NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
438398 |
2k4n   |
15805 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2k4n
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 1080
_Distance_constraint_stats_list.Viol_count 350
_Distance_constraint_stats_list.Viol_total 124.163
_Distance_constraint_stats_list.Viol_max 0.083
_Distance_constraint_stats_list.Viol_rms 0.0029
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0003
_Distance_constraint_stats_list.Viol_average_violations_only 0.0177
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 MET 0.671 0.065 3 0 "[ . 1 . 2]"
1 2 ASN 0.371 0.080 14 0 "[ . 1 . 2]"
1 3 SER 0.059 0.023 15 0 "[ . 1 . 2]"
1 4 GLU 0.218 0.033 14 0 "[ . 1 . 2]"
1 5 VAL 0.381 0.053 18 0 "[ . 1 . 2]"
1 6 ILE 0.254 0.065 3 0 "[ . 1 . 2]"
1 7 LYS 0.169 0.033 14 0 "[ . 1 . 2]"
1 8 GLU 0.083 0.029 9 0 "[ . 1 . 2]"
1 9 PHE 0.134 0.049 7 0 "[ . 1 . 2]"
1 10 LEU 0.144 0.024 7 0 "[ . 1 . 2]"
1 11 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 ILE 0.208 0.049 7 0 "[ . 1 . 2]"
1 14 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 GLU 0.006 0.006 13 0 "[ . 1 . 2]"
1 16 ASP 0.105 0.044 17 0 "[ . 1 . 2]"
1 17 TYR 0.209 0.046 10 0 "[ . 1 . 2]"
1 18 ILE 0.346 0.061 5 0 "[ . 1 . 2]"
1 19 GLU 0.240 0.032 9 0 "[ . 1 . 2]"
1 20 LEU 0.397 0.083 19 0 "[ . 1 . 2]"
1 21 GLU 0.167 0.083 19 0 "[ . 1 . 2]"
1 22 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 GLU 0.292 0.035 14 0 "[ . 1 . 2]"
1 24 ILE 0.103 0.034 5 0 "[ . 1 . 2]"
1 25 HIS 0.199 0.061 5 0 "[ . 1 . 2]"
1 26 LEU 0.152 0.046 10 0 "[ . 1 . 2]"
1 27 LYS 0.054 0.021 9 0 "[ . 1 . 2]"
1 28 PRO 0.191 0.030 1 0 "[ . 1 . 2]"
1 29 GLU 0.010 0.005 19 0 "[ . 1 . 2]"
1 30 VAL 0.237 0.044 17 0 "[ . 1 . 2]"
1 31 PHE 0.043 0.035 19 0 "[ . 1 . 2]"
1 32 TYR 0.067 0.021 16 0 "[ . 1 . 2]"
1 33 GLU 0.004 0.004 14 0 "[ . 1 . 2]"
1 34 VAL 0.193 0.036 16 0 "[ . 1 . 2]"
1 35 TRP 0.398 0.055 17 0 "[ . 1 . 2]"
1 36 LYS 0.127 0.032 13 0 "[ . 1 . 2]"
1 37 TYR 0.097 0.038 1 0 "[ . 1 . 2]"
1 38 VAL 0.178 0.043 13 0 "[ . 1 . 2]"
1 39 GLY 0.018 0.018 17 0 "[ . 1 . 2]"
1 40 GLU 0.146 0.055 17 0 "[ . 1 . 2]"
1 41 PRO 0.113 0.043 13 0 "[ . 1 . 2]"
1 42 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 LEU 0.224 0.038 9 0 "[ . 1 . 2]"
1 44 LYS 0.023 0.014 4 0 "[ . 1 . 2]"
1 45 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 TYR 0.096 0.027 15 0 "[ . 1 . 2]"
1 47 VAL 0.024 0.014 1 0 "[ . 1 . 2]"
1 48 ILE 0.075 0.021 16 0 "[ . 1 . 2]"
1 49 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 GLY 0.052 0.036 2 0 "[ . 1 . 2]"
1 57 GLU 0.052 0.036 2 0 "[ . 1 . 2]"
1 58 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 LYS 0.011 0.011 14 0 "[ . 1 . 2]"
1 73 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 LYS 0.033 0.020 3 0 "[ . 1 . 2]"
1 75 LYS 0.284 0.041 18 0 "[ . 1 . 2]"
1 76 VAL 0.200 0.038 9 0 "[ . 1 . 2]"
1 77 TYR 0.122 0.027 15 0 "[ . 1 . 2]"
1 78 PHE 0.283 0.040 6 0 "[ . 1 . 2]"
1 79 GLU 0.211 0.039 5 0 "[ . 1 . 2]"
1 80 THR 0.038 0.023 14 0 "[ . 1 . 2]"
1 81 LEU 0.298 0.080 14 0 "[ . 1 . 2]"
1 82 ASP 0.062 0.028 7 0 "[ . 1 . 2]"
1 83 ASN 0.148 0.046 5 0 "[ . 1 . 2]"
1 84 VAL 0.105 0.028 7 0 "[ . 1 . 2]"
1 85 ARG 0.164 0.039 5 0 "[ . 1 . 2]"
1 86 VAL 0.026 0.021 19 0 "[ . 1 . 2]"
1 87 VAL 0.082 0.018 13 0 "[ . 1 . 2]"
1 88 THR 0.371 0.041 18 0 "[ . 1 . 2]"
1 89 ASP 0.052 0.019 6 0 "[ . 1 . 2]"
1 90 TYR 0.764 0.071 15 0 "[ . 1 . 2]"
1 91 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 GLU 0.101 0.016 18 0 "[ . 1 . 2]"
1 93 PHE 0.023 0.014 5 0 "[ . 1 . 2]"
1 94 GLN 0.565 0.071 15 0 "[ . 1 . 2]"
1 95 LYS 0.066 0.066 6 0 "[ . 1 . 2]"
1 96 ILE 0.244 0.042 12 0 "[ . 1 . 2]"
1 97 LEU 0.195 0.041 10 0 "[ . 1 . 2]"
1 98 LYS 0.271 0.066 6 0 "[ . 1 . 2]"
1 99 LYS 0.194 0.042 12 0 "[ . 1 . 2]"
1 100 ARG 0.018 0.018 4 0 "[ . 1 . 2]"
1 101 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 103 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 104 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 3 SER H 1 4 GLU H 1.800 . 5.000 2.605 2.410 2.720 . 0 0 "[ . 1 . 2]" 1
2 1 4 GLU H 1 5 VAL H 1.800 . 3.500 2.725 2.598 2.930 . 0 0 "[ . 1 . 2]" 1
3 1 5 VAL H 1 6 ILE H 1.800 . 3.500 2.641 2.535 2.780 . 0 0 "[ . 1 . 2]" 1
4 1 6 ILE H 1 7 LYS H 1.800 . 3.500 2.682 2.584 2.869 . 0 0 "[ . 1 . 2]" 1
5 1 8 GLU H 1 9 PHE H 1.800 . 5.000 2.726 2.574 2.907 . 0 0 "[ . 1 . 2]" 1
6 1 9 PHE H 1 10 LEU H 1.800 . 5.000 2.694 2.597 2.786 . 0 0 "[ . 1 . 2]" 1
7 1 12 ASP H 1 13 ILE H 1.800 . 5.000 2.695 2.430 2.831 . 0 0 "[ . 1 . 2]" 1
8 1 13 ILE H 1 14 GLY H 1.800 . 2.900 2.488 2.362 2.642 . 0 0 "[ . 1 . 2]" 1
9 1 14 GLY H 1 15 GLU H 1.800 . 3.500 2.425 1.973 2.761 . 0 0 "[ . 1 . 2]" 1
10 1 15 GLU H 1 16 ASP H 1.800 . 5.000 4.473 4.288 4.576 . 0 0 "[ . 1 . 2]" 1
11 1 16 ASP H 1 17 TYR H 1.800 . 5.000 4.432 4.187 4.572 . 0 0 "[ . 1 . 2]" 1
12 1 17 TYR H 1 18 ILE H 1.800 . 5.000 4.384 4.101 4.542 . 0 0 "[ . 1 . 2]" 1
13 1 18 ILE H 1 19 GLU H 1.800 . 5.000 4.139 3.957 4.283 . 0 0 "[ . 1 . 2]" 1
14 1 22 ASN H 1 23 GLU H 1.800 . 3.500 2.611 2.480 2.812 . 0 0 "[ . 1 . 2]" 1
15 1 29 GLU H 1 30 VAL H 1.800 . 3.500 2.654 2.488 2.931 . 0 0 "[ . 1 . 2]" 1
16 1 30 VAL H 1 31 PHE H 1.800 . 3.500 2.488 2.160 2.703 . 0 0 "[ . 1 . 2]" 1
17 1 31 PHE H 1 32 TYR H 1.800 . 3.500 2.727 2.625 2.877 . 0 0 "[ . 1 . 2]" 1
18 1 32 TYR H 1 33 GLU H 1.800 . 3.500 2.763 2.664 2.844 . 0 0 "[ . 1 . 2]" 1
19 1 33 GLU H 1 34 VAL H 1.800 . 3.500 2.499 2.266 2.775 . 0 0 "[ . 1 . 2]" 1
20 1 34 VAL H 1 35 TRP H 1.800 . 3.500 2.580 2.229 2.650 . 0 0 "[ . 1 . 2]" 1
21 1 35 TRP H 1 36 LYS H 1.800 . 3.500 2.837 2.742 3.002 . 0 0 "[ . 1 . 2]" 1
22 1 36 LYS H 1 37 TYR H 1.800 . 3.500 2.509 2.428 2.669 . 0 0 "[ . 1 . 2]" 1
23 1 38 VAL H 1 39 GLY H 1.800 . 3.500 2.581 2.309 2.855 . 0 0 "[ . 1 . 2]" 1
24 1 39 GLY H 1 40 GLU H 1.800 . 3.500 2.322 2.115 3.518 0.018 17 0 "[ . 1 . 2]" 1
25 1 52 ILE H 1 53 VAL H 1.800 . 5.000 4.009 2.671 4.590 . 0 0 "[ . 1 . 2]" 1
26 1 56 GLY H 1 57 GLU H 1.800 . 5.000 2.204 1.764 2.711 0.036 2 0 "[ . 1 . 2]" 1
27 1 57 GLU H 1 58 TYR H 1.800 . 5.000 3.210 2.351 4.533 . 0 0 "[ . 1 . 2]" 1
28 1 66 THR H 1 67 ASN H 1.800 . 5.000 4.136 2.335 4.642 . 0 0 "[ . 1 . 2]" 1
29 1 80 THR H 1 81 LEU H 1.800 . 5.000 4.508 4.372 4.583 . 0 0 "[ . 1 . 2]" 1
30 1 81 LEU H 1 82 ASP H 1.800 . 3.500 2.550 2.458 2.756 . 0 0 "[ . 1 . 2]" 1
31 1 82 ASP H 1 83 ASN H 1.800 . 3.500 2.478 1.951 2.712 . 0 0 "[ . 1 . 2]" 1
32 1 83 ASN H 1 84 VAL H 1.800 . 3.500 2.558 2.398 2.721 . 0 0 "[ . 1 . 2]" 1
33 1 88 THR H 1 89 ASP H 1.800 . 5.000 4.354 4.310 4.391 . 0 0 "[ . 1 . 2]" 1
34 1 89 ASP H 1 90 TYR H 1.800 . 5.000 4.500 4.385 4.592 . 0 0 "[ . 1 . 2]" 1
35 1 90 TYR H 1 91 SER H 1.800 . 5.000 2.504 2.392 2.629 . 0 0 "[ . 1 . 2]" 1
36 1 91 SER H 1 92 GLU H 1.800 . 5.000 2.706 2.503 2.936 . 0 0 "[ . 1 . 2]" 1
37 1 92 GLU H 1 93 PHE H 1.800 . 3.500 2.550 2.349 2.655 . 0 0 "[ . 1 . 2]" 1
38 1 93 PHE H 1 94 GLN H 1.800 . 3.500 2.731 2.628 2.858 . 0 0 "[ . 1 . 2]" 1
39 1 94 GLN H 1 95 LYS H 1.800 . 3.500 2.614 2.433 2.725 . 0 0 "[ . 1 . 2]" 1
40 1 95 LYS H 1 96 ILE H 1.800 . 3.500 2.710 2.528 2.812 . 0 0 "[ . 1 . 2]" 1
41 1 96 ILE H 1 97 LEU H 1.800 . 3.500 2.590 2.451 2.830 . 0 0 "[ . 1 . 2]" 1
42 1 97 LEU H 1 98 LYS H 1.800 . 3.500 2.700 2.555 2.801 . 0 0 "[ . 1 . 2]" 1
43 1 98 LYS H 1 99 LYS H 1.800 . 2.900 2.527 2.351 2.618 . 0 0 "[ . 1 . 2]" 1
44 1 99 LYS H 1 100 ARG H 1.800 . 5.000 2.728 2.551 2.943 . 0 0 "[ . 1 . 2]" 1
45 1 100 ARG H 1 101 GLY H 1.800 . 3.500 2.426 2.158 2.591 . 0 0 "[ . 1 . 2]" 1
46 1 101 GLY H 1 102 THR H 1.800 . 3.500 2.407 1.846 3.208 . 0 0 "[ . 1 . 2]" 1
47 1 13 ILE H 1 15 GLU H 1.800 . 5.500 4.181 3.823 4.866 . 0 0 "[ . 1 . 2]" 1
48 1 37 TYR H 1 39 GLY H 1.800 . 5.500 3.955 3.494 4.182 . 0 0 "[ . 1 . 2]" 1
49 1 82 ASP H 1 84 VAL H 1.800 . 5.000 3.398 3.102 3.718 . 0 0 "[ . 1 . 2]" 1
50 1 15 GLU HA 1 16 ASP H 1.800 . 3.500 2.334 2.123 2.607 . 0 0 "[ . 1 . 2]" 1
51 1 17 TYR HA 1 18 ILE H 1.800 . 3.500 2.218 2.105 2.446 . 0 0 "[ . 1 . 2]" 1
52 1 18 ILE HA 1 19 GLU H 1.800 . 2.900 2.186 2.101 2.213 . 0 0 "[ . 1 . 2]" 1
53 1 19 GLU HA 1 20 LEU H 1.800 . 2.900 2.111 2.077 2.169 . 0 0 "[ . 1 . 2]" 1
54 1 20 LEU HA 1 21 GLU H 1.800 . 2.900 2.629 2.144 2.856 . 0 0 "[ . 1 . 2]" 1
55 1 21 GLU HA 1 22 ASN H 1.800 . 2.900 2.200 2.073 2.833 . 0 0 "[ . 1 . 2]" 1
56 1 22 ASN HA 1 23 GLU H 1.800 . 3.500 3.098 2.880 3.353 . 0 0 "[ . 1 . 2]" 1
57 1 23 GLU HA 1 24 ILE H 1.800 . 3.500 2.153 2.123 2.210 . 0 0 "[ . 1 . 2]" 1
58 1 24 ILE HA 1 25 HIS H 1.800 . 2.900 2.163 2.136 2.184 . 0 0 "[ . 1 . 2]" 1
59 1 25 HIS HA 1 26 LEU H 1.800 . 3.500 2.128 2.098 2.162 . 0 0 "[ . 1 . 2]" 1
60 1 26 LEU HA 1 27 LYS H 1.800 . 3.500 2.415 2.248 2.608 . 0 0 "[ . 1 . 2]" 1
61 1 41 PRO HA 1 42 GLU H 1.800 . 2.900 2.505 2.156 2.780 . 0 0 "[ . 1 . 2]" 1
62 1 43 LEU HA 1 44 LYS H 1.800 . 2.900 2.199 2.113 2.433 . 0 0 "[ . 1 . 2]" 1
63 1 45 THR HA 1 46 TYR H 1.800 . 3.500 2.221 2.148 2.331 . 0 0 "[ . 1 . 2]" 1
64 1 46 TYR HA 1 47 VAL H 1.800 . 3.500 2.247 2.151 2.402 . 0 0 "[ . 1 . 2]" 1
65 1 47 VAL HA 1 48 ILE H 1.800 . 3.500 2.139 2.121 2.168 . 0 0 "[ . 1 . 2]" 1
66 1 48 ILE HA 1 49 GLU H 1.800 . 3.500 2.148 2.093 2.306 . 0 0 "[ . 1 . 2]" 1
67 1 72 LYS HA 1 73 ILE H 1.800 . 3.500 2.180 2.129 2.239 . 0 0 "[ . 1 . 2]" 1
68 1 75 LYS HA 1 76 VAL H 1.800 . 3.500 2.445 2.281 2.517 . 0 0 "[ . 1 . 2]" 1
69 1 76 VAL HA 1 77 TYR H 1.800 . 3.500 2.250 2.211 2.301 . 0 0 "[ . 1 . 2]" 1
70 1 77 TYR HA 1 78 PHE H 1.800 . 3.500 2.351 2.264 2.466 . 0 0 "[ . 1 . 2]" 1
71 1 78 PHE HA 1 79 GLU H 1.800 . 2.900 2.305 2.153 2.420 . 0 0 "[ . 1 . 2]" 1
72 1 79 GLU HA 1 80 THR H 1.800 . 2.900 2.167 2.109 2.252 . 0 0 "[ . 1 . 2]" 1
73 1 82 ASP HA 1 83 ASN H 1.800 . 3.500 3.188 3.021 3.352 . 0 0 "[ . 1 . 2]" 1
74 1 83 ASN HA 1 84 VAL H 1.800 . 3.500 3.032 2.914 3.227 . 0 0 "[ . 1 . 2]" 1
75 1 84 VAL HA 1 85 ARG H 1.800 . 3.500 2.161 2.102 2.218 . 0 0 "[ . 1 . 2]" 1
76 1 85 ARG HA 1 86 VAL H 1.800 . 2.900 2.142 2.101 2.193 . 0 0 "[ . 1 . 2]" 1
77 1 86 VAL HA 1 87 VAL H 1.800 . 2.900 2.148 2.134 2.195 . 0 0 "[ . 1 . 2]" 1
78 1 87 VAL HA 1 88 THR H 1.800 . 2.900 2.191 2.151 2.253 . 0 0 "[ . 1 . 2]" 1
79 1 88 THR HA 1 89 ASP H 1.800 . 2.900 2.425 2.258 2.707 . 0 0 "[ . 1 . 2]" 1
80 1 89 ASP HA 1 90 TYR H 1.800 . 3.500 2.124 2.060 2.175 . 0 0 "[ . 1 . 2]" 1
81 1 98 LYS HA 1 99 LYS H 1.800 . 3.500 3.495 3.408 3.528 0.028 8 0 "[ . 1 . 2]" 1
82 1 3 SER HA 1 5 VAL H 1.800 . 5.000 4.211 3.907 4.714 . 0 0 "[ . 1 . 2]" 1
83 1 21 GLU HA 1 23 GLU H 1.800 . 5.000 3.786 3.489 4.428 . 0 0 "[ . 1 . 2]" 1
84 1 81 LEU HA 1 83 ASN H 1.800 . 5.000 3.491 3.371 3.703 . 0 0 "[ . 1 . 2]" 1
85 1 95 LYS HA 1 97 LEU H 1.800 . 5.000 4.460 4.333 4.678 . 0 0 "[ . 1 . 2]" 1
86 1 97 LEU HA 1 99 LYS H 1.800 . 5.000 4.306 3.959 4.527 . 0 0 "[ . 1 . 2]" 1
87 1 98 LYS HA 1 100 ARG H 1.800 . 5.000 4.491 4.155 4.757 . 0 0 "[ . 1 . 2]" 1
88 1 3 SER HA 1 6 ILE H 1.800 . 5.000 3.288 3.022 3.688 . 0 0 "[ . 1 . 2]" 1
89 1 4 GLU HA 1 7 LYS H 1.800 . 5.000 3.421 3.187 3.672 . 0 0 "[ . 1 . 2]" 1
90 1 5 VAL HA 1 8 GLU H 1.800 . 5.000 3.453 3.199 3.650 . 0 0 "[ . 1 . 2]" 1
91 1 6 ILE HA 1 9 PHE H 1.800 . 5.000 3.445 3.320 3.560 . 0 0 "[ . 1 . 2]" 1
92 1 7 LYS HA 1 10 LEU H 1.800 . 5.000 3.537 3.271 3.741 . 0 0 "[ . 1 . 2]" 1
93 1 8 GLU HA 1 11 GLU H 1.800 . 5.000 3.552 3.062 3.898 . 0 0 "[ . 1 . 2]" 1
94 1 9 PHE HA 1 12 ASP H 1.800 . 5.000 3.517 3.185 3.649 . 0 0 "[ . 1 . 2]" 1
95 1 10 LEU HA 1 13 ILE H 1.800 . 5.000 3.531 3.255 3.716 . 0 0 "[ . 1 . 2]" 1
96 1 11 GLU HA 1 14 GLY H 1.800 . 5.000 3.371 2.955 3.832 . 0 0 "[ . 1 . 2]" 1
97 1 28 PRO HA 1 31 PHE H 1.800 . 5.000 3.724 3.370 4.084 . 0 0 "[ . 1 . 2]" 1
98 1 29 GLU HA 1 32 TYR H 1.800 . 5.000 3.727 3.295 4.275 . 0 0 "[ . 1 . 2]" 1
99 1 30 VAL HA 1 33 GLU H 1.800 . 5.000 3.477 3.349 3.654 . 0 0 "[ . 1 . 2]" 1
100 1 31 PHE HA 1 34 VAL H 1.800 . 5.000 3.380 3.157 3.646 . 0 0 "[ . 1 . 2]" 1
101 1 32 TYR HA 1 35 TRP H 1.800 . 5.000 3.719 3.440 4.158 . 0 0 "[ . 1 . 2]" 1
102 1 33 GLU HA 1 36 LYS H 1.800 . 5.000 3.491 3.167 3.844 . 0 0 "[ . 1 . 2]" 1
103 1 34 VAL HA 1 37 TYR H 1.800 . 5.000 3.202 3.031 3.379 . 0 0 "[ . 1 . 2]" 1
104 1 36 LYS HA 1 39 GLY H 1.800 . 5.000 3.549 3.080 4.225 . 0 0 "[ . 1 . 2]" 1
105 1 90 TYR HA 1 93 PHE H 1.800 . 5.000 3.352 2.964 3.831 . 0 0 "[ . 1 . 2]" 1
106 1 91 SER HA 1 94 GLN H 1.800 . 5.000 3.750 3.372 4.043 . 0 0 "[ . 1 . 2]" 1
107 1 92 GLU HA 1 95 LYS H 1.800 . 5.000 3.235 2.981 3.478 . 0 0 "[ . 1 . 2]" 1
108 1 93 PHE HA 1 96 ILE H 1.800 . 5.000 3.438 3.260 3.600 . 0 0 "[ . 1 . 2]" 1
109 1 94 GLN HA 1 97 LEU H 1.800 . 5.000 3.161 2.727 3.552 . 0 0 "[ . 1 . 2]" 1
