NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | in_recoord | stage | program | type | subtype | subsubtype |
|
|
370113 |
1blj   |
cing | recoord | 4-filtered-FRED | Wattos | check | violation | distance |
data_1blj
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 1356
_Distance_constraint_stats_list.Viol_count 4700
_Distance_constraint_stats_list.Viol_total 5084.673
_Distance_constraint_stats_list.Viol_max 0.742
_Distance_constraint_stats_list.Viol_rms 0.0279
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0094
_Distance_constraint_stats_list.Viol_average_violations_only 0.0541
_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 11 VAL 0.855 0.165 13 0 "[ . 1 . 2]"
1 12 GLU 1.880 0.190 17 0 "[ . 1 . 2]"
1 13 LYS 2.345 0.190 17 0 "[ . 1 . 2]"
1 14 TRP 7.784 0.239 3 0 "[ . 1 . 2]"
1 15 PHE 1.548 0.130 1 0 "[ . 1 . 2]"
1 16 PHE 3.571 0.174 13 0 "[ . 1 . 2]"
1 17 ARG 1.840 0.117 19 0 "[ . 1 . 2]"
1 18 THR 8.208 0.195 20 0 "[ . 1 . 2]"
1 19 ILE 13.908 0.167 4 0 "[ . 1 . 2]"
1 20 SER 1.645 0.089 12 0 "[ . 1 . 2]"
1 21 ARG 1.887 0.120 17 0 "[ . 1 . 2]"
1 22 LYS 6.603 0.234 1 0 "[ . 1 . 2]"
1 23 ASP 8.519 0.234 1 0 "[ . 1 . 2]"
1 24 ALA 10.518 0.224 4 0 "[ . 1 . 2]"
1 25 GLU 1.694 0.109 3 0 "[ . 1 . 2]"
1 26 ARG 4.143 0.148 4 0 "[ . 1 . 2]"
1 27 GLN 3.722 0.133 12 0 "[ . 1 . 2]"
1 28 LEU 7.842 0.742 1 1 "[+ . 1 . 2]"
1 29 LEU 4.603 0.135 20 0 "[ . 1 . 2]"
1 30 ALA 1.942 0.080 4 0 "[ . 1 . 2]"
1 31 PRO 2.343 0.065 12 0 "[ . 1 . 2]"
1 32 MET 3.485 0.106 14 0 "[ . 1 . 2]"
1 33 ASN 0.414 0.060 9 0 "[ . 1 . 2]"
1 34 LYS 1.802 0.201 15 0 "[ . 1 . 2]"
1 35 ALA 2.997 0.201 15 0 "[ . 1 . 2]"
1 36 GLY 0.999 0.095 11 0 "[ . 1 . 2]"
1 37 SER 4.381 0.181 3 0 "[ . 1 . 2]"
1 38 PHE 4.987 0.175 7 0 "[ . 1 . 2]"
1 39 LEU 11.019 0.342 13 0 "[ . 1 . 2]"
1 40 ILE 13.368 0.310 20 0 "[ . 1 . 2]"
1 41 ARG 2.867 0.167 4 0 "[ . 1 . 2]"
1 42 GLU 3.929 0.195 20 0 "[ . 1 . 2]"
1 43 SER 2.702 0.158 1 0 "[ . 1 . 2]"
1 44 GLU 3.210 0.116 11 0 "[ . 1 . 2]"
1 45 SER 0.471 0.058 16 0 "[ . 1 . 2]"
1 46 ASN 4.103 0.242 17 0 "[ . 1 . 2]"
1 47 LYS 8.339 0.205 19 0 "[ . 1 . 2]"
1 48 GLY 0.522 0.103 20 0 "[ . 1 . 2]"
1 49 ALA 8.306 0.242 17 0 "[ . 1 . 2]"
1 50 PHE 2.901 0.107 9 0 "[ . 1 . 2]"
1 51 SER 0.481 0.107 3 0 "[ . 1 . 2]"
1 52 LEU 6.889 0.342 13 0 "[ . 1 . 2]"
