 1 98 GLY H 1.800 . 4.000 2.854 2.705 3.012 . 0 0 "[ . 1 . 2 .]" 2
437 1 97 THR HA 1 99 ASP H 1.800 . 4.000 3.459 3.180 4.012 0.012 20 0 "[ . 1 . 2 .]" 2
438 1 98 GLY QA 1 99 ASP H 1.800 . 4.060 2.818 2.638 2.955 . 0 0 "[ . 1 . 2 .]" 2
439 1 98 GLY H 1 99 ASP H 1.800 . 5.000 2.680 1.978 3.378 . 0 0 "[ . 1 . 2 .]" 2
440 1 99 ASP H 1 99 ASP HA 1.800 . 3.000 2.956 2.935 3.002 0.002 6 0 "[ . 1 . 2 .]" 2
441 1 99 ASP H 1 99 ASP HB3 1.800 . 3.000 2.744 2.443 3.038 0.038 12 0 "[ . 1 . 2 .]" 2
442 1 42 HIS H 1 100 PHE QD 1.800 . 6.300 3.777 3.170 4.775 . 0 0 "[ . 1 . 2 .]" 2
443 1 86 VAL H 1 100 PHE QE 1.800 . 6.300 3.653 2.687 4.969 . 0 0 "[ . 1 . 2 .]" 2
444 1 98 GLY QA 1 100 PHE H 1.800 . 5.180 3.949 3.592 4.641 . 0 0 "[ . 1 . 2 .]" 2
445 1 99 ASP HA 1 100 PHE H 1.800 . 3.000 2.590 2.284 2.745 . 0 0 "[ . 1 . 2 .]" 2
446 1 99 ASP HB3 1 100 PHE H 1.800 . 5.000 4.404 4.293 4.687 . 0 0 "[ . 1 . 2 .]" 2
447 1 99 ASP H 1 100 PHE H 1.800 . 5.000 3.653 3.199 4.220 . 0 0 "[ . 1 . 2 .]" 2
448 1 100 PHE H 1 100 PHE HB2 1.800 . 3.000 2.422 2.303 2.518 . 0 0 "[ . 1 . 2 .]" 2
449 1 100 PHE H 1 100 PHE QD 1.800 . 4.060 3.144 2.265 3.643 . 0 0 "[ . 1 . 2 .]" 2
450 1 41 ARG H 1 101 ASP HB3 1.800 . 5.000 5.010 4.905 5.039 0.039 7 0 "[ . 1 . 2 .]" 2
451 1 41 ARG H 1 101 ASP HB2 1.800 . 4.000 3.603 3.468 3.841 . 0 0 "[ . 1 . 2 .]" 2
452 1 41 ARG QB 1 101 ASP H 1.800 . 5.180 3.535 3.375 3.711 . 0 0 "[ . 1 . 2 .]" 2
453 1 41 ARG H 1 101 ASP H 1.800 . 5.000 3.942 3.631 4.215 . 0 0 "[ . 1 . 2 .]" 2
454 1 42 HIS HA 1 101 ASP H 1.800 . 5.000 3.206 3.002 3.406 . 0 0 "[ . 1 . 2 .]" 2
455 1 43 LEU H 1 101 ASP H 1.800 . 5.000 4.976 4.802 5.038 0.038 20 0 "[ . 1 . 2 .]" 2
456 1 100 PHE HB3 1 101 ASP H 1.800 . 4.000 2.957 2.847 3.276 . 0 0 "[ . 1 . 2 .]" 2
457 1 100 PHE HB2 1 101 ASP H 1.800 . 5.000 4.073 3.912 4.219 . 0 0 "[ . 1 . 2 .]" 2
458 1 100 PHE QD 1 101 ASP H 1.800 . 6.300 3.585 2.994 4.237 . 0 0 "[ . 1 . 2 .]" 2
459 1 100 PHE H 1 101 ASP H 1.800 . 5.000 4.509 4.456 4.543 . 0 0 "[ . 1 . 2 .]" 2
460 1 101 ASP H 1 101 ASP HA 1.800 . 3.000 2.922 2.865 2.960 . 0 0 "[ . 1 . 2 .]" 2
461 1 101 ASP H 1 101 ASP HB3 1.800 . 4.000 3.448 3.409 3.553 . 0 0 "[ . 1 . 2 .]" 2
462 1 42 HIS HA 1 102 SER H 1.800 . 3.000 2.795 2.659 2.990 . 0 0 "[ . 1 . 2 .]" 2
463 1 43 LEU H 1 102 SER H 1.800 . 5.000 3.850 3.689 4.001 . 0 0 "[ . 1 . 2 .]" 2
464 1 100 PHE HA 1 102 SER H 1.800 . 4.000 4.027 3.813 4.081 0.081 7 0 "[ . 1 . 2 .]" 2
465 1 100 PHE HB3 1 102 SER H 1.800 . 3.000 2.774 2.568 2.947 . 0 0 "[ . 1 . 2 .]" 2
466 1 100 PHE HB2 1 102 SER H 1.800 . 4.000 4.094 4.056 4.161 0.161 4 0 "[ . 1 . 2 .]" 2
467 1 101 ASP HB3 1 102 SER H 1.800 . 4.000 3.526 3.398 3.799 . 0 0 "[ . 1 . 2 .]" 2
468 1 101 ASP HB2 1 102 SER H 1.800 . 4.000 2.868 2.746 2.989 . 0 0 "[ . 1 . 2 .]" 2
469 1 101 ASP H 1 102 SER H 1.800 . 3.000 2.419 2.236 2.625 . 0 0 "[ . 1 . 2 .]" 2
470 1 102 SER H 1 102 SER HA 1.800 . 3.000 2.934 2.929 2.940 . 0 0 "[ . 1 . 2 .]" 2
471 1 102 SER HA 1 103 VAL H 1.800 . 3.000 2.415 2.399 2.434 . 0 0 "[ . 1 . 2 .]" 2
472 1 102 SER HB2 1 103 VAL H 1.800 . 3.000 2.803 2.741 2.877 . 0 0 "[ . 1 . 2 .]" 2
473 1 103 VAL H 1 103 VAL MG2 1.800 . 4.000 1.966 1.862 2.048 . 0 0 "[ . 1 . 2 .]" 2
474 1 32 ILE H 1 104 ILE MG 1.800 . 6.400 5.320 5.252 5.388 . 0 0 "[ . 1 . 2 .]" 2
475 1 44 ILE HA 1 104 ILE H 1.800 . 3.000 2.556 2.340 2.821 . 0 0 "[ . 1 . 2 .]" 2
476 1 45 PHE H 1 104 ILE H 1.800 . 5.000 3.842 3.632 4.063 . 0 0 "[ . 1 . 2 .]" 2
477 1 103 VAL HA 1 104 ILE H 1.800 . 3.000 2.206 2.182 2.225 . 0 0 "[ . 1 . 2 .]" 2
478 1 103 VAL HB 1 104 ILE H 1.800 . 5.000 3.704 3.543 3.792 . 0 0 "[ . 1 . 2 .]" 2
