NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
606665 |
5krw   |
30134 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5krw
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 836
_Distance_constraint_stats_list.Viol_count 345
_Distance_constraint_stats_list.Viol_total 385.850
_Distance_constraint_stats_list.Viol_max 0.339
_Distance_constraint_stats_list.Viol_rms 0.0101
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0012
_Distance_constraint_stats_list.Viol_average_violations_only 0.0559
_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 1 MET 0.146 0.111 17 0 "[ . 1 . 2]"
1 4 THR 0.297 0.064 1 0 "[ . 1 . 2]"
1 5 VAL 0.506 0.113 17 0 "[ . 1 . 2]"
1 6 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 PHE 3.252 0.158 5 0 "[ . 1 . 2]"
1 8 ILE 0.324 0.113 17 0 "[ . 1 . 2]"
1 9 ASN 1.707 0.131 11 0 "[ . 1 . 2]"
1 10 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 TRP 1.262 0.166 20 0 "[ . 1 . 2]"
1 12 GLN 1.409 0.155 19 0 "[ . 1 . 2]"
1 13 ARG 0.133 0.077 10 0 "[ . 1 . 2]"
1 14 ILE 0.101 0.050 18 0 "[ . 1 . 2]"
1 15 ALA 0.373 0.087 3 0 "[ . 1 . 2]"
1 16 LEU 0.313 0.077 10 0 "[ . 1 . 2]"
1 18 SER 0.118 0.111 12 0 "[ . 1 . 2]"
1 19 GLN 0.992 0.107 13 0 "[ . 1 . 2]"
1 20 SER 0.210 0.041 16 0 "[ . 1 . 2]"
1 21 LEU 1.257 0.107 13 0 "[ . 1 . 2]"
1 22 LEU 1.297 0.150 12 0 "[ . 1 . 2]"
1 23 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 LEU 0.649 0.091 17 0 "[ . 1 . 2]"
1 25 ALA 0.493 0.069 6 0 "[ . 1 . 2]"
1 26 GLN 0.103 0.046 20 0 "[ . 1 . 2]"
1 27 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 GLY 0.007 0.007 13 0 "[ . 1 . 2]"
1 29 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 TRP 0.288 0.067 16 0 "[ . 1 . 2]"
1 31 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 33 LEU 1.142 0.091 17 0 "[ . 1 . 2]"
1 34 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 35 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 VAL 0.179 0.086 11 0 "[ . 1 . 2]"
1 39 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 TYR 0.320 0.111 12 0 "[ . 1 . 2]"
1 41 LEU 0.029 0.029 20 0 "[ . 1 . 2]"
1 42 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 ILE 0.232 0.185 2 0 "[ . 1 . 2]"
1 45 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 THR 0.074 0.025 16 0 "[ . 1 . 2]"
1 47 VAL 0.422 0.339 2 0 "[ . 1 . 2]"
1 48 MET 0.830 0.339 2 0 "[ . 1 . 2]"
1 49 GLU 0.281 0.097 13 0 "[ . 1 . 2]"
1 50 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 51 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 THR 1.150 0.231 8 0 "[ . 1 . 2]"
1 53 PRO 0.053 0.035 19 0 "[ . 1 . 2]"
1 54 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 ILE 1.290 0.231 8 0 "[ . 1 . 2]"
1 57 THR 0.039 0.039 19 0 "[ . 1 . 2]"
1 58 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 ILE 0.632 0.130 16 0 "[ . 1 . 2]"
1 61 GLN 0.097 0.040 18 0 "[ . 1 . 2]"
1 62 ASP 0.082 0.048 4 0 "[ . 1 . 2]"
1 63 MET 4.497 0.155 19 0 "[ . 1 . 2]"
1 64 VAL 4.852 0.235 18 0 "[ . 1 . 2]"
1 65 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 TYR 2.581 0.235 18 0 "[ . 1 . 2]"
1 68 ILE 0.187 0.089 12 0 "[ . 1 . 2]"
1 69 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 GLN 0.494 0.087 3 0 "[ . 1 . 2]"
1 71 THR 0.122 0.054 3 0 "[ . 1 . 2]"
1 72 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 ASN 0.214 0.123 13 0 "[ . 1 . 2]"
1 75 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 GLN 0.259 0.073 1 0 "[ . 1 . 2]"
1 77 LEU 0.339 0.080 20 0 "[ . 1 . 2]"
1 78 LEU 1.091 0.150 12 0 "[ . 1 . 2]"
1 79 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 81 LEU 0.020 0.012 13 0 "[ . 1 . 2]"
1 82 LEU 0.041 0.037 11 0 "[ . 1 . 2]"
1 83 GLN 0.053 0.031 3 0 "[ . 1 . 2]"
1 84 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 85 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 86 LEU 0.136 0.042 13 0 "[ . 1 . 2]"
1 87 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 88 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 LEU 0.317 0.067 16 0 "[ . 1 . 2]"
1 90 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 91 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 95 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 VAL 0.158 0.070 16 0 "[ . 1 . 2]"
1 97 LEU 0.510 0.129 11 0 "[ . 1 . 2]"
1 98 PHE 0.352 0.129 11 0 "[ . 1 . 2]"
1 105 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 106 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 113 ILE 0.097 0.036 3 0 "[ . 1 . 2]"
1 114 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 115 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 7 PHE HE1 1 11 TRP HE1 2.520 . 3.240 2.395 2.174 3.308 0.068 19 0 "[ . 1 . 2]" 1
2 1 67 TYR H 1 67 TYR HE1 3.820 . 5.840 5.149 4.231 5.371 . 0 0 "[ . 1 . 2]" 1
3 1 98 PHE H 1 98 PHE HD1 3.350 . 4.900 4.389 3.726 4.679 . 0 0 "[ . 1 . 2]" 1
4 1 97 LEU H 1 98 PHE H 3.420 . 5.040 4.328 4.228 4.390 . 0 0 "[ . 1 . 2]" 1
5 1 41 LEU MD1 1 42 GLN H 3.480 . 5.160 4.670 4.571 4.795 . 0 0 "[ . 1 . 2]" 1
6 1 44 ILE H 1 47 VAL H 3.690 . 5.580 4.940 4.789 5.018 . 0 0 "[ . 1 . 2]" 1
7 1 47 VAL H 1 47 VAL HB 3.030 . 4.260 3.748 3.730 3.776 . 0 0 "[ . 1 . 2]" 1
8 1 46 THR HB 1 47 VAL H 3.170 . 4.540 4.176 4.039 4.262 . 0 0 "[ . 1 . 2]" 1
9 1 44 ILE HA 1 47 VAL H 3.390 . 4.980 3.796 3.348 3.980 . 0 0 "[ . 1 . 2]" 1
10 1 11 TRP HE1 1 64 VAL MG1 2.980 . 4.160 4.180 4.070 4.275 0.115 6 0 "[ . 1 . 2]" 1
11 1 11 TRP HE1 1 52 THR MG 3.100 . 4.400 3.998 2.876 4.566 0.166 20 0 "[ . 1 . 2]" 1
12 1 15 ALA H 1 15 ALA MB 2.680 . 3.560 2.243 2.208 2.266 . 0 0 "[ . 1 . 2]" 1
13 1 14 ILE MG 1 15 ALA H 3.440 . 5.080 3.343 3.233 3.521 . 0 0 "[ . 1 . 2]" 1
14 1 22 LEU MD1 1 78 LEU H 2.750 . 3.700 3.137 2.969 3.364 . 0 0 "[ . 1 . 2]" 1
15 1 21 LEU MD1 1 78 LEU H 4.170 . 6.540 5.524 5.338 5.699 . 0 0 "[ . 1 . 2]" 1
16 1 89 LEU H 1 89 LEU MD1 3.040 . 4.280 3.724 3.580 3.814 . 0 0 "[ . 1 . 2]" 1
17 1 37 GLU HB3 1 38 VAL H 2.790 . 3.780 2.278 2.156 2.460 . 0 0 "[ . 1 . 2]" 1
18 1 38 VAL H 1 38 VAL HB 3.090 . 4.370 3.638 3.616 3.671 . 0 0 "[ . 1 . 2]" 1
19 1 36 GLN HB2 1 38 VAL H 4.140 . 6.480 5.675 5.521 5.832 . 0 0 "[ . 1 . 2]" 1
20 1 84 GLN H 1 84 GLN HB2 2.540 . 3.280 2.554 2.419 2.628 . 0 0 "[ . 1 . 2]" 1
21 1 81 LEU MD2 1 84 GLN H 3.660 . 5.520 4.937 4.764 5.047 . 0 0 "[ . 1 . 2]" 1
22 1 4 THR MG 1 5 VAL H 3.070 . 4.340 3.714 3.600 3.905 . 0 0 "[ . 1 . 2]" 1
23 1 5 VAL H 1 8 ILE MD 3.090 . 4.380 4.348 4.176 4.493 0.113 17 0 "[ . 1 . 2]" 1
24 1 6 GLU H 1 7 PHE HA 4.010 . 6.220 5.250 5.211 5.301 . 0 0 "[ . 1 . 2]" 1
25 1 6 GLU H 1 6 GLU HB3 2.640 . 3.480 2.613 2.553 2.693 . 0 0 "[ . 1 . 2]" 1
26 1 4 THR MG 1 6 GLU H 3.990 . 6.180 5.342 5.245 5.537 . 0 0 "[ . 1 . 2]" 1
27 1 5 VAL MG2 1 6 GLU H 3.170 . 4.540 3.829 3.704 3.937 . 0 0 "[ . 1 . 2]" 1
28 1 6 GLU HB2 1 7 PHE H 3.110 . 4.420 3.829 3.738 3.897 . 0 0 "[ . 1 . 2]" 1
29 1 4 THR MG 1 7 PHE H 3.400 . 5.000 4.953 4.749 5.064 0.064 1 0 "[ . 1 . 2]" 1
30 1 8 ILE H 1 10 ARG H 3.440 . 5.080 4.401 4.260 4.516 . 0 0 "[ . 1 . 2]" 1
31 1 8 ILE HB 1 9 ASN H 2.870 . 3.940 2.266 2.176 2.366 . 0 0 "[ . 1 . 2]" 1
32 1 8 ILE MG 1 9 ASN H 2.840 . 3.880 3.104 2.988 3.275 . 0 0 "[ . 1 . 2]" 1
33 1 11 TRP H 1 11 TRP HE3 3.710 . 5.620 5.019 4.788 5.134 . 0 0 "[ . 1 . 2]" 1
34 1 11 TRP H 1 11 TRP HD1 3.250 . 4.700 3.443 3.257 3.644 . 0 0 "[ . 1 . 2]" 1
35 1 8 ILE HA 1 11 TRP H 3.570 . 5.340 4.111 3.809 4.301 . 0 0 "[ . 1 . 2]" 1
36 1 10 ARG HA 1 12 GLN H 3.600 . 5.400 4.318 4.126 4.472 . 0 0 "[ . 1 . 2]" 1
37 1 24 LEU MD1 1 34 LEU H 3.730 . 5.660 5.236 5.008 5.556 . 0 0 "[ . 1 . 2]" 1
38 1 10 ARG HA 1 14 ILE H 3.610 . 5.420 4.084 3.939 4.207 . 0 0 "[ . 1 . 2]" 1
39 1 14 ILE H 1 14 ILE MG 3.110 . 4.420 3.792 3.763 3.820 . 0 0 "[ . 1 . 2]" 1
40 1 14 ILE H 1 47 VAL MG1 3.900 . 6.000 5.355 4.786 5.790 . 0 0 "[ . 1 . 2]" 1
41 1 14 ILE H 1 14 ILE MD 3.150 . 4.500 3.557 3.496 3.643 . 0 0 "[ . 1 . 2]" 1
42 1 15 ALA H 1 18 SER H 3.800 . 5.800 4.763 4.595 4.903 . 0 0 "[ . 1 . 2]" 1
43 1 18 SER H 1 40 TYR HD1 3.350 . 4.900 3.516 3.360 3.788 . 0 0 "[ . 1 . 2]" 1
44 1 19 GLN H 1 21 LEU MD1 3.690 . 5.580 5.044 4.912 5.225 . 0 0 "[ . 1 . 2]" 1
45 1 20 SER H 1 20 SER QB 2.740 . 3.680 2.487 2.417 2.581 . 0 0 "[ . 1 . 2]" 1
46 1 20 SER QB 1 21 LEU H 2.850 . 3.900 2.469 2.264 3.383 . 0 0 "[ . 1 . 2]" 1
47 1 19 GLN HA 1 22 LEU H 3.200 . 4.600 3.850 3.713 4.037 . 0 0 "[ . 1 . 2]" 1
48 1 23 GLU H 1 26 GLN H 3.750 . 5.700 4.891 4.709 5.023 . 0 0 "[ . 1 . 2]" 1
49 1 74 ASN H 1 76 GLN H 3.390 . 4.980 4.036 3.959 4.184 . 0 0 "[ . 1 . 2]" 1
50 1 76 GLN H 1 77 LEU H 2.850 . 3.900 2.558 2.463 2.636 . 0 0 "[ . 1 . 2]" 1
51 1 76 GLN H 1 76 GLN HB2 2.820 . 3.840 2.607 2.551 2.663 . 0 0 "[ . 1 . 2]" 1
52 1 76 GLN H 1 76 GLN HB3 2.820 . 3.840 2.471 2.378 2.581 . 0 0 "[ . 1 . 2]" 1
53 1 23 GLU H 1 23 GLU HB2 2.650 . 3.500 2.514 2.426 2.639 . 0 0 "[ . 1 . 2]" 1
54 1 22 LEU MD2 1 23 GLU H 3.190 . 4.580 4.033 3.772 4.207 . 0 0 "[ . 1 . 2]" 1
55 1 26 GLN H 1 29 GLU H 4.120 . 6.440 5.514 5.238 5.790 . 0 0 "[ . 1 . 2]" 1
56 1 26 GLN H 1 27 ARG HA 4.000 . 6.200 5.211 5.138 5.293 . 0 0 "[ . 1 . 2]" 1
57 1 23 GLU HA 1 26 GLN H 3.030 . 4.260 3.652 3.299 3.901 . 0 0 "[ . 1 . 2]" 1
58 1 25 ALA HA 1 27 ARG H 3.560 . 5.320 4.319 4.142 4.562 . 0 0 "[ . 1 . 2]" 1
59 1 25 ALA MB 1 27 ARG H 3.410 . 5.020 4.392 4.235 4.607 . 0 0 "[ . 1 . 2]" 1
60 1 27 ARG H 1 81 LEU MD1 3.520 . 5.240 4.860 4.674 5.113 . 0 0 "[ . 1 . 2]" 1
61 1 28 GLY H 1 30 TRP H 3.990 . 6.180 5.565 5.189 5.845 . 0 0 "[ . 1 . 2]" 1
62 1 28 GLY H 1 29 GLU HA 3.910 . 6.020 5.089 4.986 5.210 . 0 0 "[ . 1 . 2]" 1
63 1 25 ALA HA 1 28 GLY H 3.260 . 4.720 3.465 3.247 3.662 . 0 0 "[ . 1 . 2]" 1
64 1 27 ARG HB2 1 28 GLY H 3.610 . 5.420 3.304 2.969 3.864 . 0 0 "[ . 1 . 2]" 1
65 1 27 ARG HB3 1 28 GLY H 3.610 . 5.420 3.744 3.366 3.956 . 0 0 "[ . 1 . 2]" 1
66 1 25 ALA MB 1 28 GLY H 3.490 . 5.180 4.485 4.333 4.560 . 0 0 "[ . 1 . 2]" 1
67 1 28 GLY H 1 81 LEU MD2 3.690 . 5.580 5.019 4.589 5.439 . 0 0 "[ . 1 . 2]" 1
68 1 28 GLY H 1 81 LEU MD1 3.640 . 5.480 5.106 4.595 5.487 0.007 13 0 "[ . 1 . 2]" 1
69 1 63 MET H 1 64 VAL HA 4.020 . 6.240 5.404 5.353 5.474 . 0 0 "[ . 1 . 2]" 1
70 1 25 ALA HA 1 29 GLU H 3.270 . 4.740 4.223 3.852 4.543 . 0 0 "[ . 1 . 2]" 1
71 1 63 MET H 1 63 MET HG3 2.750 . 3.700 2.342 2.197 2.441 . 0 0 "[ . 1 . 2]" 1
72 1 62 ASP HB3 1 63 MET H 2.600 . 3.400 2.580 2.415 2.779 . 0 0 "[ . 1 . 2]" 1
73 1 63 MET H 1 64 VAL MG2 3.220 . 4.640 4.132 4.046 4.280 . 0 0 "[ . 1 . 2]" 1
74 1 63 MET H 1 64 VAL MG1 3.560 . 5.320 4.401 4.306 4.578 . 0 0 "[ . 1 . 2]" 1
75 1 30 TRP H 1 32 LEU H 3.580 . 5.360 4.242 4.066 4.450 . 0 0 "[ . 1 . 2]" 1
76 1 29 GLU H 1 30 TRP H 3.210 . 4.620 4.022 3.846 4.173 . 0 0 "[ . 1 . 2]" 1
77 1 29 GLU HA 1 30 TRP H 2.660 . 3.520 2.278 2.184 2.361 . 0 0 "[ . 1 . 2]" 1
78 1 30 TRP HD1 1 31 ASP H 3.720 . 5.640 4.778 4.623 4.941 . 0 0 "[ . 1 . 2]" 1
79 1 29 GLU HA 1 31 ASP H 3.420 . 5.040 3.555 3.293 3.793 . 0 0 "[ . 1 . 2]" 1
80 1 29 GLU HA 1 32 LEU H 3.430 . 5.060 4.075 3.883 4.258 . 0 0 "[ . 1 . 2]" 1
81 1 30 TRP HE3 1 33 LEU H 3.830 . 5.860 4.947 4.832 5.348 . 0 0 "[ . 1 . 2]" 1
