NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
415644 |
2dc2   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2dc2
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 1355
_Distance_constraint_stats_list.Viol_count 298
_Distance_constraint_stats_list.Viol_total 132.840
_Distance_constraint_stats_list.Viol_max 0.833
_Distance_constraint_stats_list.Viol_rms 0.0060
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0002
_Distance_constraint_stats_list.Viol_average_violations_only 0.0223
_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 9 PRO 0.018 0.011 17 0 "[ . 1 . 2]"
1 10 ILE 0.328 0.045 18 0 "[ . 1 . 2]"
1 11 ARG 0.319 0.045 18 0 "[ . 1 . 2]"
1 12 LYS 0.002 0.002 11 0 "[ . 1 . 2]"
1 13 VAL 0.079 0.035 4 0 "[ . 1 . 2]"
1 14 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 LEU 0.025 0.016 2 0 "[ . 1 . 2]"
1 16 LEU 0.017 0.010 15 0 "[ . 1 . 2]"
1 17 LYS 0.063 0.026 15 0 "[ . 1 . 2]"
1 18 GLU 0.041 0.033 2 0 "[ . 1 . 2]"
1 19 ASP 0.022 0.009 10 0 "[ . 1 . 2]"
1 20 HIS 0.084 0.033 2 0 "[ . 1 . 2]"
1 21 GLU 0.020 0.014 7 0 "[ . 1 . 2]"
1 22 GLY 0.059 0.017 19 0 "[ . 1 . 2]"
1 23 LEU 1.232 0.833 13 1 "[ . 1 + . 2]"
1 24 GLY 0.005 0.005 16 0 "[ . 1 . 2]"
1 25 ILE 0.010 0.005 18 0 "[ . 1 . 2]"
1 26 SER 0.165 0.035 1 0 "[ . 1 . 2]"
1 27 ILE 0.083 0.022 17 0 "[ . 1 . 2]"
1 28 THR 0.112 0.021 2 0 "[ . 1 . 2]"
1 29 GLY 0.068 0.023 17 0 "[ . 1 . 2]"
1 30 GLY 0.043 0.023 17 0 "[ . 1 . 2]"
1 31 LYS 0.234 0.044 3 0 "[ . 1 . 2]"
1 32 GLU 0.006 0.006 10 0 "[ . 1 . 2]"
1 33 HIS 0.019 0.010 4 0 "[ . 1 . 2]"
1 34 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 35 VAL 0.021 0.014 2 0 "[ . 1 . 2]"
1 36 PRO 0.068 0.014 11 0 "[ . 1 . 2]"
1 37 ILE 0.385 0.051 11 0 "[ . 1 . 2]"
1 38 LEU 0.050 0.021 9 0 "[ . 1 . 2]"
1 39 ILE 0.155 0.031 11 0 "[ . 1 . 2]"
1 40 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 GLU 0.255 0.035 1 0 "[ . 1 . 2]"
1 42 ILE 0.057 0.019 14 0 "[ . 1 . 2]"
1 43 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 45 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 GLN 0.030 0.023 8 0 "[ . 1 . 2]"
1 47 PRO 0.007 0.007 17 0 "[ . 1 . 2]"
1 48 ALA 0.022 0.014 15 0 "[ . 1 . 2]"
1 49 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 ARG 0.050 0.023 8 0 "[ . 1 . 2]"
1 51 CYS 0.418 0.066 14 0 "[ . 1 . 2]"
1 52 GLY 0.027 0.010 3 0 "[ . 1 . 2]"
1 53 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 LEU 0.469 0.066 14 0 "[ . 1 . 2]"
1 55 HIS 0.552 0.061 18 0 "[ . 1 . 2]"
1 56 VAL 0.244 0.091 7 0 "[ . 1 . 2]"
1 57 GLY 0.009 0.009 15 0 "[ . 1 . 2]"
1 58 ASP 0.211 0.057 6 0 "[ . 1 . 2]"
1 59 ALA 0.018 0.010 15 0 "[ . 1 . 2]"
1 60 ILE 0.360 0.051 11 0 "[ . 1 . 2]"
1 61 LEU 0.052 0.026 4 0 "[ . 1 . 2]"
1 62 ALA 0.199 0.021 9 0 "[ . 1 . 2]"
1 63 VAL 0.019 0.019 5 0 "[ . 1 . 2]"
1 64 ASN 0.713 0.079 5 0 "[ . 1 . 2]"
1 65 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 VAL 0.199 0.021 9 0 "[ . 1 . 2]"
1 67 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 LEU 0.044 0.044 20 0 "[ . 1 . 2]"
1 69 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 ASP 0.070 0.044 3 0 "[ . 1 . 2]"
1 71 THR 0.302 0.044 20 0 "[ . 1 . 2]"
1 72 LYS 0.017 0.011 3 0 "[ . 1 . 2]"
1 73 HIS 0.123 0.022 17 0 "[ . 1 . 2]"
1 74 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 GLU 0.095 0.041 11 0 "[ . 1 . 2]"
1 76 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 VAL 0.043 0.020 9 0 "[ . 1 . 2]"
1 78 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 79 ILE 0.120 0.036 10 0 "[ . 1 . 2]"
1 80 LEU 0.063 0.020 4 0 "[ . 1 . 2]"
1 81 SER 0.036 0.011 14 0 "[ . 1 . 2]"
1 82 GLN 0.388 0.091 5 0 "[ . 1 . 2]"
1 83 GLN 0.725 0.091 5 0 "[ . 1 . 2]"
1 84 ARG 0.671 0.079 5 0 "[ . 1 . 2]"
1 85 GLY 0.042 0.023 1 0 "[ . 1 . 2]"
1 86 GLU 0.041 0.010 15 0 "[ . 1 . 2]"
1 87 ILE 0.434 0.035 1 0 "[ . 1 . 2]"
1 88 GLU 0.009 0.009 14 0 "[ . 1 . 2]"
1 89 PHE 1.260 0.833 13 1 "[ . 1 + . 2]"
1 90 GLU 0.006 0.006 18 0 "[ . 1 . 2]"
1 91 VAL 0.031 0.029 5 0 "[ . 1 . 2]"
1 92 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 TYR 0.791 0.061 18 0 "[ . 1 . 2]"
1 94 VAL 0.018 0.010 15 0 "[ . 1 . 2]"
1 95 ALA 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 9 PRO HA 1 10 ILE H 1.800 . 3.000 2.272 2.156 2.679 . 0 0 "[ . 1 . 2]" 1
2 1 9 PRO HA 1 10 ILE MG 1.800 . 6.000 4.648 3.773 5.706 . 0 0 "[ . 1 . 2]" 1
3 1 9 PRO QB 1 10 ILE H 1.800 . 5.000 3.550 2.294 3.965 . 0 0 "[ . 1 . 2]" 1
4 1 9 PRO QG 1 93 TYR H 1.800 . 5.000 4.589 3.222 5.011 0.011 17 0 "[ . 1 . 2]" 1
5 1 10 ILE HA 1 11 ARG H 1.800 . 3.000 2.185 2.136 2.232 . 0 0 "[ . 1 . 2]" 1
6 1 10 ILE HA 1 91 VAL H 1.800 . 6.000 5.293 4.805 5.797 . 0 0 "[ . 1 . 2]" 1
7 1 10 ILE HA 1 93 TYR H 1.800 . 5.000 4.560 3.614 5.010 0.010 16 0 "[ . 1 . 2]" 1
8 1 10 ILE H 1 10 ILE HB 1.800 . 3.000 2.649 2.520 2.960 . 0 0 "[ . 1 . 2]" 1
9 1 10 ILE QG 1 11 ARG H 1.800 . 4.000 3.156 2.076 4.045 0.045 18 0 "[ . 1 . 2]" 1
10 1 10 ILE H 1 10 ILE MG 1.800 . 4.000 2.820 1.967 3.827 . 0 0 "[ . 1 . 2]" 1
11 1 10 ILE H 1 11 ARG H 1.800 . 5.000 4.532 4.389 4.600 . 0 0 "[ . 1 . 2]" 1
12 1 10 ILE HA 1 10 ILE QG 1.800 . 5.000 2.366 2.268 2.505 . 0 0 "[ . 1 . 2]" 1
13 1 10 ILE HA 1 10 ILE MG 1.800 . 5.000 2.804 2.290 3.216 . 0 0 "[ . 1 . 2]" 1
14 1 10 ILE HA 1 10 ILE MD 1.800 . 6.000 3.390 2.710 3.900 . 0 0 "[ . 1 . 2]" 1
15 1 10 ILE HA 1 92 VAL HA 1.800 . 4.000 3.041 2.375 3.602 . 0 0 "[ . 1 . 2]" 1
16 1 10 ILE HA 1 92 VAL HB 1.800 . 6.000 4.033 2.431 4.836 . 0 0 "[ . 1 . 2]" 1
17 1 10 ILE HA 1 92 VAL QG 1.800 . 5.000 2.003 1.839 2.806 . 0 0 "[ . 1 . 2]" 1
18 1 10 ILE HB 1 10 ILE MD 1.800 . 4.000 2.156 2.023 2.306 . 0 0 "[ . 1 . 2]" 1
19 1 10 ILE HB 1 92 VAL QG 1.800 . 5.000 3.335 2.011 4.897 . 0 0 "[ . 1 . 2]" 1
20 1 10 ILE MD 1 90 GLU QG 1.800 . 6.000 4.043 1.899 6.006 0.006 18 0 "[ . 1 . 2]" 1
21 1 10 ILE QG 1 92 VAL HB 1.800 . 6.000 4.787 3.013 5.981 . 0 0 "[ . 1 . 2]" 1
22 1 11 ARG HA 1 12 LYS H 1.800 . 3.000 2.184 2.138 2.300 . 0 0 "[ . 1 . 2]" 1
23 1 11 ARG HB3 1 91 VAL H 1.800 . 6.000 4.220 3.677 4.962 . 0 0 "[ . 1 . 2]" 1
24 1 11 ARG HB2 1 91 VAL H 1.800 . 6.000 4.992 3.850 5.694 . 0 0 "[ . 1 . 2]" 1
25 1 11 ARG QB 1 91 VAL H 1.800 . 5.000 3.972 3.526 4.485 . 0 0 "[ . 1 . 2]" 1
26 1 11 ARG H 1 11 ARG QD 1.800 . 6.000 4.399 2.971 5.138 . 0 0 "[ . 1 . 2]" 1
27 1 11 ARG H 1 11 ARG QG 1.800 . 6.000 4.019 3.502 4.239 . 0 0 "[ . 1 . 2]" 1
28 1 11 ARG QG 1 12 LYS H 1.800 . 5.000 2.931 2.075 3.867 . 0 0 "[ . 1 . 2]" 1
29 1 11 ARG H 1 12 LYS QD 1.800 . 5.000 4.293 3.796 4.893 . 0 0 "[ . 1 . 2]" 1
30 1 11 ARG H 1 90 GLU HA 1.800 . 6.000 5.012 4.477 5.633 . 0 0 "[ . 1 . 2]" 1
31 1 11 ARG H 1 91 VAL QG 1.800 . 5.000 3.948 3.517 4.326 . 0 0 "[ . 1 . 2]" 1
32 1 11 ARG H 1 92 VAL HA 1.800 . 5.000 3.075 2.571 3.394 . 0 0 "[ . 1 . 2]" 1
33 1 11 ARG H 1 92 VAL HB 1.800 . 6.000 5.104 3.554 5.820 . 0 0 "[ . 1 . 2]" 1
34 1 11 ARG H 1 12 LYS H 1.800 . 5.000 4.392 4.277 4.474 . 0 0 "[ . 1 . 2]" 1
35 1 11 ARG H 1 91 VAL H 1.800 . 5.000 3.688 3.145 4.090 . 0 0 "[ . 1 . 2]" 1
36 1 11 ARG HA 1 11 ARG QD 1.800 . 4.000 3.487 2.259 4.007 0.007 11 0 "[ . 1 . 2]" 1
37 1 11 ARG HA 1 11 ARG QG 1.800 . 4.000 2.207 2.022 2.461 . 0 0 "[ . 1 . 2]" 1
38 1 11 ARG HA 1 13 VAL QG 1.800 . 6.000 4.569 4.218 4.892 . 0 0 "[ . 1 . 2]" 1
39 1 11 ARG QB 1 11 ARG QD 1.800 . 4.000 2.120 1.926 2.439 . 0 0 "[ . 1 . 2]" 1
40 1 11 ARG HB3 1 91 VAL QG 1.800 . 5.000 3.327 2.476 4.037 . 0 0 "[ . 1 . 2]" 1
41 1 11 ARG HB2 1 91 VAL QG 1.800 . 5.000 3.977 2.690 4.956 . 0 0 "[ . 1 . 2]" 1
42 1 11 ARG QG 1 13 VAL QG 1.800 . 4.000 3.236 2.098 3.997 . 0 0 "[ . 1 . 2]" 1
43 1 12 LYS HA 1 13 VAL H 1.800 . 3.000 2.156 2.133 2.167 . 0 0 "[ . 1 . 2]" 1
44 1 12 LYS HA 1 89 PHE H 1.800 . 6.000 5.158 4.795 5.538 . 0 0 "[ . 1 . 2]" 1
45 1 12 LYS HA 1 91 VAL H 1.800 . 5.000 3.768 2.989 4.190 . 0 0 "[ . 1 . 2]" 1
46 1 12 LYS H 1 12 LYS HB3 1.800 . 4.000 3.620 3.246 3.762 . 0 0 "[ . 1 . 2]" 1
47 1 12 LYS H 1 12 LYS HB2 1.800 . 4.000 2.551 2.277 3.674 . 0 0 "[ . 1 . 2]" 1
48 1 12 LYS QB 1 13 VAL H 1.800 . 5.000 3.436 3.288 3.552 . 0 0 "[ . 1 . 2]" 1
49 1 12 LYS QD 1 91 VAL H 1.800 . 5.000 4.618 3.815 4.971 . 0 0 "[ . 1 . 2]" 1
50 1 12 LYS H 1 12 LYS HG3 1.800 . 6.000 3.911 3.659 4.316 . 0 0 "[ . 1 . 2]" 1
51 1 12 LYS H 1 12 LYS HG2 1.800 . 6.000 3.529 2.198 4.780 . 0 0 "[ . 1 . 2]" 1
52 1 12 LYS H 1 12 LYS QG 1.800 . 5.000 3.136 2.182 4.016 . 0 0 "[ . 1 . 2]" 1
53 1 12 LYS HG3 1 13 VAL H 1.800 . 6.000 4.812 3.646 5.779 . 0 0 "[ . 1 . 2]" 1
54 1 12 LYS HG2 1 13 VAL H 1.800 . 6.000 5.169 4.740 5.418 . 0 0 "[ . 1 . 2]" 1
55 1 12 LYS QG 1 91 VAL H 1.800 . 6.000 5.154 4.329 6.002 0.002 11 0 "[ . 1 . 2]" 1
56 1 12 LYS H 1 13 VAL QG 1.800 . 4.000 3.802 3.467 3.986 . 0 0 "[ . 1 . 2]" 1
57 1 12 LYS H 1 13 VAL H 1.800 . 5.000 4.313 4.216 4.442 . 0 0 "[ . 1 . 2]" 1
58 1 12 LYS HA 1 13 VAL HA 1.800 . 6.000 4.406 4.397 4.414 . 0 0 "[ . 1 . 2]" 1
59 1 12 LYS HA 1 90 GLU HA 1.800 . 4.000 2.819 2.271 3.162 . 0 0 "[ . 1 . 2]" 1
60 1 12 LYS QB 1 12 LYS QE 1.800 . 5.000 3.098 2.060 3.848 . 0 0 "[ . 1 . 2]" 1
61 1 12 LYS QD 1 90 GLU HA 1.800 . 6.000 3.788 2.876 4.429 . 0 0 "[ . 1 . 2]" 1
62 1 12 LYS QD 1 91 VAL QG 1.800 . 6.000 5.326 4.704 5.609 . 0 0 "[ . 1 . 2]" 1
63 1 12 LYS QE 1 12 LYS QG 1.800 . 5.000 2.183 1.970 2.605 . 0 0 "[ . 1 . 2]" 1
64 1 12 LYS QG 1 90 GLU HA 1.800 . 6.000 4.040 2.715 5.206 . 0 0 "[ . 1 . 2]" 1
65 1 12 LYS QG 1 90 GLU HG3 1.800 . 5.000 3.377 1.977 4.923 . 0 0 "[ . 1 . 2]" 1
66 1 12 LYS QG 1 90 GLU HG2 1.800 . 5.000 3.618 1.878 4.815 . 0 0 "[ . 1 . 2]" 1
67 1 13 VAL HA 1 14 LEU H 1.800 . 3.000 2.198 2.157 2.241 . 0 0 "[ . 1 . 2]" 1
68 1 13 VAL H 1 13 VAL HB 1.800 . 4.000 3.027 2.687 3.802 . 0 0 "[ . 1 . 2]" 1
69 1 13 VAL HB 1 14 LEU H 1.800 . 5.000 3.739 2.893 4.094 . 0 0 "[ . 1 . 2]" 1
70 1 13 VAL HB 1 89 PHE H 1.800 . 5.000 4.729 4.247 5.035 0.035 4 0 "[ . 1 . 2]" 1
71 1 13 VAL H 1 13 VAL QG 1.800 . 5.000 2.506 1.985 2.772 . 0 0 "[ . 1 . 2]" 1
72 1 13 VAL QG 1 14 LEU H 1.800 . 3.500 2.593 2.136 3.491 . 0 0 "[ . 1 . 2]" 1
73 1 13 VAL QG 1 53 GLY H 1.800 . 5.000 3.609 3.053 4.454 . 0 0 "[ . 1 . 2]" 1
74 1 13 VAL QG 1 54 LEU H 1.800 . 5.000 3.783 3.276 4.358 . 0 0 "[ . 1 . 2]" 1
75 1 13 VAL QG 1 89 PHE H 1.800 . 6.000 4.300 2.887 4.822 . 0 0 "[ . 1 . 2]" 1
76 1 13 VAL H 1 88 GLU HA 1.800 . 6.000 5.457 4.928 5.871 . 0 0 "[ . 1 . 2]" 1
77 1 13 VAL H 1 89 PHE HB3 1.800 . 5.000 4.112 3.686 4.648 . 0 0 "[ . 1 . 2]" 1
78 1 13 VAL H 1 89 PHE HB2 1.800 . 5.000 4.553 4.088 4.979 . 0 0 "[ . 1 . 2]" 1
79 1 13 VAL H 1 90 GLU HA 1.800 . 5.000 3.459 3.158 3.798 . 0 0 "[ . 1 . 2]" 1
80 1 13 VAL H 1 91 VAL QG 1.800 . 6.000 4.058 3.342 4.429 . 0 0 "[ . 1 . 2]" 1
81 1 13 VAL H 1 14 LEU H 1.800 . 5.000 4.402 4.324 4.505 . 0 0 "[ . 1 . 2]" 1
82 1 13 VAL H 1 89 PHE H 1.800 . 4.500 3.764 3.243 4.192 . 0 0 "[ . 1 . 2]" 1
83 1 13 VAL H 1 91 VAL H 1.800 . 5.000 4.265 3.849 4.732 . 0 0 "[ . 1 . 2]" 1
84 1 13 VAL HA 1 13 VAL MG1 1.800 . 4.000 2.290 2.108 2.380 . 0 0 "[ . 1 . 2]" 1
85 1 13 VAL HA 1 13 VAL MG2 1.800 . 4.000 2.640 2.396 3.199 . 0 0 "[ . 1 . 2]" 1
86 1 13 VAL HB 1 89 PHE HB3 1.800 . 5.000 4.070 3.224 5.001 0.001 4 0 "[ . 1 . 2]" 1
87 1 13 VAL HB 1 89 PHE HB2 1.800 . 5.000 4.228 3.294 4.899 . 0 0 "[ . 1 . 2]" 1
88 1 13 VAL QG 1 15 LEU QD 1.800 . 4.000 3.266 1.936 3.935 . 0 0 "[ . 1 . 2]" 1
89 1 13 VAL QG 1 51 CYS QB 1.800 . 6.000 3.094 2.224 4.211 . 0 0 "[ . 1 . 2]" 1
90 1 13 VAL QG 1 53 GLY HA3 1.800 . 4.000 2.466 2.019 2.844 . 0 0 "[ . 1 . 2]" 1
91 1 13 VAL QG 1 53 GLY HA2 1.800 . 4.000 3.683 3.058 3.991 . 0 0 "[ . 1 . 2]" 1
92 1 13 VAL QG 1 54 LEU HA 1.800 . 5.000 4.184 3.428 4.672 . 0 0 "[ . 1 . 2]" 1
93 1 13 VAL QG 1 54 LEU HG 1.800 . 6.000 4.868 3.587 5.992 . 0 0 "[ . 1 . 2]" 1
94 1 13 VAL QG 1 54 LEU QD 1.800 . 6.000 3.197 2.149 4.549 . 0 0 "[ . 1 . 2]" 1
95 1 13 VAL QG 1 89 PHE HB3 1.800 . 6.000 3.816 1.875 4.875 . 0 0 "[ . 1 . 2]" 1
96 1 13 VAL QG 1 89 PHE HB2 1.800 . 6.000 3.946 2.297 4.806 . 0 0 "[ . 1 . 2]" 1
97 1 13 VAL QG 1 91 VAL QG 1.800 . 6.000 2.996 1.999 3.596 . 0 0 "[ . 1 . 2]" 1
98 1 14 LEU HA 1 15 LEU H 1.800 . 3.000 2.166 2.138 2.213 . 0 0 "[ . 1 . 2]" 1
99 1 14 LEU HA 1 87 ILE H 1.800 . 6.000 4.905 4.468 5.414 . 0 0 "[ . 1 . 2]" 1
100 1 14 LEU HA 1 89 PHE H 1.800 . 4.000 2.909 2.480 3.444 . 0 0 "[ . 1 . 2]" 1
101 1 14 LEU H 1 14 LEU QB 1.800 . 3.000 2.433 2.201 2.966 . 0 0 "[ . 1 . 2]" 1
102 1 14 LEU QB 1 15 LEU H 1.800 . 5.000 3.328 2.876 3.818 . 0 0 "[ . 1 . 2]" 1
103 1 14 LEU QB 1 89 PHE H 1.800 . 6.000 4.719 3.847 5.278 . 0 0 "[ . 1 . 2]" 1
104 1 14 LEU QD 1 15 LEU H 1.800 . 5.000 3.635 2.249 4.402 . 0 0 "[ . 1 . 2]" 1
105 1 14 LEU QD 1 87 ILE H 1.800 . 6.000 3.817 2.397 5.164 . 0 0 "[ . 1 . 2]" 1
106 1 14 LEU QD 1 88 GLU H 1.800 . 6.000 4.503 3.071 5.970 . 0 0 "[ . 1 . 2]" 1
107 1 14 LEU H 1 14 LEU HG 1.800 . 6.000 3.651 2.022 4.617 . 0 0 "[ . 1 . 2]" 1
108 1 14 LEU H 1 15 LEU H 1.800 . 6.000 4.456 4.371 4.545 . 0 0 "[ . 1 . 2]" 1
109 1 14 LEU HA 1 14 LEU QD 1.800 . 4.000 2.806 2.124 3.438 . 0 0 "[ . 1 . 2]" 1
110 1 14 LEU HA 1 14 LEU HG 1.800 . 4.000 2.653 2.169 3.660 . 0 0 "[ . 1 . 2]" 1
111 1 14 LEU HA 1 88 GLU HA 1.800 . 4.000 2.588 2.262 2.900 . 0 0 "[ . 1 . 2]" 1
112 1 14 LEU HA 1 88 GLU QG 1.800 . 6.000 3.664 3.427 4.046 . 0 0 "[ . 1 . 2]" 1
113 1 14 LEU QD 1 86 GLU HG3 1.800 . 5.000 2.929 1.840 3.984 . 0 0 "[ . 1 . 2]" 1
114 1 14 LEU QD 1 86 GLU HG2 1.800 . 5.000 2.947 2.058 4.418 . 0 0 "[ . 1 . 2]" 1
115 1 14 LEU QD 1 88 GLU HA 1.800 . 5.000 3.099 1.994 4.482 . 0 0 "[ . 1 . 2]" 1
116 1 15 LEU HA 1 16 LEU H 1.800 . 3.000 2.180 2.132 2.242 . 0 0 "[ . 1 . 2]" 1
117 1 15 LEU H 1 15 LEU QB 1.800 . 4.000 2.410 2.288 2.566 . 0 0 "[ . 1 . 2]" 1
118 1 15 LEU QB 1 16 LEU H 1.800 . 5.000 3.511 3.024 3.771 . 0 0 "[ . 1 . 2]" 1
119 1 15 LEU QB 1 87 ILE H 1.800 . 5.000 4.367 3.771 4.673 . 0 0 "[ . 1 . 2]" 1
120 1 15 LEU H 1 15 LEU QD 1.800 . 6.000 3.548 2.395 3.913 . 0 0 "[ . 1 . 2]" 1
121 1 15 LEU QD 1 16 LEU H 1.800 . 5.000 3.334 2.044 4.132 . 0 0 "[ . 1 . 2]" 1
122 1 15 LEU QD 1 48 ALA H 1.800 . 6.000 3.374 2.631 4.119 . 0 0 "[ . 1 . 2]" 1
123 1 15 LEU QD 1 52 GLY H 1.800 . 6.000 5.498 4.797 6.007 0.007 18 0 "[ . 1 . 2]" 1
124 1 15 LEU HG 1 16 LEU H 1.800 . 4.000 3.041 2.348 3.971 . 0 0 "[ . 1 . 2]" 1
125 1 15 LEU H 1 86 GLU HA 1.800 . 6.000 5.456 4.825 5.880 . 0 0 "[ . 1 . 2]" 1
126 1 15 LEU H 1 87 ILE HB 1.800 . 5.000 3.349 2.866 4.144 . 0 0 "[ . 1 . 2]" 1
127 1 15 LEU H 1 88 GLU HA 1.800 . 4.000 3.509 3.261 3.841 . 0 0 "[ . 1 . 2]" 1
128 1 15 LEU H 1 16 LEU H 1.800 . 5.000 4.417 4.288 4.490 . 0 0 "[ . 1 . 2]" 1
129 1 15 LEU H 1 87 ILE H 1.800 . 5.000 3.629 3.162 3.956 . 0 0 "[ . 1 . 2]" 1
130 1 15 LEU H 1 89 PHE H 1.800 . 5.000 3.897 3.460 4.228 . 0 0 "[ . 1 . 2]" 1
131 1 15 LEU HA 1 15 LEU QD 1.800 . 5.000 2.513 2.001 3.052 . 0 0 "[ . 1 . 2]" 1
132 1 15 LEU HA 1 15 LEU HG 1.800 . 4.000 2.441 2.176 2.843 . 0 0 "[ . 1 . 2]" 1
133 1 15 LEU HA 1 51 CYS QB 1.800 . 6.000 4.367 3.888 4.822 . 0 0 "[ . 1 . 2]" 1
134 1 15 LEU QB 1 15 LEU QD 1.800 . 5.000 1.879 1.829 1.949 . 0 0 "[ . 1 . 2]" 1
135 1 15 LEU QB 1 87 ILE HB 1.800 . 6.000 2.827 2.226 3.483 . 0 0 "[ . 1 . 2]" 1
136 1 15 LEU QD 1 47 PRO HB3 1.800 . 6.000 3.325 2.074 4.988 . 0 0 "[ . 1 . 2]" 1