479 1 103 VAL MG1 1 104 ILE H 1.800 . 5.000 3.687 3.314 3.905 . 0 0 "[ . 1 . 2 .]" 2
480 1 104 ILE H 1 104 ILE MD 1.800 . 6.400 2.113 1.910 3.163 . 0 0 "[ . 1 . 2 .]" 2
481 1 104 ILE H 1 104 ILE QG 1.800 . 5.200 3.205 2.137 3.391 . 0 0 "[ . 1 . 2 .]" 2
482 1 104 ILE H 1 104 ILE MG 1.800 . 6.400 3.702 3.670 3.775 . 0 0 "[ . 1 . 2 .]" 2
483 1 103 VAL MG2 1 105 ASP H 1.800 . 6.400 5.167 4.586 5.339 . 0 0 "[ . 1 . 2 .]" 2
484 1 104 ILE HA 1 105 ASP H 1.800 . 3.000 2.234 2.221 2.251 . 0 0 "[ . 1 . 2 .]" 2
485 1 104 ILE HB 1 105 ASP H 1.800 . 5.000 4.476 4.358 4.520 . 0 0 "[ . 1 . 2 .]" 2
486 1 104 ILE QG 1 105 ASP H 1.800 . 6.400 4.248 4.131 4.903 . 0 0 "[ . 1 . 2 .]" 2
487 1 104 ILE MG 1 105 ASP H 1.800 . 5.200 2.986 2.855 3.081 . 0 0 "[ . 1 . 2 .]" 2
488 1 105 ASP H 1 105 ASP HB3 1.800 . 4.000 2.858 2.813 2.915 . 0 0 "[ . 1 . 2 .]" 2
489 1 105 ASP H 1 105 ASP HB2 1.800 . 4.000 2.564 2.479 2.667 . 0 0 "[ . 1 . 2 .]" 2
490 1 105 ASP HA 1 106 CYS H 1.800 . 3.000 2.350 2.331 2.361 . 0 0 "[ . 1 . 2 .]" 2
491 1 106 CYS H 1 106 CYS HB3 1.800 . 4.000 2.706 2.348 3.608 . 0 0 "[ . 1 . 2 .]" 2
492 1 105 ASP HA 1 107 ASN H 1.800 . 5.000 3.839 3.794 3.899 . 0 0 "[ . 1 . 2 .]" 2
493 1 105 ASP HB2 1 107 ASN H 1.800 . 4.000 4.097 4.059 4.141 0.141 16 0 "[ . 1 . 2 .]" 2
494 1 106 CYS H 1 107 ASN H 1.800 . 4.000 2.311 2.195 2.398 . 0 0 "[ . 1 . 2 .]" 2
495 1 107 ASN HA 1 107 ASN QD 1.800 . 5.200 3.406 2.085 3.771 . 0 0 "[ . 1 . 2 .]" 2
496 1 107 ASN H 1 107 ASN HA 1.800 . 3.000 2.353 2.345 2.364 . 0 0 "[ . 1 . 2 .]" 2
497 1 107 ASN H 1 107 ASN QD 1.800 . 6.400 4.394 2.024 4.792 . 0 0 "[ . 1 . 2 .]" 2
498 1 106 CYS HA 1 108 THR H 1.800 . 5.000 4.324 4.178 4.580 . 0 0 "[ . 1 . 2 .]" 2
499 1 107 ASN H 1 108 THR H 1.800 . 3.000 2.868 2.758 2.942 . 0 0 "[ . 1 . 2 .]" 2
500 1 108 THR H 1 108 THR MG 1.800 . 4.000 3.414 3.262 3.634 . 0 0 "[ . 1 . 2 .]" 2
501 1 109 SER H 1 109 SER HA 1.800 . 3.000 2.990 2.943 3.001 0.001 22 0 "[ . 1 . 2 .]" 2
502 1 109 SER H 1 109 SER HB3 1.800 . 3.000 2.597 2.230 2.899 . 0 0 "[ . 1 . 2 .]" 2
503 1 109 SER H 1 109 SER HB2 1.800 . 4.000 3.662 3.519 3.710 . 0 0 "[ . 1 . 2 .]" 2
504 1 109 SER HB2 1 110 ASP H 1.800 . 5.000 3.461 3.227 3.675 . 0 0 "[ . 1 . 2 .]" 2
505 1 109 SER H 1 110 ASP H 1.800 . 5.000 4.475 4.380 4.610 . 0 0 "[ . 1 . 2 .]" 2
506 1 110 ASP H 1 110 ASP HA 1.800 . 3.000 2.364 2.357 2.373 . 0 0 "[ . 1 . 2 .]" 2
507 1 110 ASP HA 1 111 GLY H 1.800 . 3.000 3.016 2.874 3.070 0.070 6 0 "[ . 1 . 2 .]" 2
508 1 109 SER H 1 112 LYS H 1.800 . 4.000 3.882 3.149 4.024 0.024 24 0 "[ . 1 . 2 .]" 2
509 1 111 GLY H 1 112 LYS QE 1.800 . 6.300 5.233 4.267 5.648 . 0 0 "[ . 1 . 2 .]" 2
510 1 111 GLY H 1 112 LYS H 1.800 . 3.000 2.835 2.498 3.016 0.016 14 0 "[ . 1 . 2 .]" 2
511 1 112 LYS H 1 112 LYS HA 1.800 . 3.000 2.955 2.911 3.000 0.000 21 0 "[ . 1 . 2 .]" 2
512 1 112 LYS H 1 112 LYS QD 1.800 . 4.060 2.942 1.995 3.697 . 0 0 "[ . 1 . 2 .]" 2
513 1 112 LYS H 1 112 LYS QG 1.800 . 4.060 2.836 1.931 3.519 . 0 0 "[ . 1 . 2 .]" 2
514 1 112 LYS H 1 113 PRO QD 1.800 . 5.180 4.416 4.377 4.432 . 0 0 "[ . 1 . 2 .]" 2
515 1 107 ASN QD 1 114 GLN H 1.800 . 6.400 5.490 4.988 5.658 . 0 0 "[ . 1 . 2 .]" 2
516 1 108 THR MG 1 114 GLN H 1.800 . 6.400 3.435 2.509 4.543 . 0 0 "[ . 1 . 2 .]" 2
517 1 109 SER H 1 114 GLN QB 1.800 . 6.300 3.778 3.302 4.003 . 0 0 "[ . 1 . 2 .]" 2
518 1 109 SER H 1 114 GLN H 1.800 . 5.000 3.342 3.040 3.628 . 0 0 "[ . 1 . 2 .]" 2
519 1 113 PRO HA 1 114 GLN H 1.800 . 3.000 2.259 2.180 2.454 . 0 0 "[ . 1 . 2 .]" 2
520 1 114 GLN H 1 114 GLN QG 1.800 . 6.300 2.823 1.978 3.959 . 0 0 "[ . 1 . 2 .]" 2