110 1 95 LYS HA 1 98 LYS H 1.800 . 5.000 3.546 3.109 3.826 . 0 0 "[ . 1 . 2]" 1
111 1 96 ILE HA 1 99 LYS H 1.800 . 5.000 3.157 2.828 3.670 . 0 0 "[ . 1 . 2]" 1
112 1 97 LEU HA 1 100 ARG H 1.800 . 5.000 3.640 3.074 3.991 . 0 0 "[ . 1 . 2]" 1
113 1 3 SER HA 1 7 LYS H 1.800 . 5.000 4.246 3.999 4.510 . 0 0 "[ . 1 . 2]" 1
114 1 5 VAL HA 1 9 PHE H 1.800 . 5.000 4.193 3.886 4.440 . 0 0 "[ . 1 . 2]" 1
115 1 6 ILE HA 1 10 LEU H 1.800 . 5.000 4.065 3.849 4.407 . 0 0 "[ . 1 . 2]" 1
116 1 7 LYS HA 1 11 GLU H 1.800 . 5.000 4.022 3.629 4.392 . 0 0 "[ . 1 . 2]" 1
117 1 8 GLU HA 1 12 ASP H 1.800 . 5.000 4.098 3.782 4.408 . 0 0 "[ . 1 . 2]" 1
118 1 10 LEU HA 1 14 GLY H 1.800 . 5.000 4.159 3.552 4.513 . 0 0 "[ . 1 . 2]" 1
119 1 11 GLU HA 1 15 GLU H 1.800 . 5.000 3.703 3.058 4.998 . 0 0 "[ . 1 . 2]" 1
120 1 19 GLU HA 1 23 GLU H 1.800 . 5.000 4.626 3.783 5.032 0.032 9 0 "[ . 1 . 2]" 1
121 1 30 VAL HA 1 34 VAL H 1.800 . 5.000 4.328 3.902 4.723 . 0 0 "[ . 1 . 2]" 1
122 1 31 PHE HA 1 35 TRP H 1.800 . 5.000 3.831 3.586 4.085 . 0 0 "[ . 1 . 2]" 1
123 1 34 VAL HA 1 38 VAL H 1.800 . 5.000 4.151 3.960 4.383 . 0 0 "[ . 1 . 2]" 1
124 1 90 TYR HA 1 94 GLN H 1.800 . 5.000 3.724 3.537 3.873 . 0 0 "[ . 1 . 2]" 1
125 1 92 GLU HA 1 96 ILE H 1.800 . 5.000 4.242 3.930 4.517 . 0 0 "[ . 1 . 2]" 1
126 1 93 PHE HA 1 97 LEU H 1.800 . 5.000 4.372 4.097 4.677 . 0 0 "[ . 1 . 2]" 1
127 1 94 GLN HA 1 98 LYS H 1.800 . 5.000 4.035 3.585 4.448 . 0 0 "[ . 1 . 2]" 1
128 1 95 LYS HA 1 99 LYS H 1.800 . 5.000 4.210 3.907 4.595 . 0 0 "[ . 1 . 2]" 1
129 1 96 ILE HA 1 100 ARG H 1.800 . 5.000 4.013 3.636 4.468 . 0 0 "[ . 1 . 2]" 1
130 1 97 LEU HA 1 101 GLY H 1.800 . 5.000 4.149 3.823 4.530 . 0 0 "[ . 1 . 2]" 1
131 1 5 VAL HB 1 6 ILE H 1.800 . 5.000 2.596 2.373 2.747 . 0 0 "[ . 1 . 2]" 1
132 1 6 ILE HB 1 7 LYS H 1.800 . 5.000 2.551 2.451 2.640 . 0 0 "[ . 1 . 2]" 1
133 1 7 LYS QB 1 8 GLU H 1.800 . 4.500 2.428 2.237 2.629 . 0 0 "[ . 1 . 2]" 1
134 1 11 GLU QB 1 12 ASP H 1.800 . 4.500 2.708 2.362 3.277 . 0 0 "[ . 1 . 2]" 1
135 1 13 ILE HB 1 14 GLY H 1.800 . 5.000 3.845 2.575 4.231 . 0 0 "[ . 1 . 2]" 1
136 1 18 ILE HB 1 19 GLU H 1.800 . 5.000 4.396 4.250 4.435 . 0 0 "[ . 1 . 2]" 1
137 1 24 ILE HB 1 25 HIS H 1.800 . 5.000 4.371 4.065 4.481 . 0 0 "[ . 1 . 2]" 1
138 1 26 LEU QB 1 27 LYS H 1.800 . 4.500 2.274 1.862 2.852 . 0 0 "[ . 1 . 2]" 1
139 1 30 VAL HB 1 31 PHE H 1.800 . 3.500 2.595 2.431 2.798 . 0 0 "[ . 1 . 2]" 1
140 1 34 VAL HB 1 35 TRP H 1.800 . 5.000 2.674 2.516 2.825 . 0 0 "[ . 1 . 2]" 1
141 1 38 VAL HB 1 39 GLY H 1.800 . 5.000 4.329 4.181 4.435 . 0 0 "[ . 1 . 2]" 1
142 1 45 THR HB 1 46 TYR H 1.800 . 3.500 2.941 2.660 3.453 . 0 0 "[ . 1 . 2]" 1
143 1 47 VAL HB 1 48 ILE H 1.800 . 5.000 4.297 4.114 4.372 . 0 0 "[ . 1 . 2]" 1
144 1 48 ILE HB 1 49 GLU H 1.800 . 5.000 4.052 2.923 4.359 . 0 0 "[ . 1 . 2]" 1
145 1 76 VAL HB 1 77 TYR H 1.800 . 5.000 4.051 4.018 4.107 . 0 0 "[ . 1 . 2]" 1
146 1 78 PHE HB3 1 79 GLU H 1.800 . 4.000 3.956 3.819 4.023 0.023 6 0 "[ . 1 . 2]" 1
147 1 78 PHE HB2 1 79 GLU H 1.800 . 4.000 2.710 2.443 3.027 . 0 0 "[ . 1 . 2]" 1
148 1 88 THR HB 1 89 ASP H 1.800 . 5.000 3.777 3.605 3.977 . 0 0 "[ . 1 . 2]" 1
149 1 93 PHE QB 1 94 GLN H 1.800 . 4.500 2.428 2.338 2.549 . 0 0 "[ . 1 . 2]" 1
150 1 96 ILE HB 1 97 LEU H 1.800 . 3.500 2.690 2.379 2.909 . 0 0 "[ . 1 . 2]" 1
151 1 99 LYS QB 1 100 ARG H 1.800 . 4.500 2.506 2.250 3.566 . 0 0 "[ . 1 . 2]" 1
152 1 5 VAL MG1 1 6 ILE H 1.800 . 5.500 3.476 3.287 3.654 . 0 0 "[ . 1 . 2]" 1
153 1 5 VAL MG2 1 6 ILE H 1.800 . 5.500 3.774 3.652 3.876 . 0 0 "[ . 1 . 2]" 1
154 1 6 ILE MD 1 7 LYS H 1.800 . 5.500 4.515 4.403 4.619 . 0 0 "[ . 1 . 2]" 1
155 1 6 ILE QG 1 7 LYS H 1.800 . 5.500 3.919 3.805 4.006 . 0 0 "[ . 1 . 2]" 1
156 1 6 ILE MG 1 7 LYS H 1.800 . 5.500 3.463 3.366 3.556 . 0 0 "[ . 1 . 2]" 1
157 1 9 PHE QD 1 10 LEU H 1.800 . 5.500 3.520 3.336 3.755 . 0 0 "[ . 1 . 2]" 1
158 1 10 LEU MD1 1 11 GLU H 1.800 . 5.500 4.509 4.275 4.704 . 0 0 "[ . 1 . 2]" 1
159 1 10 LEU MD2 1 11 GLU H 1.800 . 5.500 4.661 4.623 4.696 . 0 0 "[ . 1 . 2]" 1
160 1 11 GLU QG 1 12 ASP H 1.800 . 5.500 3.923 3.463 4.353 . 0 0 "[ . 1 . 2]" 1
161 1 13 ILE MD 1 14 GLY H 1.800 . 5.500 4.319 3.800 4.609 . 0 0 "[ . 1 . 2]" 1
162 1 13 ILE QG 1 14 GLY H 1.800 . 5.000 2.795 2.056 3.983 . 0 0 "[ . 1 . 2]" 1
163 1 13 ILE MG 1 14 GLY H 1.800 . 5.500 3.999 3.460 4.173 . 0 0 "[ . 1 . 2]" 1
164 1 17 TYR QD 1 18 ILE H 1.800 . 5.500 3.981 3.432 4.678 . 0 0 "[ . 1 . 2]" 1
165 1 18 ILE MD 1 19 GLU H 1.800 . 5.500 5.353 3.909 5.530 0.030 7 0 "[ . 1 . 2]" 1
166 1 18 ILE QG 1 19 GLU H 1.800 . 5.000 4.316 2.804 4.838 . 0 0 "[ . 1 . 2]" 1
167 1 18 ILE MG 1 19 GLU H 1.800 . 5.000 3.337 3.137 4.034 . 0 0 "[ . 1 . 2]" 1
168 1 19 GLU QG 1 20 LEU H 1.800 . 5.000 3.053 2.540 3.489 . 0 0 "[ . 1 . 2]" 1
169 1 20 LEU MD1 1 21 GLU H 1.800 . 5.500 4.226 2.579 5.583 0.083 19 0 "[ . 1 . 2]" 1
170 1 20 LEU MD2 1 21 GLU H 1.800 . 5.500 3.806 3.294 5.380 . 0 0 "[ . 1 . 2]" 1
171 1 23 GLU QG 1 24 ILE H 1.800 . 5.000 3.964 3.304 4.230 . 0 0 "[ . 1 . 2]" 1
172 1 24 ILE MG 1 25 HIS H 1.800 . 5.500 3.091 2.564 3.315 . 0 0 "[ . 1 . 2]" 1
173 1 26 LEU MD1 1 27 LYS H 1.800 . 5.500 4.037 1.802 4.634 . 0 0 "[ . 1 . 2]" 1
174 1 26 LEU MD2 1 27 LYS H 1.800 . 5.500 3.119 2.360 3.616 . 0 0 "[ . 1 . 2]" 1
175 1 28 PRO QD 1 29 GLU H 1.800 . 5.000 3.006 2.622 3.463 . 0 0 "[ . 1 . 2]" 1
176 1 28 PRO QG 1 29 GLU H 1.800 . 5.000 3.563 2.488 3.858 . 0 0 "[ . 1 . 2]" 1
177 1 29 GLU QG 1 30 VAL H 1.800 . 5.500 3.825 3.094 4.390 . 0 0 "[ . 1 . 2]" 1
178 1 30 VAL MG1 1 31 PHE H 1.800 . 5.500 3.548 3.374 3.716 . 0 0 "[ . 1 . 2]" 1
179 1 30 VAL MG2 1 31 PHE H 1.800 . 5.500 3.721 3.564 3.791 . 0 0 "[ . 1 . 2]" 1
180 1 31 PHE QD 1 32 TYR H 1.800 . 5.500 3.556 3.338 3.930 . 0 0 "[ . 1 . 2]" 1
181 1 33 GLU QG 1 34 VAL H 1.800 . 5.500 4.115 3.745 4.342 . 0 0 "[ . 1 . 2]" 1
182 1 34 VAL MG1 1 35 TRP H 1.800 . 5.500 3.518 3.405 3.643 . 0 0 "[ . 1 . 2]" 1
183 1 34 VAL MG2 1 35 TRP H 1.800 . 5.500 3.819 3.723 3.909 . 0 0 "[ . 1 . 2]" 1
184 1 35 TRP HE3 1 36 LYS H 1.800 . 5.000 3.670 3.201 3.940 . 0 0 "[ . 1 . 2]" 1
185 1 36 LYS QG 1 37 TYR H 1.800 . 5.500 4.242 3.798 4.499 . 0 0 "[ . 1 . 2]" 1
186 1 37 TYR QD 1 38 VAL H 1.800 . 5.500 3.661 3.341 4.292 . 0 0 "[ . 1 . 2]" 1
187 1 38 VAL MG1 1 39 GLY H 1.800 . 5.500 4.256 4.138 4.406 . 0 0 "[ . 1 . 2]" 1
188 1 38 VAL MG2 1 39 GLY H 1.800 . 5.500 3.146 2.844 3.437 . 0 0 "[ . 1 . 2]" 1
189 1 43 LEU MD2 1 44 LYS H 1.800 . 5.500 3.457 3.284 3.726 . 0 0 "[ . 1 . 2]" 1
190 1 43 LEU MD1 1 44 LYS H 1.800 . 5.500 4.894 4.425 5.380 . 0 0 "[ . 1 . 2]" 1
191 1 43 LEU HG 1 44 LYS H 1.800 . 5.500 5.013 4.828 5.209 . 0 0 "[ . 1 . 2]" 1
192 1 44 LYS QG 1 45 THR H 1.800 . 5.500 3.814 2.462 4.441 . 0 0 "[ . 1 . 2]" 1
193 1 45 THR MG 1 46 TYR H 1.800 . 5.500 3.686 3.412 3.980 . 0 0 "[ . 1 . 2]" 1
194 1 46 TYR QD 1 47 VAL H 1.800 . 5.500 3.743 3.125 4.172 . 0 0 "[ . 1 . 2]" 1
195 1 47 VAL MG1 1 48 ILE H 1.800 . 5.500 3.032 2.650 4.235 . 0 0 "[ . 1 . 2]" 1
196 1 47 VAL MG2 1 48 ILE H 1.800 . 5.500 4.096 3.159 4.241 . 0 0 "[ . 1 . 2]" 1
197 1 48 ILE MG 1 49 GLU H 1.800 . 5.500 4.071 3.551 4.270 . 0 0 "[ . 1 . 2]" 1
198 1 74 LYS QG 1 75 LYS H 1.800 . 5.000 3.152 2.784 3.692 . 0 0 "[ . 1 . 2]" 1
199 1 75 LYS QD 1 76 VAL H 1.800 . 5.500 4.357 3.508 4.886 . 0 0 "[ . 1 . 2]" 1
200 1 75 LYS QG 1 76 VAL H 1.800 . 5.500 3.850 3.704 4.452 . 0 0 "[ . 1 . 2]" 1
201 1 76 VAL MG1 1 77 TYR H 1.800 . 5.500 3.735 3.601 3.835 . 0 0 "[ . 1 . 2]" 1
202 1 76 VAL MG2 1 77 TYR H 1.800 . 5.500 2.270 2.153 2.365 . 0 0 "[ . 1 . 2]" 1
203 1 77 TYR QD 1 78 PHE H 1.800 . 5.500 3.376 2.956 3.764 . 0 0 "[ . 1 . 2]" 1
204 1 78 PHE QD 1 79 GLU H 1.800 . 5.500 3.468 3.087 4.105 . 0 0 "[ . 1 . 2]" 1
205 1 79 GLU QG 1 80 THR H 1.800 . 5.000 3.901 2.662 4.316 . 0 0 "[ . 1 . 2]" 1
206 1 81 LEU MD1 1 82 ASP H 1.800 . 5.500 4.091 3.898 4.709 . 0 0 "[ . 1 . 2]" 1
207 1 84 VAL MG1 1 85 ARG H 1.800 . 5.500 2.615 2.307 2.939 . 0 0 "[ . 1 . 2]" 1
208 1 84 VAL MG2 1 85 ARG H 1.800 . 5.500 3.969 3.807 4.118 . 0 0 "[ . 1 . 2]" 1
209 1 85 ARG QG 1 86 VAL H 1.800 . 5.500 4.245 3.901 4.484 . 0 0 "[ . 1 . 2]" 1
210 1 86 VAL MG1 1 87 VAL H 1.800 . 5.500 3.071 2.890 3.297 . 0 0 "[ . 1 . 2]" 1
211 1 86 VAL MG2 1 87 VAL H 1.800 . 5.500 4.182 4.115 4.316 . 0 0 "[ . 1 . 2]" 1
212 1 87 VAL MG1 1 88 THR H 1.800 . 5.500 2.367 2.242 2.482 . 0 0 "[ . 1 . 2]" 1
213 1 87 VAL MG2 1 88 THR H 1.800 . 5.500 4.021 3.968 4.062 . 0 0 "[ . 1 . 2]" 1
214 1 88 THR HG1 1 89 ASP H 1.800 . 5.000 4.047 2.718 4.636 . 0 0 "[ . 1 . 2]" 1
215 1 88 THR MG 1 89 ASP H 1.800 . 5.500 2.240 1.940 2.950 . 0 0 "[ . 1 . 2]" 1
216 1 90 TYR QD 1 91 SER H 1.800 . 5.500 4.080 3.411 4.582 . 0 0 "[ . 1 . 2]" 1
217 1 92 GLU QG 1 93 PHE H 1.800 . 5.500 4.148 3.841 4.369 . 0 0 "[ . 1 . 2]" 1
218 1 93 PHE QD 1 94 GLN H 1.800 . 5.500 3.565 3.311 3.799 . 0 0 "[ . 1 . 2]" 1
219 1 94 GLN QG 1 95 LYS H 1.800 . 5.000 4.107 2.295 4.439 . 0 0 "[ . 1 . 2]" 1
220 1 95 LYS QD 1 96 ILE H 1.800 . 5.500 4.393 3.077 5.286 . 0 0 "[ . 1 . 2]" 1
221 1 95 LYS QG 1 96 ILE H 1.800 . 5.500 3.744 3.028 4.194 . 0 0 "[ . 1 . 2]" 1
222 1 96 ILE QG 1 97 LEU H 1.800 . 5.500 4.023 3.884 4.201 . 0 0 "[ . 1 . 2]" 1
223 1 96 ILE MG 1 97 LEU H 1.800 . 5.500 3.476 3.304 3.667 . 0 0 "[ . 1 . 2]" 1
224 1 97 LEU MD1 1 98 LYS H 1.800 . 5.500 4.508 3.803 4.835 . 0 0 "[ . 1 . 2]" 1
225 1 97 LEU MD2 1 98 LYS H 1.800 . 5.500 4.535 3.986 4.659 . 0 0 "[ . 1 . 2]" 1
226 1 97 LEU HG 1 98 LYS H 1.800 . 5.000 4.466 4.214 5.041 0.041 10 0 "[ . 1 . 2]" 1
227 1 98 LYS QG 1 99 LYS H 1.800 . 5.000 4.040 3.516 4.449 . 0 0 "[ . 1 . 2]" 1
228 1 100 ARG QG 1 101 GLY H 1.800 . 5.000 3.941 2.305 4.469 . 0 0 "[ . 1 . 2]" 1
229 1 102 THR MG 1 103 LYS H 1.800 . 5.500 3.123 2.045 3.936 . 0 0 "[ . 1 . 2]" 1
230 1 2 ASN QB 1 4 GLU H 1.800 . 4.500 2.478 2.181 2.792 . 0 0 "[ . 1 . 2]" 1
231 1 27 LYS QB 1 29 GLU H 1.800 . 5.500 3.204 2.558 4.565 . 0 0 "[ . 1 . 2]" 1
232 1 80 THR HB 1 82 ASP H 1.800 . 3.500 2.691 2.385 2.912 . 0 0 "[ . 1 . 2]" 1
233 1 82 ASP QB 1 84 VAL H 1.800 . 5.500 3.121 2.190 4.401 . 0 0 "[ . 1 . 2]" 1
234 1 93 PHE QB 1 95 LYS H 1.800 . 5.500 4.528 4.330 4.698 . 0 0 "[ . 1 . 2]" 1
235 1 97 LEU QB 1 99 LYS H 1.800 . 5.500 4.545 4.348 4.765 . 0 0 "[ . 1 . 2]" 1
236 1 99 LYS QB 1 101 GLY H 1.800 . 5.500 4.474 4.245 5.225 . 0 0 "[ . 1 . 2]" 1
237 1 5 VAL MG1 1 7 LYS H 1.800 . 5.500 5.085 4.979 5.232 . 0 0 "[ . 1 . 2]" 1
238 1 13 ILE MD 1 15 GLU H 1.800 . 5.500 3.927 3.112 4.736 . 0 0 "[ . 1 . 2]" 1
239 1 13 ILE QG 1 15 GLU H 1.800 . 5.000 2.829 1.794 4.968 0.006 13 0 "[ . 1 . 2]" 1
240 1 17 TYR QD 1 19 GLU H 1.800 . 5.500 3.417 2.792 4.285 . 0 0 "[ . 1 . 2]" 1
241 1 17 TYR QE 1 19 GLU H 1.800 . 5.500 4.324 3.677 4.939 . 0 0 "[ . 1 . 2]" 1
242 1 19 GLU QG 1 21 GLU H 1.800 . 5.500 4.698 1.830 5.444 . 0 0 "[ . 1 . 2]" 1
243 1 24 ILE MG 1 26 LEU H 1.800 . 5.500 4.002 3.381 4.302 . 0 0 "[ . 1 . 2]" 1
244 1 30 VAL MG1 1 32 TYR H 1.800 . 5.500 4.981 4.841 5.104 . 0 0 "[ . 1 . 2]" 1
245 1 38 VAL MG2 1 40 GLU H 1.800 . 5.500 2.751 2.263 3.431 . 0 0 "[ . 1 . 2]" 1
246 1 48 ILE QG 1 50 ASP H 1.800 . 5.500 3.926 3.040 4.313 . 0 0 "[ . 1 . 2]" 1
247 1 76 VAL MG2 1 78 PHE H 1.800 . 5.500 4.710 4.547 4.972 . 0 0 "[ . 1 . 2]" 1
248 1 80 THR HG1 1 82 ASP H 1.800 . 4.000 2.810 2.168 3.743 . 0 0 "[ . 1 . 2]" 1
249 1 81 LEU MD1 1 83 ASN H 1.800 . 5.500 5.089 4.453 5.527 0.027 8 0 "[ . 1 . 2]" 1
250 1 87 VAL MG1 1 89 ASP H 1.800 . 5.500 4.645 4.375 5.047 . 0 0 "[ . 1 . 2]" 1
251 1 2 ASN QB 1 5 VAL H 1.800 . 5.500 2.989 2.578 3.433 . 0 0 "[ . 1 . 2]" 1
252 1 20 LEU HB3 1 23 GLU H 1.800 . 5.000 4.493 3.409 5.029 0.029 2 0 "[ . 1 . 2]" 1
253 1 20 LEU HB2 1 23 GLU H 1.800 . 5.000 3.695 3.208 5.032 0.032 5 0 "[ . 1 . 2]" 1
254 1 27 LYS QB 1 30 VAL H 1.800 . 4.500 2.712 2.365 3.290 . 0 0 "[ . 1 . 2]" 1
255 1 89 ASP QB 1 92 GLU H 1.800 . 5.500 3.025 2.381 3.460 . 0 0 "[ . 1 . 2]" 1
256 1 5 VAL MG1 1 8 GLU H 1.800 . 5.500 4.691 4.412 4.853 . 0 0 "[ . 1 . 2]" 1
257 1 6 ILE MG 1 9 PHE H 1.800 . 5.500 4.645 4.489 4.821 . 0 0 "[ . 1 . 2]" 1
258 1 10 LEU MD2 1 13 ILE H 1.800 . 5.500 4.967 4.700 5.203 . 0 0 "[ . 1 . 2]" 1
259 1 19 GLU QG 1 22 ASN H 1.800 . 5.500 3.973 1.971 4.878 . 0 0 "[ . 1 . 2]" 1
260 1 30 VAL MG1 1 33 GLU H 1.800 . 5.500 4.421 4.175 4.659 . 0 0 "[ . 1 . 2]" 1
261 1 34 VAL MG1 1 37 TYR H 1.800 . 5.500 4.367 4.105 4.541 . 0 0 "[ . 1 . 2]" 1
262 1 34 VAL MG2 1 37 TYR H 1.800 . 5.500 5.030 4.918 5.141 . 0 0 "[ . 1 . 2]" 1
263 1 80 THR HG1 1 83 ASN H 1.800 . 5.000 3.900 3.301 4.455 . 0 0 "[ . 1 . 2]" 1
264 1 87 VAL MG1 1 90 TYR H 1.800 . 5.500 5.425 5.186 5.518 0.018 13 0 "[ . 1 . 2]" 1
265 1 4 GLU QG 1 8 GLU H 1.800 . 5.500 4.314 3.965 5.529 0.029 9 0 "[ . 1 . 2]" 1
