NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
439715 |
2k75   |
15902 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2k75
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 1307
_Distance_constraint_stats_list.Viol_count 421
_Distance_constraint_stats_list.Viol_total 433.836
_Distance_constraint_stats_list.Viol_max 0.300
_Distance_constraint_stats_list.Viol_rms 0.0086
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0008
_Distance_constraint_stats_list.Viol_average_violations_only 0.0515
_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 SER 1.136 0.133 2 0 "[ . 1 . 2]"
1 2 ASP 0.172 0.073 15 0 "[ . 1 . 2]"
1 3 LEU 1.396 0.109 2 0 "[ . 1 . 2]"
1 4 VAL 0.447 0.086 20 0 "[ . 1 . 2]"
1 5 LYS 0.503 0.073 3 0 "[ . 1 . 2]"
1 6 ILE 0.301 0.075 8 0 "[ . 1 . 2]"
1 7 ARG 1.224 0.139 3 0 "[ . 1 . 2]"
1 8 ASP 0.312 0.086 20 0 "[ . 1 . 2]"
1 9 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 SER 0.163 0.064 6 0 "[ . 1 . 2]"
1 11 LEU 1.273 0.140 19 0 "[ . 1 . 2]"
1 12 SER 0.287 0.074 16 0 "[ . 1 . 2]"
1 13 THR 0.230 0.079 18 0 "[ . 1 . 2]"
1 14 PRO 0.130 0.068 19 0 "[ . 1 . 2]"
1 15 TYR 1.119 0.079 18 0 "[ . 1 . 2]"
1 16 VAL 0.762 0.133 2 0 "[ . 1 . 2]"
1 17 SER 0.042 0.040 13 0 "[ . 1 . 2]"
1 18 VAL 0.085 0.044 9 0 "[ . 1 . 2]"
1 19 ILE 0.631 0.245 3 0 "[ . 1 . 2]"
1 20 GLY 0.095 0.095 3 0 "[ . 1 . 2]"
1 21 LYS 0.515 0.143 2 0 "[ . 1 . 2]"
1 22 ILE 1.055 0.111 1 0 "[ . 1 . 2]"
1 23 THR 0.685 0.143 2 0 "[ . 1 . 2]"
1 24 GLY 0.365 0.113 2 0 "[ . 1 . 2]"
1 25 ILE 1.401 0.193 20 0 "[ . 1 . 2]"
1 26 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 27 LYS 0.215 0.087 8 0 "[ . 1 . 2]"
1 28 LYS 0.287 0.114 16 0 "[ . 1 . 2]"
1 29 GLU 0.718 0.114 16 0 "[ . 1 . 2]"
1 30 TYR 0.035 0.035 4 0 "[ . 1 . 2]"
1 31 GLU 0.805 0.137 10 0 "[ . 1 . 2]"
1 32 SER 0.057 0.035 20 0 "[ . 1 . 2]"
1 33 ASP 0.540 0.122 20 0 "[ . 1 . 2]"
1 34 GLY 0.627 0.137 10 0 "[ . 1 . 2]"
1 35 THR 1.080 0.126 19 0 "[ . 1 . 2]"
1 36 THR 0.743 0.113 16 0 "[ . 1 . 2]"
1 37 LYS 0.058 0.058 19 0 "[ . 1 . 2]"
1 38 SER 0.282 0.053 10 0 "[ . 1 . 2]"
1 39 VAL 0.064 0.035 4 0 "[ . 1 . 2]"
1 40 TYR 0.922 0.193 20 0 "[ . 1 . 2]"
1 41 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 GLY 0.485 0.060 20 0 "[ . 1 . 2]"
1 43 TYR 0.680 0.077 14 0 "[ . 1 . 2]"
1 44 ILE 0.194 0.076 17 0 "[ . 1 . 2]"
1 45 GLU 0.381 0.075 8 0 "[ . 1 . 2]"
1 46 ASP 1.136 0.300 3 0 "[ . 1 . 2]"
1 47 ASP 1.178 0.300 3 0 "[ . 1 . 2]"
1 48 THR 0.966 0.139 3 0 "[ . 1 . 2]"
1 49 ALA 0.710 0.075 9 0 "[ . 1 . 2]"
1 50 ARG 0.669 0.075 20 0 "[ . 1 . 2]"
1 51 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 ARG 1.009 0.218 14 0 "[ . 1 . 2]"
1 53 ILE 0.866 0.087 12 0 "[ . 1 . 2]"
1 54 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 57 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 LYS 0.206 0.055 10 0 "[ . 1 . 2]"
1 59 GLN 0.216 0.082 1 0 "[ . 1 . 2]"
1 60 LEU 0.001 0.001 1 0 "[ . 1 . 2]"
1 61 GLN 0.277 0.082 1 0 "[ . 1 . 2]"
1 62 ASP 0.557 0.102 18 0 "[ . 1 . 2]"
1 63 SER 0.166 0.089 2 0 "[ . 1 . 2]"
1 64 ASP 0.577 0.102 18 0 "[ . 1 . 2]"
1 65 VAL 0.233 0.071 1 0 "[ . 1 . 2]"
1 66 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 ARG 0.546 0.245 3 0 "[ . 1 . 2]"
1 68 ILE 0.053 0.044 9 0 "[ . 1 . 2]"
1 69 ASP 0.202 0.057 17 0 "[ . 1 . 2]"
1 70 ASN 0.206 0.129 14 0 "[ . 1 . 2]"
1 71 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 ARG 0.834 0.141 10 0 "[ . 1 . 2]"
1 73 VAL 1.008 0.141 10 0 "[ . 1 . 2]"
1 74 ALA 0.317 0.140 19 0 "[ . 1 . 2]"
1 75 GLN 2.101 0.211 18 0 "[ . 1 . 2]"
1 76 PHE 0.108 0.108 18 0 "[ . 1 . 2]"
1 77 ASN 0.206 0.065 4 0 "[ . 1 . 2]"
1 78 GLY 0.759 0.197 1 0 "[ . 1 . 2]"
1 79 TYR 0.642 0.211 18 0 "[ . 1 . 2]"
1 80 LEU 1.428 0.194 2 0 "[ . 1 . 2]"
1 81 SER 1.110 0.218 14 0 "[ . 1 . 2]"
1 82 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 84 VAL 0.067 0.045 3 0 "[ . 1 . 2]"
1 85 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 86 ASP 0.075 0.044 6 0 "[ . 1 . 2]"
1 87 SER 0.129 0.129 14 0 "[ . 1 . 2]"
1 88 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 ARG 0.202 0.057 17 0 "[ . 1 . 2]"
1 90 ILE 0.064 0.055 10 0 "[ . 1 . 2]"
1 91 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 VAL 0.010 0.010 10 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 SER HA 1 15 TYR HB3 1.800 . 5.760 3.922 3.011 4.865 . 0 0 "[ . 1 . 2]" 1
2 1 1 SER HA 1 15 TYR HB2 1.800 . 5.010 4.510 3.497 5.088 0.078 15 0 "[ . 1 . 2]" 1
3 1 1 SER HA 1 16 VAL HA 1.800 . 5.290 3.336 2.241 5.286 . 0 0 "[ . 1 . 2]" 1
4 1 1 SER HA 1 2 ASP H 1.800 . 3.470 2.956 2.169 3.543 0.073 15 0 "[ . 1 . 2]" 1
5 1 1 SER QB 1 15 TYR HB3 1.800 . 4.650 3.460 2.372 4.468 . 0 0 "[ . 1 . 2]" 1
6 1 1 SER QB 1 15 TYR HB2 1.800 . 5.380 4.063 2.483 5.368 . 0 0 "[ . 1 . 2]" 1
7 1 1 SER QB 1 16 VAL HA 1.800 . 4.070 3.712 2.350 4.203 0.133 2 0 "[ . 1 . 2]" 1
8 1 1 SER QB 1 16 VAL H 1.800 . 5.810 4.698 3.769 5.371 . 0 0 "[ . 1 . 2]" 1
9 1 1 SER QB 1 2 ASP H 1.800 . 4.040 3.116 1.917 4.069 0.029 18 0 "[ . 1 . 2]" 1
10 1 1 SER QB 1 70 ASN HA 1.800 . 4.650 3.125 2.333 4.147 . 0 0 "[ . 1 . 2]" 1
11 1 1 SER QB 1 70 ASN QB 1.800 . 5.870 3.868 2.825 5.005 . 0 0 "[ . 1 . 2]" 1
12 1 1 SER QB 1 70 ASN QD 1.800 . 5.870 5.284 4.297 5.912 0.042 15 0 "[ . 1 . 2]" 1
13 1 1 SER QB 1 70 ASN H 1.800 . 4.810 3.209 1.768 4.814 0.032 9 0 "[ . 1 . 2]" 1
14 1 2 ASP HA 1 3 LEU H 1.800 . 3.080 2.316 2.207 2.494 . 0 0 "[ . 1 . 2]" 1
15 1 2 ASP HB3 1 3 LEU H 1.800 . 4.480 3.555 2.400 4.115 . 0 0 "[ . 1 . 2]" 1
16 1 2 ASP HB2 1 3 LEU H 1.800 . 4.480 3.651 2.303 4.239 . 0 0 "[ . 1 . 2]" 1
17 1 2 ASP QB 1 4 VAL MG1 1.800 . 3.950 3.146 2.879 3.920 . 0 0 "[ . 1 . 2]" 1
18 1 2 ASP H 1 16 VAL HA 1.800 . 4.470 3.329 2.831 3.936 . 0 0 "[ . 1 . 2]" 1
19 1 2 ASP H 1 2 ASP HB3 1.800 . 4.230 3.070 2.513 3.769 . 0 0 "[ . 1 . 2]" 1
20 1 2 ASP H 1 2 ASP HB2 1.800 . 4.230 2.928 2.321 4.252 0.022 4 0 "[ . 1 . 2]" 1
21 1 2 ASP H 1 3 LEU H 1.800 . 5.070 4.534 4.114 4.672 . 0 0 "[ . 1 . 2]" 1
22 1 2 ASP H 1 4 VAL MG1 1.800 . 4.880 4.477 4.157 4.913 0.033 4 0 "[ . 1 . 2]" 1
23 1 3 LEU HA 1 16 VAL HA 1.800 . 6.050 5.370 5.056 5.755 . 0 0 "[ . 1 . 2]" 1
24 1 3 LEU HA 1 17 SER HB3 1.800 . 4.250 3.079 2.308 4.234 . 0 0 "[ . 1 . 2]" 1
25 1 3 LEU HA 1 17 SER HB2 1.800 . 4.250 3.297 2.308 4.290 0.040 13 0 "[ . 1 . 2]" 1
26 1 3 LEU HA 1 17 SER H 1.800 . 4.330 3.214 2.955 3.556 . 0 0 "[ . 1 . 2]" 1
27 1 3 LEU HA 1 18 VAL HA 1.800 . 5.410 4.199 3.958 4.433 . 0 0 "[ . 1 . 2]" 1
28 1 3 LEU HA 1 3 LEU MD1 1.800 . 3.950 2.231 2.069 3.342 . 0 0 "[ . 1 . 2]" 1
29 1 3 LEU HA 1 3 LEU MD2 1.800 . 4.060 3.546 2.153 3.817 . 0 0 "[ . 1 . 2]" 1
30 1 3 LEU HA 1 4 VAL H 1.800 . 3.150 2.176 2.135 2.208 . 0 0 "[ . 1 . 2]" 1
31 1 3 LEU HB3 1 3 LEU MD2 1.800 . 3.820 2.457 2.185 3.220 . 0 0 "[ . 1 . 2]" 1
32 1 3 LEU HB3 1 4 VAL H 1.800 . 5.240 4.162 3.344 4.324 . 0 0 "[ . 1 . 2]" 1
33 1 3 LEU HB2 1 3 LEU MD2 1.800 . 3.820 2.425 2.250 3.112 . 0 0 "[ . 1 . 2]" 1
34 1 3 LEU HB2 1 4 VAL H 1.800 . 5.240 4.279 4.185 4.508 . 0 0 "[ . 1 . 2]" 1
35 1 3 LEU QB 1 17 SER QB 1.800 . 4.770 3.463 3.089 4.296 . 0 0 "[ . 1 . 2]" 1
36 1 3 LEU QB 1 3 LEU MD1 1.800 . 3.540 2.263 2.114 2.304 . 0 0 "[ . 1 . 2]" 1
37 1 3 LEU MD1 1 17 SER QB 1.800 . 5.000 3.043 2.299 4.069 . 0 0 "[ . 1 . 2]" 1
38 1 3 LEU MD1 1 18 VAL HA 1.800 . 4.030 2.620 2.126 3.574 . 0 0 "[ . 1 . 2]" 1
39 1 3 LEU MD1 1 4 VAL H 1.800 . 4.000 2.393 1.869 4.073 0.073 7 0 "[ . 1 . 2]" 1
40 1 3 LEU MD2 1 17 SER QB 1.800 . 5.000 4.359 2.283 4.970 . 0 0 "[ . 1 . 2]" 1
41 1 3 LEU HG 1 4 VAL H 1.800 . 6.050 3.427 2.396 5.287 . 0 0 "[ . 1 . 2]" 1
42 1 3 LEU H 1 17 SER QB 1.800 . 4.990 3.810 3.440 4.920 . 0 0 "[ . 1 . 2]" 1
43 1 3 LEU H 1 17 SER H 1.800 . 5.950 4.909 4.640 5.234 . 0 0 "[ . 1 . 2]" 1
44 1 3 LEU H 1 3 LEU HB3 1.800 . 3.510 2.559 2.393 3.557 0.047 13 0 "[ . 1 . 2]" 1
45 1 3 LEU H 1 3 LEU HB2 1.800 . 3.510 2.604 2.248 2.725 . 0 0 "[ . 1 . 2]" 1
46 1 3 LEU H 1 3 LEU MD1 1.800 . 4.770 4.111 3.847 4.367 . 0 0 "[ . 1 . 2]" 1
47 1 3 LEU H 1 3 LEU MD2 1.800 . 4.200 3.992 1.893 4.309 0.109 2 0 "[ . 1 . 2]" 1
48 1 3 LEU H 1 3 LEU HG 1.800 . 5.130 4.360 3.845 4.608 . 0 0 "[ . 1 . 2]" 1
49 1 3 LEU H 1 4 VAL MG1 1.800 . 5.310 4.114 3.991 4.325 . 0 0 "[ . 1 . 2]" 1
50 1 4 VAL HA 1 4 VAL MG1 1.800 . 3.540 2.302 2.259 2.460 . 0 0 "[ . 1 . 2]" 1
51 1 4 VAL HA 1 4 VAL MG2 1.800 . 4.110 3.199 3.192 3.214 . 0 0 "[ . 1 . 2]" 1
52 1 4 VAL HA 1 5 LYS H 1.800 . 3.310 2.385 2.353 2.423 . 0 0 "[ . 1 . 2]" 1
53 1 4 VAL HB 1 5 LYS H 1.800 . 3.490 2.481 2.368 2.562 . 0 0 "[ . 1 . 2]" 1
54 1 4 VAL HB 1 8 ASP HB3 1.800 . 4.820 3.204 2.553 4.557 . 0 0 "[ . 1 . 2]" 1
55 1 4 VAL HB 1 8 ASP HB2 1.800 . 4.820 3.371 2.447 4.573 . 0 0 "[ . 1 . 2]" 1
56 1 4 VAL MG1 1 17 SER H 1.800 . 4.190 3.737 3.223 3.975 . 0 0 "[ . 1 . 2]" 1
57 1 4 VAL MG1 1 5 LYS H 1.800 . 4.350 3.707 3.670 3.917 . 0 0 "[ . 1 . 2]" 1
58 1 4 VAL MG1 1 8 ASP QB 1.800 . 4.510 3.931 3.527 4.596 0.086 20 0 "[ . 1 . 2]" 1
59 1 4 VAL MG2 1 16 VAL HA 1.800 . 4.640 3.833 3.364 4.152 . 0 0 "[ . 1 . 2]" 1
60 1 4 VAL MG2 1 16 VAL HB 1.800 . 3.810 2.087 2.048 2.160 . 0 0 "[ . 1 . 2]" 1
61 1 4 VAL MG2 1 16 VAL MG1 1.800 . 3.580 2.331 2.139 2.778 . 0 0 "[ . 1 . 2]" 1
62 1 4 VAL MG2 1 17 SER QB 1.800 . 4.930 4.383 4.042 4.730 . 0 0 "[ . 1 . 2]" 1
63 1 4 VAL MG2 1 17 SER H 1.800 . 4.110 2.912 2.655 3.288 . 0 0 "[ . 1 . 2]" 1
64 1 4 VAL MG2 1 5 LYS H 1.800 . 4.260 3.465 3.191 3.538 . 0 0 "[ . 1 . 2]" 1
65 1 4 VAL MG2 1 8 ASP HB3 1.800 . 5.260 4.112 3.288 5.329 0.069 20 0 "[ . 1 . 2]" 1
66 1 4 VAL MG2 1 8 ASP HB2 1.800 . 5.260 4.206 3.194 5.309 0.049 7 0 "[ . 1 . 2]" 1
67 1 4 VAL MG2 1 9 VAL HA 1.800 . 4.550 3.698 3.352 3.889 . 0 0 "[ . 1 . 2]" 1
68 1 4 VAL H 1 16 VAL HB 1.800 . 5.030 4.092 3.897 4.437 . 0 0 "[ . 1 . 2]" 1
69 1 4 VAL H 1 17 SER QB 1.800 . 5.350 3.957 3.825 4.539 . 0 0 "[ . 1 . 2]" 1
70 1 4 VAL H 1 17 SER H 1.800 . 4.650 3.515 3.175 3.846 . 0 0 "[ . 1 . 2]" 1
71 1 4 VAL H 1 18 VAL HA 1.800 . 4.660 3.608 3.384 3.951 . 0 0 "[ . 1 . 2]" 1
72 1 4 VAL H 1 4 VAL MG1 1.800 . 3.850 2.973 2.662 3.066 . 0 0 "[ . 1 . 2]" 1
73 1 4 VAL H 1 4 VAL MG2 1.800 . 3.690 2.067 1.993 2.236 . 0 0 "[ . 1 . 2]" 1
74 1 5 LYS HA 1 48 THR MG 1.800 . 5.130 3.494 2.295 4.543 . 0 0 "[ . 1 . 2]" 1
75 1 5 LYS HA 1 5 LYS HD3 1.800 . 4.590 3.970 2.217 4.647 0.057 15 0 "[ . 1 . 2]" 1
76 1 5 LYS HA 1 5 LYS HD2 1.800 . 4.590 3.836 2.417 4.625 0.035 10 0 "[ . 1 . 2]" 1
77 1 5 LYS HA 1 5 LYS QE 1.800 . 4.950 4.424 3.870 4.899 . 0 0 "[ . 1 . 2]" 1
78 1 5 LYS HA 1 6 ILE H 1.800 . 3.860 2.334 2.234 2.400 . 0 0 "[ . 1 . 2]" 1
79 1 5 LYS HB3 1 48 THR MG 1.800 . 4.130 2.328 2.246 2.969 . 0 0 "[ . 1 . 2]" 1
80 1 5 LYS HB3 1 8 ASP H 1.800 . 4.750 3.298 2.858 3.655 . 0 0 "[ . 1 . 2]" 1
81 1 5 LYS HB2 1 48 THR MG 1.800 . 4.130 3.639 3.278 4.179 0.049 11 0 "[ . 1 . 2]" 1
82 1 5 LYS HB2 1 8 ASP H 1.800 . 4.750 2.892 2.549 3.149 . 0 0 "[ . 1 . 2]" 1
83 1 5 LYS QB 1 48 THR HB 1.800 . 4.710 3.511 2.715 4.320 . 0 0 "[ . 1 . 2]" 1
84 1 5 LYS QB 1 5 LYS QE 1.800 . 4.380 3.489 2.176 3.834 . 0 0 "[ . 1 . 2]" 1
85 1 5 LYS QB 1 7 ARG H 1.800 . 4.350 2.789 2.671 2.870 . 0 0 "[ . 1 . 2]" 1
86 1 5 LYS QB 1 8 ASP QB 1.800 . 4.890 2.580 2.139 2.969 . 0 0 "[ . 1 . 2]" 1
87 1 5 LYS HD3 1 48 THR MG 1.800 . 4.840 3.294 2.199 4.913 0.073 3 0 "[ . 1 . 2]" 1
88 1 5 LYS HD2 1 48 THR MG 1.800 . 4.840 3.741 2.289 4.847 0.007 3 0 "[ . 1 . 2]" 1
89 1 5 LYS QD 1 6 ILE H 1.800 . 5.870 4.553 3.500 5.025 . 0 0 "[ . 1 . 2]" 1
90 1 5 LYS QE 1 48 THR MG 1.800 . 4.370 3.618 2.903 4.318 . 0 0 "[ . 1 . 2]" 1
91 1 5 LYS QG 1 48 THR MG 1.800 . 3.650 2.607 2.031 3.665 0.015 9 0 "[ . 1 . 2]" 1
92 1 5 LYS QE 1 5 LYS QG 1.800 . 3.520 2.226 2.125 2.324 . 0 0 "[ . 1 . 2]" 1
93 1 5 LYS QG 1 6 ILE H 1.800 . 5.690 3.792 3.393 4.434 . 0 0 "[ . 1 . 2]" 1
94 1 5 LYS H 1 5 LYS QB 1.800 . 3.790 2.330 2.154 2.524 . 0 0 "[ . 1 . 2]" 1
95 1 5 LYS H 1 5 LYS QD 1.800 . 4.330 3.319 1.789 4.300 0.011 6 0 "[ . 1 . 2]" 1
96 1 5 LYS H 1 5 LYS HG3 1.800 . 4.980 2.933 2.319 4.026 . 0 0 "[ . 1 . 2]" 1
97 1 5 LYS H 1 5 LYS HG2 1.800 . 4.980 3.580 2.102 4.092 . 0 0 "[ . 1 . 2]" 1
98 1 5 LYS H 1 6 ILE H 1.800 . 5.710 4.636 4.608 4.658 . 0 0 "[ . 1 . 2]" 1
99 1 5 LYS H 1 8 ASP HB3 1.800 . 4.940 3.477 2.637 4.072 . 0 0 "[ . 1 . 2]" 1
100 1 5 LYS H 1 8 ASP HB2 1.800 . 4.940 3.054 2.166 4.667 . 0 0 "[ . 1 . 2]" 1
101 1 5 LYS H 1 8 ASP H 1.800 . 5.090 4.126 3.830 4.298 . 0 0 "[ . 1 . 2]" 1
102 1 6 ILE HA 1 18 VAL MG1 1.800 . 4.840 3.360 3.005 3.937 . 0 0 "[ . 1 . 2]" 1
103 1 6 ILE HA 1 6 ILE MD 1.800 . 4.000 3.271 2.075 3.838 . 0 0 "[ . 1 . 2]" 1
104 1 6 ILE HA 1 8 ASP H 1.800 . 4.800 3.922 3.793 4.166 . 0 0 "[ . 1 . 2]" 1
105 1 6 ILE HA 1 9 VAL MG2 1.800 . 3.650 2.122 2.021 2.302 . 0 0 "[ . 1 . 2]" 1
106 1 6 ILE HA 1 9 VAL H 1.800 . 4.570 3.687 3.293 3.867 . 0 0 "[ . 1 . 2]" 1
107 1 6 ILE HB 1 46 ASP H 1.800 . 5.750 5.299 4.618 5.741 . 0 0 "[ . 1 . 2]" 1
108 1 6 ILE HB 1 49 ALA MB 1.800 . 4.000 3.164 2.685 3.675 . 0 0 "[ . 1 . 2]" 1
109 1 6 ILE HB 1 7 ARG H 1.800 . 3.710 2.543 2.463 2.594 . 0 0 "[ . 1 . 2]" 1
110 1 6 ILE MD 1 18 VAL HB 1.800 . 4.530 3.637 2.262 4.546 0.016 3 0 "[ . 1 . 2]" 1
111 1 6 ILE MD 1 45 GLU HA 1.800 . 4.870 3.583 2.495 4.945 0.075 8 0 "[ . 1 . 2]" 1
112 1 6 ILE MD 1 46 ASP HB3 1.800 . 6.050 3.036 2.256 4.735 . 0 0 "[ . 1 . 2]" 1
113 1 6 ILE MD 1 46 ASP HB2 1.800 . 6.050 3.206 2.209 5.112 . 0 0 "[ . 1 . 2]" 1
114 1 6 ILE MD 1 50 ARG HA 1.800 . 5.150 3.161 2.292 5.184 0.034 8 0 "[ . 1 . 2]" 1
115 1 6 ILE MD 1 7 ARG H 1.800 . 5.910 4.383 3.684 4.736 . 0 0 "[ . 1 . 2]" 1
116 1 6 ILE QG 1 18 VAL MG1 1.800 . 4.990 3.332 2.689 4.491 . 0 0 "[ . 1 . 2]" 1
117 1 6 ILE QG 1 46 ASP H 1.800 . 6.050 4.644 3.354 5.527 . 0 0 "[ . 1 . 2]" 1
118 1 6 ILE QG 1 50 ARG HA 1.800 . 5.060 4.197 2.662 4.812 . 0 0 "[ . 1 . 2]" 1
119 1 6 ILE QG 1 50 ARG H 1.800 . 6.050 5.539 4.171 6.035 . 0 0 "[ . 1 . 2]" 1
120 1 6 ILE QG 1 7 ARG H 1.800 . 5.630 4.053 3.778 4.440 . 0 0 "[ . 1 . 2]" 1
121 1 6 ILE MG 1 45 GLU HA 1.800 . 5.010 4.545 3.878 5.037 0.027 16 0 "[ . 1 . 2]" 1
122 1 6 ILE MG 1 49 ALA MB 1.800 . 5.000 2.887 2.374 3.373 . 0 0 "[ . 1 . 2]" 1
123 1 6 ILE MG 1 49 ALA H 1.800 . 4.960 3.977 3.715 4.477 . 0 0 "[ . 1 . 2]" 1
124 1 6 ILE MG 1 50 ARG HA 1.800 . 4.500 2.969 2.487 3.556 . 0 0 "[ . 1 . 2]" 1
125 1 6 ILE MG 1 50 ARG H 1.800 . 4.890 3.529 3.014 3.820 . 0 0 "[ . 1 . 2]" 1
126 1 6 ILE MG 1 51 ILE HB 1.800 . 3.730 2.203 2.065 2.458 . 0 0 "[ . 1 . 2]" 1
127 1 6 ILE MG 1 51 ILE MG 1.800 . 3.600 2.136 1.984 2.499 . 0 0 "[ . 1 . 2]" 1
128 1 6 ILE MG 1 51 ILE H 1.800 . 4.380 3.288 2.857 3.664 . 0 0 "[ . 1 . 2]" 1
129 1 6 ILE HG13 1 6 ILE MG 1.800 . 4.610 2.900 2.247 3.200 . 0 0 "[ . 1 . 2]" 1
130 1 6 ILE HG12 1 6 ILE MG 1.800 . 4.610 2.552 2.214 3.199 . 0 0 "[ . 1 . 2]" 1
131 1 6 ILE MG 1 7 ARG H 1.800 . 4.890 3.325 3.005 3.617 . 0 0 "[ . 1 . 2]" 1
132 1 6 ILE MG 1 8 ASP H 1.800 . 5.670 4.643 4.468 4.983 . 0 0 "[ . 1 . 2]" 1
133 1 6 ILE MG 1 9 VAL HB 1.800 . 5.500 3.773 3.589 4.029 . 0 0 "[ . 1 . 2]" 1
134 1 6 ILE MG 1 9 VAL H 1.800 . 4.940 4.276 4.137 4.429 . 0 0 "[ . 1 . 2]" 1
135 1 6 ILE H 1 6 ILE MD 1.800 . 4.700 3.130 1.741 3.487 0.059 8 0 "[ . 1 . 2]" 1
136 1 6 ILE H 1 6 ILE HG13 1.800 . 4.650 2.660 2.175 3.824 . 0 0 "[ . 1 . 2]" 1
