NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
431697 |
2jqo   |
15288 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2jqo
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 946
_Distance_constraint_stats_list.Viol_count 582
_Distance_constraint_stats_list.Viol_total 267.426
_Distance_constraint_stats_list.Viol_max 0.135
_Distance_constraint_stats_list.Viol_rms 0.0054
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0007
_Distance_constraint_stats_list.Viol_average_violations_only 0.0230
_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 10 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 LYS 0.008 0.008 17 0 "[ . 1 . 2]"
1 13 MET 0.813 0.078 13 0 "[ . 1 . 2]"
1 14 GLN 0.063 0.045 12 0 "[ . 1 . 2]"
1 15 SER 0.025 0.011 19 0 "[ . 1 . 2]"
1 16 LEU 0.848 0.088 2 0 "[ . 1 . 2]"
1 17 VAL 0.086 0.050 20 0 "[ . 1 . 2]"
1 18 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 19 TYR 0.306 0.078 5 0 "[ . 1 . 2]"
1 20 VAL 0.766 0.082 4 0 "[ . 1 . 2]"
1 21 VAL 0.047 0.030 15 0 "[ . 1 . 2]"
1 22 LEU 0.249 0.050 10 0 "[ . 1 . 2]"
1 23 LYS 0.275 0.050 3 0 "[ . 1 . 2]"
1 24 ASP 0.361 0.059 1 0 "[ . 1 . 2]"
1 25 ASN 0.234 0.059 1 0 "[ . 1 . 2]"
1 26 GLU 0.087 0.037 6 0 "[ . 1 . 2]"
1 27 ARG 0.050 0.019 18 0 "[ . 1 . 2]"
1 28 ALA 0.290 0.042 4 0 "[ . 1 . 2]"
1 29 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 LEU 0.045 0.019 9 0 "[ . 1 . 2]"
1 31 ILE 1.292 0.119 16 0 "[ . 1 . 2]"
1 32 THR 0.044 0.015 8 0 "[ . 1 . 2]"
1 33 ASP 0.610 0.077 15 0 "[ . 1 . 2]"
1 34 THR 1.445 0.119 16 0 "[ . 1 . 2]"
1 35 LYS 0.457 0.135 15 0 "[ . 1 . 2]"
1 36 ALA 0.325 0.135 15 0 "[ . 1 . 2]"
1 37 PRO 0.163 0.034 4 0 "[ . 1 . 2]"
1 38 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 LYS 0.116 0.046 3 0 "[ . 1 . 2]"
1 40 GLU 0.091 0.046 3 0 "[ . 1 . 2]"
1 41 ASP 0.045 0.024 11 0 "[ . 1 . 2]"
1 42 TYR 0.211 0.045 19 0 "[ . 1 . 2]"
1 43 ASN 0.012 0.012 6 0 "[ . 1 . 2]"
1 44 LEU 0.077 0.026 1 0 "[ . 1 . 2]"
1 45 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 GLU 0.609 0.080 10 0 "[ . 1 . 2]"
1 47 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 GLN 0.050 0.025 8 0 "[ . 1 . 2]"
1 49 LEU 0.302 0.062 10 0 "[ . 1 . 2]"
1 50 MET 0.281 0.080 10 0 "[ . 1 . 2]"
1 51 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 LYS 0.032 0.032 7 0 "[ . 1 . 2]"
1 53 PHE 0.102 0.022 18 0 "[ . 1 . 2]"
1 54 LYS 0.505 0.077 14 0 "[ . 1 . 2]"
1 55 ASN 0.474 0.077 14 0 "[ . 1 . 2]"
1 56 ASN 0.307 0.077 15 0 "[ . 1 . 2]"
1 57 ILE 0.291 0.063 16 0 "[ . 1 . 2]"
1 58 VAL 0.764 0.064 11 0 "[ . 1 . 2]"
1 59 ILE 0.050 0.019 18 0 "[ . 1 . 2]"
1 60 VAL 0.030 0.012 6 0 "[ . 1 . 2]"
1 61 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 LEU 0.734 0.049 18 0 "[ . 1 . 2]"
1 63 SER 0.003 0.003 8 0 "[ . 1 . 2]"
1 64 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 65 ILE 0.202 0.049 18 0 "[ . 1 . 2]"
1 66 ASP 0.038 0.024 16 0 "[ . 1 . 2]"
1 67 ASN 0.590 0.100 16 0 "[ . 1 . 2]"
1 68 THR 0.708 0.041 19 0 "[ . 1 . 2]"
1 69 ASP 0.571 0.100 16 0 "[ . 1 . 2]"
1 70 ASP 0.189 0.031 6 0 "[ . 1 . 2]"
1 71 LEU 0.885 0.048 3 0 "[ . 1 . 2]"
1 72 LYS 0.529 0.076 2 0 "[ . 1 . 2]"
1 73 ARG 0.331 0.053 8 0 "[ . 1 . 2]"
1 74 GLY 0.007 0.007 16 0 "[ . 1 . 2]"
1 75 GLU 0.230 0.083 6 0 "[ . 1 . 2]"
1 76 LYS 0.163 0.050 20 0 "[ . 1 . 2]"
1 77 ILE 0.233 0.034 3 0 "[ . 1 . 2]"
1 78 LYS 0.398 0.078 14 0 "[ . 1 . 2]"
1 79 VAL 0.558 0.088 2 0 "[ . 1 . 2]"
1 80 TRP 1.246 0.078 13 0 "[ . 1 . 2]"
1 81 PHE 1.039 0.064 11 0 "[ . 1 . 2]"
1 82 HIS 0.148 0.024 7 0 "[ . 1 . 2]"
1 83 THR 0.129 0.024 7 0 "[ . 1 . 2]"
1 84 ARG 0.223 0.046 15 0 "[ . 1 . 2]"
1 85 LYS 0.386 0.050 7 0 "[ . 1 . 2]"
1 86 GLU 0.075 0.042 11 0 "[ . 1 . 2]"
1 87 SER 0.330 0.050 7 0 "[ . 1 . 2]"
1 88 ASN 0.000 0.000 17 0 "[ . 1 . 2]"
1 89 PRO 0.023 0.023 5 0 "[ . 1 . 2]"
1 90 PRO 0.141 0.046 15 0 "[ . 1 . 2]"
1 91 SER 0.122 0.038 14 0 "[ . 1 . 2]"
1 92 ALA 0.088 0.023 4 0 "[ . 1 . 2]"
1 93 THR 0.078 0.038 2 0 "[ . 1 . 2]"
1 94 ILE 0.257 0.032 14 0 "[ . 1 . 2]"
1 95 GLN 0.098 0.038 2 0 "[ . 1 . 2]"
1 96 LYS 0.203 0.064 11 0 "[ . 1 . 2]"
1 97 TYR 0.931 0.082 4 0 "[ . 1 . 2]"
1 98 GLU 0.070 0.034 3 0 "[ . 1 . 2]"
1 99 LEU 0.566 0.083 6 0 "[ . 1 . 2]"
1 100 LEU 0.039 0.028 5 0 "[ . 1 . 2]"
1 101 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 GLU 0.004 0.004 5 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 10 GLU H 1 11 THR H 1.800 . 3.200 2.499 1.802 3.007 . 0 0 "[ . 1 . 2]" 1
2 1 12 LYS H 1 13 MET H 1.800 . 5.000 4.253 2.531 4.574 . 0 0 "[ . 1 . 2]" 1
3 1 14 GLN H 1 15 SER H 1.800 . 5.000 4.463 4.395 4.580 . 0 0 "[ . 1 . 2]" 1
4 1 21 VAL H 1 22 LEU H 1.800 . 3.200 2.208 1.922 2.416 . 0 0 "[ . 1 . 2]" 1
5 1 23 LYS H 1 24 ASP H 1.800 . 5.000 4.266 4.089 4.441 . 0 0 "[ . 1 . 2]" 1
6 1 25 ASN H 1 26 GLU H 1.800 . 5.000 2.739 2.035 4.301 . 0 0 "[ . 1 . 2]" 1
7 1 29 ILE H 1 30 LEU H 1.800 . 5.000 4.272 4.194 4.338 . 0 0 "[ . 1 . 2]" 1
8 1 30 LEU H 1 31 ILE H 1.800 . 5.000 4.468 4.428 4.515 . 0 0 "[ . 1 . 2]" 1
9 1 32 THR H 1 33 ASP H 1.800 . 5.000 3.080 2.227 4.460 . 0 0 "[ . 1 . 2]" 1
10 1 33 ASP H 1 34 THR H 1.800 . 5.000 4.145 2.783 4.620 . 0 0 "[ . 1 . 2]" 1
11 1 34 THR H 1 35 LYS H 1.800 . 4.800 2.577 1.862 4.062 . 0 0 "[ . 1 . 2]" 1
12 1 35 LYS H 1 36 ALA H 1.800 . 5.000 3.802 2.549 4.587 . 0 0 "[ . 1 . 2]" 1
13 1 38 GLY H 1 39 LYS H 1.800 . 5.000 4.454 4.172 4.579 . 0 0 "[ . 1 . 2]" 1
14 1 39 LYS H 1 40 GLU H 1.800 . 3.200 2.688 2.496 2.984 . 0 0 "[ . 1 . 2]" 1
15 1 40 GLU H 1 41 ASP H 1.800 . 3.200 2.563 2.375 2.717 . 0 0 "[ . 1 . 2]" 1
16 1 41 ASP H 1 42 TYR H 1.800 . 3.200 2.568 2.354 2.727 . 0 0 "[ . 1 . 2]" 1
17 1 42 TYR H 1 43 ASN H 1.800 . 3.200 2.516 2.413 2.615 . 0 0 "[ . 1 . 2]" 1
18 1 43 ASN H 1 44 LEU H 1.800 . 3.200 2.225 2.015 2.427 . 0 0 "[ . 1 . 2]" 1
19 1 45 SER H 1 46 GLU H 1.800 . 5.000 4.552 4.434 4.633 . 0 0 "[ . 1 . 2]" 1
20 1 46 GLU H 1 47 GLY H 1.800 . 3.200 2.885 2.719 3.001 . 0 0 "[ . 1 . 2]" 1
21 1 47 GLY H 1 48 GLN H 1.800 . 3.200 2.744 2.644 2.860 . 0 0 "[ . 1 . 2]" 1
22 1 48 GLN H 1 49 LEU H 1.800 . 3.200 2.621 2.513 2.712 . 0 0 "[ . 1 . 2]" 1
23 1 49 LEU H 1 50 MET H 1.800 . 3.200 2.593 2.431 2.720 . 0 0 "[ . 1 . 2]" 1
24 1 50 MET H 1 51 ASN H 1.800 . 3.200 2.634 2.497 2.853 . 0 0 "[ . 1 . 2]" 1
25 1 51 ASN H 1 52 LYS H 1.800 . 3.200 2.410 2.262 2.592 . 0 0 "[ . 1 . 2]" 1
26 1 52 LYS H 1 53 PHE H 1.800 . 3.200 2.521 2.112 2.725 . 0 0 "[ . 1 . 2]" 1
27 1 53 PHE H 1 54 LYS H 1.800 . 3.200 3.033 2.733 3.222 0.022 18 0 "[ . 1 . 2]" 1
28 1 55 ASN H 1 56 ASN H 1.800 . 5.000 2.549 2.206 3.314 . 0 0 "[ . 1 . 2]" 1
29 1 56 ASN H 1 57 ILE H 1.800 . 3.200 2.197 1.893 2.502 . 0 0 "[ . 1 . 2]" 1
30 1 62 LEU H 1 63 SER H 1.800 . 3.200 2.548 2.178 3.203 0.003 8 0 "[ . 1 . 2]" 1
31 1 63 SER H 1 64 GLU H 1.800 . 3.200 2.707 2.623 2.829 . 0 0 "[ . 1 . 2]" 1
32 1 64 GLU H 1 65 ILE H 1.800 . 3.200 2.403 2.159 2.585 . 0 0 "[ . 1 . 2]" 1
33 1 66 ASP H 1 67 ASN H 1.800 . 3.200 2.645 2.223 3.224 0.024 16 0 "[ . 1 . 2]" 1
34 1 67 ASN H 1 68 THR H 1.800 . 5.000 3.147 2.245 4.412 . 0 0 "[ . 1 . 2]" 1
35 1 68 THR H 1 69 ASP H 1.800 . 3.200 2.671 2.206 3.235 0.035 18 0 "[ . 1 . 2]" 1
36 1 69 ASP H 1 70 ASP H 1.800 . 3.200 2.493 2.209 2.787 . 0 0 "[ . 1 . 2]" 1
37 1 70 ASP H 1 71 LEU H 1.800 . 2.700 2.456 2.282 2.576 . 0 0 "[ . 1 . 2]" 1
38 1 72 LYS H 1 73 ARG H 1.800 . 5.000 4.465 4.377 4.528 . 0 0 "[ . 1 . 2]" 1
39 1 73 ARG H 1 74 GLY H 1.800 . 5.000 4.416 3.497 4.631 . 0 0 "[ . 1 . 2]" 1
40 1 74 GLY H 1 75 GLU H 1.800 . 3.200 2.229 1.990 2.519 . 0 0 "[ . 1 . 2]" 1
41 1 75 GLU H 1 76 LYS H 1.800 . 5.000 4.418 4.286 4.565 . 0 0 "[ . 1 . 2]" 1
42 1 81 PHE H 1 82 HIS H 1.800 . 5.000 4.435 4.367 4.521 . 0 0 "[ . 1 . 2]" 1
43 1 82 HIS H 1 83 THR H 1.800 . 3.200 2.027 1.778 2.349 0.022 13 0 "[ . 1 . 2]" 1
44 1 84 ARG H 1 85 LYS H 1.800 . 5.000 4.389 4.246 4.521 . 0 0 "[ . 1 . 2]" 1
45 1 86 GLU H 1 87 SER H 1.800 . 5.000 3.825 3.125 4.319 . 0 0 "[ . 1 . 2]" 1
46 1 87 SER H 1 88 ASN H 1.800 . 5.000 2.379 1.934 4.345 . 0 0 "[ . 1 . 2]" 1
47 1 95 GLN H 1 96 LYS H 1.800 . 3.200 2.056 1.879 2.210 . 0 0 "[ . 1 . 2]" 1
48 1 100 LEU H 1 101 LEU H 1.800 . 5.000 4.191 3.766 4.526 . 0 0 "[ . 1 . 2]" 1
49 1 67 ASN H 1 69 ASP H 1.800 . 5.000 4.950 4.586 5.100 0.100 16 0 "[ . 1 . 2]" 1
50 1 12 LYS HA 1 13 MET H 1.800 . 2.900 2.187 2.094 2.908 0.008 17 0 "[ . 1 . 2]" 1
51 1 13 MET HA 1 14 GLN H 1.800 . 2.700 2.260 2.129 2.532 . 0 0 "[ . 1 . 2]" 1
52 1 14 GLN HA 1 15 SER H 1.800 . 2.700 2.149 2.100 2.418 . 0 0 "[ . 1 . 2]" 1
53 1 15 SER HA 1 16 LEU H 1.800 . 2.700 2.152 2.120 2.220 . 0 0 "[ . 1 . 2]" 1
54 1 16 LEU HA 1 17 VAL H 1.800 . 2.700 2.187 2.130 2.385 . 0 0 "[ . 1 . 2]" 1
55 1 17 VAL HA 1 18 GLY H 1.800 . 2.700 2.178 2.147 2.245 . 0 0 "[ . 1 . 2]" 1
56 1 19 TYR HA 1 20 VAL H 1.800 . 2.700 2.157 2.122 2.265 . 0 0 "[ . 1 . 2]" 1
57 1 20 VAL HA 1 21 VAL H 1.800 . 3.500 2.191 2.146 2.260 . 0 0 "[ . 1 . 2]" 1
58 1 22 LEU HA 1 23 LYS H 1.800 . 2.700 2.222 2.111 2.382 . 0 0 "[ . 1 . 2]" 1
59 1 23 LYS HA 1 24 ASP H 1.800 . 3.500 2.159 2.088 2.379 . 0 0 "[ . 1 . 2]" 1
60 1 24 ASP HA 1 25 ASN H 1.800 . 3.500 3.013 2.473 3.537 0.037 5 0 "[ . 1 . 2]" 1
61 1 27 ARG HA 1 28 ALA H 1.800 . 2.700 2.286 2.103 2.510 . 0 0 "[ . 1 . 2]" 1
62 1 28 ALA HA 1 29 ILE H 1.800 . 2.700 2.182 2.111 2.327 . 0 0 "[ . 1 . 2]" 1
63 1 29 ILE HA 1 30 LEU H 1.800 . 2.700 2.124 2.082 2.164 . 0 0 "[ . 1 . 2]" 1
64 1 30 LEU HA 1 31 ILE H 1.800 . 2.700 2.222 2.173 2.328 . 0 0 "[ . 1 . 2]" 1
65 1 31 ILE HA 1 32 THR H 1.800 . 2.700 2.160 2.114 2.310 . 0 0 "[ . 1 . 2]" 1
66 1 33 ASP HA 1 34 THR H 1.800 . 2.700 2.422 2.125 2.758 0.058 5 0 "[ . 1 . 2]" 1
67 1 35 LYS HA 1 36 ALA H 1.800 . 2.700 2.382 2.123 2.835 0.135 15 0 "[ . 1 . 2]" 1
68 1 38 GLY HA3 1 39 LYS H 1.800 . 3.500 2.588 2.316 2.922 . 0 0 "[ . 1 . 2]" 1
69 1 38 GLY HA2 1 39 LYS H 1.800 . 3.500 2.522 2.244 2.763 . 0 0 "[ . 1 . 2]" 1
70 1 54 LYS HA 1 55 ASN H 1.800 . 3.500 2.954 2.077 3.554 0.054 19 0 "[ . 1 . 2]" 1
71 1 57 ILE HA 1 58 VAL H 1.800 . 2.700 2.176 2.113 2.270 . 0 0 "[ . 1 . 2]" 1
72 1 58 VAL HA 1 59 ILE H 1.800 . 2.700 2.143 2.123 2.195 . 0 0 "[ . 1 . 2]" 1
73 1 59 ILE HA 1 60 VAL H 1.800 . 2.700 2.177 2.145 2.241 . 0 0 "[ . 1 . 2]" 1
74 1 60 VAL HA 1 61 GLY H 1.800 . 2.700 2.199 2.119 2.302 . 0 0 "[ . 1 . 2]" 1
75 1 65 ILE HA 1 66 ASP H 1.800 . 3.500 2.242 2.123 3.514 0.014 16 0 "[ . 1 . 2]" 1
76 1 67 ASN HA 1 68 THR H 1.800 . 3.500 2.644 2.142 3.114 . 0 0 "[ . 1 . 2]" 1
77 1 71 LEU HA 1 72 LYS H 1.800 . 2.700 2.186 2.121 2.381 . 0 0 "[ . 1 . 2]" 1
78 1 72 LYS HA 1 73 ARG H 1.800 . 2.700 2.450 2.170 2.696 . 0 0 "[ . 1 . 2]" 1
79 1 73 ARG HA 1 74 GLY H 1.800 . 2.700 2.215 2.118 2.541 . 0 0 "[ . 1 . 2]" 1
80 1 75 GLU HA 1 76 LYS H 1.800 . 3.500 2.567 2.330 2.780 . 0 0 "[ . 1 . 2]" 1
81 1 76 LYS HA 1 77 ILE H 1.800 . 2.700 2.214 2.142 2.264 . 0 0 "[ . 1 . 2]" 1
82 1 77 ILE HA 1 78 LYS H 1.800 . 2.700 2.265 2.150 2.402 . 0 0 "[ . 1 . 2]" 1
83 1 78 LYS HA 1 79 VAL H 1.800 . 2.700 2.186 2.149 2.220 . 0 0 "[ . 1 . 2]" 1
84 1 79 VAL HA 1 80 TRP H 1.800 . 2.700 2.251 2.135 2.304 . 0 0 "[ . 1 . 2]" 1
85 1 80 TRP HA 1 81 PHE H 1.800 . 2.700 2.153 2.111 2.201 . 0 0 "[ . 1 . 2]" 1
86 1 81 PHE HA 1 82 HIS H 1.800 . 2.700 2.404 2.128 2.573 . 0 0 "[ . 1 . 2]" 1