266 1 5 VAL MG1 1 9 PHE H 1.800 . 5.500 4.021 3.866 4.304 . 0 0 "[ . 1 . 2]" 1
267 1 19 GLU QG 1 23 GLU H 1.800 . 5.500 3.780 2.536 4.772 . 0 0 "[ . 1 . 2]" 1
268 1 80 THR HG1 1 84 VAL H 1.800 . 5.000 2.712 2.252 3.613 . 0 0 "[ . 1 . 2]" 1
269 1 80 THR MG 1 84 VAL H 1.800 . 5.500 4.093 3.661 4.699 . 0 0 "[ . 1 . 2]" 1
270 1 90 TYR QD 1 94 GLN H 1.800 . 5.500 4.480 3.864 4.891 . 0 0 "[ . 1 . 2]" 1
271 1 96 ILE MG 1 100 ARG H 1.800 . 5.500 3.816 3.487 4.364 . 0 0 "[ . 1 . 2]" 1
272 1 3 SER HA 1 6 ILE HB 1.800 . 5.000 2.897 2.551 3.179 . 0 0 "[ . 1 . 2]" 1
273 1 4 GLU HA 1 7 LYS QB 1.800 . 5.000 2.717 2.333 2.950 . 0 0 "[ . 1 . 2]" 1
274 1 5 VAL HA 1 8 GLU QB 1.800 . 5.000 2.834 2.444 3.067 . 0 0 "[ . 1 . 2]" 1
275 1 6 ILE HA 1 9 PHE QB 1.800 . 5.000 2.621 2.364 3.091 . 0 0 "[ . 1 . 2]" 1
276 1 7 LYS HA 1 10 LEU QB 1.800 . 5.000 2.818 2.531 3.190 . 0 0 "[ . 1 . 2]" 1
277 1 9 PHE HA 1 12 ASP QB 1.800 . 5.000 2.641 2.194 3.083 . 0 0 "[ . 1 . 2]" 1
278 1 29 GLU HA 1 32 TYR QB 1.800 . 5.000 3.032 2.073 3.870 . 0 0 "[ . 1 . 2]" 1
279 1 30 VAL HA 1 33 GLU QB 1.800 . 5.000 3.192 2.798 3.740 . 0 0 "[ . 1 . 2]" 1
280 1 31 PHE HA 1 34 VAL HB 1.800 . 5.000 2.615 2.277 3.038 . 0 0 "[ . 1 . 2]" 1
281 1 33 GLU HA 1 36 LYS QB 1.800 . 5.000 3.169 2.458 3.690 . 0 0 "[ . 1 . 2]" 1
282 1 34 VAL HA 1 37 TYR HB3 1.800 . 5.000 2.269 1.979 2.472 . 0 0 "[ . 1 . 2]" 1
283 1 34 VAL HA 1 37 TYR HB2 1.800 . 5.000 2.862 2.278 3.353 . 0 0 "[ . 1 . 2]" 1
284 1 90 TYR HA 1 93 PHE QB 1.800 . 5.000 2.242 1.946 2.580 . 0 0 "[ . 1 . 2]" 1
285 1 91 SER HA 1 94 GLN QB 1.800 . 5.000 3.162 2.443 4.136 . 0 0 "[ . 1 . 2]" 1
286 1 92 GLU HA 1 95 LYS QB 1.800 . 5.000 2.293 1.857 2.924 . 0 0 "[ . 1 . 2]" 1
287 1 93 PHE HA 1 96 ILE HB 1.800 . 5.000 3.146 2.778 3.537 . 0 0 "[ . 1 . 2]" 1
288 1 94 GLN HA 1 97 LEU QB 1.800 . 5.000 2.420 1.944 2.873 . 0 0 "[ . 1 . 2]" 1
289 1 95 LYS HA 1 98 LYS QB 1.800 . 5.000 2.884 2.050 3.278 . 0 0 "[ . 1 . 2]" 1
290 1 96 ILE HA 1 99 LYS QB 1.800 . 5.000 2.314 1.758 3.623 0.042 12 0 "[ . 1 . 2]" 1
291 1 97 LEU HA 1 100 ARG QB 1.800 . 5.000 3.397 2.406 4.554 . 0 0 "[ . 1 . 2]" 1
292 1 3 SER HA 1 6 ILE MD 1.800 . 5.000 2.243 1.929 2.753 . 0 0 "[ . 1 . 2]" 1
293 1 3 SER HA 1 6 ILE QG 1.800 . 5.500 2.806 2.465 3.437 . 0 0 "[ . 1 . 2]" 1
294 1 3 SER HA 1 6 ILE MG 1.800 . 5.000 4.165 3.850 4.417 . 0 0 "[ . 1 . 2]" 1
295 1 4 GLU HA 1 7 LYS HE3 1.800 . 5.000 3.903 2.680 5.017 0.017 19 0 "[ . 1 . 2]" 1
296 1 4 GLU HA 1 7 LYS HE2 1.800 . 5.000 4.583 3.271 5.033 0.033 14 0 "[ . 1 . 2]" 1
297 1 4 GLU HA 1 7 LYS QG 1.800 . 5.500 3.061 2.508 3.727 . 0 0 "[ . 1 . 2]" 1
298 1 6 ILE HA 1 9 PHE QD 1.800 . 5.500 4.088 3.775 4.716 . 0 0 "[ . 1 . 2]" 1
299 1 7 LYS HA 1 10 LEU MD1 1.800 . 5.000 2.652 1.996 3.460 . 0 0 "[ . 1 . 2]" 1
300 1 10 LEU HA 1 13 ILE MD 1.800 . 5.000 2.476 2.248 2.925 . 0 0 "[ . 1 . 2]" 1
301 1 10 LEU HA 1 13 ILE HG13 1.800 . 5.000 3.103 2.850 3.564 . 0 0 "[ . 1 . 2]" 1
302 1 10 LEU HA 1 13 ILE HG12 1.800 . 5.000 2.549 1.956 4.998 . 0 0 "[ . 1 . 2]" 1
303 1 10 LEU HA 1 13 ILE MG 1.800 . 5.500 4.001 3.717 4.339 . 0 0 "[ . 1 . 2]" 1
304 1 30 VAL HA 1 33 GLU QG 1.800 . 5.000 3.613 2.871 5.004 0.004 14 0 "[ . 1 . 2]" 1
305 1 31 PHE HA 1 34 VAL MG1 1.800 . 5.500 4.019 3.730 4.410 . 0 0 "[ . 1 . 2]" 1
306 1 31 PHE HA 1 34 VAL MG2 1.800 . 5.500 3.006 2.585 3.454 . 0 0 "[ . 1 . 2]" 1
307 1 33 GLU HA 1 36 LYS QG 1.800 . 5.500 4.005 2.826 5.271 . 0 0 "[ . 1 . 2]" 1
308 1 34 VAL HA 1 37 TYR QD 1.800 . 5.500 3.731 3.393 4.094 . 0 0 "[ . 1 . 2]" 1
309 1 35 TRP HA 1 38 VAL MG2 1.800 . 5.000 2.455 2.075 3.087 . 0 0 "[ . 1 . 2]" 1
310 1 90 TYR HA 1 93 PHE QD 1.800 . 5.500 3.569 3.246 3.823 . 0 0 "[ . 1 . 2]" 1
311 1 92 GLU HA 1 95 LYS QD 1.800 . 5.500 2.832 1.858 4.766 . 0 0 "[ . 1 . 2]" 1
312 1 92 GLU HA 1 95 LYS QG 1.800 . 5.500 3.528 2.438 4.523 . 0 0 "[ . 1 . 2]" 1
313 1 93 PHE HA 1 96 ILE MD 1.800 . 5.000 2.777 2.232 3.384 . 0 0 "[ . 1 . 2]" 1
314 1 93 PHE HA 1 96 ILE MG 1.800 . 5.500 4.458 4.172 4.900 . 0 0 "[ . 1 . 2]" 1
315 1 94 GLN HA 1 97 LEU MD1 1.800 . 5.000 2.672 1.864 4.878 . 0 0 "[ . 1 . 2]" 1
316 1 94 GLN HA 1 97 LEU MD2 1.800 . 5.000 4.000 2.117 4.875 . 0 0 "[ . 1 . 2]" 1
317 1 94 GLN HA 1 97 LEU HG 1.800 . 5.000 2.924 2.404 3.680 . 0 0 "[ . 1 . 2]" 1
318 1 95 LYS HA 1 98 LYS QD 1.800 . 5.500 3.437 2.348 5.137 . 0 0 "[ . 1 . 2]" 1
319 1 95 LYS HA 1 98 LYS QE 1.800 . 5.500 4.537 3.149 5.566 0.066 6 0 "[ . 1 . 2]" 1
320 1 95 LYS HA 1 98 LYS QG 1.800 . 5.500 3.682 2.811 5.216 . 0 0 "[ . 1 . 2]" 1
321 1 96 ILE HA 1 99 LYS HG3 1.800 . 5.000 4.069 1.883 5.022 0.022 7 0 "[ . 1 . 2]" 1
322 1 96 ILE HA 1 99 LYS HG2 1.800 . 5.000 4.188 2.169 4.855 . 0 0 "[ . 1 . 2]" 1
323 1 3 SER H 1 82 ASP H 1.800 . 5.000 3.923 3.404 4.460 . 0 0 "[ . 1 . 2]" 1
324 1 18 ILE H 1 25 HIS H 1.800 . 5.000 3.590 3.156 3.998 . 0 0 "[ . 1 . 2]" 1
325 1 20 LEU H 1 23 GLU H 1.800 . 5.000 3.297 2.815 3.740 . 0 0 "[ . 1 . 2]" 1
326 1 24 ILE H 1 85 ARG H 1.800 . 5.000 3.897 3.625 4.257 . 0 0 "[ . 1 . 2]" 1
327 1 24 ILE H 1 87 VAL H 1.800 . 5.500 3.386 3.033 3.717 . 0 0 "[ . 1 . 2]" 1
328 1 25 HIS H 1 87 VAL H 1.800 . 5.500 4.497 4.319 4.713 . 0 0 "[ . 1 . 2]" 1
329 1 44 LYS H 1 77 TYR H 1.800 . 5.000 3.275 3.028 3.629 . 0 0 "[ . 1 . 2]" 1
330 1 46 TYR H 1 75 LYS H 1.800 . 5.000 3.177 2.963 3.410 . 0 0 "[ . 1 . 2]" 1
331 1 48 ILE H 1 73 ILE H 1.800 . 5.000 3.572 3.128 3.904 . 0 0 "[ . 1 . 2]" 1
332 1 76 VAL H 1 88 THR H 1.800 . 5.000 3.250 2.967 3.423 . 0 0 "[ . 1 . 2]" 1
333 1 76 VAL H 1 90 TYR H 1.800 . 5.000 3.110 2.798 3.382 . 0 0 "[ . 1 . 2]" 1
334 1 78 PHE H 1 86 VAL H 1.800 . 5.000 3.054 2.829 3.430 . 0 0 "[ . 1 . 2]" 1
335 1 80 THR H 1 83 ASN H 1.800 . 5.500 4.008 3.655 4.315 . 0 0 "[ . 1 . 2]" 1
336 1 80 THR H 1 84 VAL H 1.800 . 3.500 3.177 2.754 3.523 0.023 14 0 "[ . 1 . 2]" 1
337 1 2 ASN HA 1 82 ASP H 1.800 . 5.000 3.963 3.117 4.626 . 0 0 "[ . 1 . 2]" 1
338 1 10 LEU HA 1 15 GLU H 1.800 . 5.000 3.715 3.353 4.111 . 0 0 "[ . 1 . 2]" 1
339 1 19 GLU HA 1 25 HIS H 1.800 . 5.000 3.326 2.802 3.919 . 0 0 "[ . 1 . 2]" 1
340 1 23 GLU HA 1 85 ARG H 1.800 . 5.000 2.865 2.484 3.328 . 0 0 "[ . 1 . 2]" 1
341 1 24 ILE HA 1 87 VAL H 1.800 . 5.500 4.747 4.578 4.938 . 0 0 "[ . 1 . 2]" 1
342 1 25 HIS HA 1 87 VAL H 1.800 . 5.000 2.849 2.481 3.375 . 0 0 "[ . 1 . 2]" 1
343 1 35 TRP HA 1 40 GLU H 1.800 . 5.000 4.404 4.021 5.055 0.055 17 0 "[ . 1 . 2]" 1
344 1 43 LEU HA 1 77 TYR H 1.800 . 5.500 4.727 4.095 5.219 . 0 0 "[ . 1 . 2]" 1
345 1 45 THR HA 1 77 TYR H 1.800 . 5.000 3.290 3.032 3.757 . 0 0 "[ . 1 . 2]" 1
346 1 47 VAL HA 1 75 LYS H 1.800 . 5.000 3.387 2.994 3.600 . 0 0 "[ . 1 . 2]" 1
347 1 75 LYS HA 1 88 THR H 1.800 . 5.500 5.366 4.707 5.541 0.041 18 0 "[ . 1 . 2]" 1
348 1 75 LYS HA 1 90 TYR H 1.800 . 3.500 2.002 1.779 2.489 0.021 9 0 "[ . 1 . 2]" 1
349 1 77 TYR HA 1 86 VAL H 1.800 . 5.500 4.740 4.397 4.939 . 0 0 "[ . 1 . 2]" 1
350 1 77 TYR HA 1 88 THR H 1.800 . 5.000 3.470 3.280 3.730 . 0 0 "[ . 1 . 2]" 1
351 1 79 GLU HA 1 84 VAL H 1.800 . 5.500 4.711 4.294 5.308 . 0 0 "[ . 1 . 2]" 1
352 1 79 GLU HA 1 86 VAL H 1.800 . 5.000 3.438 3.124 3.684 . 0 0 "[ . 1 . 2]" 1
353 1 20 LEU H 1 24 ILE HA 1.800 . 5.000 3.329 2.919 3.825 . 0 0 "[ . 1 . 2]" 1
354 1 24 ILE H 1 86 VAL HA 1.800 . 3.500 2.623 2.402 3.344 . 0 0 "[ . 1 . 2]" 1
355 1 26 LEU H 1 88 THR HA 1.800 . 5.000 3.552 3.233 3.898 . 0 0 "[ . 1 . 2]" 1
356 1 44 LYS H 1 76 VAL HA 1.800 . 5.500 4.925 4.582 5.338 . 0 0 "[ . 1 . 2]" 1
357 1 44 LYS H 1 78 PHE HA 1.800 . 5.000 3.395 2.991 3.985 . 0 0 "[ . 1 . 2]" 1
358 1 46 TYR H 1 74 LYS HA 1.800 . 5.500 4.453 4.256 4.816 . 0 0 "[ . 1 . 2]" 1
359 1 46 TYR H 1 76 VAL HA 1.800 . 5.000 3.432 3.127 3.700 . 0 0 "[ . 1 . 2]" 1
360 1 76 VAL H 1 87 VAL HA 1.800 . 5.500 4.826 4.533 4.999 . 0 0 "[ . 1 . 2]" 1
361 1 76 VAL H 1 89 ASP HA 1.800 . 5.000 3.522 3.152 4.033 . 0 0 "[ . 1 . 2]" 1
362 1 78 PHE H 1 85 ARG HA 1.800 . 5.500 4.316 3.975 4.729 . 0 0 "[ . 1 . 2]" 1
363 1 78 PHE H 1 87 VAL HA 1.800 . 5.000 4.080 3.870 4.202 . 0 0 "[ . 1 . 2]" 1
364 1 79 GLU H 1 85 ARG HA 1.800 . 5.500 4.768 4.448 5.044 . 0 0 "[ . 1 . 2]" 1
365 1 80 THR H 1 83 ASN HA 1.800 . 5.000 4.162 3.383 4.626 . 0 0 "[ . 1 . 2]" 1
366 1 80 THR H 1 85 ARG HA 1.800 . 5.000 3.665 3.285 4.084 . 0 0 "[ . 1 . 2]" 1
367 1 19 GLU HA 1 24 ILE HA 1.800 . 5.000 2.367 2.120 2.678 . 0 0 "[ . 1 . 2]" 1
368 1 45 THR HA 1 76 VAL HA 1.800 . 5.000 2.111 1.940 2.269 . 0 0 "[ . 1 . 2]" 1
369 1 77 TYR HA 1 87 VAL HA 1.800 . 5.000 2.510 2.272 2.664 . 0 0 "[ . 1 . 2]" 1
370 1 79 GLU HA 1 85 ARG HA 1.800 . 5.000 2.424 2.015 2.615 . 0 0 "[ . 1 . 2]" 1
371 1 1 MET QB 1 6 ILE H 1.800 . 5.500 4.644 3.559 5.565 0.065 3 0 "[ . 1 . 2]" 1
372 1 3 SER QB 1 84 VAL H 1.800 . 5.500 4.428 3.473 5.100 . 0 0 "[ . 1 . 2]" 1
373 1 18 ILE HB 1 25 HIS H 1.800 . 5.000 3.248 2.606 5.061 0.061 5 0 "[ . 1 . 2]" 1
374 1 18 ILE MG 1 25 HIS H 1.800 . 5.500 3.720 2.245 4.124 . 0 0 "[ . 1 . 2]" 1
375 1 22 ASN QB 1 85 ARG H 1.800 . 5.500 3.470 3.090 3.990 . 0 0 "[ . 1 . 2]" 1
376 1 24 ILE HB 1 87 VAL H 1.800 . 5.000 3.901 2.783 4.177 . 0 0 "[ . 1 . 2]" 1
377 1 24 ILE QG 1 85 ARG H 1.800 . 5.500 4.691 3.876 5.022 . 0 0 "[ . 1 . 2]" 1
378 1 24 ILE MG 1 87 VAL H 1.800 . 5.500 4.255 3.615 4.509 . 0 0 "[ . 1 . 2]" 1
379 1 26 LEU QB 1 31 PHE H 1.800 . 4.500 3.377 3.013 3.747 . 0 0 "[ . 1 . 2]" 1
380 1 26 LEU QB 1 87 VAL H 1.800 . 5.500 5.088 4.446 5.489 . 0 0 "[ . 1 . 2]" 1
381 1 26 LEU MD1 1 31 PHE H 1.800 . 5.500 4.021 3.144 4.647 . 0 0 "[ . 1 . 2]" 1
382 1 26 LEU MD1 1 34 VAL H 1.800 . 5.500 4.775 4.396 5.271 . 0 0 "[ . 1 . 2]" 1
383 1 28 PRO QB 1 93 PHE H 1.800 . 5.500 3.665 2.937 5.177 . 0 0 "[ . 1 . 2]" 1
384 1 28 PRO QG 1 89 ASP H 1.800 . 5.000 3.654 2.053 5.019 0.019 6 0 "[ . 1 . 2]" 1
385 1 35 TRP HD1 1 40 GLU H 1.800 . 5.000 4.744 4.454 5.048 0.048 17 0 "[ . 1 . 2]" 1
386 1 35 TRP HE1 1 43 LEU H 1.800 . 5.000 4.310 3.629 4.997 . 0 0 "[ . 1 . 2]" 1
387 1 43 LEU QB 1 77 TYR H 1.800 . 5.500 3.875 3.295 4.878 . 0 0 "[ . 1 . 2]" 1
388 1 43 LEU MD2 1 77 TYR H 1.800 . 5.500 4.252 3.905 4.577 . 0 0 "[ . 1 . 2]" 1
389 1 43 LEU MD2 1 78 PHE H 1.800 . 5.500 4.191 3.569 5.227 . 0 0 "[ . 1 . 2]" 1
390 1 45 THR MG 1 75 LYS H 1.800 . 5.500 4.792 4.551 5.125 . 0 0 "[ . 1 . 2]" 1
391 1 45 THR MG 1 77 TYR H 1.800 . 5.500 3.786 3.431 4.415 . 0 0 "[ . 1 . 2]" 1
392 1 47 VAL MG1 1 73 ILE H 1.800 . 5.500 3.557 3.022 5.485 . 0 0 "[ . 1 . 2]" 1
393 1 47 VAL MG2 1 74 LYS H 1.800 . 5.500 4.570 3.422 5.348 . 0 0 "[ . 1 . 2]" 1
394 1 48 ILE QG 1 73 ILE H 1.800 . 5.000 4.386 2.838 4.813 . 0 0 "[ . 1 . 2]" 1
395 1 75 LYS QD 1 90 TYR H 1.800 . 5.500 4.550 3.254 5.371 . 0 0 "[ . 1 . 2]" 1
396 1 76 VAL HB 1 90 TYR H 1.800 . 5.000 4.501 3.998 4.976 . 0 0 "[ . 1 . 2]" 1
397 1 76 VAL MG1 1 88 THR H 1.800 . 5.500 3.099 2.868 3.336 . 0 0 "[ . 1 . 2]" 1
398 1 76 VAL MG1 1 90 TYR H 1.800 . 5.500 3.338 3.062 3.748 . 0 0 "[ . 1 . 2]" 1
399 1 76 VAL MG1 1 93 PHE H 1.800 . 5.500 4.533 4.132 4.946 . 0 0 "[ . 1 . 2]" 1
400 1 77 TYR QB 1 86 VAL H 1.800 . 5.000 3.507 3.270 3.808 . 0 0 "[ . 1 . 2]" 1
401 1 77 TYR QB 1 87 VAL H 1.800 . 5.500 3.899 3.676 4.282 . 0 0 "[ . 1 . 2]" 1
402 1 77 TYR QB 1 88 THR H 1.800 . 5.500 3.519 3.262 3.857 . 0 0 "[ . 1 . 2]" 1
403 1 77 TYR QD 1 86 VAL H 1.800 . 5.000 4.028 3.440 4.577 . 0 0 "[ . 1 . 2]" 1
404 1 78 PHE QE 1 86 VAL H 1.800 . 5.000 4.740 4.563 4.979 . 0 0 "[ . 1 . 2]" 1
405 1 88 THR MG 1 93 PHE H 1.800 . 5.500 4.144 3.848 4.493 . 0 0 "[ . 1 . 2]" 1
406 1 97 LEU QB 1 102 THR H 1.800 . 5.500 3.832 3.303 5.104 . 0 0 "[ . 1 . 2]" 1
407 1 3 SER H 1 6 ILE MD 1.800 . 5.500 4.414 3.961 4.710 . 0 0 "[ . 1 . 2]" 1
408 1 3 SER H 1 80 THR HG1 1.800 . 5.000 3.255 2.359 4.577 . 0 0 "[ . 1 . 2]" 1
409 1 3 SER H 1 80 THR MG 1.800 . 5.500 3.434 2.687 4.194 . 0 0 "[ . 1 . 2]" 1
410 1 3 SER H 1 84 VAL HB 1.800 . 5.000 4.511 3.901 5.011 0.011 2 0 "[ . 1 . 2]" 1
411 1 3 SER H 1 84 VAL MG2 1.800 . 5.500 4.339 3.509 4.879 . 0 0 "[ . 1 . 2]" 1
412 1 4 GLU H 1 7 LYS QB 1.800 . 5.500 5.095 4.742 5.316 . 0 0 "[ . 1 . 2]" 1
413 1 4 GLU H 1 7 LYS QD 1.800 . 5.500 4.475 3.897 4.852 . 0 0 "[ . 1 . 2]" 1
414 1 7 LYS H 1 24 ILE MD 1.800 . 5.500 4.385 3.814 4.912 . 0 0 "[ . 1 . 2]" 1
415 1 16 ASP H 1 30 VAL MG2 1.800 . 5.500 4.733 3.846 5.544 0.044 17 0 "[ . 1 . 2]" 1
416 1 18 ILE H 1 24 ILE MG 1.800 . 5.500 3.765 2.956 4.457 . 0 0 "[ . 1 . 2]" 1
417 1 18 ILE H 1 25 HIS QB 1.800 . 5.000 3.651 2.817 4.957 . 0 0 "[ . 1 . 2]" 1
418 1 18 ILE H 1 26 LEU MD2 1.800 . 5.000 3.412 2.876 4.204 . 0 0 "[ . 1 . 2]" 1
419 1 20 LEU H 1 23 GLU QB 1.800 . 5.500 3.172 2.809 3.643 . 0 0 "[ . 1 . 2]" 1
420 1 20 LEU H 1 25 HIS HD2 1.800 . 5.000 3.787 2.762 4.552 . 0 0 "[ . 1 . 2]" 1