137 1 6 ILE H 1 6 ILE HG12 1.800 . 4.650 3.175 1.849 3.772 . 0 0 "[ . 1 . 2]" 1
138 1 6 ILE H 1 7 ARG H 1.800 . 4.520 2.712 2.675 2.755 . 0 0 "[ . 1 . 2]" 1
139 1 7 ARG HA 1 49 ALA MB 1.800 . 4.000 3.957 3.708 4.075 0.075 9 0 "[ . 1 . 2]" 1
140 1 7 ARG HA 1 7 ARG HD3 1.800 . 6.050 4.381 2.261 5.526 . 0 0 "[ . 1 . 2]" 1
141 1 7 ARG HA 1 7 ARG HD2 1.800 . 6.050 4.248 2.281 4.796 . 0 0 "[ . 1 . 2]" 1
142 1 7 ARG HA 1 7 ARG QG 1.800 . 3.960 2.548 2.277 3.320 . 0 0 "[ . 1 . 2]" 1
143 1 7 ARG HA 1 9 VAL H 1.800 . 5.100 3.581 3.485 4.029 . 0 0 "[ . 1 . 2]" 1
144 1 7 ARG QB 1 48 THR HB 1.800 . 4.920 3.502 2.399 4.823 . 0 0 "[ . 1 . 2]" 1
145 1 7 ARG HB3 1 7 ARG HE 1.800 . 5.160 3.901 2.173 4.804 . 0 0 "[ . 1 . 2]" 1
146 1 7 ARG HB2 1 7 ARG HE 1.800 . 5.160 3.590 2.216 4.850 . 0 0 "[ . 1 . 2]" 1
147 1 7 ARG QB 1 48 THR HA 1.800 . 5.440 5.254 4.501 5.576 0.136 9 0 "[ . 1 . 2]" 1
148 1 7 ARG QB 1 48 THR MG 1.800 . 4.430 3.622 2.248 4.499 0.069 17 0 "[ . 1 . 2]" 1
149 1 7 ARG QB 1 7 ARG QD 1.800 . 3.620 2.225 2.121 2.317 . 0 0 "[ . 1 . 2]" 1
150 1 7 ARG QB 1 7 ARG HE 1.800 . 4.420 3.180 2.148 4.125 . 0 0 "[ . 1 . 2]" 1
151 1 7 ARG QD 1 48 THR HB 1.800 . 4.570 3.858 2.363 4.709 0.139 3 0 "[ . 1 . 2]" 1
152 1 7 ARG QD 1 48 THR MG 1.800 . 4.980 4.035 2.036 5.058 0.078 7 0 "[ . 1 . 2]" 1
153 1 7 ARG QD 1 49 ALA MB 1.800 . 5.530 3.113 2.253 4.459 . 0 0 "[ . 1 . 2]" 1
154 1 7 ARG QG 1 48 THR HB 1.800 . 5.120 3.732 2.249 4.997 . 0 0 "[ . 1 . 2]" 1
155 1 7 ARG QG 1 48 THR MG 1.800 . 5.280 4.027 2.184 5.300 0.020 1 0 "[ . 1 . 2]" 1
156 1 7 ARG QG 1 8 ASP H 1.800 . 4.690 3.882 2.497 4.454 . 0 0 "[ . 1 . 2]" 1
157 1 7 ARG H 1 48 THR HB 1.800 . 4.600 3.344 2.866 4.070 . 0 0 "[ . 1 . 2]" 1
158 1 7 ARG H 1 48 THR MG 1.800 . 4.920 3.458 2.201 4.022 . 0 0 "[ . 1 . 2]" 1
159 1 7 ARG H 1 7 ARG QB 1.800 . 3.440 2.345 2.218 2.533 . 0 0 "[ . 1 . 2]" 1
160 1 7 ARG H 1 7 ARG HD3 1.800 . 6.050 4.603 3.771 5.976 . 0 0 "[ . 1 . 2]" 1
161 1 7 ARG H 1 7 ARG HD2 1.800 . 6.050 4.593 3.922 5.958 . 0 0 "[ . 1 . 2]" 1
162 1 7 ARG H 1 7 ARG HG3 1.800 . 4.910 3.232 2.242 4.482 . 0 0 "[ . 1 . 2]" 1
163 1 7 ARG H 1 7 ARG HG2 1.800 . 4.910 3.538 1.963 4.701 . 0 0 "[ . 1 . 2]" 1
164 1 7 ARG H 1 8 ASP H 1.800 . 4.070 2.619 2.552 2.760 . 0 0 "[ . 1 . 2]" 1
165 1 7 ARG H 1 9 VAL H 1.800 . 5.580 4.131 4.063 4.230 . 0 0 "[ . 1 . 2]" 1
166 1 8 ASP HB3 1 9 VAL H 1.800 . 5.140 3.987 3.450 4.452 . 0 0 "[ . 1 . 2]" 1
167 1 8 ASP HB2 1 9 VAL H 1.800 . 5.140 3.873 3.102 4.468 . 0 0 "[ . 1 . 2]" 1
168 1 8 ASP H 1 8 ASP HB3 1.800 . 3.970 3.162 2.541 3.646 . 0 0 "[ . 1 . 2]" 1
169 1 8 ASP H 1 8 ASP HB2 1.800 . 3.970 2.596 2.364 3.663 . 0 0 "[ . 1 . 2]" 1
170 1 8 ASP H 1 9 VAL HB 1.800 . 5.430 4.727 4.500 4.911 . 0 0 "[ . 1 . 2]" 1
171 1 8 ASP H 1 9 VAL MG2 1.800 . 4.190 3.529 3.403 3.686 . 0 0 "[ . 1 . 2]" 1
172 1 8 ASP H 1 9 VAL H 1.800 . 3.340 2.477 2.271 2.708 . 0 0 "[ . 1 . 2]" 1
173 1 9 VAL HA 1 10 SER H 1.800 . 3.110 2.178 2.116 2.208 . 0 0 "[ . 1 . 2]" 1
174 1 9 VAL HA 1 13 THR MG 1.800 . 5.350 4.396 3.372 5.314 . 0 0 "[ . 1 . 2]" 1
175 1 9 VAL HA 1 16 VAL MG2 1.800 . 5.320 3.911 3.574 4.340 . 0 0 "[ . 1 . 2]" 1
176 1 9 VAL HA 1 9 VAL MG1 1.800 . 3.560 2.393 2.342 2.444 . 0 0 "[ . 1 . 2]" 1
177 1 9 VAL HA 1 9 VAL MG2 1.800 . 3.480 2.338 2.292 2.356 . 0 0 "[ . 1 . 2]" 1
178 1 9 VAL HB 1 10 SER H 1.800 . 5.040 4.220 4.168 4.265 . 0 0 "[ . 1 . 2]" 1
179 1 9 VAL HB 1 51 ILE MD 1.800 . 4.280 3.049 2.694 3.427 . 0 0 "[ . 1 . 2]" 1
180 1 9 VAL MG1 1 10 SER HA 1.800 . 4.790 3.288 3.254 3.326 . 0 0 "[ . 1 . 2]" 1
181 1 9 VAL MG1 1 10 SER H 1.800 . 3.560 2.525 2.411 2.578 . 0 0 "[ . 1 . 2]" 1
182 1 9 VAL MG1 1 51 ILE MD 1.800 . 3.770 2.568 2.247 2.992 . 0 0 "[ . 1 . 2]" 1
183 1 9 VAL MG2 1 10 SER H 1.800 . 5.080 3.897 3.784 3.928 . 0 0 "[ . 1 . 2]" 1
184 1 9 VAL H 1 10 SER H 1.800 . 4.890 4.596 4.533 4.633 . 0 0 "[ . 1 . 2]" 1
185 1 9 VAL H 1 9 VAL HB 1.800 . 3.230 2.425 2.367 2.471 . 0 0 "[ . 1 . 2]" 1
186 1 9 VAL H 1 9 VAL MG1 1.800 . 4.330 3.760 3.743 3.781 . 0 0 "[ . 1 . 2]" 1
187 1 9 VAL H 1 9 VAL MG2 1.800 . 3.210 2.233 2.157 2.404 . 0 0 "[ . 1 . 2]" 1
188 1 10 SER HA 1 11 LEU H 1.800 . 3.400 2.439 2.387 2.512 . 0 0 "[ . 1 . 2]" 1
189 1 10 SER HA 1 12 SER H 1.800 . 4.890 4.124 3.769 4.467 . 0 0 "[ . 1 . 2]" 1
190 1 10 SER HA 1 13 THR H 1.800 . 5.760 4.907 4.697 5.287 . 0 0 "[ . 1 . 2]" 1
191 1 10 SER HA 1 73 VAL MG1 1.800 . 4.880 3.579 3.257 3.870 . 0 0 "[ . 1 . 2]" 1
192 1 10 SER HA 1 80 LEU MD1 1.800 . 3.580 2.625 2.273 2.925 . 0 0 "[ . 1 . 2]" 1
193 1 10 SER HA 1 80 LEU MD2 1.800 . 4.170 3.694 2.893 4.182 0.012 7 0 "[ . 1 . 2]" 1
194 1 10 SER HB3 1 11 LEU H 1.800 . 4.280 3.377 2.300 3.786 . 0 0 "[ . 1 . 2]" 1
195 1 10 SER HB3 1 12 SER H 1.800 . 4.320 3.675 2.471 4.384 0.064 6 0 "[ . 1 . 2]" 1
196 1 10 SER HB3 1 80 LEU MD1 1.800 . 5.310 4.262 3.331 5.007 . 0 0 "[ . 1 . 2]" 1
197 1 10 SER HB2 1 11 LEU H 1.800 . 4.280 2.841 2.365 3.884 . 0 0 "[ . 1 . 2]" 1
198 1 10 SER HB2 1 12 SER H 1.800 . 4.320 2.867 2.418 4.348 0.028 13 0 "[ . 1 . 2]" 1
199 1 10 SER HB2 1 80 LEU MD1 1.800 . 5.310 4.568 3.897 5.309 . 0 0 "[ . 1 . 2]" 1
200 1 10 SER QB 1 13 THR H 1.800 . 4.630 3.874 3.152 4.474 . 0 0 "[ . 1 . 2]" 1
201 1 10 SER QB 1 80 LEU MD2 1.800 . 5.600 4.858 3.947 5.253 . 0 0 "[ . 1 . 2]" 1
202 1 10 SER H 1 13 THR MG 1.800 . 4.860 3.634 2.536 4.739 . 0 0 "[ . 1 . 2]" 1
203 1 10 SER H 1 13 THR H 1.800 . 4.470 3.762 3.586 3.983 . 0 0 "[ . 1 . 2]" 1
204 1 10 SER H 1 16 VAL MG1 1.800 . 5.480 4.214 3.906 4.675 . 0 0 "[ . 1 . 2]" 1
205 1 10 SER H 1 73 VAL MG1 1.800 . 5.150 3.325 3.031 3.790 . 0 0 "[ . 1 . 2]" 1
206 1 11 LEU HA 1 11 LEU MD1 1.800 . 4.410 3.583 2.184 3.861 . 0 0 "[ . 1 . 2]" 1
207 1 11 LEU HA 1 11 LEU MD2 1.800 . 3.270 2.161 2.098 2.301 . 0 0 "[ . 1 . 2]" 1
208 1 11 LEU HA 1 11 LEU HG 1.800 . 4.250 3.089 2.720 3.657 . 0 0 "[ . 1 . 2]" 1
209 1 11 LEU HA 1 13 THR H 1.800 . 5.240 3.571 3.415 3.731 . 0 0 "[ . 1 . 2]" 1
210 1 11 LEU HA 1 73 VAL HB 1.800 . 4.880 3.516 3.190 3.818 . 0 0 "[ . 1 . 2]" 1
211 1 11 LEU HA 1 73 VAL MG1 1.800 . 4.110 2.848 2.511 3.181 . 0 0 "[ . 1 . 2]" 1
212 1 11 LEU QB 1 11 LEU MD1 1.800 . 3.300 2.122 2.091 2.206 . 0 0 "[ . 1 . 2]" 1
213 1 11 LEU QB 1 11 LEU MD2 1.800 . 3.540 2.243 2.173 2.337 . 0 0 "[ . 1 . 2]" 1
214 1 11 LEU QB 1 12 SER H 1.800 . 4.200 2.912 2.591 3.312 . 0 0 "[ . 1 . 2]" 1
215 1 11 LEU QB 1 73 VAL MG1 1.800 . 5.400 4.326 4.001 4.700 . 0 0 "[ . 1 . 2]" 1
216 1 11 LEU MD1 1 12 SER H 1.800 . 6.010 4.759 4.519 5.067 . 0 0 "[ . 1 . 2]" 1
217 1 11 LEU MD1 1 74 ALA HA 1.800 . 6.050 4.997 2.809 5.824 . 0 0 "[ . 1 . 2]" 1
218 1 11 LEU MD1 1 75 GLN HE21 1.800 . 5.170 4.066 2.111 5.175 0.005 17 0 "[ . 1 . 2]" 1
219 1 11 LEU MD1 1 75 GLN HE22 1.800 . 4.970 3.833 2.337 5.060 0.090 12 0 "[ . 1 . 2]" 1
220 1 11 LEU MD1 1 75 GLN QG 1.800 . 4.710 4.058 2.350 4.774 0.064 13 0 "[ . 1 . 2]" 1
221 1 11 LEU MD1 1 75 GLN H 1.800 . 4.920 4.643 3.101 4.997 0.077 4 0 "[ . 1 . 2]" 1
222 1 11 LEU MD2 1 12 SER H 1.800 . 5.530 4.552 3.891 4.915 . 0 0 "[ . 1 . 2]" 1
223 1 11 LEU MD2 1 73 VAL HB 1.800 . 4.630 3.723 3.059 4.518 . 0 0 "[ . 1 . 2]" 1
224 1 11 LEU MD2 1 74 ALA HA 1.800 . 4.130 3.485 3.054 4.270 0.140 19 0 "[ . 1 . 2]" 1
225 1 11 LEU MD2 1 75 GLN QB 1.800 . 4.820 2.546 2.243 4.255 . 0 0 "[ . 1 . 2]" 1
226 1 11 LEU MD2 1 75 GLN QG 1.800 . 4.390 3.878 2.665 4.402 0.012 14 0 "[ . 1 . 2]" 1
227 1 11 LEU MD2 1 75 GLN H 1.800 . 4.200 3.623 3.135 4.280 0.080 19 0 "[ . 1 . 2]" 1
228 1 11 LEU HG 1 73 VAL MG1 1.800 . 4.800 3.967 3.245 4.837 0.037 13 0 "[ . 1 . 2]" 1
229 1 11 LEU HG 1 80 LEU MD2 1.800 . 4.230 3.082 2.406 4.107 . 0 0 "[ . 1 . 2]" 1
230 1 11 LEU H 1 11 LEU QB 1.800 . 3.490 2.419 2.218 2.609 . 0 0 "[ . 1 . 2]" 1
231 1 11 LEU H 1 11 LEU MD1 1.800 . 4.770 3.519 3.172 3.846 . 0 0 "[ . 1 . 2]" 1
232 1 11 LEU H 1 11 LEU MD2 1.800 . 4.570 3.069 1.781 3.707 0.019 13 0 "[ . 1 . 2]" 1
233 1 11 LEU H 1 11 LEU HG 1.800 . 3.920 2.334 1.827 3.724 . 0 0 "[ . 1 . 2]" 1
234 1 11 LEU H 1 12 SER H 1.800 . 3.580 2.613 2.533 2.684 . 0 0 "[ . 1 . 2]" 1
235 1 11 LEU H 1 73 VAL MG1 1.800 . 5.140 3.908 3.643 4.310 . 0 0 "[ . 1 . 2]" 1
236 1 11 LEU H 1 80 LEU MD1 1.800 . 4.200 3.803 2.806 4.222 0.022 12 0 "[ . 1 . 2]" 1
237 1 11 LEU H 1 80 LEU MD2 1.800 . 4.740 3.861 3.229 4.726 . 0 0 "[ . 1 . 2]" 1
238 1 12 SER HB3 1 13 THR H 1.800 . 4.920 3.732 3.069 4.173 . 0 0 "[ . 1 . 2]" 1
239 1 12 SER HB2 1 13 THR H 1.800 . 4.920 3.728 2.741 4.168 . 0 0 "[ . 1 . 2]" 1
240 1 12 SER QB 1 13 THR MG 1.800 . 5.320 2.908 2.484 3.712 . 0 0 "[ . 1 . 2]" 1
241 1 12 SER H 1 12 SER QB 1.800 . 3.320 2.393 2.227 2.654 . 0 0 "[ . 1 . 2]" 1
242 1 12 SER H 1 13 THR H 1.800 . 3.420 2.663 2.459 2.785 . 0 0 "[ . 1 . 2]" 1
243 1 12 SER H 1 80 LEU MD1 1.800 . 6.050 5.805 4.978 6.124 0.074 16 0 "[ . 1 . 2]" 1
244 1 13 THR HA 1 13 THR MG 1.800 . 3.530 2.461 2.253 3.176 . 0 0 "[ . 1 . 2]" 1
245 1 13 THR HA 1 14 PRO HD3 1.800 . 3.660 2.572 2.233 2.888 . 0 0 "[ . 1 . 2]" 1
246 1 13 THR HA 1 14 PRO HD2 1.800 . 3.660 2.276 2.152 2.377 . 0 0 "[ . 1 . 2]" 1
247 1 13 THR HA 1 14 PRO QG 1.800 . 5.500 4.041 3.956 4.114 . 0 0 "[ . 1 . 2]" 1
248 1 13 THR HB 1 16 VAL MG1 1.800 . 3.830 2.178 2.007 3.473 . 0 0 "[ . 1 . 2]" 1
249 1 13 THR HB 1 16 VAL MG2 1.800 . 6.000 4.247 3.815 5.726 . 0 0 "[ . 1 . 2]" 1
250 1 13 THR MG 1 14 PRO HD3 1.800 . 5.370 4.292 3.919 4.493 . 0 0 "[ . 1 . 2]" 1
251 1 13 THR MG 1 14 PRO HD2 1.800 . 5.370 4.232 3.328 4.837 . 0 0 "[ . 1 . 2]" 1
252 1 13 THR MG 1 15 TYR H 1.800 . 5.140 5.070 4.789 5.219 0.079 18 0 "[ . 1 . 2]" 1
253 1 13 THR MG 1 16 VAL MG1 1.800 . 4.030 2.973 2.236 3.168 . 0 0 "[ . 1 . 2]" 1
254 1 13 THR H 1 13 THR MG 1.800 . 3.840 2.452 1.964 2.877 . 0 0 "[ . 1 . 2]" 1
255 1 13 THR H 1 14 PRO QD 1.800 . 5.100 3.522 3.192 4.379 . 0 0 "[ . 1 . 2]" 1
256 1 13 THR H 1 16 VAL MG1 1.800 . 5.350 4.526 4.306 4.742 . 0 0 "[ . 1 . 2]" 1
257 1 13 THR H 1 73 VAL MG1 1.800 . 5.480 4.410 4.074 4.792 . 0 0 "[ . 1 . 2]" 1
258 1 13 THR H 1 73 VAL MG2 1.800 . 5.160 4.239 3.933 4.557 . 0 0 "[ . 1 . 2]" 1
259 1 14 PRO HA 1 73 VAL HB 1.800 . 3.610 2.771 2.314 3.678 0.068 19 0 "[ . 1 . 2]" 1
260 1 14 PRO HA 1 73 VAL MG1 1.800 . 5.260 4.265 3.864 5.008 . 0 0 "[ . 1 . 2]" 1
261 1 14 PRO HA 1 73 VAL MG2 1.800 . 4.300 3.420 2.711 4.208 . 0 0 "[ . 1 . 2]" 1
262 1 14 PRO HA 1 73 VAL H 1.800 . 4.650 3.152 2.771 4.241 . 0 0 "[ . 1 . 2]" 1
263 1 14 PRO QB 1 15 TYR QD 1.800 . 5.290 2.997 2.385 3.619 . 0 0 "[ . 1 . 2]" 1
264 1 14 PRO QB 1 15 TYR H 1.800 . 4.310 2.934 2.537 3.544 . 0 0 "[ . 1 . 2]" 1
265 1 14 PRO HD3 1 15 TYR H 1.800 . 4.660 3.982 3.763 4.139 . 0 0 "[ . 1 . 2]" 1
266 1 14 PRO HD2 1 15 TYR H 1.800 . 4.660 2.765 2.490 2.895 . 0 0 "[ . 1 . 2]" 1
267 1 14 PRO HG3 1 15 TYR H 1.800 . 5.320 4.267 3.415 4.608 . 0 0 "[ . 1 . 2]" 1
268 1 14 PRO HG2 1 15 TYR H 1.800 . 5.320 3.218 1.784 4.048 0.016 2 0 "[ . 1 . 2]" 1
269 1 14 PRO QG 1 15 TYR QD 1.800 . 5.140 3.211 2.317 4.349 . 0 0 "[ . 1 . 2]" 1
270 1 15 TYR HA 1 15 TYR QD 1.800 . 4.520 2.472 2.317 2.723 . 0 0 "[ . 1 . 2]" 1
271 1 15 TYR HA 1 16 VAL MG1 1.800 . 5.160 3.837 3.685 3.985 . 0 0 "[ . 1 . 2]" 1
272 1 15 TYR HA 1 16 VAL MG2 1.800 . 4.850 3.546 3.400 3.728 . 0 0 "[ . 1 . 2]" 1
273 1 15 TYR HA 1 16 VAL H 1.800 . 3.250 2.180 2.133 2.204 . 0 0 "[ . 1 . 2]" 1
274 1 15 TYR HA 1 71 ALA H 1.800 . 5.470 4.429 4.168 4.822 . 0 0 "[ . 1 . 2]" 1
275 1 15 TYR HA 1 72 ARG HA 1.800 . 4.070 3.092 2.414 3.423 . 0 0 "[ . 1 . 2]" 1
276 1 15 TYR HA 1 73 VAL MG2 1.800 . 5.050 3.849 3.131 4.276 . 0 0 "[ . 1 . 2]" 1
277 1 15 TYR HA 1 73 VAL H 1.800 . 4.950 3.941 3.357 4.244 . 0 0 "[ . 1 . 2]" 1
278 1 15 TYR HB3 1 16 VAL H 1.800 . 4.550 3.455 3.112 3.805 . 0 0 "[ . 1 . 2]" 1
279 1 15 TYR HB3 1 70 ASN HA 1.800 . 6.050 2.922 2.323 3.809 . 0 0 "[ . 1 . 2]" 1
280 1 15 TYR HB2 1 16 VAL H 1.800 . 5.610 4.293 4.094 4.450 . 0 0 "[ . 1 . 2]" 1
281 1 15 TYR HB2 1 70 ASN HA 1.800 . 6.050 4.605 4.011 5.506 . 0 0 "[ . 1 . 2]" 1
282 1 15 TYR QD 1 16 VAL H 1.800 . 5.080 3.965 3.732 4.231 . 0 0 "[ . 1 . 2]" 1
283 1 15 TYR QD 1 70 ASN HA 1.800 . 4.830 3.557 3.217 4.224 . 0 0 "[ . 1 . 2]" 1
284 1 15 TYR QD 1 72 ARG HA 1.800 . 4.880 3.337 2.465 3.733 . 0 0 "[ . 1 . 2]" 1
285 1 15 TYR QD 1 72 ARG QG 1.800 . 4.870 4.276 3.710 4.871 0.001 10 0 "[ . 1 . 2]" 1
286 1 15 TYR QE 1 72 ARG QB 1.800 . 3.950 3.149 2.321 3.944 . 0 0 "[ . 1 . 2]" 1
287 1 15 TYR QE 1 72 ARG HD3 1.800 . 4.800 4.082 3.128 4.851 0.051 17 0 "[ . 1 . 2]" 1
288 1 15 TYR QE 1 72 ARG HD2 1.800 . 4.800 4.478 3.288 4.870 0.070 9 0 "[ . 1 . 2]" 1
289 1 15 TYR QE 1 72 ARG QG 1.800 . 4.740 3.605 2.833 4.552 . 0 0 "[ . 1 . 2]" 1
290 1 15 TYR H 1 15 TYR QB 1.800 . 3.810 2.553 2.431 2.750 . 0 0 "[ . 1 . 2]" 1
291 1 15 TYR H 1 15 TYR QD 1.800 . 4.300 3.164 2.854 3.408 . 0 0 "[ . 1 . 2]" 1
292 1 15 TYR H 1 16 VAL MG1 1.800 . 4.480 3.428 3.065 3.862 . 0 0 "[ . 1 . 2]" 1
293 1 15 TYR H 1 16 VAL MG2 1.800 . 5.640 4.595 4.178 5.078 . 0 0 "[ . 1 . 2]" 1
294 1 15 TYR H 1 16 VAL H 1.800 . 4.910 4.293 4.028 4.486 . 0 0 "[ . 1 . 2]" 1
295 1 15 TYR H 1 73 VAL MG2 1.800 . 4.930 4.389 3.927 4.855 . 0 0 "[ . 1 . 2]" 1
296 1 16 VAL HA 1 16 VAL MG1 1.800 . 3.690 2.260 2.233 2.317 . 0 0 "[ . 1 . 2]" 1
297 1 16 VAL HA 1 16 VAL MG2 1.800 . 4.190 3.199 3.189 3.214 . 0 0 "[ . 1 . 2]" 1
298 1 16 VAL HA 1 17 SER H 1.800 . 3.280 2.436 2.311 2.659 . 0 0 "[ . 1 . 2]" 1
299 1 16 VAL HB 1 17 SER H 1.800 . 3.510 2.367 1.939 2.561 . 0 0 "[ . 1 . 2]" 1
300 1 16 VAL MG1 1 17 SER H 1.800 . 4.530 3.616 3.499 3.698 . 0 0 "[ . 1 . 2]" 1
301 1 16 VAL MG2 1 17 SER HA 1.800 . 5.490 3.922 3.650 4.030 . 0 0 "[ . 1 . 2]" 1
302 1 16 VAL MG2 1 17 SER H 1.800 . 4.180 3.451 3.055 3.634 . 0 0 "[ . 1 . 2]" 1
303 1 16 VAL MG2 1 71 ALA MB 1.800 . 3.740 2.612 2.273 3.387 . 0 0 "[ . 1 . 2]" 1
304 1 16 VAL MG2 1 71 ALA H 1.800 . 5.000 3.870 3.435 4.447 . 0 0 "[ . 1 . 2]" 1
305 1 16 VAL MG2 1 73 VAL MG2 1.800 . 3.640 2.231 2.037 2.622 . 0 0 "[ . 1 . 2]" 1
306 1 16 VAL MG2 1 82 LEU MD2 1.800 . 3.600 2.761 2.378 3.305 . 0 0 "[ . 1 . 2]" 1
307 1 16 VAL H 1 16 VAL MG1 1.800 . 4.190 3.134 3.026 3.252 . 0 0 "[ . 1 . 2]" 1
308 1 16 VAL H 1 16 VAL MG2 1.800 . 3.520 2.198 2.053 2.330 . 0 0 "[ . 1 . 2]" 1
309 1 16 VAL H 1 17 SER H 1.800 . 5.290 4.429 4.380 4.467 . 0 0 "[ . 1 . 2]" 1
310 1 16 VAL H 1 70 ASN HA 1.800 . 4.980 3.768 3.074 4.657 . 0 0 "[ . 1 . 2]" 1
311 1 16 VAL H 1 70 ASN H 1.800 . 5.330 4.576 3.996 5.146 . 0 0 "[ . 1 . 2]" 1
312 1 16 VAL H 1 71 ALA MB 1.800 . 4.630 3.197 2.927 3.649 . 0 0 "[ . 1 . 2]" 1
313 1 16 VAL H 1 72 ARG HA 1.800 . 5.160 4.222 3.556 4.437 . 0 0 "[ . 1 . 2]" 1
314 1 16 VAL H 1 73 VAL MG2 1.800 . 4.510 3.717 3.245 4.226 . 0 0 "[ . 1 . 2]" 1
315 1 17 SER HA 1 18 VAL MG1 1.800 . 5.540 3.740 3.534 5.423 . 0 0 "[ . 1 . 2]" 1
316 1 17 SER HA 1 18 VAL MG2 1.800 . 5.040 3.480 3.292 3.553 . 0 0 "[ . 1 . 2]" 1
317 1 17 SER HA 1 18 VAL H 1.800 . 3.390 2.221 2.165 2.266 . 0 0 "[ . 1 . 2]" 1
318 1 17 SER HA 1 68 ILE MG 1.800 . 6.030 4.016 3.214 4.207 . 0 0 "[ . 1 . 2]" 1
319 1 17 SER HA 1 69 ASP HA 1.800 . 4.150 2.669 2.296 3.071 . 0 0 "[ . 1 . 2]" 1
320 1 17 SER HA 1 70 ASN H 1.800 . 4.480 3.371 2.985 3.923 . 0 0 "[ . 1 . 2]" 1
321 1 17 SER HA 1 71 ALA MB 1.800 . 5.790 3.364 3.115 3.631 . 0 0 "[ . 1 . 2]" 1
322 1 17 SER HA 1 71 ALA H 1.800 . 4.890 3.275 3.002 3.470 . 0 0 "[ . 1 . 2]" 1