82 1 29 GLU HA 1 33 LEU H 3.870 . 5.940 4.993 4.788 5.260 . 0 0 "[ . 1 . 2]" 1
83 1 31 ASP HB2 1 33 LEU H 3.670 . 5.540 4.885 4.702 4.988 . 0 0 "[ . 1 . 2]" 1
84 1 33 LEU H 1 33 LEU MD2 3.360 . 4.920 4.300 4.224 4.373 . 0 0 "[ . 1 . 2]" 1
85 1 32 LEU MD1 1 33 LEU H 3.670 . 5.540 4.711 4.617 4.813 . 0 0 "[ . 1 . 2]" 1
86 1 32 LEU MD2 1 33 LEU H 3.900 . 6.000 4.698 4.638 4.822 . 0 0 "[ . 1 . 2]" 1
87 1 31 ASP H 1 34 LEU H 3.800 . 5.800 4.780 4.623 4.900 . 0 0 "[ . 1 . 2]" 1
88 1 32 LEU HA 1 35 GLN H 3.250 . 4.700 3.305 2.947 3.487 . 0 0 "[ . 1 . 2]" 1
89 1 35 GLN H 1 36 GLN HB2 3.730 . 5.660 4.899 4.651 5.131 . 0 0 "[ . 1 . 2]" 1
90 1 34 LEU MD1 1 35 GLN H 3.480 . 5.160 4.759 4.595 4.924 . 0 0 "[ . 1 . 2]" 1
91 1 24 LEU MD1 1 35 GLN H 3.750 . 5.700 5.103 4.871 5.410 . 0 0 "[ . 1 . 2]" 1
92 1 33 LEU H 1 36 GLN H 3.740 . 5.680 4.886 4.728 4.998 . 0 0 "[ . 1 . 2]" 1
93 1 32 LEU HA 1 36 GLN H 3.470 . 5.140 4.271 3.930 4.517 . 0 0 "[ . 1 . 2]" 1
94 1 36 GLN H 1 37 GLU HA 3.780 . 5.750 4.967 4.882 5.016 . 0 0 "[ . 1 . 2]" 1
95 1 36 GLN H 1 36 GLN HB2 2.870 . 3.940 2.525 2.390 2.674 . 0 0 "[ . 1 . 2]" 1
96 1 24 LEU MD1 1 36 GLN H 3.330 . 4.860 4.270 4.061 4.498 . 0 0 "[ . 1 . 2]" 1
97 1 36 GLN HB2 1 37 GLU H 3.090 . 4.370 3.131 2.939 3.401 . 0 0 "[ . 1 . 2]" 1
98 1 36 GLN H 1 39 SER H 4.180 . 6.560 5.458 5.243 5.730 . 0 0 "[ . 1 . 2]" 1
99 1 38 VAL HB 1 39 SER H 2.970 . 4.140 3.666 3.541 3.803 . 0 0 "[ . 1 . 2]" 1
100 1 38 VAL H 1 40 TYR H 3.210 . 4.620 4.204 4.040 4.500 . 0 0 "[ . 1 . 2]" 1
101 1 96 VAL HB 1 97 LEU H 2.920 . 4.040 3.937 3.703 4.110 0.070 16 0 "[ . 1 . 2]" 1
102 1 96 VAL MG2 1 97 LEU H 2.750 . 3.700 2.368 2.082 2.803 . 0 0 "[ . 1 . 2]" 1
103 1 41 LEU H 1 44 ILE H 3.750 . 5.700 4.898 4.826 4.962 . 0 0 "[ . 1 . 2]" 1
104 1 41 LEU H 1 44 ILE HG13 3.740 . 5.680 4.824 4.700 4.924 . 0 0 "[ . 1 . 2]" 1
105 1 38 VAL MG2 1 42 GLN H 3.940 . 6.080 5.443 5.330 5.549 . 0 0 "[ . 1 . 2]" 1
106 1 41 LEU HA 1 43 SER H 3.410 . 5.020 4.416 4.259 4.543 . 0 0 "[ . 1 . 2]" 1
107 1 43 SER H 1 44 ILE HG13 3.360 . 4.920 4.311 4.146 4.476 . 0 0 "[ . 1 . 2]" 1
108 1 44 ILE H 1 46 THR H 3.400 . 5.000 4.126 3.971 4.280 . 0 0 "[ . 1 . 2]" 1
109 1 46 THR H 1 46 THR HB 2.750 . 3.700 2.694 2.542 2.815 . 0 0 "[ . 1 . 2]" 1
110 1 44 ILE HA 1 46 THR H 3.780 . 5.760 4.412 4.254 4.565 . 0 0 "[ . 1 . 2]" 1
111 1 44 ILE HB 1 46 THR H 3.890 . 5.980 5.009 4.807 5.226 . 0 0 "[ . 1 . 2]" 1
112 1 46 THR H 1 46 THR MG 2.840 . 3.880 2.196 2.024 2.460 . 0 0 "[ . 1 . 2]" 1
113 1 44 ILE MG 1 46 THR H 4.010 . 6.210 5.040 4.758 5.212 . 0 0 "[ . 1 . 2]" 1
114 1 46 THR H 1 47 VAL MG1 3.770 . 5.740 4.318 4.264 4.387 . 0 0 "[ . 1 . 2]" 1
115 1 44 ILE MG 1 47 VAL H 3.710 . 5.620 4.974 4.639 5.085 . 0 0 "[ . 1 . 2]" 1
116 1 48 MET H 1 49 GLU HA 3.880 . 5.960 5.154 5.023 5.232 . 0 0 "[ . 1 . 2]" 1
117 1 44 ILE HA 1 48 MET H 3.630 . 5.460 4.403 4.271 4.584 . 0 0 "[ . 1 . 2]" 1
118 1 46 THR MG 1 48 MET H 3.590 . 5.380 4.484 4.339 4.597 . 0 0 "[ . 1 . 2]" 1
119 1 44 ILE MG 1 48 MET H 3.590 . 5.380 4.404 4.254 4.522 . 0 0 "[ . 1 . 2]" 1
120 1 47 VAL MG2 1 48 MET H 2.840 . 3.880 2.391 2.195 2.661 . 0 0 "[ . 1 . 2]" 1
121 1 47 VAL H 1 49 GLU H 3.500 . 5.200 3.919 3.769 4.139 . 0 0 "[ . 1 . 2]" 1
122 1 48 MET HB3 1 49 GLU H 2.960 . 4.120 4.003 3.795 4.217 0.097 13 0 "[ . 1 . 2]" 1
123 1 46 THR MG 1 49 GLU H 4.090 . 6.380 4.928 4.765 5.188 . 0 0 "[ . 1 . 2]" 1
124 1 47 VAL MG2 1 49 GLU H 3.610 . 5.420 4.414 4.262 4.599 . 0 0 "[ . 1 . 2]" 1
125 1 47 VAL MG2 1 50 LYS H 3.880 . 5.960 5.109 4.901 5.347 . 0 0 "[ . 1 . 2]" 1
126 1 56 ILE H 1 57 THR H 3.440 . 5.080 4.230 4.109 4.456 . 0 0 "[ . 1 . 2]" 1
127 1 56 ILE HB 1 57 THR H 3.620 . 5.440 4.365 4.236 4.501 . 0 0 "[ . 1 . 2]" 1
128 1 57 THR H 1 60 ILE HG13 3.540 . 5.280 4.030 3.712 4.275 . 0 0 "[ . 1 . 2]" 1
129 1 56 ILE MD 1 57 THR H 3.480 . 5.160 3.960 3.801 4.220 . 0 0 "[ . 1 . 2]" 1
130 1 56 ILE HA 1 60 ILE H 4.000 . 6.200 5.550 5.317 5.863 . 0 0 "[ . 1 . 2]" 1
131 1 60 ILE H 1 61 GLN HB3 3.690 . 5.580 4.561 4.316 4.727 . 0 0 "[ . 1 . 2]" 1
132 1 60 ILE H 1 60 ILE HB 2.950 . 4.100 2.470 2.427 2.530 . 0 0 "[ . 1 . 2]" 1
133 1 60 ILE H 1 60 ILE HG13 3.070 . 4.340 2.228 2.080 2.345 . 0 0 "[ . 1 . 2]" 1
134 1 57 THR MG 1 60 ILE H 2.920 . 4.040 2.036 1.843 2.815 . 0 0 "[ . 1 . 2]" 1
135 1 60 ILE H 1 60 ILE MG 3.190 . 4.580 3.795 3.778 3.816 . 0 0 "[ . 1 . 2]" 1
136 1 62 ASP H 1 62 ASP HB3 2.990 . 4.180 2.488 2.368 2.579 . 0 0 "[ . 1 . 2]" 1
137 1 62 ASP H 1 63 MET ME 3.890 . 5.980 5.382 5.189 6.028 0.048 4 0 "[ . 1 . 2]" 1
138 1 62 ASP H 1 65 ALA MB 3.550 . 5.300 4.561 4.332 4.717 . 0 0 "[ . 1 . 2]" 1
139 1 75 GLU H 1 77 LEU H 3.460 . 5.120 4.047 3.913 4.191 . 0 0 "[ . 1 . 2]" 1
140 1 64 VAL H 1 67 TYR HD1 3.510 . 5.220 3.966 3.688 4.523 . 0 0 "[ . 1 . 2]" 1
141 1 63 MET HG3 1 64 VAL H 3.360 . 4.920 4.207 4.006 4.373 . 0 0 "[ . 1 . 2]" 1
142 1 63 MET HB3 1 64 VAL H 2.960 . 4.120 3.380 3.144 3.535 . 0 0 "[ . 1 . 2]" 1
143 1 63 MET HB2 1 64 VAL H 2.950 . 4.100 2.319 2.089 2.456 . 0 0 "[ . 1 . 2]" 1
144 1 64 VAL H 1 64 VAL HB 3.070 . 4.340 3.677 3.643 3.700 . 0 0 "[ . 1 . 2]" 1
145 1 64 VAL H 1 65 ALA MB 3.400 . 5.000 4.371 4.289 4.510 . 0 0 "[ . 1 . 2]" 1
146 1 64 VAL H 1 64 VAL MG2 2.760 . 3.720 2.201 2.106 2.276 . 0 0 "[ . 1 . 2]" 1
147 1 66 GLY H 1 68 ILE H 3.370 . 4.940 4.207 4.005 4.545 . 0 0 "[ . 1 . 2]" 1
148 1 64 VAL HA 1 66 GLY H 3.530 . 5.260 4.169 4.029 4.343 . 0 0 "[ . 1 . 2]" 1
149 1 65 ALA MB 1 66 GLY H 2.810 . 3.820 2.589 2.422 2.713 . 0 0 "[ . 1 . 2]" 1
150 1 64 VAL MG2 1 66 GLY H 3.440 . 5.080 4.546 4.391 4.749 . 0 0 "[ . 1 . 2]" 1
151 1 66 GLY H 1 68 ILE MD 4.130 . 6.460 5.557 5.176 5.849 . 0 0 "[ . 1 . 2]" 1
152 1 66 GLY HA3 1 67 TYR H 2.860 . 3.920 2.799 2.739 2.875 . 0 0 "[ . 1 . 2]" 1
153 1 64 VAL HA 1 67 TYR H 3.050 . 4.300 2.851 2.442 3.151 . 0 0 "[ . 1 . 2]" 1
154 1 67 TYR H 1 67 TYR HB2 3.020 . 4.240 2.488 2.420 2.566 . 0 0 "[ . 1 . 2]" 1
155 1 67 TYR H 1 67 TYR HB3 3.020 . 4.240 3.627 3.608 3.680 . 0 0 "[ . 1 . 2]" 1
156 1 64 VAL HB 1 67 TYR H 3.950 . 6.100 4.824 4.436 5.031 . 0 0 "[ . 1 . 2]" 1
157 1 65 ALA MB 1 67 TYR H 3.630 . 5.460 4.575 4.500 4.679 . 0 0 "[ . 1 . 2]" 1
158 1 64 VAL MG2 1 67 TYR H 3.860 . 5.920 4.859 4.721 4.937 . 0 0 "[ . 1 . 2]" 1
159 1 64 VAL MG1 1 67 TYR H 3.940 . 6.080 4.777 4.443 5.026 . 0 0 "[ . 1 . 2]" 1
160 1 67 TYR H 1 68 ILE MD 3.950 . 6.100 5.338 5.230 5.415 . 0 0 "[ . 1 . 2]" 1
161 1 67 TYR HD1 1 68 ILE H 3.590 . 5.380 4.929 4.401 5.086 . 0 0 "[ . 1 . 2]" 1
162 1 65 ALA HA 1 68 ILE H 3.230 . 4.660 3.424 3.082 3.827 . 0 0 "[ . 1 . 2]" 1
163 1 64 VAL HA 1 68 ILE H 3.520 . 5.240 3.920 3.630 4.160 . 0 0 "[ . 1 . 2]" 1
164 1 67 TYR HB3 1 68 ILE H 3.460 . 5.120 3.741 3.507 3.915 . 0 0 "[ . 1 . 2]" 1
165 1 64 VAL HB 1 68 ILE H 3.650 . 5.500 4.612 4.139 4.858 . 0 0 "[ . 1 . 2]" 1
166 1 65 ALA MB 1 68 ILE H 3.740 . 5.680 4.646 4.419 4.951 . 0 0 "[ . 1 . 2]" 1
167 1 68 ILE H 1 68 ILE HG12 3.170 . 4.540 3.513 3.348 3.669 . 0 0 "[ . 1 . 2]" 1
168 1 68 ILE H 1 68 ILE MG 3.160 . 4.520 3.861 3.848 3.875 . 0 0 "[ . 1 . 2]" 1
169 1 64 VAL MG1 1 68 ILE H 4.000 . 6.200 5.439 5.084 5.651 . 0 0 "[ . 1 . 2]" 1
170 1 66 GLY HA2 1 69 LYS H 3.090 . 4.370 3.659 3.462 3.892 . 0 0 "[ . 1 . 2]" 1
171 1 68 ILE HG13 1 69 LYS H 3.420 . 5.040 4.220 4.066 4.380 . 0 0 "[ . 1 . 2]" 1
172 1 68 ILE MG 1 69 LYS H 3.230 . 4.660 3.630 3.526 3.734 . 0 0 "[ . 1 . 2]" 1
173 1 69 LYS H 1 72 LEU MD1 3.510 . 5.220 4.253 4.040 4.443 . 0 0 "[ . 1 . 2]" 1
174 1 68 ILE MD 1 69 LYS H 3.550 . 5.300 4.639 4.526 4.769 . 0 0 "[ . 1 . 2]" 1
175 1 70 GLN H 1 71 THR H 2.990 . 4.180 2.727 2.584 2.783 . 0 0 "[ . 1 . 2]" 1
176 1 67 TYR HB3 1 70 GLN H 3.980 . 6.160 5.495 5.275 5.793 . 0 0 "[ . 1 . 2]" 1
177 1 68 ILE HA 1 71 THR H 3.460 . 5.120 3.381 3.253 3.580 . 0 0 "[ . 1 . 2]" 1
178 1 14 ILE MG 1 71 THR H 3.420 . 5.040 4.424 4.132 4.623 . 0 0 "[ . 1 . 2]" 1
179 1 72 LEU H 1 72 LEU MD1 3.020 . 4.240 3.704 3.641 3.880 . 0 0 "[ . 1 . 2]" 1
180 1 73 ASP H 1 75 GLU H 3.430 . 5.060 4.178 4.055 4.317 . 0 0 "[ . 1 . 2]" 1
181 1 73 ASP H 1 76 GLN H 3.690 . 5.580 4.711 4.564 4.853 . 0 0 "[ . 1 . 2]" 1
182 1 71 THR H 1 73 ASP H 3.630 . 5.460 4.253 4.093 4.399 . 0 0 "[ . 1 . 2]" 1
183 1 72 LEU MD1 1 73 ASP H 3.450 . 5.100 4.502 4.402 4.580 . 0 0 "[ . 1 . 2]" 1
184 1 72 LEU MD2 1 73 ASP H 3.640 . 5.480 4.702 4.622 4.747 . 0 0 "[ . 1 . 2]" 1
185 1 74 ASN H 1 75 GLU H 2.920 . 4.040 2.647 2.586 2.730 . 0 0 "[ . 1 . 2]" 1
186 1 73 ASP H 1 74 ASN H 2.850 . 3.900 2.762 2.671 2.913 . 0 0 "[ . 1 . 2]" 1
187 1 72 LEU H 1 74 ASN H 3.440 . 5.080 4.243 4.036 4.468 . 0 0 "[ . 1 . 2]" 1
188 1 71 THR HA 1 74 ASN H 3.160 . 4.520 3.571 3.417 3.778 . 0 0 "[ . 1 . 2]" 1
189 1 71 THR HA 1 75 GLU H 3.220 . 4.640 3.823 3.729 3.923 . 0 0 "[ . 1 . 2]" 1
190 1 75 GLU H 1 75 GLU HG2 3.720 . 5.640 4.459 4.410 4.492 . 0 0 "[ . 1 . 2]" 1
191 1 22 LEU MD2 1 75 GLU H 3.670 . 5.540 4.995 4.804 5.230 . 0 0 "[ . 1 . 2]" 1
192 1 79 LYS H 1 80 GLY H 2.980 . 4.160 2.906 2.829 2.988 . 0 0 "[ . 1 . 2]" 1
193 1 80 GLY H 1 83 GLN H 3.640 . 5.480 4.732 4.584 4.886 . 0 0 "[ . 1 . 2]" 1
194 1 80 GLY H 1 81 LEU H 2.880 . 3.960 2.756 2.670 2.902 . 0 0 "[ . 1 . 2]" 1
195 1 77 LEU HA 1 80 GLY H 3.170 . 4.540 3.505 3.290 3.685 . 0 0 "[ . 1 . 2]" 1
196 1 78 LEU HA 1 82 LEU H 2.840 . 3.880 3.399 3.193 3.589 . 0 0 "[ . 1 . 2]" 1
197 1 78 LEU HB3 1 82 LEU H 3.400 . 5.000 4.601 4.441 4.726 . 0 0 "[ . 1 . 2]" 1
198 1 81 LEU MD2 1 82 LEU H 2.870 . 3.940 3.256 3.136 3.407 . 0 0 "[ . 1 . 2]" 1
199 1 82 LEU H 1 82 LEU MD2 2.820 . 3.840 3.132 3.027 3.249 . 0 0 "[ . 1 . 2]" 1
200 1 84 GLN H 1 86 LEU HB2 4.020 . 6.240 5.381 5.144 5.623 . 0 0 "[ . 1 . 2]" 1
201 1 83 GLN H 1 85 ARG H 3.550 . 5.300 4.136 4.041 4.217 . 0 0 "[ . 1 . 2]" 1
202 1 85 ARG H 1 88 GLU H 3.750 . 5.700 4.914 4.817 4.989 . 0 0 "[ . 1 . 2]" 1
203 1 81 LEU HA 1 85 ARG H 3.520 . 5.240 4.559 4.332 4.648 . 0 0 "[ . 1 . 2]" 1
204 1 84 GLN HB2 1 85 ARG H 2.840 . 3.880 2.449 2.351 2.579 . 0 0 "[ . 1 . 2]" 1
205 1 82 LEU MD2 1 85 ARG H 3.680 . 5.560 4.655 4.486 4.835 . 0 0 "[ . 1 . 2]" 1
206 1 83 GLN HA 1 86 LEU H 3.530 . 5.260 3.602 3.333 3.973 . 0 0 "[ . 1 . 2]" 1
207 1 86 LEU H 1 86 LEU MD1 3.060 . 4.320 3.739 3.608 3.881 . 0 0 "[ . 1 . 2]" 1
208 1 83 GLN HA 1 87 ASP H 3.320 . 4.840 4.130 4.019 4.276 . 0 0 "[ . 1 . 2]" 1
209 1 85 ARG HA 1 87 ASP H 3.500 . 5.200 4.462 4.289 4.568 . 0 0 "[ . 1 . 2]" 1
210 1 86 LEU MD1 1 87 ASP H 3.560 . 5.320 4.759 4.664 4.895 . 0 0 "[ . 1 . 2]" 1
211 1 91 SER H 1 92 LEU HB2 3.800 . 5.800 4.829 4.698 4.917 . 0 0 "[ . 1 . 2]" 1
212 1 91 SER H 1 92 LEU MD2 4.150 . 6.500 5.280 4.801 5.569 . 0 0 "[ . 1 . 2]" 1
213 1 92 LEU H 1 93 ILE HG13 3.360 . 4.920 4.357 4.132 4.497 . 0 0 "[ . 1 . 2]" 1
214 1 94 GLY H 1 95 GLN HA 3.840 . 5.880 5.362 5.282 5.428 . 0 0 "[ . 1 . 2]" 1
215 1 93 ILE HB 1 94 GLY H 3.020 . 4.240 2.677 2.496 2.805 . 0 0 "[ . 1 . 2]" 1
216 1 93 ILE HG12 1 94 GLY H 3.900 . 6.000 5.083 4.999 5.160 . 0 0 "[ . 1 . 2]" 1
217 1 93 ILE MG 1 94 GLY H 3.100 . 4.400 3.477 3.195 3.693 . 0 0 "[ . 1 . 2]" 1