87 1 83 THR HA 1 84 ARG H 1.800 . 3.500 2.246 2.131 2.617 . 0 0 "[ . 1 . 2]" 1
88 1 84 ARG HA 1 85 LYS H 1.800 . 2.700 2.194 2.099 2.391 . 0 0 "[ . 1 . 2]" 1
89 1 85 LYS HA 1 86 GLU H 1.800 . 2.700 2.168 2.110 2.260 . 0 0 "[ . 1 . 2]" 1
90 1 86 GLU HA 1 87 SER H 1.800 . 2.700 2.362 2.112 2.742 0.042 11 0 "[ . 1 . 2]" 1
91 1 87 SER HA 1 88 ASN H 1.800 . 3.500 3.332 2.513 3.500 0.000 17 0 "[ . 1 . 2]" 1
92 1 90 PRO HA 1 91 SER H 1.800 . 3.500 2.176 2.136 2.253 . 0 0 "[ . 1 . 2]" 1
93 1 91 SER HA 1 92 ALA H 1.800 . 2.700 2.306 2.151 2.444 . 0 0 "[ . 1 . 2]" 1
94 1 92 ALA HA 1 93 THR H 1.800 . 2.700 2.192 2.138 2.502 . 0 0 "[ . 1 . 2]" 1
95 1 93 THR HA 1 94 ILE H 1.800 . 2.700 2.170 2.140 2.210 . 0 0 "[ . 1 . 2]" 1
96 1 94 ILE HA 1 95 GLN H 1.800 . 2.700 2.219 2.142 2.306 . 0 0 "[ . 1 . 2]" 1
97 1 96 LYS HA 1 97 TYR H 1.800 . 2.700 2.307 2.185 2.488 . 0 0 "[ . 1 . 2]" 1
98 1 97 TYR HA 1 98 GLU H 1.800 . 2.700 2.313 2.213 2.541 . 0 0 "[ . 1 . 2]" 1
99 1 98 GLU HA 1 99 LEU H 1.800 . 2.700 2.154 2.109 2.267 . 0 0 "[ . 1 . 2]" 1
100 1 99 LEU HA 1 100 LEU H 1.800 . 2.700 2.156 2.114 2.226 . 0 0 "[ . 1 . 2]" 1
101 1 100 LEU HA 1 101 LEU H 1.800 . 2.900 2.234 2.079 2.705 . 0 0 "[ . 1 . 2]" 1
102 1 20 VAL HA 1 22 LEU H 1.800 . 5.000 3.826 3.560 4.310 . 0 0 "[ . 1 . 2]" 1
103 1 33 ASP HA 1 35 LYS H 1.800 . 5.000 3.973 3.025 5.026 0.026 8 0 "[ . 1 . 2]" 1
104 1 38 GLY QA 1 40 GLU H 1.800 . 5.000 3.345 3.002 3.894 . 0 0 "[ . 1 . 2]" 1
105 1 39 LYS HA 1 41 ASP H 1.800 . 5.000 4.194 3.934 4.402 . 0 0 "[ . 1 . 2]" 1
106 1 40 GLU HA 1 42 TYR H 1.800 . 5.000 4.270 4.055 4.649 . 0 0 "[ . 1 . 2]" 1
107 1 41 ASP HA 1 43 ASN H 1.800 . 5.000 3.746 3.550 3.935 . 0 0 "[ . 1 . 2]" 1
108 1 42 TYR HA 1 44 LEU H 1.800 . 5.000 3.989 3.865 4.270 . 0 0 "[ . 1 . 2]" 1
109 1 54 LYS HA 1 56 ASN H 1.800 . 5.000 3.906 3.347 4.399 . 0 0 "[ . 1 . 2]" 1
110 1 63 SER HA 1 65 ILE H 1.800 . 5.000 3.946 3.614 4.824 . 0 0 "[ . 1 . 2]" 1
111 1 65 ILE HA 1 67 ASN H 1.800 . 5.000 3.696 3.219 4.993 . 0 0 "[ . 1 . 2]" 1
112 1 67 ASN HA 1 69 ASP H 1.800 . 5.000 3.221 2.690 4.145 . 0 0 "[ . 1 . 2]" 1
113 1 68 THR HA 1 70 ASP H 1.800 . 5.000 3.450 3.177 3.931 . 0 0 "[ . 1 . 2]" 1
114 1 69 ASP HA 1 71 LEU H 1.800 . 5.000 3.682 3.208 4.041 . 0 0 "[ . 1 . 2]" 1
115 1 73 ARG HA 1 75 GLU H 1.800 . 5.000 3.661 3.067 4.149 . 0 0 "[ . 1 . 2]" 1
116 1 81 PHE HA 1 83 THR H 1.800 . 5.000 4.159 3.849 4.594 . 0 0 "[ . 1 . 2]" 1
117 1 94 ILE HA 1 96 LYS H 1.800 . 5.000 3.826 3.502 4.274 . 0 0 "[ . 1 . 2]" 1
118 1 38 GLY QA 1 41 ASP H 1.800 . 5.000 3.386 2.954 3.705 . 0 0 "[ . 1 . 2]" 1
119 1 39 LYS HA 1 42 TYR H 1.800 . 5.000 3.481 2.967 3.975 . 0 0 "[ . 1 . 2]" 1
120 1 40 GLU HA 1 43 ASN H 1.800 . 5.000 3.306 3.001 3.625 . 0 0 "[ . 1 . 2]" 1
121 1 41 ASP HA 1 44 LEU H 1.800 . 5.000 3.211 2.975 3.603 . 0 0 "[ . 1 . 2]" 1
122 1 46 GLU HA 1 49 LEU H 1.800 . 5.000 3.625 3.333 3.863 . 0 0 "[ . 1 . 2]" 1
123 1 47 GLY QA 1 50 MET H 1.800 . 5.000 3.383 3.167 3.687 . 0 0 "[ . 1 . 2]" 1
124 1 48 GLN HA 1 51 ASN H 1.800 . 5.000 3.481 3.171 3.920 . 0 0 "[ . 1 . 2]" 1
125 1 49 LEU HA 1 52 LYS H 1.800 . 5.000 3.395 3.126 3.798 . 0 0 "[ . 1 . 2]" 1
126 1 50 MET HA 1 53 PHE H 1.800 . 5.000 3.876 3.596 4.456 . 0 0 "[ . 1 . 2]" 1
127 1 46 GLU HA 1 50 MET H 1.800 . 5.000 4.012 3.670 4.260 . 0 0 "[ . 1 . 2]" 1
128 1 11 THR HB 1 12 LYS H 1.800 . 5.000 3.901 1.882 4.463 . 0 0 "[ . 1 . 2]" 1
129 1 20 VAL HB 1 21 VAL H 1.800 . 5.000 4.317 4.252 4.421 . 0 0 "[ . 1 . 2]" 1
130 1 21 VAL HB 1 22 LEU H 1.800 . 5.000 3.597 2.172 4.055 . 0 0 "[ . 1 . 2]" 1
131 1 24 ASP QB 1 25 ASN H 1.800 . 3.500 2.649 1.741 3.528 0.059 1 0 "[ . 1 . 2]" 1
132 1 31 ILE HB 1 32 THR H 1.800 . 5.000 4.261 3.638 4.440 . 0 0 "[ . 1 . 2]" 1
133 1 32 THR HB 1 33 ASP H 1.800 . 5.000 3.827 2.662 4.346 . 0 0 "[ . 1 . 2]" 1
134 1 34 THR HB 1 35 LYS H 1.800 . 5.000 4.122 3.516 4.441 . 0 0 "[ . 1 . 2]" 1
135 1 57 ILE HB 1 58 VAL H 1.800 . 5.000 4.200 4.100 4.300 . 0 0 "[ . 1 . 2]" 1
136 1 60 VAL HB 1 61 GLY H 1.800 . 5.000 2.825 2.566 3.182 . 0 0 "[ . 1 . 2]" 1
137 1 65 ILE HB 1 66 ASP H 1.800 . 5.000 4.193 2.529 4.428 . 0 0 "[ . 1 . 2]" 1
138 1 68 THR HB 1 69 ASP H 1.800 . 5.000 4.285 3.994 4.431 . 0 0 "[ . 1 . 2]" 1
139 1 77 ILE HB 1 78 LYS H 1.800 . 5.000 2.513 2.111 2.952 . 0 0 "[ . 1 . 2]" 1
140 1 79 VAL HB 1 80 TRP H 1.800 . 5.000 2.678 2.527 3.026 . 0 0 "[ . 1 . 2]" 1
141 1 83 THR HB 1 84 ARG H 1.800 . 5.000 4.078 3.185 4.357 . 0 0 "[ . 1 . 2]" 1
142 1 94 ILE HB 1 95 GLN H 1.800 . 5.000 2.815 2.574 3.201 . 0 0 "[ . 1 . 2]" 1
143 1 11 THR MG 1 12 LYS H 1.800 . 5.000 3.497 2.536 4.258 . 0 0 "[ . 1 . 2]" 1
144 1 13 MET QG 1 14 GLN H 1.800 . 5.000 4.079 3.683 4.656 . 0 0 "[ . 1 . 2]" 1
145 1 14 GLN QG 1 15 SER H 1.800 . 5.000 3.803 2.529 4.676 . 0 0 "[ . 1 . 2]" 1
146 1 17 VAL MG1 1 18 GLY H 1.800 . 5.000 2.821 2.388 3.954 . 0 0 "[ . 1 . 2]" 1
147 1 20 VAL MG1 1 21 VAL H 1.800 . 5.000 3.232 2.999 3.465 . 0 0 "[ . 1 . 2]" 1
148 1 22 LEU MD1 1 23 LYS H 1.800 . 5.000 4.198 2.358 5.007 0.007 6 0 "[ . 1 . 2]" 1
149 1 22 LEU MD2 1 23 LYS H 1.800 . 5.000 3.697 3.229 4.847 . 0 0 "[ . 1 . 2]" 1
150 1 22 LEU HG 1 23 LYS H 1.800 . 5.000 4.508 2.782 5.021 0.021 2 0 "[ . 1 . 2]" 1
151 1 23 LYS QD 1 24 ASP H 1.800 . 5.000 4.643 2.613 5.025 0.025 4 0 "[ . 1 . 2]" 1
152 1 23 LYS QG 1 24 ASP H 1.800 . 5.000 2.948 2.415 4.079 . 0 0 "[ . 1 . 2]" 1
153 1 26 GLU QG 1 27 ARG H 1.800 . 5.000 4.196 3.743 4.512 . 0 0 "[ . 1 . 2]" 1
154 1 27 ARG QG 1 28 ALA H 1.800 . 5.000 3.903 3.502 4.242 . 0 0 "[ . 1 . 2]" 1
155 1 29 ILE QG 1 30 LEU H 1.800 . 5.000 4.194 4.021 4.341 . 0 0 "[ . 1 . 2]" 1
156 1 29 ILE MG 1 30 LEU H 1.800 . 5.000 3.063 2.903 3.246 . 0 0 "[ . 1 . 2]" 1
157 1 30 LEU MD1 1 31 ILE H 1.800 . 5.000 4.675 2.774 4.930 . 0 0 "[ . 1 . 2]" 1
158 1 31 ILE MG 1 32 THR H 1.800 . 5.000 2.819 2.085 3.142 . 0 0 "[ . 1 . 2]" 1
159 1 34 THR MG 1 35 LYS H 1.800 . 5.000 3.995 2.449 4.390 . 0 0 "[ . 1 . 2]" 1
160 1 35 LYS QG 1 36 ALA H 1.800 . 5.000 3.712 2.259 4.862 . 0 0 "[ . 1 . 2]" 1
161 1 39 LYS QD 1 40 GLU H 1.800 . 5.000 4.495 3.231 5.006 0.006 8 0 "[ . 1 . 2]" 1
162 1 39 LYS QG 1 40 GLU H 1.800 . 5.000 3.680 2.510 4.431 . 0 0 "[ . 1 . 2]" 1
163 1 40 GLU QG 1 41 ASP H 1.800 . 5.000 4.121 3.533 4.737 . 0 0 "[ . 1 . 2]" 1
164 1 44 LEU MD2 1 45 SER H 1.800 . 5.000 3.397 3.210 3.537 . 0 0 "[ . 1 . 2]" 1
165 1 46 GLU QG 1 47 GLY H 1.800 . 5.000 3.526 2.348 4.376 . 0 0 "[ . 1 . 2]" 1
166 1 49 LEU MD1 1 50 MET H 1.800 . 5.000 4.615 4.467 4.746 . 0 0 "[ . 1 . 2]" 1
167 1 49 LEU MD2 1 50 MET H 1.800 . 5.000 4.329 3.455 4.717 . 0 0 "[ . 1 . 2]" 1
168 1 50 MET QG 1 51 ASN H 1.800 . 5.000 4.090 3.625 4.381 . 0 0 "[ . 1 . 2]" 1
169 1 54 LYS QD 1 55 ASN H 1.800 . 5.000 4.828 4.405 5.077 0.077 14 0 "[ . 1 . 2]" 1
170 1 54 LYS QG 1 55 ASN H 1.800 . 5.000 3.497 2.602 4.160 . 0 0 "[ . 1 . 2]" 1
171 1 57 ILE MD 1 58 VAL H 1.800 . 5.000 4.337 4.106 4.638 . 0 0 "[ . 1 . 2]" 1
172 1 57 ILE QG 1 58 VAL H 1.800 . 5.000 2.664 2.427 2.982 . 0 0 "[ . 1 . 2]" 1
173 1 57 ILE MG 1 58 VAL H 1.800 . 5.000 3.955 3.342 4.191 . 0 0 "[ . 1 . 2]" 1
174 1 58 VAL MG1 1 59 ILE H 1.800 . 5.000 2.707 2.429 2.953 . 0 0 "[ . 1 . 2]" 1
175 1 58 VAL MG2 1 59 ILE H 1.800 . 5.000 3.968 3.810 4.127 . 0 0 "[ . 1 . 2]" 1
176 1 59 ILE MG 1 60 VAL H 1.800 . 5.000 3.144 2.884 3.328 . 0 0 "[ . 1 . 2]" 1
177 1 60 VAL MG1 1 61 GLY H 1.800 . 5.000 3.752 3.685 3.838 . 0 0 "[ . 1 . 2]" 1
178 1 65 ILE QG 1 66 ASP H 1.800 . 5.000 4.386 3.774 4.845 . 0 0 "[ . 1 . 2]" 1
179 1 65 ILE MG 1 66 ASP H 1.800 . 5.000 3.058 2.051 3.576 . 0 0 "[ . 1 . 2]" 1
180 1 68 THR MG 1 69 ASP H 1.800 . 5.000 4.335 4.186 4.425 . 0 0 "[ . 1 . 2]" 1
181 1 71 LEU MD1 1 72 LYS H 1.800 . 5.000 3.263 2.463 5.015 0.015 5 0 "[ . 1 . 2]" 1
182 1 71 LEU MD2 1 72 LYS H 1.800 . 5.000 4.359 3.176 5.010 0.010 20 0 "[ . 1 . 2]" 1
183 1 72 LYS QG 1 73 ARG H 1.800 . 5.000 3.710 2.234 4.208 . 0 0 "[ . 1 . 2]" 1
184 1 73 ARG QG 1 74 GLY H 1.800 . 5.000 3.901 2.604 4.527 . 0 0 "[ . 1 . 2]" 1
185 1 75 GLU QG 1 76 LYS H 1.800 . 5.000 3.407 1.765 4.359 0.035 15 0 "[ . 1 . 2]" 1
186 1 76 LYS QG 1 77 ILE H 1.800 . 5.000 3.277 2.569 4.364 . 0 0 "[ . 1 . 2]" 1
187 1 77 ILE MG 1 78 LYS H 1.800 . 5.000 3.562 3.251 3.716 . 0 0 "[ . 1 . 2]" 1
188 1 78 LYS QG 1 79 VAL H 1.800 . 5.000 3.271 3.039 3.415 . 0 0 "[ . 1 . 2]" 1
189 1 79 VAL MG1 1 80 TRP H 1.800 . 5.000 3.723 3.643 3.818 . 0 0 "[ . 1 . 2]" 1
190 1 79 VAL MG2 1 80 TRP H 1.800 . 5.000 3.633 3.322 3.939 . 0 0 "[ . 1 . 2]" 1
191 1 81 PHE QD 1 82 HIS H 1.800 . 5.000 3.482 2.653 4.184 . 0 0 "[ . 1 . 2]" 1
192 1 83 THR MG 1 84 ARG H 1.800 . 5.000 3.214 2.538 4.038 . 0 0 "[ . 1 . 2]" 1
193 1 84 ARG QD 1 85 LYS H 1.800 . 5.000 4.763 4.404 5.035 0.035 7 0 "[ . 1 . 2]" 1
194 1 84 ARG QG 1 85 LYS H 1.800 . 5.000 3.273 2.479 4.104 . 0 0 "[ . 1 . 2]" 1
195 1 85 LYS QG 1 86 GLU H 1.800 . 5.000 3.515 2.581 4.193 . 0 0 "[ . 1 . 2]" 1
196 1 93 THR MG 1 94 ILE H 1.800 . 5.000 2.959 2.569 3.101 . 0 0 "[ . 1 . 2]" 1
197 1 94 ILE MD 1 95 GLN H 1.800 . 5.000 4.577 3.624 4.998 . 0 0 "[ . 1 . 2]" 1
198 1 94 ILE QG 1 95 GLN H 1.800 . 5.000 3.919 3.602 4.406 . 0 0 "[ . 1 . 2]" 1
199 1 94 ILE MG 1 95 GLN H 1.800 . 5.000 3.739 3.627 3.829 . 0 0 "[ . 1 . 2]" 1
200 1 96 LYS HG3 1 97 TYR H 1.800 . 5.000 3.784 2.294 5.029 0.029 14 0 "[ . 1 . 2]" 1
201 1 96 LYS HG2 1 97 TYR H 1.800 . 5.000 3.350 1.792 4.410 0.008 15 0 "[ . 1 . 2]" 1
202 1 97 TYR QD 1 98 GLU H 1.800 . 5.000 3.712 3.035 4.043 . 0 0 "[ . 1 . 2]" 1
203 1 98 GLU QG 1 99 LEU H 1.800 . 5.000 3.412 2.405 4.669 . 0 0 "[ . 1 . 2]" 1
204 1 99 LEU MD1 1 100 LEU H 1.800 . 5.000 2.960 2.178 4.927 . 0 0 "[ . 1 . 2]" 1
205 1 99 LEU MD2 1 100 LEU H 1.800 . 5.000 4.501 2.583 4.974 . 0 0 "[ . 1 . 2]" 1
206 1 99 LEU HG 1 100 LEU H 1.800 . 5.000 3.341 2.785 3.842 . 0 0 "[ . 1 . 2]" 1
207 1 100 LEU MD2 1 101 LEU H 1.800 . 5.000 3.783 3.374 4.063 . 0 0 "[ . 1 . 2]" 1
208 1 43 ASN H 1 44 LEU HG 1.800 . 5.000 3.781 3.512 4.116 . 0 0 "[ . 1 . 2]" 1
209 1 56 ASN H 1 57 ILE MG 1.800 . 5.000 3.112 2.751 3.519 . 0 0 "[ . 1 . 2]" 1
210 1 76 LYS H 1 77 ILE MG 1.800 . 5.000 3.641 3.048 4.202 . 0 0 "[ . 1 . 2]" 1
211 1 24 ASP QB 1 26 GLU H 1.800 . 5.000 3.491 2.331 5.037 0.037 6 0 "[ . 1 . 2]" 1
212 1 33 ASP QB 1 35 LYS H 1.800 . 5.000 3.708 2.581 4.885 . 0 0 "[ . 1 . 2]" 1
213 1 45 SER QB 1 47 GLY H 1.800 . 5.000 3.083 2.819 3.438 . 0 0 "[ . 1 . 2]" 1
214 1 81 PHE QB 1 83 THR H 1.800 . 5.000 3.149 2.405 4.070 . 0 0 "[ . 1 . 2]" 1
215 1 85 LYS QB 1 87 SER H 1.800 . 5.000 4.014 2.918 5.001 0.001 8 0 "[ . 1 . 2]" 1
216 1 94 ILE HB 1 96 LYS H 1.800 . 5.000 2.909 2.559 3.496 . 0 0 "[ . 1 . 2]" 1
217 1 20 VAL MG1 1 22 LEU H 1.800 . 5.000 3.534 3.031 4.192 . 0 0 "[ . 1 . 2]" 1
218 1 31 ILE MG 1 33 ASP H 1.800 . 5.000 2.688 1.769 5.002 0.031 11 0 "[ . 1 . 2]" 1
219 1 58 VAL MG1 1 60 VAL H 1.800 . 5.000 3.553 3.293 3.794 . 0 0 "[ . 1 . 2]" 1
220 1 65 ILE MG 1 67 ASN H 1.800 . 5.000 2.250 1.784 2.961 0.016 13 0 "[ . 1 . 2]" 1
221 1 81 PHE QD 1 83 THR H 1.800 . 5.000 3.668 2.109 4.589 . 0 0 "[ . 1 . 2]" 1
222 1 85 LYS QG 1 87 SER H 1.800 . 5.000 4.155 2.950 5.050 0.050 7 0 "[ . 1 . 2]" 1
223 1 94 ILE MD 1 96 LYS H 1.800 . 5.000 4.156 2.976 4.708 . 0 0 "[ . 1 . 2]" 1