323 1 17 SER HB3 1 69 ASP HA 1.800 . 5.080 3.335 2.298 4.296 . 0 0 "[ . 1 . 2]" 1
324 1 17 SER HB2 1 69 ASP HA 1.800 . 5.080 3.139 2.361 4.032 . 0 0 "[ . 1 . 2]" 1
325 1 17 SER QB 1 18 VAL H 1.800 . 4.210 3.355 2.753 3.730 . 0 0 "[ . 1 . 2]" 1
326 1 17 SER QB 1 69 ASP QB 1.800 . 5.700 3.795 3.189 4.270 . 0 0 "[ . 1 . 2]" 1
327 1 17 SER H 1 17 SER HB3 1.800 . 4.290 3.143 2.473 3.886 . 0 0 "[ . 1 . 2]" 1
328 1 17 SER H 1 17 SER HB2 1.800 . 4.290 2.953 2.565 3.738 . 0 0 "[ . 1 . 2]" 1
329 1 17 SER H 1 18 VAL H 1.800 . 5.470 4.436 4.338 4.522 . 0 0 "[ . 1 . 2]" 1
330 1 17 SER H 1 70 ASN H 1.800 . 6.050 4.713 4.446 5.243 . 0 0 "[ . 1 . 2]" 1
331 1 18 VAL HA 1 18 VAL MG1 1.800 . 3.730 2.279 2.230 2.339 . 0 0 "[ . 1 . 2]" 1
332 1 18 VAL HA 1 18 VAL MG2 1.800 . 4.400 3.166 2.463 3.215 . 0 0 "[ . 1 . 2]" 1
333 1 18 VAL HA 1 19 ILE H 1.800 . 3.380 2.364 2.311 2.398 . 0 0 "[ . 1 . 2]" 1
334 1 18 VAL HB 1 19 ILE H 1.800 . 3.620 2.575 2.448 3.599 . 0 0 "[ . 1 . 2]" 1
335 1 18 VAL MG1 1 19 ILE H 1.800 . 4.810 3.599 2.052 3.715 . 0 0 "[ . 1 . 2]" 1
336 1 18 VAL MG1 1 82 LEU MD1 1.800 . 4.130 2.467 2.014 2.944 . 0 0 "[ . 1 . 2]" 1
337 1 18 VAL MG2 1 19 ILE HA 1.800 . 5.520 3.861 3.710 5.480 . 0 0 "[ . 1 . 2]" 1
338 1 18 VAL MG2 1 19 ILE H 1.800 . 4.650 3.585 3.491 4.038 . 0 0 "[ . 1 . 2]" 1
339 1 18 VAL MG2 1 68 ILE HB 1.800 . 3.930 2.452 2.090 3.626 . 0 0 "[ . 1 . 2]" 1
340 1 18 VAL MG2 1 68 ILE QG 1.800 . 4.940 3.548 3.106 4.984 0.044 9 0 "[ . 1 . 2]" 1
341 1 18 VAL MG2 1 68 ILE H 1.800 . 4.650 3.263 2.877 4.660 0.010 9 0 "[ . 1 . 2]" 1
342 1 18 VAL MG2 1 71 ALA MB 1.800 . 4.930 3.064 2.709 3.492 . 0 0 "[ . 1 . 2]" 1
343 1 18 VAL MG2 1 82 LEU MD1 1.800 . 3.960 2.108 1.982 2.398 . 0 0 "[ . 1 . 2]" 1
344 1 18 VAL H 1 18 VAL MG1 1.800 . 4.440 3.058 2.927 3.971 . 0 0 "[ . 1 . 2]" 1
345 1 18 VAL H 1 18 VAL MG2 1.800 . 3.700 2.153 2.014 2.626 . 0 0 "[ . 1 . 2]" 1
346 1 18 VAL H 1 67 ARG HA 1.800 . 6.050 4.951 4.687 5.370 . 0 0 "[ . 1 . 2]" 1
347 1 18 VAL H 1 67 ARG QG 1.800 . 5.870 3.984 3.619 4.544 . 0 0 "[ . 1 . 2]" 1
348 1 18 VAL H 1 68 ILE HB 1.800 . 4.370 3.027 2.680 3.212 . 0 0 "[ . 1 . 2]" 1
349 1 18 VAL H 1 68 ILE QG 1.800 . 5.870 4.718 4.453 4.925 . 0 0 "[ . 1 . 2]" 1
350 1 18 VAL H 1 68 ILE H 1.800 . 4.550 3.242 2.961 3.527 . 0 0 "[ . 1 . 2]" 1
351 1 18 VAL H 1 69 ASP HA 1.800 . 5.390 3.976 3.632 4.258 . 0 0 "[ . 1 . 2]" 1
352 1 18 VAL H 1 71 ALA MB 1.800 . 5.380 3.868 3.543 4.260 . 0 0 "[ . 1 . 2]" 1
353 1 19 ILE HA 1 19 ILE MD 1.800 . 4.950 3.650 2.094 3.832 . 0 0 "[ . 1 . 2]" 1
354 1 19 ILE HA 1 19 ILE MG 1.800 . 3.670 3.030 2.323 3.206 . 0 0 "[ . 1 . 2]" 1
355 1 19 ILE HA 1 20 GLY H 1.800 . 3.450 2.216 2.153 2.291 . 0 0 "[ . 1 . 2]" 1
356 1 19 ILE HA 1 44 ILE MD 1.800 . 4.650 3.734 3.256 4.350 . 0 0 "[ . 1 . 2]" 1
357 1 19 ILE HA 1 67 ARG HA 1.800 . 4.050 2.351 2.247 2.890 . 0 0 "[ . 1 . 2]" 1
358 1 19 ILE HA 1 68 ILE H 1.800 . 4.470 3.304 3.155 3.479 . 0 0 "[ . 1 . 2]" 1
359 1 19 ILE HB 1 20 GLY H 1.800 . 5.060 4.198 4.111 4.285 . 0 0 "[ . 1 . 2]" 1
360 1 19 ILE MD 1 67 ARG HA 1.800 . 4.990 3.865 2.204 4.751 . 0 0 "[ . 1 . 2]" 1
361 1 19 ILE MD 1 67 ARG QB 1.800 . 4.930 2.703 2.185 4.360 . 0 0 "[ . 1 . 2]" 1
362 1 19 ILE MD 1 67 ARG QD 1.800 . 4.420 2.788 2.283 4.134 . 0 0 "[ . 1 . 2]" 1
363 1 19 ILE MD 1 67 ARG QG 1.800 . 4.820 3.161 2.702 3.451 . 0 0 "[ . 1 . 2]" 1
364 1 19 ILE QG 1 67 ARG HA 1.800 . 4.000 2.804 2.298 4.245 0.245 3 0 "[ . 1 . 2]" 1
365 1 19 ILE QG 1 67 ARG QB 1.800 . 4.930 2.698 2.312 3.853 . 0 0 "[ . 1 . 2]" 1
366 1 19 ILE QG 1 67 ARG QD 1.800 . 4.280 3.875 3.009 4.405 0.125 3 0 "[ . 1 . 2]" 1
367 1 19 ILE QG 1 67 ARG QG 1.800 . 4.400 3.158 2.131 3.862 . 0 0 "[ . 1 . 2]" 1
368 1 19 ILE MD 1 19 ILE MG 1.800 . 3.490 2.065 1.872 3.236 . 0 0 "[ . 1 . 2]" 1
369 1 19 ILE HG13 1 19 ILE MG 1.800 . 4.550 3.142 2.257 3.201 . 0 0 "[ . 1 . 2]" 1
370 1 19 ILE HG12 1 19 ILE MG 1.800 . 4.550 2.273 2.191 2.451 . 0 0 "[ . 1 . 2]" 1
371 1 19 ILE MG 1 20 GLY QA 1.800 . 4.140 3.442 3.044 3.821 . 0 0 "[ . 1 . 2]" 1
372 1 19 ILE MG 1 20 GLY H 1.800 . 4.000 3.553 2.461 4.095 0.095 3 0 "[ . 1 . 2]" 1
373 1 19 ILE MG 1 44 ILE MD 1.800 . 5.390 4.967 4.606 5.242 . 0 0 "[ . 1 . 2]" 1
374 1 19 ILE MG 1 67 ARG HA 1.800 . 4.770 4.341 3.136 4.793 0.023 2 0 "[ . 1 . 2]" 1
375 1 19 ILE H 1 19 ILE HB 1.800 . 3.750 3.134 2.627 3.396 . 0 0 "[ . 1 . 2]" 1
376 1 19 ILE H 1 19 ILE MD 1.800 . 5.410 4.556 3.923 4.759 . 0 0 "[ . 1 . 2]" 1
377 1 19 ILE H 1 19 ILE QG 1.800 . 5.330 3.886 2.841 4.165 . 0 0 "[ . 1 . 2]" 1
378 1 19 ILE H 1 19 ILE MG 1.800 . 4.890 2.486 2.084 3.868 . 0 0 "[ . 1 . 2]" 1
379 1 19 ILE H 1 44 ILE MD 1.800 . 4.940 4.429 3.926 4.939 . 0 0 "[ . 1 . 2]" 1
380 1 20 GLY HA3 1 44 ILE MD 1.800 . 4.990 2.946 2.309 3.504 . 0 0 "[ . 1 . 2]" 1
381 1 20 GLY HA3 1 45 GLU H 1.800 . 6.050 3.966 3.701 4.177 . 0 0 "[ . 1 . 2]" 1
382 1 20 GLY HA2 1 44 ILE MD 1.800 . 4.990 4.220 3.650 4.672 . 0 0 "[ . 1 . 2]" 1
383 1 20 GLY HA2 1 45 GLU H 1.800 . 6.050 5.152 4.870 5.442 . 0 0 "[ . 1 . 2]" 1
384 1 20 GLY H 1 21 LYS H 1.800 . 5.700 4.363 4.304 4.392 . 0 0 "[ . 1 . 2]" 1
385 1 20 GLY H 1 44 ILE MD 1.800 . 3.970 3.033 2.546 3.498 . 0 0 "[ . 1 . 2]" 1
386 1 20 GLY H 1 67 ARG HA 1.800 . 5.650 3.687 3.482 3.891 . 0 0 "[ . 1 . 2]" 1
387 1 21 LYS HA 1 21 LYS QD 1.800 . 5.520 4.178 3.888 4.461 . 0 0 "[ . 1 . 2]" 1
388 1 21 LYS HA 1 22 ILE HB 1.800 . 5.610 4.590 4.441 4.822 . 0 0 "[ . 1 . 2]" 1
389 1 21 LYS HA 1 22 ILE H 1.800 . 3.620 2.179 2.108 2.247 . 0 0 "[ . 1 . 2]" 1
390 1 21 LYS HA 1 65 VAL HA 1.800 . 4.040 2.301 2.224 2.584 . 0 0 "[ . 1 . 2]" 1
391 1 21 LYS HA 1 65 VAL MG1 1.800 . 4.730 3.547 2.572 3.982 . 0 0 "[ . 1 . 2]" 1
392 1 21 LYS HA 1 65 VAL MG2 1.800 . 4.730 3.618 3.016 4.801 0.071 1 0 "[ . 1 . 2]" 1
393 1 21 LYS QB 1 21 LYS QE 1.800 . 4.830 2.720 2.024 3.677 . 0 0 "[ . 1 . 2]" 1
394 1 21 LYS QB 1 45 GLU H 1.800 . 4.930 4.031 3.219 4.790 . 0 0 "[ . 1 . 2]" 1
395 1 21 LYS QB 1 65 VAL HA 1.800 . 6.050 3.444 2.640 4.289 . 0 0 "[ . 1 . 2]" 1
396 1 21 LYS QD 1 63 SER HA 1.800 . 5.220 3.833 2.160 5.152 . 0 0 "[ . 1 . 2]" 1
397 1 21 LYS QE 1 23 THR MG 1.800 . 3.920 3.194 2.158 4.063 0.143 2 0 "[ . 1 . 2]" 1
398 1 21 LYS QE 1 63 SER HA 1.800 . 4.300 2.845 2.164 4.377 0.077 7 0 "[ . 1 . 2]" 1
399 1 21 LYS QE 1 63 SER QB 1.800 . 4.880 3.325 2.183 4.969 0.089 2 0 "[ . 1 . 2]" 1
400 1 21 LYS QG 1 22 ILE H 1.800 . 4.350 3.409 2.549 4.157 . 0 0 "[ . 1 . 2]" 1
401 1 21 LYS QG 1 63 SER HA 1.800 . 4.790 3.332 2.171 4.520 . 0 0 "[ . 1 . 2]" 1
402 1 21 LYS H 1 21 LYS QB 1.800 . 3.850 2.617 2.372 3.007 . 0 0 "[ . 1 . 2]" 1
403 1 21 LYS H 1 21 LYS QG 1.800 . 5.300 2.915 1.900 4.083 . 0 0 "[ . 1 . 2]" 1
404 1 21 LYS H 1 44 ILE MD 1.800 . 5.360 4.067 3.696 4.524 . 0 0 "[ . 1 . 2]" 1
405 1 21 LYS H 1 44 ILE HG13 1.800 . 4.790 3.177 2.792 3.539 . 0 0 "[ . 1 . 2]" 1
406 1 21 LYS H 1 44 ILE HG12 1.800 . 4.790 3.597 3.107 3.927 . 0 0 "[ . 1 . 2]" 1
407 1 21 LYS H 1 45 GLU QG 1.800 . 5.900 4.343 2.774 5.217 . 0 0 "[ . 1 . 2]" 1
408 1 21 LYS H 1 45 GLU H 1.800 . 4.100 2.838 2.620 3.069 . 0 0 "[ . 1 . 2]" 1
409 1 21 LYS H 1 46 ASP HA 1.800 . 6.050 4.057 3.777 4.434 . 0 0 "[ . 1 . 2]" 1
410 1 22 ILE HA 1 22 ILE MD 1.800 . 4.000 3.015 2.078 3.834 . 0 0 "[ . 1 . 2]" 1
411 1 22 ILE HA 1 23 THR MG 1.800 . 5.410 3.778 3.305 5.458 0.048 5 0 "[ . 1 . 2]" 1
412 1 22 ILE HA 1 23 THR H 1.800 . 3.410 2.182 2.148 2.207 . 0 0 "[ . 1 . 2]" 1
413 1 22 ILE HA 1 44 ILE HA 1.800 . 3.890 2.479 2.283 2.867 . 0 0 "[ . 1 . 2]" 1
414 1 22 ILE HA 1 44 ILE HB 1.800 . 5.480 3.517 3.280 3.799 . 0 0 "[ . 1 . 2]" 1
415 1 22 ILE HA 1 44 ILE QG 1.800 . 5.830 3.228 3.009 3.724 . 0 0 "[ . 1 . 2]" 1
416 1 22 ILE HA 1 45 GLU H 1.800 . 6.050 4.052 3.803 4.336 . 0 0 "[ . 1 . 2]" 1
417 1 22 ILE HB 1 23 THR H 1.800 . 5.470 4.172 4.018 4.316 . 0 0 "[ . 1 . 2]" 1
418 1 22 ILE HB 1 62 ASP HA 1.800 . 5.040 4.341 2.880 5.004 . 0 0 "[ . 1 . 2]" 1
419 1 22 ILE HB 1 63 SER H 1.800 . 5.160 4.416 3.665 4.895 . 0 0 "[ . 1 . 2]" 1
420 1 22 ILE HB 1 64 ASP H 1.800 . 4.300 3.513 2.782 4.108 . 0 0 "[ . 1 . 2]" 1
421 1 22 ILE MD 1 23 THR H 1.800 . 5.540 4.588 3.658 5.109 . 0 0 "[ . 1 . 2]" 1
422 1 22 ILE MD 1 44 ILE HA 1.800 . 5.000 4.001 2.979 5.043 0.043 10 0 "[ . 1 . 2]" 1
423 1 22 ILE MD 1 44 ILE HB 1.800 . 4.070 3.368 2.468 4.010 . 0 0 "[ . 1 . 2]" 1
424 1 22 ILE MD 1 44 ILE QG 1.800 . 3.980 2.915 2.254 4.056 0.076 17 0 "[ . 1 . 2]" 1
425 1 22 ILE QG 1 23 THR H 1.800 . 5.870 4.228 3.948 4.790 . 0 0 "[ . 1 . 2]" 1
426 1 22 ILE QG 1 66 VAL MG1 1.800 . 5.180 4.193 2.643 5.100 . 0 0 "[ . 1 . 2]" 1
427 1 22 ILE QG 1 66 VAL MG2 1.800 . 4.270 2.874 1.998 3.574 . 0 0 "[ . 1 . 2]" 1
428 1 22 ILE QG 1 22 ILE MG 1.800 . 3.600 2.202 2.048 2.314 . 0 0 "[ . 1 . 2]" 1
429 1 22 ILE MG 1 23 THR HA 1.800 . 4.770 3.555 3.414 3.767 . 0 0 "[ . 1 . 2]" 1
430 1 22 ILE MG 1 23 THR H 1.800 . 3.720 2.554 2.399 2.705 . 0 0 "[ . 1 . 2]" 1
431 1 22 ILE MG 1 24 GLY H 1.800 . 5.800 4.769 4.383 5.047 . 0 0 "[ . 1 . 2]" 1
432 1 22 ILE MG 1 25 ILE HB 1.800 . 5.820 5.443 4.759 5.680 . 0 0 "[ . 1 . 2]" 1
433 1 22 ILE MG 1 25 ILE MD 1.800 . 3.550 2.019 1.899 2.165 . 0 0 "[ . 1 . 2]" 1
434 1 22 ILE MG 1 25 ILE HG13 1.800 . 4.190 4.014 3.218 4.301 0.111 1 0 "[ . 1 . 2]" 1
435 1 22 ILE MG 1 25 ILE HG12 1.800 . 4.190 3.869 2.694 4.180 . 0 0 "[ . 1 . 2]" 1
436 1 22 ILE MG 1 43 TYR H 1.800 . 5.170 3.396 3.014 4.234 . 0 0 "[ . 1 . 2]" 1
437 1 22 ILE MG 1 60 LEU HB3 1.800 . 5.260 2.714 2.277 3.399 . 0 0 "[ . 1 . 2]" 1
438 1 22 ILE MG 1 60 LEU HB2 1.800 . 5.260 3.344 2.388 4.045 . 0 0 "[ . 1 . 2]" 1
439 1 22 ILE MG 1 60 LEU MD1 1.800 . 4.520 2.455 2.184 2.838 . 0 0 "[ . 1 . 2]" 1
440 1 22 ILE MG 1 62 ASP HA 1.800 . 3.870 3.615 3.316 3.900 0.030 10 0 "[ . 1 . 2]" 1
441 1 22 ILE MG 1 62 ASP H 1.800 . 6.050 5.293 4.911 5.861 . 0 0 "[ . 1 . 2]" 1
442 1 22 ILE MG 1 63 SER H 1.800 . 4.800 4.214 3.717 4.573 . 0 0 "[ . 1 . 2]" 1
443 1 22 ILE MG 1 64 ASP QB 1.800 . 5.600 4.818 3.903 5.649 0.049 9 0 "[ . 1 . 2]" 1
444 1 22 ILE MG 1 64 ASP H 1.800 . 4.940 4.534 4.022 4.997 0.057 11 0 "[ . 1 . 2]" 1
445 1 22 ILE H 1 22 ILE HB 1.800 . 3.950 2.482 2.352 2.640 . 0 0 "[ . 1 . 2]" 1
446 1 22 ILE H 1 22 ILE MD 1.800 . 4.410 2.833 1.896 3.722 . 0 0 "[ . 1 . 2]" 1
447 1 22 ILE H 1 22 ILE HG13 1.800 . 4.730 3.309 2.516 3.836 . 0 0 "[ . 1 . 2]" 1
448 1 22 ILE H 1 22 ILE HG12 1.800 . 4.730 3.504 2.133 4.091 . 0 0 "[ . 1 . 2]" 1
449 1 22 ILE H 1 63 SER H 1.800 . 5.640 4.449 3.570 5.140 . 0 0 "[ . 1 . 2]" 1
450 1 22 ILE H 1 64 ASP QB 1.800 . 5.870 4.103 3.161 4.831 . 0 0 "[ . 1 . 2]" 1
451 1 22 ILE H 1 64 ASP H 1.800 . 4.990 2.989 2.439 3.526 . 0 0 "[ . 1 . 2]" 1
452 1 22 ILE H 1 65 VAL HA 1.800 . 4.810 3.810 3.415 4.183 . 0 0 "[ . 1 . 2]" 1
453 1 22 ILE H 1 65 VAL QG 1.800 . 5.090 4.435 3.986 4.725 . 0 0 "[ . 1 . 2]" 1
454 1 23 THR HA 1 23 THR MG 1.800 . 3.590 2.504 2.241 3.206 . 0 0 "[ . 1 . 2]" 1
455 1 23 THR HA 1 24 GLY H 1.800 . 3.450 2.337 2.180 2.402 . 0 0 "[ . 1 . 2]" 1
456 1 23 THR HA 1 25 ILE H 1.800 . 5.250 4.596 3.997 5.161 . 0 0 "[ . 1 . 2]" 1
457 1 23 THR HA 1 62 ASP HB3 1.800 . 5.530 4.505 3.318 5.515 . 0 0 "[ . 1 . 2]" 1
458 1 23 THR HA 1 62 ASP HB2 1.800 . 5.530 3.980 2.721 4.992 . 0 0 "[ . 1 . 2]" 1
459 1 23 THR HB 1 24 GLY H 1.800 . 3.710 2.978 2.516 3.823 0.113 2 0 "[ . 1 . 2]" 1
460 1 23 THR MG 1 24 GLY H 1.800 . 4.310 3.589 2.070 4.075 . 0 0 "[ . 1 . 2]" 1
461 1 23 THR MG 1 63 SER H 1.800 . 5.320 2.824 1.838 4.564 . 0 0 "[ . 1 . 2]" 1
462 1 23 THR H 1 23 THR MG 1.800 . 4.250 2.866 2.070 3.996 . 0 0 "[ . 1 . 2]" 1
463 1 23 THR H 1 24 GLY H 1.800 . 5.290 4.449 4.356 4.479 . 0 0 "[ . 1 . 2]" 1
464 1 23 THR H 1 25 ILE MD 1.800 . 5.240 4.036 3.613 4.384 . 0 0 "[ . 1 . 2]" 1
465 1 23 THR H 1 43 TYR QB 1.800 . 5.240 3.771 3.448 4.303 . 0 0 "[ . 1 . 2]" 1
466 1 23 THR H 1 43 TYR H 1.800 . 4.350 3.068 2.788 3.354 . 0 0 "[ . 1 . 2]" 1
467 1 23 THR H 1 44 ILE HA 1.800 . 4.890 3.465 3.339 3.758 . 0 0 "[ . 1 . 2]" 1
468 1 23 THR H 1 44 ILE HB 1.800 . 6.050 4.910 4.743 5.336 . 0 0 "[ . 1 . 2]" 1
469 1 24 GLY QA 1 43 TYR QD 1.800 . 4.840 3.353 2.850 3.843 . 0 0 "[ . 1 . 2]" 1
470 1 24 GLY H 1 25 ILE HB 1.800 . 6.050 5.166 4.548 5.844 . 0 0 "[ . 1 . 2]" 1
471 1 24 GLY H 1 25 ILE H 1.800 . 4.270 3.263 2.558 3.963 . 0 0 "[ . 1 . 2]" 1
472 1 24 GLY H 1 63 SER H 1.800 . 6.050 4.184 3.443 5.342 . 0 0 "[ . 1 . 2]" 1
473 1 25 ILE HA 1 25 ILE MD 1.800 . 3.750 2.114 2.064 2.320 . 0 0 "[ . 1 . 2]" 1
474 1 25 ILE HA 1 26 HIS H 1.800 . 3.290 2.155 2.099 2.193 . 0 0 "[ . 1 . 2]" 1
475 1 25 ILE HA 1 41 GLN H 1.800 . 5.090 4.366 4.019 4.888 . 0 0 "[ . 1 . 2]" 1
476 1 25 ILE HA 1 42 GLY HA3 1.800 . 4.730 3.325 3.095 3.680 . 0 0 "[ . 1 . 2]" 1
477 1 25 ILE HA 1 42 GLY HA2 1.800 . 4.730 3.866 3.561 4.104 . 0 0 "[ . 1 . 2]" 1
478 1 25 ILE HB 1 26 HIS H 1.800 . 5.050 4.214 4.092 4.473 . 0 0 "[ . 1 . 2]" 1
479 1 25 ILE HB 1 62 ASP H 1.800 . 6.050 4.769 3.670 5.464 . 0 0 "[ . 1 . 2]" 1
480 1 25 ILE MD 1 26 HIS H 1.800 . 4.520 3.770 3.625 4.210 . 0 0 "[ . 1 . 2]" 1
481 1 25 ILE MD 1 40 TYR HB3 1.800 . 5.520 4.041 3.204 4.778 . 0 0 "[ . 1 . 2]" 1
482 1 25 ILE MD 1 40 TYR HB2 1.800 . 5.520 5.196 4.254 5.713 0.193 20 0 "[ . 1 . 2]" 1
483 1 25 ILE MD 1 41 GLN H 1.800 . 5.740 5.113 4.427 5.738 . 0 0 "[ . 1 . 2]" 1
484 1 25 ILE MD 1 42 GLY HA3 1.800 . 4.350 3.094 2.570 3.315 . 0 0 "[ . 1 . 2]" 1
485 1 25 ILE MD 1 42 GLY HA2 1.800 . 4.350 4.211 3.828 4.391 0.041 4 0 "[ . 1 . 2]" 1
486 1 25 ILE MD 1 42 GLY H 1.800 . 6.050 5.139 4.393 5.468 . 0 0 "[ . 1 . 2]" 1
487 1 25 ILE MD 1 43 TYR H 1.800 . 4.580 4.151 3.881 4.330 . 0 0 "[ . 1 . 2]" 1
488 1 25 ILE MD 1 60 LEU HB3 1.800 . 4.870 2.949 2.372 3.854 . 0 0 "[ . 1 . 2]" 1
489 1 25 ILE MD 1 60 LEU HB2 1.800 . 4.870 2.575 2.069 3.804 . 0 0 "[ . 1 . 2]" 1
490 1 25 ILE QG 1 26 HIS H 1.800 . 5.690 4.654 3.972 4.886 . 0 0 "[ . 1 . 2]" 1
491 1 25 ILE QG 1 61 GLN HA 1.800 . 5.150 3.176 2.694 3.884 . 0 0 "[ . 1 . 2]" 1
492 1 25 ILE QG 1 61 GLN H 1.800 . 5.870 4.486 3.941 5.363 . 0 0 "[ . 1 . 2]" 1
493 1 25 ILE QG 1 62 ASP HA 1.800 . 4.760 2.896 2.134 4.100 . 0 0 "[ . 1 . 2]" 1
494 1 25 ILE MD 1 25 ILE MG 1.800 . 3.690 2.086 1.813 3.241 . 0 0 "[ . 1 . 2]" 1
495 1 25 ILE HG13 1 25 ILE MG 1.800 . 4.290 2.298 2.262 2.365 . 0 0 "[ . 1 . 2]" 1
496 1 25 ILE HG12 1 25 ILE MG 1.800 . 4.290 3.073 2.355 3.206 . 0 0 "[ . 1 . 2]" 1
497 1 25 ILE MG 1 26 HIS HA 1.800 . 4.400 3.740 3.496 3.910 . 0 0 "[ . 1 . 2]" 1
498 1 25 ILE MG 1 26 HIS H 1.800 . 3.980 2.800 2.651 3.277 . 0 0 "[ . 1 . 2]" 1
499 1 25 ILE MG 1 27 LYS H 1.800 . 5.640 4.377 3.843 4.699 . 0 0 "[ . 1 . 2]" 1
500 1 25 ILE MG 1 40 TYR HA 1.800 . 4.570 4.132 3.570 4.603 0.033 12 0 "[ . 1 . 2]" 1
501 1 25 ILE MG 1 40 TYR HB3 1.800 . 5.010 2.884 2.272 3.568 . 0 0 "[ . 1 . 2]" 1
502 1 25 ILE MG 1 40 TYR HB2 1.800 . 5.010 4.326 3.780 5.058 0.048 7 0 "[ . 1 . 2]" 1
503 1 25 ILE MG 1 40 TYR QD 1.800 . 3.860 2.456 2.154 2.812 . 0 0 "[ . 1 . 2]" 1
504 1 25 ILE MG 1 40 TYR QE 1.800 . 5.020 3.742 3.482 3.970 . 0 0 "[ . 1 . 2]" 1
505 1 25 ILE MG 1 41 GLN H 1.800 . 4.980 4.077 3.415 4.604 . 0 0 "[ . 1 . 2]" 1
506 1 25 ILE MG 1 61 GLN HA 1.800 . 4.570 4.060 3.315 4.650 0.080 10 0 "[ . 1 . 2]" 1
507 1 25 ILE MG 1 61 GLN H 1.800 . 5.750 5.133 4.432 5.718 . 0 0 "[ . 1 . 2]" 1