521 1 114 GLN QB 1 115 ASP H 1.800 . 6.300 2.866 2.234 3.599 . 0 0 "[ . 1 . 2 .]" 2
522 1 114 GLN QG 1 115 ASP H 1.800 . 5.180 3.214 2.002 4.127 . 0 0 "[ . 1 . 2 .]" 2
523 1 115 ASP H 1 115 ASP HB3 1.800 . 4.000 2.812 2.646 2.953 . 0 0 "[ . 1 . 2 .]" 2
524 1 115 ASP H 1 115 ASP HB2 1.800 . 4.000 3.590 3.547 3.636 . 0 0 "[ . 1 . 2 .]" 2
525 1 115 ASP HA 1 116 ALA H 1.800 . 3.000 2.391 2.375 2.418 . 0 0 "[ . 1 . 2 .]" 2
526 1 115 ASP HB3 1 116 ALA H 1.800 . 4.000 3.865 3.831 3.897 . 0 0 "[ . 1 . 2 .]" 2
527 1 115 ASP HB2 1 116 ALA H 1.800 . 3.000 2.662 2.635 2.716 . 0 0 "[ . 1 . 2 .]" 2
528 1 116 ALA H 1 116 ALA HA 1.800 . 3.000 2.759 2.735 2.834 . 0 0 "[ . 1 . 2 .]" 2
529 1 116 ALA H 1 116 ALA MB 1.800 . 4.060 2.007 1.907 2.160 . 0 0 "[ . 1 . 2 .]" 2
530 1 115 ASP HA 1 117 VAL H 1.800 . 5.000 4.793 4.561 4.985 . 0 0 "[ . 1 . 2 .]" 2
531 1 115 ASP HB2 1 117 VAL H 1.800 . 5.000 3.416 3.080 3.648 . 0 0 "[ . 1 . 2 .]" 2
532 1 116 ALA HA 1 117 VAL H 1.800 . 4.000 3.607 3.599 3.621 . 0 0 "[ . 1 . 2 .]" 2
533 1 116 ALA MB 1 117 VAL H 1.800 . 4.060 2.307 2.003 2.541 . 0 0 "[ . 1 . 2 .]" 2
534 1 116 ALA H 1 117 VAL H 1.800 . 4.000 3.156 2.878 3.278 . 0 0 "[ . 1 . 2 .]" 2
535 1 117 VAL H 1 117 VAL HA 1.800 . 3.000 2.868 2.822 2.884 . 0 0 "[ . 1 . 2 .]" 2
536 1 117 VAL H 1 117 VAL HB 1.800 . 4.000 3.558 3.543 3.573 . 0 0 "[ . 1 . 2 .]" 2
537 1 117 VAL H 1 117 VAL MG2 1.800 . 4.000 2.074 2.005 2.166 . 0 0 "[ . 1 . 2 .]" 2
538 1 115 ASP H 1 118 SER HB3 1.800 . 4.000 3.141 2.849 3.640 . 0 0 "[ . 1 . 2 .]" 2
539 1 115 ASP HA 1 118 SER H 1.800 . 5.000 4.640 4.562 4.812 . 0 0 "[ . 1 . 2 .]" 2
540 1 116 ALA H 1 118 SER H 1.800 . 5.000 4.266 4.198 4.401 . 0 0 "[ . 1 . 2 .]" 2
541 1 117 VAL HA 1 118 SER H 1.800 . 5.000 3.533 3.521 3.565 . 0 0 "[ . 1 . 2 .]" 2
542 1 117 VAL HB 1 118 SER H 1.800 . 4.000 3.966 3.941 3.998 . 0 0 "[ . 1 . 2 .]" 2
543 1 117 VAL MG1 1 118 SER H 1.800 . 5.200 3.857 3.811 3.903 . 0 0 "[ . 1 . 2 .]" 2
544 1 117 VAL H 1 118 SER H 1.800 . 3.000 2.702 2.611 2.836 . 0 0 "[ . 1 . 2 .]" 2
545 1 118 SER H 1 118 SER HA 1.800 . 3.000 2.788 2.780 2.821 . 0 0 "[ . 1 . 2 .]" 2
546 1 118 SER H 1 118 SER HB3 1.800 . 4.000 3.153 2.766 3.329 . 0 0 "[ . 1 . 2 .]" 2
547 1 114 GLN QB 1 119 ARG HE 1.800 . 6.300 5.258 3.918 5.669 . 0 0 "[ . 1 . 2 .]" 2
548 1 114 GLN QG 1 119 ARG HE 1.800 . 6.300 4.463 2.036 5.484 . 0 0 "[ . 1 . 2 .]" 2
549 1 114 GLN QG 1 119 ARG H 1.800 . 5.180 3.602 2.476 4.613 . 0 0 "[ . 1 . 2 .]" 2
550 1 115 ASP H 1 119 ARG H 1.800 . 5.000 4.692 4.450 5.029 0.029 20 0 "[ . 1 . 2 .]" 2
551 1 117 VAL HA 1 119 ARG H 1.800 . 5.000 4.573 4.544 4.649 . 0 0 "[ . 1 . 2 .]" 2
552 1 118 SER HA 1 119 ARG H 1.800 . 4.000 3.602 3.593 3.620 . 0 0 "[ . 1 . 2 .]" 2
553 1 118 SER HB2 1 119 ARG H 1.800 . 4.000 3.018 2.764 3.226 . 0 0 "[ . 1 . 2 .]" 2
554 1 119 ARG HA 1 119 ARG HE 1.800 . 5.000 4.429 4.167 5.017 0.017 13 0 "[ . 1 . 2 .]" 2
555 1 119 ARG QB 1 119 ARG HE 1.800 . 6.300 2.082 1.903 3.207 . 0 0 "[ . 1 . 2 .]" 2
556 1 119 ARG H 1 119 ARG QD 1.800 . 4.060 2.979 2.274 3.745 . 0 0 "[ . 1 . 2 .]" 2
557 1 118 SER H 1 120 THR H 1.800 . 4.000 3.990 3.928 4.041 0.041 22 0 "[ . 1 . 2 .]" 2
558 1 119 ARG QB 1 120 THR H 1.800 . 4.060 3.448 3.402 3.502 . 0 0 "[ . 1 . 2 .]" 2
559 1 119 ARG H 1 120 THR H 1.800 . 5.000 2.565 2.530 2.630 . 0 0 "[ . 1 . 2 .]" 2
560 1 120 THR H 1 120 THR HA 1.800 . 3.000 2.852 2.846 2.861 . 0 0 "[ . 1 . 2 .]" 2
561 1 120 THR H 1 120 THR HB 1.800 . 3.000 2.525 2.407 2.608 . 0 0 "[ . 1 . 2 .]" 2
562 1 120 THR H 1 120 THR MG 1.800 . 5.000 3.697 3.682 3.707 . 0 0 "[ . 1 . 2 .]" 2
563 1 117 VAL MG2 1 121 GLN H 1.800 . 5.200 4.247 4.229 4.263 . 0 0 "[ . 1 . 2 .]" 2