1 53 SER 4.366 0.174 20 0 "[ . 1 . 2]"
1 54 VAL 9.566 0.262 18 0 "[ . 1 . 2]"
1 55 LYS 2.892 0.129 11 0 "[ . 1 . 2]"
1 56 ASP 4.118 0.240 20 0 "[ . 1 . 2]"
1 57 ILE 3.590 0.205 15 0 "[ . 1 . 2]"
1 58 THR 1.332 0.147 16 0 "[ . 1 . 2]"
1 59 THR 0.412 0.045 4 0 "[ . 1 . 2]"
1 60 GLN 2.215 0.147 16 0 "[ . 1 . 2]"
1 61 GLY 0.023 0.016 12 0 "[ . 1 . 2]"
1 62 GLU 3.326 0.126 18 0 "[ . 1 . 2]"
1 63 VAL 5.213 0.240 20 0 "[ . 1 . 2]"
1 64 VAL 9.747 0.174 20 0 "[ . 1 . 2]"
1 65 LYS 5.701 0.243 12 0 "[ . 1 . 2]"
1 66 HIS 3.162 0.196 11 0 "[ . 1 . 2]"
1 67 TYR 1.610 0.104 7 0 "[ . 1 . 2]"
1 68 LYS 4.893 0.150 9 0 "[ . 1 . 2]"
1 69 ILE 8.220 0.187 3 0 "[ . 1 . 2]"
1 70 ARG 4.573 0.130 5 0 "[ . 1 . 2]"
1 71 SER 3.227 0.120 3 0 "[ . 1 . 2]"
1 72 LEU 9.632 0.139 17 0 "[ . 1 . 2]"
1 73 ASP 2.566 0.095 6 0 "[ . 1 . 2]"
1 74 ASN 2.568 0.096 11 0 "[ . 1 . 2]"
1 75 GLY 2.278 0.120 7 0 "[ . 1 . 2]"
1 76 GLY 4.718 0.139 17 0 "[ . 1 . 2]"
1 77 TYR 7.539 0.193 4 0 "[ . 1 . 2]"
1 78 TYR 8.804 0.132 1 0 "[ . 1 . 2]"
1 79 ILE 3.626 0.115 7 0 "[ . 1 . 2]"
1 80 SER 1.824 0.154 7 0 "[ . 1 . 2]"
1 81 PRO 3.478 0.098 11 0 "[ . 1 . 2]"
1 82 ARG 1.934 0.083 4 0 "[ . 1 . 2]"
1 83 ILE 6.035 0.186 4 0 "[ . 1 . 2]"
1 84 THR 4.092 0.162 13 0 "[ . 1 . 2]"
1 85 PHE 5.744 0.162 13 0 "[ . 1 . 2]"
1 86 PRO 1.027 0.103 9 0 "[ . 1 . 2]"
1 87 THR 5.687 0.193 4 0 "[ . 1 . 2]"
1 88 LEU 10.807 0.310 20 0 "[ . 1 . 2]"
1 89 GLN 10.146 0.223 2 0 "[ . 1 . 2]"
1 90 ALA 3.169 0.103 7 0 "[ . 1 . 2]"
1 91 LEU 11.347 0.239 3 0 "[ . 1 . 2]"
1 92 VAL 9.910 0.215 12 0 "[ . 1 . 2]"
1 93 GLN 3.962 0.109 13 0 "[ . 1 . 2]"
1 94 HIS 0.259 0.053 3 0 "[ . 1 . 2]"
1 95 TYR 1.828 0.116 13 0 "[ . 1 . 2]"
1 96 SER 1.702 0.109 13 0 "[ . 1 . 2]"
1 97 LYS 2.881 0.193 12 0 "[ . 1 . 2]"
1 98 LYS 6.866 0.165 3 0 "[ . 1 . 2]"
1 99 GLY 0.746 0.085 10 0 "[ . 1 . 2]"
1 100 ASP 4.328 0.168 10 0 "[ . 1 . 2]"
1 101 GLY 1.385 0.163 6 0 "[ . 1 . 2]"
1 102 LEU 2.479 0.116 13 0 "[ . 1 . 2]"
1 103 CYS 0.244 0.075 19 0 "[ . 1 . 2]"
1 104 GLN 3.537 0.159 11 0 "[ . 1 . 2]"
1 105 LYS 10.629 0.193 12 0 "[ . 1 . 2]"
1 106 LEU 11.987 0.262 18 0 "[ . 1 . 2]"
1 107 THR 5.431 0.146 3 0 "[ . 1 . 2]"
1 108 LEU 7.543 0.202 19 0 "[ . 1 . 2]"
1 109 PRO 4.124 0.202 19 0 "[ . 1 . 2]"
1 110 CYS 1.849 0.742 1 1 "[+ . 1 . 2]"
1 111 VAL 0.256 0.047 16 0 "[ . 1 . 2]"