421 1 22 ASN H 1 84 VAL MG2 1.800 . 5.500 4.104 3.259 5.498 . 0 0 "[ . 1 . 2]" 1
422 1 23 GLU H 1 84 VAL MG1 1.800 . 5.500 3.560 3.075 4.458 . 0 0 "[ . 1 . 2]" 1
423 1 24 ILE H 1 84 VAL MG1 1.800 . 5.500 3.002 2.679 3.561 . 0 0 "[ . 1 . 2]" 1
424 1 24 ILE H 1 86 VAL MG1 1.800 . 5.500 4.297 4.056 4.969 . 0 0 "[ . 1 . 2]" 1
425 1 24 ILE H 1 86 VAL MG2 1.800 . 5.500 3.682 3.290 4.659 . 0 0 "[ . 1 . 2]" 1
426 1 24 ILE H 1 87 VAL MG2 1.800 . 5.500 3.590 3.121 3.877 . 0 0 "[ . 1 . 2]" 1
427 1 26 LEU H 1 31 PHE QB 1.800 . 5.500 4.498 3.917 4.905 . 0 0 "[ . 1 . 2]" 1
428 1 26 LEU H 1 86 VAL MG1 1.800 . 5.500 3.641 3.294 4.188 . 0 0 "[ . 1 . 2]" 1
429 1 26 LEU H 1 88 THR HB 1.800 . 5.000 4.555 3.150 5.019 0.019 1 0 "[ . 1 . 2]" 1
430 1 27 LYS H 1 30 VAL HB 1.800 . 3.500 3.015 2.410 3.515 0.015 5 0 "[ . 1 . 2]" 1
431 1 27 LYS H 1 30 VAL MG2 1.800 . 5.500 3.535 2.991 4.149 . 0 0 "[ . 1 . 2]" 1
432 1 29 GLU H 1 96 ILE MD 1.800 . 5.500 3.128 2.670 3.583 . 0 0 "[ . 1 . 2]" 1
433 1 31 PHE H 1 88 THR MG 1.800 . 5.500 4.126 3.494 5.103 . 0 0 "[ . 1 . 2]" 1
434 1 32 TYR H 1 93 PHE QD 1.800 . 5.500 3.919 3.548 4.479 . 0 0 "[ . 1 . 2]" 1
435 1 32 TYR H 1 93 PHE QE 1.800 . 5.500 3.664 3.046 4.742 . 0 0 "[ . 1 . 2]" 1
436 1 32 TYR H 1 96 ILE MD 1.800 . 5.500 4.156 3.543 4.904 . 0 0 "[ . 1 . 2]" 1
437 1 32 TYR H 1 96 ILE MG 1.800 . 5.500 4.975 4.504 5.398 . 0 0 "[ . 1 . 2]" 1
438 1 39 GLY H 1 41 PRO QD 1.800 . 5.000 3.982 3.582 4.496 . 0 0 "[ . 1 . 2]" 1
439 1 44 LYS H 1 76 VAL MG2 1.800 . 5.500 3.281 2.632 3.810 . 0 0 "[ . 1 . 2]" 1
440 1 46 TYR H 1 74 LYS QG 1.800 . 5.000 3.683 3.075 4.009 . 0 0 "[ . 1 . 2]" 1
441 1 46 TYR H 1 75 LYS QB 1.800 . 5.500 3.857 3.377 4.043 . 0 0 "[ . 1 . 2]" 1
442 1 46 TYR H 1 77 TYR QE 1.800 . 5.500 3.641 2.937 4.236 . 0 0 "[ . 1 . 2]" 1
443 1 47 VAL H 1 74 LYS QG 1.800 . 5.500 4.476 3.915 5.011 . 0 0 "[ . 1 . 2]" 1
444 1 76 VAL H 1 87 VAL MG1 1.800 . 5.500 3.562 3.248 3.834 . 0 0 "[ . 1 . 2]" 1
445 1 76 VAL H 1 88 THR MG 1.800 . 5.500 4.525 3.460 5.146 . 0 0 "[ . 1 . 2]" 1
446 1 76 VAL H 1 90 TYR QB 1.800 . 5.500 2.803 2.394 3.060 . 0 0 "[ . 1 . 2]" 1
447 1 76 VAL H 1 90 TYR QD 1.800 . 5.500 4.415 4.119 4.747 . 0 0 "[ . 1 . 2]" 1
448 1 78 PHE H 1 86 VAL HB 1.800 . 5.000 3.015 2.868 3.195 . 0 0 "[ . 1 . 2]" 1
449 1 78 PHE H 1 86 VAL MG1 1.800 . 5.500 4.109 3.995 4.307 . 0 0 "[ . 1 . 2]" 1
450 1 78 PHE H 1 86 VAL MG2 1.800 . 5.500 4.240 4.072 4.412 . 0 0 "[ . 1 . 2]" 1
451 1 78 PHE H 1 87 VAL MG2 1.800 . 5.500 4.471 4.239 4.730 . 0 0 "[ . 1 . 2]" 1
452 1 80 THR H 1 84 VAL MG2 1.800 . 5.500 4.869 4.593 5.254 . 0 0 "[ . 1 . 2]" 1
453 1 80 THR H 1 86 VAL MG2 1.800 . 5.500 4.200 3.576 4.588 . 0 0 "[ . 1 . 2]" 1
454 1 82 ASP H 1 84 VAL HB 1.800 . 5.000 4.590 4.008 5.028 0.028 7 0 "[ . 1 . 2]" 1
455 1 82 ASP H 1 84 VAL MG2 1.800 . 5.500 4.219 3.708 4.733 . 0 0 "[ . 1 . 2]" 1
456 1 1 MET HA 1 5 VAL MG2 1.800 . 5.500 2.664 1.792 4.005 0.008 3 0 "[ . 1 . 2]" 1
457 1 1 MET ME 1 38 VAL HA 1.800 . 5.500 3.785 2.182 5.049 . 0 0 "[ . 1 . 2]" 1
458 1 1 MET ME 1 3 SER HA 1.800 . 5.500 4.911 3.244 5.523 0.023 15 0 "[ . 1 . 2]" 1
459 1 2 ASN HA 1 80 THR HB 1.800 . 5.000 2.922 1.791 3.847 0.009 15 0 "[ . 1 . 2]" 1
460 1 2 ASN HA 1 80 THR MG 1.800 . 5.000 3.732 2.740 4.660 . 0 0 "[ . 1 . 2]" 1
461 1 2 ASN HA 1 81 LEU MD1 1.800 . 5.500 3.938 3.022 5.490 . 0 0 "[ . 1 . 2]" 1
462 1 3 SER HA 1 24 ILE MD 1.800 . 5.000 3.597 2.812 4.108 . 0 0 "[ . 1 . 2]" 1
463 1 3 SER HA 1 80 THR MG 1.800 . 5.500 2.704 2.104 3.303 . 0 0 "[ . 1 . 2]" 1
464 1 6 ILE HA 1 34 VAL MG1 1.800 . 5.500 3.994 3.323 4.434 . 0 0 "[ . 1 . 2]" 1
465 1 6 ILE HA 1 34 VAL MG2 1.800 . 5.500 4.762 4.079 5.272 . 0 0 "[ . 1 . 2]" 1
466 1 6 ILE MG 1 34 VAL HA 1.800 . 5.500 5.039 4.516 5.515 0.015 15 0 "[ . 1 . 2]" 1
467 1 7 LYS HA 1 17 TYR QD 1.800 . 5.500 4.293 3.076 5.278 . 0 0 "[ . 1 . 2]" 1
468 1 17 TYR HA 1 24 ILE MG 1.800 . 5.500 4.134 3.430 5.159 . 0 0 "[ . 1 . 2]" 1
469 1 17 TYR HA 1 26 LEU MD2 1.800 . 5.000 2.696 1.990 3.396 . 0 0 "[ . 1 . 2]" 1
470 1 19 GLU HA 1 24 ILE QG 1.800 . 5.000 3.120 2.400 3.681 . 0 0 "[ . 1 . 2]" 1
471 1 19 GLU HA 1 24 ILE MG 1.800 . 5.000 3.594 3.088 3.922 . 0 0 "[ . 1 . 2]" 1
472 1 22 ASN HA 1 84 VAL MG1 1.800 . 5.000 2.661 1.995 3.627 . 0 0 "[ . 1 . 2]" 1
473 1 22 ASN HA 1 84 VAL MG2 1.800 . 5.000 2.511 1.861 3.544 . 0 0 "[ . 1 . 2]" 1
474 1 22 ASN QB 1 84 VAL HA 1.800 . 5.000 2.909 2.075 4.226 . 0 0 "[ . 1 . 2]" 1
475 1 23 GLU HA 1 84 VAL MG1 1.800 . 5.000 3.210 2.793 3.736 . 0 0 "[ . 1 . 2]" 1
476 1 23 GLU HA 1 85 ARG QB 1.800 . 5.500 3.011 2.526 4.496 . 0 0 "[ . 1 . 2]" 1
477 1 23 GLU HA 1 87 VAL MG2 1.800 . 5.000 3.506 3.138 3.858 . 0 0 "[ . 1 . 2]" 1
478 1 24 ILE MG 1 26 LEU HA 1.800 . 5.500 3.999 3.518 4.307 . 0 0 "[ . 1 . 2]" 1
479 1 25 HIS HA 1 86 VAL MG1 1.800 . 5.500 4.077 3.655 4.811 . 0 0 "[ . 1 . 2]" 1
480 1 25 HIS HA 1 87 VAL HB 1.800 . 5.000 3.114 2.740 3.400 . 0 0 "[ . 1 . 2]" 1
481 1 25 HIS HA 1 87 VAL MG2 1.800 . 5.000 4.198 3.765 4.434 . 0 0 "[ . 1 . 2]" 1
482 1 26 LEU MD1 1 31 PHE HA 1.800 . 5.000 2.876 2.556 3.402 . 0 0 "[ . 1 . 2]" 1
483 1 28 PRO HA 1 88 THR MG 1.800 . 5.000 2.172 1.770 2.989 0.030 1 0 "[ . 1 . 2]" 1
484 1 28 PRO QB 1 93 PHE HA 1.800 . 5.000 3.108 2.266 4.688 . 0 0 "[ . 1 . 2]" 1
485 1 29 GLU HA 1 96 ILE MD 1.800 . 5.500 2.193 1.857 2.690 . 0 0 "[ . 1 . 2]" 1
486 1 29 GLU HA 1 96 ILE MG 1.800 . 5.500 3.402 2.585 4.091 . 0 0 "[ . 1 . 2]" 1
487 1 32 TYR QE 1 97 LEU HA 1.800 . 5.500 4.010 3.254 4.760 . 0 0 "[ . 1 . 2]" 1
488 1 34 VAL HA 1 38 VAL MG1 1.800 . 5.500 3.981 3.658 5.051 . 0 0 "[ . 1 . 2]" 1
489 1 35 TRP HA 1 41 PRO QD 1.800 . 5.500 3.349 2.524 3.903 . 0 0 "[ . 1 . 2]" 1
490 1 35 TRP HA 1 78 PHE QE 1.800 . 5.000 4.034 2.972 4.457 . 0 0 "[ . 1 . 2]" 1
491 1 35 TRP HA 1 78 PHE HZ 1.800 . 5.000 4.738 3.597 5.020 0.020 12 0 "[ . 1 . 2]" 1
492 1 35 TRP HD1 1 40 GLU HA 1.800 . 5.000 3.377 2.845 3.929 . 0 0 "[ . 1 . 2]" 1
493 1 35 TRP HE1 1 40 GLU HA 1.800 . 5.000 3.155 2.853 3.510 . 0 0 "[ . 1 . 2]" 1
494 1 43 LEU HA 1 76 VAL MG2 1.800 . 5.000 3.587 2.961 4.027 . 0 0 "[ . 1 . 2]" 1
495 1 43 LEU MD2 1 78 PHE HA 1.800 . 5.000 3.964 3.103 5.033 0.033 3 0 "[ . 1 . 2]" 1
496 1 45 THR HA 1 76 VAL HB 1.800 . 5.000 3.906 3.487 4.329 . 0 0 "[ . 1 . 2]" 1
497 1 45 THR HA 1 76 VAL MG2 1.800 . 5.000 3.289 2.964 3.586 . 0 0 "[ . 1 . 2]" 1
498 1 45 THR HA 1 77 TYR QD 1.800 . 5.500 3.576 2.928 4.662 . 0 0 "[ . 1 . 2]" 1
499 1 45 THR MG 1 76 VAL HA 1.800 . 5.500 2.372 1.996 3.122 . 0 0 "[ . 1 . 2]" 1
500 1 47 VAL MG1 1 72 LYS HA 1.800 . 5.000 3.245 2.642 5.011 0.011 14 0 "[ . 1 . 2]" 1
501 1 75 LYS HA 1 87 VAL MG1 1.800 . 5.000 4.698 3.965 4.969 . 0 0 "[ . 1 . 2]" 1
502 1 76 VAL HA 1 90 TYR QD 1.800 . 5.500 4.386 4.023 4.798 . 0 0 "[ . 1 . 2]" 1
503 1 76 VAL HB 1 90 TYR HA 1.800 . 5.000 3.347 2.971 3.694 . 0 0 "[ . 1 . 2]" 1
504 1 76 VAL MG1 1 90 TYR HA 1.800 . 5.000 2.315 2.089 2.466 . 0 0 "[ . 1 . 2]" 1
505 1 76 VAL MG2 1 90 TYR HA 1.800 . 5.500 4.361 4.021 4.633 . 0 0 "[ . 1 . 2]" 1
506 1 77 TYR HA 1 87 VAL MG1 1.800 . 5.500 3.940 3.698 4.134 . 0 0 "[ . 1 . 2]" 1
507 1 77 TYR HA 1 87 VAL MG2 1.800 . 5.500 3.825 3.523 4.026 . 0 0 "[ . 1 . 2]" 1
508 1 79 GLU HA 1 85 ARG QG 1.800 . 5.500 3.316 2.368 4.942 . 0 0 "[ . 1 . 2]" 1
509 1 90 TYR HA 1 94 GLN QB 1.800 . 5.000 5.011 4.847 5.071 0.071 15 0 "[ . 1 . 2]" 1
510 1 90 TYR HA 1 94 GLN QG 1.800 . 5.000 4.039 3.538 4.603 . 0 0 "[ . 1 . 2]" 1
511 1 97 LEU HA 1 102 THR HB 1.800 . 5.000 3.214 2.458 4.272 . 0 0 "[ . 1 . 2]" 1
512 1 1 MET QB 1 5 VAL MG1 1.800 . 5.500 2.822 2.355 3.464 . 0 0 "[ . 1 . 2]" 1
513 1 1 MET QG 1 38 VAL MG1 1.800 . 5.000 2.483 1.814 3.517 . 0 0 "[ . 1 . 2]" 1
514 1 1 MET QG 1 38 VAL MG2 1.800 . 5.000 4.364 3.502 5.016 0.016 7 0 "[ . 1 . 2]" 1
515 1 1 MET ME 1 34 VAL MG1 1.800 . 5.500 4.064 1.915 5.029 . 0 0 "[ . 1 . 2]" 1
516 1 1 MET ME 1 37 TYR QD 1.800 . 5.500 4.601 2.232 5.508 0.008 14 0 "[ . 1 . 2]" 1
517 1 1 MET ME 1 38 VAL MG2 1.800 . 5.000 3.022 1.957 3.816 . 0 0 "[ . 1 . 2]" 1
518 1 1 MET ME 1 5 VAL MG1 1.800 . 5.500 4.850 3.430 5.531 0.031 8 0 "[ . 1 . 2]" 1
519 1 1 MET ME 1 6 ILE MD 1.800 . 5.000 2.801 2.270 3.608 . 0 0 "[ . 1 . 2]" 1
520 1 1 MET ME 1 78 PHE QD 1.800 . 5.000 3.899 2.597 5.040 0.040 6 0 "[ . 1 . 2]" 1
521 1 1 MET ME 1 78 PHE QE 1.800 . 5.000 2.775 1.844 3.827 . 0 0 "[ . 1 . 2]" 1
522 1 1 MET QG 1 34 VAL MG1 1.800 . 5.500 5.215 4.833 5.536 0.036 16 0 "[ . 1 . 2]" 1
523 1 1 MET QG 1 5 VAL MG1 1.800 . 5.500 3.629 2.262 4.422 . 0 0 "[ . 1 . 2]" 1
524 1 1 MET QG 1 38 VAL HB 1.800 . 5.500 3.433 1.972 4.557 . 0 0 "[ . 1 . 2]" 1
525 1 1 MET QG 1 5 VAL HB 1.800 . 5.500 3.733 1.821 4.913 . 0 0 "[ . 1 . 2]" 1
526 1 2 ASN QB 1 5 VAL MG2 1.800 . 5.500 2.686 1.959 3.492 . 0 0 "[ . 1 . 2]" 1
527 1 2 ASN QB 1 5 VAL HB 1.800 . 5.500 4.220 3.518 4.885 . 0 0 "[ . 1 . 2]" 1
528 1 2 ASN QB 1 81 LEU MD1 1.800 . 5.500 4.985 4.260 5.580 0.080 14 0 "[ . 1 . 2]" 1
529 1 2 ASN QD 1 4 GLU QB 1.800 . 5.000 4.342 3.351 5.023 0.023 3 0 "[ . 1 . 2]" 1
530 1 2 ASN QD 1 5 VAL MG2 1.800 . 5.000 4.524 3.174 5.053 0.053 18 0 "[ . 1 . 2]" 1
531 1 2 ASN QD 1 81 LEU MD1 1.800 . 5.000 4.246 2.075 5.021 0.021 4 0 "[ . 1 . 2]" 1
532 1 3 SER QB 1 84 VAL MG2 1.800 . 5.000 2.669 1.859 3.563 . 0 0 "[ . 1 . 2]" 1
533 1 3 SER QB 1 84 VAL MG1 1.800 . 5.000 2.757 2.279 3.181 . 0 0 "[ . 1 . 2]" 1
534 1 3 SER QB 1 24 ILE MD 1.800 . 5.000 2.533 1.847 3.622 . 0 0 "[ . 1 . 2]" 1
535 1 3 SER QB 1 80 THR MG 1.800 . 5.500 3.022 2.109 3.853 . 0 0 "[ . 1 . 2]" 1
536 1 3 SER QB 1 84 VAL HB 1.800 . 5.500 2.607 1.892 3.240 . 0 0 "[ . 1 . 2]" 1
537 1 5 VAL MG1 1 37 TYR QD 1.800 . 5.000 4.422 3.624 5.038 0.038 1 0 "[ . 1 . 2]" 1
538 1 5 VAL MG1 1 37 TYR QE 1.800 . 5.000 2.756 1.845 3.915 . 0 0 "[ . 1 . 2]" 1
539 1 5 VAL MG2 1 8 GLU QB 1.800 . 5.500 4.465 4.079 4.749 . 0 0 "[ . 1 . 2]" 1
540 1 5 VAL MG2 1 8 GLU QG 1.800 . 5.500 4.560 3.600 5.527 0.027 19 0 "[ . 1 . 2]" 1
541 1 6 ILE HB 1 24 ILE MD 1.800 . 5.500 3.401 2.968 3.839 . 0 0 "[ . 1 . 2]" 1
542 1 6 ILE HB 1 86 VAL MG2 1.800 . 5.500 4.295 3.907 4.585 . 0 0 "[ . 1 . 2]" 1
543 1 6 ILE MD 1 34 VAL MG1 1.800 . 5.000 2.963 2.542 3.672 . 0 0 "[ . 1 . 2]" 1
544 1 6 ILE MD 1 38 VAL MG2 1.800 . 5.000 4.444 4.025 5.032 0.032 15 0 "[ . 1 . 2]" 1
545 1 6 ILE MD 1 78 PHE QD 1.800 . 5.500 4.374 3.829 4.887 . 0 0 "[ . 1 . 2]" 1
546 1 6 ILE MD 1 78 PHE QE 1.800 . 5.000 2.549 2.019 3.233 . 0 0 "[ . 1 . 2]" 1
547 1 6 ILE MD 1 78 PHE HZ 1.800 . 5.000 2.598 2.056 3.151 . 0 0 "[ . 1 . 2]" 1
548 1 6 ILE MD 1 80 THR MG 1.800 . 5.000 2.203 1.893 2.880 . 0 0 "[ . 1 . 2]" 1
549 1 6 ILE MD 1 86 VAL HB 1.800 . 5.500 4.210 3.860 4.846 . 0 0 "[ . 1 . 2]" 1
550 1 6 ILE MD 1 86 VAL MG1 1.800 . 5.000 3.460 2.540 4.016 . 0 0 "[ . 1 . 2]" 1
551 1 6 ILE MD 1 86 VAL MG2 1.800 . 5.000 2.218 1.946 2.714 . 0 0 "[ . 1 . 2]" 1
552 1 6 ILE QG 1 34 VAL MG1 1.800 . 5.500 3.048 2.294 3.370 . 0 0 "[ . 1 . 2]" 1
553 1 6 ILE MG 1 10 LEU MD1 1.800 . 5.000 2.169 1.955 2.494 . 0 0 "[ . 1 . 2]" 1
554 1 6 ILE MG 1 24 ILE MD 1.800 . 5.000 3.184 2.711 3.783 . 0 0 "[ . 1 . 2]" 1
555 1 6 ILE MG 1 34 VAL MG1 1.800 . 5.000 2.426 2.023 2.951 . 0 0 "[ . 1 . 2]" 1
556 1 6 ILE MG 1 34 VAL MG2 1.800 . 5.000 3.083 2.645 3.436 . 0 0 "[ . 1 . 2]" 1
557 1 6 ILE MG 1 78 PHE QE 1.800 . 5.500 4.484 3.923 4.956 . 0 0 "[ . 1 . 2]" 1
558 1 6 ILE MG 1 78 PHE HZ 1.800 . 5.500 3.810 3.212 4.372 . 0 0 "[ . 1 . 2]" 1
559 1 6 ILE MG 1 86 VAL MG1 1.800 . 5.000 3.485 3.157 3.857 . 0 0 "[ . 1 . 2]" 1
560 1 6 ILE MG 1 86 VAL MG2 1.800 . 5.000 3.059 2.609 3.755 . 0 0 "[ . 1 . 2]" 1
561 1 6 ILE MG 1 9 PHE QD 1.800 . 5.500 3.736 3.407 4.216 . 0 0 "[ . 1 . 2]" 1
562 1 7 LYS QD 1 24 ILE MD 1.800 . 5.500 4.336 3.789 4.874 . 0 0 "[ . 1 . 2]" 1
563 1 7 LYS QE 1 17 TYR QE 1.800 . 5.500 3.529 2.092 5.503 0.003 3 0 "[ . 1 . 2]" 1
564 1 7 LYS QE 1 24 ILE MD 1.800 . 5.500 2.987 2.011 4.464 . 0 0 "[ . 1 . 2]" 1
565 1 7 LYS QE 1 84 VAL MG2 1.800 . 5.500 4.452 3.328 5.382 . 0 0 "[ . 1 . 2]" 1
566 1 7 LYS QG 1 24 ILE MD 1.800 . 5.500 3.056 2.388 3.650 . 0 0 "[ . 1 . 2]" 1
567 1 8 GLU QB 1 12 ASP QB 1.800 . 5.500 4.373 3.652 5.099 . 0 0 "[ . 1 . 2]" 1
568 1 9 PHE QD 1 13 ILE MD 1.800 . 5.500 3.285 2.793 3.829 . 0 0 "[ . 1 . 2]" 1
569 1 9 PHE QD 1 13 ILE QG 1.800 . 5.500 4.098 3.769 4.526 . 0 0 "[ . 1 . 2]" 1
570 1 9 PHE QD 1 13 ILE MG 1.800 . 5.500 3.997 3.368 5.549 0.049 7 0 "[ . 1 . 2]" 1
571 1 9 PHE QD 1 30 VAL MG1 1.800 . 5.500 4.305 3.209 5.052 . 0 0 "[ . 1 . 2]" 1
572 1 9 PHE QD 1 34 VAL MG2 1.800 . 5.000 2.755 2.305 3.477 . 0 0 "[ . 1 . 2]" 1
573 1 9 PHE QE 1 13 ILE MD 1.800 . 5.500 2.698 2.376 3.301 . 0 0 "[ . 1 . 2]" 1