224 1 94 ILE MG 1 96 LYS H 1.800 . 5.000 4.319 4.048 4.767 . 0 0 "[ . 1 . 2]" 1
225 1 24 ASP QB 1 27 ARG H 1.800 . 5.000 2.631 2.034 4.280 . 0 0 "[ . 1 . 2]" 1
226 1 53 PHE QB 1 56 ASN H 1.800 . 5.000 3.483 2.856 4.246 . 0 0 "[ . 1 . 2]" 1
227 1 68 THR MG 1 71 LEU H 1.800 . 5.000 4.607 3.212 5.036 0.036 13 0 "[ . 1 . 2]" 1
228 1 44 LEU QB 1 48 GLN H 1.800 . 5.000 4.340 4.037 4.530 . 0 0 "[ . 1 . 2]" 1
229 1 39 LYS HA 1 42 TYR QB 1.800 . 5.000 2.986 2.252 3.681 . 0 0 "[ . 1 . 2]" 1
230 1 40 GLU HA 1 43 ASN QB 1.800 . 5.000 2.459 1.979 2.837 . 0 0 "[ . 1 . 2]" 1
231 1 41 ASP HA 1 44 LEU QB 1.800 . 5.000 2.988 2.765 3.397 . 0 0 "[ . 1 . 2]" 1
232 1 46 GLU HA 1 49 LEU QB 1.800 . 5.000 2.806 2.421 3.170 . 0 0 "[ . 1 . 2]" 1
233 1 47 GLY QA 1 50 MET QB 1.800 . 5.000 2.518 2.126 3.211 . 0 0 "[ . 1 . 2]" 1
234 1 48 GLN HA 1 51 ASN QB 1.800 . 5.000 2.848 2.215 3.683 . 0 0 "[ . 1 . 2]" 1
235 1 49 LEU HA 1 52 LYS QB 1.800 . 5.000 2.787 2.235 3.462 . 0 0 "[ . 1 . 2]" 1
236 1 39 LYS HA 1 42 TYR QD 1.800 . 5.000 2.403 1.777 3.226 0.023 17 0 "[ . 1 . 2]" 1
237 1 39 LYS HA 1 42 TYR QE 1.800 . 5.000 4.256 3.043 5.019 0.019 5 0 "[ . 1 . 2]" 1
238 1 40 GLU HA 1 43 ASN QD 1.800 . 5.000 3.442 1.982 5.012 0.012 6 0 "[ . 1 . 2]" 1
239 1 41 ASP HA 1 44 LEU MD1 1.800 . 5.000 2.184 1.879 2.609 . 0 0 "[ . 1 . 2]" 1
240 1 41 ASP HA 1 44 LEU HG 1.800 . 5.000 2.369 1.798 3.216 0.002 14 0 "[ . 1 . 2]" 1
241 1 46 GLU HA 1 49 LEU MD1 1.800 . 5.000 4.301 2.705 5.062 0.062 10 0 "[ . 1 . 2]" 1
242 1 47 GLY QA 1 50 MET ME 1.800 . 5.000 3.519 2.670 4.514 . 0 0 "[ . 1 . 2]" 1
243 1 54 LYS HA 1 57 ILE MG 1.800 . 5.000 2.881 1.856 3.952 . 0 0 "[ . 1 . 2]" 1
244 1 68 THR HA 1 71 LEU MD1 1.800 . 5.000 4.447 2.151 5.041 0.041 19 0 "[ . 1 . 2]" 1
245 1 14 GLN H 1 81 PHE H 1.800 . 5.000 3.283 2.668 4.347 . 0 0 "[ . 1 . 2]" 1
246 1 16 LEU H 1 79 VAL H 1.800 . 5.000 3.012 2.683 3.440 . 0 0 "[ . 1 . 2]" 1
247 1 18 GLY H 1 77 ILE H 1.800 . 5.000 3.230 2.977 3.597 . 0 0 "[ . 1 . 2]" 1
248 1 20 VAL H 1 75 GLU H 1.800 . 5.000 3.198 2.951 3.508 . 0 0 "[ . 1 . 2]" 1
249 1 22 LEU H 1 29 ILE H 1.800 . 5.000 3.602 3.336 3.957 . 0 0 "[ . 1 . 2]" 1
250 1 24 ASP H 1 27 ARG H 1.800 . 5.000 3.785 3.382 4.235 . 0 0 "[ . 1 . 2]" 1
251 1 28 ALA H 1 60 VAL H 1.800 . 5.000 3.262 3.032 3.543 . 0 0 "[ . 1 . 2]" 1
252 1 30 LEU H 1 58 VAL H 1.800 . 5.000 3.390 3.233 3.728 . 0 0 "[ . 1 . 2]" 1
253 1 38 GLY H 1 41 ASP H 1.800 . 5.000 3.498 3.124 4.305 . 0 0 "[ . 1 . 2]" 1
254 1 45 SER H 1 48 GLN H 1.800 . 5.000 3.889 3.513 4.222 . 0 0 "[ . 1 . 2]" 1
255 1 59 ILE H 1 92 ALA H 1.800 . 5.000 4.358 3.995 4.794 . 0 0 "[ . 1 . 2]" 1
256 1 61 GLY H 1 92 ALA H 1.800 . 5.000 3.424 3.009 3.796 . 0 0 "[ . 1 . 2]" 1
257 1 61 GLY H 1 94 ILE H 1.800 . 5.000 3.110 2.712 3.586 . 0 0 "[ . 1 . 2]" 1
258 1 78 LYS H 1 98 GLU H 1.800 . 5.000 2.895 2.606 3.275 . 0 0 "[ . 1 . 2]" 1
259 1 80 TRP H 1 96 LYS H 1.800 . 5.000 3.489 3.079 4.068 . 0 0 "[ . 1 . 2]" 1
260 1 85 LYS H 1 91 SER H 1.800 . 5.000 3.373 2.936 3.833 . 0 0 "[ . 1 . 2]" 1
261 1 87 SER H 1 91 SER H 1.800 . 5.000 3.142 2.756 3.609 . 0 0 "[ . 1 . 2]" 1
262 1 15 SER HA 1 81 PHE H 1.800 . 5.000 4.073 3.429 4.582 . 0 0 "[ . 1 . 2]" 1
263 1 17 VAL HA 1 79 VAL H 1.800 . 5.000 3.423 2.901 3.805 . 0 0 "[ . 1 . 2]" 1
264 1 19 TYR HA 1 77 ILE H 1.800 . 5.000 3.364 3.085 3.920 . 0 0 "[ . 1 . 2]" 1
265 1 23 LYS HA 1 29 ILE H 1.800 . 5.000 3.077 2.669 3.709 . 0 0 "[ . 1 . 2]" 1
266 1 26 GLU HA 1 62 LEU H 1.800 . 5.000 4.023 2.911 4.875 . 0 0 "[ . 1 . 2]" 1
267 1 27 ARG HA 1 62 LEU H 1.800 . 5.000 2.612 2.040 3.328 . 0 0 "[ . 1 . 2]" 1
268 1 29 ILE HA 1 60 VAL H 1.800 . 5.000 3.502 3.157 3.868 . 0 0 "[ . 1 . 2]" 1
269 1 31 ILE HA 1 58 VAL H 1.800 . 5.000 3.299 3.013 3.504 . 0 0 "[ . 1 . 2]" 1
270 1 60 VAL HA 1 92 ALA H 1.800 . 5.000 2.267 2.001 2.442 . 0 0 "[ . 1 . 2]" 1
271 1 77 ILE HA 1 100 LEU H 1.800 . 5.000 2.381 1.988 2.792 . 0 0 "[ . 1 . 2]" 1
272 1 79 VAL HA 1 98 GLU H 1.800 . 5.000 3.261 2.890 3.526 . 0 0 "[ . 1 . 2]" 1
273 1 81 PHE HA 1 95 GLN H 1.800 . 5.000 3.159 2.639 3.846 . 0 0 "[ . 1 . 2]" 1
274 1 14 GLN H 1 82 HIS HA 1.800 . 5.000 3.855 3.229 4.864 . 0 0 "[ . 1 . 2]" 1
275 1 16 LEU H 1 78 LYS HA 1.800 . 5.000 4.299 3.839 4.679 . 0 0 "[ . 1 . 2]" 1
276 1 16 LEU H 1 80 TRP HA 1.800 . 5.000 3.711 3.377 4.215 . 0 0 "[ . 1 . 2]" 1
277 1 18 GLY H 1 78 LYS HA 1.800 . 5.000 3.431 3.099 3.781 . 0 0 "[ . 1 . 2]" 1
278 1 20 VAL H 1 76 LYS HA 1.800 . 5.000 2.920 2.155 3.471 . 0 0 "[ . 1 . 2]" 1
279 1 21 VAL H 1 30 LEU HA 1.800 . 5.000 2.956 2.830 3.147 . 0 0 "[ . 1 . 2]" 1
280 1 24 ASP H 1 28 ALA HA 1.800 . 5.000 2.894 2.512 4.007 . 0 0 "[ . 1 . 2]" 1
281 1 28 ALA H 1 61 GLY QA 1.800 . 5.000 3.822 3.565 4.054 . 0 0 "[ . 1 . 2]" 1
282 1 30 LEU H 1 59 ILE HA 1.800 . 5.000 3.082 2.761 3.372 . 0 0 "[ . 1 . 2]" 1
283 1 32 THR H 1 57 ILE HA 1.800 . 5.000 3.181 2.337 3.896 . 0 0 "[ . 1 . 2]" 1
284 1 59 ILE H 1 91 SER HA 1.800 . 5.000 2.719 2.458 3.015 . 0 0 "[ . 1 . 2]" 1
285 1 61 GLY H 1 93 THR HA 1.800 . 5.000 2.320 1.881 2.842 . 0 0 "[ . 1 . 2]" 1
286 1 78 LYS H 1 99 LEU HA 1.800 . 5.000 3.873 3.506 4.298 . 0 0 "[ . 1 . 2]" 1
287 1 80 TRP H 1 97 TYR HA 1.800 . 5.000 2.987 2.630 3.227 . 0 0 "[ . 1 . 2]" 1
288 1 82 HIS H 1 94 ILE HA 1.800 . 5.000 4.125 3.140 5.019 0.019 4 0 "[ . 1 . 2]" 1
289 1 85 LYS H 1 92 ALA HA 1.800 . 5.000 3.040 2.122 3.348 . 0 0 "[ . 1 . 2]" 1
290 1 87 SER H 1 90 PRO HA 1.800 . 5.000 2.620 1.876 3.438 . 0 0 "[ . 1 . 2]" 1
291 1 15 SER HA 1 80 TRP HA 1.800 . 5.000 2.713 2.251 3.030 . 0 0 "[ . 1 . 2]" 1
292 1 17 VAL HA 1 78 LYS HA 1.800 . 5.000 2.233 1.949 2.652 . 0 0 "[ . 1 . 2]" 1
293 1 19 TYR HA 1 76 LYS HA 1.800 . 5.000 2.301 2.056 2.474 . 0 0 "[ . 1 . 2]" 1
294 1 20 VAL HA 1 30 LEU HA 1.800 . 5.000 2.886 2.609 3.533 . 0 0 "[ . 1 . 2]" 1
295 1 23 LYS HA 1 28 ALA HA 1.800 . 5.000 2.457 2.046 2.825 . 0 0 "[ . 1 . 2]" 1
296 1 27 ARG HA 1 61 GLY QA 1.800 . 5.000 2.759 2.385 3.039 . 0 0 "[ . 1 . 2]" 1
297 1 29 ILE HA 1 59 ILE HA 1.800 . 5.000 2.343 2.010 2.665 . 0 0 "[ . 1 . 2]" 1
298 1 31 ILE HA 1 57 ILE HA 1.800 . 5.000 2.487 2.127 2.877 . 0 0 "[ . 1 . 2]" 1
299 1 77 ILE HA 1 99 LEU HA 1.800 . 5.000 2.893 2.614 3.304 . 0 0 "[ . 1 . 2]" 1
300 1 79 VAL HA 1 97 TYR HA 1.800 . 5.000 2.132 1.829 2.411 . 0 0 "[ . 1 . 2]" 1
301 1 86 GLU HA 1 90 PRO HA 1.800 . 5.000 2.615 1.783 4.266 0.017 10 0 "[ . 1 . 2]" 1
302 1 16 LEU MD1 1 79 VAL H 1.800 . 5.000 4.664 3.677 5.088 0.088 2 0 "[ . 1 . 2]" 1
303 1 20 VAL HB 1 74 GLY H 1.800 . 5.000 3.185 2.724 3.546 . 0 0 "[ . 1 . 2]" 1
304 1 20 VAL HB 1 75 GLU H 1.800 . 5.000 2.283 1.941 2.668 . 0 0 "[ . 1 . 2]" 1
305 1 20 VAL MG1 1 73 ARG H 1.800 . 5.000 4.584 3.847 5.009 0.009 6 0 "[ . 1 . 2]" 1
306 1 20 VAL MG1 1 74 GLY H 1.800 . 5.000 3.390 2.763 3.713 . 0 0 "[ . 1 . 2]" 1
307 1 20 VAL MG1 1 75 GLU H 1.800 . 5.000 3.706 3.236 3.944 . 0 0 "[ . 1 . 2]" 1
308 1 20 VAL MG2 1 75 GLU H 1.800 . 5.000 3.601 3.290 4.058 . 0 0 "[ . 1 . 2]" 1
309 1 21 VAL QG 1 31 ILE H 1.800 . 5.000 3.105 2.715 3.427 . 0 0 "[ . 1 . 2]" 1
310 1 22 LEU MD1 1 46 GLU H 1.800 . 5.000 3.897 2.900 4.818 . 0 0 "[ . 1 . 2]" 1
311 1 22 LEU MD2 1 46 GLU H 1.800 . 5.000 4.428 3.403 5.020 0.020 16 0 "[ . 1 . 2]" 1
312 1 30 LEU QB 1 58 VAL H 1.800 . 5.000 3.608 3.359 3.812 . 0 0 "[ . 1 . 2]" 1
313 1 37 PRO QB 1 41 ASP H 1.800 . 5.000 4.311 3.968 4.978 . 0 0 "[ . 1 . 2]" 1
314 1 42 TYR QE 1 74 GLY H 1.800 . 5.000 3.563 2.750 5.007 0.007 16 0 "[ . 1 . 2]" 1
315 1 44 LEU QB 1 49 LEU H 1.800 . 5.000 3.428 3.115 3.637 . 0 0 "[ . 1 . 2]" 1
316 1 58 VAL MG1 1 92 ALA H 1.800 . 5.000 3.185 2.655 3.580 . 0 0 "[ . 1 . 2]" 1
317 1 60 VAL MG1 1 92 ALA H 1.800 . 5.000 3.393 3.064 3.685 . 0 0 "[ . 1 . 2]" 1
318 1 65 ILE MD 1 96 LYS H 1.800 . 5.000 3.573 2.604 4.855 . 0 0 "[ . 1 . 2]" 1
319 1 65 ILE MD 1 97 TYR H 1.800 . 5.000 3.553 2.736 4.310 . 0 0 "[ . 1 . 2]" 1
320 1 77 ILE HB 1 98 GLU H 1.800 . 5.000 3.665 3.023 4.078 . 0 0 "[ . 1 . 2]" 1
321 1 77 ILE MD 1 98 GLU H 1.800 . 5.000 4.799 4.188 5.034 0.034 3 0 "[ . 1 . 2]" 1
322 1 77 ILE MG 1 98 GLU H 1.800 . 5.000 4.621 4.158 5.001 0.001 1 0 "[ . 1 . 2]" 1
323 1 79 VAL MG1 1 98 GLU H 1.800 . 5.000 3.968 3.656 4.291 . 0 0 "[ . 1 . 2]" 1
324 1 80 TRP HZ3 1 98 GLU H 1.800 . 5.000 4.131 3.058 5.009 0.009 15 0 "[ . 1 . 2]" 1
325 1 85 LYS QB 1 91 SER H 1.800 . 5.000 3.301 2.858 3.874 . 0 0 "[ . 1 . 2]" 1
326 1 16 LEU H 1 79 VAL MG2 1.800 . 5.000 2.820 2.427 3.140 . 0 0 "[ . 1 . 2]" 1
327 1 16 LEU H 1 81 PHE QE 1.800 . 5.000 4.187 3.474 4.856 . 0 0 "[ . 1 . 2]" 1
328 1 18 GLY H 1 30 LEU MD1 1.800 . 5.000 4.153 3.569 4.558 . 0 0 "[ . 1 . 2]" 1
329 1 19 TYR H 1 30 LEU MD1 1.800 . 5.000 4.672 3.208 5.004 0.004 13 0 "[ . 1 . 2]" 1
330 1 21 VAL H 1 30 LEU MD2 1.800 . 5.000 3.130 2.672 3.893 . 0 0 "[ . 1 . 2]" 1
331 1 22 LEU H 1 29 ILE HB 1.800 . 5.000 2.922 2.524 3.598 . 0 0 "[ . 1 . 2]" 1
332 1 27 ARG H 1 62 LEU MD1 1.800 . 5.000 3.693 2.847 4.531 . 0 0 "[ . 1 . 2]" 1
333 1 28 ALA H 1 60 VAL MG2 1.800 . 5.000 2.704 2.504 3.121 . 0 0 "[ . 1 . 2]" 1
334 1 28 ALA H 1 62 LEU MD1 1.800 . 5.000 3.627 3.272 3.988 . 0 0 "[ . 1 . 2]" 1
335 1 28 ALA H 1 62 LEU HG 1.800 . 5.000 3.070 2.726 3.518 . 0 0 "[ . 1 . 2]" 1
336 1 30 LEU H 1 58 VAL MG1 1.800 . 5.000 4.339 4.149 4.485 . 0 0 "[ . 1 . 2]" 1
337 1 32 THR H 1 56 ASN QB 1.800 . 5.000 3.587 2.361 5.002 0.002 17 0 "[ . 1 . 2]" 1
338 1 38 GLY H 1 41 ASP QB 1.800 . 5.000 2.482 2.020 2.853 . 0 0 "[ . 1 . 2]" 1
339 1 45 SER H 1 48 GLN QB 1.800 . 5.000 2.570 2.233 3.025 . 0 0 "[ . 1 . 2]" 1
340 1 50 MET H 1 57 ILE MD 1.800 . 5.000 3.838 3.308 4.403 . 0 0 "[ . 1 . 2]" 1
341 1 55 ASN H 1 57 ILE MG 1.800 . 5.000 3.574 2.421 4.540 . 0 0 "[ . 1 . 2]" 1
342 1 59 ILE H 1 91 SER QB 1.800 . 5.000 4.108 3.543 4.788 . 0 0 "[ . 1 . 2]" 1
343 1 61 GLY H 1 93 THR MG 1.800 . 5.000 4.021 3.374 4.453 . 0 0 "[ . 1 . 2]" 1
344 1 61 GLY H 1 94 ILE MG 1.800 . 5.000 3.679 3.264 4.359 . 0 0 "[ . 1 . 2]" 1
345 1 63 SER H 1 93 THR MG 1.800 . 5.000 3.700 2.809 4.441 . 0 0 "[ . 1 . 2]" 1
346 1 64 GLU H 1 93 THR MG 1.800 . 5.000 3.612 2.931 4.209 . 0 0 "[ . 1 . 2]" 1
347 1 72 LYS H 1 75 GLU QG 1.800 . 5.000 3.240 1.775 5.021 0.025 2 0 "[ . 1 . 2]" 1
348 1 78 LYS H 1 100 LEU MD1 1.800 . 5.000 3.606 3.153 4.123 . 0 0 "[ . 1 . 2]" 1
349 1 78 LYS H 1 100 LEU MD2 1.800 . 5.000 3.812 3.054 4.677 . 0 0 "[ . 1 . 2]" 1
350 1 78 LYS H 1 100 LEU HG 1.800 . 5.000 2.876 2.431 3.374 . 0 0 "[ . 1 . 2]" 1
351 1 78 LYS H 1 98 GLU QB 1.800 . 5.000 3.194 2.626 3.694 . 0 0 "[ . 1 . 2]" 1
352 1 80 TRP H 1 94 ILE HB 1.800 . 5.000 3.332 2.871 3.992 . 0 0 "[ . 1 . 2]" 1
353 1 80 TRP H 1 94 ILE MD 1.800 . 5.000 4.084 3.503 4.958 . 0 0 "[ . 1 . 2]" 1
354 1 85 LYS H 1 92 ALA MB 1.800 . 5.000 3.775 2.587 4.573 . 0 0 "[ . 1 . 2]" 1
355 1 15 SER HA 1 79 VAL MG2 1.800 . 5.000 4.124 3.380 4.676 . 0 0 "[ . 1 . 2]" 1
356 1 15 SER HA 1 80 TRP HD1 1.800 . 5.000 2.838 2.266 3.335 . 0 0 "[ . 1 . 2]" 1
357 1 15 SER QB 1 80 TRP HA 1.800 . 5.000 4.374 3.501 5.010 0.010 8 0 "[ . 1 . 2]" 1
358 1 17 VAL MG2 1 78 LYS HA 1.800 . 5.000 3.036 2.705 3.614 . 0 0 "[ . 1 . 2]" 1
359 1 18 GLY QA 1 30 LEU QB 1.800 . 5.000 2.826 2.211 3.427 . 0 0 "[ . 1 . 2]" 1