1 112 ASN 0.464 0.078 19 0 "[ . 1 . 2]"
1 113 LEU 0.029 0.013 14 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 11 VAL H 1 12 GLU H 1.800 . 3.000 2.552 1.761 3.030 0.039 2 0 "[ . 1 . 2]" 1
2 1 11 VAL HA 1 12 GLU H 1.800 . 3.900 3.211 2.133 3.570 . 0 0 "[ . 1 . 2]" 1
3 1 11 VAL HB 1 12 GLU H 1.800 . 5.200 3.972 2.338 4.496 . 0 0 "[ . 1 . 2]" 1
4 1 11 VAL MG1 1 12 GLU H 1.800 . 4.700 3.808 2.120 4.404 . 0 0 "[ . 1 . 2]" 1
5 1 11 VAL MG2 1 12 GLU H 1.800 . 3.600 2.887 1.785 3.643 0.043 17 0 "[ . 1 . 2]" 1
6 1 11 VAL MG2 1 12 GLU QG 1.800 . 4.000 3.475 2.104 4.165 0.165 13 0 "[ . 1 . 2]" 1
7 1 12 GLU H 1 12 GLU HB3 1.800 . 4.300 3.762 3.402 4.164 . 0 0 "[ . 1 . 2]" 1
8 1 12 GLU H 1 12 GLU QG 1.800 . 3.900 2.756 1.798 3.828 0.002 4 0 "[ . 1 . 2]" 1
9 1 12 GLU HA 1 12 GLU QG 1.800 . 4.100 2.568 2.258 3.113 . 0 0 "[ . 1 . 2]" 1
10 1 12 GLU HA 1 13 LYS H 1.800 . 3.100 2.467 1.917 3.108 0.008 16 0 "[ . 1 . 2]" 1
11 1 12 GLU HA 1 13 LYS QG 1.800 . 4.000 3.898 3.405 4.190 0.190 17 0 "[ . 1 . 2]" 1
12 1 12 GLU QG 1 13 LYS H 1.800 . 4.400 3.974 3.506 4.466 0.066 15 0 "[ . 1 . 2]" 1
13 1 12 GLU HA 1 14 TRP H 1.800 . 4.800 4.398 3.760 4.857 0.057 16 0 "[ . 1 . 2]" 1
14 1 13 LYS H 1 13 LYS HB2 1.800 . 3.500 2.951 2.229 3.578 0.078 19 0 "[ . 1 . 2]" 1
15 1 13 LYS H 1 13 LYS QG 1.800 . 3.500 2.728 1.785 3.287 0.015 14 0 "[ . 1 . 2]" 1
16 1 13 LYS H 1 13 LYS QD 1.800 . 4.500 3.493 2.200 4.432 . 0 0 "[ . 1 . 2]" 1
17 1 13 LYS HA 1 13 LYS HB3 1.800 . 2.600 2.520 2.390 2.625 0.025 5 0 "[ . 1 . 2]" 1
18 1 13 LYS HA 1 13 LYS QG 1.800 . 2.800 2.760 2.392 2.897 0.097 19 0 "[ . 1 . 2]" 1
19 1 13 LYS HA 1 13 LYS QD 1.800 . 3.300 2.088 1.935 2.343 . 0 0 "[ . 1 . 2]" 1
20 1 13 LYS HB3 1 13 LYS QG 1.800 . 2.600 2.412 2.305 2.528 . 0 0 "[ . 1 . 2]" 1
21 1 13 LYS HB3 1 13 LYS QD 1.800 . 2.800 2.418 2.230 2.639 . 0 0 "[ . 1 . 2]" 1
22 1 13 LYS H 1 14 TRP H 1.800 . 4.100 3.046 1.961 4.098 . 0 0 "[ . 1 . 2]" 1
23 1 13 LYS HB2 1 14 TRP H 1.800 . 4.100 3.166 2.464 4.167 0.067 14 0 "[ . 1 . 2]" 1
24 1 13 LYS QG 1 14 TRP H 1.800 . 5.800 4.408 3.990 4.841 . 0 0 "[ . 1 . 2]" 1
25 1 13 LYS HA 1 15 PHE H 1.800 . 4.800 4.322 3.826 4.809 0.009 1 0 "[ . 1 . 2]" 1
26 1 13 LYS QD 1 39 LEU MD2 1.800 . 3.600 3.268 2.509 3.784 0.184 7 0 "[ . 1 . 2]" 1
27 1 14 TRP H 1 14 TRP HD1 1.800 . 5.200 3.760 3.550 4.897 . 0 0 "[ . 1 . 2]" 1