574 1 9 PHE QE 1 13 ILE QG 1.800 . 5.500 4.318 3.649 4.697 . 0 0 "[ . 1 . 2]" 1
575 1 9 PHE QE 1 13 ILE MG 1.800 . 5.500 3.518 2.967 5.018 . 0 0 "[ . 1 . 2]" 1
576 1 9 PHE QE 1 30 VAL MG1 1.800 . 5.500 3.674 2.528 4.465 . 0 0 "[ . 1 . 2]" 1
577 1 9 PHE QE 1 33 GLU QB 1.800 . 5.500 3.653 2.747 4.513 . 0 0 "[ . 1 . 2]" 1
578 1 9 PHE QE 1 34 VAL MG2 1.800 . 5.000 2.620 1.967 3.528 . 0 0 "[ . 1 . 2]" 1
579 1 9 PHE HZ 1 13 ILE MD 1.800 . 5.500 3.513 2.720 4.049 . 0 0 "[ . 1 . 2]" 1
580 1 9 PHE HZ 1 13 ILE MG 1.800 . 5.500 3.653 2.998 5.506 0.006 20 0 "[ . 1 . 2]" 1
581 1 9 PHE HZ 1 33 GLU QB 1.800 . 5.000 3.807 2.507 4.980 . 0 0 "[ . 1 . 2]" 1
582 1 9 PHE HZ 1 34 VAL MG2 1.800 . 5.500 4.507 4.017 5.368 . 0 0 "[ . 1 . 2]" 1
583 1 10 LEU QB 1 17 TYR QD 1.800 . 5.500 2.715 2.293 3.208 . 0 0 "[ . 1 . 2]" 1
584 1 10 LEU QB 1 13 ILE MD 1.800 . 5.500 3.877 3.569 4.590 . 0 0 "[ . 1 . 2]" 1
585 1 10 LEU QB 1 13 ILE QG 1.800 . 5.500 3.951 3.628 5.227 . 0 0 "[ . 1 . 2]" 1
586 1 10 LEU QB 1 26 LEU MD2 1.800 . 5.500 3.914 3.512 4.483 . 0 0 "[ . 1 . 2]" 1
587 1 10 LEU QB 1 30 VAL MG1 1.800 . 5.500 4.353 3.699 4.823 . 0 0 "[ . 1 . 2]" 1
588 1 10 LEU MD1 1 17 TYR QB 1.800 . 5.000 2.141 1.776 3.035 0.024 7 0 "[ . 1 . 2]" 1
589 1 10 LEU MD1 1 17 TYR QD 1.800 . 5.000 2.436 1.778 3.122 0.022 19 0 "[ . 1 . 2]" 1
590 1 10 LEU MD1 1 17 TYR QE 1.800 . 5.000 3.535 2.669 4.344 . 0 0 "[ . 1 . 2]" 1
591 1 10 LEU MD1 1 24 ILE MG 1.800 . 5.000 2.948 2.368 3.819 . 0 0 "[ . 1 . 2]" 1
592 1 10 LEU MD1 1 26 LEU MD1 1.800 . 5.000 2.506 1.865 3.176 . 0 0 "[ . 1 . 2]" 1
593 1 10 LEU MD1 1 26 LEU MD2 1.800 . 5.000 1.973 1.787 2.317 0.013 5 0 "[ . 1 . 2]" 1
594 1 10 LEU MD2 1 15 GLU QB 1.800 . 5.000 2.669 2.185 3.744 . 0 0 "[ . 1 . 2]" 1
595 1 10 LEU MD2 1 15 GLU QG 1.800 . 5.000 3.330 2.210 4.996 . 0 0 "[ . 1 . 2]" 1
596 1 10 LEU MD2 1 17 TYR QB 1.800 . 5.500 3.710 3.088 4.624 . 0 0 "[ . 1 . 2]" 1
597 1 10 LEU MD2 1 30 VAL MG1 1.800 . 5.000 2.254 1.993 2.695 . 0 0 "[ . 1 . 2]" 1
598 1 10 LEU MD2 1 34 VAL MG2 1.800 . 5.000 2.451 1.869 3.327 . 0 0 "[ . 1 . 2]" 1
599 1 10 LEU HG 1 30 VAL MG1 1.800 . 5.500 4.615 4.089 5.188 . 0 0 "[ . 1 . 2]" 1
600 1 15 GLU QB 1 30 VAL MG2 1.800 . 5.500 3.169 1.979 3.824 . 0 0 "[ . 1 . 2]" 1
601 1 13 ILE MD 1 15 GLU QB 1.800 . 5.000 2.588 2.121 3.804 . 0 0 "[ . 1 . 2]" 1
602 1 13 ILE MD 1 15 GLU QG 1.800 . 5.000 3.118 2.273 4.333 . 0 0 "[ . 1 . 2]" 1
603 1 13 ILE MD 1 30 VAL HB 1.800 . 5.500 5.114 4.492 5.534 0.034 7 0 "[ . 1 . 2]" 1
604 1 13 ILE MD 1 30 VAL MG1 1.800 . 5.000 2.640 2.060 3.064 . 0 0 "[ . 1 . 2]" 1
605 1 13 ILE MD 1 30 VAL MG2 1.800 . 5.000 3.622 3.059 4.463 . 0 0 "[ . 1 . 2]" 1
606 1 15 GLU QG 1 30 VAL MG2 1.800 . 5.000 2.414 1.851 4.018 . 0 0 "[ . 1 . 2]" 1
607 1 17 TYR QB 1 24 ILE MG 1.800 . 5.000 2.550 1.936 5.012 0.012 19 0 "[ . 1 . 2]" 1
608 1 17 TYR QB 1 26 LEU MD2 1.800 . 5.000 2.205 1.754 4.034 0.046 10 0 "[ . 1 . 2]" 1
609 1 17 TYR QD 1 19 GLU QB 1.800 . 5.500 2.493 1.860 4.084 . 0 0 "[ . 1 . 2]" 1
610 1 17 TYR QD 1 24 ILE MD 1.800 . 5.500 3.977 3.128 4.575 . 0 0 "[ . 1 . 2]" 1
611 1 17 TYR QD 1 24 ILE QG 1.800 . 5.500 3.777 2.567 5.100 . 0 0 "[ . 1 . 2]" 1
612 1 17 TYR QD 1 24 ILE MG 1.800 . 5.000 2.722 1.801 3.628 . 0 0 "[ . 1 . 2]" 1
613 1 17 TYR QD 1 26 LEU MD2 1.800 . 5.000 3.539 2.375 3.960 . 0 0 "[ . 1 . 2]" 1
614 1 17 TYR QE 1 19 GLU QB 1.800 . 5.500 2.433 1.795 3.445 0.005 9 0 "[ . 1 . 2]" 1
615 1 17 TYR QE 1 19 GLU QG 1.800 . 5.500 3.909 2.822 4.957 . 0 0 "[ . 1 . 2]" 1
616 1 17 TYR QE 1 24 ILE MD 1.800 . 5.500 4.064 1.797 5.500 0.003 5 0 "[ . 1 . 2]" 1
617 1 17 TYR QE 1 24 ILE MG 1.800 . 5.000 4.027 2.430 5.011 0.011 2 0 "[ . 1 . 2]" 1
618 1 18 ILE HB 1 24 ILE MG 1.800 . 5.500 5.023 4.381 5.534 0.034 5 0 "[ . 1 . 2]" 1
619 1 18 ILE HB 1 25 HIS QB 1.800 . 5.000 2.108 1.781 4.686 0.019 9 0 "[ . 1 . 2]" 1
620 1 18 ILE MD 1 25 HIS HB3 1.800 . 5.500 3.620 2.785 5.470 . 0 0 "[ . 1 . 2]" 1
621 1 18 ILE MD 1 25 HIS HB2 1.800 . 5.500 3.336 2.555 4.561 . 0 0 "[ . 1 . 2]" 1
622 1 18 ILE MG 1 20 LEU MD1 1.800 . 5.000 3.266 2.349 5.010 0.010 5 0 "[ . 1 . 2]" 1
623 1 18 ILE MG 1 25 HIS QB 1.800 . 5.000 2.908 1.982 3.358 . 0 0 "[ . 1 . 2]" 1
624 1 18 ILE MG 1 25 HIS HD2 1.800 . 5.000 4.192 3.472 5.001 0.001 11 0 "[ . 1 . 2]" 1
625 1 19 GLU QG 1 24 ILE MD 1.800 . 5.500 3.611 2.813 4.193 . 0 0 "[ . 1 . 2]" 1
626 1 19 GLU QG 1 24 ILE QG 1.800 . 5.500 2.465 1.796 3.000 0.004 8 0 "[ . 1 . 2]" 1
627 1 20 LEU QB 1 23 GLU QB 1.800 . 5.500 2.073 1.765 3.226 0.035 14 0 "[ . 1 . 2]" 1
628 1 20 LEU QB 1 25 HIS HD2 1.800 . 5.000 3.632 2.589 4.802 . 0 0 "[ . 1 . 2]" 1
629 1 20 LEU MD1 1 23 GLU QB 1.800 . 5.500 3.338 2.705 4.778 . 0 0 "[ . 1 . 2]" 1
630 1 20 LEU MD1 1 25 HIS HD2 1.800 . 5.000 3.564 2.510 5.015 0.015 2 0 "[ . 1 . 2]" 1
631 1 22 ASN QB 1 84 VAL MG2 1.800 . 5.000 3.556 2.640 4.708 . 0 0 "[ . 1 . 2]" 1
632 1 22 ASN QB 1 83 ASN QB 1.800 . 5.500 4.472 3.680 5.367 . 0 0 "[ . 1 . 2]" 1
633 1 23 GLU HB3 1 25 HIS HD2 1.800 . 5.000 2.412 1.974 4.275 . 0 0 "[ . 1 . 2]" 1
634 1 23 GLU HB2 1 25 HIS HD2 1.800 . 5.000 3.465 2.845 5.019 0.019 19 0 "[ . 1 . 2]" 1
635 1 23 GLU QB 1 87 VAL MG2 1.800 . 5.000 3.180 2.466 4.598 . 0 0 "[ . 1 . 2]" 1
636 1 23 GLU QG 1 85 ARG QB 1.800 . 5.500 2.603 1.824 4.267 . 0 0 "[ . 1 . 2]" 1
637 1 23 GLU QG 1 87 VAL MG2 1.800 . 5.500 2.870 2.071 3.500 . 0 0 "[ . 1 . 2]" 1
638 1 24 ILE HB 1 26 LEU MD2 1.800 . 5.500 4.610 3.470 5.401 . 0 0 "[ . 1 . 2]" 1
639 1 24 ILE HB 1 86 VAL MG1 1.800 . 5.500 2.723 2.283 3.173 . 0 0 "[ . 1 . 2]" 1
640 1 24 ILE HB 1 86 VAL MG2 1.800 . 5.500 2.103 1.795 3.113 0.005 14 0 "[ . 1 . 2]" 1
641 1 24 ILE MD 1 84 VAL HB 1.800 . 5.500 3.829 3.495 4.205 . 0 0 "[ . 1 . 2]" 1
642 1 24 ILE MD 1 84 VAL MG1 1.800 . 5.000 2.276 1.950 2.539 . 0 0 "[ . 1 . 2]" 1
643 1 24 ILE MD 1 86 VAL MG2 1.800 . 5.000 2.393 1.779 2.998 0.021 19 0 "[ . 1 . 2]" 1
644 1 24 ILE QG 1 84 VAL MG1 1.800 . 5.500 2.052 1.875 2.345 . 0 0 "[ . 1 . 2]" 1
645 1 24 ILE MG 1 26 LEU QB 1.800 . 5.500 3.909 3.501 4.249 . 0 0 "[ . 1 . 2]" 1
646 1 24 ILE MG 1 26 LEU MD2 1.800 . 5.000 2.446 2.001 3.045 . 0 0 "[ . 1 . 2]" 1
647 1 24 ILE MG 1 26 LEU HG 1.800 . 5.500 2.224 1.839 4.305 . 0 0 "[ . 1 . 2]" 1
648 1 24 ILE MG 1 86 VAL MG1 1.800 . 5.000 2.635 2.285 3.055 . 0 0 "[ . 1 . 2]" 1
649 1 24 ILE MG 1 86 VAL MG2 1.800 . 5.000 3.037 2.601 3.434 . 0 0 "[ . 1 . 2]" 1
650 1 25 HIS HD2 1 87 VAL HB 1.800 . 5.000 3.739 3.140 4.618 . 0 0 "[ . 1 . 2]" 1
651 1 25 HIS HD2 1 87 VAL MG2 1.800 . 5.000 3.907 3.442 4.778 . 0 0 "[ . 1 . 2]" 1
652 1 25 HIS HE1 1 87 VAL MG1 1.800 . 5.500 3.107 2.563 4.847 . 0 0 "[ . 1 . 2]" 1
653 1 26 LEU QB 1 31 PHE QB 1.800 . 5.500 2.517 2.100 3.162 . 0 0 "[ . 1 . 2]" 1
654 1 26 LEU QB 1 31 PHE QD 1.800 . 5.500 2.819 2.329 3.485 . 0 0 "[ . 1 . 2]" 1
655 1 26 LEU QB 1 86 VAL MG1 1.800 . 5.500 3.045 2.455 3.661 . 0 0 "[ . 1 . 2]" 1
656 1 26 LEU QB 1 88 THR HB 1.800 . 5.500 4.263 3.264 4.911 . 0 0 "[ . 1 . 2]" 1
657 1 26 LEU QB 1 88 THR MG 1.800 . 5.500 3.800 3.312 4.603 . 0 0 "[ . 1 . 2]" 1
658 1 26 LEU MD1 1 30 VAL HB 1.800 . 5.500 3.583 2.091 4.469 . 0 0 "[ . 1 . 2]" 1
659 1 26 LEU MD1 1 30 VAL MG1 1.800 . 5.000 2.767 2.116 3.545 . 0 0 "[ . 1 . 2]" 1
660 1 26 LEU MD1 1 31 PHE QB 1.800 . 5.500 3.369 2.955 3.940 . 0 0 "[ . 1 . 2]" 1
661 1 26 LEU MD1 1 31 PHE QD 1.800 . 5.000 2.675 1.847 4.023 . 0 0 "[ . 1 . 2]" 1
662 1 26 LEU MD1 1 34 VAL MG1 1.800 . 5.000 3.075 2.446 4.110 . 0 0 "[ . 1 . 2]" 1
663 1 26 LEU MD1 1 34 VAL MG2 1.800 . 5.000 2.428 2.052 2.774 . 0 0 "[ . 1 . 2]" 1
664 1 26 LEU MD1 1 86 VAL MG1 1.800 . 5.000 2.187 1.866 4.000 . 0 0 "[ . 1 . 2]" 1
665 1 26 LEU MD2 1 30 VAL HB 1.800 . 5.500 3.747 2.405 4.880 . 0 0 "[ . 1 . 2]" 1
666 1 26 LEU HG 1 34 VAL MG2 1.800 . 5.500 4.937 2.805 5.496 . 0 0 "[ . 1 . 2]" 1
667 1 26 LEU HG 1 86 VAL MG1 1.800 . 5.500 2.532 2.190 2.943 . 0 0 "[ . 1 . 2]" 1
668 1 27 LYS QB 1 30 VAL MG2 1.800 . 5.000 2.110 1.855 2.611 . 0 0 "[ . 1 . 2]" 1
669 1 27 LYS QD 1 30 VAL MG2 1.800 . 5.000 2.592 1.966 4.053 . 0 0 "[ . 1 . 2]" 1
670 1 27 LYS QG 1 30 VAL MG2 1.800 . 5.000 3.411 2.491 4.150 . 0 0 "[ . 1 . 2]" 1
671 1 27 LYS QD 1 30 VAL HB 1.800 . 5.500 4.334 3.709 5.521 0.021 9 0 "[ . 1 . 2]" 1
672 1 27 LYS QE 1 30 VAL MG2 1.800 . 5.000 3.651 1.916 4.589 . 0 0 "[ . 1 . 2]" 1
673 1 28 PRO QB 1 88 THR MG 1.800 . 5.000 3.294 2.684 3.953 . 0 0 "[ . 1 . 2]" 1
674 1 28 PRO QB 1 89 ASP QB 1.800 . 5.000 4.209 3.487 5.018 0.018 19 0 "[ . 1 . 2]" 1
675 1 28 PRO QB 1 96 ILE MD 1.800 . 5.500 2.136 1.770 3.081 0.030 12 0 "[ . 1 . 2]" 1
676 1 28 PRO QG 1 89 ASP QB 1.800 . 5.500 3.129 2.165 4.317 . 0 0 "[ . 1 . 2]" 1
677 1 28 PRO QG 1 92 GLU QB 1.800 . 5.000 2.369 1.950 3.351 . 0 0 "[ . 1 . 2]" 1
678 1 28 PRO QG 1 96 ILE MD 1.800 . 5.500 3.742 2.958 4.810 . 0 0 "[ . 1 . 2]" 1
679 1 29 GLU HB3 1 96 ILE MD 1.800 . 5.500 3.967 3.418 4.885 . 0 0 "[ . 1 . 2]" 1
680 1 29 GLU HB2 1 96 ILE MD 1.800 . 5.500 3.431 1.983 4.491 . 0 0 "[ . 1 . 2]" 1
681 1 29 GLU QB 1 96 ILE MG 1.800 . 5.500 4.483 3.196 5.501 0.001 10 0 "[ . 1 . 2]" 1
682 1 29 GLU HG3 1 96 ILE MD 1.800 . 5.500 3.332 2.397 4.646 . 0 0 "[ . 1 . 2]" 1
683 1 29 GLU HG2 1 96 ILE MD 1.800 . 5.500 3.758 2.039 5.271 . 0 0 "[ . 1 . 2]" 1
684 1 29 GLU QG 1 96 ILE MG 1.800 . 5.500 3.914 2.860 5.267 . 0 0 "[ . 1 . 2]" 1
685 1 30 VAL MG1 1 33 GLU QB 1.800 . 5.500 3.618 3.237 3.921 . 0 0 "[ . 1 . 2]" 1
686 1 30 VAL MG1 1 33 GLU QG 1.800 . 5.500 4.639 3.819 5.165 . 0 0 "[ . 1 . 2]" 1
687 1 31 PHE QB 1 88 THR MG 1.800 . 5.000 2.348 2.127 2.837 . 0 0 "[ . 1 . 2]" 1
688 1 31 PHE QB 1 88 THR HB 1.800 . 5.500 3.232 2.627 3.810 . 0 0 "[ . 1 . 2]" 1
689 1 31 PHE QD 1 43 LEU MD2 1.800 . 5.000 4.645 4.156 5.035 0.035 19 0 "[ . 1 . 2]" 1
690 1 31 PHE QD 1 76 VAL MG1 1.800 . 5.500 3.884 3.462 4.380 . 0 0 "[ . 1 . 2]" 1
691 1 31 PHE QD 1 86 VAL HB 1.800 . 5.500 4.365 3.905 5.262 . 0 0 "[ . 1 . 2]" 1
692 1 31 PHE QD 1 86 VAL MG1 1.800 . 5.000 2.382 2.045 3.093 . 0 0 "[ . 1 . 2]" 1
693 1 31 PHE QD 1 88 THR HB 1.800 . 5.500 3.239 2.717 3.647 . 0 0 "[ . 1 . 2]" 1
694 1 31 PHE QD 1 88 THR MG 1.800 . 5.000 3.090 2.627 3.601 . 0 0 "[ . 1 . 2]" 1
695 1 31 PHE QD 1 93 PHE QD 1.800 . 5.500 2.659 2.265 3.132 . 0 0 "[ . 1 . 2]" 1
696 1 31 PHE QD 1 93 PHE QE 1.800 . 5.500 2.707 2.216 3.186 . 0 0 "[ . 1 . 2]" 1
697 1 32 TYR QB 1 93 PHE QE 1.800 . 5.500 2.674 1.983 3.895 . 0 0 "[ . 1 . 2]" 1
698 1 32 TYR QB 1 93 PHE QD 1.800 . 5.500 3.172 2.579 3.754 . 0 0 "[ . 1 . 2]" 1
699 1 32 TYR QB 1 96 ILE MD 1.800 . 5.500 3.016 2.233 4.022 . 0 0 "[ . 1 . 2]" 1
700 1 32 TYR QB 1 96 ILE MG 1.800 . 5.500 2.932 2.531 3.380 . 0 0 "[ . 1 . 2]" 1
701 1 32 TYR QD 1 36 LYS QD 1.800 . 5.500 4.443 3.708 5.520 0.020 4 0 "[ . 1 . 2]" 1
702 1 32 TYR QD 1 36 LYS QG 1.800 . 5.500 4.543 4.046 5.499 . 0 0 "[ . 1 . 2]" 1
703 1 32 TYR QD 1 93 PHE QD 1.800 . 5.500 4.076 3.559 4.584 . 0 0 "[ . 1 . 2]" 1
704 1 32 TYR QD 1 93 PHE QE 1.800 . 5.500 2.520 2.029 3.135 . 0 0 "[ . 1 . 2]" 1
705 1 32 TYR QD 1 96 ILE HB 1.800 . 5.500 4.411 3.368 5.362 . 0 0 "[ . 1 . 2]" 1
706 1 32 TYR QD 1 96 ILE MG 1.800 . 5.500 3.314 2.893 3.996 . 0 0 "[ . 1 . 2]" 1
707 1 32 TYR QD 1 97 LEU MD2 1.800 . 5.000 2.706 2.175 3.165 . 0 0 "[ . 1 . 2]" 1
708 1 32 TYR QE 1 100 ARG QB 1.800 . 5.500 4.114 3.382 5.290 . 0 0 "[ . 1 . 2]" 1
709 1 32 TYR QE 1 100 ARG QD 1.800 . 5.500 2.923 2.381 4.185 . 0 0 "[ . 1 . 2]" 1
710 1 32 TYR QE 1 35 TRP HE3 1.800 . 5.500 3.731 2.821 5.133 . 0 0 "[ . 1 . 2]" 1
711 1 32 TYR QE 1 36 LYS QD 1.800 . 5.000 3.737 2.695 4.964 . 0 0 "[ . 1 . 2]" 1
712 1 32 TYR QE 1 36 LYS QE 1.800 . 5.000 3.154 2.457 4.396 . 0 0 "[ . 1 . 2]" 1
713 1 32 TYR QE 1 36 LYS QG 1.800 . 5.000 4.282 3.578 4.985 . 0 0 "[ . 1 . 2]" 1
714 1 32 TYR QE 1 96 ILE MG 1.800 . 5.500 3.774 3.168 4.699 . 0 0 "[ . 1 . 2]" 1
715 1 32 TYR QE 1 97 LEU MD1 1.800 . 5.000 4.248 2.313 5.021 0.021 16 0 "[ . 1 . 2]" 1
716 1 32 TYR QE 1 97 LEU MD2 1.800 . 5.000 2.401 1.800 3.930 . 0 0 "[ . 1 . 2]" 1
717 1 34 VAL HB 1 86 VAL MG1 1.800 . 5.500 4.322 3.627 5.049 . 0 0 "[ . 1 . 2]" 1
718 1 34 VAL MG1 1 38 VAL MG2 1.800 . 5.000 3.202 2.822 3.674 . 0 0 "[ . 1 . 2]" 1
719 1 34 VAL MG1 1 78 PHE QE 1.800 . 5.000 3.225 2.886 3.970 . 0 0 "[ . 1 . 2]" 1
720 1 34 VAL MG1 1 78 PHE HZ 1.800 . 5.000 2.463 1.903 3.319 . 0 0 "[ . 1 . 2]" 1
721 1 34 VAL MG1 1 86 VAL MG1 1.800 . 5.000 3.424 2.704 4.047 . 0 0 "[ . 1 . 2]" 1
722 1 34 VAL MG2 1 37 TYR QB 1.800 . 5.500 3.770 3.583 3.946 . 0 0 "[ . 1 . 2]" 1
723 1 34 VAL MG2 1 37 TYR QD 1.800 . 5.500 4.489 4.044 4.799 . 0 0 "[ . 1 . 2]" 1
724 1 34 VAL MG2 1 78 PHE HZ 1.800 . 5.500 4.724 3.788 5.519 0.019 16 0 "[ . 1 . 2]" 1
725 1 34 VAL MG2 1 86 VAL MG1 1.800 . 5.500 4.236 3.780 4.946 . 0 0 "[ . 1 . 2]" 1