564 1 118 SER H 1 121 GLN H 1.800 . 5.000 4.567 4.511 4.628 . 0 0 "[ . 1 . 2 .]" 2
565 1 119 ARG H 1 121 GLN QB 1.800 . 6.300 5.183 5.033 5.252 . 0 0 "[ . 1 . 2 .]" 2
566 1 119 ARG QB 1 121 GLN H 1.800 . 6.300 5.282 5.189 5.323 . 0 0 "[ . 1 . 2 .]" 2
567 1 119 ARG QG 1 121 GLN H 1.800 . 6.300 4.317 4.249 4.364 . 0 0 "[ . 1 . 2 .]" 2
568 1 120 THR HA 1 121 GLN H 1.800 . 4.000 3.581 3.565 3.590 . 0 0 "[ . 1 . 2 .]" 2
569 1 120 THR HB 1 121 GLN H 1.800 . 3.000 2.270 2.240 2.326 . 0 0 "[ . 1 . 2 .]" 2
570 1 120 THR H 1 121 GLN H 1.800 . 4.000 2.747 2.698 2.771 . 0 0 "[ . 1 . 2 .]" 2
571 1 121 GLN H 1 121 GLN QG 1.800 . 5.180 3.924 3.831 4.017 . 0 0 "[ . 1 . 2 .]" 2
572 1 118 SER HB3 1 122 ARG H 1.800 . 5.000 5.069 4.961 5.242 0.242 20 0 "[ . 1 . 2 .]" 2
573 1 119 ARG H 1 122 ARG QB 1.800 . 5.000 4.142 4.112 4.177 . 0 0 "[ . 1 . 2 .]" 2
574 1 121 GLN QB 1 122 ARG H 1.800 . 5.180 2.528 2.331 2.612 . 0 0 "[ . 1 . 2 .]" 2
575 1 122 ARG H 1 122 ARG QG 1.800 . 4.060 2.571 2.186 3.287 . 0 0 "[ . 1 . 2 .]" 2
576 1 119 ARG QB 1 123 ARG H 1.800 . 4.560 4.046 4.001 4.162 . 0 0 "[ . 1 . 2 .]" 2
577 1 120 THR H 1 123 ARG QB 1.800 . 5.180 4.568 4.401 4.666 . 0 0 "[ . 1 . 2 .]" 2
578 1 123 ARG H 1 123 ARG HA 1.800 . 3.000 2.844 2.815 2.896 . 0 0 "[ . 1 . 2 .]" 2
579 1 123 ARG H 1 123 ARG QG 1.800 . 6.300 3.905 3.767 3.948 . 0 0 "[ . 1 . 2 .]" 2
580 1 121 GLN HA 1 124 GLY H 1.800 . 5.000 3.794 3.519 4.091 . 0 0 "[ . 1 . 2 .]" 2
581 1 121 GLN QB 1 124 GLY H 1.800 . 6.300 5.189 4.922 5.445 . 0 0 "[ . 1 . 2 .]" 2
582 1 122 ARG QB 1 124 GLY H 1.800 . 5.180 4.629 4.524 4.747 . 0 0 "[ . 1 . 2 .]" 2
583 1 123 ARG QB 1 124 GLY H 1.800 . 5.180 2.481 2.292 2.630 . 0 0 "[ . 1 . 2 .]" 2
584 1 123 ARG H 1 124 GLY H 1.800 . 4.000 2.772 2.623 2.865 . 0 0 "[ . 1 . 2 .]" 2
585 1 103 VAL MG2 1 125 ARG H 1.800 . 5.200 3.953 3.590 4.197 . 0 0 "[ . 1 . 2 .]" 2
586 1 124 GLY QA 1 125 ARG H 1.800 . 5.180 2.528 2.257 2.972 . 0 0 "[ . 1 . 2 .]" 2
587 1 125 ARG H 1 125 ARG QD 1.800 . 6.300 3.680 1.915 4.592 . 0 0 "[ . 1 . 2 .]" 2
588 1 100 PHE H 1 126 THR HA 1.800 . 3.000 2.980 2.833 3.077 0.077 12 0 "[ . 1 . 2 .]" 2
589 1 100 PHE H 1 126 THR HB 1.800 . 5.000 4.863 4.640 5.033 0.033 7 0 "[ . 1 . 2 .]" 2
590 1 124 GLY QA 1 126 THR H 1.800 . 5.180 4.018 3.295 4.322 . 0 0 "[ . 1 . 2 .]" 2
591 1 125 ARG HA 1 126 THR H 1.800 . 4.000 3.542 3.371 3.589 . 0 0 "[ . 1 . 2 .]" 2
592 1 125 ARG QB 1 126 THR H 1.800 . 6.300 2.591 2.353 3.301 . 0 0 "[ . 1 . 2 .]" 2
593 1 125 ARG H 1 126 THR H 1.800 . 3.000 2.147 1.905 3.058 0.058 7 0 "[ . 1 . 2 .]" 2
594 1 126 THR H 1 126 THR HA 1.800 . 3.000 2.978 2.962 2.998 . 0 0 "[ . 1 . 2 .]" 2
595 1 14 ILE MD 1 127 GLY H 1.800 . 6.400 4.681 4.371 4.808 . 0 0 "[ . 1 . 2 .]" 2
596 1 126 THR HA 1 127 GLY H 1.800 . 3.000 2.279 2.238 2.305 . 0 0 "[ . 1 . 2 .]" 2
597 1 126 THR H 1 127 GLY H 1.800 . 5.000 4.565 4.467 4.620 . 0 0 "[ . 1 . 2 .]" 2
598 1 100 PHE H 1 128 ARG H 1.800 . 4.000 4.076 4.018 4.120 0.120 6 0 "[ . 1 . 2 .]" 2
599 1 125 ARG H 1 128 ARG HE 1.800 . 4.000 4.000 3.719 4.099 0.099 20 0 "[ . 1 . 2 .]" 2
600 1 126 THR HA 1 128 ARG H 1.800 . 4.000 3.442 3.327 3.616 . 0 0 "[ . 1 . 2 .]" 2
601 1 127 GLY QA 1 128 ARG H 1.800 . 5.180 2.923 2.850 2.952 . 0 0 "[ . 1 . 2 .]" 2
602 1 127 GLY H 1 128 ARG H 1.800 . 4.000 2.124 1.896 2.588 . 0 0 "[ . 1 . 2 .]" 2
603 1 128 ARG H 1 128 ARG HA 1.800 . 3.000 2.907 2.822 2.991 . 0 0 "[ . 1 . 2 .]" 2
604 1 128 ARG H 1 128 ARG QG 1.800 . 4.060 2.863 1.931 3.622 . 0 0 "[ . 1 . 2 .]" 2
605 1 127 GLY QA 1 129 GLY H 1.800 . 4.560 4.048 3.384 4.159 . 0 0 "[ . 1 . 2 .]" 2
606 1 128 ARG QB 1 129 GLY H 1.800 . 6.300 3.731 2.481 3.925 . 0 0 "[ . 1 . 2 .]" 2