28 1 14 TRP HA 1 14 TRP HB2 1.800 . 3.100 2.207 2.059 2.256 . 0 0 "[ . 1 . 2]" 1
29 1 14 TRP HB2 1 14 TRP HD1 1.800 . 4.000 3.638 3.507 3.834 . 0 0 "[ . 1 . 2]" 1
30 1 14 TRP H 1 15 PHE H 1.800 . 3.200 2.610 2.328 2.824 . 0 0 "[ . 1 . 2]" 1
31 1 14 TRP HE3 1 15 PHE HA 1.800 . 5.200 3.102 2.581 3.610 . 0 0 "[ . 1 . 2]" 1
32 1 14 TRP HE3 1 40 ILE HB 1.800 . 4.000 2.559 2.295 2.725 . 0 0 "[ . 1 . 2]" 1
33 1 14 TRP HE3 1 40 ILE MG 1.800 . 5.200 2.519 2.185 3.301 . 0 0 "[ . 1 . 2]" 1
34 1 14 TRP HE3 1 40 ILE MD 1.800 . 4.600 2.874 2.616 3.110 . 0 0 "[ . 1 . 2]" 1
35 1 14 TRP HZ3 1 40 ILE HB 1.800 . 5.200 3.707 2.913 4.089 . 0 0 "[ . 1 . 2]" 1
36 1 14 TRP HZ3 1 40 ILE MD 1.800 . 5.200 2.456 1.976 2.885 . 0 0 "[ . 1 . 2]" 1
37 1 14 TRP HH2 1 40 ILE MG 1.800 . 5.200 4.236 3.791 4.503 . 0 0 "[ . 1 . 2]" 1
38 1 14 TRP HZ3 1 88 LEU MD2 1.800 . 5.200 3.753 3.358 3.919 . 0 0 "[ . 1 . 2]" 1
39 1 14 TRP HH2 1 88 LEU HB3 1.800 . 5.200 2.817 2.319 3.208 . 0 0 "[ . 1 . 2]" 1
40 1 14 TRP HH2 1 88 LEU HB2 1.800 . 4.600 2.120 2.006 2.371 . 0 0 "[ . 1 . 2]" 1
41 1 14 TRP HH2 1 88 LEU MD1 1.800 . 5.200 3.703 2.688 4.596 . 0 0 "[ . 1 . 2]" 1
42 1 14 TRP HH2 1 88 LEU MD2 1.800 . 5.200 4.517 3.914 4.849 . 0 0 "[ . 1 . 2]" 1
43 1 14 TRP HZ2 1 89 GLN HA 1.800 . 3.500 2.665 2.328 3.330 . 0 0 "[ . 1 . 2]" 1
44 1 14 TRP HZ2 1 89 GLN HB2 1.800 . 4.600 2.952 2.069 4.277 . 0 0 "[ . 1 . 2]" 1
45 1 14 TRP HZ2 1 89 GLN HG3 1.800 . 4.000 4.109 4.034 4.223 0.223 2 0 "[ . 1 . 2]" 1
46 1 14 TRP HZ2 1 89 GLN HG2 1.800 . 4.600 4.281 3.898 4.668 0.068 6 0 "[ . 1 . 2]" 1
47 1 14 TRP HH2 1 89 GLN HA 1.800 . 4.600 3.074 2.647 3.587 . 0 0 "[ . 1 . 2]" 1
48 1 14 TRP HH2 1 89 GLN HG2 1.800 . 5.200 5.051 4.729 5.290 0.090 16 0 "[ . 1 . 2]" 1
49 1 14 TRP HZ2 1 91 LEU MD2 1.800 . 5.400 5.583 5.548 5.639 0.239 3 0 "[ . 1 . 2]" 1
50 1 14 TRP HZ3 1 91 LEU MD2 1.800 . 5.400 4.154 3.556 4.592 . 0 0 "[ . 1 . 2]" 1
51 1 14 TRP HD1 1 92 VAL MG2 1.800 . 5.400 5.137 4.817 5.455 0.055 9 0 "[ . 1 . 2]" 1
52 1 14 TRP HZ2 1 92 VAL HB 1.800 . 5.200 3.732 3.380 4.408 . 0 0 "[ . 1 . 2]" 1
53 1 14 TRP HZ2 1 92 VAL MG1 1.800 . 4.600 4.012 3.730 4.376 . 0 0 "[ . 1 . 2]" 1
54 1 14 TRP HZ2 1 92 VAL MG2 1.800 . 5.200 3.082 2.871 3.789 . 0 0 "[ . 1 . 2]" 1