137 1 15 LEU QD 1 47 PRO HB2 1.800 . 6.000 2.443 1.941 3.743 . 0 0 "[ . 1 . 2]" 1
138 1 15 LEU QD 1 48 ALA HA 1.800 . 4.000 2.505 1.915 2.933 . 0 0 "[ . 1 . 2]" 1
139 1 15 LEU QD 1 51 CYS QB 1.800 . 6.000 2.889 2.044 3.751 . 0 0 "[ . 1 . 2]" 1
140 1 15 LEU QD 1 54 LEU QD 1.800 . 4.000 2.094 1.784 2.514 0.016 2 0 "[ . 1 . 2]" 1
141 1 15 LEU HG 1 51 CYS QB 1.800 . 6.000 4.237 2.171 5.541 . 0 0 "[ . 1 . 2]" 1
142 1 15 LEU HG 1 48 ALA HA 1.800 . 6.000 4.250 3.215 5.627 . 0 0 "[ . 1 . 2]" 1
143 1 16 LEU HA 1 17 LYS H 1.800 . 3.000 2.149 2.140 2.161 . 0 0 "[ . 1 . 2]" 1
144 1 16 LEU HA 1 87 ILE H 1.800 . 5.000 3.391 2.949 3.896 . 0 0 "[ . 1 . 2]" 1
145 1 16 LEU H 1 16 LEU HB3 1.800 . 4.000 3.112 2.555 3.696 . 0 0 "[ . 1 . 2]" 1
146 1 16 LEU H 1 16 LEU HB2 1.800 . 4.000 2.506 2.285 2.929 . 0 0 "[ . 1 . 2]" 1
147 1 16 LEU QB 1 17 LYS H 1.800 . 5.000 3.657 3.317 3.874 . 0 0 "[ . 1 . 2]" 1
148 1 16 LEU H 1 16 LEU QD 1.800 . 5.000 3.471 2.261 3.881 . 0 0 "[ . 1 . 2]" 1
149 1 16 LEU QD 1 17 LYS H 1.800 . 6.000 3.186 2.140 4.408 . 0 0 "[ . 1 . 2]" 1
150 1 16 LEU QD 1 86 GLU H 1.800 . 6.000 4.252 3.394 5.107 . 0 0 "[ . 1 . 2]" 1
151 1 16 LEU H 1 16 LEU HG 1.800 . 5.000 4.274 3.184 4.741 . 0 0 "[ . 1 . 2]" 1
152 1 16 LEU H 1 51 CYS QB 1.800 . 6.000 5.367 4.835 5.941 . 0 0 "[ . 1 . 2]" 1
153 1 16 LEU H 1 17 LYS H 1.800 . 5.000 4.324 4.271 4.416 . 0 0 "[ . 1 . 2]" 1
154 1 16 LEU HA 1 16 LEU QD 1.800 . 5.000 2.496 1.836 3.064 . 0 0 "[ . 1 . 2]" 1
155 1 16 LEU HA 1 16 LEU HG 1.800 . 4.000 2.691 2.180 3.679 . 0 0 "[ . 1 . 2]" 1
156 1 16 LEU HA 1 86 GLU HA 1.800 . 4.000 3.257 2.336 3.671 . 0 0 "[ . 1 . 2]" 1
157 1 16 LEU HA 1 86 GLU QB 1.800 . 6.000 5.150 3.873 5.602 . 0 0 "[ . 1 . 2]" 1
158 1 16 LEU HA 1 86 GLU HG3 1.800 . 6.000 5.205 4.208 6.002 0.002 3 0 "[ . 1 . 2]" 1
159 1 16 LEU HA 1 86 GLU HG2 1.800 . 6.000 5.735 4.479 6.010 0.010 15 0 "[ . 1 . 2]" 1
160 1 16 LEU QB 1 16 LEU QD 1.800 . 4.000 1.919 1.859 2.083 . 0 0 "[ . 1 . 2]" 1
161 1 16 LEU QB 1 50 ARG QB 1.800 . 6.000 5.729 5.402 5.989 . 0 0 "[ . 1 . 2]" 1
162 1 16 LEU QD 1 85 GLY HA3 1.800 . 6.000 4.348 3.400 5.266 . 0 0 "[ . 1 . 2]" 1
163 1 16 LEU QD 1 85 GLY HA2 1.800 . 6.000 3.639 2.737 4.912 . 0 0 "[ . 1 . 2]" 1
164 1 16 LEU QD 1 85 GLY QA 1.800 . 5.000 3.447 2.633 4.411 . 0 0 "[ . 1 . 2]" 1
165 1 16 LEU QD 1 86 GLU HA 1.800 . 4.000 2.905 1.802 3.891 . 0 0 "[ . 1 . 2]" 1
166 1 16 LEU QD 1 86 GLU QB 1.800 . 5.000 3.494 2.206 4.563 . 0 0 "[ . 1 . 2]" 1
167 1 16 LEU HG 1 86 GLU HA 1.800 . 6.000 3.769 2.011 5.449 . 0 0 "[ . 1 . 2]" 1
168 1 17 LYS HA 1 18 GLU H 1.800 . 3.000 2.205 2.133 2.304 . 0 0 "[ . 1 . 2]" 1
169 1 17 LYS QB 1 18 GLU H 1.800 . 4.000 3.288 2.602 3.764 . 0 0 "[ . 1 . 2]" 1
170 1 17 LYS QD 1 18 GLU H 1.800 . 6.000 3.892 3.008 5.175 . 0 0 "[ . 1 . 2]" 1
171 1 17 LYS QD 1 85 GLY H 1.800 . 6.000 4.733 3.335 5.845 . 0 0 "[ . 1 . 2]" 1
172 1 17 LYS H 1 17 LYS HG3 1.800 . 6.000 3.791 2.047 5.001 . 0 0 "[ . 1 . 2]" 1
173 1 17 LYS H 1 17 LYS HG2 1.800 . 6.000 3.933 2.192 4.572 . 0 0 "[ . 1 . 2]" 1
174 1 17 LYS QG 1 18 GLU H 1.800 . 5.000 3.175 2.129 4.360 . 0 0 "[ . 1 . 2]" 1
175 1 17 LYS H 1 85 GLY HA3 1.800 . 6.000 5.412 4.788 5.783 . 0 0 "[ . 1 . 2]" 1
176 1 17 LYS H 1 85 GLY HA2 1.800 . 6.000 4.169 3.301 4.701 . 0 0 "[ . 1 . 2]" 1
177 1 17 LYS H 1 86 GLU HA 1.800 . 5.000 4.354 3.699 4.950 . 0 0 "[ . 1 . 2]" 1
178 1 17 LYS H 1 18 GLU H 1.800 . 6.000 4.421 4.276 4.533 . 0 0 "[ . 1 . 2]" 1
179 1 17 LYS H 1 86 GLU H 1.800 . 6.000 5.646 5.138 5.951 . 0 0 "[ . 1 . 2]" 1
180 1 17 LYS H 1 87 ILE H 1.800 . 5.000 4.470 3.802 4.868 . 0 0 "[ . 1 . 2]" 1
181 1 17 LYS HA 1 17 LYS QD 1.800 . 6.000 3.906 3.390 4.313 . 0 0 "[ . 1 . 2]" 1
182 1 17 LYS HA 1 17 LYS QG 1.800 . 5.000 2.736 2.032 3.407 . 0 0 "[ . 1 . 2]" 1
183 1 17 LYS HA 1 87 ILE MD 1.800 . 6.000 4.602 3.868 5.593 . 0 0 "[ . 1 . 2]" 1
184 1 17 LYS QB 1 85 GLY QA 1.800 . 6.000 5.200 4.408 5.936 . 0 0 "[ . 1 . 2]" 1
185 1 17 LYS QB 1 87 ILE MD 1.800 . 6.000 2.626 1.774 3.871 0.026 15 0 "[ . 1 . 2]" 1
186 1 17 LYS QB 1 87 ILE QG 1.800 . 6.000 3.954 2.923 5.236 . 0 0 "[ . 1 . 2]" 1
187 1 17 LYS QD 1 23 LEU QD 1.800 . 6.000 4.687 2.999 5.826 . 0 0 "[ . 1 . 2]" 1
188 1 17 LYS QD 1 83 GLN QB 1.800 . 6.000 4.874 3.546 5.825 . 0 0 "[ . 1 . 2]" 1
189 1 17 LYS QD 1 84 ARG HA 1.800 . 6.000 4.390 3.094 5.534 . 0 0 "[ . 1 . 2]" 1
190 1 17 LYS QD 1 87 ILE MD 1.800 . 6.000 2.914 1.887 4.038 . 0 0 "[ . 1 . 2]" 1
191 1 17 LYS HE3 1 23 LEU QD 1.800 . 6.000 4.320 3.084 5.540 . 0 0 "[ . 1 . 2]" 1
192 1 17 LYS HE2 1 23 LEU QD 1.800 . 6.000 4.234 2.324 6.010 0.010 3 0 "[ . 1 . 2]" 1
193 1 17 LYS QE 1 80 LEU QD 1.800 . 6.000 4.704 3.252 5.976 . 0 0 "[ . 1 . 2]" 1
194 1 17 LYS QE 1 81 SER HA 1.800 . 5.000 3.992 2.457 4.912 . 0 0 "[ . 1 . 2]" 1
195 1 17 LYS QG 1 23 LEU QD 1.800 . 6.000 4.330 3.236 5.870 . 0 0 "[ . 1 . 2]" 1
196 1 17 LYS QG 1 87 ILE MD 1.800 . 6.000 2.834 1.843 4.098 . 0 0 "[ . 1 . 2]" 1
197 1 18 GLU HA 1 19 ASP H 1.800 . 4.000 2.423 2.296 2.517 . 0 0 "[ . 1 . 2]" 1
198 1 18 GLU HB3 1 19 ASP H 1.800 . 6.000 2.629 2.212 3.204 . 0 0 "[ . 1 . 2]" 1
199 1 18 GLU HB2 1 19 ASP H 1.800 . 6.000 3.857 3.450 4.170 . 0 0 "[ . 1 . 2]" 1
200 1 18 GLU QB 1 19 ASP H 1.800 . 4.000 2.582 2.194 3.101 . 0 0 "[ . 1 . 2]" 1
201 1 18 GLU HB3 1 21 GLU H 1.800 . 6.000 2.855 2.045 3.662 . 0 0 "[ . 1 . 2]" 1
202 1 18 GLU HB2 1 21 GLU H 1.800 . 6.000 3.036 2.157 3.697 . 0 0 "[ . 1 . 2]" 1
203 1 18 GLU QB 1 21 GLU H 1.800 . 5.000 2.464 2.033 2.759 . 0 0 "[ . 1 . 2]" 1
204 1 18 GLU H 1 18 GLU QG 1.800 . 6.000 3.444 2.553 4.140 . 0 0 "[ . 1 . 2]" 1
205 1 18 GLU H 1 21 GLU QB 1.800 . 6.000 2.114 1.957 2.616 . 0 0 "[ . 1 . 2]" 1
206 1 18 GLU H 1 21 GLU H 1.800 . 6.000 3.490 3.287 3.692 . 0 0 "[ . 1 . 2]" 1
207 1 18 GLU HA 1 18 GLU HG3 1.800 . 4.000 2.922 2.028 3.875 . 0 0 "[ . 1 . 2]" 1
208 1 18 GLU HA 1 18 GLU HG2 1.800 . 4.000 2.798 2.108 3.600 . 0 0 "[ . 1 . 2]" 1
209 1 18 GLU HA 1 20 HIS HD2 1.800 . 6.000 4.853 4.262 5.295 . 0 0 "[ . 1 . 2]" 1
210 1 18 GLU HB3 1 20 HIS HD2 1.800 . 6.000 2.470 2.119 3.120 . 0 0 "[ . 1 . 2]" 1
211 1 18 GLU HB2 1 20 HIS HD2 1.800 . 6.000 3.623 2.604 4.446 . 0 0 "[ . 1 . 2]" 1
212 1 18 GLU QB 1 20 HIS HE1 1.800 . 6.000 3.789 3.312 4.268 . 0 0 "[ . 1 . 2]" 1
213 1 18 GLU QB 1 21 GLU QB 1.800 . 4.000 2.552 1.991 3.357 . 0 0 "[ . 1 . 2]" 1
214 1 18 GLU QB 1 21 GLU QG 1.800 . 4.000 2.557 1.872 3.478 . 0 0 "[ . 1 . 2]" 1
215 1 18 GLU HG3 1 20 HIS HD2 1.800 . 5.000 4.039 2.841 5.009 0.009 14 0 "[ . 1 . 2]" 1
216 1 18 GLU HG2 1 20 HIS HD2 1.800 . 5.000 3.846 2.086 5.033 0.033 2 0 "[ . 1 . 2]" 1
217 1 18 GLU QG 1 20 HIS HE1 1.800 . 6.000 4.534 3.614 5.459 . 0 0 "[ . 1 . 2]" 1
218 1 19 ASP HA 1 21 GLU H 1.800 . 5.000 4.296 4.188 4.354 . 0 0 "[ . 1 . 2]" 1
219 1 19 ASP H 1 20 HIS QB 1.800 . 5.000 4.978 4.898 5.006 0.006 12 0 "[ . 1 . 2]" 1
220 1 19 ASP H 1 20 HIS HD2 1.800 . 4.000 3.739 3.447 4.009 0.009 10 0 "[ . 1 . 2]" 1
221 1 19 ASP H 1 21 GLU H 1.800 . 6.000 4.012 3.894 4.100 . 0 0 "[ . 1 . 2]" 1
222 1 19 ASP QB 1 20 HIS QB 1.800 . 4.000 3.907 3.792 4.002 0.002 4 0 "[ . 1 . 2]" 1
223 1 19 ASP QB 1 20 HIS HD2 1.800 . 5.000 3.927 3.754 4.239 . 0 0 "[ . 1 . 2]" 1
224 1 20 HIS HA 1 21 GLU H 1.800 . 4.000 3.495 3.461 3.507 . 0 0 "[ . 1 . 2]" 1
225 1 20 HIS QB 1 21 GLU QG 1.800 . 6.000 4.201 3.842 4.610 . 0 0 "[ . 1 . 2]" 1
226 1 20 HIS HD2 1 21 GLU QB 1.800 . 6.000 5.098 4.205 5.919 . 0 0 "[ . 1 . 2]" 1
227 1 20 HIS HD2 1 21 GLU HG3 1.800 . 6.000 4.901 3.942 6.006 0.006 9 0 "[ . 1 . 2]" 1
228 1 20 HIS HD2 1 21 GLU HG2 1.800 . 6.000 5.258 4.403 6.014 0.014 7 0 "[ . 1 . 2]" 1
229 1 20 HIS HE1 1 21 GLU HA 1.800 . 6.000 4.912 4.499 5.285 . 0 0 "[ . 1 . 2]" 1
230 1 20 HIS HE1 1 21 GLU QB 1.800 . 6.000 4.371 3.675 4.948 . 0 0 "[ . 1 . 2]" 1
231 1 20 HIS HE1 1 21 GLU HG3 1.800 . 6.000 2.896 2.452 3.461 . 0 0 "[ . 1 . 2]" 1
232 1 20 HIS HE1 1 21 GLU HG2 1.800 . 6.000 2.851 2.376 4.030 . 0 0 "[ . 1 . 2]" 1
233 1 21 GLU HA 1 22 GLY H 1.800 . 3.000 2.441 2.154 2.624 . 0 0 "[ . 1 . 2]" 1
234 1 21 GLU QB 1 22 GLY H 1.800 . 5.000 2.400 2.017 3.511 . 0 0 "[ . 1 . 2]" 1
235 1 21 GLU H 1 21 GLU QG 1.800 . 5.000 2.831 2.220 3.338 . 0 0 "[ . 1 . 2]" 1
236 1 21 GLU QG 1 22 GLY H 1.800 . 5.000 3.871 3.277 4.519 . 0 0 "[ . 1 . 2]" 1
237 1 21 GLU H 1 22 GLY H 1.800 . 5.000 4.565 4.279 4.641 . 0 0 "[ . 1 . 2]" 1
238 1 21 GLU QB 1 47 PRO QG 1.800 . 6.000 3.326 2.501 3.917 . 0 0 "[ . 1 . 2]" 1
239 1 21 GLU QG 1 47 PRO QG 1.800 . 6.000 4.276 3.374 5.090 . 0 0 "[ . 1 . 2]" 1
240 1 22 GLY HA3 1 23 LEU H 1.800 . 3.000 2.299 2.208 2.448 . 0 0 "[ . 1 . 2]" 1
241 1 22 GLY HA2 1 23 LEU H 1.800 . 3.000 2.883 2.691 3.014 0.014 4 0 "[ . 1 . 2]" 1
242 1 22 GLY QA 1 24 GLY H 1.800 . 5.000 4.035 3.551 4.288 . 0 0 "[ . 1 . 2]" 1
243 1 22 GLY H 1 23 LEU H 1.800 . 5.000 4.225 4.067 4.392 . 0 0 "[ . 1 . 2]" 1
244 1 22 GLY QA 1 23 LEU QD 1.800 . 6.000 4.452 3.695 4.798 . 0 0 "[ . 1 . 2]" 1
245 1 22 GLY QA 1 23 LEU HG 1.800 . 6.000 5.361 4.232 6.017 0.017 19 0 "[ . 1 . 2]" 1
246 1 22 GLY QA 1 46 GLN QG 1.800 . 5.000 4.445 4.013 5.005 0.005 12 0 "[ . 1 . 2]" 1
247 1 23 LEU H 1 23 LEU QB 1.800 . 3.500 2.124 2.060 2.263 . 0 0 "[ . 1 . 2]" 1
248 1 23 LEU HB3 1 24 GLY H 1.800 . 5.000 2.370 2.128 2.797 . 0 0 "[ . 1 . 2]" 1
249 1 23 LEU HB2 1 24 GLY H 1.800 . 5.000 3.043 2.422 3.595 . 0 0 "[ . 1 . 2]" 1
250 1 23 LEU HB3 1 25 ILE H 1.800 . 5.000 2.274 2.129 2.825 . 0 0 "[ . 1 . 2]" 1
251 1 23 LEU HB2 1 25 ILE H 1.800 . 5.000 3.839 3.311 4.225 . 0 0 "[ . 1 . 2]" 1
252 1 23 LEU H 1 23 LEU QD 1.800 . 6.000 3.472 2.777 3.731 . 0 0 "[ . 1 . 2]" 1
253 1 23 LEU H 1 23 LEU HG 1.800 . 6.000 4.033 3.342 4.543 . 0 0 "[ . 1 . 2]" 1
254 1 23 LEU H 1 24 GLY H 1.800 . 4.000 2.793 2.497 2.974 . 0 0 "[ . 1 . 2]" 1
255 1 23 LEU H 1 25 ILE H 1.800 . 5.000 4.749 4.476 4.929 . 0 0 "[ . 1 . 2]" 1
256 1 23 LEU HA 1 23 LEU QD 1.800 . 4.000 2.336 1.914 2.808 . 0 0 "[ . 1 . 2]" 1
257 1 23 LEU HA 1 23 LEU HG 1.800 . 4.000 2.577 2.146 3.632 . 0 0 "[ . 1 . 2]" 1
258 1 23 LEU HA 1 47 PRO QD 1.800 . 6.000 5.100 4.307 5.677 . 0 0 "[ . 1 . 2]" 1
259 1 23 LEU HA 1 47 PRO QG 1.800 . 6.000 4.697 3.667 5.696 . 0 0 "[ . 1 . 2]" 1
260 1 23 LEU HB3 1 25 ILE QG 1.800 . 5.000 3.132 2.356 3.858 . 0 0 "[ . 1 . 2]" 1
261 1 23 LEU HB2 1 25 ILE QG 1.800 . 5.000 4.537 3.913 5.000 . 6 0 "[ . 1 . 2]" 1
262 1 23 LEU QB 1 25 ILE MG 1.800 . 6.000 4.691 4.145 5.108 . 0 0 "[ . 1 . 2]" 1
263 1 23 LEU QD 1 25 ILE MG 1.800 . 5.000 3.990 3.421 4.447 . 0 0 "[ . 1 . 2]" 1
264 1 23 LEU QD 1 87 ILE MD 1.800 . 6.000 4.188 3.597 4.839 . 0 0 "[ . 1 . 2]" 1
265 1 23 LEU QD 1 89 PHE HE1 1.800 . 5.000 4.308 3.268 5.833 0.833 13 1 "[ . 1 + . 2]" 1
266 1 24 GLY QA 1 25 ILE H 1.800 . 4.000 2.933 2.879 2.950 . 0 0 "[ . 1 . 2]" 1
267 1 24 GLY QA 1 48 ALA H 1.800 . 5.000 3.396 2.626 3.835 . 0 0 "[ . 1 . 2]" 1
268 1 24 GLY H 1 25 ILE QG 1.800 . 5.000 4.284 3.886 5.005 0.005 16 0 "[ . 1 . 2]" 1
269 1 24 GLY H 1 43 HIS HD2 1.800 . 6.000 4.623 3.331 5.410 . 0 0 "[ . 1 . 2]" 1
270 1 24 GLY H 1 46 GLN HB3 1.800 . 6.000 4.914 4.307 5.310 . 0 0 "[ . 1 . 2]" 1
271 1 24 GLY H 1 46 GLN HB2 1.800 . 6.000 5.440 4.972 5.966 . 0 0 "[ . 1 . 2]" 1
272 1 24 GLY H 1 25 ILE H 1.800 . 3.000 2.484 2.252 2.684 . 0 0 "[ . 1 . 2]" 1
273 1 24 GLY HA3 1 43 HIS QB 1.800 . 6.000 3.623 3.168 4.140 . 0 0 "[ . 1 . 2]" 1
274 1 24 GLY HA2 1 43 HIS QB 1.800 . 6.000 2.547 2.006 3.091 . 0 0 "[ . 1 . 2]" 1
275 1 24 GLY QA 1 43 HIS HD2 1.800 . 6.000 3.986 3.180 5.173 . 0 0 "[ . 1 . 2]" 1
276 1 24 GLY HA3 1 46 GLN HB3 1.800 . 4.000 2.315 2.019 2.742 . 0 0 "[ . 1 . 2]" 1
277 1 24 GLY HA3 1 46 GLN HB2 1.800 . 4.000 3.186 2.669 3.901 . 0 0 "[ . 1 . 2]" 1
278 1 24 GLY HA2 1 46 GLN HB3 1.800 . 4.000 3.195 2.121 3.747 . 0 0 "[ . 1 . 2]" 1
279 1 24 GLY HA2 1 46 GLN HB2 1.800 . 4.000 3.250 2.697 3.995 . 0 0 "[ . 1 . 2]" 1
280 1 24 GLY QA 1 46 GLN QG 1.800 . 6.000 2.109 1.884 3.200 . 0 0 "[ . 1 . 2]" 1
281 1 24 GLY QA 1 48 ALA MB 1.800 . 5.000 3.100 2.366 3.534 . 0 0 "[ . 1 . 2]" 1
282 1 25 ILE HA 1 26 SER H 1.800 . 3.000 2.322 2.226 2.489 . 0 0 "[ . 1 . 2]" 1
283 1 25 ILE HA 1 41 GLU H 1.800 . 6.000 5.508 5.160 5.700 . 0 0 "[ . 1 . 2]" 1
284 1 25 ILE HA 1 43 HIS H 1.800 . 4.000 2.394 2.017 2.789 . 0 0 "[ . 1 . 2]" 1
285 1 25 ILE H 1 25 ILE HG13 1.800 . 5.000 2.486 2.009 4.092 . 0 0 "[ . 1 . 2]" 1
286 1 25 ILE H 1 25 ILE HG12 1.800 . 5.000 3.165 2.448 3.767 . 0 0 "[ . 1 . 2]" 1
287 1 25 ILE H 1 25 ILE QG 1.800 . 4.000 2.252 1.994 2.911 . 0 0 "[ . 1 . 2]" 1
288 1 25 ILE H 1 25 ILE MG 1.800 . 5.000 3.223 3.111 3.349 . 0 0 "[ . 1 . 2]" 1
289 1 25 ILE MG 1 26 SER H 1.800 . 5.000 3.616 3.386 3.708 . 0 0 "[ . 1 . 2]" 1
290 1 25 ILE H 1 43 HIS HD2 1.800 . 5.000 4.086 2.853 4.998 . 0 0 "[ . 1 . 2]" 1
291 1 25 ILE H 1 26 SER H 1.800 . 5.000 4.404 4.350 4.440 . 0 0 "[ . 1 . 2]" 1
292 1 25 ILE HA 1 25 ILE MD 1.800 . 6.000 3.922 3.501 4.176 . 0 0 "[ . 1 . 2]" 1
293 1 25 ILE HA 1 25 ILE MG 1.800 . 4.000 2.269 2.139 2.370 . 0 0 "[ . 1 . 2]" 1
294 1 25 ILE HA 1 42 ILE HA 1.800 . 4.000 2.332 2.103 2.793 . 0 0 "[ . 1 . 2]" 1
295 1 25 ILE HA 1 42 ILE MG 1.800 . 6.000 3.506 3.015 3.968 . 0 0 "[ . 1 . 2]" 1
296 1 25 ILE HA 1 43 HIS HD2 1.800 . 6.000 3.156 2.140 4.385 . 0 0 "[ . 1 . 2]" 1
297 1 25 ILE HA 1 48 ALA MB 1.800 . 6.000 4.129 3.821 4.663 . 0 0 "[ . 1 . 2]" 1
298 1 25 ILE HB 1 25 ILE MD 1.800 . 5.000 2.272 1.994 3.218 . 0 0 "[ . 1 . 2]" 1
299 1 25 ILE HB 1 27 ILE QG 1.800 . 6.000 5.865 5.552 6.001 0.001 17 0 "[ . 1 . 2]" 1
300 1 25 ILE HB 1 42 ILE HA 1.800 . 6.000 3.417 2.871 3.968 . 0 0 "[ . 1 . 2]" 1
301 1 25 ILE MD 1 80 LEU QD 1.800 . 6.000 3.869 3.124 4.974 . 0 0 "[ . 1 . 2]" 1
302 1 25 ILE MD 1 89 PHE QE 1.800 . 6.000 4.122 2.982 5.195 . 0 0 "[ . 1 . 2]" 1
303 1 25 ILE MG 1 42 ILE MG 1.800 . 5.000 1.982 1.801 2.571 . 0 0 "[ . 1 . 2]" 1
304 1 25 ILE MG 1 48 ALA MB 1.800 . 5.000 1.883 1.795 2.223 0.005 18 0 "[ . 1 . 2]" 1
305 1 26 SER HA 1 27 ILE H 1.800 . 3.500 2.193 2.182 2.208 . 0 0 "[ . 1 . 2]" 1
306 1 26 SER HB3 1 27 ILE H 1.800 . 5.000 3.502 3.064 4.034 . 0 0 "[ . 1 . 2]" 1
307 1 26 SER HB2 1 27 ILE H 1.800 . 5.000 4.166 3.814 4.386 . 0 0 "[ . 1 . 2]" 1
308 1 26 SER HB3 1 41 GLU H 1.800 . 5.000 3.386 2.467 4.588 . 0 0 "[ . 1 . 2]" 1
309 1 26 SER HB2 1 41 GLU H 1.800 . 5.000 3.593 2.518 4.602 . 0 0 "[ . 1 . 2]" 1
310 1 26 SER H 1 41 GLU QB 1.800 . 5.000 3.167 2.695 3.790 . 0 0 "[ . 1 . 2]" 1
311 1 26 SER H 1 42 ILE HA 1.800 . 4.000 3.168 2.886 3.550 . 0 0 "[ . 1 . 2]" 1
312 1 26 SER H 1 43 HIS HD2 1.800 . 5.000 4.027 3.208 4.810 . 0 0 "[ . 1 . 2]" 1
313 1 26 SER H 1 27 ILE H 1.800 . 5.000 4.468 4.414 4.532 . 0 0 "[ . 1 . 2]" 1
314 1 26 SER H 1 40 SER H 1.800 . 5.000 4.588 4.315 4.812 . 0 0 "[ . 1 . 2]" 1
315 1 26 SER H 1 41 GLU H 1.800 . 4.000 3.448 3.218 3.650 . 0 0 "[ . 1 . 2]" 1
316 1 26 SER H 1 43 HIS H 1.800 . 5.000 4.105 3.703 4.483 . 0 0 "[ . 1 . 2]" 1
317 1 26 SER HB3 1 40 SER QB 1.800 . 6.000 4.606 3.798 5.579 . 0 0 "[ . 1 . 2]" 1
318 1 26 SER HB2 1 40 SER QB 1.800 . 6.000 5.175 3.431 5.979 . 0 0 "[ . 1 . 2]" 1
319 1 26 SER HB3 1 41 GLU QB 1.800 . 5.000 2.550 1.854 3.936 . 0 0 "[ . 1 . 2]" 1
320 1 26 SER HB2 1 41 GLU QB 1.800 . 5.000 2.213 1.773 3.075 0.027 1 0 "[ . 1 . 2]" 1
321 1 26 SER QB 1 41 GLU QB 1.800 . 4.000 1.920 1.765 2.510 0.035 1 0 "[ . 1 . 2]" 1