508 1 25 ILE MG 1 62 ASP H 1.800 . 5.530 4.564 3.631 5.351 . 0 0 "[ . 1 . 2]" 1
509 1 25 ILE H 1 25 ILE HB 1.800 . 3.660 2.804 2.272 3.667 0.007 7 0 "[ . 1 . 2]" 1
510 1 25 ILE H 1 25 ILE MD 1.800 . 4.840 2.748 1.920 3.262 . 0 0 "[ . 1 . 2]" 1
511 1 25 ILE H 1 25 ILE HG13 1.800 . 4.530 3.898 3.557 4.302 . 0 0 "[ . 1 . 2]" 1
512 1 25 ILE H 1 25 ILE HG12 1.800 . 4.530 2.612 2.006 4.040 . 0 0 "[ . 1 . 2]" 1
513 1 25 ILE H 1 25 ILE MG 1.800 . 4.360 3.834 3.664 4.038 . 0 0 "[ . 1 . 2]" 1
514 1 25 ILE H 1 26 HIS H 1.800 . 5.280 4.339 3.691 4.571 . 0 0 "[ . 1 . 2]" 1
515 1 25 ILE H 1 62 ASP HA 1.800 . 5.310 4.687 3.860 5.343 0.033 15 0 "[ . 1 . 2]" 1
516 1 26 HIS HB3 1 27 LYS H 1.800 . 4.950 3.389 3.031 4.094 . 0 0 "[ . 1 . 2]" 1
517 1 26 HIS HB2 1 27 LYS H 1.800 . 4.950 4.209 4.059 4.343 . 0 0 "[ . 1 . 2]" 1
518 1 26 HIS H 1 41 GLN H 1.800 . 4.220 2.735 2.431 3.101 . 0 0 "[ . 1 . 2]" 1
519 1 26 HIS H 1 42 GLY HA3 1.800 . 6.050 4.209 3.912 4.608 . 0 0 "[ . 1 . 2]" 1
520 1 26 HIS H 1 42 GLY HA2 1.800 . 6.050 4.097 3.735 4.457 . 0 0 "[ . 1 . 2]" 1
521 1 27 LYS HA 1 27 LYS HG3 1.800 . 4.430 2.428 2.336 2.495 . 0 0 "[ . 1 . 2]" 1
522 1 27 LYS HA 1 27 LYS HG2 1.800 . 4.430 3.055 2.971 3.085 . 0 0 "[ . 1 . 2]" 1
523 1 27 LYS HA 1 40 TYR QD 1.800 . 5.710 3.445 2.892 4.062 . 0 0 "[ . 1 . 2]" 1
524 1 27 LYS QB 1 27 LYS QE 1.800 . 5.060 3.310 2.174 3.648 . 0 0 "[ . 1 . 2]" 1
525 1 27 LYS QD 1 38 SER QB 1.800 . 5.240 4.227 3.071 4.979 . 0 0 "[ . 1 . 2]" 1
526 1 27 LYS QD 1 40 TYR QD 1.800 . 5.680 4.696 4.004 5.460 . 0 0 "[ . 1 . 2]" 1
527 1 27 LYS QD 1 40 TYR QE 1.800 . 4.290 3.162 2.299 4.322 0.032 8 0 "[ . 1 . 2]" 1
528 1 27 LYS QE 1 29 GLU QG 1.800 . 5.330 3.864 3.120 5.417 0.087 8 0 "[ . 1 . 2]" 1
529 1 27 LYS QE 1 38 SER QB 1.800 . 4.640 3.047 2.166 4.672 0.032 10 0 "[ . 1 . 2]" 1
530 1 27 LYS QE 1 40 TYR QE 1.800 . 5.020 4.098 2.391 5.046 0.026 12 0 "[ . 1 . 2]" 1
531 1 27 LYS HG3 1 28 LYS H 1.800 . 4.750 2.946 2.816 3.086 . 0 0 "[ . 1 . 2]" 1
532 1 27 LYS HG2 1 28 LYS H 1.800 . 4.750 2.885 2.722 3.045 . 0 0 "[ . 1 . 2]" 1
533 1 27 LYS QE 1 27 LYS QG 1.800 . 3.520 2.200 2.122 2.314 . 0 0 "[ . 1 . 2]" 1
534 1 27 LYS QG 1 29 GLU QG 1.800 . 5.710 3.734 3.087 5.253 . 0 0 "[ . 1 . 2]" 1
535 1 27 LYS QG 1 38 SER QB 1.800 . 4.080 3.346 2.785 4.097 0.017 4 0 "[ . 1 . 2]" 1
536 1 27 LYS H 1 27 LYS HB3 1.800 . 4.060 2.547 2.488 2.648 . 0 0 "[ . 1 . 2]" 1
537 1 27 LYS H 1 27 LYS HB2 1.800 . 4.060 2.794 2.615 2.912 . 0 0 "[ . 1 . 2]" 1
538 1 27 LYS H 1 27 LYS QG 1.800 . 5.080 4.015 3.983 4.046 . 0 0 "[ . 1 . 2]" 1
539 1 28 LYS HA 1 28 LYS QD 1.800 . 4.490 3.775 2.129 4.173 . 0 0 "[ . 1 . 2]" 1
540 1 28 LYS HA 1 28 LYS QE 1.800 . 4.850 4.490 3.919 4.914 0.064 13 0 "[ . 1 . 2]" 1
541 1 28 LYS HA 1 28 LYS QG 1.800 . 3.760 2.368 2.241 3.006 . 0 0 "[ . 1 . 2]" 1
542 1 28 LYS HA 1 29 GLU QG 1.800 . 4.960 3.742 3.527 4.428 . 0 0 "[ . 1 . 2]" 1
543 1 28 LYS HA 1 29 GLU H 1.800 . 3.050 2.339 2.229 2.427 . 0 0 "[ . 1 . 2]" 1
544 1 28 LYS HB3 1 29 GLU H 1.800 . 5.180 3.235 2.443 4.100 . 0 0 "[ . 1 . 2]" 1
545 1 28 LYS HB3 1 39 VAL MG1 1.800 . 3.970 2.700 2.166 3.325 . 0 0 "[ . 1 . 2]" 1
546 1 28 LYS HB2 1 29 GLU H 1.800 . 5.180 3.925 3.694 4.145 . 0 0 "[ . 1 . 2]" 1
547 1 28 LYS HB2 1 39 VAL MG1 1.800 . 3.970 3.067 2.080 3.996 0.026 19 0 "[ . 1 . 2]" 1
548 1 28 LYS QB 1 29 GLU H 1.800 . 4.410 3.045 2.411 3.654 . 0 0 "[ . 1 . 2]" 1
549 1 28 LYS QB 1 39 VAL H 1.800 . 5.840 3.954 3.658 4.190 . 0 0 "[ . 1 . 2]" 1
550 1 28 LYS QD 1 29 GLU H 1.800 . 5.290 4.195 1.806 5.100 . 0 0 "[ . 1 . 2]" 1
551 1 28 LYS QD 1 39 VAL MG1 1.800 . 4.880 3.664 3.209 4.515 . 0 0 "[ . 1 . 2]" 1
552 1 28 LYS QE 1 28 LYS QG 1.800 . 3.620 2.229 2.118 2.405 . 0 0 "[ . 1 . 2]" 1
553 1 28 LYS QG 1 29 GLU H 1.800 . 4.260 2.905 1.999 4.374 0.114 16 0 "[ . 1 . 2]" 1
554 1 28 LYS QG 1 39 VAL MG1 1.800 . 4.720 3.563 2.932 4.035 . 0 0 "[ . 1 . 2]" 1
555 1 28 LYS H 1 28 LYS HB3 1.800 . 4.170 3.332 2.828 3.879 . 0 0 "[ . 1 . 2]" 1
556 1 28 LYS H 1 28 LYS HB2 1.800 . 4.170 3.041 2.670 3.397 . 0 0 "[ . 1 . 2]" 1
557 1 28 LYS H 1 28 LYS QG 1.800 . 4.730 3.704 3.002 4.178 . 0 0 "[ . 1 . 2]" 1
558 1 28 LYS H 1 29 GLU H 1.800 . 5.020 4.402 4.302 4.444 . 0 0 "[ . 1 . 2]" 1
559 1 28 LYS H 1 39 VAL MG1 1.800 . 5.010 3.040 2.847 3.292 . 0 0 "[ . 1 . 2]" 1
560 1 29 GLU HA 1 29 GLU QG 1.800 . 3.880 2.425 2.281 3.321 . 0 0 "[ . 1 . 2]" 1
561 1 29 GLU HA 1 30 TYR H 1.800 . 3.170 2.236 2.168 2.273 . 0 0 "[ . 1 . 2]" 1
562 1 29 GLU HA 1 36 THR MG 1.800 . 4.660 3.843 3.567 4.035 . 0 0 "[ . 1 . 2]" 1
563 1 29 GLU HA 1 37 LYS H 1.800 . 5.700 4.509 4.239 4.789 . 0 0 "[ . 1 . 2]" 1
564 1 29 GLU HA 1 39 VAL MG1 1.800 . 5.670 3.372 2.478 3.837 . 0 0 "[ . 1 . 2]" 1
565 1 29 GLU QB 1 30 TYR H 1.800 . 3.970 2.920 2.826 3.061 . 0 0 "[ . 1 . 2]" 1
566 1 29 GLU QB 1 36 THR HB 1.800 . 5.390 4.947 4.666 5.359 . 0 0 "[ . 1 . 2]" 1
567 1 29 GLU QB 1 36 THR MG 1.800 . 3.640 2.359 2.173 2.729 . 0 0 "[ . 1 . 2]" 1
568 1 29 GLU QB 1 38 SER HA 1.800 . 4.960 3.893 2.744 4.216 . 0 0 "[ . 1 . 2]" 1
569 1 29 GLU QG 1 30 TYR H 1.800 . 4.660 3.907 3.762 4.445 . 0 0 "[ . 1 . 2]" 1
570 1 29 GLU QG 1 36 THR HB 1.800 . 5.710 5.711 5.398 5.823 0.113 16 0 "[ . 1 . 2]" 1
571 1 29 GLU QG 1 36 THR MG 1.800 . 3.990 3.272 2.945 3.515 . 0 0 "[ . 1 . 2]" 1
572 1 29 GLU QG 1 37 LYS H 1.800 . 6.050 5.110 4.638 5.848 . 0 0 "[ . 1 . 2]" 1
573 1 29 GLU QG 1 38 SER HA 1.800 . 4.910 2.847 2.308 4.786 . 0 0 "[ . 1 . 2]" 1
574 1 29 GLU H 1 29 GLU QB 1.800 . 3.370 2.537 2.429 3.071 . 0 0 "[ . 1 . 2]" 1
575 1 29 GLU H 1 29 GLU QG 1.800 . 3.860 2.934 2.101 3.591 . 0 0 "[ . 1 . 2]" 1
576 1 29 GLU H 1 30 TYR H 1.800 . 5.190 4.491 4.441 4.539 . 0 0 "[ . 1 . 2]" 1
577 1 30 TYR HA 1 30 TYR QD 1.800 . 4.840 3.693 3.683 3.716 . 0 0 "[ . 1 . 2]" 1
578 1 30 TYR HA 1 36 THR MG 1.800 . 5.160 4.185 3.822 4.654 . 0 0 "[ . 1 . 2]" 1
579 1 30 TYR QB 1 31 GLU H 1.800 . 3.400 2.572 2.491 2.735 . 0 0 "[ . 1 . 2]" 1
580 1 30 TYR QD 1 31 GLU H 1.800 . 4.380 3.522 3.275 3.748 . 0 0 "[ . 1 . 2]" 1
581 1 30 TYR QD 1 32 SER QB 1.800 . 5.080 3.591 2.560 4.698 . 0 0 "[ . 1 . 2]" 1
582 1 30 TYR QD 1 39 VAL HB 1.800 . 3.960 3.067 2.404 3.995 0.035 4 0 "[ . 1 . 2]" 1
583 1 30 TYR QD 1 39 VAL MG1 1.800 . 4.440 2.640 2.213 2.995 . 0 0 "[ . 1 . 2]" 1
584 1 30 TYR QD 1 39 VAL MG2 1.800 . 5.160 4.294 3.942 4.705 . 0 0 "[ . 1 . 2]" 1
585 1 30 TYR QD 1 39 VAL H 1.800 . 5.490 3.853 3.465 4.466 . 0 0 "[ . 1 . 2]" 1
586 1 30 TYR QE 1 32 SER QB 1.800 . 4.040 2.496 2.199 3.588 . 0 0 "[ . 1 . 2]" 1
587 1 30 TYR QE 1 32 SER H 1.800 . 5.840 4.712 4.025 5.455 . 0 0 "[ . 1 . 2]" 1
588 1 30 TYR QE 1 37 LYS QB 1.800 . 4.380 2.671 2.494 3.245 . 0 0 "[ . 1 . 2]" 1
589 1 30 TYR QE 1 37 LYS QG 1.800 . 5.080 4.379 3.985 5.061 . 0 0 "[ . 1 . 2]" 1
590 1 30 TYR QE 1 38 SER HA 1.800 . 5.650 4.079 3.737 5.110 . 0 0 "[ . 1 . 2]" 1
591 1 30 TYR QE 1 38 SER H 1.800 . 6.050 4.333 3.997 5.528 . 0 0 "[ . 1 . 2]" 1
592 1 30 TYR QE 1 39 VAL HB 1.800 . 3.670 2.345 2.310 2.486 . 0 0 "[ . 1 . 2]" 1
593 1 30 TYR QE 1 39 VAL MG1 1.800 . 4.400 3.422 2.366 3.811 . 0 0 "[ . 1 . 2]" 1
594 1 30 TYR QE 1 39 VAL MG2 1.800 . 4.400 3.742 3.564 3.976 . 0 0 "[ . 1 . 2]" 1
595 1 30 TYR QE 1 39 VAL H 1.800 . 5.650 4.091 3.789 4.733 . 0 0 "[ . 1 . 2]" 1
596 1 30 TYR QE 1 56 PHE QD 1.800 . 4.880 2.456 2.334 2.741 . 0 0 "[ . 1 . 2]" 1
597 1 30 TYR H 1 30 TYR QD 1.800 . 3.890 2.104 1.882 2.410 . 0 0 "[ . 1 . 2]" 1
598 1 30 TYR H 1 30 TYR QE 1.800 . 5.390 3.877 3.724 4.053 . 0 0 "[ . 1 . 2]" 1
599 1 30 TYR H 1 31 GLU H 1.800 . 4.940 4.437 4.411 4.463 . 0 0 "[ . 1 . 2]" 1
600 1 30 TYR H 1 36 THR HA 1.800 . 5.130 4.268 4.093 4.525 . 0 0 "[ . 1 . 2]" 1
601 1 30 TYR H 1 36 THR MG 1.800 . 4.440 3.181 2.707 3.600 . 0 0 "[ . 1 . 2]" 1
602 1 30 TYR H 1 37 LYS QB 1.800 . 5.350 4.153 3.693 4.513 . 0 0 "[ . 1 . 2]" 1
603 1 31 GLU HA 1 32 SER H 1.800 . 3.040 2.204 2.129 2.277 . 0 0 "[ . 1 . 2]" 1
604 1 31 GLU HA 1 36 THR MG 1.800 . 4.810 3.655 3.184 4.299 . 0 0 "[ . 1 . 2]" 1
605 1 31 GLU QB 1 32 SER H 1.800 . 4.590 3.576 2.977 4.005 . 0 0 "[ . 1 . 2]" 1
606 1 31 GLU QB 1 36 THR HA 1.800 . 5.870 4.393 3.886 4.722 . 0 0 "[ . 1 . 2]" 1
607 1 31 GLU HG3 1 32 SER H 1.800 . 6.040 4.097 2.252 5.031 . 0 0 "[ . 1 . 2]" 1
608 1 31 GLU HG2 1 32 SER H 1.800 . 6.040 4.308 2.816 5.440 . 0 0 "[ . 1 . 2]" 1
609 1 31 GLU QG 1 34 GLY H 1.800 . 6.050 4.327 2.277 6.187 0.137 10 0 "[ . 1 . 2]" 1
610 1 31 GLU QG 1 35 THR H 1.800 . 5.200 4.501 3.171 5.326 0.126 19 0 "[ . 1 . 2]" 1
611 1 31 GLU H 1 31 GLU QB 1.800 . 3.270 2.349 2.287 2.586 . 0 0 "[ . 1 . 2]" 1
612 1 31 GLU H 1 31 GLU QG 1.800 . 4.580 3.241 1.947 4.099 . 0 0 "[ . 1 . 2]" 1
613 1 32 SER HA 1 34 GLY H 1.800 . 4.880 4.092 3.449 4.769 . 0 0 "[ . 1 . 2]" 1
614 1 32 SER HB3 1 33 ASP H 1.800 . 5.410 3.626 1.812 4.523 . 0 0 "[ . 1 . 2]" 1
615 1 32 SER HB2 1 33 ASP H 1.800 . 5.410 3.842 2.176 4.548 . 0 0 "[ . 1 . 2]" 1
616 1 32 SER QB 1 35 THR MG 1.800 . 5.870 4.220 2.113 5.625 . 0 0 "[ . 1 . 2]" 1
617 1 32 SER QB 1 35 THR H 1.800 . 5.290 3.748 3.190 4.485 . 0 0 "[ . 1 . 2]" 1
618 1 32 SER QB 1 37 LYS QE 1.800 . 4.580 3.235 2.296 4.325 . 0 0 "[ . 1 . 2]" 1
619 1 32 SER QB 1 37 LYS QG 1.800 . 4.620 2.755 2.168 3.808 . 0 0 "[ . 1 . 2]" 1
620 1 32 SER H 1 32 SER QB 1.800 . 3.850 2.538 2.250 2.803 . 0 0 "[ . 1 . 2]" 1
621 1 32 SER H 1 33 ASP H 1.800 . 5.240 4.203 3.918 4.355 . 0 0 "[ . 1 . 2]" 1
622 1 32 SER H 1 34 GLY H 1.800 . 5.160 4.114 3.296 5.195 0.035 20 0 "[ . 1 . 2]" 1
623 1 32 SER H 1 35 THR HA 1.800 . 6.050 4.614 4.372 4.953 . 0 0 "[ . 1 . 2]" 1
624 1 32 SER H 1 35 THR MG 1.800 . 5.850 4.574 3.502 5.620 . 0 0 "[ . 1 . 2]" 1
625 1 32 SER H 1 35 THR H 1.800 . 3.650 3.015 2.365 3.666 0.016 16 0 "[ . 1 . 2]" 1
626 1 32 SER H 1 36 THR HA 1.800 . 6.050 3.059 2.507 3.651 . 0 0 "[ . 1 . 2]" 1
627 1 32 SER H 1 37 LYS QG 1.800 . 5.360 3.896 3.277 4.677 . 0 0 "[ . 1 . 2]" 1
628 1 32 SER H 1 37 LYS H 1.800 . 4.860 3.757 3.029 4.525 . 0 0 "[ . 1 . 2]" 1
629 1 33 ASP HA 1 34 GLY H 1.800 . 3.660 2.745 2.314 3.059 . 0 0 "[ . 1 . 2]" 1
630 1 33 ASP HA 1 35 THR H 1.800 . 5.400 4.223 3.831 4.462 . 0 0 "[ . 1 . 2]" 1
631 1 33 ASP HB3 1 34 GLY H 1.800 . 5.100 4.278 3.971 4.456 . 0 0 "[ . 1 . 2]" 1
632 1 33 ASP HB2 1 34 GLY H 1.800 . 5.100 4.425 4.067 4.679 . 0 0 "[ . 1 . 2]" 1
633 1 33 ASP QB 1 35 THR MG 1.800 . 5.020 4.175 2.679 5.084 0.064 19 0 "[ . 1 . 2]" 1
634 1 33 ASP QB 1 35 THR H 1.800 . 4.960 3.657 3.354 4.200 . 0 0 "[ . 1 . 2]" 1
635 1 33 ASP H 1 34 GLY H 1.800 . 3.970 3.189 2.651 4.092 0.122 20 0 "[ . 1 . 2]" 1
636 1 33 ASP H 1 35 THR H 1.800 . 5.400 3.937 3.637 4.104 . 0 0 "[ . 1 . 2]" 1
637 1 34 GLY H 1 35 THR H 1.800 . 3.550 2.558 2.339 2.840 . 0 0 "[ . 1 . 2]" 1
638 1 35 THR HA 1 35 THR MG 1.800 . 3.600 2.419 2.274 3.203 . 0 0 "[ . 1 . 2]" 1
639 1 35 THR HA 1 36 THR H 1.800 . 2.930 2.197 2.120 2.338 . 0 0 "[ . 1 . 2]" 1
640 1 35 THR HB 1 36 THR H 1.800 . 4.160 3.765 2.678 4.215 0.055 14 0 "[ . 1 . 2]" 1
641 1 35 THR HB 1 37 LYS QE 1.800 . 5.060 3.307 2.392 5.118 0.058 19 0 "[ . 1 . 2]" 1
642 1 35 THR HB 1 37 LYS QG 1.800 . 5.470 3.679 3.309 5.032 . 0 0 "[ . 1 . 2]" 1
643 1 35 THR MG 1 36 THR H 1.800 . 4.350 3.196 2.511 4.099 . 0 0 "[ . 1 . 2]" 1
644 1 35 THR MG 1 37 LYS QE 1.800 . 4.180 2.971 2.090 4.131 . 0 0 "[ . 1 . 2]" 1
645 1 35 THR H 1 35 THR MG 1.800 . 4.000 3.320 2.139 3.926 . 0 0 "[ . 1 . 2]" 1
646 1 35 THR H 1 36 THR H 1.800 . 5.130 4.369 4.277 4.493 . 0 0 "[ . 1 . 2]" 1
647 1 36 THR HA 1 36 THR MG 1.800 . 3.700 2.299 2.248 2.383 . 0 0 "[ . 1 . 2]" 1
648 1 36 THR HA 1 37 LYS H 1.800 . 3.160 2.185 2.111 2.215 . 0 0 "[ . 1 . 2]" 1
649 1 36 THR HB 1 37 LYS H 1.800 . 4.930 4.142 4.040 4.294 . 0 0 "[ . 1 . 2]" 1
650 1 36 THR MG 1 37 LYS H 1.800 . 3.980 2.653 2.524 2.775 . 0 0 "[ . 1 . 2]" 1
651 1 36 THR H 1 36 THR HB 1.800 . 3.320 2.552 2.406 2.641 . 0 0 "[ . 1 . 2]" 1
652 1 36 THR H 1 36 THR MG 1.800 . 4.430 3.774 3.751 3.808 . 0 0 "[ . 1 . 2]" 1
653 1 37 LYS HA 1 37 LYS QD 1.800 . 4.440 3.420 2.118 4.155 . 0 0 "[ . 1 . 2]" 1
654 1 37 LYS HA 1 38 SER H 1.800 . 3.170 2.231 2.174 2.267 . 0 0 "[ . 1 . 2]" 1
655 1 37 LYS QB 1 38 SER H 1.800 . 3.610 2.877 2.788 2.984 . 0 0 "[ . 1 . 2]" 1
656 1 37 LYS QE 1 37 LYS QG 1.800 . 3.630 2.175 2.117 2.346 . 0 0 "[ . 1 . 2]" 1
657 1 37 LYS QG 1 38 SER H 1.800 . 4.960 4.063 3.789 4.553 . 0 0 "[ . 1 . 2]" 1
658 1 37 LYS H 1 37 LYS QB 1.800 . 3.840 2.610 2.486 2.656 . 0 0 "[ . 1 . 2]" 1
659 1 37 LYS H 1 37 LYS QE 1.800 . 5.780 5.188 4.996 5.510 . 0 0 "[ . 1 . 2]" 1
660 1 37 LYS H 1 37 LYS QG 1.800 . 4.530 3.018 2.881 3.174 . 0 0 "[ . 1 . 2]" 1
661 1 37 LYS H 1 38 SER H 1.800 . 4.990 4.425 4.383 4.502 . 0 0 "[ . 1 . 2]" 1
662 1 38 SER HA 1 39 VAL MG1 1.800 . 6.000 3.688 3.368 3.910 . 0 0 "[ . 1 . 2]" 1
663 1 38 SER HA 1 39 VAL H 1.800 . 3.300 2.250 2.174 2.319 . 0 0 "[ . 1 . 2]" 1
664 1 38 SER HB3 1 39 VAL H 1.800 . 4.990 3.817 2.944 4.253 . 0 0 "[ . 1 . 2]" 1
665 1 38 SER HB3 1 40 TYR QE 1.800 . 5.120 4.423 3.660 5.150 0.030 20 0 "[ . 1 . 2]" 1
666 1 38 SER HB2 1 39 VAL H 1.800 . 4.990 3.532 2.799 4.142 . 0 0 "[ . 1 . 2]" 1
667 1 38 SER HB2 1 40 TYR QE 1.800 . 5.120 4.333 3.620 5.173 0.053 10 0 "[ . 1 . 2]" 1
668 1 38 SER H 1 38 SER QB 1.800 . 3.670 2.421 2.247 2.749 . 0 0 "[ . 1 . 2]" 1
669 1 38 SER H 1 40 TYR QE 1.800 . 6.050 5.931 5.605 6.071 0.021 6 0 "[ . 1 . 2]" 1
670 1 39 VAL HA 1 39 VAL MG1 1.800 . 4.110 3.204 3.193 3.215 . 0 0 "[ . 1 . 2]" 1
671 1 39 VAL HA 1 39 VAL MG2 1.800 . 3.930 2.327 2.226 2.432 . 0 0 "[ . 1 . 2]" 1
672 1 39 VAL HA 1 40 TYR QD 1.800 . 4.980 3.324 3.192 3.566 . 0 0 "[ . 1 . 2]" 1
673 1 39 VAL HA 1 40 TYR H 1.800 . 3.580 2.199 2.135 2.246 . 0 0 "[ . 1 . 2]" 1
674 1 39 VAL HA 1 57 GLY H 1.800 . 4.530 2.784 2.621 3.065 . 0 0 "[ . 1 . 2]" 1
675 1 39 VAL HB 1 40 TYR H 1.800 . 5.010 4.188 4.064 4.261 . 0 0 "[ . 1 . 2]" 1
676 1 39 VAL HB 1 56 PHE HA 1.800 . 5.200 3.380 2.854 3.709 . 0 0 "[ . 1 . 2]" 1
677 1 39 VAL HB 1 56 PHE QD 1.800 . 5.220 2.584 2.327 2.912 . 0 0 "[ . 1 . 2]" 1
678 1 39 VAL HB 1 56 PHE QE 1.800 . 6.050 3.048 2.621 3.514 . 0 0 "[ . 1 . 2]" 1
679 1 39 VAL MG1 1 40 TYR H 1.800 . 4.260 3.791 3.670 4.026 . 0 0 "[ . 1 . 2]" 1
680 1 39 VAL MG1 1 41 GLN QE 1.800 . 5.020 3.029 1.847 4.127 . 0 0 "[ . 1 . 2]" 1
681 1 39 VAL MG1 1 41 GLN HG3 1.800 . 4.770 2.969 2.506 4.453 . 0 0 "[ . 1 . 2]" 1
682 1 39 VAL MG1 1 41 GLN HG2 1.800 . 4.770 4.106 3.782 4.662 . 0 0 "[ . 1 . 2]" 1
683 1 39 VAL MG1 1 41 GLN H 1.800 . 5.330 4.551 4.276 4.990 . 0 0 "[ . 1 . 2]" 1
684 1 39 VAL MG1 1 54 SER QB 1.800 . 5.010 4.390 3.806 4.960 . 0 0 "[ . 1 . 2]" 1
685 1 39 VAL MG1 1 56 PHE HA 1.800 . 6.050 4.638 4.397 4.800 . 0 0 "[ . 1 . 2]" 1
686 1 39 VAL MG1 1 56 PHE QD 1.800 . 5.240 4.056 3.720 4.347 . 0 0 "[ . 1 . 2]" 1
687 1 39 VAL MG1 1 56 PHE QE 1.800 . 5.350 3.448 2.921 3.913 . 0 0 "[ . 1 . 2]" 1
688 1 39 VAL MG1 1 56 PHE HZ 1.800 . 6.020 4.861 3.930 5.516 . 0 0 "[ . 1 . 2]" 1
689 1 39 VAL MG2 1 40 TYR H 1.800 . 4.320 2.422 2.323 2.543 . 0 0 "[ . 1 . 2]" 1
690 1 39 VAL MG2 1 41 GLN QG 1.800 . 5.000 2.753 2.243 3.778 . 0 0 "[ . 1 . 2]" 1
691 1 39 VAL MG2 1 41 GLN H 1.800 . 4.960 4.504 4.217 4.721 . 0 0 "[ . 1 . 2]" 1
692 1 39 VAL MG2 1 54 SER HA 1.800 . 5.220 3.563 3.381 3.929 . 0 0 "[ . 1 . 2]" 1
693 1 39 VAL MG2 1 54 SER HB3 1.800 . 4.920 3.527 2.356 4.114 . 0 0 "[ . 1 . 2]" 1