726 1 35 TRP QB 1 78 PHE QE 1.800 . 5.500 4.227 3.056 4.880 . 0 0 "[ . 1 . 2]" 1
727 1 35 TRP HD1 1 38 VAL MG2 1.800 . 5.000 3.533 3.077 4.473 . 0 0 "[ . 1 . 2]" 1
728 1 35 TRP HD1 1 41 PRO HD3 1.800 . 5.000 3.551 3.214 4.055 . 0 0 "[ . 1 . 2]" 1
729 1 35 TRP HD1 1 41 PRO HD2 1.800 . 5.000 2.086 1.859 2.581 . 0 0 "[ . 1 . 2]" 1
730 1 35 TRP HD1 1 41 PRO QG 1.800 . 5.000 3.378 2.519 4.071 . 0 0 "[ . 1 . 2]" 1
731 1 35 TRP HD1 1 43 LEU MD2 1.800 . 5.000 2.374 1.791 3.113 0.009 6 0 "[ . 1 . 2]" 1
732 1 35 TRP HD1 1 78 PHE QD 1.800 . 5.500 4.166 3.345 4.649 . 0 0 "[ . 1 . 2]" 1
733 1 35 TRP HD1 1 78 PHE QE 1.800 . 5.500 4.734 3.895 5.195 . 0 0 "[ . 1 . 2]" 1
734 1 35 TRP HE1 1 41 PRO QG 1.800 . 5.500 3.936 3.322 4.647 . 0 0 "[ . 1 . 2]" 1
735 1 35 TRP HE1 1 41 PRO QD 1.800 . 5.500 2.637 2.430 3.195 . 0 0 "[ . 1 . 2]" 1
736 1 35 TRP HE1 1 43 LEU MD2 1.800 . 5.000 2.936 2.437 3.391 . 0 0 "[ . 1 . 2]" 1
737 1 35 TRP HE1 1 43 LEU MD1 1.800 . 5.000 3.336 2.842 4.248 . 0 0 "[ . 1 . 2]" 1
738 1 35 TRP HE1 1 43 LEU HG 1.800 . 5.000 2.576 2.231 3.324 . 0 0 "[ . 1 . 2]" 1
739 1 35 TRP HE3 1 93 PHE HZ 1.800 . 5.000 3.217 2.351 3.873 . 0 0 "[ . 1 . 2]" 1
740 1 35 TRP HE3 1 93 PHE QE 1.800 . 5.500 3.809 2.904 4.396 . 0 0 "[ . 1 . 2]" 1
741 1 35 TRP HE3 1 97 LEU MD2 1.800 . 5.000 4.087 3.298 4.703 . 0 0 "[ . 1 . 2]" 1
742 1 35 TRP HH2 1 102 THR MG 1.800 . 5.000 3.806 3.151 4.733 . 0 0 "[ . 1 . 2]" 1
743 1 35 TRP HH2 1 40 GLU QB 1.800 . 5.500 4.356 3.409 5.487 . 0 0 "[ . 1 . 2]" 1
744 1 35 TRP HH2 1 97 LEU MD1 1.800 . 5.000 4.429 3.047 5.012 0.012 1 0 "[ . 1 . 2]" 1
745 1 35 TRP HH2 1 97 LEU MD2 1.800 . 5.000 4.228 3.227 5.007 0.007 5 0 "[ . 1 . 2]" 1
746 1 35 TRP HZ2 1 40 GLU QB 1.800 . 5.000 3.655 2.697 4.963 . 0 0 "[ . 1 . 2]" 1
747 1 35 TRP HZ2 1 43 LEU MD2 1.800 . 5.500 4.793 3.677 5.510 0.010 6 0 "[ . 1 . 2]" 1
748 1 35 TRP HZ2 1 43 LEU MD1 1.800 . 5.500 3.810 2.922 4.759 . 0 0 "[ . 1 . 2]" 1
749 1 35 TRP HZ3 1 102 THR MG 1.800 . 5.000 3.420 2.206 4.676 . 0 0 "[ . 1 . 2]" 1
750 1 35 TRP HZ3 1 97 LEU MD1 1.800 . 5.000 4.294 2.460 5.015 0.015 9 0 "[ . 1 . 2]" 1
751 1 35 TRP HZ3 1 97 LEU MD2 1.800 . 5.000 3.271 2.056 4.177 . 0 0 "[ . 1 . 2]" 1
752 1 38 VAL MG2 1 41 PRO QG 1.800 . 5.000 2.449 1.880 3.014 . 0 0 "[ . 1 . 2]" 1
753 1 38 VAL MG2 1 41 PRO QD 1.800 . 5.000 1.879 1.757 2.219 0.043 13 0 "[ . 1 . 2]" 1
754 1 38 VAL MG2 1 78 PHE QD 1.800 . 5.500 3.951 3.448 5.155 . 0 0 "[ . 1 . 2]" 1
755 1 38 VAL MG2 1 78 PHE QE 1.800 . 5.000 3.409 2.799 4.446 . 0 0 "[ . 1 . 2]" 1
756 1 38 VAL MG2 1 78 PHE HZ 1.800 . 5.000 3.711 3.094 4.742 . 0 0 "[ . 1 . 2]" 1
757 1 41 PRO QB 1 78 PHE QB 1.800 . 5.500 3.896 2.355 5.493 . 0 0 "[ . 1 . 2]" 1
758 1 41 PRO QG 1 78 PHE QB 1.800 . 5.000 3.198 2.559 4.135 . 0 0 "[ . 1 . 2]" 1
759 1 41 PRO QG 1 78 PHE QD 1.800 . 5.500 3.782 3.003 4.878 . 0 0 "[ . 1 . 2]" 1
760 1 43 LEU QB 1 76 VAL MG2 1.800 . 5.500 1.925 1.762 2.402 0.038 9 0 "[ . 1 . 2]" 1
761 1 43 LEU MD2 1 76 VAL MG1 1.800 . 5.500 3.791 3.168 4.405 . 0 0 "[ . 1 . 2]" 1
762 1 43 LEU MD2 1 76 VAL MG2 1.800 . 5.000 2.579 2.020 3.284 . 0 0 "[ . 1 . 2]" 1
763 1 43 LEU MD2 1 78 PHE QB 1.800 . 5.000 2.289 1.818 3.395 . 0 0 "[ . 1 . 2]" 1
764 1 43 LEU MD2 1 78 PHE QD 1.800 . 5.000 2.797 2.093 3.636 . 0 0 "[ . 1 . 2]" 1
765 1 43 LEU MD2 1 78 PHE QE 1.800 . 5.000 4.313 3.597 5.014 0.014 5 0 "[ . 1 . 2]" 1
766 1 43 LEU MD1 1 76 VAL MG1 1.800 . 5.000 3.200 2.764 4.106 . 0 0 "[ . 1 . 2]" 1
767 1 43 LEU MD1 1 76 VAL MG2 1.800 . 5.000 2.213 1.840 2.906 . 0 0 "[ . 1 . 2]" 1
768 1 43 LEU MD1 1 93 PHE QE 1.800 . 5.000 2.428 1.786 3.002 0.014 5 0 "[ . 1 . 2]" 1
769 1 43 LEU MD1 1 93 PHE HZ 1.800 . 5.000 2.985 2.499 3.426 . 0 0 "[ . 1 . 2]" 1
770 1 43 LEU HG 1 76 VAL MG2 1.800 . 5.500 4.029 3.848 4.377 . 0 0 "[ . 1 . 2]" 1
771 1 44 LYS HB3 1 77 TYR QE 1.800 . 5.500 3.507 3.006 3.975 . 0 0 "[ . 1 . 2]" 1
772 1 44 LYS HB2 1 77 TYR QE 1.800 . 5.500 3.608 2.749 5.016 . 0 0 "[ . 1 . 2]" 1
773 1 44 LYS QB 1 77 TYR QE 1.800 . 5.000 3.090 2.616 3.681 . 0 0 "[ . 1 . 2]" 1
774 1 44 LYS HD3 1 77 TYR QE 1.800 . 5.500 3.671 2.704 5.235 . 0 0 "[ . 1 . 2]" 1
775 1 44 LYS HD2 1 77 TYR QE 1.800 . 5.500 3.355 2.475 4.688 . 0 0 "[ . 1 . 2]" 1
776 1 44 LYS QD 1 77 TYR QE 1.800 . 5.000 2.953 2.417 4.374 . 0 0 "[ . 1 . 2]" 1
777 1 44 LYS QE 1 77 TYR QE 1.800 . 5.000 4.396 3.069 5.014 0.014 4 0 "[ . 1 . 2]" 1
778 1 45 THR HB 1 74 LYS QD 1.800 . 5.000 3.666 2.262 4.015 . 0 0 "[ . 1 . 2]" 1
779 1 45 THR HB 1 74 LYS QG 1.800 . 5.000 2.374 1.998 2.650 . 0 0 "[ . 1 . 2]" 1
780 1 45 THR HB 1 74 LYS QE 1.800 . 5.000 2.697 1.942 4.503 . 0 0 "[ . 1 . 2]" 1
781 1 45 THR HB 1 76 VAL MG2 1.800 . 5.000 4.501 4.236 4.972 . 0 0 "[ . 1 . 2]" 1
782 1 45 THR MG 1 76 VAL HB 1.800 . 5.500 2.172 1.947 3.139 . 0 0 "[ . 1 . 2]" 1
783 1 45 THR MG 1 90 TYR QB 1.800 . 5.500 3.037 2.416 3.315 . 0 0 "[ . 1 . 2]" 1
784 1 45 THR MG 1 90 TYR QD 1.800 . 5.000 2.851 2.479 3.448 . 0 0 "[ . 1 . 2]" 1
785 1 45 THR MG 1 90 TYR QE 1.800 . 5.000 3.041 2.637 3.716 . 0 0 "[ . 1 . 2]" 1
786 1 46 TYR QB 1 77 TYR QE 1.800 . 5.500 2.111 1.775 2.596 0.025 9 0 "[ . 1 . 2]" 1
787 1 46 TYR QD 1 48 ILE MD 1.800 . 5.500 4.437 3.759 5.060 . 0 0 "[ . 1 . 2]" 1
788 1 46 TYR QD 1 48 ILE MG 1.800 . 5.500 3.554 1.999 4.327 . 0 0 "[ . 1 . 2]" 1
789 1 46 TYR QD 1 75 LYS QB 1.800 . 5.500 3.460 3.276 3.668 . 0 0 "[ . 1 . 2]" 1
790 1 46 TYR QD 1 77 TYR QD 1.800 . 5.500 2.053 1.785 3.687 0.015 16 0 "[ . 1 . 2]" 1
791 1 46 TYR QD 1 77 TYR QE 1.800 . 5.500 2.433 1.968 3.210 . 0 0 "[ . 1 . 2]" 1
792 1 46 TYR QE 1 48 ILE HB 1.800 . 5.500 2.564 1.825 4.943 . 0 0 "[ . 1 . 2]" 1
793 1 46 TYR QE 1 48 ILE MD 1.800 . 5.500 2.896 2.131 4.774 . 0 0 "[ . 1 . 2]" 1
794 1 46 TYR QE 1 48 ILE QG 1.800 . 5.500 3.903 3.192 5.144 . 0 0 "[ . 1 . 2]" 1
795 1 46 TYR QE 1 48 ILE MG 1.800 . 5.500 2.778 1.969 3.444 . 0 0 "[ . 1 . 2]" 1
796 1 46 TYR QE 1 77 TYR QD 1.800 . 5.500 3.015 2.354 5.527 0.027 15 0 "[ . 1 . 2]" 1
797 1 46 TYR QE 1 87 VAL MG1 1.800 . 5.000 2.132 1.793 4.663 0.007 6 0 "[ . 1 . 2]" 1
798 1 46 TYR QE 1 87 VAL MG2 1.800 . 5.000 3.344 2.873 4.710 . 0 0 "[ . 1 . 2]" 1
799 1 47 VAL MG1 1 72 LYS QB 1.800 . 5.000 2.356 1.872 3.755 . 0 0 "[ . 1 . 2]" 1
800 1 47 VAL MG1 1 72 LYS QD 1.800 . 5.000 3.012 1.956 4.012 . 0 0 "[ . 1 . 2]" 1
801 1 47 VAL MG1 1 72 LYS QG 1.800 . 5.000 3.152 2.028 4.547 . 0 0 "[ . 1 . 2]" 1
802 1 47 VAL MG1 1 72 LYS HG2 1.800 . 5.500 3.295 2.159 4.996 . 0 0 "[ . 1 . 2]" 1
803 1 47 VAL MG2 1 74 LYS QB 1.800 . 5.500 2.705 1.898 3.468 . 0 0 "[ . 1 . 2]" 1
804 1 47 VAL MG2 1 74 LYS QD 1.800 . 5.500 3.074 2.296 4.465 . 0 0 "[ . 1 . 2]" 1
805 1 47 VAL MG2 1 74 LYS QE 1.800 . 5.500 3.671 2.476 5.479 . 0 0 "[ . 1 . 2]" 1
806 1 47 VAL MG2 1 74 LYS QG 1.800 . 5.500 2.480 1.786 4.082 0.014 1 0 "[ . 1 . 2]" 1
807 1 48 ILE MD 1 75 LYS QB 1.800 . 5.500 5.018 3.707 5.521 0.021 16 0 "[ . 1 . 2]" 1
808 1 48 ILE MD 1 75 LYS QE 1.800 . 5.500 3.575 1.792 5.064 0.008 5 0 "[ . 1 . 2]" 1
809 1 48 ILE MG 1 75 LYS QB 1.800 . 5.500 3.639 3.022 4.777 . 0 0 "[ . 1 . 2]" 1
810 1 74 LYS QB 1 90 TYR QB 1.800 . 5.000 3.421 2.876 4.036 . 0 0 "[ . 1 . 2]" 1
811 1 74 LYS QB 1 90 TYR QD 1.800 . 5.000 3.160 2.087 3.846 . 0 0 "[ . 1 . 2]" 1
812 1 74 LYS QD 1 90 TYR QE 1.800 . 5.500 3.389 2.327 4.789 . 0 0 "[ . 1 . 2]" 1
813 1 74 LYS QE 1 90 TYR QD 1.800 . 5.500 3.697 1.780 5.315 0.020 3 0 "[ . 1 . 2]" 1
814 1 74 LYS QE 1 90 TYR QE 1.800 . 5.500 3.566 2.086 4.903 . 0 0 "[ . 1 . 2]" 1
815 1 74 LYS QG 1 90 TYR QB 1.800 . 5.000 3.166 2.502 4.109 . 0 0 "[ . 1 . 2]" 1
816 1 75 LYS QB 1 87 VAL MG1 1.800 . 5.000 2.617 2.103 2.839 . 0 0 "[ . 1 . 2]" 1
817 1 75 LYS QD 1 87 VAL MG1 1.800 . 5.000 2.849 2.303 3.235 . 0 0 "[ . 1 . 2]" 1
818 1 76 VAL HB 1 90 TYR QB 1.800 . 5.000 2.325 1.843 2.909 . 0 0 "[ . 1 . 2]" 1
819 1 76 VAL HB 1 90 TYR QD 1.800 . 5.000 2.082 1.788 2.627 0.012 12 0 "[ . 1 . 2]" 1
820 1 76 VAL MG1 1 88 THR MG 1.800 . 5.000 3.106 1.984 3.606 . 0 0 "[ . 1 . 2]" 1
821 1 76 VAL MG1 1 90 TYR QB 1.800 . 5.000 2.673 2.333 3.092 . 0 0 "[ . 1 . 2]" 1
822 1 76 VAL MG1 1 90 TYR QD 1.800 . 5.000 2.461 1.993 2.823 . 0 0 "[ . 1 . 2]" 1
823 1 76 VAL MG1 1 93 PHE QB 1.800 . 5.000 2.801 2.454 3.135 . 0 0 "[ . 1 . 2]" 1
824 1 76 VAL MG1 1 93 PHE QD 1.800 . 5.500 3.064 2.736 3.495 . 0 0 "[ . 1 . 2]" 1
825 1 76 VAL MG1 1 93 PHE QE 1.800 . 5.500 4.054 3.754 4.411 . 0 0 "[ . 1 . 2]" 1
826 1 76 VAL MG2 1 88 THR MG 1.800 . 5.500 5.053 3.725 5.520 0.020 14 0 "[ . 1 . 2]" 1
827 1 76 VAL MG2 1 90 TYR QD 1.800 . 5.000 2.920 2.566 3.286 . 0 0 "[ . 1 . 2]" 1
828 1 76 VAL MG2 1 90 TYR QE 1.800 . 5.000 3.577 3.155 4.010 . 0 0 "[ . 1 . 2]" 1
829 1 76 VAL MG2 1 93 PHE QD 1.800 . 5.500 3.933 3.278 4.450 . 0 0 "[ . 1 . 2]" 1
830 1 76 VAL MG2 1 93 PHE QE 1.800 . 5.500 4.049 3.324 4.693 . 0 0 "[ . 1 . 2]" 1
831 1 77 TYR QB 1 87 VAL MG1 1.800 . 5.500 2.356 1.990 2.566 . 0 0 "[ . 1 . 2]" 1
832 1 77 TYR QB 1 87 VAL MG2 1.800 . 5.000 1.901 1.791 2.072 0.009 3 0 "[ . 1 . 2]" 1
833 1 77 TYR QD 1 79 GLU QG 1.800 . 5.500 3.091 2.506 4.767 . 0 0 "[ . 1 . 2]" 1
834 1 77 TYR QD 1 85 ARG QB 1.800 . 5.000 2.612 2.008 3.335 . 0 0 "[ . 1 . 2]" 1
835 1 77 TYR QD 1 85 ARG QD 1.800 . 5.500 3.483 2.654 4.873 . 0 0 "[ . 1 . 2]" 1
836 1 77 TYR QD 1 85 ARG QG 1.800 . 5.500 3.082 2.422 3.843 . 0 0 "[ . 1 . 2]" 1
837 1 77 TYR QD 1 87 VAL MG1 1.800 . 5.500 3.345 2.891 3.754 . 0 0 "[ . 1 . 2]" 1
838 1 77 TYR QD 1 87 VAL MG2 1.800 . 5.000 3.298 2.987 3.570 . 0 0 "[ . 1 . 2]" 1
839 1 77 TYR QE 1 79 GLU QB 1.800 . 5.000 4.084 2.163 4.992 . 0 0 "[ . 1 . 2]" 1
840 1 77 TYR QE 1 79 GLU QG 1.800 . 5.000 2.797 2.043 4.723 . 0 0 "[ . 1 . 2]" 1
841 1 77 TYR QE 1 85 ARG QB 1.800 . 5.500 3.854 3.099 4.598 . 0 0 "[ . 1 . 2]" 1
842 1 77 TYR QE 1 85 ARG QD 1.800 . 5.500 3.127 2.242 5.212 . 0 0 "[ . 1 . 2]" 1
843 1 77 TYR QE 1 85 ARG QG 1.800 . 5.500 3.239 2.460 4.763 . 0 0 "[ . 1 . 2]" 1
844 1 78 PHE QD 1 80 THR MG 1.800 . 5.500 3.265 2.670 3.493 . 0 0 "[ . 1 . 2]" 1
845 1 78 PHE QD 1 86 VAL HB 1.800 . 5.500 3.317 3.116 3.498 . 0 0 "[ . 1 . 2]" 1
846 1 78 PHE QD 1 86 VAL MG1 1.800 . 5.000 3.865 3.708 4.103 . 0 0 "[ . 1 . 2]" 1
847 1 78 PHE QD 1 86 VAL MG2 1.800 . 5.500 3.874 3.658 4.051 . 0 0 "[ . 1 . 2]" 1
848 1 78 PHE QE 1 86 VAL HB 1.800 . 5.000 2.986 2.758 3.191 . 0 0 "[ . 1 . 2]" 1
849 1 78 PHE QE 1 86 VAL MG1 1.800 . 5.000 2.680 2.554 2.901 . 0 0 "[ . 1 . 2]" 1
850 1 78 PHE QE 1 86 VAL MG2 1.800 . 5.000 3.008 2.734 3.113 . 0 0 "[ . 1 . 2]" 1
851 1 78 PHE HZ 1 86 VAL HB 1.800 . 5.000 3.529 3.275 3.825 . 0 0 "[ . 1 . 2]" 1
852 1 78 PHE HZ 1 86 VAL MG1 1.800 . 5.000 3.067 2.642 3.469 . 0 0 "[ . 1 . 2]" 1
853 1 78 PHE HZ 1 86 VAL MG2 1.800 . 5.000 2.741 2.590 3.006 . 0 0 "[ . 1 . 2]" 1
854 1 79 GLU QG 1 85 ARG QG 1.800 . 5.000 2.156 1.761 4.174 0.039 5 0 "[ . 1 . 2]" 1
855 1 80 THR HG1 1 84 VAL MG2 1.800 . 5.500 3.290 2.918 3.908 . 0 0 "[ . 1 . 2]" 1
856 1 80 THR MG 1 84 VAL HB 1.800 . 5.500 3.322 2.895 4.111 . 0 0 "[ . 1 . 2]" 1
857 1 80 THR MG 1 84 VAL MG1 1.800 . 5.000 3.777 3.380 4.562 . 0 0 "[ . 1 . 2]" 1
858 1 80 THR MG 1 86 VAL MG2 1.800 . 5.000 2.658 2.292 3.502 . 0 0 "[ . 1 . 2]" 1
859 1 82 ASP QB 1 84 VAL MG2 1.800 . 5.500 2.328 1.773 3.544 0.027 3 0 "[ . 1 . 2]" 1
860 1 84 VAL HB 1 86 VAL MG2 1.800 . 5.500 4.146 3.753 4.583 . 0 0 "[ . 1 . 2]" 1
861 1 84 VAL MG1 1 86 VAL MG2 1.800 . 5.500 3.025 2.603 3.447 . 0 0 "[ . 1 . 2]" 1
862 1 85 ARG HB3 1 87 VAL MG2 1.800 . 5.000 2.847 2.301 4.367 . 0 0 "[ . 1 . 2]" 1
863 1 85 ARG HB2 1 87 VAL MG2 1.800 . 5.000 3.070 2.570 3.503 . 0 0 "[ . 1 . 2]" 1
864 1 85 ARG QD 1 87 VAL MG2 1.800 . 5.000 3.849 2.879 4.837 . 0 0 "[ . 1 . 2]" 1
865 1 85 ARG QG 1 87 VAL MG2 1.800 . 5.500 4.142 2.192 4.784 . 0 0 "[ . 1 . 2]" 1
866 1 86 VAL MG1 1 88 THR MG 1.800 . 5.500 4.837 4.253 5.181 . 0 0 "[ . 1 . 2]" 1
867 1 88 THR MG 1 93 PHE QB 1.800 . 5.000 2.963 2.449 3.382 . 0 0 "[ . 1 . 2]" 1
868 1 88 THR MG 1 93 PHE QD 1.800 . 5.000 3.706 3.147 4.154 . 0 0 "[ . 1 . 2]" 1
869 1 89 ASP QB 1 92 GLU HB3 1.800 . 5.000 3.932 2.254 5.004 0.004 20 0 "[ . 1 . 2]" 1
870 1 89 ASP QB 1 92 GLU HB2 1.800 . 5.000 2.751 2.196 3.716 . 0 0 "[ . 1 . 2]" 1
871 1 90 TYR QD 1 94 GLN QG 1.800 . 5.000 3.389 3.142 4.081 . 0 0 "[ . 1 . 2]" 1
872 1 90 TYR QE 1 94 GLN QG 1.800 . 5.000 3.113 2.721 4.428 . 0 0 "[ . 1 . 2]" 1
873 1 92 GLU QG 1 95 LYS QB 1.800 . 5.500 4.095 3.188 5.311 . 0 0 "[ . 1 . 2]" 1
874 1 92 GLU QG 1 96 ILE MD 1.800 . 5.500 4.893 2.580 5.516 0.016 18 0 "[ . 1 . 2]" 1
875 1 93 PHE QD 1 96 ILE MD 1.800 . 5.500 3.396 2.601 4.230 . 0 0 "[ . 1 . 2]" 1
876 1 93 PHE QD 1 96 ILE MG 1.800 . 5.500 4.628 4.238 5.217 . 0 0 "[ . 1 . 2]" 1
877 1 93 PHE QD 1 97 LEU MD2 1.800 . 5.000 3.983 3.130 4.576 . 0 0 "[ . 1 . 2]" 1