322 1 26 SER QB 1 43 HIS HD2 1.800 . 6.000 4.025 3.023 4.872 . 0 0 "[ . 1 . 2]" 1
323 1 27 ILE HA 1 28 THR H 1.800 . 3.500 2.313 2.226 2.355 . 0 0 "[ . 1 . 2]" 1
324 1 27 ILE HA 1 38 LEU H 1.800 . 6.000 4.702 4.287 4.951 . 0 0 "[ . 1 . 2]" 1
325 1 27 ILE HA 1 40 SER H 1.800 . 4.000 2.831 2.493 3.112 . 0 0 "[ . 1 . 2]" 1
326 1 27 ILE HA 1 41 GLU H 1.800 . 5.000 4.212 4.015 4.378 . 0 0 "[ . 1 . 2]" 1
327 1 27 ILE HB 1 28 THR H 1.800 . 4.000 2.606 2.501 2.892 . 0 0 "[ . 1 . 2]" 1
328 1 27 ILE HB 1 38 LEU H 1.800 . 5.000 3.932 3.383 4.297 . 0 0 "[ . 1 . 2]" 1
329 1 27 ILE H 1 27 ILE MD 1.800 . 6.000 3.816 3.733 3.918 . 0 0 "[ . 1 . 2]" 1
330 1 27 ILE MD 1 77 VAL H 1.800 . 5.000 4.790 4.396 5.009 0.009 3 0 "[ . 1 . 2]" 1
331 1 27 ILE H 1 27 ILE HG13 1.800 . 4.000 2.577 2.224 2.870 . 0 0 "[ . 1 . 2]" 1
332 1 27 ILE H 1 27 ILE HG12 1.800 . 4.000 2.284 2.094 2.645 . 0 0 "[ . 1 . 2]" 1
333 1 27 ILE QG 1 29 GLY H 1.800 . 6.000 5.755 5.388 6.005 0.005 20 0 "[ . 1 . 2]" 1
334 1 27 ILE H 1 27 ILE MG 1.800 . 5.000 3.032 2.961 3.133 . 0 0 "[ . 1 . 2]" 1
335 1 27 ILE MG 1 28 THR H 1.800 . 5.000 3.576 3.480 3.700 . 0 0 "[ . 1 . 2]" 1
336 1 27 ILE MG 1 40 SER H 1.800 . 5.000 3.957 3.625 4.260 . 0 0 "[ . 1 . 2]" 1
337 1 27 ILE H 1 28 THR H 1.800 . 5.000 4.507 4.482 4.526 . 0 0 "[ . 1 . 2]" 1
338 1 27 ILE H 1 40 SER H 1.800 . 6.000 4.959 4.625 5.280 . 0 0 "[ . 1 . 2]" 1
339 1 27 ILE HA 1 27 ILE MD 1.800 . 6.000 4.168 4.127 4.186 . 0 0 "[ . 1 . 2]" 1
340 1 27 ILE HA 1 27 ILE MG 1.800 . 4.000 2.249 2.119 2.330 . 0 0 "[ . 1 . 2]" 1
341 1 27 ILE HA 1 39 ILE HA 1.800 . 4.500 2.284 2.000 2.747 . 0 0 "[ . 1 . 2]" 1
342 1 27 ILE HA 1 40 SER HB3 1.800 . 6.000 5.397 4.513 5.994 . 0 0 "[ . 1 . 2]" 1
343 1 27 ILE HA 1 40 SER HB2 1.800 . 6.000 4.433 3.572 5.829 . 0 0 "[ . 1 . 2]" 1
344 1 27 ILE HB 1 27 ILE MD 1.800 . 5.000 2.329 2.221 2.452 . 0 0 "[ . 1 . 2]" 1
345 1 27 ILE HB 1 37 ILE MG 1.800 . 5.000 1.975 1.872 2.119 . 0 0 "[ . 1 . 2]" 1
346 1 27 ILE HB 1 39 ILE HA 1.800 . 6.000 4.010 3.488 4.389 . 0 0 "[ . 1 . 2]" 1
347 1 27 ILE MD 1 37 ILE MG 1.800 . 5.000 1.981 1.809 2.381 . 0 0 "[ . 1 . 2]" 1
348 1 27 ILE MD 1 73 HIS HA 1.800 . 5.000 4.347 4.122 4.770 . 0 0 "[ . 1 . 2]" 1
349 1 27 ILE MD 1 73 HIS HD2 1.800 . 5.000 3.023 2.375 5.022 0.022 17 0 "[ . 1 . 2]" 1
350 1 27 ILE MD 1 73 HIS HE1 1.800 . 5.000 3.976 1.856 4.972 . 0 0 "[ . 1 . 2]" 1
351 1 27 ILE MD 1 76 ALA MB 1.800 . 5.000 3.513 3.207 3.822 . 0 0 "[ . 1 . 2]" 1
352 1 27 ILE MD 1 77 VAL HA 1.800 . 5.000 4.113 3.556 4.663 . 0 0 "[ . 1 . 2]" 1
353 1 27 ILE MD 1 77 VAL QG 1.800 . 5.000 3.031 2.517 3.480 . 0 0 "[ . 1 . 2]" 1
354 1 27 ILE QG 1 27 ILE MG 1.800 . 5.000 2.225 1.994 2.355 . 0 0 "[ . 1 . 2]" 1
355 1 27 ILE QG 1 73 HIS HE1 1.800 . 6.000 3.854 2.148 4.787 . 0 0 "[ . 1 . 2]" 1
356 1 27 ILE MG 1 39 ILE HA 1.800 . 4.000 2.454 1.973 2.973 . 0 0 "[ . 1 . 2]" 1
357 1 27 ILE MG 1 39 ILE MD 1.800 . 4.000 2.880 1.784 3.578 0.016 9 0 "[ . 1 . 2]" 1
358 1 28 THR HA 1 29 GLY H 1.800 . 3.000 2.308 2.233 2.526 . 0 0 "[ . 1 . 2]" 1
359 1 28 THR HB 1 29 GLY H 1.800 . 4.000 3.480 2.266 4.020 0.020 7 0 "[ . 1 . 2]" 1
360 1 28 THR H 1 28 THR MG 1.800 . 4.500 2.457 2.093 2.882 . 0 0 "[ . 1 . 2]" 1
361 1 28 THR MG 1 29 GLY H 1.800 . 6.000 3.826 3.620 4.060 . 0 0 "[ . 1 . 2]" 1
362 1 28 THR H 1 37 ILE HA 1.800 . 6.000 4.416 4.024 4.858 . 0 0 "[ . 1 . 2]" 1
363 1 28 THR H 1 37 ILE MG 1.800 . 5.000 2.820 2.520 3.139 . 0 0 "[ . 1 . 2]" 1
364 1 28 THR H 1 38 LEU QB 1.800 . 5.000 4.549 4.084 4.983 . 0 0 "[ . 1 . 2]" 1
365 1 28 THR H 1 39 ILE HA 1.800 . 5.000 3.694 3.394 4.259 . 0 0 "[ . 1 . 2]" 1
366 1 28 THR H 1 40 SER QB 1.800 . 6.000 4.227 3.781 5.131 . 0 0 "[ . 1 . 2]" 1
367 1 28 THR H 1 29 GLY H 1.800 . 5.000 4.411 4.362 4.493 . 0 0 "[ . 1 . 2]" 1
368 1 28 THR H 1 38 LEU H 1.800 . 4.000 2.999 2.594 3.299 . 0 0 "[ . 1 . 2]" 1
369 1 28 THR H 1 40 SER H 1.800 . 6.000 4.010 3.773 4.555 . 0 0 "[ . 1 . 2]" 1
370 1 28 THR HA 1 28 THR MG 1.800 . 6.000 2.973 2.448 3.236 . 0 0 "[ . 1 . 2]" 1
371 1 28 THR HA 1 73 HIS HD2 1.800 . 5.000 4.723 4.098 5.021 0.021 2 0 "[ . 1 . 2]" 1
372 1 28 THR HA 1 73 HIS HE1 1.800 . 5.500 4.495 3.112 5.166 . 0 0 "[ . 1 . 2]" 1
373 1 28 THR MG 1 38 LEU QB 1.800 . 5.000 4.429 3.112 5.021 0.021 9 0 "[ . 1 . 2]" 1
374 1 28 THR MG 1 40 SER HA 1.800 . 6.000 4.305 3.843 4.875 . 0 0 "[ . 1 . 2]" 1
375 1 28 THR MG 1 40 SER HB3 1.800 . 4.000 3.092 2.040 3.792 . 0 0 "[ . 1 . 2]" 1
376 1 28 THR MG 1 40 SER HB2 1.800 . 4.000 2.346 1.888 3.846 . 0 0 "[ . 1 . 2]" 1
377 1 29 GLY H 1 29 GLY HA3 1.800 . 3.000 2.948 2.916 2.960 . 0 0 "[ . 1 . 2]" 1
378 1 29 GLY H 1 29 GLY HA2 1.800 . 3.000 2.501 2.378 2.661 . 0 0 "[ . 1 . 2]" 1
379 1 29 GLY HA3 1 30 GLY H 1.800 . 3.000 2.358 2.220 2.498 . 0 0 "[ . 1 . 2]" 1
380 1 29 GLY HA2 1 30 GLY H 1.800 . 3.000 2.837 2.664 3.023 0.023 17 0 "[ . 1 . 2]" 1
381 1 29 GLY QA 1 38 LEU H 1.800 . 5.000 3.604 3.242 3.956 . 0 0 "[ . 1 . 2]" 1
382 1 29 GLY H 1 73 HIS HD2 1.800 . 5.000 4.750 3.817 5.007 0.007 12 0 "[ . 1 . 2]" 1
383 1 29 GLY H 1 73 HIS HE1 1.800 . 6.000 5.257 3.917 5.986 . 0 0 "[ . 1 . 2]" 1
384 1 29 GLY H 1 30 GLY H 1.800 . 5.000 4.503 4.385 4.594 . 0 0 "[ . 1 . 2]" 1
385 1 29 GLY QA 1 33 HIS HD2 1.800 . 6.000 4.500 3.398 5.652 . 0 0 "[ . 1 . 2]" 1
386 1 29 GLY QA 1 35 VAL HB 1.800 . 6.000 4.688 3.830 5.570 . 0 0 "[ . 1 . 2]" 1
387 1 29 GLY HA3 1 35 VAL QG 1.800 . 5.000 3.225 2.422 3.826 . 0 0 "[ . 1 . 2]" 1
388 1 29 GLY HA2 1 35 VAL QG 1.800 . 5.000 3.006 2.122 3.733 . 0 0 "[ . 1 . 2]" 1
389 1 29 GLY QA 1 37 ILE HA 1.800 . 6.000 2.611 1.944 3.056 . 0 0 "[ . 1 . 2]" 1
390 1 30 GLY H 1 30 GLY HA3 1.800 . 3.000 2.865 2.751 2.949 . 0 0 "[ . 1 . 2]" 1
391 1 30 GLY H 1 30 GLY HA2 1.800 . 3.000 2.739 2.573 2.860 . 0 0 "[ . 1 . 2]" 1
392 1 30 GLY HA3 1 31 LYS H 1.800 . 4.000 3.257 3.066 3.392 . 0 0 "[ . 1 . 2]" 1
393 1 30 GLY HA2 1 31 LYS H 1.800 . 4.000 2.148 2.134 2.175 . 0 0 "[ . 1 . 2]" 1
394 1 30 GLY QA 1 73 HIS H 1.800 . 5.000 3.071 2.733 3.742 . 0 0 "[ . 1 . 2]" 1
395 1 30 GLY H 1 33 HIS QB 1.800 . 6.000 4.093 3.577 4.687 . 0 0 "[ . 1 . 2]" 1
396 1 30 GLY H 1 33 HIS HD2 1.800 . 5.000 4.451 3.783 5.010 0.010 4 0 "[ . 1 . 2]" 1
397 1 30 GLY H 1 35 VAL HB 1.800 . 6.000 4.667 3.970 5.408 . 0 0 "[ . 1 . 2]" 1
398 1 30 GLY H 1 35 VAL QG 1.800 . 3.000 2.480 1.984 3.007 0.007 2 0 "[ . 1 . 2]" 1
399 1 30 GLY H 1 37 ILE HA 1.800 . 5.000 3.685 2.931 4.163 . 0 0 "[ . 1 . 2]" 1
400 1 30 GLY H 1 37 ILE MD 1.800 . 5.000 3.477 2.142 4.883 . 0 0 "[ . 1 . 2]" 1
401 1 30 GLY H 1 73 HIS HD2 1.800 . 6.000 5.276 3.988 6.003 0.003 4 0 "[ . 1 . 2]" 1
402 1 30 GLY H 1 31 LYS H 1.800 . 5.000 3.807 3.491 4.034 . 0 0 "[ . 1 . 2]" 1
403 1 30 GLY H 1 33 HIS H 1.800 . 6.000 4.822 4.598 5.060 . 0 0 "[ . 1 . 2]" 1
404 1 30 GLY H 1 35 VAL H 1.800 . 6.000 4.095 3.482 4.593 . 0 0 "[ . 1 . 2]" 1
405 1 30 GLY H 1 38 LEU H 1.800 . 6.000 5.490 4.829 5.842 . 0 0 "[ . 1 . 2]" 1
406 1 30 GLY QA 1 33 HIS HD2 1.800 . 6.000 3.009 1.950 5.762 . 0 0 "[ . 1 . 2]" 1
407 1 30 GLY HA3 1 37 ILE MD 1.800 . 5.000 4.029 3.257 4.954 . 0 0 "[ . 1 . 2]" 1
408 1 30 GLY HA2 1 37 ILE MD 1.800 . 5.000 2.662 1.938 3.453 . 0 0 "[ . 1 . 2]" 1
409 1 30 GLY QA 1 37 ILE MD 1.800 . 4.000 2.625 1.924 3.391 . 0 0 "[ . 1 . 2]" 1
410 1 30 GLY QA 1 37 ILE QG 1.800 . 6.000 3.005 1.928 4.238 . 0 0 "[ . 1 . 2]" 1
411 1 30 GLY QA 1 73 HIS HA 1.800 . 5.000 3.707 3.219 4.570 . 0 0 "[ . 1 . 2]" 1
412 1 31 LYS HA 1 33 HIS H 1.800 . 5.000 3.986 3.869 4.172 . 0 0 "[ . 1 . 2]" 1
413 1 31 LYS HA 1 34 GLY H 1.800 . 4.000 3.189 2.993 3.737 . 0 0 "[ . 1 . 2]" 1
414 1 31 LYS HA 1 35 VAL H 1.800 . 4.000 3.078 2.476 4.014 0.014 2 0 "[ . 1 . 2]" 1
415 1 31 LYS H 1 31 LYS HB3 1.800 . 4.000 2.957 2.610 3.572 . 0 0 "[ . 1 . 2]" 1
416 1 31 LYS H 1 31 LYS HB2 1.800 . 4.000 2.222 2.077 2.437 . 0 0 "[ . 1 . 2]" 1
417 1 31 LYS HB3 1 71 THR H 1.800 . 5.000 4.862 4.552 5.039 0.039 10 0 "[ . 1 . 2]" 1
418 1 31 LYS HB2 1 71 THR H 1.800 . 5.000 4.438 4.123 4.941 . 0 0 "[ . 1 . 2]" 1
419 1 31 LYS QB 1 73 HIS H 1.800 . 5.000 3.792 3.276 4.444 . 0 0 "[ . 1 . 2]" 1
420 1 31 LYS QG 1 33 HIS H 1.800 . 6.000 5.593 5.106 5.889 . 0 0 "[ . 1 . 2]" 1
421 1 31 LYS H 1 37 ILE MD 1.800 . 6.000 2.757 2.108 3.653 . 0 0 "[ . 1 . 2]" 1
422 1 31 LYS H 1 72 LYS HA 1.800 . 5.000 3.238 2.849 3.885 . 0 0 "[ . 1 . 2]" 1
423 1 31 LYS H 1 72 LYS QB 1.800 . 6.000 4.839 4.444 5.326 . 0 0 "[ . 1 . 2]" 1
424 1 31 LYS H 1 73 HIS H 1.800 . 6.000 3.073 2.607 3.630 . 0 0 "[ . 1 . 2]" 1
425 1 31 LYS HA 1 34 GLY QA 1.800 . 5.000 4.032 3.654 4.460 . 0 0 "[ . 1 . 2]" 1
426 1 31 LYS HB3 1 72 LYS HA 1.800 . 5.000 2.682 2.072 4.371 . 0 0 "[ . 1 . 2]" 1
427 1 31 LYS HB2 1 72 LYS HA 1.800 . 5.000 2.987 2.244 4.137 . 0 0 "[ . 1 . 2]" 1
428 1 31 LYS QB 1 72 LYS QB 1.800 . 5.000 4.215 3.708 4.861 . 0 0 "[ . 1 . 2]" 1
429 1 31 LYS QD 1 34 GLY QA 1.800 . 5.500 4.173 3.115 5.223 . 0 0 "[ . 1 . 2]" 1
430 1 31 LYS QD 1 70 ASP HA 1.800 . 6.000 4.031 2.700 5.687 . 0 0 "[ . 1 . 2]" 1
431 1 31 LYS QE 1 34 GLY QA 1.800 . 6.000 4.594 3.473 5.786 . 0 0 "[ . 1 . 2]" 1
432 1 31 LYS QE 1 69 ARG QG 1.800 . 5.000 3.585 2.130 4.900 . 0 0 "[ . 1 . 2]" 1
433 1 31 LYS QE 1 70 ASP HA 1.800 . 4.000 3.172 2.053 4.044 0.044 3 0 "[ . 1 . 2]" 1
434 1 31 LYS QG 1 34 GLY QA 1.800 . 6.000 4.776 4.082 5.787 . 0 0 "[ . 1 . 2]" 1
435 1 31 LYS QG 1 36 PRO QG 1.800 . 6.000 5.344 3.629 6.006 0.006 4 0 "[ . 1 . 2]" 1
436 1 32 GLU HA 1 33 HIS H 1.800 . 5.000 3.503 3.495 3.508 . 0 0 "[ . 1 . 2]" 1
437 1 32 GLU QB 1 33 HIS H 1.800 . 5.000 2.965 2.773 3.526 . 0 0 "[ . 1 . 2]" 1
438 1 32 GLU QG 1 33 HIS H 1.800 . 6.000 3.877 2.085 4.632 . 0 0 "[ . 1 . 2]" 1
439 1 32 GLU HA 1 32 GLU QG 1.800 . 4.000 2.495 2.090 3.360 . 0 0 "[ . 1 . 2]" 1
440 1 32 GLU HA 1 33 HIS HA 1.800 . 5.000 4.713 4.634 4.763 . 0 0 "[ . 1 . 2]" 1
441 1 32 GLU HA 1 72 LYS QG 1.800 . 5.000 3.660 2.746 4.901 . 0 0 "[ . 1 . 2]" 1
442 1 32 GLU HA 1 72 LYS QD 1.800 . 5.000 4.102 2.314 5.006 0.006 10 0 "[ . 1 . 2]" 1
443 1 33 HIS HA 1 34 GLY H 1.800 . 5.000 3.471 3.083 3.528 . 0 0 "[ . 1 . 2]" 1
444 1 33 HIS H 1 33 HIS HB3 1.800 . 4.000 3.491 2.431 3.660 . 0 0 "[ . 1 . 2]" 1
445 1 33 HIS H 1 33 HIS HB2 1.800 . 4.000 2.474 2.241 2.672 . 0 0 "[ . 1 . 2]" 1
446 1 33 HIS HB3 1 34 GLY H 1.800 . 6.000 3.814 2.888 4.473 . 0 0 "[ . 1 . 2]" 1
447 1 33 HIS HB2 1 34 GLY H 1.800 . 6.000 3.126 2.838 4.080 . 0 0 "[ . 1 . 2]" 1
448 1 33 HIS HB3 1 35 VAL H 1.800 . 6.000 4.322 3.029 4.967 . 0 0 "[ . 1 . 2]" 1
449 1 33 HIS HB2 1 35 VAL H 1.800 . 6.000 3.506 2.959 4.944 . 0 0 "[ . 1 . 2]" 1
450 1 33 HIS H 1 33 HIS HD2 1.800 . 5.000 3.466 2.092 5.005 0.005 4 0 "[ . 1 . 2]" 1
451 1 33 HIS H 1 34 GLY QA 1.800 . 5.000 4.391 4.288 4.484 . 0 0 "[ . 1 . 2]" 1
452 1 33 HIS H 1 35 VAL QG 1.800 . 5.000 4.092 3.502 4.686 . 0 0 "[ . 1 . 2]" 1
453 1 33 HIS H 1 34 GLY H 1.800 . 3.000 2.434 2.297 2.724 . 0 0 "[ . 1 . 2]" 1
454 1 33 HIS H 1 35 VAL H 1.800 . 5.000 3.831 3.425 4.145 . 0 0 "[ . 1 . 2]" 1
455 1 33 HIS HB3 1 35 VAL QG 1.800 . 6.000 3.287 2.633 3.680 . 0 0 "[ . 1 . 2]" 1
456 1 33 HIS HB2 1 35 VAL QG 1.800 . 6.000 2.790 2.032 4.522 . 0 0 "[ . 1 . 2]" 1
457 1 33 HIS QB 1 35 VAL QG 1.800 . 4.000 2.550 1.983 3.103 . 0 0 "[ . 1 . 2]" 1
458 1 33 HIS HD2 1 35 VAL QG 1.800 . 5.000 3.895 2.069 4.541 . 0 0 "[ . 1 . 2]" 1
459 1 34 GLY QA 1 35 VAL H 1.800 . 4.000 2.842 2.769 2.890 . 0 0 "[ . 1 . 2]" 1
460 1 34 GLY H 1 35 VAL QG 1.800 . 6.000 3.429 3.133 3.757 . 0 0 "[ . 1 . 2]" 1
461 1 34 GLY H 1 35 VAL H 1.800 . 4.000 2.145 2.008 2.734 . 0 0 "[ . 1 . 2]" 1
462 1 34 GLY QA 1 35 VAL HA 1.800 . 5.000 4.014 4.001 4.025 . 0 0 "[ . 1 . 2]" 1
463 1 35 VAL H 1 35 VAL MG1 1.800 . 5.000 2.965 2.148 3.377 . 0 0 "[ . 1 . 2]" 1
464 1 35 VAL H 1 35 VAL MG2 1.800 . 5.000 2.601 1.977 3.985 . 0 0 "[ . 1 . 2]" 1
465 1 35 VAL H 1 35 VAL QG 1.800 . 3.000 2.151 1.947 2.384 . 0 0 "[ . 1 . 2]" 1
466 1 35 VAL H 1 36 PRO HA 1.800 . 6.000 4.959 4.800 5.365 . 0 0 "[ . 1 . 2]" 1
467 1 35 VAL H 1 36 PRO QD 1.800 . 5.000 4.217 4.091 4.387 . 0 0 "[ . 1 . 2]" 1
468 1 35 VAL HA 1 35 VAL MG1 1.800 . 5.000 2.502 2.138 3.212 . 0 0 "[ . 1 . 2]" 1
469 1 35 VAL HA 1 35 VAL MG2 1.800 . 5.000 2.983 2.281 3.209 . 0 0 "[ . 1 . 2]" 1
470 1 35 VAL HA 1 36 PRO HD3 1.800 . 3.000 2.019 1.857 2.389 . 0 0 "[ . 1 . 2]" 1
471 1 35 VAL HA 1 36 PRO HD2 1.800 . 3.000 2.568 2.144 2.801 . 0 0 "[ . 1 . 2]" 1
472 1 35 VAL HA 1 36 PRO HG3 1.800 . 6.000 4.169 4.034 4.491 . 0 0 "[ . 1 . 2]" 1
473 1 35 VAL HA 1 36 PRO HG2 1.800 . 6.000 4.432 4.320 4.507 . 0 0 "[ . 1 . 2]" 1
474 1 35 VAL HB 1 36 PRO HD3 1.800 . 5.000 3.803 3.299 4.711 . 0 0 "[ . 1 . 2]" 1
475 1 35 VAL HB 1 36 PRO HD2 1.800 . 5.000 3.070 2.145 4.267 . 0 0 "[ . 1 . 2]" 1
476 1 35 VAL HB 1 36 PRO QG 1.800 . 6.000 4.736 3.730 5.730 . 0 0 "[ . 1 . 2]" 1
477 1 35 VAL HB 1 36 PRO QD 1.800 . 4.000 2.905 2.129 3.778 . 0 0 "[ . 1 . 2]" 1
478 1 35 VAL QG 1 36 PRO HD3 1.800 . 5.000 3.362 2.814 3.789 . 0 0 "[ . 1 . 2]" 1
479 1 35 VAL QG 1 36 PRO HD2 1.800 . 5.000 2.923 1.944 3.447 . 0 0 "[ . 1 . 2]" 1
480 1 35 VAL QG 1 36 PRO QD 1.800 . 4.000 2.710 1.930 3.088 . 0 0 "[ . 1 . 2]" 1
481 1 35 VAL QG 1 36 PRO QG 1.800 . 6.000 4.161 2.918 4.545 . 0 0 "[ . 1 . 2]" 1
482 1 36 PRO HA 1 36 PRO HD3 1.800 . 6.000 3.723 3.539 3.790 . 0 0 "[ . 1 . 2]" 1
483 1 36 PRO HA 1 36 PRO HD2 1.800 . 6.000 3.979 3.926 4.099 . 0 0 "[ . 1 . 2]" 1
484 1 36 PRO HA 1 36 PRO QD 1.800 . 5.000 3.412 3.339 3.434 . 0 0 "[ . 1 . 2]" 1
485 1 36 PRO HA 1 37 ILE H 1.800 . 3.000 2.307 2.282 2.325 . 0 0 "[ . 1 . 2]" 1
486 1 36 PRO HB3 1 37 ILE H 1.800 . 5.000 3.245 3.068 3.635 . 0 0 "[ . 1 . 2]" 1
487 1 36 PRO HB2 1 37 ILE H 1.800 . 5.000 3.246 2.898 3.439 . 0 0 "[ . 1 . 2]" 1
488 1 36 PRO QB 1 37 ILE H 1.800 . 4.000 2.844 2.782 2.907 . 0 0 "[ . 1 . 2]" 1
489 1 36 PRO HB3 1 59 ALA MB 1.800 . 5.000 4.452 3.893 4.880 . 0 0 "[ . 1 . 2]" 1
490 1 36 PRO HB2 1 59 ALA MB 1.800 . 5.000 3.450 2.808 3.977 . 0 0 "[ . 1 . 2]" 1
491 1 36 PRO QB 1 61 LEU HA 1.800 . 6.000 4.860 4.236 5.596 . 0 0 "[ . 1 . 2]" 1
492 1 36 PRO HB3 1 61 LEU QD 1.800 . 5.000 4.187 3.563 4.815 . 0 0 "[ . 1 . 2]" 1
493 1 36 PRO HB2 1 61 LEU QD 1.800 . 5.000 4.687 4.264 5.014 0.014 11 0 "[ . 1 . 2]" 1
494 1 36 PRO QB 1 68 LEU QD 1.800 . 6.000 4.955 3.255 5.930 . 0 0 "[ . 1 . 2]" 1
495 1 36 PRO QD 1 37 ILE H 1.800 . 5.000 4.979 4.959 5.010 0.010 13 0 "[ . 1 . 2]" 1
496 1 36 PRO QG 1 59 ALA MB 1.800 . 6.000 3.962 3.040 4.611 . 0 0 "[ . 1 . 2]" 1
497 1 37 ILE HA 1 38 LEU H 1.800 . 3.000 2.189 2.152 2.221 . 0 0 "[ . 1 . 2]" 1
498 1 37 ILE HB 1 60 ILE H 1.800 . 5.000 4.296 3.707 4.902 . 0 0 "[ . 1 . 2]" 1
499 1 37 ILE MD 1 76 ALA H 1.800 . 6.000 4.909 3.954 5.999 . 0 0 "[ . 1 . 2]" 1
500 1 37 ILE H 1 37 ILE HG13 1.800 . 5.000 3.008 2.066 3.738 . 0 0 "[ . 1 . 2]" 1
501 1 37 ILE H 1 37 ILE HG12 1.800 . 5.000 3.134 2.116 3.888 . 0 0 "[ . 1 . 2]" 1
502 1 37 ILE MG 1 38 LEU H 1.800 . 4.000 2.399 2.131 2.716 . 0 0 "[ . 1 . 2]" 1
503 1 37 ILE H 1 60 ILE HB 1.800 . 5.000 4.047 3.545 4.497 . 0 0 "[ . 1 . 2]" 1
504 1 37 ILE H 1 60 ILE MD 1.800 . 4.000 3.989 3.840 4.051 0.051 11 0 "[ . 1 . 2]" 1
505 1 37 ILE H 1 60 ILE MG 1.800 . 6.000 5.194 4.704 5.673 . 0 0 "[ . 1 . 2]" 1
506 1 37 ILE H 1 38 LEU H 1.800 . 5.000 4.556 4.497 4.587 . 0 0 "[ . 1 . 2]" 1