218 1 93 ILE MD 1 94 GLY H 3.590 . 5.380 4.625 4.450 4.764 . 0 0 "[ . 1 . 2]" 1
219 1 96 VAL H 1 96 VAL MG1 2.750 . 3.700 2.484 2.267 2.845 . 0 0 "[ . 1 . 2]" 1
220 1 97 LEU HA 1 98 PHE H 2.490 . 3.180 2.166 2.127 2.213 . 0 0 "[ . 1 . 2]" 1
221 1 96 VAL HA 1 98 PHE H 4.010 . 6.210 5.339 5.215 5.571 . 0 0 "[ . 1 . 2]" 1
222 1 98 PHE H 1 98 PHE HB3 3.090 . 4.380 3.664 3.624 3.764 . 0 0 "[ . 1 . 2]" 1
223 1 98 PHE H 1 98 PHE HB2 2.710 . 3.620 2.572 2.511 2.663 . 0 0 "[ . 1 . 2]" 1
224 1 56 ILE H 1 56 ILE HB 2.700 . 3.600 2.632 2.466 2.710 . 0 0 "[ . 1 . 2]" 1
225 1 56 ILE H 1 56 ILE HG12 2.600 . 3.400 2.774 2.349 3.016 . 0 0 "[ . 1 . 2]" 1
226 1 56 ILE H 1 56 ILE MG 3.210 . 4.620 3.883 3.806 3.919 . 0 0 "[ . 1 . 2]" 1
227 1 56 ILE H 1 56 ILE MD 2.980 . 4.160 3.541 3.187 3.744 . 0 0 "[ . 1 . 2]" 1
228 1 113 ILE H 1 113 ILE HB 2.720 . 3.640 2.705 2.563 2.911 . 0 0 "[ . 1 . 2]" 1
229 1 113 ILE H 1 113 ILE MD 3.130 . 4.460 2.101 1.764 3.690 0.036 3 0 "[ . 1 . 2]" 1
230 1 11 TRP H 1 11 TRP HE1 4.120 . 6.440 5.366 5.178 5.635 . 0 0 "[ . 1 . 2]" 1
231 1 30 TRP HE1 1 89 LEU MD1 3.560 . 5.320 5.178 4.665 5.387 0.067 16 0 "[ . 1 . 2]" 1
232 1 92 LEU H 1 92 LEU HB2 2.820 . 3.840 2.487 2.366 2.581 . 0 0 "[ . 1 . 2]" 1
233 1 89 LEU MD2 1 92 LEU HB2 3.190 . 4.580 3.830 3.423 4.335 . 0 0 "[ . 1 . 2]" 1
234 1 75 GLU H 1 75 GLU HG3 3.720 . 5.640 4.500 4.470 4.554 . 0 0 "[ . 1 . 2]" 1
235 1 7 PHE HD1 1 53 PRO HD2 3.620 . 5.440 2.481 1.868 3.784 . 0 0 "[ . 1 . 2]" 1
236 1 7 PHE HE1 1 53 PRO HD2 3.760 . 5.720 3.608 3.098 4.230 . 0 0 "[ . 1 . 2]" 1
237 1 7 PHE HE1 1 53 PRO HD3 4.340 . 6.880 4.895 4.121 5.620 . 0 0 "[ . 1 . 2]" 1
238 1 53 PRO HD2 1 56 ILE MD 3.750 . 5.700 3.189 2.083 4.463 . 0 0 "[ . 1 . 2]" 1
239 1 52 THR MG 1 53 PRO HD2 3.190 . 4.580 3.135 2.793 3.566 . 0 0 "[ . 1 . 2]" 1
240 1 53 PRO HD2 1 56 ILE HG12 4.080 . 6.360 4.525 3.425 6.321 . 0 0 "[ . 1 . 2]" 1
241 1 53 PRO HD2 1 56 ILE HG13 3.870 . 5.940 4.292 3.168 5.958 0.018 8 0 "[ . 1 . 2]" 1
242 1 53 PRO HA 1 54 PRO HD3 3.030 . 4.260 2.136 1.895 2.534 . 0 0 "[ . 1 . 2]" 1
243 1 53 PRO HA 1 54 PRO HD2 3.030 . 4.260 2.664 2.210 3.008 . 0 0 "[ . 1 . 2]" 1
244 1 48 MET H 1 48 MET HB3 3.190 . 4.580 3.625 3.605 3.669 . 0 0 "[ . 1 . 2]" 1
245 1 48 MET HB2 1 49 GLU H 3.680 . 5.560 3.212 2.972 3.598 . 0 0 "[ . 1 . 2]" 1
246 1 47 VAL H 1 48 MET HB2 3.750 . 5.700 4.698 4.577 4.887 . 0 0 "[ . 1 . 2]" 1
247 1 45 GLU HA 1 48 MET HB3 3.450 . 5.100 4.403 3.917 4.813 . 0 0 "[ . 1 . 2]" 1
248 1 48 MET HA 1 48 MET HG2 3.340 . 4.880 3.039 2.920 3.407 . 0 0 "[ . 1 . 2]" 1
249 1 45 GLU HA 1 48 MET HG2 3.560 . 5.320 4.262 3.216 4.902 . 0 0 "[ . 1 . 2]" 1
250 1 44 ILE MG 1 48 MET HG2 3.340 . 4.880 3.169 2.653 3.414 . 0 0 "[ . 1 . 2]" 1
251 1 63 MET H 1 63 MET HB2 3.290 . 4.780 2.585 2.407 2.692 . 0 0 "[ . 1 . 2]" 1
252 1 63 MET H 1 63 MET HB3 3.200 . 4.600 3.652 3.570 3.701 . 0 0 "[ . 1 . 2]" 1
253 1 62 ASP H 1 63 MET HG3 3.770 . 5.740 4.493 4.329 4.639 . 0 0 "[ . 1 . 2]" 1
254 1 63 MET HG2 1 67 TYR HE1 3.450 . 5.100 4.774 4.070 5.002 . 0 0 "[ . 1 . 2]" 1
255 1 60 ILE MG 1 63 MET HG3 3.570 . 5.340 4.806 4.407 5.161 . 0 0 "[ . 1 . 2]" 1
256 1 63 MET HB2 1 64 VAL MG2 3.380 . 4.960 3.977 3.832 4.081 . 0 0 "[ . 1 . 2]" 1
257 1 63 MET HA 1 63 MET HG2 3.170 . 4.540 2.584 2.518 2.702 . 0 0 "[ . 1 . 2]" 1
258 1 7 PHE HZ 1 11 TRP HD1 3.210 . 4.620 4.215 4.074 4.355 . 0 0 "[ . 1 . 2]" 1
259 1 7 PHE HD1 1 11 TRP HD1 3.300 . 4.800 3.722 3.180 3.998 . 0 0 "[ . 1 . 2]" 1
260 1 8 ILE HA 1 11 TRP HD1 3.550 . 5.290 3.681 3.389 3.942 . 0 0 "[ . 1 . 2]" 1
261 1 11 TRP HD1 1 64 VAL HA 3.900 . 6.000 5.139 4.545 5.858 . 0 0 "[ . 1 . 2]" 1
262 1 11 TRP HZ2 1 68 ILE MD 3.410 . 5.020 3.481 3.278 3.626 . 0 0 "[ . 1 . 2]" 1
263 1 11 TRP HZ2 1 68 ILE MG 3.630 . 5.460 5.072 3.976 5.405 . 0 0 "[ . 1 . 2]" 1
264 1 40 TYR HD1 1 44 ILE MD 3.210 . 4.620 3.836 3.644 4.000 . 0 0 "[ . 1 . 2]" 1
265 1 40 TYR H 1 40 TYR HD1 3.570 . 5.340 4.756 4.637 4.829 . 0 0 "[ . 1 . 2]" 1
266 1 30 TRP H 1 30 TRP HD1 2.900 . 4.000 3.446 3.191 3.762 . 0 0 "[ . 1 . 2]" 1
267 1 98 PHE HB3 1 98 PHE HD1 2.940 . 4.080 2.631 2.525 2.972 . 0 0 "[ . 1 . 2]" 1
268 1 40 TYR HB3 1 40 TYR HD1 3.040 . 4.280 3.775 3.759 3.784 . 0 0 "[ . 1 . 2]" 1
269 1 40 TYR HB2 1 40 TYR HD1 3.040 . 4.280 2.832 2.757 2.908 . 0 0 "[ . 1 . 2]" 1
270 1 40 TYR HA 1 40 TYR HD1 3.050 . 4.300 2.443 2.298 2.580 . 0 0 "[ . 1 . 2]" 1
271 1 64 VAL HA 1 67 TYR HD1 2.830 . 3.860 1.841 1.706 2.770 0.094 15 0 "[ . 1 . 2]" 1
272 1 67 TYR HB2 1 67 TYR HD1 2.930 . 4.060 2.424 2.363 3.139 . 0 0 "[ . 1 . 2]" 1
273 1 67 TYR HB3 1 67 TYR HD1 2.950 . 4.100 3.328 3.216 3.719 . 0 0 "[ . 1 . 2]" 1
274 1 21 LEU MD2 1 40 TYR HD1 3.110 . 4.420 3.795 3.387 4.092 . 0 0 "[ . 1 . 2]" 1
275 1 7 PHE HD1 1 56 ILE MD 3.440 . 5.080 3.862 2.511 4.295 . 0 0 "[ . 1 . 2]" 1
276 1 7 PHE HD1 1 64 VAL MG1 3.670 . 5.540 4.909 2.460 5.252 . 0 0 "[ . 1 . 2]" 1
277 1 7 PHE HE1 1 64 VAL MG2 2.840 . 3.880 3.912 2.571 4.038 0.158 5 0 "[ . 1 . 2]" 1
278 1 7 PHE HE1 1 64 VAL MG1 3.230 . 4.660 4.586 2.908 4.798 0.138 15 0 "[ . 1 . 2]" 1
279 1 7 PHE HE1 1 56 ILE MG 3.340 . 4.880 4.771 3.895 4.983 0.103 20 0 "[ . 1 . 2]" 1
280 1 7 PHE HZ 1 11 TRP HE1 3.210 . 4.620 3.627 2.434 3.811 . 0 0 "[ . 1 . 2]" 1
281 1 67 TYR H 1 67 TYR HD1 2.930 . 4.060 3.501 1.905 3.823 . 0 0 "[ . 1 . 2]" 1
282 1 64 VAL H 1 67 TYR HE1 3.200 . 4.600 4.586 4.348 4.715 0.115 18 0 "[ . 1 . 2]" 1
283 1 11 TRP HD1 1 64 VAL MG1 3.150 . 4.500 2.555 2.342 2.887 . 0 0 "[ . 1 . 2]" 1
284 1 11 TRP HD1 1 64 VAL MG2 3.190 . 4.580 3.941 3.597 4.271 . 0 0 "[ . 1 . 2]" 1
285 1 11 TRP HE3 1 14 ILE HB 3.400 . 5.000 2.778 2.445 3.090 . 0 0 "[ . 1 . 2]" 1
286 1 11 TRP HE3 1 14 ILE MG 3.190 . 4.580 3.004 2.774 3.357 . 0 0 "[ . 1 . 2]" 1
287 1 11 TRP HE3 1 47 VAL MG1 3.590 . 5.380 4.714 3.675 5.122 . 0 0 "[ . 1 . 2]" 1
288 1 11 TRP HE3 1 14 ILE MD 3.440 . 5.080 2.579 2.386 2.958 . 0 0 "[ . 1 . 2]" 1
289 1 18 SER QB 1 40 TYR HD1 3.300 . 4.800 3.740 3.475 4.911 0.111 12 0 "[ . 1 . 2]" 1
290 1 40 TYR HD1 1 44 ILE HG13 3.090 . 4.380 4.108 3.911 4.302 . 0 0 "[ . 1 . 2]" 1
291 1 40 TYR HD1 1 44 ILE HG12 3.440 . 5.080 4.922 4.755 5.105 0.025 12 0 "[ . 1 . 2]" 1
292 1 21 LEU MD2 1 40 TYR HE1 3.560 . 5.320 4.671 4.131 5.150 . 0 0 "[ . 1 . 2]" 1
293 1 7 PHE H 1 7 PHE HD1 3.960 . 6.120 4.804 4.734 4.882 . 0 0 "[ . 1 . 2]" 1
294 1 7 PHE HD1 1 53 PRO HD3 3.360 . 4.920 3.473 2.801 4.955 0.035 19 0 "[ . 1 . 2]" 1
295 1 7 PHE HD1 1 56 ILE MG 3.940 . 6.080 5.706 4.437 5.944 . 0 0 "[ . 1 . 2]" 1
296 1 63 MET ME 1 67 TYR HD1 3.600 . 5.400 4.693 4.279 5.312 . 0 0 "[ . 1 . 2]" 1
297 1 64 VAL HB 1 67 TYR HD1 3.340 . 4.880 3.677 3.373 5.115 0.235 18 0 "[ . 1 . 2]" 1
298 1 64 VAL MG1 1 67 TYR HD1 3.150 . 4.500 2.478 2.062 4.228 . 0 0 "[ . 1 . 2]" 1
299 1 63 MET HA 1 67 TYR HE1 3.170 . 4.540 4.508 3.263 4.688 0.148 7 0 "[ . 1 . 2]" 1
300 1 64 VAL HA 1 67 TYR HE1 3.100 . 4.400 3.835 3.614 4.149 . 0 0 "[ . 1 . 2]" 1
301 1 67 TYR HB2 1 67 TYR HE1 3.510 . 5.220 4.703 4.662 5.082 . 0 0 "[ . 1 . 2]" 1
302 1 63 MET HG3 1 67 TYR HE1 3.670 . 5.540 5.384 5.120 5.627 0.087 15 0 "[ . 1 . 2]" 1
303 1 30 TRP HE3 1 33 LEU MD1 3.450 . 5.100 4.216 4.042 4.391 . 0 0 "[ . 1 . 2]" 1
304 1 97 LEU HA 1 98 PHE HD1 3.970 . 6.140 6.031 5.304 6.269 0.129 11 0 "[ . 1 . 2]" 1
305 1 25 ALA MB 1 30 TRP HH2 3.210 . 4.620 3.867 3.592 4.205 . 0 0 "[ . 1 . 2]" 1
306 1 30 TRP HH2 1 81 LEU MD2 3.000 . 4.200 2.260 1.923 2.718 . 0 0 "[ . 1 . 2]" 1
307 1 30 TRP HH2 1 81 LEU MD1 3.220 . 4.640 4.190 3.713 4.652 0.012 13 0 "[ . 1 . 2]" 1
308 1 5 VAL H 1 6 GLU H 2.910 . 4.020 2.599 2.476 2.686 . 0 0 "[ . 1 . 2]" 1
309 1 6 GLU H 1 7 PHE H 2.860 . 3.920 2.602 2.542 2.679 . 0 0 "[ . 1 . 2]" 1
310 1 7 PHE H 1 8 ILE H 2.730 . 3.660 2.955 2.771 3.026 . 0 0 "[ . 1 . 2]" 1
311 1 9 ASN H 1 10 ARG H 2.720 . 3.640 2.798 2.698 2.932 . 0 0 "[ . 1 . 2]" 1
312 1 10 ARG H 1 11 TRP H 2.940 . 4.080 2.649 2.524 2.760 . 0 0 "[ . 1 . 2]" 1
313 1 13 ARG H 1 14 ILE H 2.920 . 4.040 2.744 2.638 2.867 . 0 0 "[ . 1 . 2]" 1
314 1 19 GLN H 1 20 SER H 2.810 . 3.820 2.781 2.690 2.903 . 0 0 "[ . 1 . 2]" 1
315 1 20 SER H 1 21 LEU H 2.840 . 3.880 2.833 2.676 2.955 . 0 0 "[ . 1 . 2]" 1
316 1 21 LEU H 1 22 LEU H 2.720 . 3.640 2.567 2.450 2.655 . 0 0 "[ . 1 . 2]" 1
317 1 23 GLU H 1 24 LEU H 2.960 . 4.120 2.699 2.600 2.764 . 0 0 "[ . 1 . 2]" 1
318 1 25 ALA H 1 26 GLN H 2.920 . 4.040 2.637 2.540 2.713 . 0 0 "[ . 1 . 2]" 1
319 1 28 GLY H 1 29 GLU H 2.710 . 3.620 2.433 2.318 2.516 . 0 0 "[ . 1 . 2]" 1
320 1 31 ASP H 1 32 LEU H 2.680 . 3.560 2.737 2.616 2.857 . 0 0 "[ . 1 . 2]" 1
321 1 33 LEU H 1 34 LEU H 2.880 . 3.960 2.779 2.658 2.944 . 0 0 "[ . 1 . 2]" 1
322 1 34 LEU H 1 35 GLN H 2.800 . 3.800 2.494 2.395 2.576 . 0 0 "[ . 1 . 2]" 1
323 1 38 VAL H 1 39 SER H 2.720 . 3.640 2.792 2.716 2.893 . 0 0 "[ . 1 . 2]" 1
324 1 39 SER H 1 40 TYR H 2.800 . 3.800 2.583 2.446 2.656 . 0 0 "[ . 1 . 2]" 1
325 1 40 TYR H 1 41 LEU H 2.760 . 3.720 2.827 2.722 2.923 . 0 0 "[ . 1 . 2]" 1
326 1 44 ILE H 1 45 GLU H 2.710 . 3.620 2.685 2.612 2.844 . 0 0 "[ . 1 . 2]" 1
327 1 47 VAL H 1 48 MET H 2.680 . 3.560 2.540 2.440 2.642 . 0 0 "[ . 1 . 2]" 1
328 1 48 MET H 1 49 GLU H 2.710 . 3.620 2.496 2.366 2.636 . 0 0 "[ . 1 . 2]" 1
329 1 57 THR H 1 58 ARG H 4.350 . 6.900 4.600 4.552 4.628 . 0 0 "[ . 1 . 2]" 1
330 1 62 ASP H 1 63 MET H 2.610 . 3.420 2.699 2.527 2.801 . 0 0 "[ . 1 . 2]" 1
331 1 63 MET H 1 64 VAL H 2.720 . 3.640 2.834 2.775 2.936 . 0 0 "[ . 1 . 2]" 1
332 1 64 VAL H 1 65 ALA H 2.800 . 3.800 2.649 2.571 2.809 . 0 0 "[ . 1 . 2]" 1
333 1 66 GLY H 1 67 TYR H 2.750 . 3.700 2.711 2.623 2.839 . 0 0 "[ . 1 . 2]" 1
334 1 69 LYS H 1 70 GLN H 2.870 . 3.940 2.741 2.629 2.847 . 0 0 "[ . 1 . 2]" 1
335 1 71 THR H 1 72 LEU H 3.040 . 4.280 2.645 2.556 2.749 . 0 0 "[ . 1 . 2]" 1
336 1 78 LEU H 1 79 LYS H 2.950 . 4.100 2.637 2.565 2.713 . 0 0 "[ . 1 . 2]" 1
337 1 83 GLN H 1 84 GLN H 2.870 . 3.940 2.732 2.662 2.835 . 0 0 "[ . 1 . 2]" 1
338 1 85 ARG H 1 86 LEU H 2.860 . 3.920 2.803 2.718 2.884 . 0 0 "[ . 1 . 2]" 1
339 1 87 ASP H 1 88 GLU H 2.810 . 3.820 2.623 2.505 2.704 . 0 0 "[ . 1 . 2]" 1
340 1 89 LEU H 1 90 SER H 2.820 . 3.840 2.726 2.652 2.793 . 0 0 "[ . 1 . 2]" 1
341 1 92 LEU H 1 93 ILE H 2.680 . 3.560 2.665 2.417 2.843 . 0 0 "[ . 1 . 2]" 1
342 1 8 ILE H 1 9 ASN H 2.720 . 3.640 2.878 2.804 2.970 . 0 0 "[ . 1 . 2]" 1
343 1 11 TRP H 1 12 GLN H 2.850 . 3.900 2.679 2.600 2.757 . 0 0 "[ . 1 . 2]" 1
344 1 12 GLN H 1 13 ARG H 2.860 . 3.920 2.761 2.695 2.848 . 0 0 "[ . 1 . 2]" 1
345 1 18 SER H 1 19 GLN H 2.910 . 4.020 2.773 2.693 2.864 . 0 0 "[ . 1 . 2]" 1
346 1 22 LEU H 1 23 GLU H 2.760 . 3.720 2.677 2.594 2.749 . 0 0 "[ . 1 . 2]" 1
347 1 24 LEU H 1 25 ALA H 2.920 . 4.040 2.652 2.557 2.730 . 0 0 "[ . 1 . 2]" 1
348 1 26 GLN H 1 27 ARG H 2.820 . 3.840 2.521 2.424 2.608 . 0 0 "[ . 1 . 2]" 1
349 1 27 ARG H 1 28 GLY H 2.600 . 3.400 2.475 2.295 2.587 . 0 0 "[ . 1 . 2]" 1
350 1 30 TRP H 1 31 ASP H 2.680 . 3.560 2.541 2.447 2.621 . 0 0 "[ . 1 . 2]" 1
351 1 32 LEU H 1 33 LEU H 2.710 . 3.620 2.548 2.435 2.649 . 0 0 "[ . 1 . 2]" 1