360 1 18 GLY QA 1 30 LEU MD1 1.800 . 5.000 3.201 2.499 3.921 . 0 0 "[ . 1 . 2]" 1
361 1 18 GLY QA 1 32 THR MG 1.800 . 5.000 3.353 2.170 4.463 . 0 0 "[ . 1 . 2]" 1
362 1 19 TYR QE 1 34 THR HA 1.800 . 5.000 3.273 1.779 5.078 0.078 5 0 "[ . 1 . 2]" 1
363 1 20 VAL HA 1 30 LEU MD1 1.800 . 5.000 4.180 2.197 4.665 . 0 0 "[ . 1 . 2]" 1
364 1 20 VAL HA 1 30 LEU MD2 1.800 . 5.000 1.938 1.798 2.646 0.002 20 0 "[ . 1 . 2]" 1
365 1 20 VAL HB 1 73 ARG HA 1.800 . 5.000 3.505 2.312 3.964 . 0 0 "[ . 1 . 2]" 1
366 1 20 VAL MG1 1 73 ARG HA 1.800 . 5.000 2.662 2.086 3.055 . 0 0 "[ . 1 . 2]" 1
367 1 20 VAL MG2 1 73 ARG HA 1.800 . 5.000 4.758 3.690 5.053 0.053 8 0 "[ . 1 . 2]" 1
368 1 21 VAL HA 1 42 TYR QD 1.800 . 5.000 3.563 2.376 4.707 . 0 0 "[ . 1 . 2]" 1
369 1 21 VAL QG 1 42 TYR HA 1.800 . 5.000 3.862 2.384 5.001 0.001 11 0 "[ . 1 . 2]" 1
370 1 21 VAL QG 1 30 LEU HA 1.800 . 5.000 3.068 2.743 3.768 . 0 0 "[ . 1 . 2]" 1
371 1 22 LEU HA 1 73 ARG QD 1.800 . 5.000 3.226 2.056 4.429 . 0 0 "[ . 1 . 2]" 1
372 1 22 LEU HA 1 73 ARG QG 1.800 . 5.000 3.333 2.552 5.010 0.010 1 0 "[ . 1 . 2]" 1
373 1 22 LEU MD1 1 46 GLU HA 1.800 . 5.000 2.848 1.806 4.673 . 0 0 "[ . 1 . 2]" 1
374 1 26 GLU HA 1 62 LEU QB 1.800 . 5.000 2.993 1.794 4.236 0.006 6 0 "[ . 1 . 2]" 1
375 1 26 GLU HA 1 62 LEU MD1 1.800 . 5.000 3.994 3.138 5.008 0.008 3 0 "[ . 1 . 2]" 1
376 1 27 ARG HA 1 62 LEU MD1 1.800 . 5.000 3.621 3.026 4.454 . 0 0 "[ . 1 . 2]" 1
377 1 27 ARG HA 1 62 LEU MD2 1.800 . 5.000 4.407 3.812 5.018 0.018 16 0 "[ . 1 . 2]" 1
378 1 27 ARG HA 1 62 LEU HG 1.800 . 5.000 2.928 2.259 3.766 . 0 0 "[ . 1 . 2]" 1
379 1 29 ILE MD 1 46 GLU HA 1.800 . 5.000 3.785 2.776 4.424 . 0 0 "[ . 1 . 2]" 1
380 1 31 ILE MD 1 37 PRO HA 1.800 . 5.000 4.486 3.666 5.034 0.034 4 0 "[ . 1 . 2]" 1
381 1 31 ILE MD 1 57 ILE HA 1.800 . 5.000 4.954 4.768 5.063 0.063 16 0 "[ . 1 . 2]" 1
382 1 31 ILE MG 1 57 ILE HA 1.800 . 5.000 3.704 3.264 4.501 . 0 0 "[ . 1 . 2]" 1
383 1 32 THR MG 1 57 ILE HA 1.800 . 5.000 4.347 3.431 4.902 . 0 0 "[ . 1 . 2]" 1
384 1 37 PRO HA 1 41 ASP QB 1.800 . 5.000 3.535 2.578 4.349 . 0 0 "[ . 1 . 2]" 1
385 1 37 PRO HA 1 53 PHE HZ 1.800 . 5.000 3.482 2.008 4.925 . 0 0 "[ . 1 . 2]" 1
386 1 42 TYR QE 1 74 GLY QA 1.800 . 5.000 2.634 1.851 3.530 . 0 0 "[ . 1 . 2]" 1
387 1 44 LEU QB 1 48 GLN HA 1.800 . 5.000 4.733 4.420 5.025 0.025 8 0 "[ . 1 . 2]" 1
388 1 44 LEU MD1 1 49 LEU HA 1.800 . 5.000 3.461 2.634 3.993 . 0 0 "[ . 1 . 2]" 1
389 1 49 LEU HA 1 53 PHE QD 1.800 . 5.000 3.155 2.393 3.875 . 0 0 "[ . 1 . 2]" 1
390 1 50 MET HA 1 57 ILE MD 1.800 . 5.000 2.482 1.794 3.384 0.006 1 0 "[ . 1 . 2]" 1
391 1 50 MET HA 1 57 ILE QG 1.800 . 5.000 4.378 3.899 4.936 . 0 0 "[ . 1 . 2]" 1
392 1 50 MET HA 1 57 ILE MG 1.800 . 5.000 2.523 1.830 3.288 . 0 0 "[ . 1 . 2]" 1
393 1 58 VAL HA 1 90 PRO QD 1.800 . 5.000 3.415 3.032 4.056 . 0 0 "[ . 1 . 2]" 1
394 1 58 VAL HA 1 90 PRO QG 1.800 . 5.000 3.709 2.578 4.710 . 0 0 "[ . 1 . 2]" 1
395 1 58 VAL MG1 1 91 SER HA 1.800 . 5.000 2.860 2.371 3.279 . 0 0 "[ . 1 . 2]" 1
396 1 58 VAL MG2 1 91 SER HA 1.800 . 5.000 4.786 4.313 5.038 0.038 14 0 "[ . 1 . 2]" 1
397 1 59 ILE HB 1 91 SER HA 1.800 . 5.000 3.080 2.581 3.563 . 0 0 "[ . 1 . 2]" 1
398 1 59 ILE MG 1 91 SER HA 1.800 . 5.000 4.204 3.977 4.616 . 0 0 "[ . 1 . 2]" 1
399 1 60 VAL HA 1 92 ALA MB 1.800 . 5.000 3.099 2.840 3.766 . 0 0 "[ . 1 . 2]" 1
400 1 60 VAL HA 1 94 ILE MG 1.800 . 5.000 3.830 3.560 4.382 . 0 0 "[ . 1 . 2]" 1
401 1 65 ILE MD 1 95 GLN HA 1.800 . 5.000 3.584 2.642 5.019 0.019 7 0 "[ . 1 . 2]" 1
402 1 65 ILE MD 1 96 LYS HA 1.800 . 5.000 2.726 1.796 3.670 0.004 19 0 "[ . 1 . 2]" 1
403 1 65 ILE QG 1 95 GLN HA 1.800 . 5.000 3.382 2.350 4.408 . 0 0 "[ . 1 . 2]" 1
404 1 71 LEU HA 1 99 LEU MD2 1.800 . 5.000 4.395 3.148 5.012 0.012 5 0 "[ . 1 . 2]" 1
405 1 77 ILE HA 1 100 LEU MD1 1.800 . 5.000 3.425 3.057 3.927 . 0 0 "[ . 1 . 2]" 1
406 1 77 ILE HA 1 100 LEU HG 1.800 . 5.000 2.582 1.954 3.467 . 0 0 "[ . 1 . 2]" 1
407 1 77 ILE HB 1 99 LEU HA 1.800 . 5.000 3.599 3.262 3.841 . 0 0 "[ . 1 . 2]" 1
408 1 77 ILE MG 1 99 LEU HA 1.800 . 5.000 1.964 1.778 2.278 0.022 5 0 "[ . 1 . 2]" 1
409 1 79 VAL HA 1 94 ILE MG 1.800 . 5.000 4.033 3.763 4.420 . 0 0 "[ . 1 . 2]" 1
410 1 79 VAL HA 1 97 TYR QB 1.800 . 5.000 2.545 2.113 2.915 . 0 0 "[ . 1 . 2]" 1
411 1 79 VAL HA 1 97 TYR QD 1.800 . 5.000 4.602 4.157 4.936 . 0 0 "[ . 1 . 2]" 1
412 1 79 VAL MG1 1 97 TYR HA 1.800 . 5.000 3.408 2.977 3.847 . 0 0 "[ . 1 . 2]" 1
413 1 80 TRP HE3 1 97 TYR HA 1.800 . 5.000 3.083 2.625 4.010 . 0 0 "[ . 1 . 2]" 1
414 1 80 TRP HZ3 1 97 TYR HA 1.800 . 5.000 3.786 3.141 4.886 . 0 0 "[ . 1 . 2]" 1
415 1 81 PHE HA 1 94 ILE MG 1.800 . 5.000 3.361 2.583 4.381 . 0 0 "[ . 1 . 2]" 1
416 1 81 PHE HA 1 95 GLN QG 1.800 . 5.000 3.935 2.311 4.942 . 0 0 "[ . 1 . 2]" 1
417 1 84 ARG HA 1 92 ALA MB 1.800 . 5.000 2.975 1.789 3.702 0.011 4 0 "[ . 1 . 2]" 1
418 1 86 GLU HA 1 90 PRO QB 1.800 . 5.000 3.146 2.132 4.511 . 0 0 "[ . 1 . 2]" 1
419 1 88 ASN HA 1 90 PRO QD 1.800 . 5.000 2.560 2.097 3.305 . 0 0 "[ . 1 . 2]" 1
420 1 13 MET QB 1 80 TRP QB 1.800 . 5.000 1.876 1.747 2.199 0.053 19 0 "[ . 1 . 2]" 1
421 1 13 MET QB 1 80 TRP HD1 1.800 . 5.000 2.708 2.220 2.938 . 0 0 "[ . 1 . 2]" 1
422 1 13 MET QB 1 80 TRP HE3 1.800 . 5.000 4.990 4.716 5.078 0.078 13 0 "[ . 1 . 2]" 1
423 1 13 MET ME 1 80 TRP QB 1.800 . 5.000 2.329 1.784 3.651 0.016 11 0 "[ . 1 . 2]" 1
424 1 13 MET ME 1 80 TRP HD1 1.800 . 5.000 4.031 3.339 4.935 . 0 0 "[ . 1 . 2]" 1
425 1 13 MET ME 1 80 TRP HE3 1.800 . 5.000 3.936 3.131 5.004 0.004 5 0 "[ . 1 . 2]" 1
426 1 13 MET ME 1 96 LYS QD 1.800 . 5.000 3.435 1.785 4.957 0.015 16 0 "[ . 1 . 2]" 1
427 1 13 MET QG 1 80 TRP QB 1.800 . 5.000 3.440 2.969 3.894 . 0 0 "[ . 1 . 2]" 1
428 1 13 MET QG 1 80 TRP HD1 1.800 . 5.000 4.805 4.317 5.031 0.031 14 0 "[ . 1 . 2]" 1
429 1 14 GLN QB 1 81 PHE QE 1.800 . 5.000 3.080 2.273 4.057 . 0 0 "[ . 1 . 2]" 1
430 1 14 GLN QB 1 81 PHE HZ 1.800 . 5.000 3.945 3.115 4.701 . 0 0 "[ . 1 . 2]" 1
431 1 15 SER QB 1 78 LYS QD 1.800 . 5.000 3.822 3.104 4.585 . 0 0 "[ . 1 . 2]" 1
432 1 15 SER QB 1 78 LYS QE 1.800 . 5.000 2.751 1.796 5.011 0.011 19 0 "[ . 1 . 2]" 1
433 1 15 SER QB 1 78 LYS QG 1.800 . 5.000 2.966 2.212 3.837 . 0 0 "[ . 1 . 2]" 1
434 1 15 SER QB 1 80 TRP HD1 1.800 . 5.000 3.147 1.842 4.190 . 0 0 "[ . 1 . 2]" 1
435 1 15 SER QB 1 80 TRP HE1 1.800 . 5.000 2.769 1.885 4.055 . 0 0 "[ . 1 . 2]" 1
436 1 16 LEU QB 1 32 THR MG 1.800 . 5.000 3.950 2.873 4.781 . 0 0 "[ . 1 . 2]" 1
437 1 16 LEU QB 1 79 VAL MG2 1.800 . 5.000 2.125 1.771 2.668 0.029 3 0 "[ . 1 . 2]" 1
438 1 16 LEU QB 1 81 PHE QE 1.800 . 5.000 2.193 1.774 3.371 0.026 19 0 "[ . 1 . 2]" 1
439 1 16 LEU MD1 1 32 THR MG 1.800 . 5.000 2.218 1.785 3.974 0.015 8 0 "[ . 1 . 2]" 1
440 1 16 LEU MD1 1 58 VAL MG1 1.800 . 5.000 4.068 1.839 5.020 0.020 1 0 "[ . 1 . 2]" 1
441 1 16 LEU MD1 1 79 VAL MG2 1.800 . 5.000 3.128 2.297 4.107 . 0 0 "[ . 1 . 2]" 1
442 1 16 LEU MD1 1 81 PHE QE 1.800 . 5.000 3.209 1.794 4.484 0.006 13 0 "[ . 1 . 2]" 1
443 1 16 LEU MD1 1 81 PHE HZ 1.800 . 5.000 3.988 2.290 5.007 0.007 8 0 "[ . 1 . 2]" 1
444 1 16 LEU MD2 1 32 THR MG 1.800 . 5.000 2.983 1.801 4.189 . 0 0 "[ . 1 . 2]" 1
445 1 16 LEU MD2 1 81 PHE QE 1.800 . 5.000 3.596 2.287 4.595 . 0 0 "[ . 1 . 2]" 1
446 1 16 LEU MD2 1 81 PHE HZ 1.800 . 5.000 3.655 2.512 5.043 0.043 19 0 "[ . 1 . 2]" 1
447 1 16 LEU HG 1 81 PHE QE 1.800 . 5.000 2.967 2.005 4.767 . 0 0 "[ . 1 . 2]" 1
448 1 16 LEU HG 1 81 PHE HZ 1.800 . 5.000 3.601 2.693 5.006 0.006 9 0 "[ . 1 . 2]" 1
449 1 17 VAL MG1 1 76 LYS QE 1.800 . 5.000 3.236 1.896 5.050 0.050 20 0 "[ . 1 . 2]" 1
450 1 17 VAL MG2 1 78 LYS QB 1.800 . 5.000 2.602 1.881 3.477 . 0 0 "[ . 1 . 2]" 1
451 1 17 VAL MG2 1 78 LYS QD 1.800 . 5.000 3.249 2.646 4.256 . 0 0 "[ . 1 . 2]" 1
452 1 17 VAL MG2 1 78 LYS QE 1.800 . 5.000 4.015 2.989 5.013 0.013 8 0 "[ . 1 . 2]" 1
453 1 17 VAL MG2 1 78 LYS QG 1.800 . 5.000 2.588 1.850 3.743 . 0 0 "[ . 1 . 2]" 1
454 1 19 TYR QB 1 21 VAL QG 1.800 . 5.000 2.999 2.401 4.059 . 0 0 "[ . 1 . 2]" 1
455 1 19 TYR QB 1 31 ILE HB 1.800 . 5.000 2.572 2.047 3.601 . 0 0 "[ . 1 . 2]" 1
456 1 19 TYR QB 1 37 PRO QG 1.800 . 5.000 3.676 2.535 4.812 . 0 0 "[ . 1 . 2]" 1
457 1 19 TYR QD 1 31 ILE HB 1.800 . 5.000 3.188 2.212 3.701 . 0 0 "[ . 1 . 2]" 1
458 1 19 TYR QD 1 36 ALA MB 1.800 . 5.000 4.039 2.794 5.033 0.033 16 0 "[ . 1 . 2]" 1
459 1 19 TYR QD 1 37 PRO QD 1.800 . 5.000 3.647 2.483 4.984 . 0 0 "[ . 1 . 2]" 1
460 1 19 TYR QD 1 76 LYS QB 1.800 . 5.000 3.131 2.490 4.561 . 0 0 "[ . 1 . 2]" 1
461 1 19 TYR QE 1 36 ALA MB 1.800 . 5.000 3.514 2.636 4.757 . 0 0 "[ . 1 . 2]" 1
462 1 19 TYR QE 1 76 LYS QB 1.800 . 5.000 3.439 2.566 4.936 . 0 0 "[ . 1 . 2]" 1
463 1 19 TYR QE 1 76 LYS QD 1.800 . 5.000 2.646 2.198 3.457 . 0 0 "[ . 1 . 2]" 1
464 1 19 TYR QE 1 76 LYS QE 1.800 . 5.000 3.287 1.766 4.717 0.034 13 0 "[ . 1 . 2]" 1
465 1 20 VAL MG1 1 23 LYS QB 1.800 . 5.000 3.029 2.474 4.833 . 0 0 "[ . 1 . 2]" 1
466 1 20 VAL MG1 1 23 LYS QD 1.800 . 5.000 3.723 2.686 5.050 0.050 3 0 "[ . 1 . 2]" 1
467 1 20 VAL MG1 1 23 LYS QG 1.800 . 5.000 3.789 3.018 4.308 . 0 0 "[ . 1 . 2]" 1
468 1 20 VAL MG1 1 71 LEU MD2 1.800 . 5.000 2.760 1.994 4.760 . 0 0 "[ . 1 . 2]" 1
469 1 20 VAL MG1 1 71 LEU HG 1.800 . 5.000 2.973 2.022 5.022 0.022 5 0 "[ . 1 . 2]" 1
470 1 20 VAL MG1 1 73 ARG QB 1.800 . 5.000 4.066 2.087 4.600 . 0 0 "[ . 1 . 2]" 1
471 1 20 VAL MG2 1 28 ALA MB 1.800 . 5.000 3.823 3.341 4.747 . 0 0 "[ . 1 . 2]" 1
472 1 20 VAL MG2 1 30 LEU MD1 1.800 . 5.000 3.224 1.831 3.730 . 0 0 "[ . 1 . 2]" 1
473 1 20 VAL MG2 1 30 LEU MD2 1.800 . 5.000 1.967 1.781 2.444 0.019 9 0 "[ . 1 . 2]" 1
474 1 20 VAL MG2 1 71 LEU MD1 1.800 . 5.000 2.456 1.785 4.286 0.015 3 0 "[ . 1 . 2]" 1
475 1 20 VAL MG2 1 71 LEU MD2 1.800 . 5.000 2.960 1.838 4.644 . 0 0 "[ . 1 . 2]" 1
476 1 20 VAL MG2 1 75 GLU QB 1.800 . 5.000 2.674 1.849 3.427 . 0 0 "[ . 1 . 2]" 1
477 1 20 VAL MG2 1 77 ILE MD 1.800 . 5.000 2.222 2.044 3.098 . 0 0 "[ . 1 . 2]" 1
478 1 20 VAL MG2 1 97 TYR QD 1.800 . 5.000 4.947 4.514 5.082 0.082 4 0 "[ . 1 . 2]" 1
479 1 21 VAL HB 1 31 ILE QG 1.800 . 5.000 4.065 3.253 4.622 . 0 0 "[ . 1 . 2]" 1
480 1 21 VAL HB 1 31 ILE MD 1.800 . 5.000 3.688 2.760 4.257 . 0 0 "[ . 1 . 2]" 1
481 1 21 VAL HB 1 42 TYR QD 1.800 . 5.000 3.975 3.100 5.030 0.030 15 0 "[ . 1 . 2]" 1
482 1 21 VAL HB 1 42 TYR QE 1.800 . 5.000 3.442 2.294 4.657 . 0 0 "[ . 1 . 2]" 1
483 1 21 VAL HB 1 49 LEU MD2 1.800 . 5.000 3.707 2.474 5.008 0.008 8 0 "[ . 1 . 2]" 1
484 1 21 VAL QG 1 29 ILE HB 1.800 . 5.000 3.332 2.834 4.722 . 0 0 "[ . 1 . 2]" 1
485 1 21 VAL QG 1 31 ILE MD 1.800 . 5.000 2.027 1.808 2.406 . 0 0 "[ . 1 . 2]" 1
486 1 21 VAL QG 1 37 PRO QB 1.800 . 5.000 3.262 2.465 3.756 . 0 0 "[ . 1 . 2]" 1
487 1 21 VAL QG 1 37 PRO QG 1.800 . 5.000 2.259 1.797 3.262 0.003 20 0 "[ . 1 . 2]" 1
488 1 21 VAL QG 1 42 TYR QD 1.800 . 5.000 3.175 1.797 4.363 0.003 8 0 "[ . 1 . 2]" 1
489 1 21 VAL QG 1 42 TYR QE 1.800 . 5.000 2.535 2.011 3.232 . 0 0 "[ . 1 . 2]" 1
490 1 22 LEU MD1 1 29 ILE MD 1.800 . 5.000 2.559 1.877 4.124 . 0 0 "[ . 1 . 2]" 1
491 1 22 LEU MD1 1 46 GLU QB 1.800 . 5.000 3.073 2.010 4.266 . 0 0 "[ . 1 . 2]" 1
492 1 22 LEU MD1 1 46 GLU QG 1.800 . 5.000 3.148 1.789 5.050 0.050 10 0 "[ . 1 . 2]" 1