878 1 93 PHE QE 1 97 LEU MD2 1.800 . 5.000 3.183 2.808 3.756 . 0 0 "[ . 1 . 2]" 1
879 1 93 PHE HZ 1 97 LEU MD2 1.800 . 5.000 3.060 2.651 3.692 . 0 0 "[ . 1 . 2]" 1
880 1 94 GLN QB 1 97 LEU QB 1.800 . 5.500 3.834 3.121 4.357 . 0 0 "[ . 1 . 2]" 1
881 1 96 ILE MG 1 100 ARG QD 1.800 . 5.500 3.600 2.316 4.802 . 0 0 "[ . 1 . 2]" 1
882 1 96 ILE MG 1 100 ARG QG 1.800 . 5.500 3.872 2.188 5.518 0.018 4 0 "[ . 1 . 2]" 1
883 1 96 ILE MG 1 99 LYS QB 1.800 . 5.500 3.210 2.795 4.933 . 0 0 "[ . 1 . 2]" 1
884 1 97 LEU MD1 1 102 THR MG 1.800 . 5.000 3.471 2.311 4.493 . 0 0 "[ . 1 . 2]" 1
885 1 97 LEU MD2 1 102 THR HB 1.800 . 5.000 2.896 1.990 4.572 . 0 0 "[ . 1 . 2]" 1
886 1 97 LEU MD2 1 102 THR MG 1.800 . 5.000 2.920 2.305 4.688 . 0 0 "[ . 1 . 2]" 1
887 1 1 MET HA 1 1 MET ME 1.800 . 5.500 4.784 3.980 5.403 . 0 0 "[ . 1 . 2]" 1
888 1 1 MET ME 1 1 MET QG 1.800 . 5.500 2.326 2.212 2.554 . 0 0 "[ . 1 . 2]" 1
889 1 4 GLU H 1 4 GLU QG 1.800 . 5.500 3.934 3.427 4.040 . 0 0 "[ . 1 . 2]" 1
890 1 5 VAL H 1 5 VAL HB 1.800 . 3.500 2.551 2.449 2.639 . 0 0 "[ . 1 . 2]" 1
891 1 5 VAL H 1 5 VAL MG1 1.800 . 5.500 3.766 3.751 3.776 . 0 0 "[ . 1 . 2]" 1
892 1 5 VAL H 1 5 VAL MG2 1.800 . 5.500 2.034 1.861 2.192 . 0 0 "[ . 1 . 2]" 1
893 1 6 ILE HA 1 6 ILE MD 1.800 . 5.500 3.841 3.801 3.873 . 0 0 "[ . 1 . 2]" 1
894 1 6 ILE HG13 1 6 ILE MG 1.800 . 5.500 3.205 3.201 3.208 . 0 0 "[ . 1 . 2]" 1
895 1 6 ILE HG12 1 6 ILE MG 1.800 . 5.500 2.386 2.365 2.415 . 0 0 "[ . 1 . 2]" 1
896 1 6 ILE H 1 6 ILE HB 1.800 . 3.500 2.580 2.545 2.637 . 0 0 "[ . 1 . 2]" 1
897 1 6 ILE H 1 6 ILE MD 1.800 . 5.500 3.547 3.482 3.610 . 0 0 "[ . 1 . 2]" 1
898 1 7 LYS H 1 7 LYS QD 1.800 . 5.500 3.761 3.516 3.887 . 0 0 "[ . 1 . 2]" 1
899 1 7 LYS H 1 7 LYS QE 1.800 . 5.500 4.467 3.960 5.234 . 0 0 "[ . 1 . 2]" 1
900 1 7 LYS H 1 7 LYS QG 1.800 . 5.000 2.235 1.898 2.626 . 0 0 "[ . 1 . 2]" 1
901 1 8 GLU H 1 8 GLU QG 1.800 . 5.500 2.442 1.971 4.050 . 0 0 "[ . 1 . 2]" 1
902 1 9 PHE HA 1 9 PHE QD 1.800 . 5.500 2.643 2.490 2.794 . 0 0 "[ . 1 . 2]" 1
903 1 9 PHE H 1 9 PHE QD 1.800 . 5.500 4.183 4.171 4.194 . 0 0 "[ . 1 . 2]" 1
904 1 10 LEU HA 1 10 LEU MD2 1.800 . 5.500 2.011 1.926 2.116 . 0 0 "[ . 1 . 2]" 1
905 1 10 LEU H 1 10 LEU MD1 1.800 . 5.500 3.573 3.430 3.713 . 0 0 "[ . 1 . 2]" 1
906 1 10 LEU H 1 10 LEU MD2 1.800 . 5.500 3.327 3.235 3.397 . 0 0 "[ . 1 . 2]" 1
907 1 10 LEU H 1 10 LEU HG 1.800 . 5.000 2.252 2.103 2.415 . 0 0 "[ . 1 . 2]" 1
908 1 11 GLU H 1 11 GLU QB 1.800 . 3.900 2.315 2.213 2.489 . 0 0 "[ . 1 . 2]" 1
909 1 11 GLU H 1 11 GLU QG 1.800 . 5.000 3.245 2.128 4.030 . 0 0 "[ . 1 . 2]" 1
910 1 12 ASP H 1 12 ASP QB 1.800 . 3.500 2.257 2.221 2.289 . 0 0 "[ . 1 . 2]" 1
911 1 13 ILE HA 1 13 ILE MD 1.800 . 5.500 4.135 3.821 4.192 . 0 0 "[ . 1 . 2]" 1
912 1 13 ILE H 1 13 ILE MD 1.800 . 5.500 3.650 3.550 3.708 . 0 0 "[ . 1 . 2]" 1
913 1 13 ILE H 1 13 ILE QG 1.800 . 5.000 2.017 1.847 2.203 . 0 0 "[ . 1 . 2]" 1
914 1 16 ASP H 1 16 ASP QB 1.800 . 3.500 2.432 2.261 2.847 . 0 0 "[ . 1 . 2]" 1
915 1 17 TYR HA 1 17 TYR QD 1.800 . 5.500 3.645 2.706 3.769 . 0 0 "[ . 1 . 2]" 1
916 1 17 TYR H 1 17 TYR QD 1.800 . 5.500 2.840 2.148 4.289 . 0 0 "[ . 1 . 2]" 1
917 1 18 ILE HA 1 18 ILE MD 1.800 . 5.500 3.763 2.040 3.880 . 0 0 "[ . 1 . 2]" 1
918 1 18 ILE HG13 1 18 ILE MG 1.800 . 5.500 3.162 2.347 3.210 . 0 0 "[ . 1 . 2]" 1
919 1 18 ILE HG12 1 18 ILE MG 1.800 . 5.500 2.419 2.356 3.203 . 0 0 "[ . 1 . 2]" 1
920 1 18 ILE H 1 18 ILE HB 1.800 . 3.500 2.611 2.496 3.205 . 0 0 "[ . 1 . 2]" 1
921 1 18 ILE H 1 18 ILE MD 1.800 . 5.500 3.787 3.448 4.772 . 0 0 "[ . 1 . 2]" 1
922 1 18 ILE H 1 18 ILE QG 1.800 . 5.000 2.464 2.168 4.110 . 0 0 "[ . 1 . 2]" 1
923 1 19 GLU H 1 19 GLU QB 1.800 . 3.500 2.366 2.281 2.582 . 0 0 "[ . 1 . 2]" 1
924 1 20 LEU HA 1 20 LEU MD2 1.800 . 5.500 2.279 2.002 3.882 . 0 0 "[ . 1 . 2]" 1
925 1 20 LEU QB 1 20 LEU MD1 1.800 . 5.500 2.127 2.076 2.380 . 0 0 "[ . 1 . 2]" 1
926 1 20 LEU QB 1 20 LEU MD2 1.800 . 5.500 2.293 2.090 2.340 . 0 0 "[ . 1 . 2]" 1
927 1 20 LEU H 1 20 LEU MD1 1.800 . 5.500 3.945 3.623 4.336 . 0 0 "[ . 1 . 2]" 1
928 1 20 LEU H 1 20 LEU MD2 1.800 . 5.500 3.643 2.279 4.603 . 0 0 "[ . 1 . 2]" 1
929 1 20 LEU H 1 20 LEU HG 1.800 . 5.000 3.037 2.355 4.585 . 0 0 "[ . 1 . 2]" 1
930 1 21 GLU H 1 21 GLU QG 1.800 . 5.500 2.928 2.043 4.229 . 0 0 "[ . 1 . 2]" 1
931 1 22 ASN H 1 22 ASN HA 1.800 . 2.900 2.262 2.247 2.274 . 0 0 "[ . 1 . 2]" 1
932 1 22 ASN H 1 22 ASN QD 1.800 . 5.500 3.995 2.191 4.846 . 0 0 "[ . 1 . 2]" 1
933 1 23 GLU H 1 23 GLU QG 1.800 . 5.000 3.360 2.995 4.062 . 0 0 "[ . 1 . 2]" 1
934 1 24 ILE H 1 24 ILE MD 1.800 . 5.500 3.966 3.631 4.304 . 0 0 "[ . 1 . 2]" 1
935 1 24 ILE H 1 24 ILE QG 1.800 . 5.500 2.659 2.173 3.099 . 0 0 "[ . 1 . 2]" 1
936 1 25 HIS H 1 25 HIS HD2 1.800 . 5.000 2.759 2.525 3.203 . 0 0 "[ . 1 . 2]" 1
937 1 26 LEU HA 1 26 LEU MD1 1.800 . 5.500 3.738 2.121 3.856 . 0 0 "[ . 1 . 2]" 1
938 1 26 LEU HA 1 26 LEU MD2 1.800 . 4.000 1.925 1.841 2.041 . 0 0 "[ . 1 . 2]" 1
939 1 26 LEU H 1 26 LEU MD1 1.800 . 5.500 4.075 3.915 4.311 . 0 0 "[ . 1 . 2]" 1
940 1 26 LEU H 1 26 LEU MD2 1.800 . 5.500 3.794 3.387 4.103 . 0 0 "[ . 1 . 2]" 1
941 1 26 LEU H 1 26 LEU HG 1.800 . 5.000 3.167 2.880 4.552 . 0 0 "[ . 1 . 2]" 1
942 1 27 LYS QB 1 27 LYS QD 1.800 . 5.500 2.156 2.091 2.347 . 0 0 "[ . 1 . 2]" 1
943 1 27 LYS QB 1 27 LYS QE 1.800 . 5.500 3.186 1.870 3.657 . 0 0 "[ . 1 . 2]" 1
944 1 27 LYS H 1 27 LYS QD 1.800 . 5.000 3.848 3.410 4.367 . 0 0 "[ . 1 . 2]" 1
945 1 27 LYS H 1 27 LYS QG 1.800 . 5.500 2.417 1.902 3.981 . 0 0 "[ . 1 . 2]" 1
946 1 29 GLU H 1 29 GLU QB 1.800 . 3.500 2.337 2.202 2.662 . 0 0 "[ . 1 . 2]" 1
947 1 29 GLU H 1 29 GLU QG 1.800 . 5.000 3.275 1.796 4.033 0.004 17 0 "[ . 1 . 2]" 1
948 1 30 VAL H 1 30 VAL HB 1.800 . 3.500 2.572 2.504 2.629 . 0 0 "[ . 1 . 2]" 1
949 1 30 VAL H 1 30 VAL MG1 1.800 . 5.500 3.778 3.760 3.802 . 0 0 "[ . 1 . 2]" 1
950 1 30 VAL H 1 30 VAL MG2 1.800 . 5.500 2.075 1.925 2.378 . 0 0 "[ . 1 . 2]" 1
951 1 31 PHE HA 1 31 PHE QD 1.800 . 5.500 2.801 2.596 3.039 . 0 0 "[ . 1 . 2]" 1
952 1 31 PHE H 1 31 PHE QD 1.800 . 5.500 4.172 4.153 4.187 . 0 0 "[ . 1 . 2]" 1
953 1 32 TYR H 1 32 TYR QD 1.800 . 5.500 4.162 4.008 4.202 . 0 0 "[ . 1 . 2]" 1
954 1 33 GLU H 1 33 GLU QG 1.800 . 5.000 2.502 2.213 3.985 . 0 0 "[ . 1 . 2]" 1
955 1 34 VAL H 1 34 VAL HB 1.800 . 3.500 2.552 2.516 2.618 . 0 0 "[ . 1 . 2]" 1
956 1 34 VAL H 1 34 VAL MG1 1.800 . 5.500 3.782 3.770 3.812 . 0 0 "[ . 1 . 2]" 1
957 1 34 VAL H 1 34 VAL MG2 1.800 . 5.500 2.106 1.971 2.371 . 0 0 "[ . 1 . 2]" 1
958 1 35 TRP HA 1 35 TRP HD1 1.800 . 5.000 2.610 2.406 2.819 . 0 0 "[ . 1 . 2]" 1
959 1 35 TRP QB 1 35 TRP HZ3 1.800 . 5.500 4.630 4.614 4.658 . 0 0 "[ . 1 . 2]" 1
960 1 35 TRP H 1 35 TRP HE3 1.800 . 5.000 4.757 4.547 4.968 . 0 0 "[ . 1 . 2]" 1
961 1 36 LYS HA 1 36 LYS QD 1.800 . 5.000 3.819 1.965 4.193 . 0 0 "[ . 1 . 2]" 1
962 1 36 LYS HB3 1 36 LYS QE 1.800 . 5.500 3.958 1.846 4.503 . 0 0 "[ . 1 . 2]" 1
963 1 36 LYS HB2 1 36 LYS QE 1.800 . 5.500 3.980 2.922 4.251 . 0 0 "[ . 1 . 2]" 1
964 1 36 LYS QE 1 36 LYS HG3 1.800 . 5.500 2.587 2.296 3.388 . 0 0 "[ . 1 . 2]" 1
965 1 36 LYS QE 1 36 LYS HG2 1.800 . 5.500 2.646 2.303 3.020 . 0 0 "[ . 1 . 2]" 1
966 1 36 LYS H 1 36 LYS QD 1.800 . 5.000 3.831 2.557 4.348 . 0 0 "[ . 1 . 2]" 1
967 1 36 LYS H 1 36 LYS QG 1.800 . 5.500 2.587 1.975 3.965 . 0 0 "[ . 1 . 2]" 1
968 1 37 TYR HA 1 37 TYR QD 1.800 . 5.500 2.733 2.208 3.174 . 0 0 "[ . 1 . 2]" 1
969 1 37 TYR HA 1 37 TYR QE 1.800 . 5.500 4.654 4.460 4.779 . 0 0 "[ . 1 . 2]" 1
970 1 37 TYR H 1 37 TYR QD 1.800 . 5.500 4.184 4.089 4.217 . 0 0 "[ . 1 . 2]" 1
971 1 38 VAL HA 1 38 VAL MG1 1.800 . 3.500 2.323 2.181 2.405 . 0 0 "[ . 1 . 2]" 1
972 1 38 VAL H 1 38 VAL MG1 1.800 . 5.500 2.446 2.172 3.025 . 0 0 "[ . 1 . 2]" 1
973 1 38 VAL H 1 38 VAL MG2 1.800 . 5.500 1.973 1.798 2.155 0.002 15 0 "[ . 1 . 2]" 1
974 1 40 GLU H 1 40 GLU QG 1.800 . 5.000 3.375 2.655 4.201 . 0 0 "[ . 1 . 2]" 1
975 1 43 LEU HA 1 43 LEU MD2 1.800 . 3.500 1.994 1.893 2.119 . 0 0 "[ . 1 . 2]" 1
976 1 43 LEU H 1 43 LEU MD1 1.800 . 5.500 3.767 3.501 3.988 . 0 0 "[ . 1 . 2]" 1
977 1 43 LEU H 1 43 LEU HG 1.800 . 5.000 2.646 2.231 3.036 . 0 0 "[ . 1 . 2]" 1
978 1 44 LYS QB 1 44 LYS QD 1.800 . 5.500 2.134 2.082 2.388 . 0 0 "[ . 1 . 2]" 1
979 1 44 LYS QB 1 44 LYS QE 1.800 . 5.500 3.617 3.518 3.764 . 0 0 "[ . 1 . 2]" 1
980 1 44 LYS H 1 44 LYS QG 1.800 . 5.500 2.962 2.298 4.070 . 0 0 "[ . 1 . 2]" 1
981 1 45 THR H 1 45 THR MG 1.800 . 5.500 2.931 2.602 3.308 . 0 0 "[ . 1 . 2]" 1
982 1 46 TYR HA 1 46 TYR QD 1.800 . 5.500 3.694 2.659 3.765 . 0 0 "[ . 1 . 2]" 1
983 1 46 TYR H 1 46 TYR QD 1.800 . 5.500 2.441 2.054 4.339 . 0 0 "[ . 1 . 2]" 1
984 1 47 VAL H 1 47 VAL HB 1.800 . 3.500 2.602 2.500 2.995 . 0 0 "[ . 1 . 2]" 1
985 1 47 VAL H 1 47 VAL MG1 1.800 . 5.500 3.730 1.937 3.858 . 0 0 "[ . 1 . 2]" 1
986 1 47 VAL H 1 47 VAL MG2 1.800 . 5.500 2.524 2.316 3.817 . 0 0 "[ . 1 . 2]" 1
987 1 48 ILE H 1 48 ILE MD 1.800 . 5.500 4.453 3.698 4.679 . 0 0 "[ . 1 . 2]" 1
988 1 48 ILE H 1 48 ILE QG 1.800 . 5.000 3.703 1.961 4.045 . 0 0 "[ . 1 . 2]" 1
989 1 66 THR H 1 66 THR MG 1.800 . 5.500 3.222 1.985 3.941 . 0 0 "[ . 1 . 2]" 1
990 1 72 LYS QB 1 72 LYS QD 1.800 . 5.500 2.123 2.097 2.153 . 0 0 "[ . 1 . 2]" 1
991 1 72 LYS H 1 72 LYS QD 1.800 . 5.500 3.914 3.679 4.345 . 0 0 "[ . 1 . 2]" 1
992 1 72 LYS H 1 72 LYS QG 1.800 . 5.000 2.481 1.852 3.940 . 0 0 "[ . 1 . 2]" 1
993 1 74 LYS HB3 1 74 LYS QE 1.800 . 5.500 3.709 1.871 4.243 . 0 0 "[ . 1 . 2]" 1
994 1 74 LYS HB2 1 74 LYS QE 1.800 . 5.500 3.790 2.503 4.217 . 0 0 "[ . 1 . 2]" 1
995 1 74 LYS QB 1 74 LYS QD 1.800 . 5.500 2.139 2.076 2.346 . 0 0 "[ . 1 . 2]" 1
996 1 74 LYS H 1 74 LYS QD 1.800 . 5.500 4.519 4.347 5.067 . 0 0 "[ . 1 . 2]" 1
997 1 74 LYS H 1 74 LYS QG 1.800 . 5.500 4.014 3.978 4.071 . 0 0 "[ . 1 . 2]" 1
998 1 75 LYS HA 1 75 LYS QD 1.800 . 5.500 3.879 2.100 4.074 . 0 0 "[ . 1 . 2]" 1
999 1 75 LYS QB 1 75 LYS QD 1.800 . 5.000 2.140 2.112 2.310 . 0 0 "[ . 1 . 2]" 1
1000 1 76 VAL H 1 76 VAL MG1 1.800 . 5.500 2.141 2.073 2.225 . 0 0 "[ . 1 . 2]" 1
1001 1 76 VAL H 1 76 VAL MG2 1.800 . 5.500 3.895 3.871 3.925 . 0 0 "[ . 1 . 2]" 1
1002 1 77 TYR HA 1 77 TYR QD 1.800 . 5.500 3.753 3.742 3.759 . 0 0 "[ . 1 . 2]" 1
1003 1 77 TYR H 1 77 TYR QD 1.800 . 5.500 2.920 2.535 3.212 . 0 0 "[ . 1 . 2]" 1
1004 1 77 TYR H 1 77 TYR QE 1.800 . 5.500 4.436 4.282 4.668 . 0 0 "[ . 1 . 2]" 1
1005 1 78 PHE HA 1 78 PHE QD 1.800 . 5.500 3.749 3.741 3.756 . 0 0 "[ . 1 . 2]" 1
1006 1 78 PHE H 1 78 PHE QD 1.800 . 5.500 2.818 2.631 2.980 . 0 0 "[ . 1 . 2]" 1
1007 1 79 GLU H 1 79 GLU QB 1.800 . 3.500 2.496 2.360 2.593 . 0 0 "[ . 1 . 2]" 1
1008 1 79 GLU H 1 79 GLU QG 1.800 . 5.500 2.822 2.363 4.080 . 0 0 "[ . 1 . 2]" 1
1009 1 80 THR HG1 1 80 THR MG 1.800 . 5.500 2.444 2.125 2.826 . 0 0 "[ . 1 . 2]" 1
1010 1 80 THR H 1 80 THR HG1 1.800 . 5.000 3.228 2.138 3.620 . 0 0 "[ . 1 . 2]" 1
1011 1 80 THR H 1 80 THR MG 1.800 . 5.500 2.459 2.263 2.806 . 0 0 "[ . 1 . 2]" 1
1012 1 81 LEU HA 1 81 LEU MD1 1.800 . 5.500 2.835 1.935 4.021 . 0 0 "[ . 1 . 2]" 1
1013 1 81 LEU HA 1 81 LEU MD2 1.800 . 5.500 3.605 1.847 3.891 . 0 0 "[ . 1 . 2]" 1
1014 1 81 LEU H 1 81 LEU MD1 1.800 . 5.500 2.445 1.794 4.294 0.006 5 0 "[ . 1 . 2]" 1
1015 1 81 LEU H 1 81 LEU MD2 1.800 . 5.500 3.766 1.774 4.269 0.026 8 0 "[ . 1 . 2]" 1
1016 1 81 LEU H 1 81 LEU HG 1.800 . 5.000 3.707 2.833 4.505 . 0 0 "[ . 1 . 2]" 1
1017 1 83 ASN HA 1 83 ASN QD 1.800 . 5.000 3.245 1.754 4.062 0.046 5 0 "[ . 1 . 2]" 1
1018 1 83 ASN H 1 83 ASN HA 1.800 . 2.900 2.265 2.246 2.275 . 0 0 "[ . 1 . 2]" 1
1019 1 84 VAL H 1 84 VAL HB 1.800 . 3.500 2.510 2.405 2.586 . 0 0 "[ . 1 . 2]" 1
1020 1 84 VAL H 1 84 VAL MG1 1.800 . 5.500 3.789 3.742 3.824 . 0 0 "[ . 1 . 2]" 1
1021 1 84 VAL H 1 84 VAL MG2 1.800 . 5.500 2.433 2.116 2.718 . 0 0 "[ . 1 . 2]" 1
1022 1 85 ARG H 1 85 ARG QG 1.800 . 5.000 2.620 2.104 3.584 . 0 0 "[ . 1 . 2]" 1
1023 1 86 VAL H 1 86 VAL MG1 1.800 . 5.500 3.799 3.783 3.831 . 0 0 "[ . 1 . 2]" 1
1024 1 86 VAL H 1 86 VAL MG2 1.800 . 5.500 2.277 2.172 2.442 . 0 0 "[ . 1 . 2]" 1
1025 1 87 VAL H 1 87 VAL HB 1.800 . 3.500 2.647 2.602 2.769 . 0 0 "[ . 1 . 2]" 1
1026 1 87 VAL H 1 87 VAL MG1 1.800 . 5.500 3.853 3.833 3.905 . 0 0 "[ . 1 . 2]" 1
1027 1 87 VAL H 1 87 VAL MG2 1.800 . 5.500 2.402 2.296 2.540 . 0 0 "[ . 1 . 2]" 1
1028 1 88 THR HG1 1 88 THR MG 1.800 . 5.500 2.928 2.844 3.028 . 0 0 "[ . 1 . 2]" 1
1029 1 88 THR H 1 88 THR HG1 1.800 . 5.000 3.572 2.953 4.817 . 0 0 "[ . 1 . 2]" 1
1030 1 88 THR H 1 88 THR MG 1.800 . 5.500 3.602 2.475 3.978 . 0 0 "[ . 1 . 2]" 1
1031 1 90 TYR HA 1 90 TYR QD 1.800 . 5.500 2.512 2.002 2.979 . 0 0 "[ . 1 . 2]" 1