352 1 35 GLN H 1 36 GLN H 2.750 . 3.700 2.606 2.467 2.711 . 0 0 "[ . 1 . 2]" 1
353 1 36 GLN H 1 37 GLU H 2.700 . 3.600 2.390 2.316 2.452 . 0 0 "[ . 1 . 2]" 1
354 1 37 GLU H 1 38 VAL H 2.880 . 3.960 2.942 2.827 3.054 . 0 0 "[ . 1 . 2]" 1
355 1 41 LEU H 1 42 GLN H 2.750 . 3.700 2.734 2.680 2.805 . 0 0 "[ . 1 . 2]" 1
356 1 42 GLN H 1 43 SER H 2.690 . 3.580 2.773 2.687 2.868 . 0 0 "[ . 1 . 2]" 1
357 1 43 SER H 1 44 ILE H 2.800 . 3.800 2.729 2.633 2.802 . 0 0 "[ . 1 . 2]" 1
358 1 45 GLU H 1 46 THR H 2.770 . 3.740 2.709 2.573 2.827 . 0 0 "[ . 1 . 2]" 1
359 1 46 THR H 1 47 VAL H 2.700 . 3.600 2.567 2.471 2.678 . 0 0 "[ . 1 . 2]" 1
360 1 49 GLU H 1 50 LYS H 2.670 . 3.540 2.501 2.349 2.626 . 0 0 "[ . 1 . 2]" 1
361 1 50 LYS H 1 51 GLN H 3.510 . 5.220 2.406 2.133 2.634 . 0 0 "[ . 1 . 2]" 1
362 1 60 ILE H 1 61 GLN H 2.650 . 3.500 2.571 2.428 2.692 . 0 0 "[ . 1 . 2]" 1
363 1 65 ALA H 1 66 GLY H 2.780 . 3.760 2.659 2.557 2.751 . 0 0 "[ . 1 . 2]" 1
364 1 67 TYR H 1 68 ILE H 2.790 . 3.780 2.681 2.567 2.764 . 0 0 "[ . 1 . 2]" 1
365 1 72 LEU H 1 73 ASP H 2.990 . 4.180 2.626 2.552 2.740 . 0 0 "[ . 1 . 2]" 1
366 1 75 GLU H 1 76 GLN H 2.970 . 4.140 2.524 2.473 2.598 . 0 0 "[ . 1 . 2]" 1
367 1 77 LEU H 1 78 LEU H 2.870 . 3.940 2.606 2.523 2.686 . 0 0 "[ . 1 . 2]" 1
368 1 81 LEU H 1 82 LEU H 2.910 . 4.020 2.802 2.715 2.961 . 0 0 "[ . 1 . 2]" 1
369 1 82 LEU H 1 83 GLN H 2.950 . 4.100 2.687 2.629 2.748 . 0 0 "[ . 1 . 2]" 1
370 1 84 GLN H 1 85 ARG H 2.620 . 3.450 2.723 2.649 2.771 . 0 0 "[ . 1 . 2]" 1
371 1 86 LEU H 1 87 ASP H 2.850 . 3.900 2.616 2.511 2.716 . 0 0 "[ . 1 . 2]" 1
372 1 88 GLU H 1 89 LEU H 2.820 . 3.840 2.698 2.614 2.828 . 0 0 "[ . 1 . 2]" 1
373 1 90 SER H 1 91 SER H 2.810 . 3.820 2.677 2.557 2.801 . 0 0 "[ . 1 . 2]" 1
374 1 91 SER H 1 92 LEU H 2.880 . 3.960 2.647 2.531 2.780 . 0 0 "[ . 1 . 2]" 1
375 1 93 ILE H 1 94 GLY H 2.730 . 3.660 2.674 2.586 2.798 . 0 0 "[ . 1 . 2]" 1
376 1 94 GLY H 1 95 GLN H 2.900 . 4.000 2.725 2.634 2.814 . 0 0 "[ . 1 . 2]" 1
377 1 96 VAL H 1 97 LEU H 2.710 . 3.620 2.437 2.230 2.619 . 0 0 "[ . 1 . 2]" 1
378 1 113 ILE H 1 114 GLU H 4.260 . 6.720 4.465 3.114 4.667 . 0 0 "[ . 1 . 2]" 1
379 1 114 GLU H 1 115 GLY H 4.350 . 6.900 4.445 3.216 4.639 . 0 0 "[ . 1 . 2]" 1
380 1 87 ASP H 1 89 LEU H 3.340 . 4.880 4.141 3.974 4.333 . 0 0 "[ . 1 . 2]" 1
381 1 86 LEU H 1 88 GLU H 3.460 . 5.120 4.208 4.025 4.337 . 0 0 "[ . 1 . 2]" 1
382 1 78 LEU H 1 80 GLY H 3.440 . 5.080 4.408 4.272 4.568 . 0 0 "[ . 1 . 2]" 1
383 1 48 MET H 1 50 LYS H 3.070 . 4.340 4.009 3.694 4.267 . 0 0 "[ . 1 . 2]" 1
384 1 78 LEU H 1 81 LEU H 3.640 . 5.480 4.829 4.771 4.959 . 0 0 "[ . 1 . 2]" 1
385 1 38 VAL H 1 42 GLN H 4.310 . 6.820 5.903 5.830 6.001 . 0 0 "[ . 1 . 2]" 1
386 1 82 LEU H 1 84 GLN H 3.640 . 5.480 4.356 4.188 4.479 . 0 0 "[ . 1 . 2]" 1
387 1 84 GLN H 1 86 LEU H 3.380 . 4.960 4.305 4.112 4.467 . 0 0 "[ . 1 . 2]" 1
388 1 7 PHE H 1 9 ASN H 3.570 . 5.340 4.559 4.408 4.763 . 0 0 "[ . 1 . 2]" 1
389 1 9 ASN H 1 11 TRP H 3.640 . 5.480 4.370 4.099 4.528 . 0 0 "[ . 1 . 2]" 1
390 1 8 ILE H 1 11 TRP H 3.740 . 5.680 4.977 4.805 5.123 . 0 0 "[ . 1 . 2]" 1
391 1 11 TRP H 1 13 ARG H 3.480 . 5.160 4.093 4.006 4.192 . 0 0 "[ . 1 . 2]" 1
392 1 10 ARG H 1 12 GLN H 3.520 . 5.240 4.069 3.914 4.208 . 0 0 "[ . 1 . 2]" 1
393 1 8 ILE H 1 12 GLN H 4.350 . 6.900 6.201 6.000 6.341 . 0 0 "[ . 1 . 2]" 1
394 1 12 GLN H 1 14 ILE H 3.360 . 4.920 4.192 4.020 4.343 . 0 0 "[ . 1 . 2]" 1
395 1 14 ILE H 1 16 LEU H 3.360 . 4.920 4.292 4.105 4.549 . 0 0 "[ . 1 . 2]" 1
396 1 11 TRP H 1 14 ILE H 3.690 . 5.580 4.672 4.558 4.813 . 0 0 "[ . 1 . 2]" 1
397 1 15 ALA H 1 16 LEU H 2.790 . 3.780 2.662 2.621 2.757 . 0 0 "[ . 1 . 2]" 1
398 1 16 LEU H 1 18 SER H 3.450 . 5.100 4.265 4.034 4.424 . 0 0 "[ . 1 . 2]" 1
399 1 18 SER H 1 20 SER H 3.450 . 5.100 4.270 4.101 4.388 . 0 0 "[ . 1 . 2]" 1
400 1 18 SER H 1 40 TYR HE1 3.520 . 5.240 3.518 3.232 3.855 . 0 0 "[ . 1 . 2]" 1
401 1 18 SER H 1 21 LEU H 3.870 . 5.940 4.936 4.878 4.988 . 0 0 "[ . 1 . 2]" 1
402 1 20 SER H 1 22 LEU H 3.270 . 4.740 4.013 3.877 4.127 . 0 0 "[ . 1 . 2]" 1
403 1 34 LEU H 1 36 GLN H 3.270 . 4.740 4.066 3.914 4.234 . 0 0 "[ . 1 . 2]" 1
404 1 93 ILE H 1 95 GLN H 3.390 . 4.980 4.161 4.013 4.462 . 0 0 "[ . 1 . 2]" 1
405 1 22 LEU H 1 24 LEU H 3.380 . 4.960 3.919 3.786 4.014 . 0 0 "[ . 1 . 2]" 1
406 1 24 LEU H 1 27 ARG H 3.600 . 5.400 4.678 4.535 4.839 . 0 0 "[ . 1 . 2]" 1
407 1 23 GLU H 1 25 ALA H 3.490 . 5.180 4.162 4.026 4.366 . 0 0 "[ . 1 . 2]" 1
408 1 22 LEU H 1 25 ALA H 3.700 . 5.600 4.600 4.478 4.698 . 0 0 "[ . 1 . 2]" 1
409 1 25 ALA H 1 27 ARG H 3.180 . 4.560 3.881 3.699 4.197 . 0 0 "[ . 1 . 2]" 1
410 1 24 LEU H 1 26 GLN H 3.310 . 4.820 4.253 3.866 4.481 . 0 0 "[ . 1 . 2]" 1
411 1 26 GLN H 1 28 GLY H 3.270 . 4.740 3.859 3.619 3.997 . 0 0 "[ . 1 . 2]" 1
412 1 25 ALA H 1 28 GLY H 3.780 . 5.760 4.667 4.452 4.878 . 0 0 "[ . 1 . 2]" 1
413 1 63 MET H 1 65 ALA H 3.380 . 4.960 4.104 3.850 4.288 . 0 0 "[ . 1 . 2]" 1
414 1 29 GLU H 1 33 LEU H 4.230 . 6.660 5.601 5.429 5.730 . 0 0 "[ . 1 . 2]" 1
415 1 25 ALA H 1 29 GLU H 3.910 . 6.020 5.234 5.019 5.557 . 0 0 "[ . 1 . 2]" 1
416 1 30 TRP H 1 30 TRP HE1 3.590 . 5.380 4.782 4.593 4.965 . 0 0 "[ . 1 . 2]" 1
417 1 30 TRP H 1 33 LEU H 3.710 . 5.620 4.661 4.496 4.850 . 0 0 "[ . 1 . 2]" 1
418 1 30 TRP H 1 30 TRP HE3 3.390 . 4.980 4.191 3.914 4.448 . 0 0 "[ . 1 . 2]" 1
419 1 32 LEU H 1 35 GLN H 3.670 . 5.540 4.640 4.472 4.822 . 0 0 "[ . 1 . 2]" 1
420 1 31 ASP H 1 33 LEU H 3.290 . 4.780 4.050 3.912 4.191 . 0 0 "[ . 1 . 2]" 1
421 1 34 LEU H 1 37 GLU H 3.560 . 5.320 4.493 4.369 4.614 . 0 0 "[ . 1 . 2]" 1
422 1 30 TRP H 1 34 LEU H 4.350 . 6.900 6.009 5.888 6.110 . 0 0 "[ . 1 . 2]" 1
423 1 33 LEU H 1 35 GLN H 3.320 . 4.840 4.024 3.925 4.190 . 0 0 "[ . 1 . 2]" 1
424 1 39 SER H 1 42 GLN H 3.680 . 5.560 4.869 4.740 5.009 . 0 0 "[ . 1 . 2]" 1
425 1 37 GLU H 1 39 SER H 3.610 . 5.420 4.438 4.231 4.685 . 0 0 "[ . 1 . 2]" 1
426 1 40 TYR H 1 42 GLN H 3.220 . 4.640 4.046 3.914 4.243 . 0 0 "[ . 1 . 2]" 1
427 1 37 GLU H 1 40 TYR H 3.490 . 5.180 4.847 4.761 5.028 . 0 0 "[ . 1 . 2]" 1
428 1 41 LEU H 1 43 SER H 3.420 . 5.040 4.256 4.086 4.395 . 0 0 "[ . 1 . 2]" 1
429 1 90 SER H 1 93 ILE H 3.750 . 5.700 4.757 4.629 4.950 . 0 0 "[ . 1 . 2]" 1
430 1 45 GLU H 1 47 VAL H 3.330 . 4.860 4.335 4.219 4.449 . 0 0 "[ . 1 . 2]" 1
431 1 46 THR H 1 49 GLU H 3.940 . 6.080 4.494 4.221 4.725 . 0 0 "[ . 1 . 2]" 1
432 1 45 GLU H 1 48 MET H 3.830 . 5.860 4.866 4.652 5.046 . 0 0 "[ . 1 . 2]" 1
433 1 48 MET H 1 51 GLN H 4.090 . 6.380 4.614 4.194 4.995 . 0 0 "[ . 1 . 2]" 1
434 1 49 GLU H 1 51 GLN H 3.660 . 5.520 3.650 3.435 3.822 . 0 0 "[ . 1 . 2]" 1
435 1 47 VAL H 1 50 LYS H 3.990 . 6.180 4.937 4.466 5.407 . 0 0 "[ . 1 . 2]" 1
436 1 60 ILE H 1 63 MET H 3.800 . 5.800 4.797 4.660 4.922 . 0 0 "[ . 1 . 2]" 1
437 1 57 THR H 1 60 ILE H 3.300 . 4.800 4.150 3.894 4.592 . 0 0 "[ . 1 . 2]" 1
438 1 61 GLN H 1 63 MET H 3.510 . 5.220 4.262 4.085 4.396 . 0 0 "[ . 1 . 2]" 1
439 1 57 THR H 1 61 GLN H 3.620 . 5.440 4.496 4.335 4.687 . 0 0 "[ . 1 . 2]" 1
440 1 62 ASP H 1 65 ALA H 3.670 . 5.540 4.709 4.591 4.853 . 0 0 "[ . 1 . 2]" 1
441 1 60 ILE H 1 62 ASP H 3.400 . 5.000 4.063 3.863 4.288 . 0 0 "[ . 1 . 2]" 1
442 1 77 LEU H 1 79 LYS H 3.300 . 4.800 4.061 3.880 4.262 . 0 0 "[ . 1 . 2]" 1
443 1 74 ASN H 1 77 LEU H 3.750 . 5.700 4.799 4.707 4.898 . 0 0 "[ . 1 . 2]" 1
444 1 65 ALA H 1 67 TYR H 3.450 . 5.100 4.012 3.844 4.105 . 0 0 "[ . 1 . 2]" 1
445 1 67 TYR H 1 70 GLN H 3.700 . 5.600 4.797 4.672 4.972 . 0 0 "[ . 1 . 2]" 1
446 1 65 ALA H 1 68 ILE H 3.710 . 5.620 4.687 4.582 4.848 . 0 0 "[ . 1 . 2]" 1
447 1 68 ILE H 1 70 GLN H 3.310 . 4.820 4.073 3.841 4.344 . 0 0 "[ . 1 . 2]" 1
448 1 68 ILE H 1 71 THR H 3.730 . 5.660 4.725 4.641 4.819 . 0 0 "[ . 1 . 2]" 1
449 1 69 LYS H 1 71 THR H 3.530 . 5.260 4.246 4.117 4.406 . 0 0 "[ . 1 . 2]" 1
450 1 67 TYR H 1 69 LYS H 3.340 . 4.880 4.121 3.997 4.265 . 0 0 "[ . 1 . 2]" 1
451 1 15 ALA H 1 71 THR H 4.070 . 6.340 5.762 5.626 5.999 . 0 0 "[ . 1 . 2]" 1
452 1 72 LEU H 1 75 GLU H 3.610 . 5.420 4.721 4.646 4.794 . 0 0 "[ . 1 . 2]" 1
453 1 70 GLN H 1 72 LEU H 3.340 . 4.880 4.144 4.036 4.317 . 0 0 "[ . 1 . 2]" 1
454 1 79 LYS H 1 82 LEU H 3.760 . 5.720 4.916 4.841 4.977 . 0 0 "[ . 1 . 2]" 1
455 1 76 GLN H 1 79 LYS H 3.640 . 5.480 4.556 4.452 4.685 . 0 0 "[ . 1 . 2]" 1
456 1 79 LYS H 1 81 LEU H 3.330 . 4.860 4.360 4.129 4.584 . 0 0 "[ . 1 . 2]" 1
457 1 80 GLY H 1 82 LEU H 3.560 . 5.320 4.541 4.448 4.679 . 0 0 "[ . 1 . 2]" 1
458 1 82 LEU H 1 85 ARG H 3.770 . 5.740 4.776 4.713 4.864 . 0 0 "[ . 1 . 2]" 1
459 1 86 LEU H 1 89 LEU H 3.730 . 5.660 4.703 4.599 4.830 . 0 0 "[ . 1 . 2]" 1
460 1 87 ASP H 1 90 SER H 3.710 . 5.620 4.689 4.587 4.801 . 0 0 "[ . 1 . 2]" 1
461 1 85 ARG H 1 87 ASP H 3.370 . 4.940 4.162 4.085 4.285 . 0 0 "[ . 1 . 2]" 1
462 1 89 LEU H 1 92 LEU H 3.780 . 5.760 4.754 4.618 4.886 . 0 0 "[ . 1 . 2]" 1
463 1 88 GLU H 1 90 SER H 3.460 . 5.120 4.145 3.902 4.364 . 0 0 "[ . 1 . 2]" 1
464 1 89 LEU H 1 91 SER H 3.290 . 4.780 4.178 3.935 4.405 . 0 0 "[ . 1 . 2]" 1
465 1 91 SER H 1 93 ILE H 3.360 . 4.920 4.258 4.019 4.603 . 0 0 "[ . 1 . 2]" 1
466 1 90 SER H 1 92 LEU H 3.410 . 5.020 4.078 3.964 4.308 . 0 0 "[ . 1 . 2]" 1
467 1 4 THR MG 1 60 ILE MD 2.920 . 4.040 2.015 1.904 2.118 . 0 0 "[ . 1 . 2]" 1
468 1 57 THR MG 1 60 ILE MD 3.230 . 4.660 2.041 1.921 2.177 . 0 0 "[ . 1 . 2]" 1
469 1 64 VAL MG2 1 65 ALA MB 3.790 . 5.780 3.355 3.091 3.637 . 0 0 "[ . 1 . 2]" 1
470 1 65 ALA MB 1 68 ILE MD 3.790 . 5.780 3.802 3.131 4.306 . 0 0 "[ . 1 . 2]" 1
471 1 25 ALA MB 1 33 LEU MD1 3.270 . 4.740 1.880 1.743 2.130 0.057 5 0 "[ . 1 . 2]" 1
472 1 25 ALA MB 1 82 LEU MD2 4.010 . 6.220 2.462 1.980 2.867 . 0 0 "[ . 1 . 2]" 1
473 1 21 LEU MD1 1 25 ALA MB 3.830 . 5.860 3.704 3.564 3.964 . 0 0 "[ . 1 . 2]" 1
474 1 97 LEU MD1 1 113 ILE MD 3.900 . 6.000 3.767 2.525 5.039 . 0 0 "[ . 1 . 2]" 1
475 1 97 LEU MD2 1 113 ILE MD 3.550 . 5.300 3.520 2.252 4.996 . 0 0 "[ . 1 . 2]" 1
476 1 64 VAL MG2 1 68 ILE MD 3.010 . 4.220 3.075 2.898 3.248 . 0 0 "[ . 1 . 2]" 1
477 1 14 ILE MD 1 71 THR MG 3.860 . 5.920 3.964 3.788 4.053 . 0 0 "[ . 1 . 2]" 1
478 1 14 ILE MD 1 47 VAL MG2 2.950 . 4.100 2.368 2.085 2.708 . 0 0 "[ . 1 . 2]" 1
479 1 14 ILE MD 1 47 VAL MG1 2.960 . 4.120 2.507 2.007 2.711 . 0 0 "[ . 1 . 2]" 1
480 1 21 LEU MD2 1 44 ILE MD 3.910 . 6.020 5.261 5.134 5.447 . 0 0 "[ . 1 . 2]" 1
481 1 41 LEU MD2 1 44 ILE MD 3.170 . 4.540 2.208 2.015 2.482 . 0 0 "[ . 1 . 2]" 1
482 1 14 ILE MD 1 44 ILE MD 3.180 . 4.560 3.787 3.671 3.870 . 0 0 "[ . 1 . 2]" 1
483 1 89 LEU MD2 1 93 ILE MD 3.870 . 5.940 4.358 4.060 4.888 . 0 0 "[ . 1 . 2]" 1
484 1 89 LEU MD1 1 93 ILE MD 3.790 . 5.780 4.221 3.931 4.652 . 0 0 "[ . 1 . 2]" 1
485 1 56 ILE MD 1 64 VAL MG1 3.570 . 5.340 4.254 3.299 4.487 . 0 0 "[ . 1 . 2]" 1
486 1 4 THR MG 1 56 ILE MD 3.220 . 4.640 1.964 1.813 2.162 . 0 0 "[ . 1 . 2]" 1
487 1 52 THR MG 1 56 ILE MD 2.880 . 3.960 3.645 3.173 4.191 0.231 8 0 "[ . 1 . 2]" 1
488 1 56 ILE MD 1 60 ILE MD 3.610 . 5.420 3.361 2.971 3.821 . 0 0 "[ . 1 . 2]" 1
489 1 44 ILE MD 1 47 VAL MG1 4.350 . 6.900 6.280 5.864 6.449 . 0 0 "[ . 1 . 2]" 1