493 1 23 LYS QB 1 28 ALA MB 1.800 . 5.000 3.816 3.082 4.876 . 0 0 "[ . 1 . 2]" 1
494 1 23 LYS QE 1 62 LEU MD1 1.800 . 5.000 3.206 1.874 4.562 . 0 0 "[ . 1 . 2]" 1
495 1 23 LYS QE 1 68 THR HB 1.800 . 5.000 3.142 1.870 4.341 . 0 0 "[ . 1 . 2]" 1
496 1 23 LYS QE 1 68 THR MG 1.800 . 5.000 4.169 3.040 5.011 0.011 4 0 "[ . 1 . 2]" 1
497 1 23 LYS QE 1 71 LEU QB 1.800 . 5.000 2.421 1.804 3.090 . 0 0 "[ . 1 . 2]" 1
498 1 23 LYS QE 1 71 LEU MD1 1.800 . 5.000 4.399 3.216 5.006 0.006 17 0 "[ . 1 . 2]" 1
499 1 23 LYS QE 1 71 LEU MD2 1.800 . 5.000 2.979 2.080 5.004 0.004 4 0 "[ . 1 . 2]" 1
500 1 23 LYS QE 1 71 LEU HG 1.800 . 5.000 4.062 2.983 5.013 0.013 18 0 "[ . 1 . 2]" 1
501 1 27 ARG QB 1 59 ILE MG 1.800 . 5.000 2.253 1.916 3.091 . 0 0 "[ . 1 . 2]" 1
502 1 27 ARG QD 1 59 ILE MG 1.800 . 5.000 2.791 1.863 4.350 . 0 0 "[ . 1 . 2]" 1
503 1 27 ARG HE 1 59 ILE MG 1.800 . 5.000 4.291 3.000 5.019 0.019 18 0 "[ . 1 . 2]" 1
504 1 27 ARG QG 1 59 ILE MG 1.800 . 5.000 3.078 2.419 4.204 . 0 0 "[ . 1 . 2]" 1
505 1 28 ALA MB 1 30 LEU MD1 1.800 . 5.000 3.349 2.724 4.144 . 0 0 "[ . 1 . 2]" 1
506 1 28 ALA MB 1 30 LEU MD2 1.800 . 5.000 2.404 1.970 2.987 . 0 0 "[ . 1 . 2]" 1
507 1 28 ALA MB 1 60 VAL HB 1.800 . 5.000 4.307 4.173 4.572 . 0 0 "[ . 1 . 2]" 1
508 1 28 ALA MB 1 60 VAL MG1 1.800 . 5.000 4.016 3.801 4.235 . 0 0 "[ . 1 . 2]" 1
509 1 28 ALA MB 1 60 VAL MG2 1.800 . 5.000 1.911 1.790 2.117 0.010 6 0 "[ . 1 . 2]" 1
510 1 28 ALA MB 1 62 LEU MD1 1.800 . 5.000 1.826 1.774 2.174 0.026 17 0 "[ . 1 . 2]" 1
511 1 28 ALA MB 1 62 LEU MD2 1.800 . 5.000 2.548 1.916 2.953 . 0 0 "[ . 1 . 2]" 1
512 1 28 ALA MB 1 71 LEU MD2 1.800 . 5.000 2.979 2.166 5.042 0.042 4 0 "[ . 1 . 2]" 1
513 1 29 ILE MD 1 46 GLU QB 1.800 . 5.000 3.208 2.420 3.891 . 0 0 "[ . 1 . 2]" 1
514 1 29 ILE MD 1 46 GLU QG 1.800 . 5.000 2.549 1.881 4.228 . 0 0 "[ . 1 . 2]" 1
515 1 29 ILE MG 1 57 ILE QG 1.800 . 5.000 2.251 1.821 2.632 . 0 0 "[ . 1 . 2]" 1
516 1 30 LEU QB 1 58 VAL HB 1.800 . 5.000 3.103 2.721 3.627 . 0 0 "[ . 1 . 2]" 1
517 1 30 LEU QB 1 58 VAL MG1 1.800 . 5.000 3.875 3.525 4.223 . 0 0 "[ . 1 . 2]" 1
518 1 30 LEU MD1 1 60 VAL MG1 1.800 . 5.000 2.215 1.924 4.258 . 0 0 "[ . 1 . 2]" 1
519 1 30 LEU MD1 1 60 VAL MG2 1.800 . 5.000 2.233 2.063 3.988 . 0 0 "[ . 1 . 2]" 1
520 1 30 LEU MD1 1 77 ILE MD 1.800 . 5.000 1.963 1.786 2.312 0.014 3 0 "[ . 1 . 2]" 1
521 1 30 LEU MD1 1 79 VAL MG2 1.800 . 5.000 3.058 2.601 4.131 . 0 0 "[ . 1 . 2]" 1
522 1 30 LEU MD2 1 60 VAL MG2 1.800 . 5.000 3.022 1.887 3.357 . 0 0 "[ . 1 . 2]" 1
523 1 30 LEU MD2 1 77 ILE MD 1.800 . 5.000 2.346 2.036 2.817 . 0 0 "[ . 1 . 2]" 1
524 1 30 LEU HG 1 60 VAL MG1 1.800 . 5.000 3.026 2.692 3.352 . 0 0 "[ . 1 . 2]" 1
525 1 30 LEU HG 1 60 VAL MG2 1.800 . 5.000 2.360 2.140 3.056 . 0 0 "[ . 1 . 2]" 1
526 1 31 ILE HB 1 37 PRO QG 1.800 . 5.000 4.084 3.024 4.868 . 0 0 "[ . 1 . 2]" 1
527 1 31 ILE MD 1 37 PRO QB 1.800 . 5.000 3.174 2.320 3.636 . 0 0 "[ . 1 . 2]" 1
528 1 31 ILE MD 1 37 PRO QD 1.800 . 5.000 3.151 2.107 4.559 . 0 0 "[ . 1 . 2]" 1
529 1 31 ILE MD 1 37 PRO QG 1.800 . 5.000 2.222 1.863 2.878 . 0 0 "[ . 1 . 2]" 1
530 1 31 ILE MD 1 49 LEU MD2 1.800 . 5.000 2.919 2.265 3.952 . 0 0 "[ . 1 . 2]" 1
531 1 31 ILE MD 1 53 PHE QB 1.800 . 5.000 3.310 2.678 4.078 . 0 0 "[ . 1 . 2]" 1
532 1 31 ILE MD 1 53 PHE QD 1.800 . 5.000 2.994 2.554 3.375 . 0 0 "[ . 1 . 2]" 1
533 1 31 ILE MD 1 53 PHE QE 1.800 . 5.000 3.077 2.669 3.465 . 0 0 "[ . 1 . 2]" 1
534 1 31 ILE MD 1 53 PHE HZ 1.800 . 5.000 3.660 2.901 4.067 . 0 0 "[ . 1 . 2]" 1
535 1 31 ILE MD 1 57 ILE HB 1.800 . 5.000 4.613 4.130 4.935 . 0 0 "[ . 1 . 2]" 1
536 1 31 ILE MD 1 57 ILE MD 1.800 . 5.000 4.196 3.040 5.007 0.007 2 0 "[ . 1 . 2]" 1
537 1 31 ILE MD 1 57 ILE QG 1.800 . 5.000 4.489 3.829 5.010 0.010 2 0 "[ . 1 . 2]" 1
538 1 31 ILE QG 1 37 PRO QG 1.800 . 5.000 3.962 3.587 4.414 . 0 0 "[ . 1 . 2]" 1
539 1 31 ILE QG 1 57 ILE MD 1.800 . 5.000 3.554 2.239 4.544 . 0 0 "[ . 1 . 2]" 1
540 1 31 ILE MG 1 33 ASP QB 1.800 . 5.000 3.206 1.929 4.977 . 0 0 "[ . 1 . 2]" 1
541 1 31 ILE MG 1 34 THR MG 1.800 . 5.000 4.237 2.026 5.119 0.119 16 0 "[ . 1 . 2]" 1
542 1 31 ILE MG 1 37 PRO QD 1.800 . 5.000 4.154 3.350 5.024 0.024 9 0 "[ . 1 . 2]" 1
543 1 31 ILE MG 1 37 PRO QG 1.800 . 5.000 4.024 3.432 4.761 . 0 0 "[ . 1 . 2]" 1
544 1 31 ILE MG 1 53 PHE QB 1.800 . 5.000 3.042 2.184 3.761 . 0 0 "[ . 1 . 2]" 1
545 1 31 ILE MG 1 53 PHE QD 1.800 . 5.000 3.100 2.612 3.868 . 0 0 "[ . 1 . 2]" 1
546 1 31 ILE MG 1 56 ASN QB 1.800 . 5.000 2.961 2.221 4.418 . 0 0 "[ . 1 . 2]" 1
547 1 32 THR MG 1 58 VAL HB 1.800 . 5.000 2.780 2.179 3.811 . 0 0 "[ . 1 . 2]" 1
548 1 32 THR MG 1 58 VAL MG1 1.800 . 5.000 3.557 3.050 4.334 . 0 0 "[ . 1 . 2]" 1
549 1 33 ASP QB 1 56 ASN QB 1.800 . 5.000 3.147 1.762 5.077 0.077 15 0 "[ . 1 . 2]" 1
550 1 33 ASP QB 1 56 ASN QD 1.800 . 5.000 3.678 2.167 5.007 0.007 14 0 "[ . 1 . 2]" 1
551 1 37 PRO QB 1 41 ASP QB 1.800 . 5.000 2.038 1.776 2.470 0.024 11 0 "[ . 1 . 2]" 1
552 1 37 PRO QB 1 42 TYR QD 1.800 . 5.000 3.819 2.972 4.757 . 0 0 "[ . 1 . 2]" 1
553 1 37 PRO QB 1 42 TYR QE 1.800 . 5.000 3.347 2.631 4.468 . 0 0 "[ . 1 . 2]" 1
554 1 37 PRO QB 1 53 PHE HZ 1.800 . 5.000 3.408 2.354 5.016 0.016 16 0 "[ . 1 . 2]" 1
555 1 41 ASP QB 1 49 LEU MD2 1.800 . 5.000 3.747 2.265 4.798 . 0 0 "[ . 1 . 2]" 1
556 1 41 ASP QB 1 53 PHE QE 1.800 . 5.000 3.108 2.446 4.350 . 0 0 "[ . 1 . 2]" 1
557 1 42 TYR QD 1 73 ARG QD 1.800 . 5.000 4.726 4.051 5.045 0.045 19 0 "[ . 1 . 2]" 1
558 1 44 LEU QB 1 48 GLN QB 1.800 . 5.000 2.122 1.818 2.453 . 0 0 "[ . 1 . 2]" 1
559 1 44 LEU QB 1 48 GLN QG 1.800 . 5.000 3.781 2.279 4.390 . 0 0 "[ . 1 . 2]" 1
560 1 44 LEU QB 1 49 LEU MD2 1.800 . 5.000 3.670 2.043 5.026 0.026 1 0 "[ . 1 . 2]" 1
561 1 44 LEU MD1 1 48 GLN QB 1.800 . 5.000 2.683 1.827 3.172 . 0 0 "[ . 1 . 2]" 1
562 1 44 LEU MD1 1 48 GLN QG 1.800 . 5.000 4.368 3.121 4.981 . 0 0 "[ . 1 . 2]" 1
563 1 44 LEU MD1 1 52 LYS QB 1.800 . 5.000 3.528 2.835 4.497 . 0 0 "[ . 1 . 2]" 1
564 1 44 LEU MD1 1 52 LYS QD 1.800 . 5.000 2.792 2.166 3.775 . 0 0 "[ . 1 . 2]" 1
565 1 44 LEU MD2 1 48 GLN QB 1.800 . 5.000 2.765 2.063 3.413 . 0 0 "[ . 1 . 2]" 1
566 1 44 LEU MD2 1 48 GLN QG 1.800 . 5.000 3.594 1.993 4.461 . 0 0 "[ . 1 . 2]" 1
567 1 46 GLU QG 1 50 MET QG 1.800 . 5.000 4.120 2.490 5.080 0.080 10 0 "[ . 1 . 2]" 1
568 1 49 LEU QB 1 57 ILE MD 1.800 . 5.000 3.353 2.431 4.650 . 0 0 "[ . 1 . 2]" 1
569 1 49 LEU MD2 1 53 PHE QD 1.800 . 5.000 3.475 2.243 4.407 . 0 0 "[ . 1 . 2]" 1
570 1 49 LEU MD2 1 53 PHE QE 1.800 . 5.000 3.777 2.039 5.007 0.007 10 0 "[ . 1 . 2]" 1
571 1 49 LEU MD2 1 57 ILE MD 1.800 . 5.000 3.426 2.150 5.022 0.022 14 0 "[ . 1 . 2]" 1
572 1 50 MET QB 1 57 ILE MD 1.800 . 5.000 3.371 2.410 4.579 . 0 0 "[ . 1 . 2]" 1
573 1 50 MET ME 1 59 ILE MD 1.800 . 5.000 2.793 1.832 4.500 . 0 0 "[ . 1 . 2]" 1
574 1 50 MET ME 1 89 PRO QD 1.800 . 5.000 3.271 2.284 4.359 . 0 0 "[ . 1 . 2]" 1
575 1 50 MET QG 1 57 ILE MD 1.800 . 5.000 2.375 1.781 3.339 0.019 15 0 "[ . 1 . 2]" 1
576 1 50 MET QG 1 57 ILE MG 1.800 . 5.000 2.759 1.854 3.642 . 0 0 "[ . 1 . 2]" 1
577 1 53 PHE QB 1 56 ASN QB 1.800 . 5.000 2.588 1.781 4.160 0.019 7 0 "[ . 1 . 2]" 1
578 1 53 PHE QB 1 57 ILE HB 1.800 . 5.000 2.594 1.845 3.269 . 0 0 "[ . 1 . 2]" 1
579 1 53 PHE QB 1 57 ILE MD 1.800 . 5.000 3.381 2.075 4.147 . 0 0 "[ . 1 . 2]" 1
580 1 53 PHE QB 1 57 ILE QG 1.800 . 5.000 4.112 3.313 4.746 . 0 0 "[ . 1 . 2]" 1
581 1 53 PHE QB 1 57 ILE MG 1.800 . 5.000 3.404 2.785 4.065 . 0 0 "[ . 1 . 2]" 1
582 1 53 PHE QD 1 56 ASN QB 1.800 . 5.000 3.147 2.085 4.547 . 0 0 "[ . 1 . 2]" 1
583 1 53 PHE QD 1 57 ILE MD 1.800 . 5.000 4.305 3.167 5.018 0.018 18 0 "[ . 1 . 2]" 1
584 1 57 ILE MG 1 89 PRO QB 1.800 . 5.000 2.113 1.777 2.624 0.023 5 0 "[ . 1 . 2]" 1
585 1 57 ILE MD 1 89 PRO QB 1.800 . 5.000 3.802 2.988 4.735 . 0 0 "[ . 1 . 2]" 1
586 1 57 ILE MG 1 90 PRO QD 1.800 . 5.000 3.319 2.497 4.055 . 0 0 "[ . 1 . 2]" 1
587 1 58 VAL MG1 1 60 VAL MG1 1.800 . 5.000 2.226 2.041 2.459 . 0 0 "[ . 1 . 2]" 1
588 1 58 VAL MG1 1 90 PRO QB 1.800 . 5.000 2.956 2.564 3.697 . 0 0 "[ . 1 . 2]" 1
589 1 58 VAL MG1 1 90 PRO QG 1.800 . 5.000 3.939 2.973 4.644 . 0 0 "[ . 1 . 2]" 1
590 1 58 VAL MG2 1 81 PHE QE 1.800 . 5.000 5.028 4.993 5.064 0.064 11 0 "[ . 1 . 2]" 1
591 1 58 VAL MG2 1 90 PRO QB 1.800 . 5.000 2.566 1.790 3.944 0.010 12 0 "[ . 1 . 2]" 1
592 1 58 VAL MG2 1 90 PRO QG 1.800 . 5.000 2.597 1.786 3.513 0.014 8 0 "[ . 1 . 2]" 1
593 1 59 ILE HB 1 91 SER QB 1.800 . 5.000 3.085 2.433 3.719 . 0 0 "[ . 1 . 2]" 1
594 1 59 ILE MD 1 89 PRO QD 1.800 . 5.000 3.630 2.476 4.937 . 0 0 "[ . 1 . 2]" 1
595 1 59 ILE MD 1 89 PRO QG 1.800 . 5.000 2.664 2.048 3.790 . 0 0 "[ . 1 . 2]" 1
596 1 59 ILE MD 1 91 SER QB 1.800 . 5.000 4.223 3.589 5.018 0.018 14 0 "[ . 1 . 2]" 1
597 1 59 ILE QG 1 89 PRO QB 1.800 . 5.000 3.059 2.390 3.802 . 0 0 "[ . 1 . 2]" 1
598 1 59 ILE MG 1 91 SER QB 1.800 . 5.000 3.820 3.359 4.516 . 0 0 "[ . 1 . 2]" 1
599 1 60 VAL HB 1 62 LEU MD2 1.800 . 5.000 3.749 3.344 4.150 . 0 0 "[ . 1 . 2]" 1
600 1 60 VAL HB 1 94 ILE MD 1.800 . 5.000 2.938 2.421 4.391 . 0 0 "[ . 1 . 2]" 1
601 1 60 VAL HB 1 94 ILE MG 1.800 . 5.000 2.348 2.025 2.876 . 0 0 "[ . 1 . 2]" 1
602 1 60 VAL MG1 1 92 ALA MB 1.800 . 5.000 2.182 1.788 2.986 0.012 6 0 "[ . 1 . 2]" 1
603 1 60 VAL MG1 1 94 ILE QG 1.800 . 5.000 3.962 3.477 4.340 . 0 0 "[ . 1 . 2]" 1
604 1 60 VAL MG1 1 94 ILE MG 1.800 . 5.000 2.547 2.329 2.775 . 0 0 "[ . 1 . 2]" 1
605 1 60 VAL MG2 1 62 LEU MD2 1.800 . 5.000 2.471 2.212 2.739 . 0 0 "[ . 1 . 2]" 1
606 1 62 LEU QB 1 65 ILE MD 1.800 . 5.000 4.108 2.472 5.049 0.049 18 0 "[ . 1 . 2]" 1
607 1 62 LEU QB 1 68 THR MG 1.800 . 5.000 2.223 1.771 3.626 0.029 9 0 "[ . 1 . 2]" 1
608 1 62 LEU MD1 1 68 THR HB 1.800 . 5.000 2.407 1.792 3.152 0.008 16 0 "[ . 1 . 2]" 1
609 1 62 LEU MD1 1 68 THR MG 1.800 . 5.000 2.171 1.765 2.857 0.035 17 0 "[ . 1 . 2]" 1
610 1 62 LEU MD1 1 71 LEU MD1 1.800 . 5.000 4.204 2.294 5.048 0.048 3 0 "[ . 1 . 2]" 1
611 1 62 LEU MD1 1 71 LEU MD2 1.800 . 5.000 2.815 2.070 4.505 . 0 0 "[ . 1 . 2]" 1
612 1 62 LEU MD2 1 65 ILE HB 1.800 . 5.000 3.421 2.352 4.215 . 0 0 "[ . 1 . 2]" 1
613 1 62 LEU MD2 1 65 ILE QG 1.800 . 5.000 3.844 2.231 4.590 . 0 0 "[ . 1 . 2]" 1
614 1 62 LEU MD2 1 65 ILE MG 1.800 . 5.000 3.882 2.834 4.526 . 0 0 "[ . 1 . 2]" 1
615 1 62 LEU MD2 1 68 THR MG 1.800 . 5.000 2.128 1.786 3.276 0.014 11 0 "[ . 1 . 2]" 1
616 1 62 LEU MD2 1 71 LEU MD1 1.800 . 5.000 4.153 2.549 5.007 0.007 6 0 "[ . 1 . 2]" 1
617 1 62 LEU MD2 1 71 LEU MD2 1.800 . 5.000 3.151 2.399 4.479 . 0 0 "[ . 1 . 2]" 1
618 1 62 LEU MD2 1 94 ILE MD 1.800 . 5.000 1.892 1.785 2.097 0.015 8 0 "[ . 1 . 2]" 1
619 1 62 LEU MD2 1 94 ILE QG 1.800 . 5.000 2.552 2.253 2.823 . 0 0 "[ . 1 . 2]" 1
620 1 64 GLU QB 1 93 THR MG 1.800 . 5.000 3.391 2.321 4.616 . 0 0 "[ . 1 . 2]" 1
621 1 64 GLU QG 1 93 THR MG 1.800 . 5.000 3.174 1.973 4.997 . 0 0 "[ . 1 . 2]" 1
622 1 65 ILE HB 1 68 THR MG 1.800 . 5.000 2.532 1.784 4.271 0.016 19 0 "[ . 1 . 2]" 1
623 1 65 ILE MD 1 94 ILE MD 1.800 . 5.000 2.771 2.011 4.344 . 0 0 "[ . 1 . 2]" 1
624 1 65 ILE MD 1 68 THR MG 1.800 . 5.000 3.291 2.363 4.918 . 0 0 "[ . 1 . 2]" 1
625 1 65 ILE MD 1 97 TYR QD 1.800 . 5.000 2.497 1.796 3.617 0.004 12 0 "[ . 1 . 2]" 1
626 1 65 ILE MD 1 97 TYR QE 1.800 . 5.000 2.823 2.086 3.712 . 0 0 "[ . 1 . 2]" 1