507 1 37 ILE HA 1 37 ILE QG 1.800 . 5.000 2.716 2.408 3.107 . 0 0 "[ . 1 . 2]" 1
508 1 37 ILE HA 1 37 ILE MG 1.800 . 4.000 2.310 2.187 2.408 . 0 0 "[ . 1 . 2]" 1
509 1 37 ILE HB 1 60 ILE HB 1.800 . 4.000 3.135 2.708 3.669 . 0 0 "[ . 1 . 2]" 1
510 1 37 ILE HB 1 60 ILE MD 1.800 . 5.000 2.088 1.958 2.422 . 0 0 "[ . 1 . 2]" 1
511 1 37 ILE HB 1 68 LEU QD 1.800 . 5.000 3.128 1.877 4.717 . 0 0 "[ . 1 . 2]" 1
512 1 37 ILE MD 1 73 HIS HA 1.800 . 4.000 2.394 1.905 2.964 . 0 0 "[ . 1 . 2]" 1
513 1 37 ILE MD 1 73 HIS QB 1.800 . 6.000 2.859 1.943 3.649 . 0 0 "[ . 1 . 2]" 1
514 1 37 ILE MD 1 73 HIS HD2 1.800 . 5.000 2.815 1.977 5.020 0.020 17 0 "[ . 1 . 2]" 1
515 1 37 ILE MD 1 76 ALA MB 1.800 . 5.000 3.282 2.297 4.341 . 0 0 "[ . 1 . 2]" 1
516 1 37 ILE HG13 1 37 ILE MG 1.800 . 5.000 2.655 2.183 3.192 . 0 0 "[ . 1 . 2]" 1
517 1 37 ILE HG12 1 37 ILE MG 1.800 . 5.000 2.537 1.979 3.200 . 0 0 "[ . 1 . 2]" 1
518 1 37 ILE MG 1 76 ALA MB 1.800 . 6.000 4.078 3.666 4.642 . 0 0 "[ . 1 . 2]" 1
519 1 38 LEU HA 1 39 ILE H 1.800 . 4.000 2.347 2.239 2.411 . 0 0 "[ . 1 . 2]" 1
520 1 38 LEU HA 1 60 ILE H 1.800 . 5.000 2.666 2.384 3.121 . 0 0 "[ . 1 . 2]" 1
521 1 38 LEU H 1 38 LEU QB 1.800 . 5.000 2.876 2.446 3.251 . 0 0 "[ . 1 . 2]" 1
522 1 38 LEU HB3 1 39 ILE H 1.800 . 5.000 3.139 2.481 3.877 . 0 0 "[ . 1 . 2]" 1
523 1 38 LEU HB2 1 39 ILE H 1.800 . 5.000 3.159 2.416 4.170 . 0 0 "[ . 1 . 2]" 1
524 1 38 LEU QB 1 39 ILE H 1.800 . 4.000 2.536 2.385 2.905 . 0 0 "[ . 1 . 2]" 1
525 1 38 LEU H 1 38 LEU QD 1.800 . 5.000 2.524 2.099 3.446 . 0 0 "[ . 1 . 2]" 1
526 1 38 LEU QD 1 39 ILE H 1.800 . 4.000 3.704 3.013 3.994 . 0 0 "[ . 1 . 2]" 1
527 1 38 LEU QD 1 58 ASP H 1.800 . 5.000 3.903 3.095 4.473 . 0 0 "[ . 1 . 2]" 1
528 1 38 LEU H 1 39 ILE H 1.800 . 5.000 4.462 4.417 4.507 . 0 0 "[ . 1 . 2]" 1
529 1 38 LEU HA 1 38 LEU MD1 1.800 . 6.000 3.679 2.818 4.095 . 0 0 "[ . 1 . 2]" 1
530 1 38 LEU HA 1 38 LEU MD2 1.800 . 6.000 3.575 2.993 4.010 . 0 0 "[ . 1 . 2]" 1
531 1 38 LEU HA 1 38 LEU QD 1.800 . 5.000 3.197 2.742 3.449 . 0 0 "[ . 1 . 2]" 1
532 1 38 LEU HA 1 38 LEU HG 1.800 . 4.000 3.039 2.235 3.682 . 0 0 "[ . 1 . 2]" 1
533 1 38 LEU HA 1 59 ALA HA 1.800 . 4.000 2.392 2.137 2.643 . 0 0 "[ . 1 . 2]" 1
534 1 38 LEU HA 1 59 ALA MB 1.800 . 6.000 3.958 3.662 4.240 . 0 0 "[ . 1 . 2]" 1
535 1 38 LEU QB 1 38 LEU QD 1.800 . 5.000 1.838 1.798 1.905 0.002 15 0 "[ . 1 . 2]" 1
536 1 38 LEU QD 1 57 GLY QA 1.800 . 5.000 3.222 2.423 4.080 . 0 0 "[ . 1 . 2]" 1
537 1 38 LEU QD 1 59 ALA HA 1.800 . 5.000 2.937 1.994 3.807 . 0 0 "[ . 1 . 2]" 1
538 1 38 LEU QD 1 59 ALA MB 1.800 . 5.000 2.502 1.844 3.661 . 0 0 "[ . 1 . 2]" 1
539 1 38 LEU HG 1 59 ALA HA 1.800 . 6.000 3.347 1.947 5.112 . 0 0 "[ . 1 . 2]" 1
540 1 39 ILE HA 1 40 SER H 1.800 . 3.500 2.152 2.145 2.162 . 0 0 "[ . 1 . 2]" 1
541 1 39 ILE HA 1 41 GLU H 1.800 . 4.000 3.873 3.698 4.031 0.031 11 0 "[ . 1 . 2]" 1
542 1 39 ILE HB 1 40 SER H 1.800 . 6.000 4.132 4.029 4.249 . 0 0 "[ . 1 . 2]" 1
543 1 39 ILE HB 1 57 GLY H 1.800 . 4.500 3.455 3.247 3.709 . 0 0 "[ . 1 . 2]" 1
544 1 39 ILE HB 1 58 ASP H 1.800 . 4.000 2.589 2.380 2.852 . 0 0 "[ . 1 . 2]" 1
545 1 39 ILE H 1 39 ILE MD 1.800 . 5.000 3.368 3.057 3.630 . 0 0 "[ . 1 . 2]" 1
546 1 39 ILE H 1 39 ILE QG 1.800 . 4.000 2.104 2.041 2.228 . 0 0 "[ . 1 . 2]" 1
547 1 39 ILE QG 1 58 ASP H 1.800 . 4.000 3.814 3.347 4.015 0.015 20 0 "[ . 1 . 2]" 1
548 1 39 ILE MG 1 40 SER H 1.800 . 5.000 2.667 2.362 2.957 . 0 0 "[ . 1 . 2]" 1
549 1 39 ILE MG 1 41 GLU H 1.800 . 4.000 2.920 2.519 3.310 . 0 0 "[ . 1 . 2]" 1
550 1 39 ILE MG 1 42 ILE H 1.800 . 5.500 4.725 4.415 5.016 . 0 0 "[ . 1 . 2]" 1
551 1 39 ILE H 1 57 GLY QA 1.800 . 5.000 4.511 4.311 4.727 . 0 0 "[ . 1 . 2]" 1
552 1 39 ILE H 1 59 ALA HA 1.800 . 5.000 3.731 3.614 3.907 . 0 0 "[ . 1 . 2]" 1
553 1 39 ILE H 1 40 SER H 1.800 . 5.000 4.480 4.417 4.527 . 0 0 "[ . 1 . 2]" 1
554 1 39 ILE H 1 57 GLY H 1.800 . 6.000 4.428 4.143 4.934 . 0 0 "[ . 1 . 2]" 1
555 1 39 ILE H 1 58 ASP H 1.800 . 4.000 2.739 2.570 3.037 . 0 0 "[ . 1 . 2]" 1
556 1 39 ILE HA 1 39 ILE MD 1.800 . 6.000 3.402 2.029 3.952 . 0 0 "[ . 1 . 2]" 1
557 1 39 ILE HA 1 39 ILE QG 1.800 . 4.000 2.708 2.529 3.125 . 0 0 "[ . 1 . 2]" 1
558 1 39 ILE HA 1 39 ILE MG 1.800 . 5.000 2.310 2.163 2.382 . 0 0 "[ . 1 . 2]" 1
559 1 39 ILE HB 1 56 VAL HA 1.800 . 6.000 3.784 3.513 4.058 . 0 0 "[ . 1 . 2]" 1
560 1 39 ILE HB 1 57 GLY QA 1.800 . 6.000 4.664 4.411 4.931 . 0 0 "[ . 1 . 2]" 1
561 1 39 ILE QG 1 58 ASP HB3 1.800 . 4.000 2.846 2.039 3.508 . 0 0 "[ . 1 . 2]" 1
562 1 39 ILE QG 1 58 ASP HB2 1.800 . 4.000 3.488 2.574 3.962 . 0 0 "[ . 1 . 2]" 1
563 1 39 ILE MG 1 42 ILE HG13 1.800 . 5.000 3.163 2.266 4.253 . 0 0 "[ . 1 . 2]" 1
564 1 39 ILE MG 1 42 ILE HG12 1.800 . 5.000 2.855 2.287 3.623 . 0 0 "[ . 1 . 2]" 1
565 1 39 ILE MG 1 56 VAL HA 1.800 . 5.000 3.393 3.120 3.654 . 0 0 "[ . 1 . 2]" 1
566 1 40 SER HA 1 41 GLU H 1.800 . 5.000 3.544 3.512 3.570 . 0 0 "[ . 1 . 2]" 1
567 1 40 SER HB3 1 41 GLU H 1.800 . 6.000 3.270 2.572 4.187 . 0 0 "[ . 1 . 2]" 1
568 1 40 SER HB2 1 41 GLU H 1.800 . 6.000 3.295 2.746 4.068 . 0 0 "[ . 1 . 2]" 1
569 1 40 SER QB 1 41 GLU H 1.800 . 5.000 2.801 2.527 3.268 . 0 0 "[ . 1 . 2]" 1
570 1 40 SER H 1 41 GLU H 1.800 . 3.500 2.107 2.024 2.473 . 0 0 "[ . 1 . 2]" 1
571 1 40 SER HA 1 56 VAL QG 1.800 . 4.000 2.492 1.949 3.536 . 0 0 "[ . 1 . 2]" 1
572 1 41 GLU HA 1 42 ILE H 1.800 . 3.000 2.258 2.229 2.377 . 0 0 "[ . 1 . 2]" 1
573 1 41 GLU QB 1 42 ILE H 1.800 . 5.000 3.133 2.525 3.509 . 0 0 "[ . 1 . 2]" 1
574 1 41 GLU H 1 41 GLU HG3 1.800 . 6.000 4.219 3.044 4.583 . 0 0 "[ . 1 . 2]" 1
575 1 41 GLU H 1 41 GLU HG2 1.800 . 6.000 4.641 3.950 4.947 . 0 0 "[ . 1 . 2]" 1
576 1 41 GLU QG 1 42 ILE H 1.800 . 6.000 2.829 2.221 3.830 . 0 0 "[ . 1 . 2]" 1
577 1 41 GLU H 1 42 ILE QG 1.800 . 6.000 4.254 3.985 4.545 . 0 0 "[ . 1 . 2]" 1
578 1 41 GLU H 1 42 ILE H 1.800 . 5.000 4.484 4.421 4.547 . 0 0 "[ . 1 . 2]" 1
579 1 41 GLU HA 1 41 GLU HG3 1.800 . 4.000 2.464 2.035 3.317 . 0 0 "[ . 1 . 2]" 1
580 1 41 GLU HA 1 41 GLU HG2 1.800 . 4.000 2.884 2.056 3.574 . 0 0 "[ . 1 . 2]" 1
581 1 41 GLU HA 1 42 ILE QG 1.800 . 5.000 3.432 3.261 4.039 . 0 0 "[ . 1 . 2]" 1
582 1 41 GLU HA 1 56 VAL QG 1.800 . 4.000 3.205 2.626 3.553 . 0 0 "[ . 1 . 2]" 1
583 1 42 ILE HA 1 43 HIS H 1.800 . 3.000 2.164 2.148 2.195 . 0 0 "[ . 1 . 2]" 1
584 1 42 ILE H 1 42 ILE HB 1.800 . 4.000 2.822 2.769 2.867 . 0 0 "[ . 1 . 2]" 1
585 1 42 ILE HB 1 43 HIS H 1.800 . 6.000 4.223 4.018 4.306 . 0 0 "[ . 1 . 2]" 1
586 1 42 ILE H 1 42 ILE MD 1.800 . 6.000 3.661 2.376 4.156 . 0 0 "[ . 1 . 2]" 1
587 1 42 ILE MD 1 55 HIS H 1.800 . 4.500 3.884 3.258 4.423 . 0 0 "[ . 1 . 2]" 1
588 1 42 ILE MD 1 56 VAL H 1.800 . 4.000 2.782 2.265 3.972 . 0 0 "[ . 1 . 2]" 1
589 1 42 ILE H 1 42 ILE QG 1.800 . 4.000 2.841 2.684 3.361 . 0 0 "[ . 1 . 2]" 1
590 1 42 ILE QG 1 56 VAL H 1.800 . 6.000 4.073 3.058 4.570 . 0 0 "[ . 1 . 2]" 1
591 1 42 ILE MG 1 43 HIS H 1.800 . 5.000 2.725 2.274 2.980 . 0 0 "[ . 1 . 2]" 1
592 1 42 ILE MG 1 49 ASP H 1.800 . 5.000 3.945 3.580 4.313 . 0 0 "[ . 1 . 2]" 1
593 1 42 ILE H 1 43 HIS H 1.800 . 5.000 4.176 4.082 4.342 . 0 0 "[ . 1 . 2]" 1
594 1 42 ILE HA 1 42 ILE MG 1.800 . 4.000 2.309 2.206 2.390 . 0 0 "[ . 1 . 2]" 1
595 1 42 ILE HA 1 43 HIS HD2 1.800 . 6.000 4.329 3.158 5.506 . 0 0 "[ . 1 . 2]" 1
596 1 42 ILE HB 1 42 ILE MD 1.800 . 4.000 2.508 2.076 3.239 . 0 0 "[ . 1 . 2]" 1
597 1 42 ILE HB 1 55 HIS HA 1.800 . 6.000 5.344 4.577 5.840 . 0 0 "[ . 1 . 2]" 1
598 1 42 ILE MD 1 42 ILE MG 1.800 . 6.000 2.253 1.787 3.120 0.013 9 0 "[ . 1 . 2]" 1
599 1 42 ILE MD 1 55 HIS HA 1.800 . 4.000 2.630 2.245 3.812 . 0 0 "[ . 1 . 2]" 1
600 1 42 ILE MD 1 55 HIS QB 1.800 . 6.000 3.987 3.625 4.919 . 0 0 "[ . 1 . 2]" 1
601 1 42 ILE MD 1 56 VAL HA 1.800 . 6.000 2.766 2.236 3.207 . 0 0 "[ . 1 . 2]" 1
602 1 42 ILE MD 1 56 VAL QG 1.800 . 5.000 2.201 1.806 3.165 . 0 0 "[ . 1 . 2]" 1
603 1 42 ILE QG 1 42 ILE MG 1.800 . 5.000 2.186 1.928 2.390 . 0 0 "[ . 1 . 2]" 1
604 1 42 ILE HG13 1 55 HIS HA 1.800 . 5.000 4.644 2.965 5.019 0.019 14 0 "[ . 1 . 2]" 1
605 1 42 ILE HG12 1 55 HIS HA 1.800 . 5.000 4.563 3.622 4.992 . 0 0 "[ . 1 . 2]" 1
606 1 42 ILE QG 1 56 VAL QG 1.800 . 5.000 2.622 1.826 3.791 . 0 0 "[ . 1 . 2]" 1
607 1 42 ILE MG 1 44 PRO HA 1.800 . 6.000 4.054 3.809 4.212 . 0 0 "[ . 1 . 2]" 1
608 1 42 ILE MG 1 48 ALA MB 1.800 . 5.000 2.257 1.826 2.877 . 0 0 "[ . 1 . 2]" 1
609 1 42 ILE MG 1 49 ASP HA 1.800 . 5.000 3.892 3.303 4.483 . 0 0 "[ . 1 . 2]" 1
610 1 42 ILE MG 1 49 ASP QB 1.800 . 5.000 3.990 3.169 4.800 . 0 0 "[ . 1 . 2]" 1
611 1 42 ILE MG 1 54 LEU QB 1.800 . 5.000 2.708 2.000 3.393 . 0 0 "[ . 1 . 2]" 1
612 1 43 HIS H 1 43 HIS HD2 1.800 . 5.000 3.036 2.204 3.922 . 0 0 "[ . 1 . 2]" 1
613 1 43 HIS H 1 44 PRO QD 1.800 . 5.000 4.243 3.963 4.352 . 0 0 "[ . 1 . 2]" 1
614 1 43 HIS H 1 46 GLN QB 1.800 . 5.000 4.600 4.065 4.961 . 0 0 "[ . 1 . 2]" 1
615 1 43 HIS HA 1 44 PRO HD3 1.800 . 3.500 2.235 1.927 2.433 . 0 0 "[ . 1 . 2]" 1
616 1 43 HIS HA 1 44 PRO HD2 1.800 . 3.500 2.215 1.997 2.528 . 0 0 "[ . 1 . 2]" 1
617 1 43 HIS HA 1 44 PRO HG3 1.800 . 6.000 4.334 4.123 4.392 . 0 0 "[ . 1 . 2]" 1
618 1 43 HIS HA 1 44 PRO HG2 1.800 . 6.000 4.331 4.196 4.424 . 0 0 "[ . 1 . 2]" 1
619 1 43 HIS QB 1 44 PRO HD3 1.800 . 6.000 4.035 3.789 4.336 . 0 0 "[ . 1 . 2]" 1
620 1 43 HIS QB 1 44 PRO HD2 1.800 . 6.000 3.161 2.730 3.677 . 0 0 "[ . 1 . 2]" 1
621 1 43 HIS HB3 1 46 GLN QB 1.800 . 5.000 3.759 2.905 4.770 . 0 0 "[ . 1 . 2]" 1
622 1 43 HIS HB2 1 46 GLN QB 1.800 . 5.000 3.486 2.601 4.108 . 0 0 "[ . 1 . 2]" 1
623 1 44 PRO HA 1 45 GLY H 1.800 . 3.000 2.292 2.152 2.475 . 0 0 "[ . 1 . 2]" 1
624 1 44 PRO HA 1 46 GLN H 1.800 . 4.000 3.565 3.180 3.882 . 0 0 "[ . 1 . 2]" 1
625 1 44 PRO HB3 1 45 GLY H 1.800 . 6.000 3.549 2.721 4.097 . 0 0 "[ . 1 . 2]" 1
626 1 44 PRO HB2 1 45 GLY H 1.800 . 6.000 3.044 2.479 3.719 . 0 0 "[ . 1 . 2]" 1
627 1 44 PRO QB 1 45 GLY H 1.800 . 5.000 2.838 2.426 3.430 . 0 0 "[ . 1 . 2]" 1
628 1 44 PRO HA 1 44 PRO QD 1.800 . 5.000 3.413 3.365 3.445 . 0 0 "[ . 1 . 2]" 1
629 1 44 PRO HA 1 49 ASP QB 1.800 . 5.000 3.019 1.928 4.003 . 0 0 "[ . 1 . 2]" 1
630 1 45 GLY HA3 1 46 GLN H 1.800 . 4.000 3.424 2.867 3.558 . 0 0 "[ . 1 . 2]" 1
631 1 45 GLY H 1 49 ASP QB 1.800 . 5.000 2.777 2.041 3.673 . 0 0 "[ . 1 . 2]" 1
632 1 45 GLY H 1 46 GLN H 1.800 . 3.500 2.623 2.197 2.948 . 0 0 "[ . 1 . 2]" 1
633 1 45 GLY H 1 49 ASP H 1.800 . 5.000 4.698 4.043 4.978 . 0 0 "[ . 1 . 2]" 1
634 1 45 GLY H 1 50 ARG H 1.800 . 6.000 5.457 4.538 5.944 . 0 0 "[ . 1 . 2]" 1
635 1 45 GLY QA 1 50 ARG QG 1.800 . 5.000 4.504 3.969 4.881 . 0 0 "[ . 1 . 2]" 1
636 1 46 GLN H 1 46 GLN QB 1.800 . 3.500 2.475 2.086 2.671 . 0 0 "[ . 1 . 2]" 1
637 1 46 GLN H 1 49 ASP QB 1.800 . 4.500 2.715 2.257 3.996 . 0 0 "[ . 1 . 2]" 1
638 1 46 GLN H 1 48 ALA H 1.800 . 5.500 4.463 4.230 4.856 . 0 0 "[ . 1 . 2]" 1
639 1 46 GLN H 1 49 ASP H 1.800 . 5.000 3.316 3.011 3.939 . 0 0 "[ . 1 . 2]" 1
640 1 46 GLN H 1 50 ARG H 1.800 . 5.000 4.294 3.759 5.023 0.023 8 0 "[ . 1 . 2]" 1
641 1 46 GLN HA 1 47 PRO QD 1.800 . 3.000 2.256 2.178 2.336 . 0 0 "[ . 1 . 2]" 1
642 1 46 GLN QB 1 47 PRO QD 1.800 . 4.000 2.041 1.906 2.180 . 0 0 "[ . 1 . 2]" 1
643 1 46 GLN QG 1 47 PRO QD 1.800 . 5.000 2.043 1.878 2.301 . 0 0 "[ . 1 . 2]" 1
644 1 43 HIS QB 1 46 GLN HE21 1.800 . 6.000 2.977 1.928 4.161 . 0 0 "[ . 1 . 2]" 1
645 1 43 HIS QB 1 46 GLN HE22 1.800 . 5.000 2.721 1.992 3.484 . 0 0 "[ . 1 . 2]" 1
646 1 44 PRO QD 1 46 GLN HE21 1.800 . 6.000 5.088 4.185 5.906 . 0 0 "[ . 1 . 2]" 1
647 1 45 GLY QA 1 46 GLN HE21 1.800 . 6.000 4.177 3.320 5.898 . 0 0 "[ . 1 . 2]" 1
648 1 46 GLN HA 1 46 GLN HE21 1.800 . 6.000 3.635 2.675 4.904 . 0 0 "[ . 1 . 2]" 1
649 1 46 GLN HA 1 46 GLN HE22 1.800 . 6.000 4.765 4.149 5.441 . 0 0 "[ . 1 . 2]" 1
650 1 46 GLN HA 1 46 GLN QE 1.800 . 5.000 3.484 2.651 4.501 . 0 0 "[ . 1 . 2]" 1
651 1 46 GLN HB3 1 46 GLN HE21 1.800 . 5.000 3.639 3.209 4.126 . 0 0 "[ . 1 . 2]" 1
652 1 46 GLN HB2 1 46 GLN HE21 1.800 . 5.000 2.384 2.064 3.050 . 0 0 "[ . 1 . 2]" 1
653 1 46 GLN HB3 1 46 GLN HE22 1.800 . 5.000 4.771 4.413 4.990 . 0 0 "[ . 1 . 2]" 1
654 1 46 GLN HB2 1 46 GLN HE22 1.800 . 5.000 3.450 3.270 3.780 . 0 0 "[ . 1 . 2]" 1
655 1 46 GLN QB 1 46 GLN QE 1.800 . 4.000 2.297 2.020 2.839 . 0 0 "[ . 1 . 2]" 1
656 1 47 PRO HA 1 48 ALA H 1.800 . 5.000 3.534 3.505 3.551 . 0 0 "[ . 1 . 2]" 1
657 1 47 PRO HA 1 49 ASP H 1.800 . 5.000 4.489 4.390 4.616 . 0 0 "[ . 1 . 2]" 1
658 1 47 PRO HA 1 50 ARG H 1.800 . 4.000 3.412 3.281 3.560 . 0 0 "[ . 1 . 2]" 1
659 1 47 PRO HA 1 51 CYS H 1.800 . 5.000 4.147 3.976 4.370 . 0 0 "[ . 1 . 2]" 1
660 1 47 PRO HB3 1 48 ALA H 1.800 . 5.000 4.119 4.016 4.260 . 0 0 "[ . 1 . 2]" 1
661 1 47 PRO HB2 1 48 ALA H 1.800 . 5.000 2.903 2.688 3.304 . 0 0 "[ . 1 . 2]" 1
662 1 47 PRO QD 1 48 ALA H 1.800 . 5.000 2.913 2.808 3.150 . 0 0 "[ . 1 . 2]" 1
663 1 47 PRO HA 1 50 ARG QB 1.800 . 3.500 2.400 2.214 2.728 . 0 0 "[ . 1 . 2]" 1
664 1 47 PRO HA 1 50 ARG HD3 1.800 . 6.000 4.402 1.999 6.007 0.007 17 0 "[ . 1 . 2]" 1
665 1 47 PRO HA 1 50 ARG HD2 1.800 . 6.000 4.490 2.776 5.670 . 0 0 "[ . 1 . 2]" 1
666 1 48 ALA HA 1 49 ASP H 1.800 . 5.000 3.561 3.555 3.587 . 0 0 "[ . 1 . 2]" 1
667 1 48 ALA HA 1 50 ARG H 1.800 . 5.000 4.561 4.474 4.682 . 0 0 "[ . 1 . 2]" 1
668 1 48 ALA HA 1 51 CYS H 1.800 . 4.000 3.679 3.472 3.806 . 0 0 "[ . 1 . 2]" 1
669 1 48 ALA HA 1 52 GLY H 1.800 . 6.000 4.770 4.239 5.122 . 0 0 "[ . 1 . 2]" 1
670 1 48 ALA HA 1 54 LEU H 1.800 . 5.000 4.312 3.549 4.989 . 0 0 "[ . 1 . 2]" 1
671 1 48 ALA H 1 48 ALA MB 1.800 . 4.000 2.191 2.105 2.239 . 0 0 "[ . 1 . 2]" 1
672 1 48 ALA MB 1 49 ASP H 1.800 . 5.000 2.485 2.425 2.577 . 0 0 "[ . 1 . 2]" 1
673 1 48 ALA H 1 49 ASP H 1.800 . 4.000 2.765 2.679 2.854 . 0 0 "[ . 1 . 2]" 1
674 1 48 ALA H 1 50 ARG H 1.800 . 5.000 4.088 4.010 4.164 . 0 0 "[ . 1 . 2]" 1
675 1 48 ALA HA 1 51 CYS QB 1.800 . 5.000 3.070 2.563 4.349 . 0 0 "[ . 1 . 2]" 1
676 1 48 ALA HA 1 54 LEU HB3 1.800 . 4.000 3.807 3.322 4.014 0.014 15 0 "[ . 1 . 2]" 1
677 1 48 ALA HA 1 54 LEU HB2 1.800 . 4.000 2.870 2.411 3.421 . 0 0 "[ . 1 . 2]" 1
678 1 48 ALA HA 1 54 LEU QD 1.800 . 5.000 2.694 2.030 3.618 . 0 0 "[ . 1 . 2]" 1
679 1 48 ALA MB 1 54 LEU QB 1.800 . 4.000 2.215 1.868 2.666 . 0 0 "[ . 1 . 2]" 1
680 1 48 ALA MB 1 54 LEU QD 1.800 . 4.000 2.407 1.800 3.057 . 0 0 "[ . 1 . 2]" 1
681 1 49 ASP HA 1 50 ARG H 1.800 . 5.000 3.537 3.526 3.551 . 0 0 "[ . 1 . 2]" 1
682 1 49 ASP HA 1 51 CYS H 1.800 . 5.000 4.125 4.024 4.233 . 0 0 "[ . 1 . 2]" 1
683 1 49 ASP HA 1 52 GLY H 1.800 . 6.000 3.381 3.165 3.634 . 0 0 "[ . 1 . 2]" 1
684 1 49 ASP QB 1 50 ARG H 1.800 . 5.000 2.678 2.520 3.438 . 0 0 "[ . 1 . 2]" 1
685 1 49 ASP H 1 50 ARG H 1.800 . 4.000 2.577 2.537 2.641 . 0 0 "[ . 1 . 2]" 1
686 1 49 ASP H 1 51 CYS H 1.800 . 5.000 4.041 3.928 4.193 . 0 0 "[ . 1 . 2]" 1
687 1 49 ASP HA 1 52 GLY QA 1.800 . 5.000 3.911 3.405 4.360 . 0 0 "[ . 1 . 2]" 1
688 1 50 ARG HA 1 51 CYS H 1.800 . 5.000 3.519 3.496 3.543 . 0 0 "[ . 1 . 2]" 1
689 1 50 ARG HA 1 52 GLY H 1.800 . 5.000 4.184 4.032 4.468 . 0 0 "[ . 1 . 2]" 1
690 1 50 ARG H 1 50 ARG HB3 1.800 . 4.000 3.574 3.481 3.610 . 0 0 "[ . 1 . 2]" 1
691 1 50 ARG H 1 50 ARG HB2 1.800 . 4.000 2.435 2.168 2.685 . 0 0 "[ . 1 . 2]" 1