1032 1 92 GLU H 1 92 GLU QG 1.800 . 5.000 2.722 2.114 4.057 . 0 0 "[ . 1 . 2]" 1
1033 1 93 PHE HA 1 93 PHE QD 1.800 . 5.500 2.477 2.293 2.597 . 0 0 "[ . 1 . 2]" 1
1034 1 93 PHE H 1 93 PHE QD 1.800 . 5.500 4.186 4.148 4.212 . 0 0 "[ . 1 . 2]" 1
1035 1 94 GLN H 1 94 GLN QG 1.800 . 5.000 2.508 2.102 2.861 . 0 0 "[ . 1 . 2]" 1
1036 1 95 LYS HA 1 95 LYS QD 1.800 . 5.500 3.812 2.107 4.255 . 0 0 "[ . 1 . 2]" 1
1037 1 95 LYS QB 1 95 LYS QD 1.800 . 5.500 2.140 2.004 2.337 . 0 0 "[ . 1 . 2]" 1
1038 1 95 LYS H 1 95 LYS QB 1.800 . 3.500 2.279 2.073 2.537 . 0 0 "[ . 1 . 2]" 1
1039 1 95 LYS H 1 95 LYS QD 1.800 . 5.500 4.128 3.396 4.722 . 0 0 "[ . 1 . 2]" 1
1040 1 95 LYS H 1 95 LYS QG 1.800 . 5.000 3.430 2.035 4.042 . 0 0 "[ . 1 . 2]" 1
1041 1 96 ILE HA 1 96 ILE MD 1.800 . 5.500 3.814 3.696 3.880 . 0 0 "[ . 1 . 2]" 1
1042 1 96 ILE H 1 96 ILE HB 1.800 . 3.500 2.506 2.392 2.608 . 0 0 "[ . 1 . 2]" 1
1043 1 96 ILE H 1 96 ILE MD 1.800 . 5.500 3.599 3.406 3.822 . 0 0 "[ . 1 . 2]" 1
1044 1 96 ILE H 1 96 ILE QG 1.800 . 5.000 2.147 1.964 2.397 . 0 0 "[ . 1 . 2]" 1
1045 1 97 LEU HA 1 97 LEU MD1 1.800 . 5.500 3.494 1.893 3.858 . 0 0 "[ . 1 . 2]" 1
1046 1 97 LEU HA 1 97 LEU MD2 1.800 . 3.500 2.042 1.811 2.770 . 0 0 "[ . 1 . 2]" 1
1047 1 97 LEU QB 1 97 LEU MD1 1.800 . 5.000 2.133 2.090 2.355 . 0 0 "[ . 1 . 2]" 1
1048 1 97 LEU H 1 97 LEU QB 1.800 . 3.500 2.396 2.028 2.490 . 0 0 "[ . 1 . 2]" 1
1049 1 97 LEU H 1 97 LEU MD1 1.800 . 5.500 3.722 3.566 4.319 . 0 0 "[ . 1 . 2]" 1
1050 1 97 LEU H 1 97 LEU MD2 1.800 . 5.500 3.097 2.066 3.461 . 0 0 "[ . 1 . 2]" 1
1051 1 97 LEU H 1 97 LEU HG 1.800 . 5.000 2.650 2.196 4.385 . 0 0 "[ . 1 . 2]" 1
1052 1 98 LYS HA 1 98 LYS QD 1.800 . 5.500 3.681 2.004 4.226 . 0 0 "[ . 1 . 2]" 1
1053 1 98 LYS QB 1 98 LYS QD 1.800 . 5.500 2.188 2.106 2.395 . 0 0 "[ . 1 . 2]" 1
1054 1 98 LYS H 1 98 LYS QB 1.800 . 3.900 2.382 2.046 2.540 . 0 0 "[ . 1 . 2]" 1
1055 1 98 LYS H 1 98 LYS QD 1.800 . 5.500 3.880 3.276 4.709 . 0 0 "[ . 1 . 2]" 1
1056 1 98 LYS H 1 98 LYS HG3 1.800 . 5.000 2.911 2.099 4.494 . 0 0 "[ . 1 . 2]" 1
1057 1 98 LYS H 1 98 LYS HG2 1.800 . 5.000 3.486 2.077 4.479 . 0 0 "[ . 1 . 2]" 1
1058 1 99 LYS HA 1 99 LYS QD 1.800 . 5.500 3.867 2.110 4.255 . 0 0 "[ . 1 . 2]" 1
1059 1 99 LYS QB 1 99 LYS QD 1.800 . 5.500 2.136 2.082 2.295 . 0 0 "[ . 1 . 2]" 1
1060 1 99 LYS H 1 99 LYS QB 1.800 . 3.900 2.284 2.172 2.498 . 0 0 "[ . 1 . 2]" 1
1061 1 100 ARG HA 1 100 ARG QD 1.800 . 5.000 4.003 3.268 4.427 . 0 0 "[ . 1 . 2]" 1
1062 1 100 ARG H 1 100 ARG QD 1.800 . 5.500 4.278 3.927 4.899 . 0 0 "[ . 1 . 2]" 1
1063 1 100 ARG H 1 100 ARG QG 1.800 . 5.000 3.179 2.077 4.064 . 0 0 "[ . 1 . 2]" 1
1064 1 102 THR H 1 102 THR MG 1.800 . 5.500 3.792 3.743 3.936 . 0 0 "[ . 1 . 2]" 1
1065 1 104 LEU HA 1 104 LEU MD1 1.800 . 5.500 3.383 1.879 3.872 . 0 0 "[ . 1 . 2]" 1
1066 1 104 LEU HA 1 104 LEU MD2 1.800 . 5.500 2.482 1.897 3.888 . 0 0 "[ . 1 . 2]" 1
1067 1 104 LEU QB 1 104 LEU MD1 1.800 . 5.500 2.149 2.077 2.389 . 0 0 "[ . 1 . 2]" 1
1068 1 104 LEU H 1 104 LEU MD1 1.800 . 5.500 3.872 3.472 4.844 . 0 0 "[ . 1 . 2]" 1
1069 1 27 LYS QB 1 28 PRO QD 1.800 . 5.000 2.572 2.110 3.537 . 0 0 "[ . 1 . 2]" 1
1070 1 29 GLU QG 1 30 VAL MG2 1.800 . 5.000 4.042 2.925 5.005 0.005 19 0 "[ . 1 . 2]" 1
1071 1 32 TYR QD 1 33 GLU QG 1.800 . 5.500 2.902 2.163 4.617 . 0 0 "[ . 1 . 2]" 1
1072 1 33 GLU QB 1 34 VAL MG2 1.800 . 5.500 3.245 2.901 3.474 . 0 0 "[ . 1 . 2]" 1
1073 1 33 GLU QG 1 34 VAL MG2 1.800 . 5.500 4.786 4.043 5.064 . 0 0 "[ . 1 . 2]" 1
1074 1 35 TRP HE3 1 36 LYS QD 1.800 . 5.500 4.046 2.366 4.567 . 0 0 "[ . 1 . 2]" 1
1075 1 35 TRP HE3 1 36 LYS QG 1.800 . 5.500 2.761 2.036 4.470 . 0 0 "[ . 1 . 2]" 1
1076 1 35 TRP HZ3 1 36 LYS QD 1.800 . 5.000 4.469 3.066 5.032 0.032 13 0 "[ . 1 . 2]" 1
1077 1 35 TRP HZ3 1 36 LYS QE 1.800 . 5.000 3.176 2.292 4.504 . 0 0 "[ . 1 . 2]" 1
1078 1 35 TRP HZ3 1 36 LYS QG 1.800 . 5.000 3.659 3.091 5.013 0.013 10 0 "[ . 1 . 2]" 1
1079 1 37 TYR QD 1 38 VAL MG1 1.800 . 5.000 2.509 1.801 3.749 . 0 0 "[ . 1 . 2]" 1
1080 1 37 TYR QE 1 38 VAL MG1 1.800 . 5.500 3.828 3.067 5.032 . 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 74
_Distance_constraint_stats_list.Viol_count 102
_Distance_constraint_stats_list.Viol_total 29.914
_Distance_constraint_stats_list.Viol_max 0.053
_Distance_constraint_stats_list.Viol_rms 0.0047
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0010
_Distance_constraint_stats_list.Viol_average_violations_only 0.0147
_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 3 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 4 GLU 0.011 0.011 12 0 "[ . 1 . 2]"
1 5 VAL 0.007 0.007 18 0 "[ . 1 . 2]"
1 6 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 GLU 0.036 0.011 12 0 "[ . 1 . 2]"
1 9 PHE 0.007 0.007 18 0 "[ . 1 . 2]"
1 10 LEU 0.119 0.038 18 0 "[ . 1 . 2]"
1 11 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 ASP 0.025 0.009 13 0 "[ . 1 . 2]"
1 14 GLY 0.119 0.038 18 0 "[ . 1 . 2]"
1 22 ASN 0.005 0.005 1 0 "[ . 1 . 2]"
1 24 ILE 0.035 0.015 19 0 "[ . 1 . 2]"
1 26 LEU 0.114 0.035 14 0 "[ . 1 . 2]"
1 27 LYS 0.006 0.006 4 0 "[ . 1 . 2]"
1 30 VAL 0.019 0.011 9 0 "[ . 1 . 2]"
1 31 PHE 0.040 0.011 4 0 "[ . 1 . 2]"
1 34 VAL 0.100 0.053 12 0 "[ . 1 . 2]"
1 35 TRP 0.080 0.034 13 0 "[ . 1 . 2]"
1 38 VAL 0.081 0.053 12 0 "[ . 1 . 2]"
1 41 PRO 0.047 0.034 13 0 "[ . 1 . 2]"
1 44 LYS 0.012 0.007 3 0 "[ . 1 . 2]"
1 46 TYR 0.030 0.030 15 0 "[ . 1 . 2]"
1 48 ILE 0.046 0.045 16 0 "[ . 1 . 2]"
1 52 ILE 0.074 0.036 8 0 "[ . 1 . 2]"
1 69 LYS 0.074 0.036 8 0 "[ . 1 . 2]"
1 73 ILE 0.046 0.045 16 0 "[ . 1 . 2]"
1 75 LYS 0.030 0.030 15 0 "[ . 1 . 2]"
1 76 VAL 0.021 0.017 5 0 "[ . 1 . 2]"
1 77 TYR 0.012 0.007 3 0 "[ . 1 . 2]"
1 78 PHE 0.123 0.026 20 0 "[ . 1 . 2]"
1 80 THR 0.033 0.024 18 0 "[ . 1 . 2]"
1 84 VAL 0.033 0.024 18 0 "[ . 1 . 2]"
1 85 ARG 0.017 0.012 3 0 "[ . 1 . 2]"
1 86 VAL 0.123 0.026 20 0 "[ . 1 . 2]"
1 87 VAL 0.137 0.035 14 0 "[ . 1 . 2]"
1 88 THR 0.021 0.017 5 0 "[ . 1 . 2]"
1 89 ASP 0.175 0.041 20 0 "[ . 1 . 2]"
1 90 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 91 SER 0.135 0.031 8 0 "[ . 1 . 2]"
1 92 GLU 0.080 0.023 8 0 "[ . 1 . 2]"
1 93 PHE 0.215 0.041 20 0 "[ . 1 . 2]"
1 94 GLN 0.056 0.037 17 0 "[ . 1 . 2]"
1 95 LYS 0.182 0.031 8 0 "[ . 1 . 2]"
1 96 ILE 0.115 0.029 15 0 "[ . 1 . 2]"
1 97 LEU 0.127 0.031 14 0 "[ . 1 . 2]"
1 98 LYS 0.056 0.037 17 0 "[ . 1 . 2]"
1 99 LYS 0.047 0.028 3 0 "[ . 1 . 2]"
1 100 ARG 0.035 0.029 15 0 "[ . 1 . 2]"
1 101 GLY 0.087 0.031 14 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 3 SER O 1 7 LYS N 2.700 2.700 3.300 2.951 2.744 3.163 . 0 0 "[ . 1 . 2]" 2
2 1 3 SER O 1 7 LYS H 1.700 . 2.300 2.018 1.807 2.236 . 0 0 "[ . 1 . 2]" 2
3 1 4 GLU O 1 8 GLU N 2.700 2.700 3.300 3.007 2.813 3.227 . 0 0 "[ . 1 . 2]" 2
4 1 4 GLU O 1 8 GLU H 1.700 . 2.300 2.062 1.844 2.311 0.011 12 0 "[ . 1 . 2]" 2
5 1 5 VAL O 1 9 PHE N 2.700 2.700 3.300 2.979 2.801 3.250 . 0 0 "[ . 1 . 2]" 2
6 1 5 VAL O 1 9 PHE H 1.700 . 2.300 2.052 1.856 2.307 0.007 18 0 "[ . 1 . 2]" 2
7 1 6 ILE O 1 10 LEU N 2.700 2.700 3.300 2.878 2.746 3.042 . 0 0 "[ . 1 . 2]" 2
8 1 6 ILE O 1 10 LEU H 1.700 . 2.300 1.934 1.809 2.118 . 0 0 "[ . 1 . 2]" 2
9 1 7 LYS O 1 11 GLU N 2.700 2.700 3.300 2.864 2.732 3.138 . 0 0 "[ . 1 . 2]" 2
10 1 7 LYS O 1 11 GLU H 1.700 . 2.300 1.932 1.763 2.196 . 0 0 "[ . 1 . 2]" 2
11 1 8 GLU O 1 12 ASP N 2.700 2.700 3.300 2.901 2.700 3.155 . 0 0 "[ . 1 . 2]" 2
12 1 8 GLU O 1 12 ASP H 1.700 . 2.300 2.049 1.758 2.309 0.009 13 0 "[ . 1 . 2]" 2
13 1 10 LEU O 1 14 GLY N 2.700 2.700 3.300 2.875 2.729 3.107 . 0 0 "[ . 1 . 2]" 2
14 1 10 LEU O 1 14 GLY H 1.700 . 2.300 2.142 1.833 2.338 0.038 18 0 "[ . 1 . 2]" 2
15 1 22 ASN O 1 85 ARG N 2.700 2.700 3.300 2.827 2.695 3.200 0.005 1 0 "[ . 1 . 2]" 2
16 1 22 ASN O 1 85 ARG H 1.700 . 2.300 1.864 1.716 2.300 0.000 5 0 "[ . 1 . 2]" 2
17 1 24 ILE O 1 87 VAL N 2.700 2.700 3.300 2.774 2.685 2.922 0.015 19 0 "[ . 1 . 2]" 2
18 1 24 ILE O 1 87 VAL H 1.700 . 2.300 1.932 1.781 2.109 . 0 0 "[ . 1 . 2]" 2
19 1 27 LYS O 1 31 PHE N 2.700 2.700 3.300 2.770 2.694 2.839 0.006 4 0 "[ . 1 . 2]" 2
20 1 27 LYS O 1 31 PHE H 1.700 . 2.300 1.808 1.731 1.882 . 0 0 "[ . 1 . 2]" 2
21 1 30 VAL O 1 34 VAL N 2.700 2.700 3.300 2.978 2.764 3.270 . 0 0 "[ . 1 . 2]" 2
22 1 30 VAL O 1 34 VAL H 1.700 . 2.300 2.039 1.799 2.311 0.011 9 0 "[ . 1 . 2]" 2
23 1 31 PHE O 1 35 TRP N 2.700 2.700 3.300 2.768 2.689 2.879 0.011 4 0 "[ . 1 . 2]" 2
24 1 31 PHE O 1 35 TRP H 1.700 . 2.300 1.840 1.726 1.939 . 0 0 "[ . 1 . 2]" 2
25 1 34 VAL O 1 38 VAL N 2.700 2.700 3.300 2.979 2.798 3.256 . 0 0 "[ . 1 . 2]" 2
26 1 34 VAL O 1 38 VAL H 1.700 . 2.300 2.094 1.882 2.353 0.053 12 0 "[ . 1 . 2]" 2
27 1 44 LYS O 1 77 TYR N 2.700 2.700 3.300 2.776 2.695 2.877 0.005 3 0 "[ . 1 . 2]" 2
28 1 44 LYS O 1 77 TYR H 1.700 . 2.300 1.825 1.723 1.961 . 0 0 "[ . 1 . 2]" 2
29 1 46 TYR O 1 75 LYS N 2.700 2.700 3.300 2.909 2.761 3.094 . 0 0 "[ . 1 . 2]" 2
30 1 46 TYR O 1 75 LYS H 1.700 . 2.300 1.977 1.791 2.121 . 0 0 "[ . 1 . 2]" 2
31 1 48 ILE O 1 73 ILE N 2.700 2.700 3.300 2.919 2.761 3.290 . 0 0 "[ . 1 . 2]" 2
32 1 48 ILE O 1 73 ILE H 1.700 . 2.300 2.009 1.786 2.345 0.045 16 0 "[ . 1 . 2]" 2
33 1 52 ILE N 1 69 LYS O 2.700 2.700 3.300 2.920 2.708 3.288 . 0 0 "[ . 1 . 2]" 2
34 1 52 ILE H 1 69 LYS O 1.700 . 2.300 2.040 1.795 2.336 0.036 8 0 "[ . 1 . 2]" 2
35 1 48 ILE N 1 73 ILE O 2.700 2.700 3.300 2.833 2.707 3.171 . 0 0 "[ . 1 . 2]" 2
36 1 48 ILE H 1 73 ILE O 1.700 . 2.300 1.896 1.763 2.196 . 0 0 "[ . 1 . 2]" 2
37 1 46 TYR N 1 75 LYS O 2.700 2.700 3.300 2.852 2.670 2.952 0.030 15 0 "[ . 1 . 2]" 2
38 1 46 TYR H 1 75 LYS O 1.700 . 2.300 1.927 1.720 2.027 . 0 0 "[ . 1 . 2]" 2
39 1 76 VAL O 1 88 THR N 2.700 2.700 3.300 2.801 2.720 2.966 . 0 0 "[ . 1 . 2]" 2
40 1 76 VAL O 1 88 THR H 1.700 . 2.300 1.832 1.738 2.015 . 0 0 "[ . 1 . 2]" 2
41 1 44 LYS N 1 77 TYR O 2.700 2.700 3.300 2.936 2.770 3.171 . 0 0 "[ . 1 . 2]" 2
42 1 44 LYS H 1 77 TYR O 1.700 . 2.300 2.063 1.870 2.307 0.007 3 0 "[ . 1 . 2]" 2
43 1 78 PHE O 1 86 VAL N 2.700 2.700 3.300 2.913 2.755 3.056 . 0 0 "[ . 1 . 2]" 2
44 1 78 PHE O 1 86 VAL H 1.700 . 2.300 1.977 1.790 2.128 . 0 0 "[ . 1 . 2]" 2
45 1 80 THR N 1 84 VAL O 2.700 2.700 3.300 3.010 2.759 3.265 . 0 0 "[ . 1 . 2]" 2
46 1 80 THR H 1 84 VAL O 1.700 . 2.300 2.071 1.777 2.324 0.024 18 0 "[ . 1 . 2]" 2
47 1 24 ILE N 1 85 ARG O 2.700 2.700 3.300 2.821 2.688 3.037 0.012 3 0 "[ . 1 . 2]" 2
48 1 24 ILE H 1 85 ARG O 1.700 . 2.300 1.932 1.724 2.143 . 0 0 "[ . 1 . 2]" 2
49 1 78 PHE N 1 86 VAL O 2.700 2.700 3.300 3.146 2.987 3.201 . 0 0 "[ . 1 . 2]" 2
50 1 78 PHE H 1 86 VAL O 1.700 . 2.300 2.271 2.089 2.326 0.026 20 0 "[ . 1 . 2]" 2
51 1 26 LEU N 1 87 VAL O 2.700 2.700 3.300 3.085 2.851 3.259 . 0 0 "[ . 1 . 2]" 2
52 1 26 LEU H 1 87 VAL O 1.700 . 2.300 2.169 1.906 2.335 0.035 14 0 "[ . 1 . 2]" 2
53 1 76 VAL N 1 88 THR O 2.700 2.700 3.300 2.950 2.706 3.284 . 0 0 "[ . 1 . 2]" 2
54 1 76 VAL H 1 88 THR O 1.700 . 2.300 1.995 1.765 2.317 0.017 5 0 "[ . 1 . 2]" 2
55 1 89 ASP O 1 93 PHE N 2.700 2.700 3.300 3.036 2.772 3.245 . 0 0 "[ . 1 . 2]" 2
56 1 89 ASP O 1 93 PHE H 1.700 . 2.300 2.165 1.881 2.341 0.041 20 0 "[ . 1 . 2]" 2
57 1 90 TYR O 1 94 GLN N 2.700 2.700 3.300 2.872 2.717 3.090 . 0 0 "[ . 1 . 2]" 2
58 1 90 TYR O 1 94 GLN H 1.700 . 2.300 1.916 1.738 2.149 . 0 0 "[ . 1 . 2]" 2
59 1 91 SER O 1 95 LYS N 2.700 2.700 3.300 3.054 2.839 3.232 . 0 0 "[ . 1 . 2]" 2
60 1 91 SER O 1 95 LYS H 1.700 . 2.300 2.208 2.012 2.331 0.031 8 0 "[ . 1 . 2]" 2
61 1 92 GLU O 1 96 ILE N 2.700 2.700 3.300 3.053 2.771 3.253 . 0 0 "[ . 1 . 2]" 2
62 1 92 GLU O 1 96 ILE H 1.700 . 2.300 2.168 1.845 2.323 0.023 8 0 "[ . 1 . 2]" 2
63 1 93 PHE O 1 97 LEU N 2.700 2.700 3.300 3.024 2.814 3.276 . 0 0 "[ . 1 . 2]" 2
64 1 93 PHE O 1 97 LEU H 1.700 . 2.300 2.099 1.895 2.322 0.022 8 0 "[ . 1 . 2]" 2
65 1 94 GLN O 1 98 LYS N 2.700 2.700 3.300 2.920 2.708 3.232 . 0 0 "[ . 1 . 2]" 2
66 1 94 GLN O 1 98 LYS H 1.700 . 2.300 2.005 1.769 2.337 0.037 17 0 "[ . 1 . 2]" 2
67 1 95 LYS O 1 99 LYS N 2.700 2.700 3.300 2.884 2.692 3.199 0.008 7 0 "[ . 1 . 2]" 2
68 1 95 LYS O 1 99 LYS H 1.700 . 2.300 2.050 1.792 2.328 0.028 3 0 "[ . 1 . 2]" 2
69 1 96 ILE O 1 100 ARG N 2.700 2.700 3.300 2.944 2.715 3.239 . 0 0 "[ . 1 . 2]" 2
70 1 96 ILE O 1 100 ARG H 1.700 . 2.300 2.002 1.753 2.329 0.029 15 0 "[ . 1 . 2]" 2
71 1 97 LEU O 1 101 GLY N 2.700 2.700 3.300 2.885 2.724 3.217 . 0 0 "[ . 1 . 2]" 2
72 1 97 LEU O 1 101 GLY H 1.700 . 2.300 2.140 1.789 2.331 0.031 14 0 "[ . 1 . 2]" 2
73 1 35 TRP NE1 1 41 PRO O 2.700 2.700 3.300 3.011 2.750 3.267 . 0 0 "[ . 1 . 2]" 2
74 1 35 TRP HE1 1 41 PRO O 1.700 . 2.300 2.061 1.781 2.334 0.034 13 0 "[ . 1 . 2]" 2
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