607 1 128 ARG HA 1 130 LYS H 1.800 . 5.000 4.131 3.852 4.526 . 0 0 "[ . 1 . 2 .]" 2
608 1 129 GLY QA 1 130 LYS H 1.800 . 4.060 2.811 2.593 2.944 . 0 0 "[ . 1 . 2 .]" 2
609 1 129 GLY H 1 130 LYS H 1.800 . 3.000 2.471 2.127 3.046 0.046 8 0 "[ . 1 . 2 .]" 2
610 1 130 LYS H 1 130 LYS HA 1.800 . 3.000 2.940 2.871 3.001 0.001 25 0 "[ . 1 . 2 .]" 2
611 1 130 LYS H 1 130 LYS QG 1.800 . 4.060 2.561 1.989 3.694 . 0 0 "[ . 1 . 2 .]" 2
612 1 15 GLU H 1 131 PRO HA 1.800 . 5.000 4.933 4.665 5.058 0.058 6 0 "[ . 1 . 2 .]" 2
613 1 130 LYS H 1 131 PRO QD 1.800 . 5.180 4.341 4.282 4.419 . 0 0 "[ . 1 . 2 .]" 2
614 1 14 ILE HA 1 132 GLY H 1.800 . 3.000 2.633 2.514 2.807 . 0 0 "[ . 1 . 2 .]" 2
615 1 14 ILE HB 1 132 GLY H 1.800 . 5.000 5.096 5.025 5.123 0.123 13 0 "[ . 1 . 2 .]" 2
616 1 14 ILE MG 1 132 GLY H 1.800 . 6.400 4.114 3.892 4.850 . 0 0 "[ . 1 . 2 .]" 2
617 1 15 GLU H 1 132 GLY H 1.800 . 5.000 4.188 3.990 4.311 . 0 0 "[ . 1 . 2 .]" 2
618 1 127 GLY H 1 132 GLY QA 1.800 . 5.180 2.712 2.092 2.939 . 0 0 "[ . 1 . 2 .]" 2
619 1 127 GLY QA 1 132 GLY H 1.800 . 5.180 1.969 1.866 2.101 . 0 0 "[ . 1 . 2 .]" 2
620 1 128 ARG H 1 132 GLY QA 1.800 . 6.300 4.442 4.250 4.530 . 0 0 "[ . 1 . 2 .]" 2
621 1 128 ARG H 1 132 GLY H 1.800 . 5.000 5.095 5.025 5.157 0.157 9 0 "[ . 1 . 2 .]" 2
622 1 131 PRO QB 1 132 GLY H 1.800 . 5.180 3.685 3.551 3.812 . 0 0 "[ . 1 . 2 .]" 2
623 1 131 PRO QG 1 132 GLY H 1.800 . 6.300 4.860 4.742 4.900 . 0 0 "[ . 1 . 2 .]" 2
624 1 15 GLU H 1 133 ILE HA 1.800 . 3.000 2.417 2.141 2.637 . 0 0 "[ . 1 . 2 .]" 2
625 1 15 GLU H 1 133 ILE QG 1.800 . 6.400 3.146 2.723 3.509 . 0 0 "[ . 1 . 2 .]" 2
626 1 102 SER HA 1 133 ILE H 1.800 . 3.000 2.246 1.931 2.675 . 0 0 "[ . 1 . 2 .]" 2
627 1 103 VAL H 1 133 ILE MG 1.800 . 6.400 3.767 3.503 4.094 . 0 0 "[ . 1 . 2 .]" 2
628 1 103 VAL H 1 133 ILE H 1.800 . 5.000 4.120 3.778 4.626 . 0 0 "[ . 1 . 2 .]" 2
629 1 132 GLY QA 1 133 ILE H 1.800 . 4.060 2.282 2.225 2.322 . 0 0 "[ . 1 . 2 .]" 2
630 1 132 GLY H 1 133 ILE H 1.800 . 5.000 4.620 4.553 4.665 . 0 0 "[ . 1 . 2 .]" 2
631 1 133 ILE H 1 133 ILE MD 1.800 . 5.200 3.266 2.046 4.171 . 0 0 "[ . 1 . 2 .]" 2
632 1 133 ILE H 1 133 ILE QG 1.800 . 6.400 3.253 2.935 3.637 . 0 0 "[ . 1 . 2 .]" 2
633 1 15 GLU H 1 134 TYR H 1.800 . 5.000 3.961 3.791 4.183 . 0 0 "[ . 1 . 2 .]" 2
634 1 16 GLU HA 1 134 TYR H 1.800 . 4.000 2.915 2.568 3.211 . 0 0 "[ . 1 . 2 .]" 2
635 1 16 GLU QG 1 134 TYR H 1.800 . 6.300 4.284 3.973 4.551 . 0 0 "[ . 1 . 2 .]" 2
636 1 17 VAL H 1 134 TYR HA 1.800 . 5.000 4.853 4.653 5.033 0.033 7 0 "[ . 1 . 2 .]" 2
637 1 17 VAL H 1 134 TYR HB3 1.800 . 5.000 3.634 3.437 3.915 . 0 0 "[ . 1 . 2 .]" 2
638 1 105 ASP H 1 134 TYR QE 1.800 . 6.300 3.541 2.878 4.457 . 0 0 "[ . 1 . 2 .]" 2
639 1 123 ARG H 1 134 TYR QE 1.800 . 6.300 3.471 2.794 4.599 . 0 0 "[ . 1 . 2 .]" 2
640 1 133 ILE HA 1 134 TYR H 1.800 . 3.000 2.285 2.267 2.327 . 0 0 "[ . 1 . 2 .]" 2
641 1 133 ILE QG 1 134 TYR H 1.800 . 6.400 3.933 3.854 4.007 . 0 0 "[ . 1 . 2 .]" 2
642 1 134 TYR H 1 134 TYR HB3 1.800 . 4.000 2.693 2.585 2.754 . 0 0 "[ . 1 . 2 .]" 2
643 1 17 VAL H 1 135 ARG QG 1.800 . 6.300 3.758 3.514 4.025 . 0 0 "[ . 1 . 2 .]" 2
644 1 36 VAL MG1 1 135 ARG HE 1.800 . 6.400 2.991 1.902 3.968 . 0 0 "[ . 1 . 2 .]" 2
645 1 103 VAL HB 1 135 ARG H 1.800 . 5.000 4.560 4.238 4.872 . 0 0 "[ . 1 . 2 .]" 2
646 1 103 VAL H 1 135 ARG H 1.800 . 5.000 3.292 3.008 3.618 . 0 0 "[ . 1 . 2 .]" 2
647 1 104 ILE HA 1 135 ARG H 1.800 . 4.000 2.930 2.465 3.433 . 0 0 "[ . 1 . 2 .]" 2
648 1 105 ASP H 1 135 ARG H 1.800 . 5.000 3.907 3.558 4.323 . 0 0 "[ . 1 . 2 .]" 2