627 1 65 ILE QG 1 97 TYR QD 1.800 . 5.000 4.050 2.619 5.040 0.040 4 0 "[ . 1 . 2]" 1
628 1 65 ILE QG 1 97 TYR QE 1.800 . 5.000 4.197 2.458 4.906 . 0 0 "[ . 1 . 2]" 1
629 1 65 ILE MG 1 68 THR HB 1.800 . 5.000 4.467 3.829 4.978 . 0 0 "[ . 1 . 2]" 1
630 1 65 ILE MG 1 68 THR MG 1.800 . 5.000 2.236 1.833 3.184 . 0 0 "[ . 1 . 2]" 1
631 1 65 ILE MG 1 97 TYR QD 1.800 . 5.000 3.575 2.306 4.573 . 0 0 "[ . 1 . 2]" 1
632 1 65 ILE MG 1 97 TYR QE 1.800 . 5.000 2.455 1.797 3.482 0.003 12 0 "[ . 1 . 2]" 1
633 1 68 THR HB 1 71 LEU QB 1.800 . 5.000 3.128 2.414 4.105 . 0 0 "[ . 1 . 2]" 1
634 1 68 THR HB 1 71 LEU MD1 1.800 . 5.000 4.426 2.104 5.031 0.031 1 0 "[ . 1 . 2]" 1
635 1 68 THR HB 1 71 LEU MD2 1.800 . 5.000 3.369 2.356 5.013 0.013 18 0 "[ . 1 . 2]" 1
636 1 68 THR MG 1 71 LEU MD1 1.800 . 5.000 3.787 2.302 4.875 . 0 0 "[ . 1 . 2]" 1
637 1 68 THR MG 1 97 TYR QE 1.800 . 5.000 2.880 1.779 4.847 0.021 13 0 "[ . 1 . 2]" 1
638 1 70 ASP QB 1 99 LEU MD1 1.800 . 5.000 4.720 3.146 5.031 0.031 6 0 "[ . 1 . 2]" 1
639 1 71 LEU QB 1 97 TYR QE 1.800 . 5.000 3.559 2.048 4.975 . 0 0 "[ . 1 . 2]" 1
640 1 71 LEU MD1 1 77 ILE MD 1.800 . 5.000 2.580 1.789 4.061 0.011 11 0 "[ . 1 . 2]" 1
641 1 71 LEU MD1 1 77 ILE MG 1.800 . 5.000 2.395 1.872 4.119 . 0 0 "[ . 1 . 2]" 1
642 1 71 LEU MD1 1 97 TYR QD 1.800 . 5.000 3.313 2.569 4.219 . 0 0 "[ . 1 . 2]" 1
643 1 71 LEU MD1 1 97 TYR QE 1.800 . 5.000 2.277 1.773 3.487 0.027 16 0 "[ . 1 . 2]" 1
644 1 71 LEU MD2 1 77 ILE MD 1.800 . 5.000 2.944 1.954 4.820 . 0 0 "[ . 1 . 2]" 1
645 1 71 LEU MD2 1 97 TYR QD 1.800 . 5.000 4.092 2.900 5.047 0.047 18 0 "[ . 1 . 2]" 1
646 1 71 LEU MD2 1 97 TYR QE 1.800 . 5.000 3.329 2.072 4.373 . 0 0 "[ . 1 . 2]" 1
647 1 71 LEU HG 1 97 TYR QE 1.800 . 5.000 4.569 3.306 5.039 0.039 11 0 "[ . 1 . 2]" 1
648 1 72 LYS QB 1 75 GLU QG 1.800 . 5.000 2.716 1.812 4.197 . 0 0 "[ . 1 . 2]" 1
649 1 75 GLU QB 1 77 ILE MG 1.800 . 5.000 3.183 2.501 3.604 . 0 0 "[ . 1 . 2]" 1
650 1 75 GLU QB 1 99 LEU MD1 1.800 . 5.000 3.031 2.387 4.616 . 0 0 "[ . 1 . 2]" 1
651 1 75 GLU QB 1 99 LEU MD2 1.800 . 5.000 4.543 2.633 5.083 0.083 6 0 "[ . 1 . 2]" 1
652 1 75 GLU QG 1 99 LEU MD1 1.800 . 5.000 3.364 1.809 4.281 . 0 0 "[ . 1 . 2]" 1
653 1 75 GLU QG 1 99 LEU MD2 1.800 . 5.000 4.402 3.070 5.021 0.021 14 0 "[ . 1 . 2]" 1
654 1 76 LYS QD 1 100 LEU MD1 1.800 . 5.000 3.226 2.033 4.354 . 0 0 "[ . 1 . 2]" 1
655 1 76 LYS QE 1 100 LEU MD1 1.800 . 5.000 3.129 1.923 5.028 0.028 5 0 "[ . 1 . 2]" 1
656 1 76 LYS QG 1 100 LEU MD1 1.800 . 5.000 2.776 1.795 4.500 0.005 6 0 "[ . 1 . 2]" 1
657 1 77 ILE HB 1 79 VAL MG1 1.800 . 5.000 3.138 2.845 3.686 . 0 0 "[ . 1 . 2]" 1
658 1 77 ILE HB 1 97 TYR QB 1.800 . 5.000 2.910 2.197 3.565 . 0 0 "[ . 1 . 2]" 1
659 1 77 ILE HB 1 97 TYR QD 1.800 . 5.000 2.961 2.119 4.169 . 0 0 "[ . 1 . 2]" 1
660 1 77 ILE MD 1 79 VAL MG1 1.800 . 5.000 2.101 1.767 2.373 0.033 3 0 "[ . 1 . 2]" 1
661 1 77 ILE MD 1 97 TYR QB 1.800 . 5.000 2.822 2.311 3.765 . 0 0 "[ . 1 . 2]" 1
662 1 77 ILE MG 1 97 TYR QD 1.800 . 5.000 2.793 2.033 4.015 . 0 0 "[ . 1 . 2]" 1
663 1 77 ILE MG 1 99 LEU MD1 1.800 . 5.000 2.132 1.773 3.468 0.027 1 0 "[ . 1 . 2]" 1
664 1 77 ILE MG 1 99 LEU MD2 1.800 . 5.000 4.104 3.090 4.375 . 0 0 "[ . 1 . 2]" 1
665 1 77 ILE MG 1 99 LEU HG 1.800 . 5.000 3.835 2.235 4.202 . 0 0 "[ . 1 . 2]" 1
666 1 78 LYS QB 1 100 LEU MD1 1.800 . 5.000 2.237 1.794 3.178 0.006 12 0 "[ . 1 . 2]" 1
667 1 78 LYS QB 1 98 GLU QB 1.800 . 5.000 2.156 1.799 2.760 0.001 10 0 "[ . 1 . 2]" 1
668 1 78 LYS QD 1 80 TRP HE1 1.800 . 5.000 4.639 3.980 5.078 0.078 14 0 "[ . 1 . 2]" 1
669 1 78 LYS QD 1 80 TRP HH2 1.800 . 5.000 4.430 3.718 5.057 0.057 14 0 "[ . 1 . 2]" 1
670 1 78 LYS QD 1 80 TRP HZ2 1.800 . 5.000 3.695 2.949 4.425 . 0 0 "[ . 1 . 2]" 1
671 1 78 LYS QE 1 80 TRP HE1 1.800 . 5.000 3.155 2.137 4.620 . 0 0 "[ . 1 . 2]" 1
672 1 78 LYS QE 1 80 TRP HZ2 1.800 . 5.000 2.769 1.974 4.106 . 0 0 "[ . 1 . 2]" 1
673 1 78 LYS QG 1 100 LEU MD1 1.800 . 5.000 3.946 3.218 4.888 . 0 0 "[ . 1 . 2]" 1
674 1 79 VAL HB 1 94 ILE MD 1.800 . 5.000 2.864 2.321 3.940 . 0 0 "[ . 1 . 2]" 1
675 1 79 VAL HB 1 94 ILE MG 1.800 . 5.000 1.988 1.794 2.404 0.006 9 0 "[ . 1 . 2]" 1
676 1 79 VAL MG1 1 97 TYR QB 1.800 . 5.000 1.986 1.781 2.379 0.019 3 0 "[ . 1 . 2]" 1
677 1 79 VAL MG1 1 97 TYR QD 1.800 . 5.000 3.438 2.687 3.998 . 0 0 "[ . 1 . 2]" 1
678 1 79 VAL MG2 1 81 PHE QB 1.800 . 5.000 3.751 2.909 4.333 . 0 0 "[ . 1 . 2]" 1
679 1 79 VAL MG2 1 81 PHE QD 1.800 . 5.000 2.576 2.119 3.896 . 0 0 "[ . 1 . 2]" 1
680 1 79 VAL MG2 1 81 PHE QE 1.800 . 5.000 3.159 2.422 4.626 . 0 0 "[ . 1 . 2]" 1
681 1 80 TRP QB 1 96 LYS QB 1.800 . 5.000 2.572 2.015 3.134 . 0 0 "[ . 1 . 2]" 1
682 1 80 TRP QB 1 96 LYS QG 1.800 . 5.000 4.176 3.821 4.657 . 0 0 "[ . 1 . 2]" 1
683 1 80 TRP HE3 1 96 LYS QB 1.800 . 5.000 2.111 1.736 2.590 0.064 11 0 "[ . 1 . 2]" 1
684 1 80 TRP HE3 1 96 LYS QG 1.800 . 5.000 3.299 2.231 4.361 . 0 0 "[ . 1 . 2]" 1
685 1 80 TRP HH2 1 98 GLU QB 1.800 . 5.000 2.972 1.903 4.596 . 0 0 "[ . 1 . 2]" 1
686 1 80 TRP HH2 1 98 GLU QG 1.800 . 5.000 3.165 2.128 4.148 . 0 0 "[ . 1 . 2]" 1
687 1 80 TRP HZ3 1 96 LYS QB 1.800 . 5.000 3.462 2.728 4.171 . 0 0 "[ . 1 . 2]" 1
688 1 80 TRP HZ3 1 98 GLU QB 1.800 . 5.000 3.313 2.098 4.963 . 0 0 "[ . 1 . 2]" 1
689 1 80 TRP HZ3 1 98 GLU QG 1.800 . 5.000 3.641 2.234 4.688 . 0 0 "[ . 1 . 2]" 1
690 1 81 PHE QB 1 92 ALA MB 1.800 . 5.000 2.653 2.151 3.323 . 0 0 "[ . 1 . 2]" 1
691 1 81 PHE QB 1 94 ILE MG 1.800 . 5.000 1.953 1.768 2.539 0.032 14 0 "[ . 1 . 2]" 1
692 1 81 PHE QD 1 92 ALA MB 1.800 . 5.000 2.720 1.780 3.514 0.020 18 0 "[ . 1 . 2]" 1
693 1 81 PHE QD 1 94 ILE MG 1.800 . 5.000 2.769 2.034 3.758 . 0 0 "[ . 1 . 2]" 1
694 1 81 PHE QE 1 84 ARG QB 1.800 . 5.000 3.351 1.792 4.828 0.008 19 0 "[ . 1 . 2]" 1
695 1 81 PHE QE 1 84 ARG QD 1.800 . 5.000 3.069 1.882 5.001 0.001 6 0 "[ . 1 . 2]" 1
696 1 81 PHE QE 1 84 ARG QG 1.800 . 5.000 3.456 2.413 4.711 . 0 0 "[ . 1 . 2]" 1
697 1 84 ARG QB 1 92 ALA MB 1.800 . 5.000 3.360 2.181 4.482 . 0 0 "[ . 1 . 2]" 1
698 1 84 ARG QD 1 92 ALA MB 1.800 . 5.000 3.853 2.641 5.008 0.008 13 0 "[ . 1 . 2]" 1
699 1 84 ARG QG 1 90 PRO QB 1.800 . 5.000 4.033 2.571 5.046 0.046 15 0 "[ . 1 . 2]" 1
700 1 84 ARG QG 1 92 ALA MB 1.800 . 5.000 2.922 1.777 5.006 0.023 4 0 "[ . 1 . 2]" 1
701 1 85 LYS QB 1 87 SER QB 1.800 . 5.000 4.170 2.685 5.036 0.036 19 0 "[ . 1 . 2]" 1
702 1 85 LYS QG 1 87 SER QB 1.800 . 5.000 3.917 2.545 5.036 0.036 12 0 "[ . 1 . 2]" 1
703 1 92 ALA MB 1 94 ILE MG 1.800 . 5.000 3.078 2.814 3.475 . 0 0 "[ . 1 . 2]" 1
704 1 93 THR MG 1 95 GLN QE 1.800 . 5.000 4.450 3.324 5.038 0.038 2 0 "[ . 1 . 2]" 1
705 1 94 ILE MD 1 97 TYR QB 1.800 . 5.000 2.276 1.856 2.680 . 0 0 "[ . 1 . 2]" 1
706 1 94 ILE MD 1 97 TYR QD 1.800 . 5.000 2.991 1.800 3.860 . 0 0 "[ . 1 . 2]" 1
707 1 97 TYR QD 1 99 LEU QB 1.800 . 5.000 4.170 3.639 4.971 . 0 0 "[ . 1 . 2]" 1
708 1 97 TYR QD 1 99 LEU MD1 1.800 . 5.000 4.308 3.846 5.035 0.035 4 0 "[ . 1 . 2]" 1
709 1 97 TYR QE 1 99 LEU MD1 1.800 . 5.000 3.603 2.699 5.012 0.012 8 0 "[ . 1 . 2]" 1
710 1 98 GLU QB 1 100 LEU MD2 1.800 . 5.000 3.187 2.575 3.855 . 0 0 "[ . 1 . 2]" 1
711 1 98 GLU QG 1 100 LEU MD2 1.800 . 5.000 3.441 2.355 4.746 . 0 0 "[ . 1 . 2]" 1
712 1 12 LYS HA 1 12 LYS QD 1.800 . 5.000 4.012 3.754 4.231 . 0 0 "[ . 1 . 2]" 1
713 1 12 LYS QB 1 12 LYS QD 1.800 . 5.000 2.151 2.086 2.335 . 0 0 "[ . 1 . 2]" 1
714 1 12 LYS H 1 12 LYS QD 1.800 . 5.000 4.207 3.835 4.794 . 0 0 "[ . 1 . 2]" 1
715 1 12 LYS H 1 12 LYS HG3 1.800 . 5.000 3.207 2.339 4.719 . 0 0 "[ . 1 . 2]" 1
716 1 12 LYS H 1 12 LYS HG2 1.800 . 5.000 3.846 2.355 4.655 . 0 0 "[ . 1 . 2]" 1
717 1 13 MET H 1 13 MET QG 1.800 . 5.000 2.551 2.295 3.083 . 0 0 "[ . 1 . 2]" 1
718 1 14 GLN QB 1 14 GLN QE 1.800 . 5.000 3.358 1.755 3.729 0.045 12 0 "[ . 1 . 2]" 1
719 1 14 GLN H 1 14 GLN QG 1.800 . 5.000 2.961 2.254 4.094 . 0 0 "[ . 1 . 2]" 1
720 1 16 LEU HA 1 16 LEU MD1 1.800 . 5.000 3.065 2.051 3.897 . 0 0 "[ . 1 . 2]" 1
721 1 16 LEU QB 1 16 LEU MD1 1.800 . 5.000 2.211 2.044 2.360 . 0 0 "[ . 1 . 2]" 1
722 1 16 LEU QB 1 16 LEU MD2 1.800 . 5.000 2.328 2.077 2.446 . 0 0 "[ . 1 . 2]" 1
723 1 16 LEU H 1 16 LEU MD1 1.800 . 5.000 4.229 2.682 4.555 . 0 0 "[ . 1 . 2]" 1
724 1 16 LEU H 1 16 LEU MD2 1.800 . 5.000 4.198 3.973 4.657 . 0 0 "[ . 1 . 2]" 1
725 1 16 LEU H 1 16 LEU HG 1.800 . 5.000 4.675 3.177 5.039 0.039 20 0 "[ . 1 . 2]" 1
726 1 17 VAL H 1 17 VAL HB 1.800 . 4.000 2.583 2.461 2.841 . 0 0 "[ . 1 . 2]" 1
727 1 17 VAL H 1 17 VAL MG1 1.800 . 5.000 3.632 1.957 3.894 . 0 0 "[ . 1 . 2]" 1
728 1 17 VAL H 1 17 VAL MG2 1.800 . 4.000 2.565 2.270 3.818 . 0 0 "[ . 1 . 2]" 1
729 1 19 TYR HA 1 19 TYR QD 1.800 . 5.000 2.895 2.125 3.090 . 0 0 "[ . 1 . 2]" 1
730 1 19 TYR H 1 19 TYR QD 1.800 . 5.000 2.614 2.265 3.460 . 0 0 "[ . 1 . 2]" 1
731 1 20 VAL H 1 20 VAL MG1 1.800 . 5.000 3.805 3.789 3.843 . 0 0 "[ . 1 . 2]" 1
732 1 20 VAL H 1 20 VAL MG2 1.800 . 5.000 2.077 1.996 2.292 . 0 0 "[ . 1 . 2]" 1
733 1 22 LEU HA 1 22 LEU MD2 1.800 . 4.000 2.481 1.942 3.884 . 0 0 "[ . 1 . 2]" 1
734 1 22 LEU QB 1 22 LEU MD1 1.800 . 5.000 2.147 2.089 2.332 . 0 0 "[ . 1 . 2]" 1
735 1 22 LEU QB 1 22 LEU MD2 1.800 . 5.000 2.247 2.088 2.339 . 0 0 "[ . 1 . 2]" 1
736 1 22 LEU H 1 22 LEU MD2 1.800 . 5.000 4.064 3.645 4.650 . 0 0 "[ . 1 . 2]" 1
737 1 23 LYS QB 1 23 LYS QD 1.800 . 5.000 2.136 2.093 2.274 . 0 0 "[ . 1 . 2]" 1
738 1 23 LYS QB 1 23 LYS QE 1.800 . 5.000 3.551 2.146 3.689 . 0 0 "[ . 1 . 2]" 1
739 1 23 LYS H 1 23 LYS QG 1.800 . 5.000 3.899 2.543 4.152 . 0 0 "[ . 1 . 2]" 1
740 1 26 GLU H 1 26 GLU QG 1.800 . 5.000 2.648 2.090 4.029 . 0 0 "[ . 1 . 2]" 1
741 1 27 ARG H 1 27 ARG QD 1.800 . 5.000 4.225 2.190 4.753 . 0 0 "[ . 1 . 2]" 1
742 1 27 ARG H 1 27 ARG QG 1.800 . 5.000 2.987 2.159 3.857 . 0 0 "[ . 1 . 2]" 1
743 1 29 ILE QG 1 29 ILE MG 1.800 . 5.000 2.348 2.305 2.395 . 0 0 "[ . 1 . 2]" 1
744 1 29 ILE MD 1 29 ILE MG 1.800 . 5.000 1.923 1.872 1.959 . 0 0 "[ . 1 . 2]" 1
745 1 29 ILE H 1 29 ILE MD 1.800 . 5.000 3.867 3.727 4.093 . 0 0 "[ . 1 . 2]" 1
746 1 29 ILE H 1 29 ILE HG13 1.800 . 5.000 2.569 2.295 2.939 . 0 0 "[ . 1 . 2]" 1
747 1 29 ILE H 1 29 ILE HG12 1.800 . 5.000 3.709 3.484 3.971 . 0 0 "[ . 1 . 2]" 1
748 1 30 LEU HA 1 30 LEU MD1 1.800 . 5.000 3.781 2.075 3.906 . 0 0 "[ . 1 . 2]" 1
749 1 30 LEU HA 1 30 LEU MD2 1.800 . 5.000 2.157 2.085 2.296 . 0 0 "[ . 1 . 2]" 1
750 1 30 LEU H 1 30 LEU MD1 1.800 . 5.000 3.966 3.871 4.197 . 0 0 "[ . 1 . 2]" 1
751 1 30 LEU H 1 30 LEU MD2 1.800 . 5.000 3.347 2.796 3.562 . 0 0 "[ . 1 . 2]" 1
752 1 30 LEU H 1 30 LEU HG 1.800 . 5.000 2.725 2.505 4.271 . 0 0 "[ . 1 . 2]" 1
753 1 31 ILE HA 1 31 ILE MD 1.800 . 5.000 3.814 3.698 3.914 . 0 0 "[ . 1 . 2]" 1
754 1 31 ILE QG 1 31 ILE MG 1.800 . 5.000 2.349 2.286 2.421 . 0 0 "[ . 1 . 2]" 1
755 1 31 ILE H 1 31 ILE MD 1.800 . 5.000 3.904 3.733 4.144 . 0 0 "[ . 1 . 2]" 1
756 1 31 ILE H 1 31 ILE QG 1.800 . 5.000 2.594 2.289 2.973 . 0 0 "[ . 1 . 2]" 1
757 1 32 THR H 1 32 THR MG 1.800 . 5.000 2.667 2.281 3.438 . 0 0 "[ . 1 . 2]" 1
758 1 34 THR H 1 34 THR MG 1.800 . 5.000 3.043 1.783 4.022 0.017 8 0 "[ . 1 . 2]" 1
759 1 35 LYS HA 1 35 LYS QD 1.800 . 5.000 3.701 1.938 4.087 . 0 0 "[ . 1 . 2]" 1
760 1 35 LYS HA 1 35 LYS QE 1.800 . 5.000 4.700 3.965 5.040 0.040 1 0 "[ . 1 . 2]" 1