692 1 50 ARG QB 1 51 CYS H 1.800 . 4.000 2.804 2.634 2.910 . 0 0 "[ . 1 . 2]" 1
693 1 50 ARG QB 1 52 GLY H 1.800 . 6.000 4.687 4.591 4.742 . 0 0 "[ . 1 . 2]" 1
694 1 50 ARG H 1 50 ARG HD3 1.800 . 5.000 4.428 3.004 5.001 0.001 17 0 "[ . 1 . 2]" 1
695 1 50 ARG H 1 50 ARG HD2 1.800 . 5.000 4.551 3.875 5.017 0.017 20 0 "[ . 1 . 2]" 1
696 1 50 ARG H 1 50 ARG HG3 1.800 . 4.500 2.877 2.048 3.748 . 0 0 "[ . 1 . 2]" 1
697 1 50 ARG H 1 50 ARG HG2 1.800 . 4.500 2.972 2.068 4.038 . 0 0 "[ . 1 . 2]" 1
698 1 50 ARG QG 1 51 CYS H 1.800 . 5.500 4.222 3.924 4.500 . 0 0 "[ . 1 . 2]" 1
699 1 50 ARG H 1 51 CYS H 1.800 . 4.000 2.688 2.567 2.782 . 0 0 "[ . 1 . 2]" 1
700 1 50 ARG HA 1 50 ARG HD3 1.800 . 6.000 3.830 1.986 4.561 . 0 0 "[ . 1 . 2]" 1
701 1 50 ARG HA 1 50 ARG HD2 1.800 . 6.000 3.988 2.417 4.917 . 0 0 "[ . 1 . 2]" 1
702 1 50 ARG QB 1 50 ARG HD3 1.800 . 5.000 2.635 1.964 3.398 . 0 0 "[ . 1 . 2]" 1
703 1 50 ARG QB 1 50 ARG HD2 1.800 . 5.000 2.655 2.004 3.340 . 0 0 "[ . 1 . 2]" 1
704 1 50 ARG QB 1 51 CYS QB 1.800 . 5.000 4.108 3.808 4.462 . 0 0 "[ . 1 . 2]" 1
705 1 51 CYS HA 1 52 GLY H 1.800 . 4.000 3.502 3.489 3.512 . 0 0 "[ . 1 . 2]" 1
706 1 51 CYS HA 1 53 GLY H 1.800 . 5.000 4.277 4.182 4.447 . 0 0 "[ . 1 . 2]" 1
707 1 51 CYS QB 1 52 GLY H 1.800 . 5.000 2.954 2.870 3.605 . 0 0 "[ . 1 . 2]" 1
708 1 51 CYS QB 1 53 GLY H 1.800 . 6.000 2.759 2.244 3.626 . 0 0 "[ . 1 . 2]" 1
709 1 51 CYS H 1 52 GLY H 1.800 . 3.000 2.510 2.296 2.590 . 0 0 "[ . 1 . 2]" 1
710 1 51 CYS H 1 54 LEU H 1.800 . 5.000 4.999 4.899 5.066 0.066 14 0 "[ . 1 . 2]" 1
711 1 52 GLY HA3 1 53 GLY H 1.800 . 4.000 3.115 2.583 3.455 . 0 0 "[ . 1 . 2]" 1
712 1 52 GLY HA2 1 53 GLY H 1.800 . 4.000 3.309 3.089 3.582 . 0 0 "[ . 1 . 2]" 1
713 1 52 GLY QA 1 54 LEU H 1.800 . 6.000 4.009 3.695 4.274 . 0 0 "[ . 1 . 2]" 1
714 1 52 GLY H 1 53 GLY H 1.800 . 5.000 3.034 2.595 3.649 . 0 0 "[ . 1 . 2]" 1
715 1 52 GLY H 1 54 LEU H 1.800 . 4.000 3.810 3.535 4.010 0.010 3 0 "[ . 1 . 2]" 1
716 1 53 GLY HA3 1 54 LEU H 1.800 . 4.000 2.974 2.901 3.061 . 0 0 "[ . 1 . 2]" 1
717 1 53 GLY HA2 1 54 LEU H 1.800 . 4.000 3.515 3.488 3.537 . 0 0 "[ . 1 . 2]" 1
718 1 53 GLY H 1 54 LEU QB 1.800 . 6.000 4.103 3.668 4.688 . 0 0 "[ . 1 . 2]" 1
719 1 53 GLY H 1 54 LEU H 1.800 . 4.000 2.362 1.963 2.896 . 0 0 "[ . 1 . 2]" 1
720 1 54 LEU HA 1 55 HIS H 1.800 . 3.000 2.224 2.153 2.390 . 0 0 "[ . 1 . 2]" 1
721 1 54 LEU H 1 54 LEU HB3 1.800 . 4.000 3.241 2.913 3.550 . 0 0 "[ . 1 . 2]" 1
722 1 54 LEU H 1 54 LEU HB2 1.800 . 4.000 2.139 2.072 2.278 . 0 0 "[ . 1 . 2]" 1
723 1 54 LEU H 1 54 LEU QB 1.800 . 3.000 2.109 2.049 2.252 . 0 0 "[ . 1 . 2]" 1
724 1 54 LEU HB3 1 55 HIS H 1.800 . 6.000 4.131 3.927 4.255 . 0 0 "[ . 1 . 2]" 1
725 1 54 LEU HB2 1 55 HIS H 1.800 . 6.000 4.619 4.527 4.668 . 0 0 "[ . 1 . 2]" 1
726 1 54 LEU QB 1 55 HIS H 1.800 . 5.000 3.855 3.721 3.939 . 0 0 "[ . 1 . 2]" 1
727 1 54 LEU H 1 54 LEU MD1 1.800 . 5.000 3.971 3.150 4.249 . 0 0 "[ . 1 . 2]" 1
728 1 54 LEU H 1 54 LEU MD2 1.800 . 5.000 3.379 2.123 4.419 . 0 0 "[ . 1 . 2]" 1
729 1 54 LEU QD 1 55 HIS H 1.800 . 6.000 3.320 2.870 3.995 . 0 0 "[ . 1 . 2]" 1
730 1 54 LEU H 1 54 LEU HG 1.800 . 5.000 4.101 2.818 4.538 . 0 0 "[ . 1 . 2]" 1
731 1 54 LEU H 1 55 HIS H 1.800 . 5.000 4.167 3.799 4.342 . 0 0 "[ . 1 . 2]" 1
732 1 54 LEU HA 1 54 LEU MD1 1.800 . 6.000 2.662 2.016 3.823 . 0 0 "[ . 1 . 2]" 1
733 1 54 LEU HA 1 54 LEU MD2 1.800 . 6.000 2.468 1.995 3.762 . 0 0 "[ . 1 . 2]" 1
734 1 54 LEU HA 1 54 LEU QD 1.800 . 4.000 2.163 1.866 2.854 . 0 0 "[ . 1 . 2]" 1
735 1 54 LEU HA 1 54 LEU HG 1.800 . 4.000 3.138 2.178 3.674 . 0 0 "[ . 1 . 2]" 1
736 1 54 LEU HA 1 55 HIS HD2 1.800 . 6.000 5.062 4.758 5.338 . 0 0 "[ . 1 . 2]" 1
737 1 54 LEU QB 1 54 LEU QD 1.800 . 4.000 1.968 1.810 2.069 . 0 0 "[ . 1 . 2]" 1
738 1 54 LEU MD1 1 54 LEU MD2 1.800 . 4.000 2.067 1.971 2.098 . 0 0 "[ . 1 . 2]" 1
739 1 55 HIS HA 1 56 VAL H 1.800 . 3.000 2.347 2.333 2.357 . 0 0 "[ . 1 . 2]" 1
740 1 55 HIS HB3 1 56 VAL H 1.800 . 5.000 3.812 3.767 3.873 . 0 0 "[ . 1 . 2]" 1
741 1 55 HIS HB2 1 56 VAL H 1.800 . 5.000 2.591 2.577 2.610 . 0 0 "[ . 1 . 2]" 1
742 1 55 HIS QB 1 56 VAL H 1.800 . 4.000 2.551 2.537 2.569 . 0 0 "[ . 1 . 2]" 1
743 1 55 HIS H 1 55 HIS HD2 1.800 . 5.000 3.497 3.248 3.683 . 0 0 "[ . 1 . 2]" 1
744 1 55 HIS HE1 1 58 ASP H 1.800 . 6.000 4.667 4.378 4.958 . 0 0 "[ . 1 . 2]" 1
745 1 55 HIS HE1 1 94 VAL H 1.800 . 6.000 3.692 3.122 4.597 . 0 0 "[ . 1 . 2]" 1
746 1 55 HIS H 1 56 VAL H 1.800 . 5.000 4.535 4.506 4.612 . 0 0 "[ . 1 . 2]" 1
747 1 55 HIS HD2 1 93 TYR QD 1.800 . 4.000 4.006 3.749 4.061 0.061 18 0 "[ . 1 . 2]" 1
748 1 55 HIS HD2 1 93 TYR QE 1.800 . 4.000 3.473 3.191 4.029 0.029 12 0 "[ . 1 . 2]" 1
749 1 55 HIS HE1 1 57 GLY HA3 1.800 . 6.000 4.930 4.434 5.391 . 0 0 "[ . 1 . 2]" 1
750 1 55 HIS HE1 1 57 GLY HA2 1.800 . 6.000 5.763 5.343 5.966 . 0 0 "[ . 1 . 2]" 1
751 1 55 HIS HE1 1 57 GLY QA 1.800 . 5.000 4.663 4.230 5.009 0.009 15 0 "[ . 1 . 2]" 1
752 1 55 HIS HE1 1 58 ASP QB 1.800 . 6.000 3.580 2.618 4.183 . 0 0 "[ . 1 . 2]" 1
753 1 55 HIS HE1 1 93 TYR HA 1.800 . 5.000 2.256 1.936 3.003 . 0 0 "[ . 1 . 2]" 1
754 1 55 HIS HE1 1 93 TYR QB 1.800 . 5.000 3.503 3.142 3.907 . 0 0 "[ . 1 . 2]" 1
755 1 55 HIS HE1 1 93 TYR QD 1.800 . 3.500 3.110 2.888 3.265 . 0 0 "[ . 1 . 2]" 1
756 1 55 HIS HE1 1 93 TYR QE 1.800 . 4.000 3.826 3.625 3.996 . 0 0 "[ . 1 . 2]" 1
757 1 56 VAL HA 1 57 GLY H 1.800 . 3.000 2.194 2.177 2.225 . 0 0 "[ . 1 . 2]" 1
758 1 56 VAL HA 1 58 ASP H 1.800 . 5.000 3.925 3.688 4.063 . 0 0 "[ . 1 . 2]" 1
759 1 56 VAL H 1 56 VAL HB 1.800 . 3.500 2.735 2.537 3.591 0.091 7 0 "[ . 1 . 2]" 1
760 1 56 VAL HB 1 57 GLY H 1.800 . 5.000 3.930 3.008 4.110 . 0 0 "[ . 1 . 2]" 1
761 1 56 VAL H 1 56 VAL QG 1.800 . 3.000 2.049 1.975 2.164 . 0 0 "[ . 1 . 2]" 1
762 1 56 VAL QG 1 57 GLY H 1.800 . 4.000 2.468 2.159 3.430 . 0 0 "[ . 1 . 2]" 1
763 1 56 VAL H 1 93 TYR QE 1.800 . 6.000 5.447 4.839 5.778 . 0 0 "[ . 1 . 2]" 1
764 1 56 VAL H 1 57 GLY H 1.800 . 5.000 4.595 4.568 4.627 . 0 0 "[ . 1 . 2]" 1
765 1 56 VAL HA 1 56 VAL QG 1.800 . 4.000 2.109 2.048 2.234 . 0 0 "[ . 1 . 2]" 1
766 1 56 VAL HB 1 93 TYR QE 1.800 . 6.000 5.536 5.135 6.049 0.049 4 0 "[ . 1 . 2]" 1
767 1 57 GLY HA3 1 58 ASP H 1.800 . 5.000 3.557 3.530 3.571 . 0 0 "[ . 1 . 2]" 1
768 1 57 GLY HA2 1 58 ASP H 1.800 . 5.000 2.754 2.655 2.874 . 0 0 "[ . 1 . 2]" 1
769 1 57 GLY QA 1 58 ASP H 1.800 . 4.000 2.665 2.586 2.754 . 0 0 "[ . 1 . 2]" 1
770 1 57 GLY H 1 58 ASP H 1.800 . 4.000 2.423 2.236 2.682 . 0 0 "[ . 1 . 2]" 1
771 1 57 GLY HA3 1 93 TYR QD 1.800 . 6.000 4.353 3.928 4.867 . 0 0 "[ . 1 . 2]" 1
772 1 57 GLY HA2 1 93 TYR QD 1.800 . 6.000 5.616 5.315 5.977 . 0 0 "[ . 1 . 2]" 1
773 1 57 GLY HA3 1 93 TYR QE 1.800 . 6.000 3.725 3.334 4.108 . 0 0 "[ . 1 . 2]" 1
774 1 57 GLY HA2 1 93 TYR QE 1.800 . 6.000 5.377 4.906 5.795 . 0 0 "[ . 1 . 2]" 1
775 1 57 GLY QA 1 93 TYR QE 1.800 . 5.000 3.659 3.282 4.027 . 0 0 "[ . 1 . 2]" 1
776 1 57 GLY QA 1 94 VAL HB 1.800 . 6.000 4.757 3.383 5.910 . 0 0 "[ . 1 . 2]" 1
777 1 57 GLY QA 1 94 VAL QG 1.800 . 5.000 3.492 2.696 4.554 . 0 0 "[ . 1 . 2]" 1
778 1 57 GLY QA 1 95 ALA HA 1.800 . 6.000 5.420 4.284 5.999 . 0 0 "[ . 1 . 2]" 1
779 1 57 GLY QA 1 95 ALA MB 1.800 . 6.000 5.202 3.593 5.917 . 0 0 "[ . 1 . 2]" 1
780 1 58 ASP HA 1 59 ALA H 1.800 . 3.000 2.184 2.160 2.310 . 0 0 "[ . 1 . 2]" 1
781 1 58 ASP HA 1 94 VAL H 1.800 . 4.000 3.406 3.153 3.843 . 0 0 "[ . 1 . 2]" 1
782 1 58 ASP HB3 1 59 ALA H 1.800 . 6.000 3.712 3.352 4.059 . 0 0 "[ . 1 . 2]" 1
783 1 58 ASP HB2 1 59 ALA H 1.800 . 6.000 4.486 4.170 4.568 . 0 0 "[ . 1 . 2]" 1
784 1 58 ASP H 1 93 TYR QD 1.800 . 6.000 5.984 5.844 6.057 0.057 6 0 "[ . 1 . 2]" 1
785 1 58 ASP H 1 59 ALA H 1.800 . 5.000 4.397 4.321 4.565 . 0 0 "[ . 1 . 2]" 1
786 1 58 ASP HA 1 93 TYR HA 1.800 . 4.000 3.077 2.762 3.345 . 0 0 "[ . 1 . 2]" 1
787 1 58 ASP HA 1 94 VAL QG 1.800 . 4.000 3.362 3.062 3.710 . 0 0 "[ . 1 . 2]" 1
788 1 59 ALA HA 1 60 ILE H 1.800 . 3.000 2.146 2.131 2.161 . 0 0 "[ . 1 . 2]" 1
789 1 59 ALA H 1 59 ALA MB 1.800 . 4.000 2.280 2.161 2.481 . 0 0 "[ . 1 . 2]" 1
790 1 59 ALA MB 1 60 ILE H 1.800 . 5.000 3.179 3.066 3.244 . 0 0 "[ . 1 . 2]" 1
791 1 59 ALA MB 1 92 VAL H 1.800 . 5.000 3.063 2.751 3.267 . 0 0 "[ . 1 . 2]" 1
792 1 59 ALA H 1 91 VAL HA 1.800 . 6.000 4.672 4.200 5.086 . 0 0 "[ . 1 . 2]" 1
793 1 59 ALA H 1 91 VAL HB 1.800 . 5.000 3.211 2.887 3.552 . 0 0 "[ . 1 . 2]" 1
794 1 59 ALA H 1 92 VAL QG 1.800 . 5.000 3.625 2.727 4.495 . 0 0 "[ . 1 . 2]" 1
795 1 59 ALA H 1 93 TYR HA 1.800 . 5.000 3.943 3.490 4.344 . 0 0 "[ . 1 . 2]" 1
796 1 59 ALA H 1 94 VAL QG 1.800 . 5.000 2.859 2.369 3.418 . 0 0 "[ . 1 . 2]" 1
797 1 59 ALA H 1 60 ILE H 1.800 . 5.000 4.454 4.302 4.515 . 0 0 "[ . 1 . 2]" 1
798 1 59 ALA H 1 92 VAL H 1.800 . 4.500 2.713 2.408 3.041 . 0 0 "[ . 1 . 2]" 1
799 1 59 ALA H 1 94 VAL H 1.800 . 5.000 4.006 3.369 4.627 . 0 0 "[ . 1 . 2]" 1
800 1 59 ALA HA 1 94 VAL QG 1.800 . 6.000 3.813 3.342 4.298 . 0 0 "[ . 1 . 2]" 1
801 1 59 ALA MB 1 92 VAL QG 1.800 . 4.000 2.699 1.892 3.574 . 0 0 "[ . 1 . 2]" 1
802 1 59 ALA MB 1 94 VAL QG 1.800 . 5.000 2.094 1.790 2.943 0.010 15 0 "[ . 1 . 2]" 1
803 1 60 ILE HA 1 61 LEU H 1.800 . 3.000 2.213 2.159 2.285 . 0 0 "[ . 1 . 2]" 1
804 1 60 ILE HA 1 92 VAL H 1.800 . 5.000 4.320 3.824 4.826 . 0 0 "[ . 1 . 2]" 1
805 1 60 ILE H 1 60 ILE HB 1.800 . 4.000 2.635 2.599 2.656 . 0 0 "[ . 1 . 2]" 1
806 1 60 ILE H 1 60 ILE MD 1.800 . 5.000 2.977 2.100 3.511 . 0 0 "[ . 1 . 2]" 1
807 1 60 ILE H 1 60 ILE QG 1.800 . 4.000 2.172 1.962 2.626 . 0 0 "[ . 1 . 2]" 1
808 1 60 ILE QG 1 92 VAL H 1.800 . 6.000 5.460 5.005 5.917 . 0 0 "[ . 1 . 2]" 1
809 1 60 ILE H 1 60 ILE MG 1.800 . 6.000 3.794 3.780 3.829 . 0 0 "[ . 1 . 2]" 1
810 1 60 ILE MG 1 61 LEU H 1.800 . 4.000 2.287 2.069 3.154 . 0 0 "[ . 1 . 2]" 1
811 1 60 ILE MG 1 62 ALA H 1.800 . 4.500 3.247 3.086 3.673 . 0 0 "[ . 1 . 2]" 1
812 1 60 ILE MG 1 63 VAL H 1.800 . 6.000 4.682 4.250 4.992 . 0 0 "[ . 1 . 2]" 1
813 1 60 ILE H 1 61 LEU H 1.800 . 5.000 4.582 4.317 4.627 . 0 0 "[ . 1 . 2]" 1
814 1 60 ILE HA 1 60 ILE MD 1.800 . 5.000 3.892 3.644 3.946 . 0 0 "[ . 1 . 2]" 1
815 1 60 ILE HA 1 60 ILE QG 1.800 . 5.000 2.532 2.445 2.565 . 0 0 "[ . 1 . 2]" 1
816 1 60 ILE HA 1 60 ILE MG 1.800 . 4.000 2.282 2.198 2.388 . 0 0 "[ . 1 . 2]" 1
817 1 60 ILE HA 1 91 VAL HA 1.800 . 4.000 2.813 2.399 3.458 . 0 0 "[ . 1 . 2]" 1
818 1 60 ILE HA 1 91 VAL HB 1.800 . 6.000 3.659 3.372 4.220 . 0 0 "[ . 1 . 2]" 1
819 1 60 ILE HA 1 91 VAL QG 1.800 . 4.000 1.874 1.771 1.965 0.029 5 0 "[ . 1 . 2]" 1
820 1 60 ILE HB 1 60 ILE MD 1.800 . 5.000 2.178 1.996 2.357 . 0 0 "[ . 1 . 2]" 1
821 1 60 ILE MD 1 60 ILE MG 1.800 . 6.000 2.455 2.012 3.067 . 0 0 "[ . 1 . 2]" 1
822 1 60 ILE MD 1 89 PHE QD 1.800 . 5.000 4.800 4.190 5.004 0.004 2 0 "[ . 1 . 2]" 1
823 1 60 ILE MD 1 89 PHE QE 1.800 . 4.000 3.337 2.949 3.882 . 0 0 "[ . 1 . 2]" 1
824 1 60 ILE QG 1 60 ILE MG 1.800 . 6.000 2.145 2.003 2.261 . 0 0 "[ . 1 . 2]" 1
825 1 60 ILE QG 1 91 VAL HA 1.800 . 6.000 4.685 4.297 5.357 . 0 0 "[ . 1 . 2]" 1
826 1 60 ILE QG 1 91 VAL QG 1.800 . 4.000 2.330 1.957 2.749 . 0 0 "[ . 1 . 2]" 1
827 1 60 ILE MG 1 62 ALA HA 1.800 . 6.000 4.007 3.759 4.295 . 0 0 "[ . 1 . 2]" 1
828 1 60 ILE MG 1 63 VAL HA 1.800 . 6.000 4.618 4.277 4.994 . 0 0 "[ . 1 . 2]" 1
829 1 60 ILE MG 1 63 VAL QG 1.800 . 4.000 2.414 2.041 2.772 . 0 0 "[ . 1 . 2]" 1
830 1 60 ILE MG 1 68 LEU HB3 1.800 . 5.000 2.953 2.336 3.866 . 0 0 "[ . 1 . 2]" 1
831 1 60 ILE MG 1 68 LEU HB2 1.800 . 5.000 3.048 2.437 3.858 . 0 0 "[ . 1 . 2]" 1
832 1 60 ILE MG 1 68 LEU QD 1.800 . 4.000 2.064 1.807 2.784 . 0 0 "[ . 1 . 2]" 1
833 1 60 ILE MG 1 89 PHE QD 1.800 . 4.000 3.227 2.679 3.911 . 0 0 "[ . 1 . 2]" 1
834 1 60 ILE MG 1 89 PHE QE 1.800 . 5.000 2.710 1.977 3.588 . 0 0 "[ . 1 . 2]" 1
835 1 61 LEU HA 1 62 ALA H 1.800 . 5.000 3.583 3.575 3.589 . 0 0 "[ . 1 . 2]" 1
836 1 61 LEU HA 1 68 LEU H 1.800 . 5.000 4.230 3.827 4.853 . 0 0 "[ . 1 . 2]" 1
837 1 61 LEU H 1 61 LEU QB 1.800 . 5.000 2.534 2.226 2.651 . 0 0 "[ . 1 . 2]" 1
838 1 61 LEU HB3 1 62 ALA H 1.800 . 5.000 3.217 2.931 3.395 . 0 0 "[ . 1 . 2]" 1
839 1 61 LEU HB2 1 62 ALA H 1.800 . 5.000 2.500 2.112 2.735 . 0 0 "[ . 1 . 2]" 1
840 1 61 LEU H 1 61 LEU HG 1.800 . 4.000 3.495 3.021 4.026 0.026 4 0 "[ . 1 . 2]" 1
841 1 61 LEU H 1 63 VAL QG 1.800 . 6.000 4.244 3.996 4.672 . 0 0 "[ . 1 . 2]" 1
842 1 61 LEU H 1 90 GLU QB 1.800 . 6.000 3.735 3.517 4.113 . 0 0 "[ . 1 . 2]" 1
843 1 61 LEU H 1 91 VAL HA 1.800 . 5.000 3.156 2.669 3.334 . 0 0 "[ . 1 . 2]" 1
844 1 61 LEU H 1 91 VAL QG 1.800 . 6.000 3.002 2.305 3.183 . 0 0 "[ . 1 . 2]" 1
845 1 61 LEU H 1 62 ALA H 1.800 . 3.000 2.173 2.080 2.496 . 0 0 "[ . 1 . 2]" 1
846 1 61 LEU H 1 92 VAL H 1.800 . 6.000 5.235 4.576 5.490 . 0 0 "[ . 1 . 2]" 1
847 1 61 LEU HA 1 61 LEU MD1 1.800 . 6.000 3.727 2.288 3.884 . 0 0 "[ . 1 . 2]" 1
848 1 61 LEU HA 1 61 LEU MD2 1.800 . 6.000 2.215 1.982 3.485 . 0 0 "[ . 1 . 2]" 1
849 1 61 LEU HA 1 61 LEU QD 1.800 . 5.000 2.164 1.975 2.985 . 0 0 "[ . 1 . 2]" 1
850 1 61 LEU QB 1 61 LEU MD1 1.800 . 6.000 2.080 1.978 2.159 . 0 0 "[ . 1 . 2]" 1
851 1 61 LEU QB 1 61 LEU MD2 1.800 . 6.000 2.232 1.996 2.383 . 0 0 "[ . 1 . 2]" 1
852 1 61 LEU QB 1 61 LEU QD 1.800 . 4.000 1.910 1.828 2.006 . 0 0 "[ . 1 . 2]" 1
853 1 61 LEU QD 1 69 ARG HD3 1.800 . 6.000 4.012 1.996 5.533 . 0 0 "[ . 1 . 2]" 1
854 1 61 LEU QD 1 69 ARG HD2 1.800 . 6.000 3.802 2.187 5.830 . 0 0 "[ . 1 . 2]" 1
855 1 61 LEU QD 1 90 GLU QG 1.800 . 6.000 4.450 3.000 5.641 . 0 0 "[ . 1 . 2]" 1
856 1 61 LEU QD 1 92 VAL QG 1.800 . 5.000 1.911 1.807 2.332 . 0 0 "[ . 1 . 2]" 1
857 1 62 ALA HA 1 63 VAL H 1.800 . 3.000 2.258 2.230 2.367 . 0 0 "[ . 1 . 2]" 1
858 1 62 ALA HA 1 66 VAL H 1.800 . 5.000 4.972 4.648 5.021 0.021 9 0 "[ . 1 . 2]" 1
859 1 62 ALA HA 1 68 LEU H 1.800 . 4.000 2.792 2.503 3.108 . 0 0 "[ . 1 . 2]" 1
860 1 62 ALA H 1 62 ALA MB 1.800 . 4.000 2.610 2.426 2.720 . 0 0 "[ . 1 . 2]" 1
861 1 62 ALA MB 1 63 VAL H 1.800 . 4.000 2.760 2.516 2.848 . 0 0 "[ . 1 . 2]" 1
862 1 62 ALA MB 1 65 GLY H 1.800 . 6.000 3.388 3.085 3.624 . 0 0 "[ . 1 . 2]" 1
863 1 62 ALA MB 1 66 VAL H 1.800 . 6.000 3.935 3.243 4.278 . 0 0 "[ . 1 . 2]" 1
864 1 62 ALA MB 1 68 LEU H 1.800 . 5.000 3.771 3.025 4.219 . 0 0 "[ . 1 . 2]" 1
865 1 62 ALA MB 1 90 GLU H 1.800 . 6.000 4.082 3.554 4.295 . 0 0 "[ . 1 . 2]" 1
866 1 62 ALA H 1 89 PHE HA 1.800 . 6.000 5.365 4.904 5.788 . 0 0 "[ . 1 . 2]" 1
867 1 62 ALA H 1 90 GLU HB3 1.800 . 4.000 2.806 1.938 3.839 . 0 0 "[ . 1 . 2]" 1
868 1 62 ALA H 1 90 GLU HB2 1.800 . 4.000 3.109 2.238 3.918 . 0 0 "[ . 1 . 2]" 1
869 1 62 ALA H 1 91 VAL HA 1.800 . 6.000 4.472 4.281 4.641 . 0 0 "[ . 1 . 2]" 1
870 1 62 ALA H 1 63 VAL H 1.800 . 5.000 4.394 4.337 4.453 . 0 0 "[ . 1 . 2]" 1
871 1 62 ALA H 1 90 GLU H 1.800 . 4.000 3.459 3.038 3.816 . 0 0 "[ . 1 . 2]" 1
872 1 62 ALA HA 1 67 ASN HA 1.800 . 4.000 2.734 2.059 3.758 . 0 0 "[ . 1 . 2]" 1
873 1 62 ALA HA 1 68 LEU HB3 1.800 . 6.000 4.288 3.222 5.661 . 0 0 "[ . 1 . 2]" 1
874 1 62 ALA HA 1 68 LEU HB2 1.800 . 6.000 3.248 2.336 3.942 . 0 0 "[ . 1 . 2]" 1
875 1 62 ALA HA 1 68 LEU QB 1.800 . 4.000 3.140 2.321 3.871 . 0 0 "[ . 1 . 2]" 1
876 1 62 ALA HA 1 68 LEU QD 1.800 . 5.000 4.001 2.862 4.586 . 0 0 "[ . 1 . 2]" 1
877 1 62 ALA MB 1 65 GLY HA3 1.800 . 6.000 4.829 4.487 5.067 . 0 0 "[ . 1 . 2]" 1