649 1 133 ILE MG 1 135 ARG H 1.800 . 6.400 3.711 3.595 3.928 . 0 0 "[ . 1 . 2 .]" 2
650 1 134 TYR H 1 135 ARG QG 1.800 . 6.300 4.041 3.823 4.474 . 0 0 "[ . 1 . 2 .]" 2
651 1 134 TYR HA 1 135 ARG H 1.800 . 3.000 2.187 2.163 2.199 . 0 0 "[ . 1 . 2 .]" 2
652 1 134 TYR HB2 1 135 ARG H 1.800 . 5.000 4.487 4.431 4.532 . 0 0 "[ . 1 . 2 .]" 2
653 1 135 ARG H 1 135 ARG QG 1.800 . 4.060 2.563 2.133 3.109 . 0 0 "[ . 1 . 2 .]" 2
654 1 17 VAL H 1 136 PHE H 1.800 . 5.000 3.988 3.677 4.340 . 0 0 "[ . 1 . 2 .]" 2
655 1 18 ALA MB 1 136 PHE H 1.800 . 6.300 4.678 4.302 4.912 . 0 0 "[ . 1 . 2 .]" 2
656 1 19 LEU MD1 1 136 PHE H 1.800 . 6.400 4.534 4.277 4.882 . 0 0 "[ . 1 . 2 .]" 2
657 1 19 LEU H 1 136 PHE H 1.800 . 4.000 2.823 2.400 3.269 . 0 0 "[ . 1 . 2 .]" 2
658 1 105 ASP H 1 136 PHE HA 1.800 . 4.000 2.762 2.454 3.041 . 0 0 "[ . 1 . 2 .]" 2
659 1 135 ARG HA 1 136 PHE H 1.800 . 3.000 2.244 2.206 2.317 . 0 0 "[ . 1 . 2 .]" 2
660 1 135 ARG QB 1 136 PHE H 1.800 . 4.060 3.330 2.963 3.484 . 0 0 "[ . 1 . 2 .]" 2
661 1 135 ARG H 1 136 PHE H 1.800 . 5.000 4.468 4.390 4.592 . 0 0 "[ . 1 . 2 .]" 2
662 1 136 PHE HA 1 137 VAL H 1.800 . 4.000 2.357 2.298 2.394 . 0 0 "[ . 1 . 2 .]" 2
663 1 136 PHE HB3 1 137 VAL H 1.800 . 5.000 4.033 3.939 4.141 . 0 0 "[ . 1 . 2 .]" 2
664 1 136 PHE HB2 1 137 VAL H 1.800 . 5.000 2.860 2.768 3.033 . 0 0 "[ . 1 . 2 .]" 2
665 1 137 VAL H 1 137 VAL HB 1.800 . 4.000 2.216 2.124 2.297 . 0 0 "[ . 1 . 2 .]" 2
666 1 137 VAL H 1 137 VAL MG1 1.800 . 5.200 3.666 3.606 3.712 . 0 0 "[ . 1 . 2 .]" 2
667 1 107 ASN HB3 1 138 ALA H 1.800 . 5.000 3.478 3.035 3.687 . 0 0 "[ . 1 . 2 .]" 2
668 1 107 ASN HB2 1 138 ALA H 1.800 . 4.000 2.215 1.872 2.548 . 0 0 "[ . 1 . 2 .]" 2
669 1 136 PHE HA 1 138 ALA H 1.800 . 5.000 4.516 4.052 4.952 . 0 0 "[ . 1 . 2 .]" 2
670 1 136 PHE HB2 1 138 ALA H 1.800 . 5.000 3.465 2.872 4.098 . 0 0 "[ . 1 . 2 .]" 2
671 1 136 PHE QD 1 138 ALA H 1.800 . 5.180 3.113 2.498 3.576 . 0 0 "[ . 1 . 2 .]" 2
672 1 137 VAL HA 1 138 ALA H 1.800 . 4.000 3.569 3.497 3.596 . 0 0 "[ . 1 . 2 .]" 2
673 1 137 VAL HB 1 138 ALA H 1.800 . 5.000 2.449 2.103 2.937 . 0 0 "[ . 1 . 2 .]" 2
674 1 137 VAL MG1 1 138 ALA H 1.800 . 5.200 2.968 2.245 3.658 . 0 0 "[ . 1 . 2 .]" 2
675 1 137 VAL H 1 138 ALA H 1.800 . 4.000 2.534 2.205 2.820 . 0 0 "[ . 1 . 2 .]" 2
676 1 138 ALA H 1 138 ALA MB 1.800 . 4.060 2.377 1.904 2.884 . 0 0 "[ . 1 . 2 .]" 2
677 1 139 PRO HA 1 140 GLY H 1.800 . 4.000 3.519 2.833 3.596 . 0 0 "[ . 1 . 2 .]" 2
678 1 139 PRO QB 1 140 GLY H 1.800 . 5.180 3.075 2.681 4.020 . 0 0 "[ . 1 . 2 .]" 2
679 1 139 PRO QD 1 140 GLY H 1.800 . 4.060 2.579 2.399 3.603 . 0 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 72
_Distance_constraint_stats_list.Viol_count 251
_Distance_constraint_stats_list.Viol_total 269.036
_Distance_constraint_stats_list.Viol_max 0.159
_Distance_constraint_stats_list.Viol_rms 0.0212
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0060
_Distance_constraint_stats_list.Viol_average_violations_only 0.0429
_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 ASN 0.724 0.093 24 0 "[ . 1 . 2 .]"
1 15 GLU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 17 VAL 0.015 0.015 11 0 "[ . 1 . 2 .]"
1 25 ILE 5.226 0.159 6 0 "[ . 1 . 2 .]"
1 27 PHE 0.403 0.044 8 0 "[ . 1 . 2 .]"
1 30 LYS 0.403 0.044 8 0 "[ . 1 . 2 .]"
1 32 ILE 5.226 0.159 6 0 "[ . 1 . 2 .]"
1 34 LEU 0.203 0.024 22 0 "[ . 1 . 2 .]"
1 38 LYS 0.203 0.024 22 0 "[ . 1 . 2 .]"
1 42 HIS 0.634 0.060 22 0 "[ . 1 . 2 .]"
1 43 LEU 0.213 0.048 17 0 "[ . 1 . 2 .]"
1 44 ILE 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 45 PHE 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 46 CYS 0.830 0.084 8 0 "[ . 1 . 2 .]"