761 1 35 LYS QB 1 35 LYS QD 1.800 . 5.000 2.169 2.096 2.425 . 0 0 "[ . 1 . 2]" 1
762 1 35 LYS H 1 35 LYS QD 1.800 . 5.000 4.455 2.645 5.027 0.027 15 0 "[ . 1 . 2]" 1
763 1 35 LYS H 1 35 LYS QG 1.800 . 5.000 3.387 2.334 4.147 . 0 0 "[ . 1 . 2]" 1
764 1 39 LYS HA 1 39 LYS QD 1.800 . 5.000 3.552 1.978 4.266 . 0 0 "[ . 1 . 2]" 1
765 1 39 LYS QB 1 39 LYS QE 1.800 . 5.000 3.547 1.971 3.772 . 0 0 "[ . 1 . 2]" 1
766 1 39 LYS H 1 39 LYS QD 1.800 . 5.000 4.299 3.705 4.609 . 0 0 "[ . 1 . 2]" 1
767 1 39 LYS H 1 39 LYS QG 1.800 . 5.000 3.874 2.043 4.061 . 0 0 "[ . 1 . 2]" 1
768 1 40 GLU H 1 40 GLU QG 1.800 . 5.000 2.715 1.774 3.962 0.026 15 0 "[ . 1 . 2]" 1
769 1 42 TYR HA 1 42 TYR QD 1.800 . 5.000 2.610 2.302 2.969 . 0 0 "[ . 1 . 2]" 1
770 1 42 TYR H 1 42 TYR QD 1.800 . 5.000 2.792 2.405 3.066 . 0 0 "[ . 1 . 2]" 1
771 1 42 TYR H 1 42 TYR QE 1.800 . 5.000 4.604 4.461 4.797 . 0 0 "[ . 1 . 2]" 1
772 1 44 LEU HA 1 44 LEU MD1 1.800 . 5.000 3.849 3.823 3.874 . 0 0 "[ . 1 . 2]" 1
773 1 44 LEU HA 1 44 LEU MD2 1.800 . 4.000 2.001 1.956 2.055 . 0 0 "[ . 1 . 2]" 1
774 1 44 LEU QB 1 44 LEU MD1 1.800 . 5.000 2.093 2.083 2.099 . 0 0 "[ . 1 . 2]" 1
775 1 44 LEU QB 1 44 LEU MD2 1.800 . 5.000 2.329 2.303 2.365 . 0 0 "[ . 1 . 2]" 1
776 1 44 LEU H 1 44 LEU MD1 1.800 . 5.000 3.679 3.601 3.744 . 0 0 "[ . 1 . 2]" 1
777 1 44 LEU H 1 44 LEU MD2 1.800 . 5.000 3.312 3.158 3.477 . 0 0 "[ . 1 . 2]" 1
778 1 44 LEU H 1 44 LEU HG 1.800 . 5.000 2.353 2.200 2.539 . 0 0 "[ . 1 . 2]" 1
779 1 46 GLU H 1 46 GLU QG 1.800 . 5.000 3.592 2.621 3.967 . 0 0 "[ . 1 . 2]" 1
780 1 48 GLN HA 1 48 GLN QE 1.800 . 5.000 4.294 3.449 4.693 . 0 0 "[ . 1 . 2]" 1
781 1 48 GLN QB 1 48 GLN QE 1.800 . 5.000 3.545 3.448 3.737 . 0 0 "[ . 1 . 2]" 1
782 1 48 GLN H 1 48 GLN QG 1.800 . 5.000 2.225 1.992 2.447 . 0 0 "[ . 1 . 2]" 1
783 1 49 LEU HA 1 49 LEU MD1 1.800 . 5.000 2.769 1.939 3.863 . 0 0 "[ . 1 . 2]" 1
784 1 49 LEU HA 1 49 LEU MD2 1.800 . 4.000 3.175 1.898 3.917 . 0 0 "[ . 1 . 2]" 1
785 1 49 LEU QB 1 49 LEU MD1 1.800 . 5.000 2.189 2.075 2.277 . 0 0 "[ . 1 . 2]" 1
786 1 49 LEU QB 1 49 LEU MD2 1.800 . 5.000 2.168 2.082 2.339 . 0 0 "[ . 1 . 2]" 1
787 1 49 LEU H 1 49 LEU MD1 1.800 . 5.000 3.876 3.569 4.167 . 0 0 "[ . 1 . 2]" 1
788 1 49 LEU H 1 49 LEU MD2 1.800 . 5.000 3.973 3.157 4.274 . 0 0 "[ . 1 . 2]" 1
789 1 49 LEU H 1 49 LEU HG 1.800 . 5.000 3.780 2.228 4.541 . 0 0 "[ . 1 . 2]" 1
790 1 50 MET HA 1 50 MET ME 1.800 . 5.000 4.092 3.817 4.682 . 0 0 "[ . 1 . 2]" 1
791 1 50 MET H 1 50 MET ME 1.800 . 5.000 4.284 3.484 4.731 . 0 0 "[ . 1 . 2]" 1
792 1 50 MET H 1 50 MET QG 1.800 . 5.000 2.987 2.156 3.969 . 0 0 "[ . 1 . 2]" 1
793 1 52 LYS HA 1 52 LYS QE 1.800 . 5.000 4.627 3.837 5.032 0.032 7 0 "[ . 1 . 2]" 1
794 1 52 LYS QB 1 52 LYS QE 1.800 . 5.000 3.467 1.934 3.681 . 0 0 "[ . 1 . 2]" 1
795 1 52 LYS H 1 52 LYS QG 1.800 . 5.000 3.903 2.301 4.031 . 0 0 "[ . 1 . 2]" 1
796 1 53 PHE H 1 53 PHE QD 1.800 . 5.000 2.710 2.327 3.054 . 0 0 "[ . 1 . 2]" 1
797 1 54 LYS HA 1 54 LYS QD 1.800 . 5.000 3.849 1.962 4.053 . 0 0 "[ . 1 . 2]" 1
798 1 54 LYS HA 1 54 LYS QE 1.800 . 5.000 4.655 3.871 5.023 0.023 20 0 "[ . 1 . 2]" 1
799 1 54 LYS QB 1 54 LYS QE 1.800 . 5.000 3.514 1.914 3.867 . 0 0 "[ . 1 . 2]" 1
800 1 54 LYS H 1 54 LYS QD 1.800 . 5.000 4.267 3.773 4.559 . 0 0 "[ . 1 . 2]" 1
801 1 54 LYS H 1 54 LYS QG 1.800 . 5.000 3.826 2.007 4.054 . 0 0 "[ . 1 . 2]" 1
802 1 57 ILE HA 1 57 ILE HB 1.800 . 2.800 2.448 2.380 2.611 . 0 0 "[ . 1 . 2]" 1
803 1 57 ILE HA 1 57 ILE MD 1.800 . 5.000 3.785 3.670 3.846 . 0 0 "[ . 1 . 2]" 1
804 1 57 ILE QG 1 57 ILE MG 1.800 . 5.000 2.326 2.268 2.359 . 0 0 "[ . 1 . 2]" 1
805 1 57 ILE MD 1 57 ILE MG 1.800 . 5.000 1.918 1.864 1.996 . 0 0 "[ . 1 . 2]" 1
806 1 57 ILE H 1 57 ILE MD 1.800 . 5.000 4.569 4.416 4.691 . 0 0 "[ . 1 . 2]" 1
807 1 57 ILE H 1 57 ILE QG 1.800 . 5.000 4.030 3.948 4.123 . 0 0 "[ . 1 . 2]" 1
808 1 58 VAL HA 1 58 VAL MG1 1.800 . 3.000 2.445 2.378 2.526 . 0 0 "[ . 1 . 2]" 1
809 1 58 VAL H 1 58 VAL MG1 1.800 . 5.000 3.851 3.794 3.886 . 0 0 "[ . 1 . 2]" 1
810 1 58 VAL H 1 58 VAL MG2 1.800 . 5.000 2.888 2.725 3.127 . 0 0 "[ . 1 . 2]" 1
811 1 59 ILE HA 1 59 ILE MD 1.800 . 5.000 3.780 2.252 3.902 . 0 0 "[ . 1 . 2]" 1
812 1 59 ILE H 1 59 ILE MD 1.800 . 5.000 3.724 3.200 3.837 . 0 0 "[ . 1 . 2]" 1
813 1 59 ILE H 1 59 ILE QG 1.800 . 5.000 2.358 2.243 2.484 . 0 0 "[ . 1 . 2]" 1
814 1 60 VAL HA 1 60 VAL MG1 1.800 . 3.000 2.332 2.291 2.373 . 0 0 "[ . 1 . 2]" 1
815 1 60 VAL H 1 60 VAL MG1 1.800 . 5.000 2.506 2.286 2.661 . 0 0 "[ . 1 . 2]" 1
816 1 60 VAL H 1 60 VAL MG2 1.800 . 5.000 1.992 1.924 2.090 . 0 0 "[ . 1 . 2]" 1
817 1 62 LEU HA 1 62 LEU MD2 1.800 . 4.000 2.105 1.969 2.357 . 0 0 "[ . 1 . 2]" 1
818 1 62 LEU QB 1 62 LEU MD1 1.800 . 5.000 2.091 2.079 2.105 . 0 0 "[ . 1 . 2]" 1
819 1 62 LEU H 1 62 LEU MD1 1.800 . 5.000 3.743 3.451 3.972 . 0 0 "[ . 1 . 2]" 1
820 1 62 LEU H 1 62 LEU MD2 1.800 . 5.000 3.488 3.271 3.729 . 0 0 "[ . 1 . 2]" 1
821 1 62 LEU H 1 62 LEU HG 1.800 . 5.000 2.523 2.253 2.922 . 0 0 "[ . 1 . 2]" 1
822 1 64 GLU H 1 64 GLU QG 1.800 . 5.000 3.045 1.874 4.144 . 0 0 "[ . 1 . 2]" 1
823 1 65 ILE HA 1 65 ILE MD 1.800 . 5.000 3.510 2.026 3.927 . 0 0 "[ . 1 . 2]" 1
824 1 65 ILE QG 1 65 ILE MG 1.800 . 5.000 2.317 2.286 2.348 . 0 0 "[ . 1 . 2]" 1
825 1 65 ILE H 1 65 ILE MD 1.800 . 5.000 3.855 3.537 4.327 . 0 0 "[ . 1 . 2]" 1
826 1 65 ILE H 1 65 ILE QG 1.800 . 5.000 2.572 2.245 3.034 . 0 0 "[ . 1 . 2]" 1
827 1 68 THR H 1 68 THR MG 1.800 . 5.000 2.901 2.317 3.896 . 0 0 "[ . 1 . 2]" 1
828 1 71 LEU HA 1 71 LEU MD1 1.800 . 5.000 2.357 1.930 3.901 . 0 0 "[ . 1 . 2]" 1
829 1 71 LEU HA 1 71 LEU MD2 1.800 . 5.000 3.600 1.962 3.917 . 0 0 "[ . 1 . 2]" 1
830 1 71 LEU QB 1 71 LEU MD1 1.800 . 5.000 2.245 2.074 2.385 . 0 0 "[ . 1 . 2]" 1
831 1 71 LEU H 1 71 LEU MD1 1.800 . 5.000 3.801 1.828 4.359 . 0 0 "[ . 1 . 2]" 1
832 1 71 LEU H 1 71 LEU MD2 1.800 . 5.000 4.040 1.877 4.339 . 0 0 "[ . 1 . 2]" 1
833 1 71 LEU H 1 71 LEU HG 1.800 . 5.000 4.208 2.294 4.565 . 0 0 "[ . 1 . 2]" 1
834 1 72 LYS HA 1 72 LYS QE 1.800 . 5.000 4.843 4.097 5.076 0.076 2 0 "[ . 1 . 2]" 1
835 1 72 LYS QB 1 72 LYS QD 1.800 . 5.000 2.114 2.016 2.280 . 0 0 "[ . 1 . 2]" 1
836 1 72 LYS H 1 72 LYS QG 1.800 . 5.000 2.881 2.347 4.197 . 0 0 "[ . 1 . 2]" 1
837 1 73 ARG QB 1 73 ARG HE 1.800 . 5.000 3.533 2.029 4.011 . 0 0 "[ . 1 . 2]" 1
838 1 73 ARG H 1 73 ARG QD 1.800 . 5.000 4.113 3.736 4.615 . 0 0 "[ . 1 . 2]" 1
839 1 73 ARG H 1 73 ARG QG 1.800 . 5.000 2.659 2.011 3.989 . 0 0 "[ . 1 . 2]" 1
840 1 75 GLU H 1 75 GLU QG 1.800 . 5.000 3.310 2.559 4.351 . 0 0 "[ . 1 . 2]" 1
841 1 76 LYS QB 1 76 LYS QD 1.800 . 5.000 2.126 2.088 2.309 . 0 0 "[ . 1 . 2]" 1
842 1 76 LYS QB 1 76 LYS QE 1.800 . 5.000 3.456 1.976 3.648 . 0 0 "[ . 1 . 2]" 1
843 1 76 LYS H 1 76 LYS QD 1.800 . 5.000 4.579 4.122 4.788 . 0 0 "[ . 1 . 2]" 1
844 1 77 ILE HA 1 77 ILE MD 1.800 . 5.000 4.155 3.628 4.192 . 0 0 "[ . 1 . 2]" 1
845 1 77 ILE MD 1 77 ILE MG 1.800 . 5.000 1.989 1.882 3.226 . 0 0 "[ . 1 . 2]" 1
846 1 77 ILE H 1 77 ILE MD 1.800 . 5.000 3.924 2.736 4.051 . 0 0 "[ . 1 . 2]" 1
847 1 77 ILE H 1 77 ILE QG 1.800 . 5.000 2.285 2.155 2.365 . 0 0 "[ . 1 . 2]" 1
848 1 78 LYS QB 1 78 LYS QD 1.800 . 5.000 2.131 2.028 2.368 . 0 0 "[ . 1 . 2]" 1
849 1 78 LYS QB 1 78 LYS QE 1.800 . 5.000 3.244 1.784 3.651 0.016 19 0 "[ . 1 . 2]" 1
850 1 78 LYS H 1 78 LYS QG 1.800 . 5.000 3.972 3.827 4.061 . 0 0 "[ . 1 . 2]" 1
851 1 79 VAL HA 1 79 VAL MG1 1.800 . 3.000 2.348 2.296 2.437 . 0 0 "[ . 1 . 2]" 1
852 1 79 VAL H 1 79 VAL MG1 1.800 . 5.000 2.584 2.372 2.764 . 0 0 "[ . 1 . 2]" 1
853 1 79 VAL H 1 79 VAL MG2 1.800 . 5.000 2.009 1.925 2.174 . 0 0 "[ . 1 . 2]" 1
854 1 80 TRP HA 1 80 TRP HD1 1.800 . 5.000 2.764 2.400 3.015 . 0 0 "[ . 1 . 2]" 1
855 1 80 TRP H 1 80 TRP HE3 1.800 . 5.000 3.335 2.959 3.903 . 0 0 "[ . 1 . 2]" 1
856 1 81 PHE HA 1 81 PHE QD 1.800 . 5.000 3.714 3.525 3.746 . 0 0 "[ . 1 . 2]" 1
857 1 81 PHE H 1 81 PHE QD 1.800 . 5.000 2.712 1.774 3.208 0.026 11 0 "[ . 1 . 2]" 1
858 1 83 THR H 1 83 THR MG 1.800 . 5.000 3.306 1.990 3.974 . 0 0 "[ . 1 . 2]" 1
859 1 84 ARG QB 1 84 ARG HE 1.800 . 5.000 3.014 1.818 4.103 . 0 0 "[ . 1 . 2]" 1
860 1 84 ARG H 1 84 ARG QG 1.800 . 5.000 3.463 2.175 4.165 . 0 0 "[ . 1 . 2]" 1
861 1 85 LYS HA 1 85 LYS QD 1.800 . 5.000 3.690 2.036 4.069 . 0 0 "[ . 1 . 2]" 1
862 1 85 LYS QB 1 85 LYS QE 1.800 . 5.000 3.528 1.991 3.850 . 0 0 "[ . 1 . 2]" 1
863 1 85 LYS H 1 85 LYS QG 1.800 . 5.000 3.677 2.306 4.129 . 0 0 "[ . 1 . 2]" 1
864 1 86 GLU H 1 86 GLU QG 1.800 . 5.000 3.085 2.195 4.101 . 0 0 "[ . 1 . 2]" 1
865 1 93 THR H 1 93 THR MG 1.800 . 5.000 3.792 3.737 3.931 . 0 0 "[ . 1 . 2]" 1
866 1 94 ILE QG 1 94 ILE MG 1.800 . 5.000 2.309 2.069 2.348 . 0 0 "[ . 1 . 2]" 1
867 1 94 ILE MD 1 94 ILE MG 1.800 . 5.000 1.986 1.871 3.123 . 0 0 "[ . 1 . 2]" 1
868 1 94 ILE H 1 94 ILE MD 1.800 . 5.000 3.722 3.388 3.966 . 0 0 "[ . 1 . 2]" 1
869 1 94 ILE H 1 94 ILE QG 1.800 . 5.000 2.023 1.908 2.299 . 0 0 "[ . 1 . 2]" 1
870 1 95 GLN H 1 95 GLN QG 1.800 . 5.000 2.692 2.350 2.928 . 0 0 "[ . 1 . 2]" 1
871 1 96 LYS QB 1 96 LYS HD3 1.800 . 5.000 2.398 2.265 2.537 . 0 0 "[ . 1 . 2]" 1
872 1 96 LYS QB 1 96 LYS HD2 1.800 . 5.000 2.434 2.231 2.891 . 0 0 "[ . 1 . 2]" 1
873 1 96 LYS QE 1 96 LYS HG3 1.800 . 5.000 2.574 2.286 2.962 . 0 0 "[ . 1 . 2]" 1
874 1 96 LYS QE 1 96 LYS HG2 1.800 . 5.000 2.556 2.303 3.059 . 0 0 "[ . 1 . 2]" 1
875 1 96 LYS H 1 96 LYS QG 1.800 . 5.000 3.756 2.800 4.380 . 0 0 "[ . 1 . 2]" 1
876 1 97 TYR HA 1 97 TYR QD 1.800 . 5.000 3.708 3.520 3.756 . 0 0 "[ . 1 . 2]" 1
877 1 97 TYR H 1 97 TYR QD 1.800 . 5.000 2.464 1.797 2.972 0.003 1 0 "[ . 1 . 2]" 1
878 1 97 TYR H 1 97 TYR QE 1.800 . 5.000 4.241 3.879 4.755 . 0 0 "[ . 1 . 2]" 1
879 1 98 GLU H 1 98 GLU QG 1.800 . 5.000 3.646 2.752 4.165 . 0 0 "[ . 1 . 2]" 1
880 1 99 LEU HA 1 99 LEU MD1 1.800 . 5.000 2.234 1.972 3.763 . 0 0 "[ . 1 . 2]" 1
881 1 99 LEU HA 1 99 LEU MD2 1.800 . 4.000 3.780 2.670 3.915 . 0 0 "[ . 1 . 2]" 1
882 1 99 LEU QB 1 99 LEU MD1 1.800 . 5.000 2.264 2.066 2.325 . 0 0 "[ . 1 . 2]" 1
883 1 99 LEU QB 1 99 LEU MD2 1.800 . 5.000 2.112 2.086 2.291 . 0 0 "[ . 1 . 2]" 1
884 1 99 LEU H 1 99 LEU MD1 1.800 . 5.000 4.127 3.987 4.208 . 0 0 "[ . 1 . 2]" 1
885 1 99 LEU H 1 99 LEU MD2 1.800 . 5.000 4.280 4.223 4.382 . 0 0 "[ . 1 . 2]" 1
886 1 99 LEU H 1 99 LEU HG 1.800 . 5.000 4.462 4.318 4.542 . 0 0 "[ . 1 . 2]" 1
887 1 100 LEU HA 1 100 LEU MD1 1.800 . 5.000 3.859 3.824 3.891 . 0 0 "[ . 1 . 2]" 1
888 1 100 LEU HA 1 100 LEU MD2 1.800 . 4.000 2.043 1.966 2.117 . 0 0 "[ . 1 . 2]" 1
889 1 100 LEU QB 1 100 LEU MD1 1.800 . 5.000 2.097 2.089 2.103 . 0 0 "[ . 1 . 2]" 1
890 1 100 LEU QB 1 100 LEU MD2 1.800 . 5.000 2.328 2.306 2.358 . 0 0 "[ . 1 . 2]" 1
891 1 100 LEU H 1 100 LEU MD1 1.800 . 5.000 3.827 3.636 4.135 . 0 0 "[ . 1 . 2]" 1
892 1 100 LEU H 1 100 LEU MD2 1.800 . 5.000 3.451 3.119 3.699 . 0 0 "[ . 1 . 2]" 1
893 1 100 LEU H 1 100 LEU HG 1.800 . 5.000 2.576 2.278 3.021 . 0 0 "[ . 1 . 2]" 1
894 1 101 LEU HA 1 101 LEU MD1 1.800 . 5.000 3.022 1.844 3.875 . 0 0 "[ . 1 . 2]" 1
895 1 101 LEU HA 1 101 LEU MD2 1.800 . 5.000 2.790 1.949 3.884 . 0 0 "[ . 1 . 2]" 1
896 1 101 LEU QB 1 101 LEU MD1 1.800 . 5.000 2.187 2.094 2.360 . 0 0 "[ . 1 . 2]" 1