878 1 62 ALA MB 1 65 GLY HA2 1.800 . 6.000 3.563 3.217 3.794 . 0 0 "[ . 1 . 2]" 1
879 1 62 ALA MB 1 67 ASN HA 1.800 . 3.000 2.795 2.234 2.996 . 0 0 "[ . 1 . 2]" 1
880 1 62 ALA MB 1 90 GLU HB3 1.800 . 4.000 2.996 2.011 3.825 . 0 0 "[ . 1 . 2]" 1
881 1 62 ALA MB 1 90 GLU HB2 1.800 . 4.000 2.729 2.313 3.378 . 0 0 "[ . 1 . 2]" 1
882 1 63 VAL HA 1 64 ASN H 1.800 . 3.000 2.146 2.137 2.153 . 0 0 "[ . 1 . 2]" 1
883 1 63 VAL HA 1 65 GLY H 1.800 . 5.000 3.815 3.740 3.978 . 0 0 "[ . 1 . 2]" 1
884 1 63 VAL HA 1 66 VAL H 1.800 . 5.500 4.584 4.260 4.693 . 0 0 "[ . 1 . 2]" 1
885 1 63 VAL HA 1 88 GLU H 1.800 . 6.000 5.184 4.787 5.952 . 0 0 "[ . 1 . 2]" 1
886 1 63 VAL HA 1 90 GLU H 1.800 . 5.000 3.286 2.909 3.591 . 0 0 "[ . 1 . 2]" 1
887 1 63 VAL HB 1 64 ASN H 1.800 . 5.000 4.238 4.200 4.263 . 0 0 "[ . 1 . 2]" 1
888 1 63 VAL H 1 63 VAL MG1 1.800 . 5.000 3.937 3.884 3.961 . 0 0 "[ . 1 . 2]" 1
889 1 63 VAL H 1 63 VAL MG2 1.800 . 5.000 2.764 2.460 2.901 . 0 0 "[ . 1 . 2]" 1
890 1 63 VAL H 1 63 VAL QG 1.800 . 4.000 2.712 2.435 2.831 . 0 0 "[ . 1 . 2]" 1
891 1 63 VAL MG1 1 64 ASN H 1.800 . 6.000 2.862 2.653 2.967 . 0 0 "[ . 1 . 2]" 1
892 1 63 VAL MG2 1 64 ASN H 1.800 . 6.000 4.208 4.174 4.246 . 0 0 "[ . 1 . 2]" 1
893 1 63 VAL QG 1 64 ASN H 1.800 . 5.000 2.817 2.626 2.909 . 0 0 "[ . 1 . 2]" 1
894 1 63 VAL H 1 66 VAL HB 1.800 . 5.000 3.408 2.918 3.912 . 0 0 "[ . 1 . 2]" 1
895 1 63 VAL H 1 66 VAL QG 1.800 . 6.000 3.933 3.648 4.161 . 0 0 "[ . 1 . 2]" 1
896 1 63 VAL H 1 67 ASN HA 1.800 . 5.000 3.917 3.326 4.694 . 0 0 "[ . 1 . 2]" 1
897 1 63 VAL H 1 64 ASN H 1.800 . 5.000 4.151 4.096 4.245 . 0 0 "[ . 1 . 2]" 1
898 1 63 VAL H 1 66 VAL H 1.800 . 3.500 3.177 2.706 3.337 . 0 0 "[ . 1 . 2]" 1
899 1 63 VAL H 1 68 LEU H 1.800 . 5.000 4.376 4.085 4.808 . 0 0 "[ . 1 . 2]" 1
900 1 63 VAL HA 1 63 VAL MG1 1.800 . 5.000 2.319 2.215 2.391 . 0 0 "[ . 1 . 2]" 1
901 1 63 VAL HA 1 63 VAL MG2 1.800 . 5.000 2.443 2.369 2.527 . 0 0 "[ . 1 . 2]" 1
902 1 63 VAL HA 1 63 VAL QG 1.800 . 4.000 2.114 2.049 2.175 . 0 0 "[ . 1 . 2]" 1
903 1 63 VAL HA 1 89 PHE HA 1.800 . 4.000 2.723 2.514 2.968 . 0 0 "[ . 1 . 2]" 1
904 1 63 VAL HB 1 66 VAL HB 1.800 . 4.000 3.438 3.207 3.767 . 0 0 "[ . 1 . 2]" 1
905 1 63 VAL HB 1 79 ILE HB 1.800 . 6.000 4.938 4.281 5.413 . 0 0 "[ . 1 . 2]" 1
906 1 63 VAL HB 1 79 ILE MG 1.800 . 5.000 3.397 2.472 3.846 . 0 0 "[ . 1 . 2]" 1
907 1 63 VAL MG1 1 66 VAL HB 1.800 . 6.000 4.531 4.310 4.728 . 0 0 "[ . 1 . 2]" 1
908 1 63 VAL MG2 1 66 VAL HB 1.800 . 6.000 4.544 4.156 4.877 . 0 0 "[ . 1 . 2]" 1
909 1 63 VAL QG 1 68 LEU QB 1.800 . 4.000 2.790 2.049 3.408 . 0 0 "[ . 1 . 2]" 1
910 1 63 VAL QG 1 68 LEU QD 1.800 . 4.000 2.079 1.804 2.678 . 0 0 "[ . 1 . 2]" 1
911 1 63 VAL QG 1 79 ILE MD 1.800 . 5.000 4.630 4.219 5.019 0.019 5 0 "[ . 1 . 2]" 1
912 1 63 VAL QG 1 83 GLN HG3 1.800 . 6.000 2.742 2.183 3.951 . 0 0 "[ . 1 . 2]" 1
913 1 63 VAL QG 1 83 GLN HG2 1.800 . 6.000 3.351 2.470 4.019 . 0 0 "[ . 1 . 2]" 1
914 1 63 VAL QG 1 87 ILE HA 1.800 . 6.000 4.630 4.159 5.413 . 0 0 "[ . 1 . 2]" 1
915 1 63 VAL MG1 1 89 PHE HA 1.800 . 5.000 3.149 2.563 3.972 . 0 0 "[ . 1 . 2]" 1
916 1 63 VAL MG2 1 89 PHE HA 1.800 . 5.000 3.378 2.837 4.255 . 0 0 "[ . 1 . 2]" 1
917 1 63 VAL MG1 1 89 PHE QD 1.800 . 5.000 3.095 2.414 3.986 . 0 0 "[ . 1 . 2]" 1
918 1 63 VAL MG2 1 89 PHE QD 1.800 . 5.000 3.426 2.868 3.892 . 0 0 "[ . 1 . 2]" 1
919 1 63 VAL MG1 1 89 PHE QE 1.800 . 5.000 2.847 2.180 3.782 . 0 0 "[ . 1 . 2]" 1
920 1 63 VAL MG2 1 89 PHE QE 1.800 . 5.000 3.013 2.378 3.568 . 0 0 "[ . 1 . 2]" 1
921 1 64 ASN H 1 64 ASN HA 1.800 . 3.000 2.271 2.268 2.274 . 0 0 "[ . 1 . 2]" 1
922 1 64 ASN HA 1 65 GLY H 1.800 . 4.000 2.864 2.775 2.903 . 0 0 "[ . 1 . 2]" 1
923 1 64 ASN HA 1 88 GLU H 1.800 . 4.500 3.100 2.605 3.532 . 0 0 "[ . 1 . 2]" 1
924 1 64 ASN HB3 1 65 GLY H 1.800 . 6.000 4.207 4.175 4.277 . 0 0 "[ . 1 . 2]" 1
925 1 64 ASN HB2 1 65 GLY H 1.800 . 6.000 4.504 4.389 4.580 . 0 0 "[ . 1 . 2]" 1
926 1 64 ASN QB 1 65 GLY H 1.800 . 5.000 3.864 3.837 3.915 . 0 0 "[ . 1 . 2]" 1
927 1 64 ASN H 1 87 ILE HA 1.800 . 6.000 5.398 4.925 5.808 . 0 0 "[ . 1 . 2]" 1
928 1 64 ASN H 1 88 GLU HB3 1.800 . 5.000 2.804 2.127 3.699 . 0 0 "[ . 1 . 2]" 1
929 1 64 ASN H 1 88 GLU HB2 1.800 . 5.000 3.483 2.746 4.973 . 0 0 "[ . 1 . 2]" 1
930 1 64 ASN H 1 89 PHE HA 1.800 . 5.000 3.544 2.948 3.848 . 0 0 "[ . 1 . 2]" 1
931 1 64 ASN H 1 65 GLY H 1.800 . 3.500 2.739 2.689 2.800 . 0 0 "[ . 1 . 2]" 1
932 1 64 ASN H 1 66 VAL H 1.800 . 5.500 4.198 4.024 4.290 . 0 0 "[ . 1 . 2]" 1
933 1 64 ASN H 1 88 GLU H 1.800 . 4.500 3.540 3.022 4.135 . 0 0 "[ . 1 . 2]" 1
934 1 64 ASN HA 1 87 ILE HA 1.800 . 6.000 4.868 4.328 5.388 . 0 0 "[ . 1 . 2]" 1
935 1 64 ASN HA 1 88 GLU HB3 1.800 . 5.000 2.655 1.965 3.648 . 0 0 "[ . 1 . 2]" 1
936 1 64 ASN HA 1 88 GLU HB2 1.800 . 5.000 2.510 1.977 3.569 . 0 0 "[ . 1 . 2]" 1
937 1 64 ASN HB3 1 66 VAL QG 1.800 . 6.000 2.937 2.731 3.355 . 0 0 "[ . 1 . 2]" 1
938 1 64 ASN HB2 1 66 VAL QG 1.800 . 6.000 4.099 3.231 4.711 . 0 0 "[ . 1 . 2]" 1
939 1 64 ASN QB 1 82 GLN QB 1.800 . 6.000 5.787 5.140 6.022 0.022 2 0 "[ . 1 . 2]" 1
940 1 64 ASN HA 1 64 ASN HD21 1.800 . 6.000 3.710 3.284 4.269 . 0 0 "[ . 1 . 2]" 1
941 1 64 ASN HA 1 64 ASN QD 1.800 . 5.000 3.444 3.114 3.854 . 0 0 "[ . 1 . 2]" 1
942 1 64 ASN H 1 64 ASN QD 1.800 . 6.000 4.382 3.970 4.910 . 0 0 "[ . 1 . 2]" 1
943 1 64 ASN QD 1 83 GLN HA 1.800 . 4.000 3.632 3.182 4.022 0.022 6 0 "[ . 1 . 2]" 1
944 1 64 ASN QD 1 83 GLN H 1.800 . 6.000 5.429 4.980 5.877 . 0 0 "[ . 1 . 2]" 1
945 1 64 ASN QD 1 84 ARG H 1.800 . 6.000 4.435 3.519 4.700 . 0 0 "[ . 1 . 2]" 1
946 1 64 ASN QD 1 84 ARG QB 1.800 . 6.000 5.980 5.712 6.079 0.079 5 0 "[ . 1 . 2]" 1
947 1 64 ASN HD21 1 86 GLU QG 1.800 . 6.000 5.767 5.488 5.938 . 0 0 "[ . 1 . 2]" 1
948 1 64 ASN HD22 1 86 GLU QG 1.800 . 6.000 4.970 4.465 5.482 . 0 0 "[ . 1 . 2]" 1
949 1 64 ASN QD 1 86 GLU QG 1.800 . 5.000 4.684 4.331 4.992 . 0 0 "[ . 1 . 2]" 1
950 1 64 ASN QD 1 87 ILE HA 1.800 . 4.000 2.374 1.953 2.927 . 0 0 "[ . 1 . 2]" 1
951 1 64 ASN HD21 1 87 ILE HG13 1.800 . 6.000 5.204 4.645 5.719 . 0 0 "[ . 1 . 2]" 1
952 1 64 ASN HD22 1 87 ILE HG13 1.800 . 6.000 5.531 4.868 5.997 . 0 0 "[ . 1 . 2]" 1
953 1 64 ASN HD21 1 87 ILE HG12 1.800 . 6.000 3.878 3.242 4.438 . 0 0 "[ . 1 . 2]" 1
954 1 64 ASN HD22 1 87 ILE HG12 1.800 . 6.000 4.433 3.798 5.029 . 0 0 "[ . 1 . 2]" 1
955 1 64 ASN HD21 1 87 ILE QG 1.800 . 5.000 3.776 3.184 4.294 . 0 0 "[ . 1 . 2]" 1
956 1 64 ASN HD22 1 87 ILE QG 1.800 . 5.000 4.262 3.671 4.779 . 0 0 "[ . 1 . 2]" 1
957 1 64 ASN HD21 1 87 ILE MG 1.800 . 5.000 2.629 2.175 3.351 . 0 0 "[ . 1 . 2]" 1
958 1 64 ASN HD22 1 87 ILE MG 1.800 . 5.000 3.861 3.114 4.423 . 0 0 "[ . 1 . 2]" 1
959 1 64 ASN QD 1 88 GLU QB 1.800 . 6.000 3.780 3.342 4.265 . 0 0 "[ . 1 . 2]" 1
960 1 64 ASN QD 1 88 GLU H 1.800 . 5.000 2.662 2.224 3.373 . 0 0 "[ . 1 . 2]" 1
961 1 65 GLY HA3 1 66 VAL H 1.800 . 4.500 3.184 3.103 3.421 . 0 0 "[ . 1 . 2]" 1
962 1 65 GLY HA2 1 66 VAL H 1.800 . 4.500 3.409 3.171 3.464 . 0 0 "[ . 1 . 2]" 1
963 1 65 GLY H 1 88 GLU HB3 1.800 . 6.000 3.913 3.059 4.515 . 0 0 "[ . 1 . 2]" 1
964 1 65 GLY H 1 88 GLU HB2 1.800 . 6.000 4.651 3.750 5.747 . 0 0 "[ . 1 . 2]" 1
965 1 65 GLY H 1 66 VAL H 1.800 . 4.000 2.752 2.572 2.821 . 0 0 "[ . 1 . 2]" 1
966 1 66 VAL HA 1 67 ASN H 1.800 . 3.000 2.176 2.147 2.198 . 0 0 "[ . 1 . 2]" 1
967 1 66 VAL H 1 66 VAL HB 1.800 . 4.000 2.614 2.584 2.629 . 0 0 "[ . 1 . 2]" 1
968 1 66 VAL H 1 66 VAL QG 1.800 . 4.000 2.248 2.050 2.472 . 0 0 "[ . 1 . 2]" 1
969 1 66 VAL QG 1 67 ASN H 1.800 . 4.000 2.370 2.152 2.610 . 0 0 "[ . 1 . 2]" 1
970 1 66 VAL H 1 67 ASN H 1.800 . 5.000 4.525 4.402 4.577 . 0 0 "[ . 1 . 2]" 1
971 1 66 VAL HA 1 66 VAL QG 1.800 . 4.000 2.123 2.059 2.171 . 0 0 "[ . 1 . 2]" 1
972 1 66 VAL HB 1 79 ILE MG 1.800 . 4.000 3.177 2.777 3.959 . 0 0 "[ . 1 . 2]" 1
973 1 66 VAL QG 1 79 ILE MD 1.800 . 5.000 3.034 2.437 4.042 . 0 0 "[ . 1 . 2]" 1
974 1 66 VAL QG 1 79 ILE QG 1.800 . 5.000 3.705 3.189 4.615 . 0 0 "[ . 1 . 2]" 1
975 1 66 VAL QG 1 79 ILE MG 1.800 . 4.000 2.505 1.884 3.570 . 0 0 "[ . 1 . 2]" 1
976 1 67 ASN HA 1 68 LEU H 1.800 . 3.000 2.179 2.152 2.220 . 0 0 "[ . 1 . 2]" 1
977 1 67 ASN HA 1 69 ARG H 1.800 . 4.500 3.720 3.530 3.937 . 0 0 "[ . 1 . 2]" 1
978 1 67 ASN H 1 67 ASN QB 1.800 . 3.000 2.325 2.087 2.782 . 0 0 "[ . 1 . 2]" 1
979 1 67 ASN QB 1 68 LEU H 1.800 . 5.000 3.347 2.891 3.765 . 0 0 "[ . 1 . 2]" 1
980 1 67 ASN H 1 68 LEU H 1.800 . 5.000 4.572 4.525 4.615 . 0 0 "[ . 1 . 2]" 1
981 1 67 ASN HA 1 67 ASN HD21 1.800 . 6.000 3.969 2.165 4.608 . 0 0 "[ . 1 . 2]" 1
982 1 67 ASN H 1 67 ASN HD21 1.800 . 6.000 4.600 3.787 5.010 . 0 0 "[ . 1 . 2]" 1
983 1 67 ASN H 1 67 ASN HD22 1.800 . 6.000 5.222 3.809 5.880 . 0 0 "[ . 1 . 2]" 1
984 1 67 ASN QD 1 69 ARG QB 1.800 . 6.000 3.185 1.941 4.863 . 0 0 "[ . 1 . 2]" 1
985 1 67 ASN QD 1 69 ARG QD 1.800 . 6.000 4.720 3.250 5.976 . 0 0 "[ . 1 . 2]" 1
986 1 67 ASN HD21 1 69 ARG H 1.800 . 6.000 3.803 2.137 5.548 . 0 0 "[ . 1 . 2]" 1
987 1 67 ASN HD22 1 69 ARG H 1.800 . 6.000 4.331 2.724 5.691 . 0 0 "[ . 1 . 2]" 1
988 1 67 ASN HD22 1 70 ASP H 1.800 . 6.000 4.370 2.313 5.888 . 0 0 "[ . 1 . 2]" 1
989 1 68 LEU HA 1 71 THR H 1.800 . 5.000 3.390 3.018 3.799 . 0 0 "[ . 1 . 2]" 1
990 1 68 LEU H 1 68 LEU QB 1.800 . 4.000 2.391 2.241 2.515 . 0 0 "[ . 1 . 2]" 1
991 1 68 LEU HB3 1 69 ARG H 1.800 . 5.000 3.474 2.809 4.292 . 0 0 "[ . 1 . 2]" 1
992 1 68 LEU HB2 1 69 ARG H 1.800 . 5.000 4.021 3.620 4.431 . 0 0 "[ . 1 . 2]" 1
993 1 68 LEU QD 1 71 THR H 1.800 . 6.000 4.349 3.769 4.987 . 0 0 "[ . 1 . 2]" 1
994 1 68 LEU HG 1 71 THR H 1.800 . 5.000 4.360 3.596 4.941 . 0 0 "[ . 1 . 2]" 1
995 1 68 LEU H 1 69 ARG H 1.800 . 3.000 2.194 1.999 2.440 . 0 0 "[ . 1 . 2]" 1
996 1 68 LEU H 1 70 ASP H 1.800 . 6.000 4.233 3.860 4.749 . 0 0 "[ . 1 . 2]" 1
997 1 68 LEU HA 1 68 LEU MD1 1.800 . 5.000 2.832 2.087 3.556 . 0 0 "[ . 1 . 2]" 1
998 1 68 LEU HA 1 68 LEU MD2 1.800 . 5.000 3.584 2.929 3.840 . 0 0 "[ . 1 . 2]" 1
999 1 68 LEU HA 1 71 THR MG 1.800 . 4.000 2.689 1.866 3.878 . 0 0 "[ . 1 . 2]" 1
1000 1 68 LEU HB3 1 68 LEU QD 1.800 . 4.000 2.058 1.964 2.368 . 0 0 "[ . 1 . 2]" 1
1001 1 68 LEU HB2 1 68 LEU QD 1.800 . 4.000 2.049 1.951 2.147 . 0 0 "[ . 1 . 2]" 1
1002 1 68 LEU QD 1 71 THR MG 1.800 . 5.000 3.096 2.052 3.992 . 0 0 "[ . 1 . 2]" 1
1003 1 68 LEU QD 1 79 ILE MD 1.800 . 5.000 3.113 2.062 4.633 . 0 0 "[ . 1 . 2]" 1
1004 1 68 LEU QD 1 89 PHE QD 1.800 . 6.000 5.195 4.576 5.652 . 0 0 "[ . 1 . 2]" 1
1005 1 68 LEU QD 1 89 PHE QE 1.800 . 5.000 4.115 3.391 4.852 . 0 0 "[ . 1 . 2]" 1
1006 1 68 LEU HG 1 71 THR MG 1.800 . 4.000 3.314 2.546 4.044 0.044 20 0 "[ . 1 . 2]" 1
1007 1 69 ARG HA 1 70 ASP H 1.800 . 4.500 3.505 3.434 3.527 . 0 0 "[ . 1 . 2]" 1
1008 1 69 ARG HA 1 71 THR H 1.800 . 5.000 3.839 3.566 4.326 . 0 0 "[ . 1 . 2]" 1
1009 1 69 ARG H 1 69 ARG QB 1.800 . 3.500 2.196 2.077 2.656 . 0 0 "[ . 1 . 2]" 1
1010 1 69 ARG HB3 1 70 ASP H 1.800 . 5.000 3.064 2.781 4.178 . 0 0 "[ . 1 . 2]" 1
1011 1 69 ARG HB2 1 70 ASP H 1.800 . 5.000 3.734 3.084 3.994 . 0 0 "[ . 1 . 2]" 1
1012 1 69 ARG H 1 69 ARG QD 1.800 . 6.000 4.275 3.315 4.757 . 0 0 "[ . 1 . 2]" 1
1013 1 69 ARG H 1 70 ASP H 1.800 . 5.000 2.618 2.552 2.706 . 0 0 "[ . 1 . 2]" 1
1014 1 69 ARG HA 1 69 ARG HD3 1.800 . 5.000 4.190 2.200 4.752 . 0 0 "[ . 1 . 2]" 1
1015 1 69 ARG HA 1 69 ARG HD2 1.800 . 5.000 4.060 2.142 4.789 . 0 0 "[ . 1 . 2]" 1
1016 1 69 ARG HA 1 70 ASP HA 1.800 . 5.000 4.612 4.574 4.689 . 0 0 "[ . 1 . 2]" 1
1017 1 69 ARG QB 1 69 ARG QD 1.800 . 4.000 2.147 1.929 2.641 . 0 0 "[ . 1 . 2]" 1
1018 1 70 ASP HA 1 71 THR H 1.800 . 4.000 3.196 3.155 3.484 . 0 0 "[ . 1 . 2]" 1
1019 1 70 ASP HB3 1 71 THR H 1.800 . 5.500 4.137 3.811 4.539 . 0 0 "[ . 1 . 2]" 1
1020 1 70 ASP HB2 1 71 THR H 1.800 . 5.500 4.076 3.074 4.421 . 0 0 "[ . 1 . 2]" 1
1021 1 70 ASP H 1 71 THR HB 1.800 . 6.000 5.318 4.623 5.979 . 0 0 "[ . 1 . 2]" 1
1022 1 70 ASP H 1 71 THR HG1 1.800 . 5.000 3.422 2.997 4.243 . 0 0 "[ . 1 . 2]" 1
1023 1 70 ASP H 1 71 THR H 1.800 . 4.000 2.524 2.389 2.642 . 0 0 "[ . 1 . 2]" 1
1024 1 70 ASP HA 1 71 THR HA 1.800 . 5.000 4.545 4.451 4.719 . 0 0 "[ . 1 . 2]" 1
1025 1 70 ASP HA 1 72 LYS QD 1.800 . 6.000 5.568 5.061 6.011 0.011 3 0 "[ . 1 . 2]" 1
1026 1 70 ASP QB 1 71 THR HG1 1.800 . 6.000 3.766 3.118 4.427 . 0 0 "[ . 1 . 2]" 1
1027 1 71 THR HA 1 72 LYS H 1.800 . 3.000 2.360 2.178 2.610 . 0 0 "[ . 1 . 2]" 1
1028 1 71 THR H 1 71 THR HB 1.800 . 4.000 3.365 2.611 3.799 . 0 0 "[ . 1 . 2]" 1
1029 1 71 THR HB 1 72 LYS H 1.800 . 5.000 3.101 2.065 3.847 . 0 0 "[ . 1 . 2]" 1
1030 1 71 THR H 1 71 THR MG 1.800 . 5.000 2.881 2.166 3.867 . 0 0 "[ . 1 . 2]" 1
1031 1 71 THR MG 1 72 LYS H 1.800 . 6.000 3.309 1.988 3.989 . 0 0 "[ . 1 . 2]" 1
1032 1 71 THR MG 1 76 ALA H 1.800 . 6.000 4.248 2.812 5.348 . 0 0 "[ . 1 . 2]" 1
1033 1 71 THR H 1 72 LYS H 1.800 . 5.000 4.510 4.425 4.594 . 0 0 "[ . 1 . 2]" 1
1034 1 71 THR HA 1 71 THR MG 1.800 . 4.000 2.543 2.085 3.234 . 0 0 "[ . 1 . 2]" 1
1035 1 71 THR HA 1 72 LYS HB2 1.800 . 5.000 4.464 4.287 4.885 . 0 0 "[ . 1 . 2]" 1
1036 1 71 THR HA 1 75 GLU HB3 1.800 . 6.000 4.332 3.619 4.819 . 0 0 "[ . 1 . 2]" 1
1037 1 71 THR HA 1 75 GLU HB2 1.800 . 6.000 4.332 3.914 5.089 . 0 0 "[ . 1 . 2]" 1
1038 1 71 THR HA 1 75 GLU QB 1.800 . 5.000 3.794 3.483 4.210 . 0 0 "[ . 1 . 2]" 1
1039 1 71 THR HA 1 75 GLU QG 1.800 . 6.000 4.561 3.633 5.171 . 0 0 "[ . 1 . 2]" 1
1040 1 71 THR HB 1 75 GLU HB3 1.800 . 6.000 3.544 2.276 4.757 . 0 0 "[ . 1 . 2]" 1
1041 1 71 THR HB 1 75 GLU HB2 1.800 . 6.000 3.970 2.510 5.450 . 0 0 "[ . 1 . 2]" 1
1042 1 71 THR HB 1 75 GLU QB 1.800 . 4.000 3.168 2.257 4.041 0.041 11 0 "[ . 1 . 2]" 1
1043 1 71 THR MG 1 75 GLU HB3 1.800 . 6.000 3.315 1.918 4.177 . 0 0 "[ . 1 . 2]" 1
1044 1 71 THR MG 1 75 GLU HB2 1.800 . 6.000 3.894 1.982 5.221 . 0 0 "[ . 1 . 2]" 1
1045 1 71 THR MG 1 75 GLU QB 1.800 . 4.000 3.100 1.815 3.881 . 0 0 "[ . 1 . 2]" 1
1046 1 71 THR MG 1 76 ALA HA 1.800 . 6.000 3.689 2.877 4.649 . 0 0 "[ . 1 . 2]" 1
1047 1 71 THR MG 1 79 ILE MD 1.800 . 5.000 2.415 1.792 3.388 0.008 19 0 "[ . 1 . 2]" 1
1048 1 72 LYS HA 1 73 HIS H 1.800 . 4.000 2.392 2.370 2.402 . 0 0 "[ . 1 . 2]" 1
1049 1 72 LYS HB3 1 73 HIS H 1.800 . 5.000 2.577 2.509 2.711 . 0 0 "[ . 1 . 2]" 1
1050 1 72 LYS HB2 1 73 HIS H 1.800 . 5.000 3.881 3.520 4.030 . 0 0 "[ . 1 . 2]" 1
1051 1 72 LYS HB3 1 74 LYS H 1.800 . 5.000 2.897 2.761 3.298 . 0 0 "[ . 1 . 2]" 1
1052 1 72 LYS HB2 1 74 LYS H 1.800 . 5.000 4.059 3.437 4.402 . 0 0 "[ . 1 . 2]" 1
1053 1 72 LYS HB3 1 75 GLU H 1.800 . 5.000 3.056 2.784 3.706 . 0 0 "[ . 1 . 2]" 1
1054 1 72 LYS HB2 1 75 GLU H 1.800 . 5.000 2.902 2.430 3.287 . 0 0 "[ . 1 . 2]" 1
1055 1 72 LYS QB 1 75 GLU H 1.800 . 4.000 2.599 2.392 2.714 . 0 0 "[ . 1 . 2]" 1
1056 1 72 LYS QD 1 75 GLU H 1.800 . 6.000 5.029 4.517 5.425 . 0 0 "[ . 1 . 2]" 1
1057 1 72 LYS H 1 72 LYS QE 1.800 . 5.500 4.080 2.397 5.227 . 0 0 "[ . 1 . 2]" 1
1058 1 72 LYS H 1 72 LYS QG 1.800 . 4.500 3.487 1.997 3.901 . 0 0 "[ . 1 . 2]" 1
1059 1 72 LYS H 1 75 GLU QB 1.800 . 5.000 2.270 1.973 2.598 . 0 0 "[ . 1 . 2]" 1
1060 1 72 LYS H 1 73 HIS H 1.800 . 5.000 4.605 4.520 4.656 . 0 0 "[ . 1 . 2]" 1
1061 1 72 LYS H 1 74 LYS H 1.800 . 6.000 5.487 5.320 5.717 . 0 0 "[ . 1 . 2]" 1