1 50 LYS 0.156 0.033 9 0 "[ . 1 . 2 .]"
1 51 LYS 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 52 CYS 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 53 ASP 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 54 GLU 0.156 0.033 9 0 "[ . 1 . 2 .]"
1 55 LEU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 56 ALA 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 57 ALA 0.341 0.040 25 0 "[ . 1 . 2 .]"
1 58 LYS 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 59 LEU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 60 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 61 ALA 0.341 0.040 25 0 "[ . 1 . 2 .]"
1 65 ASN 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 67 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 69 TYR 1.228 0.089 14 0 "[ . 1 . 2 .]"
1 84 VAL 0.634 0.060 22 0 "[ . 1 . 2 .]"
1 85 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 86 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 87 VAL 0.322 0.051 18 0 "[ . 1 . 2 .]"
1 88 ALA 0.830 0.084 8 0 "[ . 1 . 2 .]"
1 89 THR 0.906 0.089 14 0 "[ . 1 . 2 .]"
1 101 ASP 0.045 0.023 10 0 "[ . 1 . 2 .]"
1 102 SER 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 103 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 104 ILE 0.213 0.048 17 0 "[ . 1 . 2 .]"
1 105 ASP 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 116 ALA 0.735 0.087 25 0 "[ . 1 . 2 .]"
1 117 VAL 0.008 0.005 20 0 "[ . 1 . 2 .]"
1 120 THR 0.735 0.087 25 0 "[ . 1 . 2 .]"
1 121 GLN 0.008 0.005 20 0 "[ . 1 . 2 .]"
1 132 GLY 0.724 0.093 24 0 "[ . 1 . 2 .]"
1 133 ILE 0.045 0.023 10 0 "[ . 1 . 2 .]"
1 134 TYR 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 135 ARG 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 136 PHE 0.015 0.015 11 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 34 LEU O 1 38 LYS N 3.300 2.500 3.500 2.493 2.476 2.509 0.024 22 0 "[ . 1 . 2 .]" 3
2 1 34 LEU O 1 38 LYS H 2.300 . 2.500 1.580 1.543 1.618 . 0 0 "[ . 1 . 2 .]" 3
3 1 50 LYS O 1 54 GLU N 3.300 2.500 3.500 3.438 3.313 3.495 . 0 0 "[ . 1 . 2 .]" 3
4 1 50 LYS O 1 54 GLU H 2.300 . 2.500 2.473 2.365 2.533 0.033 9 0 "[ . 1 . 2 .]" 3
5 1 51 LYS O 1 55 LEU N 3.300 2.500 3.500 2.685 2.587 2.834 . 0 0 "[ . 1 . 2 .]" 3
6 1 51 LYS O 1 55 LEU H 2.300 . 2.500 1.748 1.669 1.876 . 0 0 "[ . 1 . 2 .]" 3
7 1 52 CYS O 1 56 ALA N 3.300 2.500 3.500 3.083 2.876 3.268 . 0 0 "[ . 1 . 2 .]" 3
8 1 52 CYS O 1 56 ALA H 2.300 . 2.500 2.165 1.964 2.327 . 0 0 "[ . 1 . 2 .]" 3
9 1 53 ASP O 1 57 ALA N 3.300 2.500 3.500 3.198 2.975 3.400 . 0 0 "[ . 1 . 2 .]" 3
10 1 53 ASP O 1 57 ALA H 2.300 . 2.500 2.243 2.037 2.430 . 0 0 "[ . 1 . 2 .]" 3
11 1 54 GLU O 1 58 LYS N 3.300 2.500 3.500 2.691 2.572 2.911 . 0 0 "[ . 1 . 2 .]" 3
12 1 54 GLU O 1 58 LYS H 2.300 . 2.500 1.784 1.660 2.036 . 0 0 "[ . 1 . 2 .]" 3
13 1 55 LEU O 1 59 LEU N 3.300 2.500 3.500 3.251 3.079 3.401 . 0 0 "[ . 1 . 2 .]" 3
14 1 55 LEU O 1 59 LEU H 2.300 . 2.500 2.341 2.156 2.477 . 0 0 "[ . 1 . 2 .]" 3
15 1 56 ALA O 1 60 VAL N 3.300 2.500 3.500 3.281 3.164 3.390 . 0 0 "[ . 1 . 2 .]" 3
16 1 56 ALA O 1 60 VAL H 2.300 . 2.500 2.357 2.225 2.474 . 0 0 "[ . 1 . 2 .]" 3
17 1 57 ALA O 1 61 ALA N 3.300 2.500 3.500 3.345 3.262 3.382 . 0 0 "[ . 1 . 2 .]" 3
18 1 57 ALA O 1 61 ALA H 2.300 . 2.500 2.501 2.374 2.540 0.040 25 0 "[ . 1 . 2 .]" 3
19 1 116 ALA O 1 120 THR N 3.300 2.500 3.500 3.448 3.379 3.506 0.006 22 0 "[ . 1 . 2 .]" 3
20 1 116 ALA O 1 120 THR H 2.300 . 2.500 2.525 2.447 2.587 0.087 25 0 "[ . 1 . 2 .]" 3
21 1 117 VAL O 1 121 GLN N 3.300 2.500 3.500 2.523 2.495 2.591 0.005 20 0 "[ . 1 . 2 .]" 3
22 1 117 VAL O 1 121 GLN H 2.300 . 2.500 1.544 1.517 1.612 . 0 0 "[ . 1 . 2 .]" 3
23 1 25 ILE N 1 32 ILE O 3.300 2.500 3.500 3.561 3.530 3.582 0.082 22 0 "[ . 1 . 2 .]" 3
24 1 25 ILE H 1 32 ILE O 2.300 . 2.500 2.648 2.628 2.659 0.159 6 0 "[ . 1 . 2 .]" 3
25 1 25 ILE O 1 32 ILE N 3.300 2.500 3.500 2.818 2.658 2.949 . 0 0 "[ . 1 . 2 .]" 3
26 1 25 ILE O 1 32 ILE H 2.300 . 2.500 2.017 1.846 2.150 . 0 0 "[ . 1 . 2 .]" 3