897 1 101 LEU H 1 101 LEU MD1 1.800 . 5.000 3.838 3.220 4.372 . 0 0 "[ . 1 . 2]" 1
898 1 101 LEU H 1 101 LEU MD2 1.800 . 5.000 3.716 2.402 4.776 . 0 0 "[ . 1 . 2]" 1
899 1 101 LEU H 1 101 LEU HG 1.800 . 5.000 3.356 2.098 4.728 . 0 0 "[ . 1 . 2]" 1
900 1 102 GLU H 1 102 GLU QG 1.800 . 5.000 2.882 1.796 4.135 0.004 5 0 "[ . 1 . 2]" 1
901 1 17 VAL MG1 1 18 GLY QA 1.800 . 5.000 3.362 3.234 3.732 . 0 0 "[ . 1 . 2]" 1
902 1 18 GLY QA 1 19 TYR QD 1.800 . 5.000 3.465 3.077 4.382 . 0 0 "[ . 1 . 2]" 1
903 1 19 TYR HA 1 20 VAL MG2 1.800 . 5.000 3.451 3.345 3.640 . 0 0 "[ . 1 . 2]" 1
904 1 25 ASN QB 1 26 GLU QB 1.800 . 5.000 4.011 3.571 4.455 . 0 0 "[ . 1 . 2]" 1
905 1 25 ASN QB 1 26 GLU QG 1.800 . 5.000 3.011 2.311 5.000 . 0 0 "[ . 1 . 2]" 1
906 1 26 GLU QB 1 27 ARG QB 1.800 . 5.000 3.939 3.416 4.527 . 0 0 "[ . 1 . 2]" 1
907 1 26 GLU QB 1 27 ARG QD 1.800 . 5.000 3.925 2.295 4.822 . 0 0 "[ . 1 . 2]" 1
908 1 26 GLU QB 1 27 ARG QG 1.800 . 5.000 2.937 2.181 4.122 . 0 0 "[ . 1 . 2]" 1
909 1 28 ALA HA 1 29 ILE QG 1.800 . 5.000 3.619 3.279 3.912 . 0 0 "[ . 1 . 2]" 1
910 1 28 ALA MB 1 29 ILE HA 1.800 . 5.000 4.251 4.122 4.348 . 0 0 "[ . 1 . 2]" 1
911 1 28 ALA MB 1 29 ILE QG 1.800 . 5.000 4.539 4.302 4.758 . 0 0 "[ . 1 . 2]" 1
912 1 31 ILE HA 1 32 THR MG 1.800 . 5.000 3.982 3.634 5.001 0.001 19 0 "[ . 1 . 2]" 1
913 1 36 ALA MB 1 37 PRO HA 1.800 . 5.000 4.574 4.348 4.753 . 0 0 "[ . 1 . 2]" 1
914 1 36 ALA MB 1 37 PRO HD3 1.800 . 5.000 3.551 2.999 4.189 . 0 0 "[ . 1 . 2]" 1
915 1 36 ALA MB 1 37 PRO HD2 1.800 . 5.000 3.021 2.204 3.520 . 0 0 "[ . 1 . 2]" 1
916 1 37 PRO QB 1 38 GLY QA 1.800 . 5.000 3.914 3.546 4.103 . 0 0 "[ . 1 . 2]" 1
917 1 39 LYS QB 1 40 GLU HA 1.800 . 5.000 4.197 3.929 4.506 . 0 0 "[ . 1 . 2]" 1
918 1 39 LYS QG 1 40 GLU HA 1.800 . 5.000 3.808 3.180 5.046 0.046 3 0 "[ . 1 . 2]" 1
919 1 48 GLN QB 1 49 LEU HA 1.800 . 5.000 3.927 3.805 4.002 . 0 0 "[ . 1 . 2]" 1
920 1 51 ASN QB 1 52 LYS HA 1.800 . 5.000 4.035 3.791 4.312 . 0 0 "[ . 1 . 2]" 1
921 1 52 LYS QB 1 53 PHE QD 1.800 . 5.000 2.818 2.511 3.062 . 0 0 "[ . 1 . 2]" 1
922 1 52 LYS QB 1 53 PHE QE 1.800 . 5.000 3.546 3.170 3.759 . 0 0 "[ . 1 . 2]" 1
923 1 52 LYS QD 1 53 PHE QE 1.800 . 5.000 2.726 2.386 3.670 . 0 0 "[ . 1 . 2]" 1
924 1 52 LYS QE 1 53 PHE QE 1.800 . 5.000 3.451 3.024 4.566 . 0 0 "[ . 1 . 2]" 1
925 1 52 LYS QG 1 53 PHE QD 1.800 . 5.000 3.621 3.272 4.536 . 0 0 "[ . 1 . 2]" 1
926 1 52 LYS QG 1 53 PHE QE 1.800 . 5.000 3.658 3.285 4.914 . 0 0 "[ . 1 . 2]" 1
927 1 54 LYS QE 1 55 ASN QD 1.800 . 5.000 4.251 2.591 5.031 0.031 5 0 "[ . 1 . 2]" 1
928 1 54 LYS QG 1 55 ASN QD 1.800 . 5.000 3.496 2.580 4.644 . 0 0 "[ . 1 . 2]" 1
929 1 55 ASN QB 1 56 ASN QD 1.800 . 5.000 4.411 3.160 5.027 0.027 9 0 "[ . 1 . 2]" 1
930 1 56 ASN QB 1 57 ILE HB 1.800 . 5.000 4.386 3.969 4.961 . 0 0 "[ . 1 . 2]" 1
931 1 57 ILE HA 1 58 VAL MG2 1.800 . 5.000 3.683 3.470 3.974 . 0 0 "[ . 1 . 2]" 1
932 1 57 ILE MG 1 58 VAL HA 1.800 . 5.000 3.958 3.409 4.233 . 0 0 "[ . 1 . 2]" 1
933 1 58 VAL HA 1 59 ILE QG 1.800 . 5.000 3.620 3.395 3.745 . 0 0 "[ . 1 . 2]" 1
934 1 58 VAL MG1 1 59 ILE HA 1.800 . 5.000 3.767 3.660 3.921 . 0 0 "[ . 1 . 2]" 1
935 1 59 ILE HA 1 60 VAL MG2 1.800 . 5.000 3.794 3.669 3.908 . 0 0 "[ . 1 . 2]" 1
936 1 61 GLY QA 1 62 LEU HG 1.800 . 5.000 3.725 3.496 3.988 . 0 0 "[ . 1 . 2]" 1
937 1 65 ILE MG 1 66 ASP QB 1.800 . 5.000 4.454 3.013 4.937 . 0 0 "[ . 1 . 2]" 1
938 1 79 VAL HA 1 80 TRP HE3 1.800 . 5.000 4.243 3.592 4.840 . 0 0 "[ . 1 . 2]" 1
939 1 80 TRP HA 1 81 PHE QD 1.800 . 5.000 3.858 2.951 4.433 . 0 0 "[ . 1 . 2]" 1
940 1 82 HIS QB 1 83 THR MG 1.800 . 5.000 4.217 2.792 5.024 0.024 7 0 "[ . 1 . 2]" 1
941 1 88 ASN HA 1 89 PRO HA 1.800 . 4.000 2.020 1.846 2.254 . 0 0 "[ . 1 . 2]" 1
942 1 88 ASN QB 1 89 PRO HA 1.800 . 5.000 3.869 3.391 4.245 . 0 0 "[ . 1 . 2]" 1
943 1 89 PRO QB 1 90 PRO QD 1.800 . 5.000 2.553 1.934 2.844 . 0 0 "[ . 1 . 2]" 1
944 1 93 THR HA 1 94 ILE MG 1.800 . 5.000 3.793 3.571 3.931 . 0 0 "[ . 1 . 2]" 1
945 1 96 LYS QB 1 97 TYR HA 1.800 . 5.000 4.077 3.751 4.404 . 0 0 "[ . 1 . 2]" 1
946 1 97 TYR QD 1 98 GLU HA 1.800 . 5.000 4.184 3.085 4.798 . 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 58
_Distance_constraint_stats_list.Viol_count 174
_Distance_constraint_stats_list.Viol_total 84.297
_Distance_constraint_stats_list.Viol_max 0.108
_Distance_constraint_stats_list.Viol_rms 0.0114
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0036
_Distance_constraint_stats_list.Viol_average_violations_only 0.0242
_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 14 GLN 0.151 0.038 8 0 "[ . 1 . 2]"
1 16 LEU 0.042 0.025 17 0 "[ . 1 . 2]"
1 18 GLY 0.022 0.012 3 0 "[ . 1 . 2]"
1 20 VAL 1.179 0.108 7 0 "[ . 1 . 2]"
1 22 LEU 0.759 0.055 14 0 "[ . 1 . 2]"
1 24 ASP 0.044 0.041 14 0 "[ . 1 . 2]"
1 26 GLU 0.058 0.026 16 0 "[ . 1 . 2]"
1 27 ARG 0.044 0.041 14 0 "[ . 1 . 2]"
1 28 ALA 0.007 0.007 8 0 "[ . 1 . 2]"
1 29 ILE 0.759 0.055 14 0 "[ . 1 . 2]"
1 30 LEU 0.011 0.006 19 0 "[ . 1 . 2]"
1 38 GLY 0.302 0.059 17 0 "[ . 1 . 2]"
1 40 GLU 0.400 0.044 2 0 "[ . 1 . 2]"
1 42 TYR 0.302 0.059 17 0 "[ . 1 . 2]"
1 44 LEU 0.400 0.044 2 0 "[ . 1 . 2]"
1 45 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 GLU 0.065 0.041 10 0 "[ . 1 . 2]"
1 47 GLY 0.098 0.023 13 0 "[ . 1 . 2]"
1 49 LEU 0.002 0.002 11 0 "[ . 1 . 2]"
1 50 MET 0.065 0.041 10 0 "[ . 1 . 2]"
1 51 ASN 0.098 0.023 13 0 "[ . 1 . 2]"
1 53 PHE 0.002 0.002 11 0 "[ . 1 . 2]"
1 58 VAL 0.011 0.006 19 0 "[ . 1 . 2]"
1 59 ILE 0.010 0.007 6 0 "[ . 1 . 2]"
1 60 VAL 0.007 0.007 8 0 "[ . 1 . 2]"
1 61 GLY 0.754 0.073 2 0 "[ . 1 . 2]"
1 62 LEU 0.058 0.026 16 0 "[ . 1 . 2]"
1 75 GLU 1.179 0.108 7 0 "[ . 1 . 2]"
1 76 LYS 0.110 0.041 4 0 "[ . 1 . 2]"
1 77 ILE 0.022 0.012 3 0 "[ . 1 . 2]"
1 78 LYS 0.191 0.030 12 0 "[ . 1 . 2]"
1 79 VAL 0.042 0.025 17 0 "[ . 1 . 2]"
1 80 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 81 PHE 0.151 0.038 8 0 "[ . 1 . 2]"
1 85 LYS 0.010 0.005 18 0 "[ . 1 . 2]"
1 90 PRO 0.010 0.007 6 0 "[ . 1 . 2]"
1 91 SER 0.010 0.005 18 0 "[ . 1 . 2]"
1 92 ALA 0.086 0.020 18 0 "[ . 1 . 2]"
1 94 ILE 0.668 0.073 2 0 "[ . 1 . 2]"
1 96 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 98 GLU 0.191 0.030 12 0 "[ . 1 . 2]"
1 100 LEU 0.110 0.041 4 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 16 LEU N 1 79 VAL O 2.700 2.700 3.300 2.838 2.689 3.194 0.011 11 0 "[ . 1 . 2]" 2
2 1 16 LEU H 1 79 VAL O 1.700 . 2.300 1.902 1.741 2.325 0.025 17 0 "[ . 1 . 2]" 2
3 1 18 GLY N 1 77 ILE O 2.700 2.700 3.300 2.956 2.760 3.290 . 0 0 "[ . 1 . 2]" 2
4 1 18 GLY H 1 77 ILE O 1.700 . 2.300 1.986 1.787 2.312 0.012 3 0 "[ . 1 . 2]" 2
5 1 20 VAL N 1 75 GLU O 2.700 2.700 3.300 2.717 2.662 2.790 0.038 7 0 "[ . 1 . 2]" 2
6 1 20 VAL H 1 75 GLU O 1.700 . 2.300 1.809 1.728 1.922 . 0 0 "[ . 1 . 2]" 2
7 1 22 LEU N 1 29 ILE O 2.700 2.700 3.300 3.293 3.238 3.335 0.035 14 0 "[ . 1 . 2]" 2
8 1 22 LEU H 1 29 ILE O 1.700 . 2.300 2.327 2.293 2.355 0.055 14 0 "[ . 1 . 2]" 2
9 1 24 ASP N 1 27 ARG O 2.700 2.700 3.300 2.895 2.714 3.212 . 0 0 "[ . 1 . 2]" 2
10 1 24 ASP H 1 27 ARG O 1.700 . 2.300 2.033 1.776 2.341 0.041 14 0 "[ . 1 . 2]" 2
11 1 28 ALA N 1 60 VAL O 2.700 2.700 3.300 2.914 2.748 3.075 . 0 0 "[ . 1 . 2]" 2
12 1 28 ALA H 1 60 VAL O 1.700 . 2.300 1.962 1.785 2.113 . 0 0 "[ . 1 . 2]" 2
13 1 22 LEU O 1 29 ILE N 2.700 2.700 3.300 2.788 2.657 2.921 0.043 14 0 "[ . 1 . 2]" 2
14 1 22 LEU O 1 29 ILE H 1.700 . 2.300 1.872 1.754 2.021 . 0 0 "[ . 1 . 2]" 2
15 1 30 LEU N 1 58 VAL O 2.700 2.700 3.300 2.840 2.695 3.007 0.005 20 0 "[ . 1 . 2]" 2
16 1 30 LEU H 1 58 VAL O 1.700 . 2.300 1.885 1.725 2.095 . 0 0 "[ . 1 . 2]" 2
17 1 38 GLY O 1 42 TYR N 2.700 2.700 3.300 3.144 2.902 3.286 . 0 0 "[ . 1 . 2]" 2
18 1 38 GLY O 1 42 TYR H 1.700 . 2.300 2.244 1.979 2.359 0.059 17 0 "[ . 1 . 2]" 2
19 1 40 GLU O 1 44 LEU N 2.700 2.700 3.300 2.992 2.841 3.158 . 0 0 "[ . 1 . 2]" 2
20 1 40 GLU O 1 44 LEU H 1.700 . 2.300 2.313 2.208 2.344 0.044 2 0 "[ . 1 . 2]" 2
21 1 45 SER O 1 49 LEU N 2.700 2.700 3.300 2.896 2.718 3.203 . 0 0 "[ . 1 . 2]" 2
22 1 45 SER O 1 49 LEU H 1.700 . 2.300 1.947 1.750 2.241 . 0 0 "[ . 1 . 2]" 2
23 1 46 GLU O 1 50 MET N 2.700 2.700 3.300 2.806 2.659 2.972 0.041 10 0 "[ . 1 . 2]" 2
24 1 46 GLU O 1 50 MET H 1.700 . 2.300 1.885 1.743 2.054 . 0 0 "[ . 1 . 2]" 2
25 1 47 GLY O 1 51 ASN N 2.700 2.700 3.300 3.004 2.874 3.188 . 0 0 "[ . 1 . 2]" 2
26 1 47 GLY O 1 51 ASN H 1.700 . 2.300 2.228 1.976 2.323 0.023 13 0 "[ . 1 . 2]" 2
27 1 49 LEU O 1 53 PHE N 2.700 2.700 3.300 2.914 2.745 3.221 . 0 0 "[ . 1 . 2]" 2
28 1 49 LEU O 1 53 PHE H 1.700 . 2.300 1.957 1.782 2.302 0.002 11 0 "[ . 1 . 2]" 2
29 1 30 LEU O 1 58 VAL N 2.700 2.700 3.300 2.798 2.694 2.916 0.006 19 0 "[ . 1 . 2]" 2
30 1 30 LEU O 1 58 VAL H 1.700 . 2.300 1.829 1.716 1.993 . 0 0 "[ . 1 . 2]" 2
31 1 59 ILE N 1 90 PRO O 2.700 2.700 3.300 2.991 2.816 3.228 . 0 0 "[ . 1 . 2]" 2
32 1 59 ILE H 1 90 PRO O 1.700 . 2.300 2.067 1.838 2.307 0.007 6 0 "[ . 1 . 2]" 2
33 1 28 ALA O 1 60 VAL N 2.700 2.700 3.300 2.823 2.693 3.010 0.007 8 0 "[ . 1 . 2]" 2
34 1 28 ALA O 1 60 VAL H 1.700 . 2.300 1.940 1.790 2.091 . 0 0 "[ . 1 . 2]" 2
35 1 61 GLY N 1 92 ALA O 2.700 2.700 3.300 2.743 2.680 2.835 0.020 18 0 "[ . 1 . 2]" 2
36 1 61 GLY H 1 92 ALA O 1.700 . 2.300 1.807 1.716 1.900 . 0 0 "[ . 1 . 2]" 2
37 1 26 GLU O 1 62 LEU N 2.700 2.700 3.300 2.805 2.674 3.125 0.026 16 0 "[ . 1 . 2]" 2
38 1 26 GLU O 1 62 LEU H 1.700 . 2.300 1.907 1.716 2.299 . 0 0 "[ . 1 . 2]" 2
39 1 20 VAL O 1 75 GLU N 2.700 2.700 3.300 3.240 3.039 3.312 0.012 20 0 "[ . 1 . 2]" 2
40 1 20 VAL O 1 75 GLU H 1.700 . 2.300 2.345 2.198 2.408 0.108 7 0 "[ . 1 . 2]" 2
41 1 18 GLY O 1 77 ILE N 2.700 2.700 3.300 2.956 2.784 3.145 . 0 0 "[ . 1 . 2]" 2
42 1 18 GLY O 1 77 ILE H 1.700 . 2.300 1.987 1.805 2.180 . 0 0 "[ . 1 . 2]" 2
43 1 78 LYS N 1 98 GLU O 2.700 2.700 3.300 2.832 2.716 3.172 . 0 0 "[ . 1 . 2]" 2
44 1 78 LYS H 1 98 GLU O 1.700 . 2.300 1.868 1.732 2.225 . 0 0 "[ . 1 . 2]" 2
45 1 16 LEU O 1 79 VAL N 2.700 2.700 3.300 2.795 2.695 2.960 0.005 9 0 "[ . 1 . 2]" 2
46 1 16 LEU O 1 79 VAL H 1.700 . 2.300 1.860 1.710 1.996 . 0 0 "[ . 1 . 2]" 2
47 1 80 TRP N 1 96 LYS O 2.700 2.700 3.300 2.860 2.717 3.080 . 0 0 "[ . 1 . 2]" 2
48 1 80 TRP H 1 96 LYS O 1.700 . 2.300 1.916 1.739 2.172 . 0 0 "[ . 1 . 2]" 2
49 1 14 GLN O 1 81 PHE N 2.700 2.700 3.300 3.097 2.810 3.258 . 0 0 "[ . 1 . 2]" 2
50 1 14 GLN O 1 81 PHE H 1.700 . 2.300 2.172 1.848 2.338 0.038 8 0 "[ . 1 . 2]" 2
51 1 85 LYS O 1 91 SER N 2.700 2.700 3.300 2.867 2.695 3.204 0.005 18 0 "[ . 1 . 2]" 2
52 1 85 LYS O 1 91 SER H 1.700 . 2.300 1.925 1.713 2.286 . 0 0 "[ . 1 . 2]" 2
53 1 61 GLY O 1 94 ILE N 2.700 2.700 3.300 3.208 2.872 3.339 0.039 2 0 "[ . 1 . 2]" 2
54 1 61 GLY O 1 94 ILE H 1.700 . 2.300 2.288 1.958 2.373 0.073 2 0 "[ . 1 . 2]" 2
55 1 78 LYS O 1 98 GLU N 2.700 2.700 3.300 2.713 2.670 2.852 0.030 12 0 "[ . 1 . 2]" 2
56 1 78 LYS O 1 98 GLU H 1.700 . 2.300 1.790 1.701 2.152 . 0 0 "[ . 1 . 2]" 2
57 1 76 LYS O 1 100 LEU N 2.700 2.700 3.300 2.946 2.715 3.275 . 0 0 "[ . 1 . 2]" 2
58 1 76 LYS O 1 100 LEU H 1.700 . 2.300 2.096 1.787 2.341 0.041 4 0 "[ . 1 . 2]" 2
stop_
save_
Contact the webmaster for help, if required. Sunday, May 19, 2024 2:57:52 PM GMT (wattos1)