1062 1 72 LYS H 1 75 GLU H 1.800 . 5.000 3.893 3.703 4.218 . 0 0 "[ . 1 . 2]" 1
1063 1 72 LYS H 1 76 ALA H 1.800 . 6.000 4.185 3.835 4.675 . 0 0 "[ . 1 . 2]" 1
1064 1 72 LYS HA 1 72 LYS QG 1.800 . 5.000 2.356 2.092 3.091 . 0 0 "[ . 1 . 2]" 1
1065 1 72 LYS QB 1 72 LYS QE 1.800 . 5.500 2.959 1.960 3.862 . 0 0 "[ . 1 . 2]" 1
1066 1 72 LYS QB 1 75 GLU QB 1.800 . 5.000 2.490 1.934 3.066 . 0 0 "[ . 1 . 2]" 1
1067 1 72 LYS QE 1 75 GLU QG 1.800 . 6.000 4.476 2.076 5.992 . 0 0 "[ . 1 . 2]" 1
1068 1 73 HIS HA 1 74 LYS H 1.800 . 4.000 3.571 3.562 3.577 . 0 0 "[ . 1 . 2]" 1
1069 1 73 HIS HA 1 75 GLU H 1.800 . 5.000 4.505 4.384 4.680 . 0 0 "[ . 1 . 2]" 1
1070 1 73 HIS HA 1 76 ALA H 1.800 . 5.000 3.541 3.433 3.733 . 0 0 "[ . 1 . 2]" 1
1071 1 73 HIS HA 1 77 VAL H 1.800 . 6.000 4.523 4.265 4.748 . 0 0 "[ . 1 . 2]" 1
1072 1 73 HIS HB3 1 74 LYS H 1.800 . 5.000 2.405 2.338 2.479 . 0 0 "[ . 1 . 2]" 1
1073 1 73 HIS HB2 1 74 LYS H 1.800 . 5.000 3.723 3.494 3.820 . 0 0 "[ . 1 . 2]" 1
1074 1 73 HIS QB 1 74 LYS H 1.800 . 4.000 2.377 2.313 2.449 . 0 0 "[ . 1 . 2]" 1
1075 1 73 HIS HD2 1 74 LYS H 1.800 . 6.000 5.516 5.045 5.841 . 0 0 "[ . 1 . 2]" 1
1076 1 73 HIS H 1 74 LYS H 1.800 . 5.000 2.882 2.847 2.909 . 0 0 "[ . 1 . 2]" 1
1077 1 73 HIS H 1 75 GLU H 1.800 . 5.000 4.173 4.099 4.238 . 0 0 "[ . 1 . 2]" 1
1078 1 73 HIS HA 1 73 HIS HD2 1.800 . 5.000 3.046 2.408 4.740 . 0 0 "[ . 1 . 2]" 1
1079 1 73 HIS HA 1 76 ALA MB 1.800 . 6.000 2.683 2.424 2.900 . 0 0 "[ . 1 . 2]" 1
1080 1 73 HIS HD2 1 77 VAL QG 1.800 . 5.000 4.432 3.345 5.020 0.020 9 0 "[ . 1 . 2]" 1
1081 1 73 HIS HE1 1 77 VAL QG 1.800 . 5.500 3.903 3.243 4.774 . 0 0 "[ . 1 . 2]" 1
1082 1 74 LYS HA 1 75 GLU H 1.800 . 5.000 3.542 3.527 3.550 . 0 0 "[ . 1 . 2]" 1
1083 1 74 LYS HA 1 76 ALA H 1.800 . 5.000 4.365 4.233 4.430 . 0 0 "[ . 1 . 2]" 1
1084 1 74 LYS HA 1 77 VAL H 1.800 . 4.000 3.533 3.435 3.588 . 0 0 "[ . 1 . 2]" 1
1085 1 74 LYS HA 1 78 THR H 1.800 . 6.000 4.830 4.519 5.012 . 0 0 "[ . 1 . 2]" 1
1086 1 74 LYS QB 1 75 GLU H 1.800 . 4.000 2.718 2.520 3.400 . 0 0 "[ . 1 . 2]" 1
1087 1 74 LYS H 1 74 LYS QD 1.800 . 5.000 4.155 3.034 4.684 . 0 0 "[ . 1 . 2]" 1
1088 1 74 LYS H 1 74 LYS QG 1.800 . 5.000 3.156 2.012 4.010 . 0 0 "[ . 1 . 2]" 1
1089 1 74 LYS H 1 75 GLU H 1.800 . 4.000 2.691 2.625 2.769 . 0 0 "[ . 1 . 2]" 1
1090 1 74 LYS H 1 76 ALA H 1.800 . 5.000 4.123 4.060 4.204 . 0 0 "[ . 1 . 2]" 1
1091 1 74 LYS HA 1 74 LYS QD 1.800 . 6.000 3.629 2.104 4.275 . 0 0 "[ . 1 . 2]" 1
1092 1 74 LYS HA 1 74 LYS QG 1.800 . 5.000 2.500 2.075 3.352 . 0 0 "[ . 1 . 2]" 1
1093 1 74 LYS HA 1 74 LYS QE 1.800 . 6.000 4.554 2.973 5.683 . 0 0 "[ . 1 . 2]" 1
1094 1 74 LYS HA 1 77 VAL HB 1.800 . 4.000 3.440 3.308 3.552 . 0 0 "[ . 1 . 2]" 1
1095 1 74 LYS HA 1 77 VAL QG 1.800 . 4.000 2.182 2.004 2.492 . 0 0 "[ . 1 . 2]" 1
1096 1 74 LYS QE 1 74 LYS HG3 1.800 . 5.000 2.603 2.082 3.528 . 0 0 "[ . 1 . 2]" 1
1097 1 74 LYS QE 1 74 LYS HG2 1.800 . 5.000 2.711 2.006 3.448 . 0 0 "[ . 1 . 2]" 1
1098 1 75 GLU HA 1 76 ALA H 1.800 . 4.000 3.534 3.528 3.542 . 0 0 "[ . 1 . 2]" 1
1099 1 75 GLU HA 1 77 VAL H 1.800 . 5.000 4.194 4.086 4.414 . 0 0 "[ . 1 . 2]" 1
1100 1 75 GLU HA 1 78 THR H 1.800 . 5.000 3.543 3.454 3.598 . 0 0 "[ . 1 . 2]" 1
1101 1 75 GLU HA 1 79 ILE H 1.800 . 5.000 4.496 4.140 4.692 . 0 0 "[ . 1 . 2]" 1
1102 1 75 GLU QB 1 76 ALA H 1.800 . 4.000 2.675 2.591 2.757 . 0 0 "[ . 1 . 2]" 1
1103 1 75 GLU H 1 75 GLU QG 1.800 . 5.000 3.103 2.117 4.051 . 0 0 "[ . 1 . 2]" 1
1104 1 75 GLU H 1 76 ALA MB 1.800 . 6.000 4.292 4.211 4.363 . 0 0 "[ . 1 . 2]" 1
1105 1 75 GLU H 1 76 ALA H 1.800 . 4.000 2.634 2.597 2.680 . 0 0 "[ . 1 . 2]" 1
1106 1 75 GLU H 1 77 VAL H 1.800 . 5.000 4.132 4.087 4.222 . 0 0 "[ . 1 . 2]" 1
1107 1 75 GLU HA 1 75 GLU QG 1.800 . 4.000 2.330 2.032 2.791 . 0 0 "[ . 1 . 2]" 1
1108 1 75 GLU HA 1 78 THR HB 1.800 . 5.000 3.632 3.367 4.152 . 0 0 "[ . 1 . 2]" 1
1109 1 76 ALA HA 1 77 VAL H 1.800 . 4.000 3.522 3.509 3.548 . 0 0 "[ . 1 . 2]" 1
1110 1 76 ALA HA 1 78 THR H 1.800 . 5.000 4.331 4.231 4.459 . 0 0 "[ . 1 . 2]" 1
1111 1 76 ALA HA 1 79 ILE H 1.800 . 4.000 3.355 3.245 3.537 . 0 0 "[ . 1 . 2]" 1
1112 1 76 ALA HA 1 80 LEU H 1.800 . 5.000 3.990 3.596 4.442 . 0 0 "[ . 1 . 2]" 1
1113 1 76 ALA H 1 76 ALA MB 1.800 . 4.000 2.199 2.114 2.242 . 0 0 "[ . 1 . 2]" 1
1114 1 76 ALA MB 1 77 VAL H 1.800 . 4.000 2.746 2.602 2.859 . 0 0 "[ . 1 . 2]" 1
1115 1 76 ALA H 1 77 VAL H 1.800 . 4.000 2.663 2.649 2.684 . 0 0 "[ . 1 . 2]" 1
1116 1 76 ALA H 1 78 THR H 1.800 . 5.000 4.314 4.181 4.413 . 0 0 "[ . 1 . 2]" 1
1117 1 76 ALA HA 1 79 ILE HB 1.800 . 5.000 2.827 2.654 3.167 . 0 0 "[ . 1 . 2]" 1
1118 1 76 ALA HA 1 79 ILE MD 1.800 . 4.000 2.347 1.925 3.996 . 0 0 "[ . 1 . 2]" 1
1119 1 77 VAL HA 1 78 THR H 1.800 . 5.000 3.543 3.530 3.553 . 0 0 "[ . 1 . 2]" 1
1120 1 77 VAL HA 1 79 ILE H 1.800 . 5.000 4.548 4.400 4.715 . 0 0 "[ . 1 . 2]" 1
1121 1 77 VAL HA 1 80 LEU H 1.800 . 5.000 3.639 3.506 3.862 . 0 0 "[ . 1 . 2]" 1
1122 1 77 VAL HA 1 81 SER H 1.800 . 5.000 4.358 4.108 4.598 . 0 0 "[ . 1 . 2]" 1
1123 1 77 VAL H 1 77 VAL HB 1.800 . 4.000 2.666 2.640 2.686 . 0 0 "[ . 1 . 2]" 1
1124 1 77 VAL HB 1 78 THR H 1.800 . 4.000 2.594 2.519 2.680 . 0 0 "[ . 1 . 2]" 1
1125 1 77 VAL H 1 77 VAL MG1 1.800 . 5.000 3.777 3.772 3.782 . 0 0 "[ . 1 . 2]" 1
1126 1 77 VAL H 1 77 VAL MG2 1.800 . 5.000 2.108 2.019 2.188 . 0 0 "[ . 1 . 2]" 1
1127 1 77 VAL H 1 77 VAL QG 1.800 . 4.000 2.097 2.011 2.175 . 0 0 "[ . 1 . 2]" 1
1128 1 77 VAL MG1 1 78 THR H 1.800 . 5.000 3.618 3.570 3.677 . 0 0 "[ . 1 . 2]" 1
1129 1 77 VAL MG2 1 78 THR H 1.800 . 5.000 3.725 3.680 3.772 . 0 0 "[ . 1 . 2]" 1
1130 1 77 VAL H 1 78 THR H 1.800 . 4.000 2.678 2.651 2.704 . 0 0 "[ . 1 . 2]" 1
1131 1 77 VAL H 1 79 ILE H 1.800 . 5.000 4.174 4.066 4.309 . 0 0 "[ . 1 . 2]" 1
1132 1 77 VAL HA 1 77 VAL MG1 1.800 . 4.000 2.327 2.214 2.411 . 0 0 "[ . 1 . 2]" 1
1133 1 77 VAL HA 1 77 VAL MG2 1.800 . 4.000 2.423 2.385 2.475 . 0 0 "[ . 1 . 2]" 1
1134 1 77 VAL HA 1 80 LEU HG 1.800 . 6.000 4.042 2.179 5.665 . 0 0 "[ . 1 . 2]" 1
1135 1 77 VAL HA 1 80 LEU QD 1.800 . 6.000 2.509 1.895 3.372 . 0 0 "[ . 1 . 2]" 1
1136 1 78 THR HA 1 79 ILE H 1.800 . 4.000 3.555 3.540 3.568 . 0 0 "[ . 1 . 2]" 1
1137 1 78 THR HA 1 80 LEU H 1.800 . 5.000 4.527 4.381 4.706 . 0 0 "[ . 1 . 2]" 1
1138 1 78 THR HA 1 81 SER H 1.800 . 5.000 3.544 3.399 3.683 . 0 0 "[ . 1 . 2]" 1
1139 1 78 THR HA 1 82 GLN H 1.800 . 5.000 4.577 4.310 4.733 . 0 0 "[ . 1 . 2]" 1
1140 1 78 THR H 1 78 THR HB 1.800 . 4.000 2.771 2.495 3.410 . 0 0 "[ . 1 . 2]" 1
1141 1 78 THR HB 1 79 ILE H 1.800 . 4.000 2.602 2.439 3.022 . 0 0 "[ . 1 . 2]" 1
1142 1 78 THR H 1 78 THR MG 1.800 . 5.000 3.681 3.115 3.761 . 0 0 "[ . 1 . 2]" 1
1143 1 78 THR MG 1 79 ILE H 1.800 . 5.000 3.786 3.503 4.157 . 0 0 "[ . 1 . 2]" 1
1144 1 78 THR H 1 79 ILE QG 1.800 . 5.000 4.121 3.979 4.259 . 0 0 "[ . 1 . 2]" 1
1145 1 78 THR H 1 79 ILE H 1.800 . 4.500 2.658 2.572 2.717 . 0 0 "[ . 1 . 2]" 1
1146 1 78 THR H 1 80 LEU H 1.800 . 5.000 4.194 4.047 4.313 . 0 0 "[ . 1 . 2]" 1
1147 1 78 THR HA 1 78 THR MG 1.800 . 4.000 2.279 2.073 2.449 . 0 0 "[ . 1 . 2]" 1
1148 1 78 THR HA 1 81 SER QB 1.800 . 5.000 2.985 2.575 3.735 . 0 0 "[ . 1 . 2]" 1
1149 1 78 THR MG 1 81 SER QB 1.800 . 6.000 3.810 3.379 4.753 . 0 0 "[ . 1 . 2]" 1
1150 1 78 THR MG 1 82 GLN HG3 1.800 . 6.000 3.711 2.981 5.535 . 0 0 "[ . 1 . 2]" 1
1151 1 78 THR MG 1 82 GLN HG2 1.800 . 6.000 3.507 2.838 4.678 . 0 0 "[ . 1 . 2]" 1
1152 1 79 ILE HA 1 80 LEU H 1.800 . 4.000 3.558 3.538 3.585 . 0 0 "[ . 1 . 2]" 1
1153 1 79 ILE HA 1 81 SER H 1.800 . 5.000 4.323 4.206 4.472 . 0 0 "[ . 1 . 2]" 1
1154 1 79 ILE HA 1 82 GLN H 1.800 . 4.000 3.380 3.275 3.513 . 0 0 "[ . 1 . 2]" 1
1155 1 79 ILE H 1 79 ILE HB 1.800 . 4.000 2.646 2.622 2.705 . 0 0 "[ . 1 . 2]" 1
1156 1 79 ILE HB 1 80 LEU H 1.800 . 5.000 2.559 2.446 2.689 . 0 0 "[ . 1 . 2]" 1
1157 1 79 ILE H 1 79 ILE MD 1.800 . 4.500 3.126 2.730 3.470 . 0 0 "[ . 1 . 2]" 1
1158 1 79 ILE H 1 79 ILE HG13 1.800 . 5.000 2.253 1.968 3.587 . 0 0 "[ . 1 . 2]" 1
1159 1 79 ILE H 1 79 ILE HG12 1.800 . 5.000 3.300 2.004 3.592 . 0 0 "[ . 1 . 2]" 1
1160 1 79 ILE H 1 79 ILE QG 1.800 . 4.000 2.008 1.957 2.059 . 0 0 "[ . 1 . 2]" 1
1161 1 79 ILE H 1 79 ILE MG 1.800 . 6.000 3.785 3.779 3.791 . 0 0 "[ . 1 . 2]" 1
1162 1 79 ILE MG 1 80 LEU H 1.800 . 5.000 3.522 3.413 3.612 . 0 0 "[ . 1 . 2]" 1
1163 1 79 ILE MG 1 82 GLN H 1.800 . 6.000 4.369 4.172 4.523 . 0 0 "[ . 1 . 2]" 1
1164 1 79 ILE MG 1 83 GLN H 1.800 . 6.000 4.529 4.313 4.899 . 0 0 "[ . 1 . 2]" 1
1165 1 79 ILE H 1 80 LEU H 1.800 . 4.000 2.730 2.677 2.803 . 0 0 "[ . 1 . 2]" 1
1166 1 79 ILE H 1 81 SER H 1.800 . 5.000 4.158 4.030 4.276 . 0 0 "[ . 1 . 2]" 1
1167 1 79 ILE HA 1 79 ILE MD 1.800 . 5.000 3.649 2.104 3.932 . 0 0 "[ . 1 . 2]" 1
1168 1 79 ILE HA 1 79 ILE HG13 1.800 . 4.500 2.957 2.746 3.754 . 0 0 "[ . 1 . 2]" 1
1169 1 79 ILE HA 1 79 ILE HG12 1.800 . 4.500 2.905 2.628 3.281 . 0 0 "[ . 1 . 2]" 1
1170 1 79 ILE HA 1 79 ILE MG 1.800 . 5.000 2.313 2.259 2.401 . 0 0 "[ . 1 . 2]" 1
1171 1 79 ILE HA 1 82 GLN QB 1.800 . 4.000 2.960 2.587 3.385 . 0 0 "[ . 1 . 2]" 1
1172 1 79 ILE HA 1 82 GLN HG3 1.800 . 4.000 2.371 2.008 3.326 . 0 0 "[ . 1 . 2]" 1
1173 1 79 ILE HA 1 82 GLN HG2 1.800 . 4.000 3.451 2.557 4.016 0.016 18 0 "[ . 1 . 2]" 1
1174 1 79 ILE MD 1 79 ILE MG 1.800 . 5.000 2.303 1.928 2.498 . 0 0 "[ . 1 . 2]" 1
1175 1 79 ILE QG 1 79 ILE MG 1.800 . 5.000 2.177 2.011 2.292 . 0 0 "[ . 1 . 2]" 1
1176 1 79 ILE MG 1 82 GLN QB 1.800 . 6.000 3.318 3.041 3.708 . 0 0 "[ . 1 . 2]" 1
1177 1 80 LEU HA 1 81 SER H 1.800 . 4.000 3.537 3.514 3.556 . 0 0 "[ . 1 . 2]" 1
1178 1 80 LEU HA 1 82 GLN H 1.800 . 5.000 4.149 3.896 4.279 . 0 0 "[ . 1 . 2]" 1
1179 1 80 LEU HA 1 83 GLN H 1.800 . 4.000 3.596 3.435 3.989 . 0 0 "[ . 1 . 2]" 1
1180 1 80 LEU H 1 80 LEU QB 1.800 . 4.000 2.301 2.035 2.615 . 0 0 "[ . 1 . 2]" 1
1181 1 80 LEU HB3 1 81 SER H 1.800 . 5.000 3.478 2.849 4.084 . 0 0 "[ . 1 . 2]" 1
1182 1 80 LEU HB2 1 81 SER H 1.800 . 5.000 3.075 2.540 3.964 . 0 0 "[ . 1 . 2]" 1
1183 1 80 LEU H 1 80 LEU QD 1.800 . 4.500 3.074 2.557 3.505 . 0 0 "[ . 1 . 2]" 1
1184 1 80 LEU QD 1 81 SER H 1.800 . 6.000 3.763 2.253 4.179 . 0 0 "[ . 1 . 2]" 1
1185 1 80 LEU H 1 80 LEU HG 1.800 . 4.000 2.851 2.086 3.979 . 0 0 "[ . 1 . 2]" 1
1186 1 80 LEU HG 1 81 SER H 1.800 . 5.000 4.264 2.250 5.010 0.010 4 0 "[ . 1 . 2]" 1
1187 1 80 LEU H 1 81 SER H 1.800 . 4.000 2.719 2.654 2.794 . 0 0 "[ . 1 . 2]" 1
1188 1 80 LEU H 1 82 GLN H 1.800 . 5.000 4.089 3.977 4.241 . 0 0 "[ . 1 . 2]" 1
1189 1 80 LEU HA 1 80 LEU QD 1.800 . 5.000 2.661 1.972 3.409 . 0 0 "[ . 1 . 2]" 1
1190 1 80 LEU HA 1 83 GLN QG 1.800 . 5.000 2.470 1.934 4.579 . 0 0 "[ . 1 . 2]" 1
1191 1 80 LEU QB 1 80 LEU QD 1.800 . 4.000 1.848 1.780 1.934 0.020 4 0 "[ . 1 . 2]" 1
1192 1 80 LEU QD 1 89 PHE QD 1.800 . 6.000 4.188 3.481 5.456 . 0 0 "[ . 1 . 2]" 1
1193 1 80 LEU MD1 1 89 PHE QE 1.800 . 5.000 3.779 3.062 4.784 . 0 0 "[ . 1 . 2]" 1
1194 1 80 LEU MD2 1 89 PHE QE 1.800 . 5.000 2.611 1.896 4.032 . 0 0 "[ . 1 . 2]" 1
1195 1 81 SER HA 1 82 GLN H 1.800 . 5.000 3.501 3.421 3.535 . 0 0 "[ . 1 . 2]" 1
1196 1 81 SER HA 1 83 GLN H 1.800 . 4.000 3.964 3.869 4.011 0.011 14 0 "[ . 1 . 2]" 1
1197 1 81 SER QB 1 82 GLN H 1.800 . 4.500 2.985 2.694 3.763 . 0 0 "[ . 1 . 2]" 1
1198 1 81 SER QB 1 83 GLN H 1.800 . 6.000 4.748 4.601 5.074 . 0 0 "[ . 1 . 2]" 1
1199 1 81 SER H 1 82 GLN H 1.800 . 4.000 2.603 2.516 2.688 . 0 0 "[ . 1 . 2]" 1
1200 1 81 SER H 1 83 GLN H 1.800 . 5.000 4.172 4.055 4.446 . 0 0 "[ . 1 . 2]" 1
1201 1 82 GLN HA 1 83 GLN H 1.800 . 5.000 3.491 3.475 3.505 . 0 0 "[ . 1 . 2]" 1
1202 1 82 GLN H 1 82 GLN HB3 1.800 . 4.000 3.603 3.578 3.617 . 0 0 "[ . 1 . 2]" 1
1203 1 82 GLN H 1 82 GLN HB2 1.800 . 4.000 2.535 2.343 2.667 . 0 0 "[ . 1 . 2]" 1
1204 1 82 GLN HB3 1 83 GLN H 1.800 . 6.000 3.938 3.721 4.048 . 0 0 "[ . 1 . 2]" 1
1205 1 82 GLN HB2 1 83 GLN H 1.800 . 6.000 2.958 2.902 3.062 . 0 0 "[ . 1 . 2]" 1
1206 1 82 GLN H 1 82 GLN HG3 1.800 . 4.000 3.001 2.285 3.757 . 0 0 "[ . 1 . 2]" 1
1207 1 82 GLN H 1 82 GLN HG2 1.800 . 4.000 2.523 2.100 3.089 . 0 0 "[ . 1 . 2]" 1
1208 1 82 GLN H 1 83 GLN HG3 1.800 . 6.000 5.654 5.510 5.838 . 0 0 "[ . 1 . 2]" 1
1209 1 82 GLN H 1 83 GLN HG2 1.800 . 6.000 4.211 3.755 6.091 0.091 5 0 "[ . 1 . 2]" 1
1210 1 82 GLN H 1 83 GLN H 1.800 . 3.000 2.606 2.450 2.642 . 0 0 "[ . 1 . 2]" 1
1211 1 82 GLN HA 1 82 GLN HG3 1.800 . 4.000 3.673 3.342 3.810 . 0 0 "[ . 1 . 2]" 1
1212 1 82 GLN HA 1 82 GLN HG2 1.800 . 4.000 2.650 2.362 3.313 . 0 0 "[ . 1 . 2]" 1
1213 1 82 GLN HA 1 83 GLN QG 1.800 . 6.000 5.346 5.139 6.028 0.028 9 0 "[ . 1 . 2]" 1
1214 1 78 THR MG 1 82 GLN HE21 1.800 . 4.500 2.887 2.240 3.577 . 0 0 "[ . 1 . 2]" 1
1215 1 78 THR MG 1 82 GLN HE22 1.800 . 4.500 4.005 3.523 4.461 . 0 0 "[ . 1 . 2]" 1
1216 1 79 ILE HA 1 82 GLN HE21 1.800 . 6.000 4.290 2.051 5.223 . 0 0 "[ . 1 . 2]" 1
1217 1 79 ILE HA 1 82 GLN HE22 1.800 . 6.000 5.445 3.546 6.020 0.020 10 0 "[ . 1 . 2]" 1
1218 1 79 ILE HA 1 82 GLN QE 1.800 . 5.500 4.120 2.038 4.913 . 0 0 "[ . 1 . 2]" 1
1219 1 79 ILE MG 1 82 GLN QE 1.800 . 6.000 5.257 3.298 5.984 . 0 0 "[ . 1 . 2]" 1
1220 1 82 GLN HA 1 82 GLN QE 1.800 . 6.000 4.102 3.004 4.959 . 0 0 "[ . 1 . 2]" 1
1221 1 82 GLN HB3 1 82 GLN QE 1.800 . 6.000 3.825 3.548 4.121 . 0 0 "[ . 1 . 2]" 1
1222 1 82 GLN HB2 1 82 GLN QE 1.800 . 6.000 4.168 3.350 4.362 . 0 0 "[ . 1 . 2]" 1
1223 1 83 GLN HA 1 84 ARG H 1.800 . 3.000 2.163 2.137 2.231 . 0 0 "[ . 1 . 2]" 1
1224 1 83 GLN H 1 83 GLN HB3 1.800 . 4.000 3.585 3.506 3.603 . 0 0 "[ . 1 . 2]" 1
1225 1 83 GLN H 1 83 GLN HB2 1.800 . 4.000 2.644 2.214 2.743 . 0 0 "[ . 1 . 2]" 1
1226 1 83 GLN HB3 1 84 ARG H 1.800 . 6.000 3.612 3.113 4.005 . 0 0 "[ . 1 . 2]" 1
1227 1 83 GLN HB2 1 84 ARG H 1.800 . 6.000 4.269 3.985 4.536 . 0 0 "[ . 1 . 2]" 1
1228 1 83 GLN QB 1 84 ARG H 1.800 . 5.000 3.424 3.015 3.718 . 0 0 "[ . 1 . 2]" 1
1229 1 83 GLN H 1 83 GLN HG3 1.800 . 4.000 3.569 3.414 3.681 . 0 0 "[ . 1 . 2]" 1
1230 1 83 GLN H 1 83 GLN HG2 1.800 . 4.000 2.318 1.934 4.011 0.011 9 0 "[ . 1 . 2]" 1
1231 1 83 GLN H 1 87 ILE QG 1.800 . 6.000 4.953 4.709 5.173 . 0 0 "[ . 1 . 2]" 1
1232 1 83 GLN H 1 84 ARG H 1.800 . 5.000 4.413 4.165 4.601 . 0 0 "[ . 1 . 2]" 1
1233 1 83 GLN HA 1 87 ILE HA 1.800 . 5.000 5.002 4.765 5.035 0.035 1 0 "[ . 1 . 2]" 1
1234 1 83 GLN HA 1 87 ILE QG 1.800 . 5.000 3.707 3.407 3.994 . 0 0 "[ . 1 . 2]" 1
1235 1 83 GLN HB3 1 87 ILE HA 1.800 . 5.000 3.196 2.782 3.452 . 0 0 "[ . 1 . 2]" 1
1236 1 83 GLN HB2 1 87 ILE HA 1.800 . 5.000 4.665 4.107 5.014 0.014 20 0 "[ . 1 . 2]" 1
1237 1 83 GLN QB 1 87 ILE QG 1.800 . 6.000 1.918 1.834 2.029 . 0 0 "[ . 1 . 2]" 1
1238 1 83 GLN QG 1 87 ILE QG 1.800 . 6.000 3.697 3.489 3.831 . 0 0 "[ . 1 . 2]" 1
1239 1 63 VAL QG 1 83 GLN HE21 1.800 . 5.000 3.650 2.442 4.875 . 0 0 "[ . 1 . 2]" 1
1240 1 63 VAL QG 1 83 GLN HE22 1.800 . 5.000 3.971 2.810 4.617 . 0 0 "[ . 1 . 2]" 1
1241 1 66 VAL QG 1 83 GLN QE 1.800 . 6.000 3.278 2.377 4.574 . 0 0 "[ . 1 . 2]" 1
1242 1 79 ILE HA 1 83 GLN HE21 1.800 . 5.000 4.058 3.534 5.036 0.036 10 0 "[ . 1 . 2]" 1
1243 1 79 ILE HA 1 83 GLN HE22 1.800 . 5.000 4.489 3.451 4.879 . 0 0 "[ . 1 . 2]" 1
1244 1 79 ILE MG 1 83 GLN HE21 1.800 . 4.000 2.445 1.946 3.944 . 0 0 "[ . 1 . 2]" 1
1245 1 79 ILE MG 1 83 GLN HE22 1.800 . 4.000 2.610 2.137 2.892 . 0 0 "[ . 1 . 2]" 1