490 1 44 ILE MD 1 47 VAL MG2 3.770 . 5.740 5.033 4.593 5.296 . 0 0 "[ . 1 . 2]" 1
491 1 56 ILE MD 1 57 THR MG 4.020 . 6.240 4.795 4.540 5.202 . 0 0 "[ . 1 . 2]" 1
492 1 46 THR MG 1 47 VAL MG1 2.300 . 2.800 2.709 2.518 2.825 0.025 16 0 "[ . 1 . 2]" 1
493 1 14 ILE MD 1 46 THR MG 4.120 . 6.440 4.156 3.969 4.290 . 0 0 "[ . 1 . 2]" 1
494 1 15 ALA MB 1 16 LEU MD1 3.860 . 5.920 4.535 4.279 4.682 . 0 0 "[ . 1 . 2]" 1
495 1 15 ALA MB 1 71 THR MG 3.980 . 6.160 4.338 4.063 4.538 . 0 0 "[ . 1 . 2]" 1
496 1 47 VAL MG2 1 48 MET ME 3.470 . 5.140 2.970 2.236 3.620 . 0 0 "[ . 1 . 2]" 1
497 1 47 VAL MG1 1 48 MET ME 3.620 . 5.440 5.190 4.440 5.779 0.339 2 0 "[ . 1 . 2]" 1
498 1 48 MET ME 1 68 ILE MD 3.880 . 5.960 4.014 3.527 4.668 . 0 0 "[ . 1 . 2]" 1
499 1 44 ILE MD 1 48 MET ME 3.800 . 5.800 5.633 5.326 5.985 0.185 2 0 "[ . 1 . 2]" 1
500 1 4 THR MG 1 63 MET ME 3.710 . 5.620 4.997 4.720 5.288 . 0 0 "[ . 1 . 2]" 1
501 1 86 LEU MD2 1 89 LEU MD1 3.700 . 5.600 2.240 1.758 2.992 0.042 13 0 "[ . 1 . 2]" 1
502 1 21 LEU MD1 1 82 LEU MD2 4.130 . 6.460 5.255 5.070 5.553 . 0 0 "[ . 1 . 2]" 1
503 1 21 LEU MD1 1 41 LEU MD2 3.610 . 5.420 5.256 4.992 5.449 0.029 20 0 "[ . 1 . 2]" 1
504 1 4 THR MG 1 64 VAL MG1 3.820 . 5.840 5.172 4.625 5.474 . 0 0 "[ . 1 . 2]" 1
505 1 63 MET ME 1 64 VAL MG1 3.440 . 5.080 3.034 2.706 3.195 . 0 0 "[ . 1 . 2]" 1
506 1 64 VAL MG1 1 68 ILE MD 3.260 . 4.720 4.620 4.397 4.809 0.089 12 0 "[ . 1 . 2]" 1
507 1 60 ILE MD 1 64 VAL MG1 4.070 . 6.340 5.003 4.790 5.185 . 0 0 "[ . 1 . 2]" 1
508 1 38 VAL MG2 1 41 LEU MD1 4.350 . 6.900 5.843 5.585 6.231 . 0 0 "[ . 1 . 2]" 1
509 1 1 MET ME 1 5 VAL MG2 3.540 . 5.280 3.974 2.634 5.391 0.111 17 0 "[ . 1 . 2]" 1
510 1 71 THR MG 1 72 LEU MD1 3.780 . 5.760 3.998 3.797 4.189 . 0 0 "[ . 1 . 2]" 1
511 1 71 THR MG 1 72 LEU MD2 3.650 . 5.500 3.140 2.922 3.270 . 0 0 "[ . 1 . 2]" 1
512 1 44 ILE MD 1 71 THR MG 3.340 . 4.880 3.765 3.505 3.934 . 0 0 "[ . 1 . 2]" 1
513 1 21 LEU MD2 1 33 LEU MD1 3.600 . 5.400 3.111 2.955 3.210 . 0 0 "[ . 1 . 2]" 1
514 1 21 LEU MD2 1 41 LEU MD1 4.250 . 6.700 5.261 5.022 5.557 . 0 0 "[ . 1 . 2]" 1
515 1 21 LEU MD2 1 41 LEU MD2 3.670 . 5.540 4.831 4.688 4.972 . 0 0 "[ . 1 . 2]" 1
516 1 86 LEU MD1 1 89 LEU MD1 4.100 . 6.400 4.752 4.361 5.370 . 0 0 "[ . 1 . 2]" 1
517 1 82 LEU MD2 1 86 LEU MD1 3.600 . 5.400 4.764 4.240 5.288 . 0 0 "[ . 1 . 2]" 1
518 1 93 ILE MD 1 97 LEU MD1 3.970 . 6.140 4.156 3.824 4.454 . 0 0 "[ . 1 . 2]" 1
519 1 1 MET ME 1 5 VAL MG1 4.140 . 6.480 4.708 3.637 5.344 . 0 0 "[ . 1 . 2]" 1
520 1 5 VAL MG1 1 8 ILE MD 3.700 . 5.600 4.610 4.345 4.947 . 0 0 "[ . 1 . 2]" 1
521 1 33 LEU MD1 1 82 LEU MD2 3.250 . 4.700 3.464 3.262 3.762 . 0 0 "[ . 1 . 2]" 1
522 1 21 LEU MD1 1 33 LEU MD1 3.110 . 4.420 2.199 2.068 2.421 . 0 0 "[ . 1 . 2]" 1
523 1 22 LEU MD2 1 78 LEU MD1 3.380 . 4.960 4.975 4.766 5.110 0.150 12 0 "[ . 1 . 2]" 1
524 1 25 ALA MB 1 78 LEU MD1 3.720 . 5.640 4.358 4.157 4.564 . 0 0 "[ . 1 . 2]" 1
525 1 77 LEU MD1 1 81 LEU MD1 3.850 . 5.900 4.951 4.623 5.330 . 0 0 "[ . 1 . 2]" 1
526 1 78 LEU MD2 1 81 LEU MD1 3.520 . 5.240 3.576 3.080 4.098 . 0 0 "[ . 1 . 2]" 1
527 1 22 LEU MD1 1 81 LEU MD1 3.120 . 4.440 3.131 2.798 3.618 . 0 0 "[ . 1 . 2]" 1
528 1 25 ALA MB 1 81 LEU MD1 3.350 . 4.900 2.641 2.201 3.256 . 0 0 "[ . 1 . 2]" 1
529 1 33 LEU MD2 1 82 LEU MD2 2.940 . 4.080 2.184 1.983 2.345 . 0 0 "[ . 1 . 2]" 1
530 1 89 LEU MD2 1 92 LEU MD1 3.310 . 4.820 2.322 1.901 3.133 . 0 0 "[ . 1 . 2]" 1
531 1 82 LEU MD2 1 86 LEU MD2 3.370 . 4.940 4.599 4.159 4.977 0.037 11 0 "[ . 1 . 2]" 1
532 1 22 LEU MD1 1 78 LEU MD1 3.680 . 5.560 3.786 3.559 3.925 . 0 0 "[ . 1 . 2]" 1
533 1 22 LEU MD1 1 25 ALA MB 3.670 . 5.540 3.045 2.603 3.472 . 0 0 "[ . 1 . 2]" 1
534 1 1 MET ME 1 8 ILE MD 2.950 . 4.100 2.789 2.168 4.135 0.035 17 0 "[ . 1 . 2]" 1
535 1 1 MET ME 1 60 ILE MD 3.190 . 4.580 2.395 1.930 3.757 . 0 0 "[ . 1 . 2]" 1
536 1 25 ALA MB 1 81 LEU MD2 3.560 . 5.320 2.593 2.207 2.874 . 0 0 "[ . 1 . 2]" 1
537 1 33 LEU MD1 1 82 LEU MD1 2.930 . 4.060 3.032 2.633 3.437 . 0 0 "[ . 1 . 2]" 1
538 1 78 LEU MD2 1 82 LEU MD1 3.200 . 4.600 2.606 2.172 3.184 . 0 0 "[ . 1 . 2]" 1
539 1 21 LEU MD1 1 82 LEU MD1 3.940 . 6.080 4.331 3.994 4.661 . 0 0 "[ . 1 . 2]" 1
540 1 82 LEU MD1 1 86 LEU MD2 4.320 . 6.840 4.803 4.624 5.016 . 0 0 "[ . 1 . 2]" 1
541 1 25 ALA MB 1 82 LEU MD1 3.740 . 5.680 3.626 3.305 4.000 . 0 0 "[ . 1 . 2]" 1
542 1 38 VAL MG1 1 41 LEU MD1 3.970 . 6.140 4.613 4.319 5.188 . 0 0 "[ . 1 . 2]" 1
543 1 41 LEU MD1 1 44 ILE MD 3.940 . 6.080 4.679 4.515 4.908 . 0 0 "[ . 1 . 2]" 1
544 1 22 LEU MD2 1 77 LEU MD2 3.360 . 4.920 4.306 4.076 4.565 . 0 0 "[ . 1 . 2]" 1
545 1 33 LEU MD1 1 78 LEU MD2 3.090 . 4.370 2.405 2.203 2.548 . 0 0 "[ . 1 . 2]" 1
546 1 78 LEU MD2 1 82 LEU MD2 3.300 . 4.800 3.305 2.918 3.752 . 0 0 "[ . 1 . 2]" 1
547 1 22 LEU MD1 1 78 LEU MD2 3.220 . 4.640 2.373 2.291 2.490 . 0 0 "[ . 1 . 2]" 1
548 1 78 LEU MD2 1 81 LEU MD2 3.410 . 5.020 4.100 3.799 4.401 . 0 0 "[ . 1 . 2]" 1
549 1 25 ALA MB 1 78 LEU MD2 3.200 . 4.600 2.404 2.190 2.646 . 0 0 "[ . 1 . 2]" 1
550 1 22 LEU MD2 1 77 LEU MD1 2.940 . 4.080 1.983 1.842 2.174 . 0 0 "[ . 1 . 2]" 1
551 1 22 LEU MD1 1 77 LEU MD1 3.220 . 4.640 2.701 2.468 2.898 . 0 0 "[ . 1 . 2]" 1
552 1 33 LEU MD1 1 34 LEU MD2 3.680 . 5.560 4.374 4.010 4.907 . 0 0 "[ . 1 . 2]" 1
553 1 34 LEU MD2 1 82 LEU MD1 3.590 . 5.380 4.465 4.063 5.068 . 0 0 "[ . 1 . 2]" 1
554 1 4 THR MG 1 57 THR MG 3.490 . 5.180 4.080 3.751 4.299 . 0 0 "[ . 1 . 2]" 1
555 1 4 THR MG 1 5 VAL MG2 3.910 . 6.020 4.917 4.753 5.214 . 0 0 "[ . 1 . 2]" 1
556 1 1 MET ME 1 4 THR MG 3.580 . 5.360 2.772 2.067 3.592 . 0 0 "[ . 1 . 2]" 1
557 1 33 LEU MD2 1 82 LEU MD1 3.130 . 4.460 2.391 2.184 2.649 . 0 0 "[ . 1 . 2]" 1
558 1 33 LEU MD2 1 34 LEU MD2 2.900 . 4.000 3.193 2.719 3.670 . 0 0 "[ . 1 . 2]" 1
559 1 25 ALA MB 1 33 LEU MD2 3.330 . 4.860 2.433 2.106 2.696 . 0 0 "[ . 1 . 2]" 1
560 1 8 ILE MD 1 64 VAL MG1 3.720 . 5.640 4.512 3.999 4.745 . 0 0 "[ . 1 . 2]" 1
561 1 4 THR MG 1 8 ILE MD 2.870 . 3.940 2.518 2.175 3.016 . 0 0 "[ . 1 . 2]" 1
562 1 5 VAL MG2 1 8 ILE MD 3.630 . 5.460 2.965 2.463 3.420 . 0 0 "[ . 1 . 2]" 1
563 1 8 ILE MD 1 56 ILE MD 3.830 . 5.860 4.436 4.040 4.999 . 0 0 "[ . 1 . 2]" 1
564 1 8 ILE MD 1 60 ILE MD 3.090 . 4.380 2.004 1.798 2.168 0.002 18 0 "[ . 1 . 2]" 1
565 1 24 LEU MD2 1 32 LEU MD1 2.660 . 3.520 2.087 1.992 2.296 . 0 0 "[ . 1 . 2]" 1
566 1 24 LEU MD1 1 33 LEU MD1 3.830 . 5.860 4.016 3.607 4.359 . 0 0 "[ . 1 . 2]" 1
567 1 24 LEU MD1 1 33 LEU MD2 3.860 . 5.920 5.578 5.224 5.820 . 0 0 "[ . 1 . 2]" 1
568 1 24 LEU MD1 1 32 LEU MD1 3.320 . 4.830 3.197 2.983 3.368 . 0 0 "[ . 1 . 2]" 1
569 1 21 LEU MD1 1 24 LEU MD1 3.810 . 5.820 4.759 4.595 4.915 . 0 0 "[ . 1 . 2]" 1
570 1 15 ALA MB 1 16 LEU MD2 3.820 . 5.840 3.598 3.111 4.149 . 0 0 "[ . 1 . 2]" 1
571 1 33 LEU MD2 1 78 LEU MD2 2.960 . 4.120 3.405 3.222 3.642 . 0 0 "[ . 1 . 2]" 1
572 1 78 LEU MD1 1 82 LEU MD1 3.570 . 5.340 3.402 3.168 3.706 . 0 0 "[ . 1 . 2]" 1
573 1 56 ILE MD 1 64 VAL MG2 3.500 . 5.200 4.234 3.166 4.516 . 0 0 "[ . 1 . 2]" 1
574 1 21 LEU MD1 1 78 LEU MD2 3.360 . 4.920 2.206 2.038 2.557 . 0 0 "[ . 1 . 2]" 1
575 1 21 LEU MD1 1 78 LEU MD1 3.190 . 4.580 1.854 1.787 1.901 0.013 6 0 "[ . 1 . 2]" 1
576 1 64 VAL MG1 1 65 ALA MB 3.820 . 5.840 5.263 5.151 5.362 . 0 0 "[ . 1 . 2]" 1
577 1 33 LEU MD1 1 78 LEU MD1 2.990 . 4.180 3.311 2.937 3.481 . 0 0 "[ . 1 . 2]" 1
578 1 33 LEU MD2 1 81 LEU MD1 3.820 . 5.840 5.145 4.694 5.613 . 0 0 "[ . 1 . 2]" 1
579 1 52 THR MG 1 64 VAL MG1 3.770 . 5.740 5.389 5.048 5.590 . 0 0 "[ . 1 . 2]" 1
580 1 89 LEU MD1 1 92 LEU MD1 3.760 . 5.720 4.777 4.450 5.483 . 0 0 "[ . 1 . 2]" 1
581 1 24 LEU MD1 1 32 LEU MD2 3.370 . 4.940 3.724 3.475 3.935 . 0 0 "[ . 1 . 2]" 1
582 1 21 LEU MD2 1 24 LEU MD1 3.260 . 4.720 4.413 4.209 4.607 . 0 0 "[ . 1 . 2]" 1
583 1 21 LEU MD2 1 78 LEU MD2 3.640 . 5.480 4.398 4.205 4.739 . 0 0 "[ . 1 . 2]" 1
584 1 21 LEU MD2 1 78 LEU MD1 3.150 . 4.500 3.547 3.351 3.748 . 0 0 "[ . 1 . 2]" 1
585 1 46 THR MG 1 47 VAL MG2 3.250 . 4.700 3.770 3.615 3.900 . 0 0 "[ . 1 . 2]" 1
586 1 81 LEU MD2 1 82 LEU MD2 3.290 . 4.780 2.159 2.003 2.359 . 0 0 "[ . 1 . 2]" 1
587 1 82 LEU MD1 1 86 LEU MD1 3.230 . 4.660 4.196 3.791 4.664 0.004 11 0 "[ . 1 . 2]" 1
588 1 33 LEU MD2 1 81 LEU MD2 3.560 . 5.320 4.189 3.751 4.501 . 0 0 "[ . 1 . 2]" 1
589 1 5 VAL H 1 5 VAL MG1 2.580 . 3.360 2.216 2.123 2.317 . 0 0 "[ . 1 . 2]" 1
590 1 5 VAL H 1 5 VAL MG2 2.960 . 4.120 3.874 3.856 3.891 . 0 0 "[ . 1 . 2]" 1
591 1 1 MET ME 1 5 VAL H 3.490 . 5.180 4.409 4.085 4.806 . 0 0 "[ . 1 . 2]" 1
592 1 5 VAL MG1 1 6 GLU H 2.570 . 3.340 2.252 2.185 2.345 . 0 0 "[ . 1 . 2]" 1
593 1 7 PHE H 1 64 VAL MG1 4.300 . 6.800 6.217 5.924 6.600 . 0 0 "[ . 1 . 2]" 1
594 1 7 PHE H 1 56 ILE MD 3.700 . 5.600 5.140 4.757 5.507 . 0 0 "[ . 1 . 2]" 1
595 1 8 ILE H 1 64 VAL MG1 3.610 . 5.420 4.327 4.079 4.641 . 0 0 "[ . 1 . 2]" 1
596 1 4 THR MG 1 8 ILE H 3.170 . 4.540 4.190 3.956 4.374 . 0 0 "[ . 1 . 2]" 1
597 1 8 ILE H 1 63 MET ME 3.840 . 5.880 5.309 5.159 5.496 . 0 0 "[ . 1 . 2]" 1
598 1 8 ILE H 1 8 ILE MD 2.880 . 3.960 3.524 3.483 3.588 . 0 0 "[ . 1 . 2]" 1
599 1 8 ILE H 1 56 ILE MD 3.730 . 5.660 4.787 4.530 5.103 . 0 0 "[ . 1 . 2]" 1
600 1 8 ILE H 1 60 ILE MD 3.730 . 5.660 5.205 4.720 5.519 . 0 0 "[ . 1 . 2]" 1
601 1 5 VAL MG2 1 9 ASN H 3.320 . 4.840 3.953 3.804 4.159 . 0 0 "[ . 1 . 2]" 1
602 1 9 ASN H 1 63 MET ME 3.710 . 5.620 5.700 5.631 5.751 0.131 11 0 "[ . 1 . 2]" 1
603 1 8 ILE MD 1 9 ASN H 3.380 . 4.960 4.302 4.178 4.396 . 0 0 "[ . 1 . 2]" 1
604 1 10 ARG H 1 47 VAL MG1 3.490 . 5.180 4.151 3.893 4.402 . 0 0 "[ . 1 . 2]" 1
605 1 11 TRP H 1 64 VAL MG1 3.360 . 4.920 4.244 4.124 4.700 . 0 0 "[ . 1 . 2]" 1
606 1 11 TRP H 1 47 VAL MG2 3.750 . 5.700 5.196 4.885 5.540 . 0 0 "[ . 1 . 2]" 1
607 1 11 TRP H 1 47 VAL MG1 3.160 . 4.520 3.397 2.928 3.692 . 0 0 "[ . 1 . 2]" 1
608 1 11 TRP H 1 14 ILE MD 3.230 . 4.660 3.992 3.835 4.427 . 0 0 "[ . 1 . 2]" 1
609 1 12 GLN H 1 64 VAL MG1 3.350 . 4.900 4.239 4.015 4.750 . 0 0 "[ . 1 . 2]" 1
610 1 12 GLN H 1 15 ALA MB 3.850 . 5.900 5.053 4.838 5.275 . 0 0 "[ . 1 . 2]" 1
611 1 12 GLN H 1 63 MET ME 3.910 . 6.020 6.060 5.715 6.175 0.155 19 0 "[ . 1 . 2]" 1
612 1 12 GLN H 1 14 ILE MD 3.800 . 5.800 5.168 5.031 5.463 . 0 0 "[ . 1 . 2]" 1
613 1 13 ARG H 1 16 LEU MD1 3.320 . 4.830 4.428 3.917 4.907 0.077 10 0 "[ . 1 . 2]" 1
614 1 13 ARG H 1 14 ILE MD 3.780 . 5.750 5.204 5.125 5.318 . 0 0 "[ . 1 . 2]" 1
615 1 14 ILE H 1 16 LEU MD1 3.930 . 6.060 5.606 5.050 6.110 0.050 18 0 "[ . 1 . 2]" 1
616 1 14 ILE H 1 15 ALA MB 3.550 . 5.290 4.451 4.294 4.560 . 0 0 "[ . 1 . 2]" 1
617 1 16 LEU H 1 16 LEU MD1 2.950 . 4.100 3.696 3.572 3.773 . 0 0 "[ . 1 . 2]" 1
618 1 15 ALA MB 1 16 LEU H 2.500 . 3.200 2.518 2.409 2.652 . 0 0 "[ . 1 . 2]" 1
619 1 18 SER H 1 21 LEU MD2 3.290 . 4.780 4.108 3.912 4.275 . 0 0 "[ . 1 . 2]" 1
620 1 18 SER H 1 21 LEU MD1 3.330 . 4.860 4.750 4.613 4.867 0.007 9 0 "[ . 1 . 2]" 1
621 1 15 ALA MB 1 18 SER H 3.870 . 5.940 4.852 4.588 5.031 . 0 0 "[ . 1 . 2]" 1
622 1 19 GLN H 1 21 LEU MD2 3.570 . 5.340 5.381 5.273 5.447 0.107 13 0 "[ . 1 . 2]" 1