694 1 39 VAL MG2 1 54 SER HB2 1.800 . 4.920 3.419 2.377 4.101 . 0 0 "[ . 1 . 2]" 1
695 1 39 VAL MG2 1 55 SER HA 1.800 . 5.500 4.039 3.845 4.217 . 0 0 "[ . 1 . 2]" 1
696 1 39 VAL MG2 1 55 SER H 1.800 . 4.770 2.826 2.544 3.072 . 0 0 "[ . 1 . 2]" 1
697 1 39 VAL MG2 1 56 PHE HA 1.800 . 4.360 2.484 2.286 3.031 . 0 0 "[ . 1 . 2]" 1
698 1 39 VAL MG2 1 56 PHE QD 1.800 . 4.620 2.763 2.405 3.262 . 0 0 "[ . 1 . 2]" 1
699 1 39 VAL MG2 1 56 PHE QE 1.800 . 4.570 2.675 2.406 2.991 . 0 0 "[ . 1 . 2]" 1
700 1 39 VAL MG2 1 56 PHE HZ 1.800 . 5.440 3.460 2.945 3.867 . 0 0 "[ . 1 . 2]" 1
701 1 39 VAL H 1 39 VAL HB 1.800 . 4.140 3.214 3.069 3.416 . 0 0 "[ . 1 . 2]" 1
702 1 39 VAL H 1 39 VAL MG1 1.800 . 3.890 2.207 2.045 2.282 . 0 0 "[ . 1 . 2]" 1
703 1 39 VAL H 1 39 VAL MG2 1.800 . 4.930 3.928 3.826 3.974 . 0 0 "[ . 1 . 2]" 1
704 1 40 TYR HA 1 40 TYR QD 1.800 . 4.530 2.911 2.757 2.998 . 0 0 "[ . 1 . 2]" 1
705 1 40 TYR HA 1 41 GLN H 1.800 . 3.310 2.187 2.129 2.237 . 0 0 "[ . 1 . 2]" 1
706 1 40 TYR HB3 1 60 LEU MD1 1.800 . 5.760 3.435 2.541 4.358 . 0 0 "[ . 1 . 2]" 1
707 1 40 TYR HB2 1 55 SER H 1.800 . 5.590 3.401 3.242 3.518 . 0 0 "[ . 1 . 2]" 1
708 1 40 TYR HB2 1 60 LEU MD1 1.800 . 5.760 3.301 2.520 3.888 . 0 0 "[ . 1 . 2]" 1
709 1 40 TYR QB 1 55 SER QB 1.800 . 6.050 2.800 2.303 3.743 . 0 0 "[ . 1 . 2]" 1
710 1 40 TYR QB 1 60 LEU MD2 1.800 . 6.050 4.504 3.848 5.284 . 0 0 "[ . 1 . 2]" 1
711 1 40 TYR QD 1 41 GLN H 1.800 . 5.370 4.116 3.970 4.256 . 0 0 "[ . 1 . 2]" 1
712 1 40 TYR QD 1 57 GLY H 1.800 . 5.580 3.756 3.263 4.357 . 0 0 "[ . 1 . 2]" 1
713 1 40 TYR QD 1 59 GLN HA 1.800 . 4.660 3.115 2.673 3.781 . 0 0 "[ . 1 . 2]" 1
714 1 40 TYR QD 1 59 GLN QG 1.800 . 5.160 4.100 2.938 5.181 0.021 15 0 "[ . 1 . 2]" 1
715 1 40 TYR QD 1 60 LEU HG 1.800 . 5.060 4.522 3.942 4.952 . 0 0 "[ . 1 . 2]" 1
716 1 40 TYR QE 1 57 GLY H 1.800 . 5.540 4.171 3.629 4.766 . 0 0 "[ . 1 . 2]" 1
717 1 40 TYR QE 1 59 GLN HA 1.800 . 4.960 3.398 2.983 3.739 . 0 0 "[ . 1 . 2]" 1
718 1 40 TYR QE 1 59 GLN QB 1.800 . 4.750 3.466 2.775 4.326 . 0 0 "[ . 1 . 2]" 1
719 1 40 TYR QE 1 59 GLN QG 1.800 . 4.630 3.631 2.671 4.606 . 0 0 "[ . 1 . 2]" 1
720 1 40 TYR QE 1 59 GLN H 1.800 . 5.690 4.649 4.141 5.160 . 0 0 "[ . 1 . 2]" 1
721 1 40 TYR H 1 40 TYR QD 1.800 . 3.920 2.412 2.312 2.545 . 0 0 "[ . 1 . 2]" 1
722 1 40 TYR H 1 55 SER QB 1.800 . 5.360 3.648 2.961 4.460 . 0 0 "[ . 1 . 2]" 1
723 1 40 TYR H 1 55 SER H 1.800 . 4.480 3.029 2.840 3.271 . 0 0 "[ . 1 . 2]" 1
724 1 40 TYR H 1 56 PHE HA 1.800 . 5.220 3.664 3.401 3.965 . 0 0 "[ . 1 . 2]" 1
725 1 41 GLN HA 1 41 GLN HG3 1.800 . 4.510 2.896 2.335 2.972 . 0 0 "[ . 1 . 2]" 1
726 1 41 GLN HA 1 41 GLN HG2 1.800 . 4.510 2.494 2.412 3.592 . 0 0 "[ . 1 . 2]" 1
727 1 41 GLN HA 1 42 GLY H 1.800 . 3.380 2.299 2.190 2.353 . 0 0 "[ . 1 . 2]" 1
728 1 41 GLN HA 1 53 ILE MD 1.800 . 5.160 4.486 3.310 5.009 . 0 0 "[ . 1 . 2]" 1
729 1 41 GLN HA 1 54 SER HA 1.800 . 4.100 2.313 2.266 2.432 . 0 0 "[ . 1 . 2]" 1
730 1 41 GLN HA 1 54 SER QB 1.800 . 5.870 3.756 3.096 4.234 . 0 0 "[ . 1 . 2]" 1
731 1 41 GLN HB3 1 42 GLY H 1.800 . 4.890 2.757 2.639 2.930 . 0 0 "[ . 1 . 2]" 1
732 1 41 GLN HB3 1 54 SER HA 1.800 . 5.580 4.221 3.976 4.597 . 0 0 "[ . 1 . 2]" 1
733 1 41 GLN HB2 1 42 GLY H 1.800 . 4.890 3.922 3.833 4.089 . 0 0 "[ . 1 . 2]" 1
734 1 41 GLN HB2 1 54 SER HA 1.800 . 5.580 4.907 4.678 5.128 . 0 0 "[ . 1 . 2]" 1
735 1 41 GLN QE 1 54 SER QB 1.800 . 4.920 3.374 2.336 4.592 . 0 0 "[ . 1 . 2]" 1
736 1 41 GLN QG 1 42 GLY H 1.800 . 5.070 3.813 3.553 3.902 . 0 0 "[ . 1 . 2]" 1
737 1 41 GLN QG 1 54 SER HA 1.800 . 4.800 2.610 2.257 3.073 . 0 0 "[ . 1 . 2]" 1
738 1 41 GLN H 1 41 GLN QG 1.800 . 4.880 3.013 2.852 3.870 . 0 0 "[ . 1 . 2]" 1
739 1 42 GLY H 1 43 TYR H 1.800 . 5.500 4.325 4.211 4.367 . 0 0 "[ . 1 . 2]" 1
740 1 42 GLY H 1 53 ILE MD 1.800 . 3.970 3.511 1.783 4.030 0.060 20 0 "[ . 1 . 2]" 1
741 1 42 GLY H 1 53 ILE H 1.800 . 4.430 2.894 2.695 3.155 . 0 0 "[ . 1 . 2]" 1
742 1 42 GLY H 1 54 SER HA 1.800 . 4.960 3.894 3.631 4.038 . 0 0 "[ . 1 . 2]" 1
743 1 43 TYR HA 1 43 TYR QD 1.800 . 4.690 2.944 2.813 3.030 . 0 0 "[ . 1 . 2]" 1
744 1 43 TYR HA 1 44 ILE H 1.800 . 3.490 2.222 2.164 2.261 . 0 0 "[ . 1 . 2]" 1
745 1 43 TYR HA 1 50 ARG QG 1.800 . 6.050 5.807 4.033 6.049 . 0 0 "[ . 1 . 2]" 1
746 1 43 TYR HA 1 52 ARG HA 1.800 . 4.040 2.606 2.339 2.900 . 0 0 "[ . 1 . 2]" 1
747 1 43 TYR HA 1 52 ARG QB 1.800 . 6.050 4.613 4.279 4.892 . 0 0 "[ . 1 . 2]" 1
748 1 43 TYR HA 1 53 ILE MD 1.800 . 4.190 3.664 2.291 4.267 0.077 14 0 "[ . 1 . 2]" 1
749 1 43 TYR HA 1 53 ILE H 1.800 . 4.610 3.343 3.022 3.541 . 0 0 "[ . 1 . 2]" 1
750 1 43 TYR HB3 1 44 ILE H 1.800 . 4.310 3.019 2.900 3.127 . 0 0 "[ . 1 . 2]" 1
751 1 43 TYR HB2 1 44 ILE H 1.800 . 5.070 4.074 3.985 4.179 . 0 0 "[ . 1 . 2]" 1
752 1 43 TYR QB 1 50 ARG QG 1.800 . 5.150 4.307 2.571 4.688 . 0 0 "[ . 1 . 2]" 1
753 1 43 TYR QD 1 44 ILE H 1.800 . 5.070 3.952 3.743 4.120 . 0 0 "[ . 1 . 2]" 1
754 1 43 TYR QD 1 50 ARG QB 1.800 . 4.840 3.975 3.613 4.704 . 0 0 "[ . 1 . 2]" 1
755 1 43 TYR QD 1 50 ARG QG 1.800 . 4.350 3.885 2.778 4.137 . 0 0 "[ . 1 . 2]" 1
756 1 43 TYR QD 1 51 ILE H 1.800 . 5.490 4.371 4.130 4.610 . 0 0 "[ . 1 . 2]" 1
757 1 43 TYR QD 1 52 ARG HA 1.800 . 5.050 3.282 2.868 3.653 . 0 0 "[ . 1 . 2]" 1
758 1 43 TYR QD 1 52 ARG H 1.800 . 5.670 4.237 3.668 4.686 . 0 0 "[ . 1 . 2]" 1
759 1 43 TYR QE 1 50 ARG QG 1.800 . 5.270 5.215 4.695 5.331 0.061 16 0 "[ . 1 . 2]" 1
760 1 43 TYR QE 1 52 ARG QB 1.800 . 5.000 3.582 2.410 4.629 . 0 0 "[ . 1 . 2]" 1
761 1 43 TYR QE 1 52 ARG QD 1.800 . 4.420 3.497 2.260 4.484 0.064 16 0 "[ . 1 . 2]" 1
762 1 43 TYR H 1 43 TYR QD 1.800 . 4.710 2.721 2.509 2.980 . 0 0 "[ . 1 . 2]" 1
763 1 43 TYR H 1 44 ILE H 1.800 . 4.510 4.442 4.358 4.483 . 0 0 "[ . 1 . 2]" 1
764 1 43 TYR H 1 53 ILE MD 1.800 . 5.760 3.765 2.828 4.514 . 0 0 "[ . 1 . 2]" 1
765 1 44 ILE HA 1 44 ILE MD 1.800 . 4.630 3.673 3.659 3.691 . 0 0 "[ . 1 . 2]" 1
766 1 44 ILE HA 1 44 ILE QG 1.800 . 3.980 2.273 2.246 2.295 . 0 0 "[ . 1 . 2]" 1
767 1 44 ILE HA 1 45 GLU H 1.800 . 3.580 2.220 2.167 2.275 . 0 0 "[ . 1 . 2]" 1
768 1 44 ILE HB 1 45 GLU H 1.800 . 4.720 4.209 4.111 4.315 . 0 0 "[ . 1 . 2]" 1
769 1 44 ILE MD 1 45 GLU H 1.800 . 5.020 4.193 4.027 4.358 . 0 0 "[ . 1 . 2]" 1
770 1 44 ILE HG13 1 45 GLU H 1.800 . 4.210 2.737 2.514 2.972 . 0 0 "[ . 1 . 2]" 1
771 1 44 ILE HG12 1 45 GLU H 1.800 . 4.210 2.849 2.628 3.111 . 0 0 "[ . 1 . 2]" 1
772 1 44 ILE MD 1 44 ILE MG 1.800 . 3.110 2.067 1.957 2.165 . 0 0 "[ . 1 . 2]" 1
773 1 44 ILE MG 1 51 ILE H 1.800 . 3.940 2.479 2.194 2.764 . 0 0 "[ . 1 . 2]" 1
774 1 44 ILE MG 1 52 ARG HA 1.800 . 5.500 4.409 4.317 4.493 . 0 0 "[ . 1 . 2]" 1
775 1 44 ILE H 1 44 ILE MG 1.800 . 3.510 2.005 1.894 2.132 . 0 0 "[ . 1 . 2]" 1
776 1 44 ILE H 1 45 GLU H 1.800 . 5.620 4.437 4.357 4.493 . 0 0 "[ . 1 . 2]" 1
777 1 44 ILE H 1 50 ARG QB 1.800 . 5.430 3.787 3.409 5.360 . 0 0 "[ . 1 . 2]" 1
778 1 44 ILE H 1 51 ILE MG 1.800 . 5.620 3.595 3.365 3.760 . 0 0 "[ . 1 . 2]" 1
779 1 44 ILE H 1 51 ILE H 1.800 . 4.070 2.813 2.651 2.910 . 0 0 "[ . 1 . 2]" 1
780 1 44 ILE H 1 52 ARG HA 1.800 . 4.860 3.885 3.703 4.034 . 0 0 "[ . 1 . 2]" 1
781 1 44 ILE H 1 53 ILE MD 1.800 . 4.400 3.708 2.644 4.233 . 0 0 "[ . 1 . 2]" 1
782 1 44 ILE H 1 53 ILE MG 1.800 . 5.180 3.099 2.848 3.327 . 0 0 "[ . 1 . 2]" 1
783 1 44 ILE H 1 53 ILE H 1.800 . 5.390 4.606 4.303 4.838 . 0 0 "[ . 1 . 2]" 1
784 1 45 GLU HA 1 46 ASP H 1.800 . 3.500 2.287 2.223 2.355 . 0 0 "[ . 1 . 2]" 1
785 1 45 GLU HA 1 49 ALA H 1.800 . 5.950 4.888 4.080 5.333 . 0 0 "[ . 1 . 2]" 1
786 1 45 GLU HA 1 50 ARG HA 1.800 . 3.950 2.380 2.299 2.523 . 0 0 "[ . 1 . 2]" 1
787 1 45 GLU HA 1 50 ARG QG 1.800 . 5.500 4.571 3.195 5.202 . 0 0 "[ . 1 . 2]" 1
788 1 45 GLU HA 1 50 ARG H 1.800 . 5.840 4.741 4.632 4.842 . 0 0 "[ . 1 . 2]" 1
789 1 45 GLU HA 1 51 ILE H 1.800 . 4.750 4.018 3.881 4.158 . 0 0 "[ . 1 . 2]" 1
790 1 45 GLU HB3 1 46 ASP H 1.800 . 4.880 3.703 2.689 3.976 . 0 0 "[ . 1 . 2]" 1
791 1 45 GLU HB2 1 46 ASP H 1.800 . 4.160 3.473 2.544 4.016 . 0 0 "[ . 1 . 2]" 1
792 1 45 GLU QB 1 50 ARG HA 1.800 . 5.100 3.765 2.757 4.327 . 0 0 "[ . 1 . 2]" 1
793 1 45 GLU QB 1 50 ARG QB 1.800 . 4.630 2.530 2.174 3.137 . 0 0 "[ . 1 . 2]" 1
794 1 45 GLU QB 1 50 ARG QG 1.800 . 4.640 4.338 2.763 4.715 0.075 20 0 "[ . 1 . 2]" 1
795 1 45 GLU QG 1 46 ASP H 1.800 . 5.200 3.008 2.061 4.299 . 0 0 "[ . 1 . 2]" 1
796 1 45 GLU H 1 45 GLU QG 1.800 . 4.300 3.168 2.061 4.122 . 0 0 "[ . 1 . 2]" 1
797 1 46 ASP HB3 1 47 ASP H 1.800 . 4.170 2.942 1.800 4.461 0.291 14 0 "[ . 1 . 2]" 1
798 1 46 ASP HB2 1 47 ASP H 1.800 . 4.170 3.228 1.806 4.470 0.300 3 0 "[ . 1 . 2]" 1
799 1 46 ASP QB 1 48 THR H 1.800 . 5.390 2.883 2.297 4.942 . 0 0 "[ . 1 . 2]" 1
800 1 46 ASP H 1 47 ASP H 1.800 . 5.540 4.123 3.444 4.329 . 0 0 "[ . 1 . 2]" 1
801 1 46 ASP H 1 48 THR H 1.800 . 5.360 3.869 3.340 4.570 . 0 0 "[ . 1 . 2]" 1
802 1 46 ASP H 1 49 ALA H 1.800 . 4.020 3.613 2.655 4.073 0.053 7 0 "[ . 1 . 2]" 1
803 1 46 ASP H 1 50 ARG HA 1.800 . 4.490 3.862 3.549 4.140 . 0 0 "[ . 1 . 2]" 1
804 1 47 ASP H 1 47 ASP QB 1.800 . 3.810 2.445 2.225 2.902 . 0 0 "[ . 1 . 2]" 1
805 1 47 ASP H 1 48 THR H 1.800 . 4.030 2.714 2.319 4.040 0.010 3 0 "[ . 1 . 2]" 1
806 1 47 ASP H 1 49 ALA H 1.800 . 5.320 5.065 4.706 5.366 0.046 2 0 "[ . 1 . 2]" 1
807 1 48 THR HA 1 48 THR MG 1.800 . 3.570 2.339 2.232 2.556 . 0 0 "[ . 1 . 2]" 1
808 1 48 THR HA 1 49 ALA MB 1.800 . 5.810 4.256 4.118 4.459 . 0 0 "[ . 1 . 2]" 1
809 1 48 THR HB 1 49 ALA MB 1.800 . 4.880 3.479 3.250 3.793 . 0 0 "[ . 1 . 2]" 1
810 1 48 THR HB 1 49 ALA H 1.800 . 5.290 2.638 1.779 3.452 0.021 3 0 "[ . 1 . 2]" 1
811 1 48 THR MG 1 49 ALA H 1.800 . 4.590 3.473 2.684 3.705 . 0 0 "[ . 1 . 2]" 1
812 1 48 THR H 1 48 THR MG 1.800 . 4.090 2.763 2.003 4.057 . 0 0 "[ . 1 . 2]" 1
813 1 48 THR H 1 49 ALA MB 1.800 . 5.780 4.935 4.456 5.349 . 0 0 "[ . 1 . 2]" 1
814 1 48 THR H 1 49 ALA H 1.800 . 3.590 2.862 2.282 3.504 . 0 0 "[ . 1 . 2]" 1
815 1 49 ALA HA 1 50 ARG H 1.800 . 3.420 2.971 2.746 3.075 . 0 0 "[ . 1 . 2]" 1
816 1 49 ALA MB 1 50 ARG H 1.800 . 3.540 1.814 1.776 1.852 0.024 2 0 "[ . 1 . 2]" 1
817 1 49 ALA H 1 50 ARG H 1.800 . 5.130 4.173 4.053 4.355 . 0 0 "[ . 1 . 2]" 1
818 1 50 ARG HA 1 51 ILE MG 1.800 . 5.070 3.585 3.485 3.759 . 0 0 "[ . 1 . 2]" 1
819 1 50 ARG HA 1 51 ILE H 1.800 . 3.520 2.326 2.254 2.390 . 0 0 "[ . 1 . 2]" 1
820 1 50 ARG QB 1 50 ARG HE 1.800 . 4.960 3.441 2.151 4.129 . 0 0 "[ . 1 . 2]" 1
821 1 50 ARG QB 1 51 ILE H 1.800 . 4.550 2.717 2.567 3.583 . 0 0 "[ . 1 . 2]" 1
822 1 50 ARG QG 1 51 ILE H 1.800 . 5.310 3.604 2.312 3.780 . 0 0 "[ . 1 . 2]" 1
823 1 50 ARG H 1 50 ARG QB 1.800 . 3.670 3.102 2.597 3.172 . 0 0 "[ . 1 . 2]" 1
824 1 50 ARG H 1 50 ARG QG 1.800 . 4.390 2.352 2.168 4.107 . 0 0 "[ . 1 . 2]" 1
825 1 50 ARG H 1 51 ILE MG 1.800 . 6.050 5.181 5.037 5.351 . 0 0 "[ . 1 . 2]" 1
826 1 50 ARG H 1 51 ILE H 1.800 . 5.480 4.434 4.394 4.462 . 0 0 "[ . 1 . 2]" 1
827 1 51 ILE HA 1 51 ILE MD 1.800 . 4.430 3.670 3.644 3.694 . 0 0 "[ . 1 . 2]" 1
828 1 51 ILE HA 1 51 ILE HG13 1.800 . 4.390 2.353 2.312 2.395 . 0 0 "[ . 1 . 2]" 1
829 1 51 ILE HA 1 51 ILE HG12 1.800 . 4.390 3.162 3.116 3.222 . 0 0 "[ . 1 . 2]" 1
830 1 51 ILE HA 1 52 ARG H 1.800 . 3.550 2.350 2.273 2.436 . 0 0 "[ . 1 . 2]" 1
831 1 51 ILE HB 1 51 ILE MD 1.800 . 3.510 2.295 2.247 2.341 . 0 0 "[ . 1 . 2]" 1
832 1 51 ILE HB 1 52 ARG H 1.800 . 5.300 3.919 3.858 4.026 . 0 0 "[ . 1 . 2]" 1
833 1 51 ILE MD 1 52 ARG H 1.800 . 4.610 3.690 3.585 3.913 . 0 0 "[ . 1 . 2]" 1
834 1 51 ILE MD 1 80 LEU HB3 1.800 . 4.170 2.830 2.340 3.412 . 0 0 "[ . 1 . 2]" 1
835 1 51 ILE MD 1 80 LEU HB2 1.800 . 4.170 2.718 2.358 3.406 . 0 0 "[ . 1 . 2]" 1
836 1 51 ILE MD 1 81 SER HA 1.800 . 4.190 2.599 2.343 2.850 . 0 0 "[ . 1 . 2]" 1
837 1 51 ILE MD 1 81 SER H 1.800 . 5.060 3.576 3.291 3.854 . 0 0 "[ . 1 . 2]" 1
838 1 51 ILE MD 1 82 LEU MD2 1.800 . 4.100 3.139 2.827 3.554 . 0 0 "[ . 1 . 2]" 1
839 1 51 ILE MD 1 82 LEU HG 1.800 . 3.380 2.739 2.437 3.270 . 0 0 "[ . 1 . 2]" 1
840 1 51 ILE MD 1 82 LEU H 1.800 . 5.420 3.824 3.488 4.168 . 0 0 "[ . 1 . 2]" 1
841 1 51 ILE QG 1 52 ARG HA 1.800 . 5.710 4.040 3.957 4.110 . 0 0 "[ . 1 . 2]" 1
842 1 51 ILE QG 1 52 ARG H 1.800 . 3.730 1.976 1.876 2.193 . 0 0 "[ . 1 . 2]" 1
843 1 51 ILE QG 1 81 SER HA 1.800 . 3.920 2.341 2.264 2.520 . 0 0 "[ . 1 . 2]" 1
844 1 51 ILE MD 1 51 ILE MG 1.800 . 3.530 1.996 1.911 2.077 . 0 0 "[ . 1 . 2]" 1
845 1 51 ILE MG 1 81 SER HA 1.800 . 5.480 3.813 3.335 4.068 . 0 0 "[ . 1 . 2]" 1
846 1 51 ILE MG 1 82 LEU MD1 1.800 . 4.190 2.552 2.303 2.924 . 0 0 "[ . 1 . 2]" 1
847 1 51 ILE MG 1 82 LEU MD2 1.800 . 4.680 3.792 3.620 4.003 . 0 0 "[ . 1 . 2]" 1
848 1 51 ILE MG 1 82 LEU HG 1.800 . 3.810 2.870 2.703 3.103 . 0 0 "[ . 1 . 2]" 1
849 1 51 ILE H 1 51 ILE HB 1.800 . 4.220 3.342 3.268 3.401 . 0 0 "[ . 1 . 2]" 1
850 1 51 ILE H 1 51 ILE MG 1.800 . 4.100 2.290 2.175 2.361 . 0 0 "[ . 1 . 2]" 1
851 1 52 ARG HA 1 52 ARG QD 1.800 . 5.140 3.970 2.794 4.193 . 0 0 "[ . 1 . 2]" 1
852 1 52 ARG HA 1 53 ILE HA 1.800 . 6.050 4.501 4.480 4.520 . 0 0 "[ . 1 . 2]" 1
853 1 52 ARG HA 1 53 ILE H 1.800 . 3.390 2.252 2.205 2.296 . 0 0 "[ . 1 . 2]" 1
854 1 52 ARG QB 1 52 ARG QD 1.800 . 3.650 2.277 2.123 2.823 . 0 0 "[ . 1 . 2]" 1
855 1 52 ARG QB 1 52 ARG HE 1.800 . 5.140 2.792 1.844 4.143 . 0 0 "[ . 1 . 2]" 1
856 1 52 ARG QB 1 81 SER QB 1.800 . 4.160 2.499 2.071 3.624 . 0 0 "[ . 1 . 2]" 1
857 1 52 ARG QD 1 53 ILE H 1.800 . 5.330 4.750 4.232 5.417 0.087 12 0 "[ . 1 . 2]" 1
858 1 52 ARG QD 1 81 SER QB 1.800 . 4.950 3.809 2.750 4.779 . 0 0 "[ . 1 . 2]" 1
859 1 52 ARG QG 1 53 ILE H 1.800 . 5.530 3.109 2.257 3.963 . 0 0 "[ . 1 . 2]" 1
860 1 52 ARG QG 1 81 SER QB 1.800 . 4.080 3.716 2.853 4.298 0.218 14 0 "[ . 1 . 2]" 1
861 1 52 ARG H 1 52 ARG QD 1.800 . 5.270 4.148 2.267 4.742 . 0 0 "[ . 1 . 2]" 1
862 1 52 ARG H 1 52 ARG QG 1.800 . 4.880 3.231 2.230 3.998 . 0 0 "[ . 1 . 2]" 1
863 1 53 ILE HA 1 53 ILE MD 1.800 . 4.510 3.951 3.387 4.148 . 0 0 "[ . 1 . 2]" 1
864 1 53 ILE HA 1 54 SER H 1.800 . 3.470 2.345 2.272 2.460 . 0 0 "[ . 1 . 2]" 1
865 1 53 ILE HA 1 81 SER HB3 1.800 . 6.050 4.611 3.115 5.550 . 0 0 "[ . 1 . 2]" 1
866 1 53 ILE HA 1 81 SER HB2 1.800 . 6.050 3.686 2.816 5.178 . 0 0 "[ . 1 . 2]" 1
867 1 53 ILE HA 1 82 LEU HB3 1.800 . 5.360 4.676 4.455 4.915 . 0 0 "[ . 1 . 2]" 1
868 1 53 ILE HA 1 82 LEU HB2 1.800 . 4.860 3.129 2.844 3.410 . 0 0 "[ . 1 . 2]" 1
869 1 53 ILE HA 1 82 LEU MD1 1.800 . 5.280 4.604 4.313 4.847 . 0 0 "[ . 1 . 2]" 1
870 1 53 ILE HA 1 82 LEU HG 1.800 . 6.050 4.345 4.113 4.542 . 0 0 "[ . 1 . 2]" 1
871 1 53 ILE HA 1 82 LEU H 1.800 . 3.940 2.365 2.142 2.581 . 0 0 "[ . 1 . 2]" 1
872 1 53 ILE HB 1 53 ILE MD 1.800 . 3.650 2.547 2.246 3.227 . 0 0 "[ . 1 . 2]" 1
873 1 53 ILE HB 1 82 LEU MD1 1.800 . 5.170 4.489 3.792 4.863 . 0 0 "[ . 1 . 2]" 1
874 1 53 ILE HB 1 82 LEU H 1.800 . 4.950 4.261 3.528 4.652 . 0 0 "[ . 1 . 2]" 1
875 1 53 ILE HG13 1 54 SER H 1.800 . 5.190 4.045 3.745 4.579 . 0 0 "[ . 1 . 2]" 1
876 1 53 ILE HG12 1 54 SER H 1.800 . 5.190 4.493 3.259 4.954 . 0 0 "[ . 1 . 2]" 1
877 1 53 ILE QG 1 82 LEU QB 1.800 . 5.270 4.799 3.967 5.123 . 0 0 "[ . 1 . 2]" 1
878 1 53 ILE HG13 1 53 ILE MG 1.800 . 4.030 2.976 2.292 3.199 . 0 0 "[ . 1 . 2]" 1
879 1 53 ILE QG 1 53 ILE MG 1.800 . 3.400 2.218 2.170 2.299 . 0 0 "[ . 1 . 2]" 1