27 1 27 PHE N 1 30 LYS O 3.300 2.500 3.500 2.507 2.485 2.549 0.015 5 0 "[ . 1 . 2 .]" 3
28 1 27 PHE H 1 30 LYS O 2.300 . 2.500 1.678 1.600 1.804 . 0 0 "[ . 1 . 2 .]" 3
29 1 27 PHE O 1 30 LYS N 3.300 2.500 3.500 3.255 2.931 3.414 . 0 0 "[ . 1 . 2 .]" 3
30 1 27 PHE O 1 30 LYS H 2.300 . 2.500 2.483 2.187 2.544 0.044 8 0 "[ . 1 . 2 .]" 3
31 1 15 GLU O 1 134 TYR N 3.300 2.500 3.500 2.658 2.534 2.802 . 0 0 "[ . 1 . 2 .]" 3
32 1 15 GLU O 1 134 TYR H 2.300 . 2.500 1.713 1.591 1.843 . 0 0 "[ . 1 . 2 .]" 3
33 1 13 ASN O 1 132 GLY N 3.300 2.500 3.500 3.102 2.890 3.238 . 0 0 "[ . 1 . 2 .]" 3
34 1 13 ASN O 1 132 GLY H 2.300 . 2.500 2.492 2.209 2.593 0.093 24 0 "[ . 1 . 2 .]" 3
35 1 17 VAL N 1 134 TYR O 3.300 2.500 3.500 2.675 2.557 2.802 . 0 0 "[ . 1 . 2 .]" 3
36 1 17 VAL H 1 134 TYR O 2.300 . 2.500 1.731 1.589 1.910 . 0 0 "[ . 1 . 2 .]" 3
37 1 17 VAL O 1 136 PHE N 3.300 2.500 3.500 3.222 2.903 3.456 . 0 0 "[ . 1 . 2 .]" 3
38 1 17 VAL O 1 136 PHE H 2.300 . 2.500 2.297 1.988 2.515 0.015 11 0 "[ . 1 . 2 .]" 3
39 1 105 ASP N 1 135 ARG O 3.300 2.500 3.500 2.772 2.556 3.211 . 0 0 "[ . 1 . 2 .]" 3
40 1 105 ASP H 1 135 ARG O 2.300 . 2.500 1.815 1.599 2.247 . 0 0 "[ . 1 . 2 .]" 3
41 1 103 VAL O 1 135 ARG N 3.300 2.500 3.500 2.907 2.687 3.170 . 0 0 "[ . 1 . 2 .]" 3
42 1 103 VAL O 1 135 ARG H 2.300 . 2.500 2.040 1.752 2.353 . 0 0 "[ . 1 . 2 .]" 3
43 1 103 VAL N 1 133 ILE O 3.300 2.500 3.500 2.841 2.592 3.242 . 0 0 "[ . 1 . 2 .]" 3
44 1 103 VAL H 1 133 ILE O 2.300 . 2.500 1.973 1.692 2.414 . 0 0 "[ . 1 . 2 .]" 3
45 1 101 ASP O 1 133 ILE N 3.300 2.500 3.500 3.145 2.861 3.346 . 0 0 "[ . 1 . 2 .]" 3
46 1 101 ASP O 1 133 ILE H 2.300 . 2.500 2.328 1.930 2.523 0.023 10 0 "[ . 1 . 2 .]" 3
47 1 43 LEU N 1 102 SER O 3.300 2.500 3.500 3.228 3.104 3.339 . 0 0 "[ . 1 . 2 .]" 3
48 1 43 LEU H 1 102 SER O 2.300 . 2.500 2.288 2.147 2.403 . 0 0 "[ . 1 . 2 .]" 3
49 1 43 LEU O 1 104 ILE N 3.300 2.500 3.500 3.179 2.936 3.339 . 0 0 "[ . 1 . 2 .]" 3
50 1 43 LEU O 1 104 ILE H 2.300 . 2.500 2.409 2.049 2.548 0.048 17 0 "[ . 1 . 2 .]" 3
51 1 45 PHE N 1 104 ILE O 3.300 2.500 3.500 2.797 2.543 3.082 . 0 0 "[ . 1 . 2 .]" 3
52 1 45 PHE H 1 104 ILE O 2.300 . 2.500 1.877 1.619 2.168 . 0 0 "[ . 1 . 2 .]" 3
53 1 46 CYS N 1 88 ALA O 3.300 2.500 3.500 3.431 3.375 3.472 . 0 0 "[ . 1 . 2 .]" 3
54 1 46 CYS H 1 88 ALA O 2.300 . 2.500 2.532 2.481 2.584 0.084 8 0 "[ . 1 . 2 .]" 3
55 1 44 ILE O 1 88 ALA N 3.300 2.500 3.500 2.760 2.676 2.896 . 0 0 "[ . 1 . 2 .]" 3
56 1 44 ILE O 1 88 ALA H 2.300 . 2.500 2.115 2.005 2.273 . 0 0 "[ . 1 . 2 .]" 3
57 1 44 ILE N 1 86 VAL O 3.300 2.500 3.500 2.547 2.503 2.670 . 0 0 "[ . 1 . 2 .]" 3
58 1 44 ILE H 1 86 VAL O 2.300 . 2.500 1.645 1.565 1.786 . 0 0 "[ . 1 . 2 .]" 3
59 1 42 HIS O 1 86 VAL N 3.300 2.500 3.500 2.616 2.572 2.675 . 0 0 "[ . 1 . 2 .]" 3
60 1 42 HIS O 1 86 VAL H 2.300 . 2.500 1.816 1.711 1.921 . 0 0 "[ . 1 . 2 .]" 3
61 1 42 HIS N 1 84 VAL O 3.300 2.500 3.500 3.368 3.310 3.403 . 0 0 "[ . 1 . 2 .]" 3
62 1 42 HIS H 1 84 VAL O 2.300 . 2.500 2.525 2.483 2.560 0.060 22 0 "[ . 1 . 2 .]" 3
63 1 65 ASN O 1 85 VAL N 3.300 2.500 3.500 2.576 2.528 2.718 . 0 0 "[ . 1 . 2 .]" 3
64 1 65 ASN O 1 85 VAL H 2.300 . 2.500 1.637 1.579 1.783 . 0 0 "[ . 1 . 2 .]" 3
65 1 67 VAL N 1 85 VAL O 3.300 2.500 3.500 3.016 2.896 3.120 . 0 0 "[ . 1 . 2 .]" 3
66 1 67 VAL H 1 85 VAL O 2.300 . 2.500 2.107 1.986 2.222 . 0 0 "[ . 1 . 2 .]" 3
67 1 67 VAL O 1 87 VAL N 3.300 2.500 3.500 2.717 2.576 2.841 . 0 0 "[ . 1 . 2 .]" 3
68 1 67 VAL O 1 87 VAL H 2.300 . 2.500 1.771 1.638 1.890 . 0 0 "[ . 1 . 2 .]" 3
69 1 69 TYR N 1 87 VAL O 3.300 2.500 3.500 3.310 3.108 3.401 . 0 0 "[ . 1 . 2 .]" 3
70 1 69 TYR H 1 87 VAL O 2.300 . 2.500 2.474 2.241 2.551 0.051 18 0 "[ . 1 . 2 .]" 3
71 1 69 TYR O 1 89 THR N 3.300 2.500 3.500 3.383 3.323 3.454 . 0 0 "[ . 1 . 2 .]" 3
72 1 69 TYR O 1 89 THR H 2.300 . 2.500 2.532 2.434 2.589 0.089 14 0 "[ . 1 . 2 .]" 3
stop_
save_
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