623 1 15 ALA MB 1 19 GLN H 3.650 . 5.500 4.801 4.696 4.939 . 0 0 "[ . 1 . 2]" 1
624 1 20 SER H 1 21 LEU MD2 3.480 . 5.160 5.162 5.092 5.201 0.041 16 0 "[ . 1 . 2]" 1
625 1 21 LEU H 1 21 LEU MD2 2.820 . 3.840 3.432 3.359 3.514 . 0 0 "[ . 1 . 2]" 1
626 1 21 LEU H 1 24 LEU MD1 3.250 . 4.700 3.763 3.481 3.965 . 0 0 "[ . 1 . 2]" 1
627 1 21 LEU H 1 21 LEU MD1 2.970 . 4.140 3.374 3.282 3.493 . 0 0 "[ . 1 . 2]" 1
628 1 21 LEU H 1 24 LEU MD2 4.060 . 6.320 5.796 5.634 5.951 . 0 0 "[ . 1 . 2]" 1
629 1 22 LEU H 1 78 LEU MD1 3.490 . 5.180 4.481 4.118 4.722 . 0 0 "[ . 1 . 2]" 1
630 1 21 LEU MD2 1 22 LEU H 3.550 . 5.290 4.506 4.391 4.595 . 0 0 "[ . 1 . 2]" 1
631 1 22 LEU H 1 78 LEU MD2 3.600 . 5.400 3.780 3.597 3.918 . 0 0 "[ . 1 . 2]" 1
632 1 21 LEU MD1 1 22 LEU H 3.250 . 4.700 2.501 2.300 2.715 . 0 0 "[ . 1 . 2]" 1
633 1 23 GLU H 1 78 LEU MD2 3.570 . 5.340 5.133 4.995 5.314 . 0 0 "[ . 1 . 2]" 1
634 1 24 LEU H 1 24 LEU MD1 3.300 . 4.800 3.555 3.492 3.662 . 0 0 "[ . 1 . 2]" 1
635 1 24 LEU H 1 24 LEU MD2 3.440 . 5.080 3.373 3.182 3.542 . 0 0 "[ . 1 . 2]" 1
636 1 24 LEU H 1 25 ALA MB 3.460 . 5.120 4.335 4.255 4.394 . 0 0 "[ . 1 . 2]" 1
637 1 25 ALA H 1 33 LEU MD1 3.270 . 4.740 3.135 2.904 3.344 . 0 0 "[ . 1 . 2]" 1
638 1 25 ALA H 1 33 LEU MD2 3.090 . 4.380 4.352 4.169 4.449 0.069 6 0 "[ . 1 . 2]" 1
639 1 25 ALA H 1 78 LEU MD2 3.360 . 4.920 4.165 3.963 4.410 . 0 0 "[ . 1 . 2]" 1
640 1 21 LEU MD1 1 25 ALA H 4.030 . 6.260 4.634 4.493 4.798 . 0 0 "[ . 1 . 2]" 1
641 1 22 LEU MD1 1 25 ALA H 4.280 . 6.760 4.653 4.347 4.936 . 0 0 "[ . 1 . 2]" 1
642 1 26 GLN H 1 81 LEU MD1 2.810 . 3.820 3.352 2.965 3.800 . 0 0 "[ . 1 . 2]" 1
643 1 26 GLN H 1 78 LEU MD2 3.070 . 5.070 4.808 4.549 5.116 0.046 20 0 "[ . 1 . 2]" 1
644 1 22 LEU MD1 1 26 GLN H 3.290 . 4.780 4.194 3.905 4.373 . 0 0 "[ . 1 . 2]" 1
645 1 26 GLN H 1 81 LEU MD2 3.540 . 5.280 4.517 4.159 4.950 . 0 0 "[ . 1 . 2]" 1
646 1 25 ALA MB 1 26 GLN H 2.690 . 3.580 2.504 2.409 2.667 . 0 0 "[ . 1 . 2]" 1
647 1 29 GLU H 1 32 LEU MD1 3.910 . 6.020 5.066 4.618 5.412 . 0 0 "[ . 1 . 2]" 1
648 1 30 TRP H 1 33 LEU MD2 3.880 . 5.960 5.169 5.038 5.337 . 0 0 "[ . 1 . 2]" 1
649 1 31 ASP H 1 34 LEU MD1 3.470 . 5.140 4.434 3.977 4.695 . 0 0 "[ . 1 . 2]" 1
650 1 24 LEU MD1 1 32 LEU H 3.350 . 4.900 4.466 4.375 4.557 . 0 0 "[ . 1 . 2]" 1
651 1 32 LEU H 1 32 LEU MD1 3.100 . 4.400 3.753 3.597 3.864 . 0 0 "[ . 1 . 2]" 1
652 1 33 LEU H 1 33 LEU MD1 3.360 . 4.920 4.225 4.145 4.280 . 0 0 "[ . 1 . 2]" 1
653 1 24 LEU MD1 1 33 LEU H 2.670 . 3.540 3.542 3.361 3.631 0.091 17 0 "[ . 1 . 2]" 1
654 1 33 LEU MD2 1 34 LEU H 3.140 . 4.480 4.053 3.793 4.359 . 0 0 "[ . 1 . 2]" 1
655 1 34 LEU H 1 34 LEU MD1 2.990 . 4.180 3.572 3.494 3.668 . 0 0 "[ . 1 . 2]" 1
656 1 34 LEU H 1 34 LEU MD2 2.800 . 3.800 3.488 3.346 3.588 . 0 0 "[ . 1 . 2]" 1
657 1 35 GLN H 1 38 VAL MG1 4.070 . 6.340 5.749 5.409 6.151 . 0 0 "[ . 1 . 2]" 1
658 1 36 GLN H 1 38 VAL MG2 3.520 . 5.240 4.639 4.439 4.856 . 0 0 "[ . 1 . 2]" 1
659 1 36 GLN H 1 38 VAL MG1 4.010 . 6.210 5.770 5.500 6.058 . 0 0 "[ . 1 . 2]" 1
660 1 33 LEU MD1 1 37 GLU H 3.610 . 5.420 4.621 4.383 4.835 . 0 0 "[ . 1 . 2]" 1
661 1 24 LEU MD1 1 37 GLU H 3.980 . 6.160 5.736 5.379 5.903 . 0 0 "[ . 1 . 2]" 1
662 1 37 GLU H 1 38 VAL MG2 3.120 . 4.440 3.990 3.891 4.106 . 0 0 "[ . 1 . 2]" 1
663 1 37 GLU H 1 38 VAL MG1 3.380 . 4.960 4.515 4.329 4.735 . 0 0 "[ . 1 . 2]" 1
664 1 21 LEU MD2 1 38 VAL H 4.080 . 6.360 5.307 4.942 5.801 . 0 0 "[ . 1 . 2]" 1
665 1 38 VAL H 1 38 VAL MG2 2.350 . 2.900 2.077 1.951 2.189 . 0 0 "[ . 1 . 2]" 1
666 1 38 VAL H 1 38 VAL MG1 2.560 . 3.320 2.268 2.181 2.372 . 0 0 "[ . 1 . 2]" 1
667 1 38 VAL MG2 1 39 SER H 2.650 . 3.500 2.052 1.924 2.196 . 0 0 "[ . 1 . 2]" 1
668 1 38 VAL MG1 1 39 SER H 3.090 . 4.370 4.018 3.977 4.068 . 0 0 "[ . 1 . 2]" 1
669 1 38 VAL MG2 1 40 TYR H 3.050 . 4.300 4.248 4.097 4.386 0.086 11 0 "[ . 1 . 2]" 1
670 1 41 LEU H 1 41 LEU MD1 3.000 . 4.200 3.661 3.582 3.739 . 0 0 "[ . 1 . 2]" 1
671 1 21 LEU MD2 1 41 LEU H 3.460 . 5.120 4.662 4.453 4.853 . 0 0 "[ . 1 . 2]" 1
672 1 41 LEU H 1 41 LEU MD2 2.630 . 3.460 3.353 3.290 3.414 . 0 0 "[ . 1 . 2]" 1
673 1 41 LEU H 1 44 ILE MD 3.440 . 5.080 4.350 4.201 4.560 . 0 0 "[ . 1 . 2]" 1
674 1 42 GLN H 1 44 ILE MD 4.100 . 6.400 5.393 5.262 5.566 . 0 0 "[ . 1 . 2]" 1
675 1 43 SER H 1 46 THR MG 3.610 . 5.420 4.066 3.933 4.199 . 0 0 "[ . 1 . 2]" 1
676 1 14 ILE MD 1 43 SER H 3.720 . 5.640 4.955 4.800 5.163 . 0 0 "[ . 1 . 2]" 1
677 1 43 SER H 1 44 ILE MD 3.860 . 5.920 5.310 5.168 5.475 . 0 0 "[ . 1 . 2]" 1
678 1 44 ILE H 1 47 VAL MG2 3.270 . 4.740 4.321 4.179 4.537 . 0 0 "[ . 1 . 2]" 1
679 1 44 ILE H 1 46 THR MG 3.220 . 4.640 4.255 4.171 4.414 . 0 0 "[ . 1 . 2]" 1
680 1 14 ILE MD 1 44 ILE H 3.020 . 4.240 3.373 3.236 3.584 . 0 0 "[ . 1 . 2]" 1
681 1 44 ILE H 1 44 ILE MD 3.030 . 4.260 3.611 3.561 3.691 . 0 0 "[ . 1 . 2]" 1
682 1 45 GLU H 1 47 VAL MG2 3.270 . 4.740 4.347 4.247 4.531 . 0 0 "[ . 1 . 2]" 1
683 1 14 ILE MD 1 45 GLU H 3.550 . 5.290 4.828 4.746 4.974 . 0 0 "[ . 1 . 2]" 1
684 1 44 ILE MD 1 45 GLU H 3.520 . 5.240 4.542 4.414 4.713 . 0 0 "[ . 1 . 2]" 1
685 1 46 THR H 1 47 VAL MG2 3.400 . 5.000 3.939 3.796 4.072 . 0 0 "[ . 1 . 2]" 1
686 1 47 VAL H 1 47 VAL MG2 2.530 . 3.260 2.202 2.141 2.273 . 0 0 "[ . 1 . 2]" 1
687 1 46 THR MG 1 47 VAL H 2.590 . 3.380 2.467 2.327 2.586 . 0 0 "[ . 1 . 2]" 1
688 1 47 VAL H 1 47 VAL MG1 2.810 . 3.820 2.411 2.325 2.515 . 0 0 "[ . 1 . 2]" 1
689 1 14 ILE MD 1 47 VAL H 3.180 . 4.560 3.999 3.691 4.206 . 0 0 "[ . 1 . 2]" 1
690 1 47 VAL MG1 1 48 MET H 3.850 . 5.900 4.068 4.018 4.171 . 0 0 "[ . 1 . 2]" 1
691 1 86 LEU MD2 1 87 ASP H 3.630 . 5.460 4.724 4.665 4.774 . 0 0 "[ . 1 . 2]" 1
692 1 57 THR H 1 60 ILE MD 3.200 . 4.600 2.581 2.258 2.772 . 0 0 "[ . 1 . 2]" 1
693 1 60 ILE H 1 64 VAL MG1 4.170 . 6.540 5.914 5.793 6.046 . 0 0 "[ . 1 . 2]" 1
694 1 4 THR MG 1 60 ILE H 3.840 . 5.880 5.746 5.490 5.934 0.054 7 0 "[ . 1 . 2]" 1
695 1 60 ILE H 1 63 MET ME 3.360 . 4.920 4.133 3.815 5.015 0.095 4 0 "[ . 1 . 2]" 1
696 1 60 ILE H 1 60 ILE MD 3.000 . 4.200 3.589 3.476 3.664 . 0 0 "[ . 1 . 2]" 1
697 1 61 GLN H 1 64 VAL MG1 3.510 . 5.220 5.088 4.985 5.260 0.040 18 0 "[ . 1 . 2]" 1
698 1 4 THR MG 1 61 GLN H 4.170 . 6.540 6.101 5.701 6.471 . 0 0 "[ . 1 . 2]" 1
699 1 57 THR MG 1 61 GLN H 3.000 . 4.200 3.700 3.515 4.239 0.039 19 0 "[ . 1 . 2]" 1
700 1 61 GLN H 1 64 VAL MG2 3.410 . 5.020 4.086 3.934 4.224 . 0 0 "[ . 1 . 2]" 1
701 1 61 GLN H 1 63 MET ME 3.780 . 5.750 4.953 4.774 5.714 . 0 0 "[ . 1 . 2]" 1
702 1 60 ILE MD 1 61 GLN H 3.480 . 5.160 4.633 4.506 4.783 . 0 0 "[ . 1 . 2]" 1
703 1 62 ASP H 1 64 VAL MG2 3.300 . 4.800 4.378 4.254 4.590 . 0 0 "[ . 1 . 2]" 1
704 1 77 LEU H 1 78 LEU MD1 3.750 . 5.700 5.280 5.208 5.374 . 0 0 "[ . 1 . 2]" 1
705 1 22 LEU MD2 1 77 LEU H 3.500 . 5.200 4.682 4.337 5.048 . 0 0 "[ . 1 . 2]" 1
706 1 77 LEU H 1 77 LEU MD1 2.980 . 4.160 3.711 3.588 3.812 . 0 0 "[ . 1 . 2]" 1
707 1 22 LEU MD1 1 77 LEU H 2.980 . 4.160 3.957 3.837 4.154 . 0 0 "[ . 1 . 2]" 1
708 1 77 LEU H 1 77 LEU MD2 2.610 . 3.420 3.308 3.087 3.500 0.080 20 0 "[ . 1 . 2]" 1
709 1 64 VAL H 1 64 VAL MG1 2.530 . 3.260 2.272 2.135 2.337 . 0 0 "[ . 1 . 2]" 1
710 1 63 MET ME 1 64 VAL H 2.900 . 4.000 3.812 3.546 4.002 0.002 3 0 "[ . 1 . 2]" 1
711 1 64 VAL MG1 1 65 ALA H 3.140 . 4.480 4.093 4.031 4.172 . 0 0 "[ . 1 . 2]" 1
712 1 64 VAL MG2 1 65 ALA H 3.030 . 4.260 2.418 2.202 2.598 . 0 0 "[ . 1 . 2]" 1
713 1 63 MET ME 1 65 ALA H 4.190 . 6.580 6.048 5.841 6.185 . 0 0 "[ . 1 . 2]" 1
714 1 65 ALA H 1 68 ILE MD 3.340 . 4.880 4.382 3.997 4.665 . 0 0 "[ . 1 . 2]" 1
715 1 15 ALA MB 1 67 TYR H 3.240 . 4.680 4.484 4.392 4.626 . 0 0 "[ . 1 . 2]" 1
716 1 68 ILE H 1 71 THR MG 3.450 . 5.450 4.287 4.173 4.435 . 0 0 "[ . 1 . 2]" 1
717 1 64 VAL MG2 1 68 ILE H 3.700 . 5.600 4.822 4.666 5.006 . 0 0 "[ . 1 . 2]" 1
718 1 15 ALA MB 1 68 ILE H 3.480 . 5.160 4.661 4.512 4.816 . 0 0 "[ . 1 . 2]" 1
719 1 68 ILE H 1 68 ILE MD 3.100 . 4.400 3.688 3.612 3.754 . 0 0 "[ . 1 . 2]" 1
720 1 69 LYS H 1 71 THR MG 3.420 . 5.040 4.384 4.277 4.499 . 0 0 "[ . 1 . 2]" 1
721 1 15 ALA MB 1 69 LYS H 3.980 . 6.160 5.552 5.422 5.747 . 0 0 "[ . 1 . 2]" 1
722 1 65 ALA MB 1 69 LYS H 4.200 . 6.600 4.632 4.441 4.837 . 0 0 "[ . 1 . 2]" 1
723 1 70 GLN H 1 72 LEU MD1 3.730 . 5.660 5.379 5.170 5.604 . 0 0 "[ . 1 . 2]" 1
724 1 70 GLN H 1 71 THR MG 3.140 . 4.480 4.357 4.066 4.534 0.054 3 0 "[ . 1 . 2]" 1
725 1 15 ALA MB 1 70 GLN H 3.030 . 4.260 4.248 4.133 4.347 0.087 3 0 "[ . 1 . 2]" 1
726 1 72 LEU H 1 72 LEU MD2 3.120 . 4.440 3.595 3.507 3.680 . 0 0 "[ . 1 . 2]" 1
727 1 71 THR MG 1 72 LEU H 2.930 . 4.060 2.436 2.235 2.572 . 0 0 "[ . 1 . 2]" 1
728 1 71 THR MG 1 73 ASP H 3.480 . 5.160 4.600 4.483 4.743 . 0 0 "[ . 1 . 2]" 1
729 1 22 LEU MD2 1 74 ASN H 3.150 . 4.500 4.222 4.090 4.492 . 0 0 "[ . 1 . 2]" 1
730 1 74 ASN H 1 77 LEU MD1 3.450 . 5.100 4.608 4.371 4.866 . 0 0 "[ . 1 . 2]" 1
731 1 22 LEU MD1 1 74 ASN H 3.690 . 5.580 5.295 4.980 5.552 . 0 0 "[ . 1 . 2]" 1
732 1 74 ASN H 1 77 LEU MD2 4.090 . 6.380 6.174 5.834 6.368 . 0 0 "[ . 1 . 2]" 1
733 1 75 GLU H 1 77 LEU MD1 4.110 . 6.420 5.511 5.265 5.710 . 0 0 "[ . 1 . 2]" 1
734 1 72 LEU MD2 1 75 GLU H 4.170 . 6.540 5.287 5.113 5.417 . 0 0 "[ . 1 . 2]" 1
735 1 71 THR MG 1 75 GLU H 3.700 . 5.600 4.919 4.740 5.183 . 0 0 "[ . 1 . 2]" 1
736 1 22 LEU MD1 1 75 GLU H 3.680 . 5.560 4.983 4.758 5.233 . 0 0 "[ . 1 . 2]" 1
737 1 78 LEU H 1 81 LEU MD1 3.950 . 6.100 5.403 5.120 5.821 . 0 0 "[ . 1 . 2]" 1
738 1 78 LEU H 1 78 LEU MD1 3.520 . 5.240 3.654 3.611 3.694 . 0 0 "[ . 1 . 2]" 1
739 1 22 LEU MD2 1 78 LEU H 3.800 . 5.800 4.866 4.597 5.184 . 0 0 "[ . 1 . 2]" 1
740 1 77 LEU MD1 1 78 LEU H 3.540 . 5.280 4.756 4.677 4.843 . 0 0 "[ . 1 . 2]" 1
741 1 77 LEU MD2 1 78 LEU H 3.790 . 5.780 4.736 4.653 4.798 . 0 0 "[ . 1 . 2]" 1
742 1 78 LEU MD1 1 79 LYS H 3.530 . 5.260 4.383 4.293 4.525 . 0 0 "[ . 1 . 2]" 1
743 1 79 LYS H 1 82 LEU MD1 3.670 . 5.540 4.835 4.721 5.024 . 0 0 "[ . 1 . 2]" 1
744 1 78 LEU MD2 1 79 LYS H 3.680 . 5.560 4.709 4.659 4.787 . 0 0 "[ . 1 . 2]" 1
745 1 81 LEU MD1 1 82 LEU H 3.400 . 5.000 4.453 4.331 4.605 . 0 0 "[ . 1 . 2]" 1
746 1 82 LEU H 1 82 LEU MD1 3.210 . 4.620 3.769 3.729 3.811 . 0 0 "[ . 1 . 2]" 1
747 1 78 LEU MD2 1 82 LEU H 3.550 . 5.300 4.663 4.430 4.949 . 0 0 "[ . 1 . 2]" 1
748 1 83 GLN H 1 86 LEU MD1 3.340 . 4.880 4.582 4.296 4.911 0.031 3 0 "[ . 1 . 2]" 1
749 1 82 LEU MD1 1 83 GLN H 3.600 . 5.400 4.903 4.821 4.990 . 0 0 "[ . 1 . 2]" 1
750 1 81 LEU MD2 1 83 GLN H 3.680 . 5.560 4.943 4.886 5.034 . 0 0 "[ . 1 . 2]" 1
751 1 91 SER H 1 93 ILE MD 3.880 . 5.960 5.359 5.078 5.821 . 0 0 "[ . 1 . 2]" 1
752 1 81 LEU MD2 1 85 ARG H 3.110 . 4.420 3.926 3.815 4.042 . 0 0 "[ . 1 . 2]" 1
753 1 86 LEU H 1 86 LEU MD2 2.940 . 4.080 3.407 3.288 3.512 . 0 0 "[ . 1 . 2]" 1
754 1 86 LEU H 1 89 LEU MD1 3.300 . 4.800 4.292 4.018 4.559 . 0 0 "[ . 1 . 2]" 1
755 1 92 LEU H 1 92 LEU MD1 2.990 . 4.180 3.694 3.601 3.863 . 0 0 "[ . 1 . 2]" 1
756 1 92 LEU H 1 92 LEU MD2 2.950 . 4.100 3.354 3.041 3.558 . 0 0 "[ . 1 . 2]" 1