880 1 53 ILE MG 1 54 SER H 1.800 . 4.330 3.804 3.715 3.904 . 0 0 "[ . 1 . 2]" 1
881 1 53 ILE MG 1 82 LEU QB 1.800 . 5.190 2.295 2.129 2.493 . 0 0 "[ . 1 . 2]" 1
882 1 53 ILE MG 1 82 LEU MD1 1.800 . 3.830 2.660 2.168 2.860 . 0 0 "[ . 1 . 2]" 1
883 1 54 SER HA 1 55 SER H 1.800 . 3.590 2.196 2.128 2.310 . 0 0 "[ . 1 . 2]" 1
884 1 54 SER HB3 1 55 SER H 1.800 . 5.380 3.940 3.058 4.373 . 0 0 "[ . 1 . 2]" 1
885 1 54 SER HB3 1 56 PHE QE 1.800 . 5.830 4.457 3.051 5.741 . 0 0 "[ . 1 . 2]" 1
886 1 54 SER HB2 1 55 SER H 1.800 . 5.380 3.846 2.793 4.310 . 0 0 "[ . 1 . 2]" 1
887 1 54 SER HB2 1 56 PHE QE 1.800 . 5.830 4.538 2.530 5.790 . 0 0 "[ . 1 . 2]" 1
888 1 54 SER QB 1 56 PHE HZ 1.800 . 4.990 4.141 3.419 4.725 . 0 0 "[ . 1 . 2]" 1
889 1 54 SER QB 1 83 SER HA 1.800 . 5.870 3.126 2.436 4.231 . 0 0 "[ . 1 . 2]" 1
890 1 54 SER H 1 55 SER H 1.800 . 5.600 4.258 4.089 4.406 . 0 0 "[ . 1 . 2]" 1
891 1 54 SER H 1 82 LEU QB 1.800 . 5.510 3.868 3.635 4.240 . 0 0 "[ . 1 . 2]" 1
892 1 54 SER H 1 82 LEU H 1.800 . 4.970 4.041 3.819 4.230 . 0 0 "[ . 1 . 2]" 1
893 1 54 SER H 1 83 SER HA 1.800 . 4.400 2.887 2.634 3.131 . 0 0 "[ . 1 . 2]" 1
894 1 54 SER H 1 84 VAL H 1.800 . 5.850 3.679 3.488 3.802 . 0 0 "[ . 1 . 2]" 1
895 1 55 SER HA 1 56 PHE H 1.800 . 3.740 2.178 2.131 2.215 . 0 0 "[ . 1 . 2]" 1
896 1 55 SER HA 1 60 LEU MD1 1.800 . 5.090 4.418 3.989 4.811 . 0 0 "[ . 1 . 2]" 1
897 1 55 SER HA 1 84 VAL HB 1.800 . 3.750 2.313 2.268 2.461 . 0 0 "[ . 1 . 2]" 1
898 1 55 SER HA 1 84 VAL MG1 1.800 . 4.520 3.939 3.837 3.999 . 0 0 "[ . 1 . 2]" 1
899 1 55 SER HA 1 84 VAL MG2 1.800 . 4.300 3.260 2.906 3.716 . 0 0 "[ . 1 . 2]" 1
900 1 55 SER HA 1 84 VAL H 1.800 . 4.510 2.694 2.512 2.870 . 0 0 "[ . 1 . 2]" 1
901 1 55 SER HB3 1 56 PHE H 1.800 . 5.950 4.284 4.012 4.564 . 0 0 "[ . 1 . 2]" 1
902 1 55 SER HB3 1 60 LEU MD1 1.800 . 4.350 2.585 2.076 3.119 . 0 0 "[ . 1 . 2]" 1
903 1 55 SER HB3 1 60 LEU HG 1.800 . 5.060 3.346 2.724 4.052 . 0 0 "[ . 1 . 2]" 1
904 1 55 SER HB3 1 84 VAL HB 1.800 . 5.310 3.919 2.454 4.846 . 0 0 "[ . 1 . 2]" 1
905 1 55 SER HB2 1 56 PHE H 1.800 . 5.950 3.851 3.097 4.489 . 0 0 "[ . 1 . 2]" 1
906 1 55 SER HB2 1 60 LEU MD1 1.800 . 4.350 2.787 2.076 3.956 . 0 0 "[ . 1 . 2]" 1
907 1 55 SER HB2 1 60 LEU HG 1.800 . 5.060 3.742 3.049 4.564 . 0 0 "[ . 1 . 2]" 1
908 1 55 SER HB2 1 84 VAL HB 1.800 . 5.310 2.920 2.339 4.039 . 0 0 "[ . 1 . 2]" 1
909 1 55 SER QB 1 84 VAL MG2 1.800 . 4.820 3.156 2.810 3.717 . 0 0 "[ . 1 . 2]" 1
910 1 55 SER HG 1 58 LYS QB 1.800 . 4.650 2.498 1.876 3.613 . 0 0 "[ . 1 . 2]" 1
911 1 55 SER HG 1 58 LYS H 1.800 . 4.400 3.511 2.800 4.399 . 0 0 "[ . 1 . 2]" 1
912 1 55 SER H 1 56 PHE H 1.800 . 5.400 4.376 4.230 4.503 . 0 0 "[ . 1 . 2]" 1
913 1 55 SER H 1 60 LEU MD1 1.800 . 5.200 3.787 3.216 4.172 . 0 0 "[ . 1 . 2]" 1
914 1 56 PHE HA 1 57 GLY H 1.800 . 3.730 2.162 2.116 2.189 . 0 0 "[ . 1 . 2]" 1
915 1 56 PHE HB3 1 57 GLY H 1.800 . 6.050 3.484 3.316 3.598 . 0 0 "[ . 1 . 2]" 1
916 1 56 PHE HB2 1 57 GLY H 1.800 . 6.050 4.335 4.169 4.414 . 0 0 "[ . 1 . 2]" 1
917 1 56 PHE QB 1 86 ASP H 1.800 . 6.000 4.279 3.728 4.670 . 0 0 "[ . 1 . 2]" 1
918 1 56 PHE H 1 56 PHE QB 1.800 . 3.890 2.379 2.307 2.484 . 0 0 "[ . 1 . 2]" 1
919 1 56 PHE H 1 56 PHE QD 1.800 . 4.540 2.723 2.299 2.959 . 0 0 "[ . 1 . 2]" 1
920 1 56 PHE H 1 57 GLY H 1.800 . 5.390 4.459 4.359 4.559 . 0 0 "[ . 1 . 2]" 1
921 1 56 PHE H 1 84 VAL HB 1.800 . 4.000 3.507 3.025 3.902 . 0 0 "[ . 1 . 2]" 1
922 1 56 PHE H 1 84 VAL MG1 1.800 . 5.560 4.387 4.194 4.729 . 0 0 "[ . 1 . 2]" 1
923 1 56 PHE H 1 84 VAL H 1.800 . 5.000 3.938 3.471 4.273 . 0 0 "[ . 1 . 2]" 1
924 1 56 PHE H 1 85 GLY QA 1.800 . 5.000 3.654 3.149 4.095 . 0 0 "[ . 1 . 2]" 1
925 1 57 GLY H 1 58 LYS H 1.800 . 4.360 3.358 2.845 3.650 . 0 0 "[ . 1 . 2]" 1
926 1 58 LYS HA 1 58 LYS QD 1.800 . 5.260 3.522 2.151 4.146 . 0 0 "[ . 1 . 2]" 1
927 1 58 LYS HA 1 58 LYS HG3 1.800 . 4.460 3.048 2.300 3.798 . 0 0 "[ . 1 . 2]" 1
928 1 58 LYS HA 1 58 LYS HG2 1.800 . 4.460 2.585 2.331 3.609 . 0 0 "[ . 1 . 2]" 1
929 1 58 LYS HA 1 59 GLN QB 1.800 . 5.750 4.135 4.024 4.409 . 0 0 "[ . 1 . 2]" 1
930 1 58 LYS HA 1 59 GLN H 1.800 . 3.160 2.180 2.121 2.215 . 0 0 "[ . 1 . 2]" 1
931 1 58 LYS QB 1 58 LYS QE 1.800 . 5.200 3.370 2.159 3.819 . 0 0 "[ . 1 . 2]" 1
932 1 58 LYS QB 1 84 VAL MG1 1.800 . 5.930 3.805 3.374 4.134 . 0 0 "[ . 1 . 2]" 1
933 1 58 LYS QB 1 90 ILE MD 1.800 . 4.100 2.850 2.166 3.400 . 0 0 "[ . 1 . 2]" 1
934 1 58 LYS QD 1 84 VAL MG1 1.800 . 4.680 3.357 2.271 4.725 0.045 3 0 "[ . 1 . 2]" 1
935 1 58 LYS QD 1 90 ILE MD 1.800 . 3.270 2.380 1.968 3.278 0.008 10 0 "[ . 1 . 2]" 1
936 1 58 LYS QE 1 84 VAL MG1 1.800 . 4.990 3.859 2.250 5.010 0.020 3 0 "[ . 1 . 2]" 1
937 1 58 LYS QE 1 86 ASP HA 1.800 . 4.320 3.160 2.285 4.364 0.044 6 0 "[ . 1 . 2]" 1
938 1 58 LYS QE 1 90 ILE MD 1.800 . 4.710 3.470 2.053 4.290 . 0 0 "[ . 1 . 2]" 1
939 1 58 LYS QE 1 58 LYS HG3 1.800 . 4.530 2.602 2.270 3.281 . 0 0 "[ . 1 . 2]" 1
940 1 58 LYS HG3 1 59 GLN H 1.800 . 5.790 4.874 2.542 5.731 . 0 0 "[ . 1 . 2]" 1
941 1 58 LYS QE 1 58 LYS HG2 1.800 . 4.530 2.660 2.242 3.522 . 0 0 "[ . 1 . 2]" 1
942 1 58 LYS HG2 1 59 GLN H 1.800 . 5.790 4.253 2.950 5.107 . 0 0 "[ . 1 . 2]" 1
943 1 58 LYS H 1 58 LYS QB 1.800 . 3.770 2.370 2.188 2.514 . 0 0 "[ . 1 . 2]" 1
944 1 58 LYS H 1 58 LYS QG 1.800 . 4.220 2.470 2.021 4.063 . 0 0 "[ . 1 . 2]" 1
945 1 58 LYS H 1 59 GLN H 1.800 . 5.290 4.580 4.235 4.632 . 0 0 "[ . 1 . 2]" 1
946 1 58 LYS H 1 90 ILE MD 1.800 . 5.730 5.419 4.624 5.785 0.055 10 0 "[ . 1 . 2]" 1
947 1 59 GLN HA 1 60 LEU H 1.800 . 3.820 2.305 2.155 2.428 . 0 0 "[ . 1 . 2]" 1
948 1 59 GLN QB 1 59 GLN HE21 1.800 . 5.570 3.912 3.875 4.020 . 0 0 "[ . 1 . 2]" 1
949 1 59 GLN HE21 1 61 GLN QG 1.800 . 5.440 4.020 3.351 4.616 . 0 0 "[ . 1 . 2]" 1
950 1 59 GLN HE22 1 61 GLN QG 1.800 . 5.440 5.024 4.443 5.517 0.077 16 0 "[ . 1 . 2]" 1
951 1 59 GLN QG 1 60 LEU HA 1.800 . 5.270 3.706 3.562 3.912 . 0 0 "[ . 1 . 2]" 1
952 1 59 GLN QG 1 60 LEU H 1.800 . 4.380 2.434 1.974 3.681 . 0 0 "[ . 1 . 2]" 1
953 1 59 GLN QG 1 61 GLN QG 1.800 . 4.100 3.659 3.207 4.182 0.082 1 0 "[ . 1 . 2]" 1
954 1 59 GLN H 1 59 GLN QB 1.800 . 3.330 2.398 2.274 2.741 . 0 0 "[ . 1 . 2]" 1
955 1 59 GLN H 1 59 GLN QG 1.800 . 5.060 3.632 1.798 4.067 0.002 18 0 "[ . 1 . 2]" 1
956 1 60 LEU HA 1 60 LEU MD1 1.800 . 5.040 3.822 3.811 3.836 . 0 0 "[ . 1 . 2]" 1
957 1 60 LEU HA 1 60 LEU MD2 1.800 . 3.600 2.123 2.105 2.139 . 0 0 "[ . 1 . 2]" 1
958 1 60 LEU HA 1 61 GLN H 1.800 . 3.400 2.311 2.254 2.382 . 0 0 "[ . 1 . 2]" 1
959 1 60 LEU HB3 1 60 LEU MD1 1.800 . 4.320 2.380 2.318 2.453 . 0 0 "[ . 1 . 2]" 1
960 1 60 LEU HB3 1 60 LEU MD2 1.800 . 4.400 2.273 2.243 2.300 . 0 0 "[ . 1 . 2]" 1
961 1 60 LEU HB2 1 60 LEU MD1 1.800 . 4.320 2.338 2.267 2.395 . 0 0 "[ . 1 . 2]" 1
962 1 60 LEU HB2 1 60 LEU MD2 1.800 . 4.400 3.211 3.205 3.217 . 0 0 "[ . 1 . 2]" 1
963 1 60 LEU QB 1 61 GLN H 1.800 . 4.530 2.672 2.520 2.755 . 0 0 "[ . 1 . 2]" 1
964 1 60 LEU MD1 1 84 VAL MG2 1.800 . 4.980 3.753 3.269 4.138 . 0 0 "[ . 1 . 2]" 1
965 1 60 LEU MD2 1 61 GLN QG 1.800 . 5.910 4.992 4.769 5.911 0.001 1 0 "[ . 1 . 2]" 1
966 1 60 LEU MD2 1 61 GLN H 1.800 . 4.390 3.388 3.211 3.515 . 0 0 "[ . 1 . 2]" 1
967 1 60 LEU MD2 1 90 ILE MD 1.800 . 3.670 2.613 2.150 3.153 . 0 0 "[ . 1 . 2]" 1
968 1 60 LEU MD2 1 90 ILE MG 1.800 . 3.960 3.330 2.783 3.954 . 0 0 "[ . 1 . 2]" 1
969 1 60 LEU H 1 60 LEU MD2 1.800 . 5.410 3.791 3.621 3.949 . 0 0 "[ . 1 . 2]" 1
970 1 61 GLN HA 1 62 ASP H 1.800 . 3.100 2.216 2.142 2.355 . 0 0 "[ . 1 . 2]" 1
971 1 61 GLN QB 1 62 ASP H 1.800 . 3.880 2.909 2.526 3.220 . 0 0 "[ . 1 . 2]" 1
972 1 61 GLN QB 1 64 ASP QB 1.800 . 4.620 2.391 1.924 3.140 . 0 0 "[ . 1 . 2]" 1
973 1 61 GLN H 1 61 GLN QB 1.800 . 3.720 2.421 2.316 2.621 . 0 0 "[ . 1 . 2]" 1
974 1 61 GLN H 1 61 GLN QG 1.800 . 4.410 2.937 2.705 3.783 . 0 0 "[ . 1 . 2]" 1
975 1 61 GLN H 1 64 ASP HB3 1.800 . 5.530 3.902 2.948 5.054 . 0 0 "[ . 1 . 2]" 1
976 1 61 GLN H 1 64 ASP HB2 1.800 . 5.530 4.116 2.707 5.295 . 0 0 "[ . 1 . 2]" 1
977 1 62 ASP HA 1 63 SER H 1.800 . 3.600 2.196 2.123 2.278 . 0 0 "[ . 1 . 2]" 1
978 1 62 ASP HA 1 64 ASP H 1.800 . 4.660 3.878 3.141 4.762 0.102 18 0 "[ . 1 . 2]" 1
979 1 62 ASP QB 1 63 SER QB 1.800 . 5.700 3.936 3.303 4.452 . 0 0 "[ . 1 . 2]" 1
980 1 62 ASP QB 1 63 SER H 1.800 . 4.410 3.363 2.734 3.672 . 0 0 "[ . 1 . 2]" 1
981 1 62 ASP H 1 62 ASP QB 1.800 . 3.520 2.340 2.235 2.601 . 0 0 "[ . 1 . 2]" 1
982 1 62 ASP H 1 63 SER H 1.800 . 6.050 4.620 4.574 4.662 . 0 0 "[ . 1 . 2]" 1
983 1 63 SER H 1 64 ASP H 1.800 . 4.090 2.938 2.499 3.389 . 0 0 "[ . 1 . 2]" 1
984 1 64 ASP HA 1 65 VAL H 1.800 . 3.260 2.173 2.126 2.221 . 0 0 "[ . 1 . 2]" 1
985 1 64 ASP HB3 1 66 VAL MG1 1.800 . 4.690 3.475 2.813 4.277 . 0 0 "[ . 1 . 2]" 1
986 1 64 ASP HB2 1 66 VAL MG1 1.800 . 4.690 3.566 2.767 4.254 . 0 0 "[ . 1 . 2]" 1
987 1 64 ASP QB 1 65 VAL H 1.800 . 4.040 3.513 2.962 3.909 . 0 0 "[ . 1 . 2]" 1
988 1 64 ASP H 1 64 ASP HB3 1.800 . 4.220 2.933 2.482 3.961 . 0 0 "[ . 1 . 2]" 1
989 1 64 ASP H 1 64 ASP HB2 1.800 . 4.220 3.193 2.280 4.030 . 0 0 "[ . 1 . 2]" 1
990 1 64 ASP H 1 65 VAL H 1.800 . 4.800 4.369 4.005 4.627 . 0 0 "[ . 1 . 2]" 1
991 1 65 VAL HA 1 65 VAL MG1 1.800 . 3.840 2.290 2.218 2.355 . 0 0 "[ . 1 . 2]" 1
992 1 65 VAL HA 1 65 VAL MG2 1.800 . 3.840 2.592 2.338 3.180 . 0 0 "[ . 1 . 2]" 1
993 1 65 VAL HA 1 66 VAL MG2 1.800 . 4.850 3.759 3.583 4.003 . 0 0 "[ . 1 . 2]" 1
994 1 65 VAL HA 1 66 VAL H 1.800 . 3.540 2.175 2.124 2.227 . 0 0 "[ . 1 . 2]" 1
995 1 65 VAL MG1 1 66 VAL H 1.800 . 4.810 3.142 2.765 3.840 . 0 0 "[ . 1 . 2]" 1
996 1 65 VAL MG2 1 66 VAL H 1.800 . 4.810 4.246 4.053 4.410 . 0 0 "[ . 1 . 2]" 1
997 1 65 VAL H 1 65 VAL HB 1.800 . 3.780 2.817 2.418 3.575 . 0 0 "[ . 1 . 2]" 1
998 1 65 VAL H 1 65 VAL MG1 1.800 . 4.310 3.576 2.653 3.823 . 0 0 "[ . 1 . 2]" 1
999 1 65 VAL H 1 65 VAL MG2 1.800 . 4.310 2.003 1.757 2.415 0.043 14 0 "[ . 1 . 2]" 1
1000 1 65 VAL H 1 66 VAL H 1.800 . 5.330 4.436 4.303 4.505 . 0 0 "[ . 1 . 2]" 1
1001 1 66 VAL HA 1 66 VAL MG1 1.800 . 3.700 2.343 2.268 2.447 . 0 0 "[ . 1 . 2]" 1
1002 1 66 VAL HA 1 67 ARG QB 1.800 . 5.870 4.004 3.965 4.074 . 0 0 "[ . 1 . 2]" 1
1003 1 66 VAL HA 1 67 ARG H 1.800 . 3.830 2.382 2.335 2.528 . 0 0 "[ . 1 . 2]" 1
1004 1 66 VAL HA 1 92 SER HA 1.800 . 4.040 2.552 2.307 3.057 . 0 0 "[ . 1 . 2]" 1
1005 1 66 VAL HA 1 93 VAL MG2 1.800 . 4.300 2.800 2.259 3.798 . 0 0 "[ . 1 . 2]" 1
1006 1 66 VAL HA 1 93 VAL H 1.800 . 4.330 2.804 2.315 3.350 . 0 0 "[ . 1 . 2]" 1
1007 1 66 VAL HB 1 67 ARG H 1.800 . 4.040 2.473 2.284 2.627 . 0 0 "[ . 1 . 2]" 1
1008 1 66 VAL HB 1 68 ILE QG 1.800 . 4.790 4.185 3.835 4.579 . 0 0 "[ . 1 . 2]" 1
1009 1 66 VAL HB 1 90 ILE MG 1.800 . 3.780 2.523 2.222 3.036 . 0 0 "[ . 1 . 2]" 1
1010 1 66 VAL HB 1 91 GLU H 1.800 . 4.930 3.846 3.319 4.194 . 0 0 "[ . 1 . 2]" 1
1011 1 66 VAL HB 1 92 SER HA 1.800 . 5.070 3.231 2.711 3.690 . 0 0 "[ . 1 . 2]" 1
1012 1 66 VAL MG1 1 67 ARG H 1.800 . 4.570 3.779 3.644 3.924 . 0 0 "[ . 1 . 2]" 1
1013 1 66 VAL MG1 1 92 SER HA 1.800 . 3.760 2.321 2.252 2.784 . 0 0 "[ . 1 . 2]" 1
1014 1 66 VAL MG1 1 92 SER QB 1.800 . 4.770 3.222 2.683 3.865 . 0 0 "[ . 1 . 2]" 1
1015 1 66 VAL MG1 1 93 VAL H 1.800 . 5.030 3.125 2.811 3.743 . 0 0 "[ . 1 . 2]" 1
1016 1 66 VAL MG2 1 67 ARG H 1.800 . 4.910 3.331 2.939 3.528 . 0 0 "[ . 1 . 2]" 1
1017 1 66 VAL MG2 1 68 ILE MD 1.800 . 3.480 3.215 2.136 3.467 . 0 0 "[ . 1 . 2]" 1
1018 1 66 VAL MG2 1 68 ILE QG 1.800 . 3.630 2.682 2.369 2.914 . 0 0 "[ . 1 . 2]" 1
1019 1 66 VAL H 1 66 VAL MG2 1.800 . 3.470 2.149 2.019 2.336 . 0 0 "[ . 1 . 2]" 1
1020 1 67 ARG HA 1 67 ARG QG 1.800 . 4.000 2.361 2.250 2.485 . 0 0 "[ . 1 . 2]" 1
1021 1 67 ARG HA 1 68 ILE H 1.800 . 3.450 2.175 2.123 2.201 . 0 0 "[ . 1 . 2]" 1
1022 1 67 ARG QB 1 67 ARG QD 1.800 . 3.630 2.254 2.112 2.358 . 0 0 "[ . 1 . 2]" 1
1023 1 67 ARG QB 1 93 VAL MG2 1.800 . 5.460 3.006 2.382 3.990 . 0 0 "[ . 1 . 2]" 1
1024 1 67 ARG QD 1 93 VAL MG2 1.800 . 5.830 4.297 3.657 5.840 0.010 10 0 "[ . 1 . 2]" 1
1025 1 67 ARG HG3 1 68 ILE H 1.800 . 5.900 3.065 2.767 3.312 . 0 0 "[ . 1 . 2]" 1
1026 1 67 ARG HG2 1 68 ILE H 1.800 . 5.900 3.112 2.777 3.399 . 0 0 "[ . 1 . 2]" 1
1027 1 67 ARG QG 1 68 ILE H 1.800 . 4.960 2.739 2.577 2.887 . 0 0 "[ . 1 . 2]" 1
1028 1 67 ARG QG 1 93 VAL MG2 1.800 . 5.870 4.738 3.985 5.640 . 0 0 "[ . 1 . 2]" 1
1029 1 67 ARG H 1 91 GLU H 1.800 . 4.830 2.890 2.649 3.281 . 0 0 "[ . 1 . 2]" 1
1030 1 67 ARG H 1 93 VAL MG2 1.800 . 4.510 3.405 2.536 4.462 . 0 0 "[ . 1 . 2]" 1
1031 1 67 ARG H 1 93 VAL H 1.800 . 5.570 4.647 4.022 5.195 . 0 0 "[ . 1 . 2]" 1
1032 1 68 ILE HA 1 68 ILE MD 1.800 . 4.550 3.758 2.079 3.860 . 0 0 "[ . 1 . 2]" 1
1033 1 68 ILE HA 1 69 ASP H 1.800 . 3.550 2.160 2.115 2.185 . 0 0 "[ . 1 . 2]" 1
1034 1 68 ILE HA 1 90 ILE HA 1.800 . 4.660 2.717 2.478 3.117 . 0 0 "[ . 1 . 2]" 1
1035 1 68 ILE HB 1 84 VAL MG1 1.800 . 5.690 5.040 4.670 5.676 . 0 0 "[ . 1 . 2]" 1
1036 1 68 ILE MD 1 69 ASP H 1.800 . 5.370 5.094 3.720 5.235 . 0 0 "[ . 1 . 2]" 1
1037 1 68 ILE MD 1 90 ILE MG 1.800 . 5.600 4.183 2.516 4.585 . 0 0 "[ . 1 . 2]" 1
1038 1 68 ILE QG 1 69 ASP H 1.800 . 5.870 4.222 4.105 4.775 . 0 0 "[ . 1 . 2]" 1
1039 1 68 ILE MD 1 68 ILE MG 1.800 . 3.300 1.902 1.817 2.025 . 0 0 "[ . 1 . 2]" 1
1040 1 68 ILE HG13 1 68 ILE MG 1.800 . 4.360 3.146 2.337 3.198 . 0 0 "[ . 1 . 2]" 1
1041 1 68 ILE HG12 1 68 ILE MG 1.800 . 4.360 2.333 2.235 3.201 . 0 0 "[ . 1 . 2]" 1
1042 1 68 ILE MG 1 69 ASP HA 1.800 . 5.610 3.821 3.659 3.882 . 0 0 "[ . 1 . 2]" 1
1043 1 68 ILE MG 1 69 ASP H 1.800 . 4.180 2.705 2.609 2.845 . 0 0 "[ . 1 . 2]" 1
1044 1 68 ILE MG 1 71 ALA HA 1.800 . 5.160 3.138 2.863 3.784 . 0 0 "[ . 1 . 2]" 1
1045 1 68 ILE MG 1 71 ALA MB 1.800 . 3.520 2.114 1.904 2.200 . 0 0 "[ . 1 . 2]" 1
1046 1 68 ILE MG 1 84 VAL HA 1.800 . 5.390 3.828 3.616 4.417 . 0 0 "[ . 1 . 2]" 1
1047 1 68 ILE MG 1 84 VAL HB 1.800 . 5.330 4.466 4.235 4.806 . 0 0 "[ . 1 . 2]" 1
1048 1 68 ILE MG 1 84 VAL MG1 1.800 . 3.650 2.507 2.215 3.064 . 0 0 "[ . 1 . 2]" 1
1049 1 68 ILE MG 1 88 SER QB 1.800 . 4.390 3.409 2.606 3.890 . 0 0 "[ . 1 . 2]" 1
1050 1 68 ILE MG 1 89 ARG H 1.800 . 4.770 3.902 3.478 4.715 . 0 0 "[ . 1 . 2]" 1
1051 1 68 ILE MG 1 90 ILE HA 1.800 . 5.080 3.941 3.588 4.626 . 0 0 "[ . 1 . 2]" 1
1052 1 68 ILE MG 1 90 ILE QG 1.800 . 4.860 2.871 2.651 3.274 . 0 0 "[ . 1 . 2]" 1
1053 1 68 ILE H 1 68 ILE HB 1.800 . 3.950 2.563 2.477 2.620 . 0 0 "[ . 1 . 2]" 1
1054 1 68 ILE H 1 68 ILE MD 1.800 . 5.140 3.673 3.231 3.795 . 0 0 "[ . 1 . 2]" 1
1055 1 68 ILE H 1 68 ILE QG 1.800 . 3.950 2.497 2.344 2.749 . 0 0 "[ . 1 . 2]" 1
1056 1 68 ILE H 1 68 ILE MG 1.800 . 4.410 3.833 3.783 3.854 . 0 0 "[ . 1 . 2]" 1
1057 1 69 ASP HA 1 70 ASN HA 1.800 . 5.210 4.469 4.425 4.497 . 0 0 "[ . 1 . 2]" 1
1058 1 69 ASP HA 1 70 ASN H 1.800 . 3.590 2.221 2.172 2.284 . 0 0 "[ . 1 . 2]" 1
1059 1 69 ASP HA 1 71 ALA H 1.800 . 5.610 3.619 3.474 3.720 . 0 0 "[ . 1 . 2]" 1
1060 1 69 ASP HB3 1 70 ASN H 1.800 . 5.170 3.194 2.739 3.998 . 0 0 "[ . 1 . 2]" 1
1061 1 69 ASP HB3 1 89 ARG HB3 1.800 . 5.140 4.093 2.320 5.197 0.057 17 0 "[ . 1 . 2]" 1
1062 1 69 ASP HB3 1 89 ARG HB2 1.800 . 5.140 3.993 2.326 5.170 0.030 11 0 "[ . 1 . 2]" 1
1063 1 69 ASP HB2 1 70 ASN H 1.800 . 5.170 4.083 3.917 4.231 . 0 0 "[ . 1 . 2]" 1