1246 1 80 LEU HA 1 83 GLN HE21 1.800 . 5.000 3.552 2.758 5.002 0.002 9 0 "[ . 1 . 2]" 1
1247 1 80 LEU HA 1 83 GLN HE22 1.800 . 5.000 4.727 3.700 5.017 0.017 8 0 "[ . 1 . 2]" 1
1248 1 82 GLN QB 1 83 GLN HE21 1.800 . 6.000 3.083 2.133 4.029 . 0 0 "[ . 1 . 2]" 1
1249 1 82 GLN QB 1 83 GLN HE22 1.800 . 6.000 3.316 2.225 3.910 . 0 0 "[ . 1 . 2]" 1
1250 1 83 GLN HA 1 83 GLN HE21 1.800 . 5.000 3.898 2.585 4.692 . 0 0 "[ . 1 . 2]" 1
1251 1 83 GLN HA 1 83 GLN HE22 1.800 . 5.000 4.095 3.509 4.749 . 0 0 "[ . 1 . 2]" 1
1252 1 83 GLN QB 1 83 GLN HE21 1.800 . 6.000 3.872 3.462 4.045 . 0 0 "[ . 1 . 2]" 1
1253 1 83 GLN H 1 83 GLN HE21 1.800 . 4.500 3.182 2.349 3.888 . 0 0 "[ . 1 . 2]" 1
1254 1 83 GLN H 1 83 GLN HE22 1.800 . 4.500 4.074 3.102 4.475 . 0 0 "[ . 1 . 2]" 1
1255 1 83 GLN HE21 1 87 ILE MG 1.800 . 6.000 4.573 4.126 4.910 . 0 0 "[ . 1 . 2]" 1
1256 1 83 GLN HE22 1 87 ILE MG 1.800 . 6.000 4.949 4.519 5.389 . 0 0 "[ . 1 . 2]" 1
1257 1 84 ARG HA 1 85 GLY H 1.800 . 3.000 2.260 2.233 2.322 . 0 0 "[ . 1 . 2]" 1
1258 1 84 ARG HB3 1 85 GLY H 1.800 . 4.500 3.418 2.630 3.962 . 0 0 "[ . 1 . 2]" 1
1259 1 84 ARG HB2 1 85 GLY H 1.800 . 4.500 3.959 2.707 4.286 . 0 0 "[ . 1 . 2]" 1
1260 1 84 ARG H 1 84 ARG HD3 1.800 . 6.000 4.934 3.346 6.015 0.015 8 0 "[ . 1 . 2]" 1
1261 1 84 ARG H 1 84 ARG HD2 1.800 . 6.000 4.889 3.576 5.768 . 0 0 "[ . 1 . 2]" 1
1262 1 84 ARG HD3 1 85 GLY H 1.800 . 6.000 4.705 2.409 5.570 . 0 0 "[ . 1 . 2]" 1
1263 1 84 ARG HD2 1 85 GLY H 1.800 . 6.000 5.002 3.702 6.023 0.023 1 0 "[ . 1 . 2]" 1
1264 1 84 ARG H 1 84 ARG QG 1.800 . 5.000 3.539 2.006 4.191 . 0 0 "[ . 1 . 2]" 1
1265 1 84 ARG QG 1 85 GLY H 1.800 . 5.000 3.046 2.099 4.516 . 0 0 "[ . 1 . 2]" 1
1266 1 84 ARG H 1 87 ILE QG 1.800 . 5.000 3.834 3.244 4.196 . 0 0 "[ . 1 . 2]" 1
1267 1 84 ARG H 1 85 GLY H 1.800 . 6.000 4.513 4.403 4.559 . 0 0 "[ . 1 . 2]" 1
1268 1 84 ARG H 1 86 GLU H 1.800 . 6.000 5.308 4.656 5.672 . 0 0 "[ . 1 . 2]" 1
1269 1 84 ARG HA 1 84 ARG HD3 1.800 . 6.000 4.095 2.109 4.642 . 0 0 "[ . 1 . 2]" 1
1270 1 84 ARG HA 1 84 ARG HD2 1.800 . 6.000 4.194 2.362 5.498 . 0 0 "[ . 1 . 2]" 1
1271 1 84 ARG HA 1 84 ARG QG 1.800 . 6.000 2.453 2.012 3.379 . 0 0 "[ . 1 . 2]" 1
1272 1 84 ARG HB3 1 84 ARG QD 1.800 . 5.000 2.704 1.999 3.504 . 0 0 "[ . 1 . 2]" 1
1273 1 84 ARG HB2 1 84 ARG QD 1.800 . 5.000 2.439 1.932 3.281 . 0 0 "[ . 1 . 2]" 1
1274 1 85 GLY HA3 1 86 GLU H 1.800 . 4.000 2.184 2.159 2.255 . 0 0 "[ . 1 . 2]" 1
1275 1 85 GLY HA2 1 86 GLU H 1.800 . 4.000 3.408 3.365 3.484 . 0 0 "[ . 1 . 2]" 1
1276 1 85 GLY QA 1 86 GLU H 1.800 . 3.500 2.160 2.135 2.228 . 0 0 "[ . 1 . 2]" 1
1277 1 85 GLY H 1 86 GLU H 1.800 . 5.000 4.325 4.159 4.401 . 0 0 "[ . 1 . 2]" 1
1278 1 86 GLU HA 1 87 ILE H 1.800 . 3.000 2.157 2.134 2.229 . 0 0 "[ . 1 . 2]" 1
1279 1 86 GLU H 1 86 GLU QB 1.800 . 3.500 2.366 2.271 2.831 . 0 0 "[ . 1 . 2]" 1
1280 1 86 GLU QB 1 87 ILE H 1.800 . 5.000 3.689 3.071 3.858 . 0 0 "[ . 1 . 2]" 1
1281 1 86 GLU H 1 86 GLU QG 1.800 . 5.000 3.817 2.081 4.070 . 0 0 "[ . 1 . 2]" 1
1282 1 86 GLU QG 1 87 ILE H 1.800 . 5.000 2.923 2.431 4.328 . 0 0 "[ . 1 . 2]" 1
1283 1 86 GLU H 1 87 ILE HA 1.800 . 6.000 5.257 5.095 5.377 . 0 0 "[ . 1 . 2]" 1
1284 1 86 GLU H 1 87 ILE HG13 1.800 . 5.000 4.586 4.439 4.839 . 0 0 "[ . 1 . 2]" 1
1285 1 86 GLU H 1 87 ILE HG12 1.800 . 5.000 4.985 4.902 5.008 0.008 20 0 "[ . 1 . 2]" 1
1286 1 86 GLU H 1 87 ILE H 1.800 . 5.000 4.476 4.350 4.573 . 0 0 "[ . 1 . 2]" 1
1287 1 86 GLU HA 1 86 GLU HG3 1.800 . 4.000 2.689 2.245 3.671 . 0 0 "[ . 1 . 2]" 1
1288 1 86 GLU HA 1 86 GLU HG2 1.800 . 4.000 3.020 2.392 3.868 . 0 0 "[ . 1 . 2]" 1
1289 1 87 ILE HA 1 88 GLU H 1.800 . 3.000 2.150 2.137 2.192 . 0 0 "[ . 1 . 2]" 1
1290 1 87 ILE H 1 87 ILE HB 1.800 . 4.000 2.831 2.734 2.934 . 0 0 "[ . 1 . 2]" 1
1291 1 87 ILE HB 1 88 GLU H 1.800 . 5.000 4.100 3.964 4.156 . 0 0 "[ . 1 . 2]" 1
1292 1 87 ILE H 1 87 ILE MD 1.800 . 5.000 4.010 3.913 4.135 . 0 0 "[ . 1 . 2]" 1
1293 1 87 ILE H 1 87 ILE HG13 1.800 . 4.500 2.607 2.460 2.775 . 0 0 "[ . 1 . 2]" 1
1294 1 87 ILE H 1 87 ILE HG12 1.800 . 4.500 3.710 3.524 3.835 . 0 0 "[ . 1 . 2]" 1
1295 1 87 ILE H 1 87 ILE MG 1.800 . 5.000 3.927 3.885 3.973 . 0 0 "[ . 1 . 2]" 1
1296 1 87 ILE MG 1 88 GLU H 1.800 . 4.000 2.684 2.422 2.812 . 0 0 "[ . 1 . 2]" 1
1297 1 87 ILE H 1 88 GLU H 1.800 . 5.000 4.283 4.195 4.378 . 0 0 "[ . 1 . 2]" 1
1298 1 87 ILE HA 1 87 ILE MD 1.800 . 6.000 3.886 3.862 3.908 . 0 0 "[ . 1 . 2]" 1
1299 1 87 ILE HA 1 87 ILE MG 1.800 . 4.000 2.209 2.150 2.313 . 0 0 "[ . 1 . 2]" 1
1300 1 87 ILE HB 1 87 ILE MD 1.800 . 4.000 2.425 2.362 2.495 . 0 0 "[ . 1 . 2]" 1
1301 1 87 ILE MD 1 87 ILE MG 1.800 . 5.000 1.868 1.795 2.105 0.005 19 0 "[ . 1 . 2]" 1
1302 1 87 ILE HG13 1 87 ILE MG 1.800 . 5.000 3.200 3.193 3.206 . 0 0 "[ . 1 . 2]" 1
1303 1 87 ILE HG12 1 87 ILE MG 1.800 . 5.000 2.421 2.311 2.455 . 0 0 "[ . 1 . 2]" 1
1304 1 87 ILE MG 1 89 PHE HA 1.800 . 6.000 4.344 4.172 4.592 . 0 0 "[ . 1 . 2]" 1
1305 1 87 ILE MG 1 89 PHE QD 1.800 . 5.000 2.431 1.962 2.922 . 0 0 "[ . 1 . 2]" 1
1306 1 87 ILE MG 1 89 PHE QE 1.800 . 4.000 2.794 2.062 3.848 . 0 0 "[ . 1 . 2]" 1
1307 1 88 GLU HA 1 89 PHE H 1.800 . 3.000 2.167 2.150 2.202 . 0 0 "[ . 1 . 2]" 1
1308 1 88 GLU H 1 88 GLU HB3 1.800 . 4.000 3.155 2.479 3.605 . 0 0 "[ . 1 . 2]" 1
1309 1 88 GLU H 1 88 GLU HB2 1.800 . 4.000 2.382 2.195 2.821 . 0 0 "[ . 1 . 2]" 1
1310 1 88 GLU HG3 1 89 PHE H 1.800 . 5.000 4.036 2.441 5.009 0.009 14 0 "[ . 1 . 2]" 1
1311 1 88 GLU HG2 1 89 PHE H 1.800 . 5.000 3.699 2.709 4.908 . 0 0 "[ . 1 . 2]" 1
1312 1 88 GLU H 1 89 PHE QD 1.800 . 6.000 4.852 4.210 5.361 . 0 0 "[ . 1 . 2]" 1
1313 1 88 GLU H 1 89 PHE H 1.800 . 5.000 4.464 4.408 4.533 . 0 0 "[ . 1 . 2]" 1
1314 1 88 GLU HA 1 88 GLU HG3 1.800 . 4.000 2.534 2.107 3.307 . 0 0 "[ . 1 . 2]" 1
1315 1 88 GLU HA 1 88 GLU HG2 1.800 . 4.000 2.809 2.123 3.634 . 0 0 "[ . 1 . 2]" 1
1316 1 89 PHE HA 1 90 GLU H 1.800 . 3.000 2.156 2.142 2.183 . 0 0 "[ . 1 . 2]" 1
1317 1 89 PHE H 1 89 PHE QD 1.800 . 5.000 3.823 3.410 4.143 . 0 0 "[ . 1 . 2]" 1
1318 1 89 PHE H 1 90 GLU H 1.800 . 5.000 4.375 4.298 4.428 . 0 0 "[ . 1 . 2]" 1
1319 1 89 PHE QD 1 91 VAL QG 1.800 . 5.000 2.527 2.162 2.947 . 0 0 "[ . 1 . 2]" 1
1320 1 89 PHE HA 1 89 PHE QD 1.800 . 6.000 2.929 2.741 3.015 . 0 0 "[ . 1 . 2]" 1
1321 1 90 GLU HA 1 91 VAL H 1.800 . 3.000 2.139 2.129 2.148 . 0 0 "[ . 1 . 2]" 1
1322 1 90 GLU QB 1 91 VAL H 1.800 . 5.000 3.636 3.404 3.876 . 0 0 "[ . 1 . 2]" 1
1323 1 90 GLU H 1 90 GLU HG3 1.800 . 5.000 4.021 2.791 4.774 . 0 0 "[ . 1 . 2]" 1
1324 1 90 GLU H 1 90 GLU HG2 1.800 . 5.000 4.409 3.132 4.823 . 0 0 "[ . 1 . 2]" 1
1325 1 90 GLU QG 1 91 VAL H 1.800 . 6.000 3.583 2.908 4.453 . 0 0 "[ . 1 . 2]" 1
1326 1 90 GLU H 1 91 VAL H 1.800 . 5.000 4.227 4.176 4.326 . 0 0 "[ . 1 . 2]" 1
1327 1 91 VAL HA 1 92 VAL H 1.800 . 3.500 2.473 2.404 2.514 . 0 0 "[ . 1 . 2]" 1
1328 1 91 VAL HB 1 92 VAL H 1.800 . 4.000 2.239 2.188 2.396 . 0 0 "[ . 1 . 2]" 1
1329 1 91 VAL H 1 91 VAL MG1 1.800 . 5.000 3.185 3.085 3.254 . 0 0 "[ . 1 . 2]" 1
1330 1 91 VAL H 1 91 VAL MG2 1.800 . 5.000 2.183 1.973 2.286 . 0 0 "[ . 1 . 2]" 1
1331 1 91 VAL H 1 91 VAL QG 1.800 . 4.000 2.146 1.955 2.236 . 0 0 "[ . 1 . 2]" 1
1332 1 91 VAL QG 1 92 VAL H 1.800 . 5.000 3.093 3.060 3.158 . 0 0 "[ . 1 . 2]" 1
1333 1 91 VAL H 1 92 VAL H 1.800 . 5.000 4.444 4.425 4.461 . 0 0 "[ . 1 . 2]" 1
1334 1 91 VAL HA 1 91 VAL MG1 1.800 . 5.000 2.288 2.190 2.345 . 0 0 "[ . 1 . 2]" 1
1335 1 91 VAL HA 1 91 VAL MG2 1.800 . 5.000 3.199 3.187 3.210 . 0 0 "[ . 1 . 2]" 1
1336 1 91 VAL HA 1 91 VAL QG 1.800 . 4.000 2.241 2.155 2.290 . 0 0 "[ . 1 . 2]" 1
1337 1 92 VAL HA 1 93 TYR H 1.800 . 3.000 2.213 2.178 2.284 . 0 0 "[ . 1 . 2]" 1
1338 1 92 VAL HB 1 93 TYR H 1.800 . 5.000 3.553 2.737 4.120 . 0 0 "[ . 1 . 2]" 1
1339 1 92 VAL H 1 92 VAL QG 1.800 . 4.000 2.406 2.023 2.829 . 0 0 "[ . 1 . 2]" 1
1340 1 92 VAL QG 1 93 TYR H 1.800 . 4.000 2.822 2.123 3.508 . 0 0 "[ . 1 . 2]" 1
1341 1 92 VAL H 1 93 TYR HA 1.800 . 5.000 4.868 4.769 4.958 . 0 0 "[ . 1 . 2]" 1
1342 1 92 VAL H 1 93 TYR H 1.800 . 6.000 4.361 4.291 4.438 . 0 0 "[ . 1 . 2]" 1
1343 1 92 VAL HA 1 92 VAL MG1 1.800 . 5.000 2.384 2.175 3.215 . 0 0 "[ . 1 . 2]" 1
1344 1 92 VAL HA 1 92 VAL MG2 1.800 . 5.000 2.782 2.275 3.215 . 0 0 "[ . 1 . 2]" 1
1345 1 92 VAL HA 1 92 VAL QG 1.800 . 4.000 2.178 2.071 2.287 . 0 0 "[ . 1 . 2]" 1
1346 1 93 TYR HA 1 94 VAL H 1.800 . 3.000 2.152 2.141 2.175 . 0 0 "[ . 1 . 2]" 1
1347 1 93 TYR H 1 93 TYR HB3 1.800 . 4.000 3.000 2.925 3.166 . 0 0 "[ . 1 . 2]" 1
1348 1 93 TYR H 1 93 TYR HB2 1.800 . 4.000 2.189 2.125 2.270 . 0 0 "[ . 1 . 2]" 1
1349 1 93 TYR H 1 93 TYR QB 1.800 . 3.000 2.138 2.094 2.201 . 0 0 "[ . 1 . 2]" 1
1350 1 93 TYR H 1 93 TYR QD 1.800 . 5.000 4.095 3.989 4.163 . 0 0 "[ . 1 . 2]" 1
1351 1 93 TYR H 1 94 VAL H 1.800 . 5.000 4.508 4.454 4.561 . 0 0 "[ . 1 . 2]" 1
1352 1 93 TYR HA 1 93 TYR QD 1.800 . 5.000 2.404 2.236 2.642 . 0 0 "[ . 1 . 2]" 1
1353 1 93 TYR QD 1 95 ALA HA 1.800 . 6.000 5.028 4.430 5.572 . 0 0 "[ . 1 . 2]" 1
1354 1 93 TYR QD 1 95 ALA MB 1.800 . 6.000 3.924 3.287 4.922 . 0 0 "[ . 1 . 2]" 1
1355 1 94 VAL H 1 94 VAL QG 1.800 . 4.000 2.271 1.963 2.680 . 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 54
_Distance_constraint_stats_list.Viol_count 57
_Distance_constraint_stats_list.Viol_total 18.614
_Distance_constraint_stats_list.Viol_max 0.045
_Distance_constraint_stats_list.Viol_rms 0.0046
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0009
_Distance_constraint_stats_list.Viol_average_violations_only 0.0163
_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 11 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 LEU 0.013 0.007 4 0 "[ . 1 . 2]"
1 18 GLU 0.204 0.022 1 0 "[ . 1 . 2]"
1 21 GLU 0.204 0.022 1 0 "[ . 1 . 2]"
1 26 SER 0.088 0.022 15 0 "[ . 1 . 2]"
1 28 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 ILE 0.467 0.045 9 0 "[ . 1 . 2]"
1 40 SER 0.014 0.013 13 0 "[ . 1 . 2]"
1 41 GLU 0.075 0.022 15 0 "[ . 1 . 2]"
1 53 GLY 0.018 0.018 12 0 "[ . 1 . 2]"
1 55 HIS 0.018 0.018 12 0 "[ . 1 . 2]"
1 57 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 ASP 0.467 0.045 9 0 "[ . 1 . 2]"
1 59 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 ALA 0.057 0.016 10 0 "[ . 1 . 2]"
1 63 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 THR 0.084 0.038 9 0 "[ . 1 . 2]"
1 79 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 81 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 82 GLN 0.084 0.038 9 0 "[ . 1 . 2]"
1 87 ILE 0.013 0.007 4 0 "[ . 1 . 2]"
1 89 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 GLU 0.057 0.016 10 0 "[ . 1 . 2]"
1 91 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 VAL 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 13 VAL H 1 89 PHE O 2.000 . 2.500 2.147 1.801 2.457 . 0 0 "[ . 1 . 2]" 2
2 1 13 VAL N 1 89 PHE O 3.000 2.500 3.500 3.068 2.741 3.396 . 0 0 "[ . 1 . 2]" 2
3 1 15 LEU H 1 87 ILE O 2.000 . 2.500 1.921 1.714 2.218 . 0 0 "[ . 1 . 2]" 2
4 1 15 LEU N 1 87 ILE O 3.000 2.500 3.500 2.845 2.657 3.166 . 0 0 "[ . 1 . 2]" 2
5 1 18 GLU O 1 21 GLU H 1.800 . 2.400 2.402 2.327 2.422 0.022 1 0 "[ . 1 . 2]" 2
6 1 18 GLU O 1 21 GLU N 2.700 2.400 3.300 3.027 2.953 3.075 . 0 0 "[ . 1 . 2]" 2
7 1 26 SER H 1 41 GLU O 2.000 . 2.500 1.853 1.708 2.169 . 0 0 "[ . 1 . 2]" 2
8 1 26 SER N 1 41 GLU O 3.000 2.500 3.500 2.808 2.653 3.144 . 0 0 "[ . 1 . 2]" 2
9 1 28 THR H 1 38 LEU O 2.000 . 2.500 1.982 1.753 2.374 . 0 0 "[ . 1 . 2]" 2
10 1 28 THR N 1 38 LEU O 3.000 2.500 3.500 2.934 2.705 3.332 . 0 0 "[ . 1 . 2]" 2
11 1 28 THR O 1 38 LEU H 2.000 . 2.500 2.155 1.792 2.447 . 0 0 "[ . 1 . 2]" 2
12 1 28 THR O 1 38 LEU N 3.000 2.500 3.500 3.108 2.751 3.414 . 0 0 "[ . 1 . 2]" 2
13 1 39 ILE H 1 58 ASP O 2.000 . 2.500 1.753 1.706 1.803 . 0 0 "[ . 1 . 2]" 2
14 1 39 ILE N 1 58 ASP O 3.000 2.500 3.500 2.681 2.624 2.737 . 0 0 "[ . 1 . 2]" 2
15 1 26 SER O 1 40 SER H 2.000 . 2.500 2.319 2.126 2.513 0.013 13 0 "[ . 1 . 2]" 2
16 1 26 SER O 1 40 SER N 3.000 2.500 3.500 3.198 2.953 3.426 . 0 0 "[ . 1 . 2]" 2
17 1 26 SER O 1 41 GLU H 2.000 . 2.500 2.490 2.447 2.522 0.022 15 0 "[ . 1 . 2]" 2
18 1 26 SER O 1 41 GLU N 3.000 2.500 3.500 3.426 3.380 3.480 . 0 0 "[ . 1 . 2]" 2
19 1 53 GLY O 1 55 HIS H 2.000 . 2.700 2.357 1.957 2.718 0.018 12 0 "[ . 1 . 2]" 2
20 1 53 GLY O 1 55 HIS N 3.000 2.400 3.700 2.825 2.728 3.031 . 0 0 "[ . 1 . 2]" 2
21 1 39 ILE O 1 57 GLY H 2.000 . 2.500 1.892 1.740 2.236 . 0 0 "[ . 1 . 2]" 2
22 1 39 ILE O 1 57 GLY N 3.000 2.500 3.500 2.789 2.676 3.044 . 0 0 "[ . 1 . 2]" 2
23 1 39 ILE O 1 58 ASP H 2.000 . 2.500 2.522 2.479 2.545 0.045 9 0 "[ . 1 . 2]" 2
24 1 39 ILE O 1 58 ASP N 3.000 2.500 3.500 3.436 3.394 3.471 . 0 0 "[ . 1 . 2]" 2
25 1 59 ALA H 1 92 VAL O 2.000 . 2.500 2.096 1.725 2.372 . 0 0 "[ . 1 . 2]" 2
26 1 59 ALA N 1 92 VAL O 3.000 2.500 3.500 3.055 2.706 3.354 . 0 0 "[ . 1 . 2]" 2
27 1 37 ILE O 1 60 ILE H 2.000 . 2.500 2.025 1.811 2.346 . 0 0 "[ . 1 . 2]" 2
28 1 37 ILE O 1 60 ILE N 3.000 2.500 3.500 2.963 2.763 3.224 . 0 0 "[ . 1 . 2]" 2
29 1 61 LEU H 1 90 GLU O 2.000 . 2.500 2.109 1.880 2.290 . 0 0 "[ . 1 . 2]" 2
30 1 61 LEU N 1 90 GLU O 3.000 2.500 3.500 2.991 2.784 3.179 . 0 0 "[ . 1 . 2]" 2
31 1 62 ALA H 1 90 GLU O 2.000 . 2.500 2.486 2.416 2.516 0.016 10 0 "[ . 1 . 2]" 2
32 1 62 ALA N 1 90 GLU O 3.000 2.500 3.500 3.432 3.348 3.470 . 0 0 "[ . 1 . 2]" 2
33 1 63 VAL H 1 66 VAL O 2.000 . 2.500 1.834 1.700 2.259 . 0 0 "[ . 1 . 2]" 2
34 1 63 VAL N 1 66 VAL O 3.000 2.500 3.500 2.790 2.665 3.179 . 0 0 "[ . 1 . 2]" 2
35 1 63 VAL O 1 66 VAL H 2.000 . 2.500 1.986 1.873 2.067 . 0 0 "[ . 1 . 2]" 2
36 1 63 VAL O 1 66 VAL N 3.000 2.500 3.500 2.877 2.780 2.951 . 0 0 "[ . 1 . 2]" 2
37 1 15 LEU O 1 87 ILE H 2.000 . 2.500 2.310 1.758 2.507 0.007 4 0 "[ . 1 . 2]" 2
38 1 15 LEU O 1 87 ILE N 3.000 2.500 3.500 3.101 2.697 3.360 . 0 0 "[ . 1 . 2]" 2
39 1 13 VAL O 1 89 PHE H 2.000 . 2.500 2.077 1.742 2.340 . 0 0 "[ . 1 . 2]" 2
40 1 13 VAL O 1 89 PHE N 3.000 2.500 3.500 2.958 2.658 3.221 . 0 0 "[ . 1 . 2]" 2
41 1 62 ALA O 1 90 GLU H 2.000 . 2.500 2.031 1.850 2.145 . 0 0 "[ . 1 . 2]" 2
42 1 62 ALA O 1 90 GLU N 3.000 2.500 3.500 2.884 2.774 3.005 . 0 0 "[ . 1 . 2]" 2
43 1 11 ARG O 1 91 VAL H 2.000 . 2.500 2.373 2.123 2.489 . 0 0 "[ . 1 . 2]" 2
44 1 11 ARG O 1 91 VAL N 3.000 2.500 3.500 3.303 3.072 3.435 . 0 0 "[ . 1 . 2]" 2
45 1 59 ALA O 1 92 VAL H 2.000 . 2.500 2.115 1.760 2.498 . 0 0 "[ . 1 . 2]" 2
46 1 59 ALA O 1 92 VAL N 3.000 2.500 3.500 2.979 2.682 3.328 . 0 0 "[ . 1 . 2]" 2
47 1 75 GLU O 1 79 ILE H 1.800 . 2.400 2.235 2.025 2.375 . 0 0 "[ . 1 . 2]" 2
48 1 75 GLU O 1 79 ILE N 2.700 2.400 3.300 3.180 2.991 3.292 . 0 0 "[ . 1 . 2]" 2
49 1 76 ALA O 1 80 LEU H 1.800 . 2.400 1.975 1.822 2.268 . 0 0 "[ . 1 . 2]" 2
50 1 76 ALA O 1 80 LEU N 2.700 2.400 3.300 2.919 2.773 3.209 . 0 0 "[ . 1 . 2]" 2
51 1 77 VAL O 1 81 SER H 1.800 . 2.400 2.291 2.198 2.368 . 0 0 "[ . 1 . 2]" 2
52 1 77 VAL O 1 81 SER N 2.700 2.400 3.300 3.176 3.075 3.257 . 0 0 "[ . 1 . 2]" 2
53 1 78 THR O 1 82 GLN H 1.800 . 2.400 2.348 2.075 2.438 0.038 9 0 "[ . 1 . 2]" 2
54 1 78 THR O 1 82 GLN N 2.700 2.400 3.300 3.140 2.917 3.262 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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