757 1 92 LEU H 1 93 ILE MD 3.810 . 5.820 5.176 4.962 5.341 . 0 0 "[ . 1 . 2]" 1
758 1 89 LEU H 1 89 LEU MD2 2.960 . 4.120 3.330 3.120 3.510 . 0 0 "[ . 1 . 2]" 1
759 1 89 LEU H 1 92 LEU MD1 3.350 . 4.900 4.258 3.864 4.691 . 0 0 "[ . 1 . 2]" 1
760 1 86 LEU MD2 1 89 LEU H 3.940 . 6.080 4.806 4.545 5.071 . 0 0 "[ . 1 . 2]" 1
761 1 89 LEU H 1 93 ILE MD 4.140 . 6.480 5.647 5.384 5.931 . 0 0 "[ . 1 . 2]" 1
762 1 89 LEU MD2 1 90 SER H 3.600 . 5.400 4.721 4.640 4.821 . 0 0 "[ . 1 . 2]" 1
763 1 86 LEU MD2 1 90 SER H 3.770 . 5.740 4.892 4.702 5.167 . 0 0 "[ . 1 . 2]" 1
764 1 89 LEU MD1 1 90 SER H 3.460 . 5.120 4.603 4.395 4.734 . 0 0 "[ . 1 . 2]" 1
765 1 90 SER H 1 93 ILE MD 3.370 . 4.940 4.179 3.745 4.693 . 0 0 "[ . 1 . 2]" 1
766 1 92 LEU MD1 1 93 ILE H 3.560 . 5.320 4.529 4.234 4.874 . 0 0 "[ . 1 . 2]" 1
767 1 92 LEU MD2 1 93 ILE H 3.640 . 5.480 4.687 4.538 4.770 . 0 0 "[ . 1 . 2]" 1
768 1 93 ILE H 1 93 ILE MD 2.960 . 4.120 3.564 3.476 3.662 . 0 0 "[ . 1 . 2]" 1
769 1 95 GLN H 1 96 VAL MG1 3.560 . 5.320 4.079 3.850 4.533 . 0 0 "[ . 1 . 2]" 1
770 1 96 VAL H 1 96 VAL MG2 2.800 . 3.800 2.128 1.996 2.223 . 0 0 "[ . 1 . 2]" 1
771 1 97 LEU MD1 1 98 PHE H 3.750 . 5.700 5.061 4.960 5.163 . 0 0 "[ . 1 . 2]" 1
772 1 97 LEU MD2 1 98 PHE H 3.550 . 5.300 2.733 2.485 3.172 . 0 0 "[ . 1 . 2]" 1
773 1 4 THR MG 1 56 ILE H 3.510 . 5.220 4.971 4.652 5.216 . 0 0 "[ . 1 . 2]" 1
774 1 56 ILE H 1 60 ILE MD 3.850 . 5.900 5.654 5.167 6.030 0.130 16 0 "[ . 1 . 2]" 1
775 1 113 ILE MD 1 114 GLU H 3.770 . 5.740 4.896 3.809 5.113 . 0 0 "[ . 1 . 2]" 1
776 1 11 TRP HE1 1 68 ILE MD 3.130 . 4.460 4.211 3.838 4.469 0.009 1 0 "[ . 1 . 2]" 1
777 1 11 TRP HE1 1 56 ILE MD 3.900 . 6.000 5.493 5.216 5.935 . 0 0 "[ . 1 . 2]" 1
778 1 30 TRP HE1 1 89 LEU MD2 3.670 . 5.540 5.105 4.534 5.605 0.065 11 0 "[ . 1 . 2]" 1
779 1 74 ASN HD21 1 77 LEU MD1 3.090 . 4.370 3.007 2.521 3.694 . 0 0 "[ . 1 . 2]" 1
780 1 74 ASN HD22 1 77 LEU MD1 3.460 . 5.120 4.274 3.845 4.648 . 0 0 "[ . 1 . 2]" 1
781 1 76 GLN HE22 1 77 LEU MD2 3.460 . 5.120 4.780 3.932 5.193 0.073 1 0 "[ . 1 . 2]" 1
782 1 12 GLN HE22 1 16 LEU MD1 3.250 . 4.700 4.102 3.778 4.521 . 0 0 "[ . 1 . 2]" 1
783 1 12 GLN HE22 1 16 LEU MD2 3.770 . 5.740 5.466 4.676 5.778 0.038 10 0 "[ . 1 . 2]" 1
784 1 35 GLN HE22 1 38 VAL MG2 3.910 . 6.020 4.863 4.438 5.542 . 0 0 "[ . 1 . 2]" 1
785 1 5 VAL MG1 1 9 ASN HD21 3.370 . 4.940 3.930 3.471 4.989 0.049 18 0 "[ . 1 . 2]" 1
786 1 5 VAL MG2 1 9 ASN HD21 3.010 . 4.220 2.692 2.086 3.635 . 0 0 "[ . 1 . 2]" 1
787 1 5 VAL MG1 1 9 ASN HD22 3.370 . 4.940 4.044 3.277 4.699 . 0 0 "[ . 1 . 2]" 1
788 1 5 VAL MG2 1 9 ASN HD22 3.010 . 4.220 2.122 1.876 2.574 . 0 0 "[ . 1 . 2]" 1
789 1 76 GLN HE21 1 77 LEU MD2 3.460 . 5.120 3.949 3.304 4.340 . 0 0 "[ . 1 . 2]" 1
790 1 12 GLN HE21 1 16 LEU MD1 3.170 . 4.540 3.181 2.435 3.698 . 0 0 "[ . 1 . 2]" 1
791 1 12 GLN HE21 1 16 LEU MD2 3.230 . 4.660 4.159 3.413 4.418 . 0 0 "[ . 1 . 2]" 1
792 1 21 LEU MD2 1 40 TYR H 3.040 . 4.280 3.987 3.690 4.229 . 0 0 "[ . 1 . 2]" 1
793 1 89 LEU MD2 1 92 LEU H 3.790 . 5.780 4.995 4.804 5.227 . 0 0 "[ . 1 . 2]" 1
794 1 24 LEU MD2 1 33 LEU H 3.410 . 5.020 4.586 4.356 4.785 . 0 0 "[ . 1 . 2]" 1
795 1 32 LEU H 1 32 LEU MD2 2.750 . 3.700 3.302 3.130 3.553 . 0 0 "[ . 1 . 2]" 1
796 1 22 LEU MD1 1 74 ASN HD21 3.120 . 4.440 4.104 3.818 4.563 0.123 13 0 "[ . 1 . 2]" 1
797 1 22 LEU MD2 1 74 ASN HD21 2.840 . 3.880 2.108 1.795 3.138 0.005 20 0 "[ . 1 . 2]" 1
798 1 22 LEU MD2 1 74 ASN HD22 2.880 . 3.960 3.015 2.764 3.221 . 0 0 "[ . 1 . 2]" 1
799 1 22 LEU MD2 1 26 GLN HE22 3.500 . 5.200 3.850 2.976 4.858 . 0 0 "[ . 1 . 2]" 1
800 1 22 LEU MD2 1 26 GLN HE21 3.500 . 5.200 4.165 3.368 5.226 0.026 16 0 "[ . 1 . 2]" 1
801 1 35 GLN HE21 1 38 VAL MG2 3.910 . 6.020 5.191 4.838 5.733 . 0 0 "[ . 1 . 2]" 1
802 1 5 VAL MG1 1 9 ASN QD 3.070 . 4.340 3.520 3.029 4.293 . 0 0 "[ . 1 . 2]" 1
803 1 5 VAL MG2 1 9 ASN QD 2.730 . 3.660 2.003 1.856 2.524 . 0 0 "[ . 1 . 2]" 1
804 1 7 PHE H 1 7 PHE QB 2.780 . 3.760 2.164 2.142 2.177 . 0 0 "[ . 1 . 2]" 1
805 1 7 PHE QB 1 8 ILE H 3.100 . 4.400 2.421 2.312 2.523 . 0 0 "[ . 1 . 2]" 1
806 1 7 PHE QB 1 53 PRO HD2 3.690 . 5.580 3.043 2.702 3.313 . 0 0 "[ . 1 . 2]" 1
807 1 7 PHE QB 1 53 PRO HD3 4.190 . 6.580 3.618 3.073 4.284 . 0 0 "[ . 1 . 2]" 1
808 1 11 TRP H 1 11 TRP QB 2.950 . 4.100 2.351 2.260 2.397 . 0 0 "[ . 1 . 2]" 1
809 1 11 TRP HE3 1 14 ILE QG 3.450 . 5.100 4.177 4.108 4.294 . 0 0 "[ . 1 . 2]" 1
810 1 14 ILE H 1 14 ILE QG 3.210 . 4.620 2.209 2.046 2.338 . 0 0 "[ . 1 . 2]" 1
811 1 22 LEU MD1 1 26 GLN QE 3.570 . 5.340 3.538 3.099 4.770 . 0 0 "[ . 1 . 2]" 1
812 1 22 LEU MD2 1 26 GLN QE 3.120 . 4.440 3.541 2.794 4.471 0.031 16 0 "[ . 1 . 2]" 1
813 1 27 ARG QB 1 28 GLY H 3.130 . 4.460 3.066 2.874 3.368 . 0 0 "[ . 1 . 2]" 1
814 1 28 GLY QA 1 30 TRP H 3.390 . 4.980 4.156 3.900 4.391 . 0 0 "[ . 1 . 2]" 1
815 1 35 GLN QE 1 38 VAL MG2 3.460 . 5.120 4.461 4.114 5.017 . 0 0 "[ . 1 . 2]" 1
816 1 40 TYR H 1 40 TYR QB 2.850 . 3.900 2.166 2.117 2.224 . 0 0 "[ . 1 . 2]" 1
817 1 40 TYR QB 1 41 LEU H 3.180 . 4.560 2.267 2.190 2.474 . 0 0 "[ . 1 . 2]" 1
818 1 41 LEU H 1 41 LEU QB 2.890 . 3.980 2.441 2.415 2.470 . 0 0 "[ . 1 . 2]" 1
819 1 44 ILE MG 1 45 GLU QG 3.720 . 5.640 3.709 3.039 4.984 . 0 0 "[ . 1 . 2]" 1
820 1 45 GLU H 1 45 GLU QG 3.320 . 4.830 2.421 2.125 3.590 . 0 0 "[ . 1 . 2]" 1
821 1 45 GLU HA 1 45 GLU QG 2.910 . 4.020 2.438 2.338 2.485 . 0 0 "[ . 1 . 2]" 1
822 1 45 GLU QG 1 46 THR H 3.500 . 5.200 4.306 4.189 4.799 . 0 0 "[ . 1 . 2]" 1
823 1 70 GLN H 1 70 GLN QB 2.910 . 4.020 2.453 2.372 2.530 . 0 0 "[ . 1 . 2]" 1
824 1 73 ASP QB 1 74 ASN H 3.010 . 4.220 2.384 2.267 2.467 . 0 0 "[ . 1 . 2]" 1
825 1 74 ASN H 1 75 GLU QB 3.680 . 5.560 4.346 4.262 4.437 . 0 0 "[ . 1 . 2]" 1
826 1 75 GLU H 1 75 GLU QB 2.780 . 3.760 2.205 2.180 2.242 . 0 0 "[ . 1 . 2]" 1
827 1 75 GLU H 1 75 GLU QG 3.260 . 4.720 3.990 3.975 4.009 . 0 0 "[ . 1 . 2]" 1
828 1 75 GLU QB 1 76 GLN H 3.220 . 4.640 2.907 2.816 3.011 . 0 0 "[ . 1 . 2]" 1
829 1 75 GLU QG 1 78 LEU HB3 4.210 . 6.620 4.379 4.067 4.564 . 0 0 "[ . 1 . 2]" 1
830 1 75 GLU QG 1 78 LEU MD1 3.800 . 5.800 2.601 2.425 2.880 . 0 0 "[ . 1 . 2]" 1
831 1 76 GLN H 1 76 GLN QB 2.570 . 3.340 2.254 2.210 2.315 . 0 0 "[ . 1 . 2]" 1
832 1 76 GLN QE 1 77 LEU MD2 3.150 . 4.500 3.770 3.142 4.133 . 0 0 "[ . 1 . 2]" 1
833 1 79 LYS QB 1 80 GLY H 2.830 . 3.860 2.380 2.245 2.496 . 0 0 "[ . 1 . 2]" 1
834 1 80 GLY QA 1 81 LEU H 2.670 . 3.540 2.648 2.527 2.733 . 0 0 "[ . 1 . 2]" 1
835 1 105 LEU MD1 1 106 VAL QG 3.440 . 5.080 4.154 4.055 4.333 . 0 0 "[ . 1 . 2]" 1
836 1 105 LEU MD2 1 106 VAL QG 4.100 . 6.400 5.353 5.141 5.691 . 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 140
_Distance_constraint_stats_list.Viol_count 582
_Distance_constraint_stats_list.Viol_total 437.973
_Distance_constraint_stats_list.Viol_max 0.148
_Distance_constraint_stats_list.Viol_rms 0.0205
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0078
_Distance_constraint_stats_list.Viol_average_violations_only 0.0376
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 MET 0.095 0.066 1 0 "[ . 1 . 2]"
1 2 THR 0.500 0.104 13 0 "[ . 1 . 2]"
1 3 SER 1.932 0.148 11 0 "[ . 1 . 2]"
1 4 THR 0.194 0.042 8 0 "[ . 1 . 2]"
1 5 VAL 0.095 0.066 1 0 "[ . 1 . 2]"
1 6 GLU 0.655 0.104 13 0 "[ . 1 . 2]"
1 7 PHE 2.076 0.148 11 0 "[ . 1 . 2]"
1 8 ILE 0.356 0.080 9 0 "[ . 1 . 2]"
1 9 ASN 0.064 0.046 18 0 "[ . 1 . 2]"
1 10 ARG 0.245 0.049 11 0 "[ . 1 . 2]"
1 11 TRP 0.528 0.044 11 0 "[ . 1 . 2]"
1 12 GLN 0.322 0.080 9 0 "[ . 1 . 2]"
1 13 ARG 0.403 0.051 4 0 "[ . 1 . 2]"
1 14 ILE 0.111 0.043 20 0 "[ . 1 . 2]"
1 15 ALA 1.683 0.100 10 0 "[ . 1 . 2]"
1 16 LEU 0.376 0.046 12 0 "[ . 1 . 2]"
1 17 LEU 0.351 0.051 4 0 "[ . 1 . 2]"
1 18 SER 0.314 0.050 20 0 "[ . 1 . 2]"
1 19 GLN 2.303 0.106 16 0 "[ . 1 . 2]"
1 20 SER 0.415 0.046 12 0 "[ . 1 . 2]"
1 21 LEU 0.172 0.024 6 0 "[ . 1 . 2]"
1 22 LEU 0.325 0.050 20 0 "[ . 1 . 2]"
1 23 GLU 1.222 0.106 16 0 "[ . 1 . 2]"
1 24 LEU 0.199 0.036 10 0 "[ . 1 . 2]"
1 25 ALA 0.160 0.024 6 0 "[ . 1 . 2]"
1 26 GLN 0.032 0.018 12 0 "[ . 1 . 2]"
1 27 ARG 0.217 0.060 11 0 "[ . 1 . 2]"
1 30 TRP 0.013 0.012 20 0 "[ . 1 . 2]"
1 31 ASP 0.469 0.058 20 0 "[ . 1 . 2]"
1 33 LEU 0.266 0.056 9 0 "[ . 1 . 2]"
1 34 LEU 0.013 0.012 20 0 "[ . 1 . 2]"
1 35 GLN 0.469 0.058 20 0 "[ . 1 . 2]"
1 36 GLN 0.007 0.007 12 0 "[ . 1 . 2]"
1 37 GLU 0.266 0.056 9 0 "[ . 1 . 2]"
1 38 VAL 1.615 0.134 9 0 "[ . 1 . 2]"
1 39 SER 0.292 0.064 14 0 "[ . 1 . 2]"
1 40 TYR 0.897 0.123 3 0 "[ . 1 . 2]"
1 41 LEU 0.029 0.029 12 0 "[ . 1 . 2]"
1 42 GLN 1.624 0.134 9 0 "[ . 1 . 2]"
1 43 SER 1.227 0.110 17 0 "[ . 1 . 2]"
1 44 ILE 2.306 0.139 8 0 "[ . 1 . 2]"
1 45 GLU 0.614 0.079 20 0 "[ . 1 . 2]"
1 46 THR 0.008 0.008 7 0 "[ . 1 . 2]"
1 47 VAL 0.935 0.110 17 0 "[ . 1 . 2]"
1 48 MET 1.416 0.139 8 0 "[ . 1 . 2]"
1 49 GLU 0.585 0.079 20 0 "[ . 1 . 2]"
1 57 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 ARG 0.228 0.045 15 0 "[ . 1 . 2]"
1 59 SER 0.265 0.063 10 0 "[ . 1 . 2]"
1 60 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 GLN 0.035 0.019 13 0 "[ . 1 . 2]"
1 62 ASP 0.716 0.131 18 0 "[ . 1 . 2]"
1 63 MET 0.425 0.063 10 0 "[ . 1 . 2]"
1 64 VAL 0.433 0.071 9 0 "[ . 1 . 2]"
1 65 ALA 0.060 0.020 18 0 "[ . 1 . 2]"
1 66 GLY 0.536 0.131 18 0 "[ . 1 . 2]"
1 67 TYR 0.222 0.057 15 0 "[ . 1 . 2]"
1 68 ILE 0.502 0.071 9 0 "[ . 1 . 2]"
1 69 LYS 0.800 0.087 18 0 "[ . 1 . 2]"
1 70 GLN 0.048 0.020 3 0 "[ . 1 . 2]"
1 71 THR 0.066 0.039 18 0 "[ . 1 . 2]"
1 72 LEU 0.108 0.029 13 0 "[ . 1 . 2]"
1 73 ASP 1.224 0.087 18 0 "[ . 1 . 2]"
1 74 ASN 0.018 0.018 9 0 "[ . 1 . 2]"
1 75 GLU 0.003 0.003 16 0 "[ . 1 . 2]"
1 76 GLN 0.499 0.085 19 0 "[ . 1 . 2]"
1 77 LEU 0.504 0.084 12 0 "[ . 1 . 2]"
1 78 LEU 0.049 0.021 14 0 "[ . 1 . 2]"
1 79 LYS 1.362 0.111 20 0 "[ . 1 . 2]"
1 80 GLY 1.542 0.098 6 0 "[ . 1 . 2]"
1 81 LEU 0.393 0.055 10 0 "[ . 1 . 2]"
1 82 LEU 0.091 0.023 20 0 "[ . 1 . 2]"
1 83 GLN 1.550 0.111 20 0 "[ . 1 . 2]"
1 84 GLN 1.358 0.098 6 0 "[ . 1 . 2]"
1 85 ARG 0.357 0.055 10 0 "[ . 1 . 2]"
1 86 LEU 0.109 0.039 20 0 "[ . 1 . 2]"
1 87 ASP 0.759 0.094 8 0 "[ . 1 . 2]"
1 88 GLU 0.361 0.072 19 0 "[ . 1 . 2]"
1 89 LEU 0.033 0.015 9 0 "[ . 1 . 2]"
1 90 SER 0.065 0.039 20 0 "[ . 1 . 2]"
1 91 SER 0.570 0.094 8 0 "[ . 1 . 2]"
1 92 LEU 0.085 0.035 9 0 "[ . 1 . 2]"
1 93 ILE 0.015 0.015 9 0 "[ . 1 . 2]"
1 94 GLY 0.016 0.014 5 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 1 MET O 1 5 VAL H 2.000 . 2.200 2.107 1.992 2.266 0.066 1 0 "[ . 1 . 2]" 2
2 1 1 MET O 1 5 VAL N 3.000 2.850 3.300 2.984 2.855 3.165 . 0 0 "[ . 1 . 2]" 2
3 1 2 THR O 1 6 GLU H 2.000 . 2.200 2.199 2.013 2.304 0.104 13 0 "[ . 1 . 2]" 2
4 1 2 THR O 1 6 GLU N 3.000 2.850 3.300 3.165 2.971 3.287 . 0 0 "[ . 1 . 2]" 2
5 1 3 SER O 1 7 PHE H 2.000 . 2.200 2.297 2.239 2.348 0.148 11 0 "[ . 1 . 2]" 2
6 1 3 SER O 1 7 PHE N 3.000 2.850 3.300 3.192 3.122 3.266 . 0 0 "[ . 1 . 2]" 2
7 1 4 THR O 1 8 ILE H 2.000 . 2.200 2.147 2.009 2.242 0.042 8 0 "[ . 1 . 2]" 2
8 1 4 THR O 1 8 ILE N 3.000 2.850 3.300 3.077 2.947 3.170 . 0 0 "[ . 1 . 2]" 2
9 1 5 VAL O 1 9 ASN H 2.000 . 2.200 2.073 1.967 2.182 . 0 0 "[ . 1 . 2]" 2