1064 1 69 ASP HB2 1 89 ARG HB3 1.800 . 5.140 3.327 2.315 5.134 . 0 0 "[ . 1 . 2]" 1
1065 1 69 ASP HB2 1 89 ARG HB2 1.800 . 5.140 3.475 2.321 5.141 0.001 20 0 "[ . 1 . 2]" 1
1066 1 69 ASP QB 1 89 ARG H 1.800 . 4.400 3.277 2.898 3.724 . 0 0 "[ . 1 . 2]" 1
1067 1 69 ASP H 1 89 ARG QB 1.800 . 5.100 3.556 3.272 3.879 . 0 0 "[ . 1 . 2]" 1
1068 1 69 ASP H 1 89 ARG H 1.800 . 4.180 3.156 2.846 3.622 . 0 0 "[ . 1 . 2]" 1
1069 1 70 ASN HA 1 71 ALA H 1.800 . 3.640 2.850 2.815 2.889 . 0 0 "[ . 1 . 2]" 1
1070 1 70 ASN HB3 1 88 SER HA 1.800 . 4.270 2.384 2.301 3.096 . 0 0 "[ . 1 . 2]" 1
1071 1 70 ASN HB2 1 88 SER HA 1.800 . 4.270 3.826 2.282 4.043 . 0 0 "[ . 1 . 2]" 1
1072 1 70 ASN QB 1 88 SER QB 1.800 . 5.210 3.509 2.926 3.908 . 0 0 "[ . 1 . 2]" 1
1073 1 70 ASN QB 1 89 ARG H 1.800 . 4.740 3.194 2.580 3.493 . 0 0 "[ . 1 . 2]" 1
1074 1 70 ASN HD21 1 87 SER HB3 1.800 . 6.050 4.306 2.984 5.416 . 0 0 "[ . 1 . 2]" 1
1075 1 70 ASN HD21 1 87 SER HB2 1.800 . 6.050 4.054 3.085 5.795 . 0 0 "[ . 1 . 2]" 1
1076 1 70 ASN HD22 1 87 SER HB3 1.800 . 6.050 4.532 2.987 5.860 . 0 0 "[ . 1 . 2]" 1
1077 1 70 ASN HD22 1 87 SER HB2 1.800 . 6.050 4.314 3.463 6.179 0.129 14 0 "[ . 1 . 2]" 1
1078 1 70 ASN QD 1 88 SER QB 1.800 . 5.700 4.278 3.446 5.287 . 0 0 "[ . 1 . 2]" 1
1079 1 70 ASN H 1 71 ALA H 1.800 . 3.990 2.660 2.518 2.724 . 0 0 "[ . 1 . 2]" 1
1080 1 71 ALA HA 1 72 ARG H 1.800 . 3.620 2.256 2.190 2.311 . 0 0 "[ . 1 . 2]" 1
1081 1 71 ALA HA 1 84 VAL HA 1.800 . 4.440 3.421 3.214 3.773 . 0 0 "[ . 1 . 2]" 1
1082 1 71 ALA HA 1 84 VAL MG1 1.800 . 5.420 3.910 3.685 4.152 . 0 0 "[ . 1 . 2]" 1
1083 1 71 ALA HA 1 84 VAL MG2 1.800 . 4.990 3.748 3.421 3.973 . 0 0 "[ . 1 . 2]" 1
1084 1 71 ALA HA 1 88 SER QB 1.800 . 6.050 3.407 2.445 3.849 . 0 0 "[ . 1 . 2]" 1
1085 1 71 ALA MB 1 72 ARG H 1.800 . 3.880 2.897 2.790 3.125 . 0 0 "[ . 1 . 2]" 1
1086 1 71 ALA MB 1 82 LEU HA 1.800 . 5.010 4.008 3.745 4.238 . 0 0 "[ . 1 . 2]" 1
1087 1 71 ALA MB 1 82 LEU HB3 1.800 . 4.310 2.516 2.298 2.833 . 0 0 "[ . 1 . 2]" 1
1088 1 71 ALA MB 1 82 LEU HB2 1.800 . 4.310 3.918 3.680 4.255 . 0 0 "[ . 1 . 2]" 1
1089 1 71 ALA MB 1 82 LEU MD1 1.800 . 4.020 3.001 2.704 3.628 . 0 0 "[ . 1 . 2]" 1
1090 1 71 ALA MB 1 82 LEU MD2 1.800 . 3.880 2.901 2.710 3.455 . 0 0 "[ . 1 . 2]" 1
1091 1 71 ALA MB 1 83 SER H 1.800 . 4.710 4.032 3.733 4.279 . 0 0 "[ . 1 . 2]" 1
1092 1 71 ALA MB 1 84 VAL HA 1.800 . 5.390 4.074 3.543 4.275 . 0 0 "[ . 1 . 2]" 1
1093 1 71 ALA MB 1 84 VAL MG2 1.800 . 3.980 3.155 2.304 3.402 . 0 0 "[ . 1 . 2]" 1
1094 1 71 ALA MB 1 88 SER QB 1.800 . 6.050 4.396 3.647 4.802 . 0 0 "[ . 1 . 2]" 1
1095 1 71 ALA H 1 71 ALA MB 1.800 . 3.370 2.233 2.190 2.258 . 0 0 "[ . 1 . 2]" 1
1096 1 72 ARG HA 1 72 ARG QD 1.800 . 4.700 3.975 3.895 4.261 . 0 0 "[ . 1 . 2]" 1
1097 1 72 ARG HA 1 72 ARG HG3 1.800 . 4.410 2.472 2.346 3.732 . 0 0 "[ . 1 . 2]" 1
1098 1 72 ARG HA 1 72 ARG HG2 1.800 . 4.410 3.068 2.916 3.694 . 0 0 "[ . 1 . 2]" 1
1099 1 72 ARG HA 1 73 VAL H 1.800 . 3.370 2.170 2.116 2.237 . 0 0 "[ . 1 . 2]" 1
1100 1 72 ARG QB 1 72 ARG HE 1.800 . 5.240 2.728 2.153 4.142 . 0 0 "[ . 1 . 2]" 1
1101 1 72 ARG QB 1 83 SER QB 1.800 . 4.580 2.610 2.282 4.112 . 0 0 "[ . 1 . 2]" 1
1102 1 72 ARG QB 1 83 SER H 1.800 . 5.050 3.369 3.113 4.820 . 0 0 "[ . 1 . 2]" 1
1103 1 72 ARG QD 1 73 VAL H 1.800 . 5.710 4.782 4.582 4.970 . 0 0 "[ . 1 . 2]" 1
1104 1 72 ARG HG3 1 73 VAL H 1.800 . 4.430 3.175 2.875 3.683 . 0 0 "[ . 1 . 2]" 1
1105 1 72 ARG HG2 1 73 VAL H 1.800 . 4.430 3.163 2.806 4.571 0.141 10 0 "[ . 1 . 2]" 1
1106 1 72 ARG QG 1 73 VAL HA 1.800 . 5.600 4.215 3.969 4.421 . 0 0 "[ . 1 . 2]" 1
1107 1 72 ARG QG 1 74 ALA MB 1.800 . 5.300 3.463 3.171 4.349 . 0 0 "[ . 1 . 2]" 1
1108 1 72 ARG QG 1 83 SER QB 1.800 . 5.300 3.570 2.143 4.734 . 0 0 "[ . 1 . 2]" 1
1109 1 72 ARG H 1 72 ARG HB3 1.800 . 4.280 2.584 2.493 2.796 . 0 0 "[ . 1 . 2]" 1
1110 1 72 ARG H 1 72 ARG HB2 1.800 . 4.280 2.792 2.649 3.725 . 0 0 "[ . 1 . 2]" 1
1111 1 72 ARG H 1 73 VAL H 1.800 . 5.070 4.479 4.356 4.581 . 0 0 "[ . 1 . 2]" 1
1112 1 72 ARG H 1 83 SER H 1.800 . 4.530 3.403 3.074 3.948 . 0 0 "[ . 1 . 2]" 1
1113 1 73 VAL HA 1 73 VAL MG1 1.800 . 3.620 2.338 2.257 2.416 . 0 0 "[ . 1 . 2]" 1
1114 1 73 VAL HA 1 73 VAL MG2 1.800 . 3.760 2.354 2.255 2.443 . 0 0 "[ . 1 . 2]" 1
1115 1 73 VAL HA 1 74 ALA MB 1.800 . 4.970 3.976 3.935 4.012 . 0 0 "[ . 1 . 2]" 1
1116 1 73 VAL HA 1 74 ALA H 1.800 . 3.210 2.194 2.140 2.225 . 0 0 "[ . 1 . 2]" 1
1117 1 73 VAL HA 1 81 SER H 1.800 . 5.150 4.505 4.201 4.701 . 0 0 "[ . 1 . 2]" 1
1118 1 73 VAL HA 1 82 LEU HA 1.800 . 4.440 2.675 2.564 2.878 . 0 0 "[ . 1 . 2]" 1
1119 1 73 VAL HA 1 82 LEU MD2 1.800 . 4.070 2.499 2.293 2.765 . 0 0 "[ . 1 . 2]" 1
1120 1 73 VAL HA 1 83 SER H 1.800 . 5.020 3.512 3.288 3.728 . 0 0 "[ . 1 . 2]" 1
1121 1 73 VAL HB 1 74 ALA HA 1.800 . 5.800 4.714 4.553 4.835 . 0 0 "[ . 1 . 2]" 1
1122 1 73 VAL MG1 1 74 ALA HA 1.800 . 4.860 3.534 3.365 3.819 . 0 0 "[ . 1 . 2]" 1
1123 1 73 VAL MG1 1 74 ALA H 1.800 . 3.640 2.564 2.474 2.651 . 0 0 "[ . 1 . 2]" 1
1124 1 73 VAL MG1 1 75 GLN H 1.800 . 5.820 4.745 4.547 4.958 . 0 0 "[ . 1 . 2]" 1
1125 1 73 VAL MG1 1 80 LEU HB3 1.800 . 5.360 3.390 3.209 3.975 . 0 0 "[ . 1 . 2]" 1
1126 1 73 VAL MG1 1 80 LEU HB2 1.800 . 5.360 4.829 4.623 5.382 0.022 2 0 "[ . 1 . 2]" 1
1127 1 73 VAL MG1 1 80 LEU MD1 1.800 . 3.740 3.573 2.246 3.832 0.092 19 0 "[ . 1 . 2]" 1
1128 1 73 VAL MG1 1 80 LEU HG 1.800 . 5.420 5.244 4.204 5.552 0.132 18 0 "[ . 1 . 2]" 1
1129 1 73 VAL MG1 1 81 SER H 1.800 . 5.610 3.483 3.282 3.798 . 0 0 "[ . 1 . 2]" 1
1130 1 73 VAL MG1 1 82 LEU HA 1.800 . 5.620 4.086 3.656 4.403 . 0 0 "[ . 1 . 2]" 1
1131 1 73 VAL MG2 1 74 ALA H 1.800 . 4.640 4.002 3.861 4.134 . 0 0 "[ . 1 . 2]" 1
1132 1 73 VAL MG2 1 83 SER H 1.800 . 5.580 4.755 4.427 5.029 . 0 0 "[ . 1 . 2]" 1
1133 1 73 VAL H 1 73 VAL HB 1.800 . 3.490 2.486 2.370 2.599 . 0 0 "[ . 1 . 2]" 1
1134 1 73 VAL H 1 73 VAL MG1 1.800 . 4.440 3.779 3.750 3.807 . 0 0 "[ . 1 . 2]" 1
1135 1 73 VAL H 1 73 VAL MG2 1.800 . 3.480 2.293 2.057 2.663 . 0 0 "[ . 1 . 2]" 1
1136 1 73 VAL H 1 74 ALA H 1.800 . 5.140 4.560 4.494 4.591 . 0 0 "[ . 1 . 2]" 1
1137 1 74 ALA HA 1 75 GLN QB 1.800 . 5.870 4.065 3.992 4.341 . 0 0 "[ . 1 . 2]" 1
1138 1 74 ALA HA 1 75 GLN H 1.800 . 3.090 2.328 2.210 2.433 . 0 0 "[ . 1 . 2]" 1
1139 1 74 ALA HA 1 81 SER H 1.800 . 5.580 4.946 4.814 5.134 . 0 0 "[ . 1 . 2]" 1
1140 1 74 ALA MB 1 75 GLN H 1.800 . 3.300 2.618 2.412 2.897 . 0 0 "[ . 1 . 2]" 1
1141 1 74 ALA MB 1 76 PHE QB 1.800 . 5.650 4.769 4.574 5.505 . 0 0 "[ . 1 . 2]" 1
1142 1 74 ALA MB 1 76 PHE QD 1.800 . 5.330 3.237 2.852 4.704 . 0 0 "[ . 1 . 2]" 1
1143 1 74 ALA MB 1 76 PHE QE 1.800 . 4.870 2.266 2.059 4.428 . 0 0 "[ . 1 . 2]" 1
1144 1 74 ALA MB 1 76 PHE HZ 1.800 . 5.330 3.376 2.799 5.064 . 0 0 "[ . 1 . 2]" 1
1145 1 74 ALA MB 1 81 SER QB 1.800 . 5.300 4.219 3.379 4.815 . 0 0 "[ . 1 . 2]" 1
1146 1 74 ALA MB 1 83 SER HB3 1.800 . 5.760 3.972 2.949 4.720 . 0 0 "[ . 1 . 2]" 1
1147 1 74 ALA MB 1 83 SER HB2 1.800 . 5.760 3.547 3.179 4.418 . 0 0 "[ . 1 . 2]" 1
1148 1 74 ALA H 1 74 ALA MB 1.800 . 3.660 2.587 2.371 2.677 . 0 0 "[ . 1 . 2]" 1
1149 1 74 ALA H 1 75 GLN H 1.800 . 5.060 4.422 4.331 4.481 . 0 0 "[ . 1 . 2]" 1
1150 1 74 ALA H 1 80 LEU HA 1.800 . 5.250 4.631 4.328 4.799 . 0 0 "[ . 1 . 2]" 1
1151 1 74 ALA H 1 81 SER H 1.800 . 3.900 2.988 2.792 3.165 . 0 0 "[ . 1 . 2]" 1
1152 1 74 ALA H 1 82 LEU HA 1.800 . 4.880 3.456 3.229 3.800 . 0 0 "[ . 1 . 2]" 1
1153 1 74 ALA H 1 82 LEU MD2 1.800 . 5.150 3.636 3.416 4.057 . 0 0 "[ . 1 . 2]" 1
1154 1 75 GLN HA 1 75 GLN QG 1.800 . 3.940 2.386 2.244 3.413 . 0 0 "[ . 1 . 2]" 1
1155 1 75 GLN HA 1 76 PHE H 1.800 . 3.230 2.167 2.115 2.211 . 0 0 "[ . 1 . 2]" 1
1156 1 75 GLN HA 1 80 LEU MD2 1.800 . 4.070 2.838 2.447 3.315 . 0 0 "[ . 1 . 2]" 1
1157 1 75 GLN HA 1 81 SER H 1.800 . 4.750 3.455 2.985 4.022 . 0 0 "[ . 1 . 2]" 1
1158 1 75 GLN HB3 1 76 PHE H 1.800 . 5.010 4.230 3.634 4.381 . 0 0 "[ . 1 . 2]" 1
1159 1 75 GLN HB2 1 76 PHE H 1.800 . 5.010 4.333 3.141 4.564 . 0 0 "[ . 1 . 2]" 1
1160 1 75 GLN QB 1 78 GLY H 1.800 . 5.460 4.728 3.379 5.655 0.195 19 0 "[ . 1 . 2]" 1
1161 1 75 GLN QB 1 80 LEU MD2 1.800 . 4.050 2.598 1.899 3.911 . 0 0 "[ . 1 . 2]" 1
1162 1 75 GLN HE21 1 80 LEU MD1 1.800 . 5.950 4.459 3.100 5.982 0.032 17 0 "[ . 1 . 2]" 1
1163 1 75 GLN HE21 1 80 LEU MD2 1.800 . 5.080 2.788 2.060 4.256 . 0 0 "[ . 1 . 2]" 1
1164 1 75 GLN QG 1 76 PHE H 1.800 . 4.150 3.142 2.789 4.258 0.108 18 0 "[ . 1 . 2]" 1
1165 1 75 GLN QG 1 78 GLY H 1.800 . 5.000 3.221 2.520 5.197 0.197 1 0 "[ . 1 . 2]" 1
1166 1 75 GLN QG 1 79 TYR H 1.800 . 4.570 3.362 2.459 4.781 0.211 18 0 "[ . 1 . 2]" 1
1167 1 75 GLN QG 1 80 LEU MD1 1.800 . 5.330 4.550 3.127 5.460 0.130 18 0 "[ . 1 . 2]" 1
1168 1 75 GLN QG 1 80 LEU MD2 1.800 . 3.790 2.342 2.045 3.283 . 0 0 "[ . 1 . 2]" 1
1169 1 75 GLN QG 1 81 SER H 1.800 . 5.850 5.069 4.383 5.661 . 0 0 "[ . 1 . 2]" 1
1170 1 75 GLN H 1 75 GLN QB 1.800 . 3.720 2.451 2.324 2.818 . 0 0 "[ . 1 . 2]" 1
1171 1 75 GLN H 1 75 GLN QG 1.800 . 4.610 3.826 2.072 4.107 . 0 0 "[ . 1 . 2]" 1
1172 1 75 GLN H 1 76 PHE H 1.800 . 5.130 4.306 4.052 4.470 . 0 0 "[ . 1 . 2]" 1
1173 1 76 PHE HA 1 76 PHE QD 1.800 . 4.420 2.568 2.367 3.027 . 0 0 "[ . 1 . 2]" 1
1174 1 76 PHE HA 1 77 ASN H 1.800 . 3.220 2.208 2.116 2.632 . 0 0 "[ . 1 . 2]" 1
1175 1 76 PHE HA 1 78 GLY H 1.800 . 5.030 3.688 3.390 4.659 . 0 0 "[ . 1 . 2]" 1
1176 1 76 PHE HA 1 79 TYR H 1.800 . 5.350 4.328 4.119 4.655 . 0 0 "[ . 1 . 2]" 1
1177 1 76 PHE HB3 1 77 ASN H 1.800 . 5.040 3.138 1.996 3.514 . 0 0 "[ . 1 . 2]" 1
1178 1 76 PHE HB2 1 77 ASN H 1.800 . 5.040 4.179 3.438 4.416 . 0 0 "[ . 1 . 2]" 1
1179 1 76 PHE QB 1 79 TYR H 1.800 . 5.190 4.005 2.502 4.287 . 0 0 "[ . 1 . 2]" 1
1180 1 76 PHE QD 1 81 SER QB 1.800 . 5.370 3.117 2.300 3.861 . 0 0 "[ . 1 . 2]" 1
1181 1 76 PHE H 1 78 GLY H 1.800 . 4.880 4.095 3.730 4.797 . 0 0 "[ . 1 . 2]" 1
1182 1 76 PHE H 1 79 TYR H 1.800 . 3.820 3.094 2.608 3.483 . 0 0 "[ . 1 . 2]" 1
1183 1 76 PHE H 1 80 LEU MD2 1.800 . 4.910 4.300 3.436 4.871 . 0 0 "[ . 1 . 2]" 1
1184 1 77 ASN HA 1 78 GLY H 1.800 . 3.690 2.991 2.392 3.562 . 0 0 "[ . 1 . 2]" 1
1185 1 77 ASN HA 1 79 TYR H 1.800 . 5.280 4.407 4.050 5.151 . 0 0 "[ . 1 . 2]" 1
1186 1 77 ASN HB3 1 78 GLY H 1.800 . 5.210 4.222 3.461 4.449 . 0 0 "[ . 1 . 2]" 1
1187 1 77 ASN HB3 1 79 TYR QD 1.800 . 5.070 2.850 2.303 4.961 . 0 0 "[ . 1 . 2]" 1
1188 1 77 ASN HB3 1 79 TYR QE 1.800 . 5.170 3.654 3.214 4.965 . 0 0 "[ . 1 . 2]" 1
1189 1 77 ASN HB2 1 78 GLY H 1.800 . 5.210 4.128 2.060 4.571 . 0 0 "[ . 1 . 2]" 1
1190 1 77 ASN HB2 1 79 TYR QD 1.800 . 5.070 2.975 2.348 4.036 . 0 0 "[ . 1 . 2]" 1
1191 1 77 ASN HB2 1 79 TYR QE 1.800 . 5.170 4.342 2.331 5.235 0.065 4 0 "[ . 1 . 2]" 1
1192 1 77 ASN QB 1 79 TYR H 1.800 . 5.130 3.502 3.233 4.553 . 0 0 "[ . 1 . 2]" 1
1193 1 77 ASN H 1 78 GLY H 1.800 . 4.090 2.851 2.677 3.938 . 0 0 "[ . 1 . 2]" 1
1194 1 77 ASN H 1 79 TYR H 1.800 . 5.380 4.129 3.866 4.730 . 0 0 "[ . 1 . 2]" 1
1195 1 78 GLY H 1 79 TYR H 1.800 . 3.620 2.440 1.734 2.603 0.066 14 0 "[ . 1 . 2]" 1
1196 1 79 TYR HA 1 79 TYR QD 1.800 . 4.420 2.724 2.511 3.704 . 0 0 "[ . 1 . 2]" 1
1197 1 79 TYR HA 1 80 LEU H 1.800 . 3.280 2.187 2.132 2.333 . 0 0 "[ . 1 . 2]" 1
1198 1 79 TYR HB3 1 80 LEU H 1.800 . 4.590 3.194 2.907 3.911 . 0 0 "[ . 1 . 2]" 1
1199 1 79 TYR HB2 1 80 LEU H 1.800 . 4.590 4.089 2.671 4.376 . 0 0 "[ . 1 . 2]" 1
1200 1 79 TYR QD 1 80 LEU H 1.800 . 4.840 3.795 3.387 4.094 . 0 0 "[ . 1 . 2]" 1
1201 1 79 TYR H 1 79 TYR QB 1.800 . 3.480 2.548 2.444 3.193 . 0 0 "[ . 1 . 2]" 1
1202 1 79 TYR H 1 79 TYR QD 1.800 . 3.970 2.965 2.589 3.178 . 0 0 "[ . 1 . 2]" 1
1203 1 79 TYR H 1 80 LEU H 1.800 . 5.500 4.433 4.183 4.476 . 0 0 "[ . 1 . 2]" 1
1204 1 80 LEU HA 1 80 LEU MD1 1.800 . 4.320 3.647 2.143 3.820 . 0 0 "[ . 1 . 2]" 1
1205 1 80 LEU HA 1 80 LEU MD2 1.800 . 3.560 2.132 2.072 2.285 . 0 0 "[ . 1 . 2]" 1
1206 1 80 LEU HA 1 81 SER H 1.800 . 3.200 2.237 2.164 2.295 . 0 0 "[ . 1 . 2]" 1
1207 1 80 LEU HB3 1 80 LEU MD1 1.800 . 3.820 2.370 2.214 2.582 . 0 0 "[ . 1 . 2]" 1
1208 1 80 LEU HB3 1 80 LEU MD2 1.800 . 4.230 2.379 2.220 3.199 . 0 0 "[ . 1 . 2]" 1
1209 1 80 LEU HB3 1 81 SER H 1.800 . 4.720 2.955 2.850 3.100 . 0 0 "[ . 1 . 2]" 1
1210 1 80 LEU HB2 1 80 LEU MD1 1.800 . 3.820 2.436 2.230 3.216 . 0 0 "[ . 1 . 2]" 1
1211 1 80 LEU HB2 1 80 LEU MD2 1.800 . 4.230 3.128 2.383 3.216 . 0 0 "[ . 1 . 2]" 1
1212 1 80 LEU HB2 1 81 SER H 1.800 . 4.720 3.976 3.879 4.175 . 0 0 "[ . 1 . 2]" 1
1213 1 80 LEU MD2 1 81 SER H 1.800 . 3.970 3.508 3.030 4.164 0.194 2 0 "[ . 1 . 2]" 1
1214 1 80 LEU H 1 80 LEU HB3 1.800 . 4.090 3.613 3.543 3.720 . 0 0 "[ . 1 . 2]" 1
1215 1 80 LEU H 1 80 LEU HB2 1.800 . 4.090 2.462 2.220 2.623 . 0 0 "[ . 1 . 2]" 1
1216 1 80 LEU H 1 80 LEU MD2 1.800 . 4.620 3.201 1.892 4.015 . 0 0 "[ . 1 . 2]" 1
1217 1 80 LEU H 1 80 LEU HG 1.800 . 4.420 2.371 1.936 3.838 . 0 0 "[ . 1 . 2]" 1
1218 1 81 SER HA 1 82 LEU HG 1.800 . 4.580 3.431 3.367 3.564 . 0 0 "[ . 1 . 2]" 1
1219 1 81 SER HA 1 82 LEU H 1.800 . 3.360 2.377 2.324 2.441 . 0 0 "[ . 1 . 2]" 1
1220 1 81 SER HB3 1 82 LEU H 1.800 . 4.720 3.739 2.624 4.093 . 0 0 "[ . 1 . 2]" 1
1221 1 81 SER HB2 1 82 LEU H 1.800 . 4.720 3.009 2.454 3.992 . 0 0 "[ . 1 . 2]" 1
1222 1 82 LEU HA 1 82 LEU MD1 1.800 . 5.210 3.821 3.811 3.845 . 0 0 "[ . 1 . 2]" 1
1223 1 82 LEU HA 1 82 LEU MD2 1.800 . 3.510 2.114 2.099 2.146 . 0 0 "[ . 1 . 2]" 1
1224 1 82 LEU HA 1 83 SER H 1.800 . 3.480 2.157 2.109 2.180 . 0 0 "[ . 1 . 2]" 1
1225 1 82 LEU HB3 1 82 LEU MD1 1.800 . 3.900 2.383 2.340 2.431 . 0 0 "[ . 1 . 2]" 1
1226 1 82 LEU HB3 1 83 SER H 1.800 . 4.570 3.384 3.238 3.729 . 0 0 "[ . 1 . 2]" 1
1227 1 82 LEU HB2 1 82 LEU MD1 1.800 . 3.900 2.344 2.290 2.396 . 0 0 "[ . 1 . 2]" 1
1228 1 82 LEU HB2 1 83 SER H 1.800 . 4.570 4.186 4.112 4.326 . 0 0 "[ . 1 . 2]" 1
1229 1 82 LEU QB 1 82 LEU MD2 1.800 . 3.850 2.246 2.230 2.269 . 0 0 "[ . 1 . 2]" 1
1230 1 82 LEU MD1 1 84 VAL MG2 1.800 . 5.220 4.628 4.356 4.936 . 0 0 "[ . 1 . 2]" 1
1231 1 82 LEU MD2 1 83 SER H 1.800 . 4.230 3.661 3.560 3.839 . 0 0 "[ . 1 . 2]" 1
1232 1 82 LEU H 1 82 LEU MD1 1.800 . 5.190 3.794 3.699 3.877 . 0 0 "[ . 1 . 2]" 1
1233 1 82 LEU H 1 82 LEU MD2 1.800 . 4.830 3.495 3.396 3.579 . 0 0 "[ . 1 . 2]" 1
1234 1 82 LEU H 1 82 LEU HG 1.800 . 3.560 2.490 2.398 2.624 . 0 0 "[ . 1 . 2]" 1
1235 1 83 SER HA 1 84 VAL MG2 1.800 . 4.860 3.431 3.325 3.505 . 0 0 "[ . 1 . 2]" 1
1236 1 83 SER HA 1 84 VAL H 1.800 . 3.620 2.173 2.118 2.208 . 0 0 "[ . 1 . 2]" 1
1237 1 83 SER HB3 1 84 VAL H 1.800 . 5.510 3.803 3.037 4.424 . 0 0 "[ . 1 . 2]" 1
1238 1 83 SER HB2 1 84 VAL H 1.800 . 5.510 4.142 3.225 4.393 . 0 0 "[ . 1 . 2]" 1
1239 1 83 SER H 1 83 SER HB3 1.800 . 4.280 3.171 2.360 3.711 . 0 0 "[ . 1 . 2]" 1
1240 1 83 SER H 1 83 SER HB2 1.800 . 4.280 2.795 2.308 3.720 . 0 0 "[ . 1 . 2]" 1
1241 1 84 VAL HA 1 84 VAL MG1 1.800 . 3.820 2.245 2.211 2.303 . 0 0 "[ . 1 . 2]" 1
1242 1 84 VAL HA 1 84 VAL MG2 1.800 . 3.810 2.436 2.356 2.508 . 0 0 "[ . 1 . 2]" 1
1243 1 84 VAL HA 1 85 GLY H 1.800 . 3.840 2.176 2.120 2.243 . 0 0 "[ . 1 . 2]" 1
1244 1 84 VAL HA 1 88 SER QB 1.800 . 5.180 2.993 2.662 3.219 . 0 0 "[ . 1 . 2]" 1
1245 1 84 VAL HA 1 88 SER H 1.800 . 5.740 5.088 4.267 5.410 . 0 0 "[ . 1 . 2]" 1
1246 1 84 VAL MG1 1 85 GLY H 1.800 . 4.750 3.117 2.699 3.395 . 0 0 "[ . 1 . 2]" 1