10 1 5 VAL O 1 9 ASN N 3.000 2.850 3.300 3.043 2.925 3.151 . 0 0 "[ . 1 . 2]" 2
11 1 6 GLU O 1 10 ARG H 2.000 . 2.200 2.165 2.043 2.249 0.049 11 0 "[ . 1 . 2]" 2
12 1 6 GLU O 1 10 ARG N 3.000 2.850 3.300 3.086 2.986 3.187 . 0 0 "[ . 1 . 2]" 2
13 1 7 PHE O 1 11 TRP H 2.000 . 2.200 2.185 2.103 2.244 0.044 11 0 "[ . 1 . 2]" 2
14 1 7 PHE O 1 11 TRP N 3.000 2.850 3.300 3.124 2.998 3.206 . 0 0 "[ . 1 . 2]" 2
15 1 8 ILE O 1 12 GLN H 2.000 . 2.200 2.135 2.018 2.280 0.080 9 0 "[ . 1 . 2]" 2
16 1 8 ILE O 1 12 GLN N 3.000 2.850 3.300 3.073 2.951 3.244 . 0 0 "[ . 1 . 2]" 2
17 1 9 ASN O 1 13 ARG H 2.000 . 2.200 2.117 2.030 2.246 0.046 18 0 "[ . 1 . 2]" 2
18 1 9 ASN O 1 13 ARG N 3.000 2.850 3.300 3.004 2.902 3.148 . 0 0 "[ . 1 . 2]" 2
19 1 10 ARG O 1 14 ILE H 2.000 . 2.200 2.006 1.953 2.140 . 0 0 "[ . 1 . 2]" 2
20 1 10 ARG O 1 14 ILE N 3.000 2.850 3.300 2.902 2.807 3.048 0.043 20 0 "[ . 1 . 2]" 2
21 1 11 TRP O 1 15 ALA H 2.000 . 2.200 2.208 2.050 2.241 0.041 11 0 "[ . 1 . 2]" 2
22 1 11 TRP O 1 15 ALA N 3.000 2.850 3.300 3.138 2.994 3.186 . 0 0 "[ . 1 . 2]" 2
23 1 12 GLN O 1 16 LEU H 2.000 . 2.200 2.175 2.052 2.235 0.035 19 0 "[ . 1 . 2]" 2
24 1 12 GLN O 1 16 LEU N 3.000 2.850 3.300 3.118 3.000 3.194 . 0 0 "[ . 1 . 2]" 2
25 1 13 ARG O 1 17 LEU H 2.000 . 2.200 1.936 1.906 1.981 . 0 0 "[ . 1 . 2]" 2
26 1 13 ARG O 1 17 LEU N 3.000 2.850 3.300 2.841 2.799 2.928 0.051 4 0 "[ . 1 . 2]" 2
27 1 14 ILE O 1 18 SER H 2.000 . 2.200 2.072 1.945 2.199 . 0 0 "[ . 1 . 2]" 2
28 1 14 ILE O 1 18 SER N 3.000 2.850 3.300 3.004 2.830 3.130 0.020 12 0 "[ . 1 . 2]" 2
29 1 15 ALA O 1 19 GLN H 2.000 . 2.200 2.265 2.235 2.300 0.100 10 0 "[ . 1 . 2]" 2
30 1 15 ALA O 1 19 GLN N 3.000 2.850 3.300 3.211 3.145 3.256 . 0 0 "[ . 1 . 2]" 2
31 1 16 LEU O 1 20 SER H 2.000 . 2.200 2.192 2.097 2.246 0.046 12 0 "[ . 1 . 2]" 2
32 1 16 LEU O 1 20 SER N 3.000 2.850 3.300 3.107 2.978 3.192 . 0 0 "[ . 1 . 2]" 2
33 1 17 LEU O 1 21 LEU H 2.000 . 2.200 1.946 1.891 2.010 0.009 1 0 "[ . 1 . 2]" 2
34 1 17 LEU O 1 21 LEU N 3.000 2.850 3.300 2.913 2.846 2.989 0.004 1 0 "[ . 1 . 2]" 2
35 1 18 SER O 1 22 LEU H 2.000 . 2.200 2.198 2.088 2.250 0.050 20 0 "[ . 1 . 2]" 2
36 1 18 SER O 1 22 LEU N 3.000 2.850 3.300 3.007 2.895 3.103 . 0 0 "[ . 1 . 2]" 2
37 1 19 GLN O 1 23 GLU H 2.000 . 2.200 2.250 2.221 2.306 0.106 16 0 "[ . 1 . 2]" 2
38 1 19 GLN O 1 23 GLU N 3.000 2.850 3.300 3.204 3.133 3.283 . 0 0 "[ . 1 . 2]" 2
39 1 20 SER O 1 24 LEU H 2.000 . 2.200 2.174 2.060 2.236 0.036 10 0 "[ . 1 . 2]" 2
40 1 20 SER O 1 24 LEU N 3.000 2.850 3.300 3.066 2.933 3.163 . 0 0 "[ . 1 . 2]" 2
41 1 21 LEU O 1 25 ALA H 2.000 . 2.200 2.035 1.962 2.089 . 0 0 "[ . 1 . 2]" 2
42 1 21 LEU O 1 25 ALA N 3.000 2.850 3.300 2.863 2.826 2.951 0.024 6 0 "[ . 1 . 2]" 2
43 1 22 LEU O 1 26 GLN H 2.000 . 2.200 2.101 1.982 2.218 0.018 12 0 "[ . 1 . 2]" 2
44 1 22 LEU O 1 26 GLN N 3.000 2.850 3.300 3.036 2.845 3.177 0.005 17 0 "[ . 1 . 2]" 2
45 1 23 GLU O 1 27 ARG H 2.000 . 2.200 2.148 1.999 2.260 0.060 11 0 "[ . 1 . 2]" 2
46 1 23 GLU O 1 27 ARG N 3.000 2.850 3.300 2.964 2.833 3.106 0.017 19 0 "[ . 1 . 2]" 2
47 1 30 TRP O 1 34 LEU H 2.000 . 2.200 2.012 1.945 2.076 . 0 0 "[ . 1 . 2]" 2
48 1 30 TRP O 1 34 LEU N 3.000 2.850 3.300 2.926 2.838 2.997 0.012 20 0 "[ . 1 . 2]" 2
49 1 31 ASP O 1 35 GLN H 2.000 . 2.200 2.213 2.128 2.258 0.058 20 0 "[ . 1 . 2]" 2
50 1 31 ASP O 1 35 GLN N 3.000 2.850 3.300 3.017 2.825 3.136 0.025 14 0 "[ . 1 . 2]" 2
51 1 33 LEU O 1 37 GLU H 2.000 . 2.200 2.155 2.050 2.222 0.022 11 0 "[ . 1 . 2]" 2
52 1 33 LEU O 1 37 GLU N 3.000 2.850 3.300 2.860 2.794 2.941 0.056 9 0 "[ . 1 . 2]" 2
53 1 36 GLN O 1 40 TYR H 2.000 . 2.200 2.063 1.979 2.153 . 0 0 "[ . 1 . 2]" 2
54 1 36 GLN O 1 40 TYR N 3.000 2.850 3.300 2.958 2.843 3.074 0.007 12 0 "[ . 1 . 2]" 2
55 1 37 GLU O 1 41 LEU H 2.000 . 2.200 2.014 1.937 2.192 . 0 0 "[ . 1 . 2]" 2
56 1 37 GLU O 1 41 LEU N 3.000 2.850 3.300 2.973 2.892 3.155 . 0 0 "[ . 1 . 2]" 2
57 1 38 VAL O 1 42 GLN H 2.000 . 2.200 2.281 2.234 2.334 0.134 9 0 "[ . 1 . 2]" 2
58 1 38 VAL O 1 42 GLN N 3.000 2.850 3.300 3.170 3.116 3.238 . 0 0 "[ . 1 . 2]" 2
59 1 39 SER O 1 43 SER H 2.000 . 2.200 2.174 2.030 2.264 0.064 14 0 "[ . 1 . 2]" 2
60 1 39 SER O 1 43 SER N 3.000 2.850 3.300 3.055 2.902 3.192 . 0 0 "[ . 1 . 2]" 2
61 1 40 TYR O 1 44 ILE H 2.000 . 2.200 2.244 2.199 2.323 0.123 3 0 "[ . 1 . 2]" 2
62 1 40 TYR O 1 44 ILE N 3.000 2.850 3.300 3.168 3.122 3.272 . 0 0 "[ . 1 . 2]" 2
63 1 41 LEU O 1 45 GLU H 2.000 . 2.200 2.049 1.935 2.229 0.029 12 0 "[ . 1 . 2]" 2
64 1 41 LEU O 1 45 GLU N 3.000 2.850 3.300 2.980 2.869 3.136 . 0 0 "[ . 1 . 2]" 2
65 1 42 GLN O 1 46 THR H 2.000 . 2.200 2.065 1.987 2.155 . 0 0 "[ . 1 . 2]" 2
66 1 42 GLN O 1 46 THR N 3.000 2.850 3.300 2.905 2.842 3.007 0.008 7 0 "[ . 1 . 2]" 2
67 1 43 SER O 1 47 VAL H 2.000 . 2.200 2.247 2.213 2.310 0.110 17 0 "[ . 1 . 2]" 2
68 1 43 SER O 1 47 VAL N 3.000 2.850 3.300 3.171 3.118 3.265 . 0 0 "[ . 1 . 2]" 2
69 1 44 ILE O 1 48 MET H 2.000 . 2.200 2.271 2.216 2.339 0.139 8 0 "[ . 1 . 2]" 2
70 1 44 ILE O 1 48 MET N 3.000 2.850 3.300 3.159 3.033 3.299 . 0 0 "[ . 1 . 2]" 2
71 1 45 GLU O 1 49 GLU H 2.000 . 2.200 2.145 1.973 2.253 0.053 15 0 "[ . 1 . 2]" 2
72 1 45 GLU O 1 49 GLU N 3.000 2.850 3.300 2.843 2.771 2.984 0.079 20 0 "[ . 1 . 2]" 2
73 1 57 THR O 1 61 GLN H 2.000 . 2.200 1.983 1.945 2.058 . 0 0 "[ . 1 . 2]" 2
74 1 57 THR O 1 61 GLN N 3.000 2.850 3.300 2.916 2.872 2.956 . 0 0 "[ . 1 . 2]" 2
75 1 58 ARG O 1 62 ASP H 2.000 . 2.200 2.185 2.085 2.245 0.045 15 0 "[ . 1 . 2]" 2
76 1 58 ARG O 1 62 ASP N 3.000 2.850 3.300 3.028 2.919 3.110 . 0 0 "[ . 1 . 2]" 2
77 1 59 SER O 1 63 MET H 2.000 . 2.200 2.174 2.055 2.263 0.063 10 0 "[ . 1 . 2]" 2
78 1 59 SER O 1 63 MET N 3.000 2.850 3.300 3.103 2.976 3.225 . 0 0 "[ . 1 . 2]" 2
79 1 60 ILE O 1 64 VAL H 2.000 . 2.200 2.052 1.943 2.135 . 0 0 "[ . 1 . 2]" 2
80 1 60 ILE O 1 64 VAL N 3.000 2.850 3.300 3.022 2.913 3.108 . 0 0 "[ . 1 . 2]" 2
81 1 61 GLN O 1 65 ALA H 2.000 . 2.200 2.093 1.975 2.219 0.019 13 0 "[ . 1 . 2]" 2
82 1 61 GLN O 1 65 ALA N 3.000 2.850 3.300 2.953 2.849 3.101 0.001 16 0 "[ . 1 . 2]" 2
83 1 62 ASP O 1 66 GLY H 2.000 . 2.200 2.217 2.120 2.331 0.131 18 0 "[ . 1 . 2]" 2
84 1 62 ASP O 1 66 GLY N 3.000 2.850 3.300 3.131 3.020 3.294 . 0 0 "[ . 1 . 2]" 2
85 1 63 MET O 1 67 TYR H 2.000 . 2.200 2.175 2.061 2.257 0.057 15 0 "[ . 1 . 2]" 2
86 1 63 MET O 1 67 TYR N 3.000 2.850 3.300 3.046 2.948 3.157 . 0 0 "[ . 1 . 2]" 2
87 1 64 VAL O 1 68 ILE H 2.000 . 2.200 1.953 1.927 1.992 . 0 0 "[ . 1 . 2]" 2
88 1 64 VAL O 1 68 ILE N 3.000 2.850 3.300 2.832 2.779 2.896 0.071 9 0 "[ . 1 . 2]" 2
89 1 65 ALA O 1 69 LYS H 2.000 . 2.200 2.110 1.998 2.220 0.020 18 0 "[ . 1 . 2]" 2
90 1 65 ALA O 1 69 LYS N 3.000 2.850 3.300 3.015 2.911 3.110 . 0 0 "[ . 1 . 2]" 2
91 1 66 GLY O 1 70 GLN H 2.000 . 2.200 2.141 2.012 2.220 0.020 3 0 "[ . 1 . 2]" 2
92 1 66 GLY O 1 70 GLN N 3.000 2.850 3.300 3.055 2.950 3.173 . 0 0 "[ . 1 . 2]" 2
93 1 67 TYR O 1 71 THR H 2.000 . 2.200 2.154 2.089 2.239 0.039 18 0 "[ . 1 . 2]" 2
94 1 67 TYR O 1 71 THR N 3.000 2.850 3.300 3.078 2.990 3.185 . 0 0 "[ . 1 . 2]" 2
95 1 68 ILE O 1 72 LEU H 2.000 . 2.200 1.995 1.955 2.034 . 0 0 "[ . 1 . 2]" 2
96 1 68 ILE O 1 72 LEU N 3.000 2.850 3.300 2.891 2.821 2.973 0.029 13 0 "[ . 1 . 2]" 2
97 1 69 LYS O 1 73 ASP H 2.000 . 2.200 2.238 2.189 2.287 0.087 18 0 "[ . 1 . 2]" 2
98 1 69 LYS O 1 73 ASP N 3.000 2.850 3.300 3.163 3.092 3.247 . 0 0 "[ . 1 . 2]" 2
99 1 70 GLN O 1 74 ASN H 2.000 . 2.200 2.050 1.974 2.142 . 0 0 "[ . 1 . 2]" 2
100 1 70 GLN O 1 74 ASN N 3.000 2.850 3.300 3.017 2.947 3.115 . 0 0 "[ . 1 . 2]" 2
101 1 71 THR O 1 75 GLU H 2.000 . 2.200 2.094 1.994 2.203 0.003 16 0 "[ . 1 . 2]" 2
102 1 71 THR O 1 75 GLU N 3.000 2.850 3.300 2.983 2.890 3.099 . 0 0 "[ . 1 . 2]" 2
103 1 72 LEU O 1 76 GLN H 2.000 . 2.200 2.121 2.058 2.212 0.012 10 0 "[ . 1 . 2]" 2
104 1 72 LEU O 1 76 GLN N 3.000 2.850 3.300 2.940 2.823 3.065 0.027 17 0 "[ . 1 . 2]" 2
105 1 73 ASP O 1 77 LEU H 2.000 . 2.200 2.205 2.089 2.284 0.084 12 0 "[ . 1 . 2]" 2
106 1 73 ASP O 1 77 LEU N 3.000 2.850 3.300 3.115 2.988 3.204 . 0 0 "[ . 1 . 2]" 2
107 1 74 ASN O 1 78 LEU H 2.000 . 2.200 2.056 1.988 2.118 . 0 0 "[ . 1 . 2]" 2
108 1 74 ASN O 1 78 LEU N 3.000 2.850 3.300 2.910 2.832 2.985 0.018 9 0 "[ . 1 . 2]" 2
109 1 75 GLU O 1 79 LYS H 2.000 . 2.200 2.094 2.025 2.141 . 0 0 "[ . 1 . 2]" 2
110 1 75 GLU O 1 79 LYS N 3.000 2.850 3.300 2.966 2.886 3.054 . 0 0 "[ . 1 . 2]" 2
111 1 76 GLN O 1 80 GLY H 2.000 . 2.200 2.215 2.118 2.285 0.085 19 0 "[ . 1 . 2]" 2
112 1 76 GLN O 1 80 GLY N 3.000 2.850 3.300 3.174 3.070 3.253 . 0 0 "[ . 1 . 2]" 2
113 1 77 LEU O 1 81 LEU H 2.000 . 2.200 2.105 1.962 2.241 0.041 11 0 "[ . 1 . 2]" 2
114 1 77 LEU O 1 81 LEU N 3.000 2.850 3.300 3.032 2.889 3.191 . 0 0 "[ . 1 . 2]" 2
115 1 78 LEU O 1 82 LEU H 2.000 . 2.200 1.966 1.913 2.074 . 0 0 "[ . 1 . 2]" 2
116 1 78 LEU O 1 82 LEU N 3.000 2.850 3.300 2.877 2.829 2.946 0.021 14 0 "[ . 1 . 2]" 2
117 1 79 LYS O 1 83 GLN H 2.000 . 2.200 2.268 2.200 2.311 0.111 20 0 "[ . 1 . 2]" 2
118 1 79 LYS O 1 83 GLN N 3.000 2.850 3.300 3.090 2.992 3.173 . 0 0 "[ . 1 . 2]" 2
119 1 80 GLY O 1 84 GLN H 2.000 . 2.200 2.249 2.089 2.298 0.098 6 0 "[ . 1 . 2]" 2
120 1 80 GLY O 1 84 GLN N 3.000 2.850 3.300 3.184 3.011 3.252 . 0 0 "[ . 1 . 2]" 2
121 1 81 LEU O 1 85 ARG H 2.000 . 2.200 2.191 2.052 2.255 0.055 10 0 "[ . 1 . 2]" 2
122 1 81 LEU O 1 85 ARG N 3.000 2.850 3.300 3.134 2.996 3.210 . 0 0 "[ . 1 . 2]" 2
123 1 82 LEU O 1 86 LEU H 2.000 . 2.200 1.937 1.906 2.011 . 0 0 "[ . 1 . 2]" 2
124 1 82 LEU O 1 86 LEU N 3.000 2.850 3.300 2.865 2.827 2.915 0.023 20 0 "[ . 1 . 2]" 2
125 1 83 GLN O 1 87 ASP H 2.000 . 2.200 2.179 2.085 2.250 0.050 1 0 "[ . 1 . 2]" 2
126 1 83 GLN O 1 87 ASP N 3.000 2.850 3.300 3.047 2.939 3.124 . 0 0 "[ . 1 . 2]" 2
127 1 84 GLN O 1 88 GLU H 2.000 . 2.200 2.184 2.034 2.272 0.072 19 0 "[ . 1 . 2]" 2
128 1 84 GLN O 1 88 GLU N 3.000 2.850 3.300 3.117 2.942 3.221 . 0 0 "[ . 1 . 2]" 2
129 1 85 ARG O 1 89 LEU H 2.000 . 2.200 1.963 1.886 2.134 0.014 8 0 "[ . 1 . 2]" 2
130 1 85 ARG O 1 89 LEU N 3.000 2.850 3.300 2.910 2.846 3.062 0.004 8 0 "[ . 1 . 2]" 2
131 1 86 LEU O 1 90 SER H 2.000 . 2.200 2.008 1.959 2.087 . 0 0 "[ . 1 . 2]" 2
132 1 86 LEU O 1 90 SER N 3.000 2.850 3.300 2.907 2.811 3.006 0.039 20 0 "[ . 1 . 2]" 2
133 1 87 ASP O 1 91 SER H 2.000 . 2.200 2.217 2.121 2.294 0.094 8 0 "[ . 1 . 2]" 2
134 1 87 ASP O 1 91 SER N 3.000 2.850 3.300 3.103 2.958 3.244 . 0 0 "[ . 1 . 2]" 2
135 1 88 GLU O 1 92 LEU H 2.000 . 2.200 2.112 1.962 2.235 0.035 9 0 "[ . 1 . 2]" 2
136 1 88 GLU O 1 92 LEU N 3.000 2.850 3.300 2.994 2.852 3.164 . 0 0 "[ . 1 . 2]" 2
137 1 89 LEU O 1 93 ILE H 2.000 . 2.200 1.990 1.930 2.056 . 0 0 "[ . 1 . 2]" 2
138 1 89 LEU O 1 93 ILE N 3.000 2.850 3.300 2.924 2.835 3.031 0.015 9 0 "[ . 1 . 2]" 2
139 1 90 SER O 1 94 GLY H 2.000 . 2.200 2.100 2.026 2.214 0.014 5 0 "[ . 1 . 2]" 2
140 1 90 SER O 1 94 GLY N 3.000 2.850 3.300 2.986 2.847 3.133 0.003 18 0 "[ . 1 . 2]" 2
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