1247 1 84 VAL MG1 1 88 SER QB 1.800 . 3.540 2.142 1.926 2.677 . 0 0 "[ . 1 . 2]" 1
1248 1 84 VAL MG1 1 89 ARG H 1.800 . 5.430 4.170 3.960 4.450 . 0 0 "[ . 1 . 2]" 1
1249 1 84 VAL MG1 1 90 ILE MD 1.800 . 3.560 2.210 2.026 2.441 . 0 0 "[ . 1 . 2]" 1
1250 1 84 VAL MG1 1 90 ILE QG 1.800 . 4.520 2.615 2.133 2.895 . 0 0 "[ . 1 . 2]" 1
1251 1 84 VAL MG2 1 88 SER QB 1.800 . 4.680 3.939 3.647 4.189 . 0 0 "[ . 1 . 2]" 1
1252 1 84 VAL MG2 1 90 ILE QG 1.800 . 5.240 3.807 3.441 4.030 . 0 0 "[ . 1 . 2]" 1
1253 1 84 VAL H 1 84 VAL MG1 1.800 . 5.070 3.837 3.816 3.886 . 0 0 "[ . 1 . 2]" 1
1254 1 84 VAL H 1 84 VAL MG2 1.800 . 4.090 2.254 2.139 2.655 . 0 0 "[ . 1 . 2]" 1
1255 1 85 GLY HA3 1 86 ASP H 1.800 . 3.780 2.549 2.272 2.648 . 0 0 "[ . 1 . 2]" 1
1256 1 85 GLY HA2 1 86 ASP H 1.800 . 3.780 2.606 2.481 2.962 . 0 0 "[ . 1 . 2]" 1
1257 1 85 GLY H 1 86 ASP H 1.800 . 6.050 4.495 4.164 4.570 . 0 0 "[ . 1 . 2]" 1
1258 1 85 GLY H 1 88 SER QB 1.800 . 5.050 2.597 2.283 3.007 . 0 0 "[ . 1 . 2]" 1
1259 1 86 ASP HA 1 88 SER H 1.800 . 4.810 3.731 3.569 4.463 . 0 0 "[ . 1 . 2]" 1
1260 1 86 ASP QB 1 87 SER H 1.800 . 4.020 3.029 2.528 3.664 . 0 0 "[ . 1 . 2]" 1
1261 1 86 ASP H 1 86 ASP QB 1.800 . 3.640 2.362 2.230 2.593 . 0 0 "[ . 1 . 2]" 1
1262 1 86 ASP H 1 87 SER H 1.800 . 4.060 2.576 2.496 2.736 . 0 0 "[ . 1 . 2]" 1
1263 1 86 ASP H 1 88 SER H 1.800 . 5.000 4.066 3.957 4.299 . 0 0 "[ . 1 . 2]" 1
1264 1 87 SER H 1 87 SER QB 1.800 . 3.830 2.503 2.251 2.691 . 0 0 "[ . 1 . 2]" 1
1265 1 87 SER H 1 88 SER H 1.800 . 3.490 2.471 2.335 2.767 . 0 0 "[ . 1 . 2]" 1
1266 1 88 SER HA 1 89 ARG H 1.800 . 3.620 2.436 2.365 2.519 . 0 0 "[ . 1 . 2]" 1
1267 1 88 SER QB 1 89 ARG H 1.800 . 3.980 2.864 2.347 3.400 . 0 0 "[ . 1 . 2]" 1
1268 1 88 SER H 1 88 SER QB 1.800 . 3.510 2.367 2.269 2.741 . 0 0 "[ . 1 . 2]" 1
1269 1 89 ARG HA 1 89 ARG QD 1.800 . 5.020 3.599 2.198 4.181 . 0 0 "[ . 1 . 2]" 1
1270 1 89 ARG HA 1 90 ILE H 1.800 . 3.410 2.193 2.111 2.238 . 0 0 "[ . 1 . 2]" 1
1271 1 89 ARG HB3 1 89 ARG QD 1.800 . 4.580 2.704 2.250 3.262 . 0 0 "[ . 1 . 2]" 1
1272 1 89 ARG HB3 1 90 ILE H 1.800 . 5.220 3.571 3.005 4.213 . 0 0 "[ . 1 . 2]" 1
1273 1 89 ARG HB2 1 89 ARG QD 1.800 . 4.580 2.595 2.248 3.549 . 0 0 "[ . 1 . 2]" 1
1274 1 89 ARG HB2 1 90 ILE H 1.800 . 5.220 4.177 4.019 4.389 . 0 0 "[ . 1 . 2]" 1
1275 1 89 ARG QB 1 89 ARG HE 1.800 . 5.160 3.007 2.142 4.360 . 0 0 "[ . 1 . 2]" 1
1276 1 89 ARG H 1 89 ARG HB3 1.800 . 4.280 3.260 2.662 3.812 . 0 0 "[ . 1 . 2]" 1
1277 1 89 ARG H 1 89 ARG HB2 1.800 . 4.280 2.847 2.485 3.198 . 0 0 "[ . 1 . 2]" 1
1278 1 89 ARG H 1 89 ARG QG 1.800 . 4.940 3.536 2.760 4.199 . 0 0 "[ . 1 . 2]" 1
1279 1 90 ILE HA 1 90 ILE MD 1.800 . 4.830 3.827 3.818 3.843 . 0 0 "[ . 1 . 2]" 1
1280 1 90 ILE HA 1 90 ILE MG 1.800 . 3.700 2.335 2.303 2.357 . 0 0 "[ . 1 . 2]" 1
1281 1 90 ILE HB 1 90 ILE MD 1.800 . 3.780 2.286 2.249 2.349 . 0 0 "[ . 1 . 2]" 1
1282 1 90 ILE HB 1 91 GLU H 1.800 . 5.970 4.207 4.171 4.238 . 0 0 "[ . 1 . 2]" 1
1283 1 90 ILE QG 1 91 GLU H 1.800 . 5.560 4.101 4.063 4.175 . 0 0 "[ . 1 . 2]" 1
1284 1 90 ILE MG 1 91 GLU HA 1.800 . 4.320 3.647 3.577 3.740 . 0 0 "[ . 1 . 2]" 1
1285 1 90 ILE MG 1 91 GLU H 1.800 . 4.130 2.601 2.536 2.693 . 0 0 "[ . 1 . 2]" 1
1286 1 90 ILE MG 1 92 SER H 1.800 . 6.050 3.927 3.531 4.342 . 0 0 "[ . 1 . 2]" 1
1287 1 90 ILE H 1 90 ILE HB 1.800 . 3.900 2.585 2.535 2.667 . 0 0 "[ . 1 . 2]" 1
1288 1 90 ILE H 1 90 ILE MD 1.800 . 4.980 3.895 3.779 4.000 . 0 0 "[ . 1 . 2]" 1
1289 1 90 ILE H 1 90 ILE QG 1.800 . 4.210 2.803 2.663 2.886 . 0 0 "[ . 1 . 2]" 1
1290 1 90 ILE H 1 90 ILE MG 1.800 . 4.660 3.836 3.815 3.866 . 0 0 "[ . 1 . 2]" 1
1291 1 91 GLU HA 1 92 SER H 1.800 . 3.450 2.159 2.117 2.195 . 0 0 "[ . 1 . 2]" 1
1292 1 91 GLU HB3 1 92 SER H 1.800 . 4.870 3.791 3.103 4.382 . 0 0 "[ . 1 . 2]" 1
1293 1 91 GLU HB2 1 92 SER H 1.800 . 4.870 4.338 4.138 4.478 . 0 0 "[ . 1 . 2]" 1
1294 1 91 GLU HG3 1 92 SER H 1.800 . 5.590 4.215 2.772 5.589 . 0 0 "[ . 1 . 2]" 1
1295 1 91 GLU HG2 1 92 SER H 1.800 . 5.590 4.246 2.891 5.222 . 0 0 "[ . 1 . 2]" 1
1296 1 91 GLU H 1 91 GLU QG 1.800 . 4.800 3.507 2.900 4.191 . 0 0 "[ . 1 . 2]" 1
1297 1 92 SER HA 1 93 VAL MG2 1.800 . 4.710 3.544 3.195 3.730 . 0 0 "[ . 1 . 2]" 1
1298 1 92 SER HA 1 93 VAL H 1.800 . 3.360 2.275 2.196 2.359 . 0 0 "[ . 1 . 2]" 1
1299 1 92 SER HB3 1 93 VAL H 1.800 . 4.890 3.688 2.852 4.244 . 0 0 "[ . 1 . 2]" 1
1300 1 92 SER HB2 1 93 VAL H 1.800 . 4.890 3.569 2.704 4.342 . 0 0 "[ . 1 . 2]" 1
1301 1 92 SER H 1 92 SER QB 1.800 . 3.740 2.358 2.226 2.714 . 0 0 "[ . 1 . 2]" 1
1302 1 92 SER H 1 93 VAL H 1.800 . 6.020 4.643 4.591 4.669 . 0 0 "[ . 1 . 2]" 1
1303 1 93 VAL HA 1 93 VAL MG1 1.800 . 3.620 2.351 2.273 2.414 . 0 0 "[ . 1 . 2]" 1
1304 1 93 VAL HA 1 93 VAL MG2 1.800 . 3.880 2.449 2.234 3.201 . 0 0 "[ . 1 . 2]" 1
1305 1 93 VAL H 1 93 VAL HB 1.800 . 4.290 2.795 2.408 3.896 . 0 0 "[ . 1 . 2]" 1
1306 1 93 VAL H 1 93 VAL MG1 1.800 . 4.790 3.703 2.865 3.990 . 0 0 "[ . 1 . 2]" 1
1307 1 93 VAL H 1 93 VAL MG2 1.800 . 3.630 2.698 1.934 3.007 . 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 90
_Distance_constraint_stats_list.Viol_count 191
_Distance_constraint_stats_list.Viol_total 80.313
_Distance_constraint_stats_list.Viol_max 0.234
_Distance_constraint_stats_list.Viol_rms 0.0121
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0022
_Distance_constraint_stats_list.Viol_average_violations_only 0.0210
_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 4 VAL 0.058 0.021 15 0 "[ . 1 . 2]"
1 5 LYS 0.293 0.116 20 0 "[ . 1 . 2]"
1 6 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 ASP 0.293 0.116 20 0 "[ . 1 . 2]"
1 9 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 SER 0.001 0.000 2 0 "[ . 1 . 2]"
1 13 THR 0.001 0.000 2 0 "[ . 1 . 2]"
1 14 PRO 0.025 0.012 1 0 "[ . 1 . 2]"
1 16 VAL 0.208 0.041 3 0 "[ . 1 . 2]"
1 17 SER 0.058 0.021 15 0 "[ . 1 . 2]"
1 18 VAL 0.047 0.038 15 0 "[ . 1 . 2]"
1 20 GLY 0.145 0.054 20 0 "[ . 1 . 2]"
1 21 LYS 0.141 0.050 3 0 "[ . 1 . 2]"
1 22 ILE 0.169 0.055 2 0 "[ . 1 . 2]"
1 23 THR 0.006 0.004 2 0 "[ . 1 . 2]"
1 26 HIS 0.004 0.004 7 0 "[ . 1 . 2]"
1 28 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 TYR 0.040 0.025 18 0 "[ . 1 . 2]"
1 32 SER 1.348 0.137 6 0 "[ . 1 . 2]"
1 35 THR 1.348 0.137 6 0 "[ . 1 . 2]"
1 37 LYS 0.040 0.025 18 0 "[ . 1 . 2]"
1 38 SER 0.017 0.012 7 0 "[ . 1 . 2]"
1 39 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 TYR 0.003 0.002 14 0 "[ . 1 . 2]"
1 41 GLN 0.004 0.004 7 0 "[ . 1 . 2]"
1 42 GLY 0.119 0.039 3 0 "[ . 1 . 2]"
1 43 TYR 0.006 0.004 2 0 "[ . 1 . 2]"
1 44 ILE 0.078 0.023 16 0 "[ . 1 . 2]"
1 45 GLU 0.141 0.050 3 0 "[ . 1 . 2]"
1 46 ASP 0.227 0.154 14 0 "[ . 1 . 2]"
1 49 ALA 0.227 0.154 14 0 "[ . 1 . 2]"
1 51 ILE 0.078 0.023 16 0 "[ . 1 . 2]"
1 52 ARG 0.003 0.001 7 0 "[ . 1 . 2]"
1 53 ILE 0.119 0.039 3 0 "[ . 1 . 2]"
1 54 SER 0.044 0.031 7 0 "[ . 1 . 2]"
1 55 SER 0.003 0.002 14 0 "[ . 1 . 2]"
1 56 PHE 0.094 0.025 7 0 "[ . 1 . 2]"
1 57 GLY 0.017 0.012 7 0 "[ . 1 . 2]"
1 64 ASP 0.169 0.055 2 0 "[ . 1 . 2]"
1 65 VAL 0.032 0.011 2 0 "[ . 1 . 2]"
1 66 VAL 0.145 0.054 20 0 "[ . 1 . 2]"
1 67 ARG 0.016 0.016 20 0 "[ . 1 . 2]"
1 68 ILE 0.047 0.038 15 0 "[ . 1 . 2]"
1 69 ASP 0.445 0.043 14 0 "[ . 1 . 2]"
1 71 ALA 0.208 0.041 3 0 "[ . 1 . 2]"
1 72 ARG 0.005 0.005 14 0 "[ . 1 . 2]"
1 73 VAL 0.025 0.012 1 0 "[ . 1 . 2]"
1 74 ALA 0.014 0.014 7 0 "[ . 1 . 2]"
1 76 PHE 0.434 0.234 19 0 "[ . 1 . 2]"
1 79 TYR 0.434 0.234 19 0 "[ . 1 . 2]"
1 81 SER 0.014 0.014 7 0 "[ . 1 . 2]"
1 82 LEU 0.003 0.001 7 0 "[ . 1 . 2]"
1 83 SER 0.005 0.005 14 0 "[ . 1 . 2]"
1 84 VAL 0.138 0.031 7 0 "[ . 1 . 2]"
1 89 ARG 0.445 0.043 14 0 "[ . 1 . 2]"
1 91 GLU 0.016 0.016 20 0 "[ . 1 . 2]"
1 93 VAL 0.032 0.011 2 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 4 VAL H 1 17 SER O 1.700 . 2.300 2.256 2.144 2.321 0.021 15 0 "[ . 1 . 2]" 2
2 1 4 VAL N 1 17 SER O 2.700 2.700 3.300 3.210 3.111 3.283 . 0 0 "[ . 1 . 2]" 2
3 1 5 LYS O 1 8 ASP H 1.700 . 2.300 2.292 2.184 2.416 0.116 20 0 "[ . 1 . 2]" 2
4 1 5 LYS O 1 8 ASP N 2.700 2.700 3.300 3.057 2.953 3.132 . 0 0 "[ . 1 . 2]" 2
5 1 6 ILE O 1 9 VAL H 1.700 . 2.300 2.059 1.921 2.266 . 0 0 "[ . 1 . 2]" 2
6 1 6 ILE O 1 9 VAL N 2.700 2.700 3.300 2.980 2.855 3.144 . 0 0 "[ . 1 . 2]" 2
7 1 10 SER O 1 13 THR H 1.700 . 2.300 2.171 2.035 2.300 0.000 2 0 "[ . 1 . 2]" 2
8 1 10 SER O 1 13 THR N 2.700 2.700 3.300 3.094 2.959 3.264 . 0 0 "[ . 1 . 2]" 2
9 1 16 VAL H 1 71 ALA O 1.700 . 2.300 2.225 1.898 2.322 0.022 18 0 "[ . 1 . 2]" 2
10 1 16 VAL N 1 71 ALA O 2.700 2.700 3.300 3.146 2.851 3.253 . 0 0 "[ . 1 . 2]" 2
11 1 18 VAL H 1 68 ILE O 1.700 . 2.300 2.164 1.891 2.338 0.038 15 0 "[ . 1 . 2]" 2
12 1 18 VAL N 1 68 ILE O 2.700 2.700 3.300 3.035 2.822 3.180 . 0 0 "[ . 1 . 2]" 2
13 1 22 ILE H 1 64 ASP O 1.700 . 2.300 2.252 1.896 2.355 0.055 2 0 "[ . 1 . 2]" 2
14 1 22 ILE N 1 64 ASP O 2.700 2.700 3.300 3.200 2.872 3.286 . 0 0 "[ . 1 . 2]" 2
15 1 23 THR H 1 43 TYR O 1.700 . 2.300 1.956 1.729 2.180 . 0 0 "[ . 1 . 2]" 2
16 1 23 THR N 1 43 TYR O 2.700 2.700 3.300 2.909 2.696 3.062 0.004 2 0 "[ . 1 . 2]" 2
17 1 26 HIS H 1 41 GLN O 1.700 . 2.300 1.983 1.804 2.208 . 0 0 "[ . 1 . 2]" 2
18 1 26 HIS N 1 41 GLN O 2.700 2.700 3.300 2.821 2.696 3.077 0.004 7 0 "[ . 1 . 2]" 2
19 1 28 LYS H 1 39 VAL O 1.700 . 2.300 2.131 1.909 2.282 . 0 0 "[ . 1 . 2]" 2
20 1 28 LYS N 1 39 VAL O 2.700 2.700 3.300 3.023 2.864 3.198 . 0 0 "[ . 1 . 2]" 2
21 1 30 TYR H 1 37 LYS O 1.700 . 2.300 2.245 2.106 2.325 0.025 18 0 "[ . 1 . 2]" 2
22 1 30 TYR N 1 37 LYS O 2.700 2.700 3.300 3.193 3.050 3.273 . 0 0 "[ . 1 . 2]" 2
23 1 32 SER H 1 35 THR O 1.700 . 2.300 1.841 1.725 2.026 . 0 0 "[ . 1 . 2]" 2
24 1 32 SER N 1 35 THR O 2.700 2.700 3.300 2.689 2.590 2.752 0.110 10 0 "[ . 1 . 2]" 2
25 1 32 SER O 1 35 THR H 1.700 . 2.300 2.043 1.756 2.437 0.137 6 0 "[ . 1 . 2]" 2
26 1 32 SER O 1 35 THR N 2.700 2.700 3.300 2.940 2.689 3.364 0.064 6 0 "[ . 1 . 2]" 2
27 1 30 TYR O 1 37 LYS H 1.700 . 2.300 2.103 1.931 2.229 . 0 0 "[ . 1 . 2]" 2
28 1 30 TYR O 1 37 LYS N 2.700 2.700 3.300 3.052 2.888 3.158 . 0 0 "[ . 1 . 2]" 2
29 1 28 LYS O 1 39 VAL H 1.700 . 2.300 1.866 1.758 1.952 . 0 0 "[ . 1 . 2]" 2
30 1 28 LYS O 1 39 VAL N 2.700 2.700 3.300 2.805 2.705 2.899 . 0 0 "[ . 1 . 2]" 2
31 1 40 TYR H 1 55 SER O 1.700 . 2.300 1.893 1.783 2.051 . 0 0 "[ . 1 . 2]" 2
32 1 40 TYR N 1 55 SER O 2.700 2.700 3.300 2.836 2.723 2.983 . 0 0 "[ . 1 . 2]" 2
33 1 26 HIS O 1 41 GLN H 1.700 . 2.300 1.983 1.729 2.167 . 0 0 "[ . 1 . 2]" 2
34 1 26 HIS O 1 41 GLN N 2.700 2.700 3.300 2.940 2.706 3.096 . 0 0 "[ . 1 . 2]" 2
35 1 42 GLY H 1 53 ILE O 1.700 . 2.300 2.287 2.202 2.339 0.039 3 0 "[ . 1 . 2]" 2
36 1 42 GLY N 1 53 ILE O 2.700 2.700 3.300 3.204 3.136 3.255 . 0 0 "[ . 1 . 2]" 2
37 1 23 THR O 1 43 TYR H 1.700 . 2.300 2.092 1.861 2.302 0.002 18 0 "[ . 1 . 2]" 2
38 1 23 THR O 1 43 TYR N 2.700 2.700 3.300 3.054 2.819 3.280 . 0 0 "[ . 1 . 2]" 2
39 1 44 ILE H 1 51 ILE O 1.700 . 2.300 2.190 1.892 2.300 . 18 0 "[ . 1 . 2]" 2
40 1 44 ILE N 1 51 ILE O 2.700 2.700 3.300 3.151 2.854 3.275 . 0 0 "[ . 1 . 2]" 2
41 1 21 LYS O 1 45 GLU H 1.700 . 2.300 2.267 2.122 2.350 0.050 3 0 "[ . 1 . 2]" 2
42 1 21 LYS O 1 45 GLU N 2.700 2.700 3.300 3.193 3.065 3.276 . 0 0 "[ . 1 . 2]" 2
43 1 46 ASP H 1 49 ALA O 1.700 . 2.300 2.237 1.999 2.454 0.154 14 0 "[ . 1 . 2]" 2
44 1 46 ASP N 1 49 ALA O 2.700 2.700 3.300 3.123 2.924 3.331 0.031 14 0 "[ . 1 . 2]" 2
45 1 44 ILE O 1 51 ILE H 1.700 . 2.300 2.254 2.123 2.323 0.023 16 0 "[ . 1 . 2]" 2
46 1 44 ILE O 1 51 ILE N 2.700 2.700 3.300 3.142 3.029 3.212 . 0 0 "[ . 1 . 2]" 2
47 1 42 GLY O 1 53 ILE H 1.700 . 2.300 2.125 1.856 2.299 . 0 0 "[ . 1 . 2]" 2
48 1 42 GLY O 1 53 ILE N 2.700 2.700 3.300 3.061 2.807 3.247 . 0 0 "[ . 1 . 2]" 2
49 1 54 SER H 1 82 LEU O 1.700 . 2.300 1.970 1.843 2.292 . 0 0 "[ . 1 . 2]" 2
50 1 54 SER N 1 82 LEU O 2.700 2.700 3.300 2.880 2.705 3.242 . 0 0 "[ . 1 . 2]" 2
51 1 40 TYR O 1 55 SER H 1.700 . 2.300 1.806 1.731 1.913 . 0 0 "[ . 1 . 2]" 2
52 1 40 TYR O 1 55 SER N 2.700 2.700 3.300 2.761 2.698 2.843 0.002 14 0 "[ . 1 . 2]" 2
53 1 56 PHE H 1 84 VAL O 1.700 . 2.300 2.286 2.152 2.325 0.025 7 0 "[ . 1 . 2]" 2
54 1 56 PHE N 1 84 VAL O 2.700 2.700 3.300 3.253 3.099 3.291 . 0 0 "[ . 1 . 2]" 2
55 1 38 SER O 1 57 GLY H 1.700 . 2.300 2.259 2.095 2.312 0.012 7 0 "[ . 1 . 2]" 2
56 1 38 SER O 1 57 GLY N 2.700 2.700 3.300 3.188 3.002 3.265 . 0 0 "[ . 1 . 2]" 2
57 1 20 GLY O 1 66 VAL H 1.700 . 2.300 2.220 2.025 2.354 0.054 20 0 "[ . 1 . 2]" 2
58 1 20 GLY O 1 66 VAL N 2.700 2.700 3.300 3.132 2.923 3.289 . 0 0 "[ . 1 . 2]" 2
59 1 67 ARG H 1 91 GLU O 1.700 . 2.300 1.966 1.762 2.176 . 0 0 "[ . 1 . 2]" 2
60 1 67 ARG N 1 91 GLU O 2.700 2.700 3.300 2.890 2.724 3.019 . 0 0 "[ . 1 . 2]" 2
61 1 18 VAL O 1 68 ILE H 1.700 . 2.300 2.013 1.873 2.300 0.000 20 0 "[ . 1 . 2]" 2
62 1 18 VAL O 1 68 ILE N 2.700 2.700 3.300 2.948 2.830 3.248 . 0 0 "[ . 1 . 2]" 2
63 1 69 ASP H 1 89 ARG O 1.700 . 2.300 2.028 1.865 2.294 . 0 0 "[ . 1 . 2]" 2
64 1 69 ASP N 1 89 ARG O 2.700 2.700 3.300 2.990 2.838 3.245 . 0 0 "[ . 1 . 2]" 2
65 1 16 VAL O 1 71 ALA H 1.700 . 2.300 1.999 1.772 2.319 0.019 10 0 "[ . 1 . 2]" 2
66 1 16 VAL O 1 71 ALA N 2.700 2.700 3.300 2.847 2.659 3.139 0.041 3 0 "[ . 1 . 2]" 2
67 1 72 ARG H 1 83 SER O 1.700 . 2.300 2.161 2.007 2.299 . 0 0 "[ . 1 . 2]" 2
68 1 72 ARG N 1 83 SER O 2.700 2.700 3.300 3.077 2.940 3.232 . 0 0 "[ . 1 . 2]" 2
69 1 14 PRO O 1 73 VAL H 1.700 . 2.300 2.204 1.775 2.312 0.012 1 0 "[ . 1 . 2]" 2
70 1 14 PRO O 1 73 VAL N 2.700 2.700 3.300 3.134 2.714 3.249 . 0 0 "[ . 1 . 2]" 2
71 1 74 ALA H 1 81 SER O 1.700 . 2.300 2.026 1.882 2.284 . 0 0 "[ . 1 . 2]" 2
72 1 74 ALA N 1 81 SER O 2.700 2.700 3.300 2.987 2.856 3.262 . 0 0 "[ . 1 . 2]" 2
73 1 76 PHE H 1 79 TYR O 1.700 . 2.300 1.868 1.721 2.083 . 0 0 "[ . 1 . 2]" 2
74 1 76 PHE N 1 79 TYR O 2.700 2.700 3.300 2.786 2.659 2.961 0.041 7 0 "[ . 1 . 2]" 2
75 1 76 PHE O 1 79 TYR H 1.700 . 2.300 1.908 1.755 2.534 0.234 19 0 "[ . 1 . 2]" 2
76 1 76 PHE O 1 79 TYR N 2.700 2.700 3.300 2.810 2.688 3.409 0.109 19 0 "[ . 1 . 2]" 2
77 1 74 ALA O 1 81 SER H 1.700 . 2.300 2.039 1.918 2.314 0.014 7 0 "[ . 1 . 2]" 2
78 1 74 ALA O 1 81 SER N 2.700 2.700 3.300 2.910 2.734 3.265 . 0 0 "[ . 1 . 2]" 2
79 1 52 ARG O 1 82 LEU H 1.700 . 2.300 2.211 1.995 2.301 0.001 7 0 "[ . 1 . 2]" 2
80 1 52 ARG O 1 82 LEU N 2.700 2.700 3.300 3.131 2.935 3.220 . 0 0 "[ . 1 . 2]" 2
81 1 72 ARG O 1 83 SER H 1.700 . 2.300 1.782 1.727 2.182 . 0 0 "[ . 1 . 2]" 2
82 1 72 ARG O 1 83 SER N 2.700 2.700 3.300 2.746 2.695 2.993 0.005 14 0 "[ . 1 . 2]" 2
83 1 54 SER O 1 84 VAL H 1.700 . 2.300 1.846 1.704 1.973 . 0 0 "[ . 1 . 2]" 2
84 1 54 SER O 1 84 VAL N 2.700 2.700 3.300 2.804 2.669 2.935 0.031 7 0 "[ . 1 . 2]" 2
85 1 69 ASP O 1 89 ARG H 1.700 . 2.300 2.317 2.269 2.343 0.043 14 0 "[ . 1 . 2]" 2
86 1 69 ASP O 1 89 ARG N 2.700 2.700 3.300 3.287 3.208 3.317 0.017 1 0 "[ . 1 . 2]" 2
87 1 67 ARG O 1 91 GLU H 1.700 . 2.300 2.056 1.856 2.316 0.016 20 0 "[ . 1 . 2]" 2
88 1 67 ARG O 1 91 GLU N 2.700 2.700 3.300 3.012 2.830 3.250 . 0 0 "[ . 1 . 2]" 2
89 1 65 VAL O 1 93 VAL H 1.700 . 2.300 2.248 2.155 2.311 0.011 2 0 "[ . 1 . 2]" 2
90 1 65 VAL O 1 93 VAL N 2.700 2.700 3.300 3.154 2.992 3.281 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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