55 1 14 TRP HH2 1 92 VAL MG1 1.800 . 5.200 4.580 4.235 4.858 . 0 0 "[ . 1 . 2]" 1
56 1 14 TRP HA 1 109 PRO QB 1.800 . 3.100 3.141 3.039 3.253 0.153 9 0 "[ . 1 . 2]" 1
57 1 14 TRP HB3 1 109 PRO QB 1.800 . 4.000 2.042 1.886 2.294 . 0 0 "[ . 1 . 2]" 1
58 1 14 TRP HD1 1 109 PRO HG3 1.800 . 4.600 2.906 2.192 3.382 . 0 0 "[ . 1 . 2]" 1
59 1 14 TRP HD1 1 109 PRO HG2 1.800 . 4.000 3.724 2.825 4.068 0.068 9 0 "[ . 1 . 2]" 1
60 1 15 PHE H 1 15 PHE QB 1.800 . 3.800 2.425 2.306 2.556 . 0 0 "[ . 1 . 2]" 1
61 1 15 PHE HA 1 15 PHE QD 1.800 . 3.500 2.366 2.088 2.856 . 0 0 "[ . 1 . 2]" 1
62 1 15 PHE HA 1 16 PHE H 1.800 . 3.700 2.142 1.984 2.390 . 0 0 "[ . 1 . 2]" 1
63 1 15 PHE HA 1 40 ILE H 1.800 . 5.100 3.428 2.677 3.921 . 0 0 "[ . 1 . 2]" 1
64 1 15 PHE QD 1 40 ILE HB 1.800 . 4.000 4.077 4.038 4.130 0.130 1 0 "[ . 1 . 2]" 1
65 1 15 PHE QD 1 40 ILE MG 1.800 . 4.000 1.977 1.894 2.204 . 0 0 "[ . 1 . 2]" 1
66 1 16 PHE H 1 16 PHE QD 1.800 . 4.900 3.978 3.381 4.436 . 0 0 "[ . 1 . 2]" 1
67 1 16 PHE HA 1 16 PHE QD 1.800 . 3.700 2.193 1.998 2.538 . 0 0 "[ . 1 . 2]" 1
68 1 16 PHE HA 1 16 PHE QE 1.800 . 5.800 4.255 4.058 4.625 . 0 0 "[ . 1 . 2]" 1
69 1 16 PHE QB 1 19 ILE MG 1.800 . 3.300 3.361 3.306 3.410 0.110 17 0 "[ . 1 . 2]" 1
70 1 16 PHE QB 1 19 ILE MD 1.800 . 4.100 4.017 3.447 4.144 0.044 17 0 "[ . 1 . 2]" 1
71 1 16 PHE QD 1 19 ILE MG 1.800 . 3.800 2.691 2.326 3.754 . 0 0 "[ . 1 . 2]" 1
72 1 16 PHE QD 1 19 ILE MD 1.800 . 3.200 2.649 2.075 3.225 0.025 6 0 "[ . 1 . 2]" 1
73 1 16 PHE QE 1 19 ILE MD 1.800 . 4.800 2.316 1.984 3.045 . 0 0 "[ . 1 . 2]" 1
74 1 16 PHE QD 1 24 ALA MB 1.800 . 3.800 3.837 3.801 3.888 0.088 18 0 "[ . 1 . 2]" 1
75 1 16 PHE QB 1 39 LEU MD1 1.800 . 3.800 3.021 1.983 3.856 0.056 15 0 "[ . 1 . 2]" 1
76 1 16 PHE QD 1 39 LEU HB3 1.800 . 4.500 4.096 2.133 4.674 0.174 13 0 "[ . 1 . 2]" 1
77 1 16 PHE QD 1 39 LEU MD1 1.800 . 5.200 2.579 1.901 4.076 . 0 0 "[ . 1 . 2]" 1
78 1 16 PHE QD 1 39 LEU MD2 1.800 . 5.200 3.462 2.068 4.091 . 0 0 "[ . 1 . 2]" 1
79 1 16 PHE QE 1 39 LEU HB3 1.800 . 6.900 5.751 4.326 6.707 . 0 0 "[ . 1 . 2]" 1
80 1 16 PHE QE 1 39 LEU MD2 1.800 . 6.900 3.743 2.326 5.050 . 0 0 "[ . 1 . 2]" 1
81 1 16 PHE H 1 40 ILE H 1.800 . 4.800 2.758 1.966 3.657 . 0 0 "[ . 1 . 2]" 1
82 1 16 PHE QE 1 112 ASN HA 1.800 . 5.800 5.638 4.978 5.878 0.078 19 0 "[ . 1 . 2]" 1
83 1 16 PHE HZ 1 112 ASN HA 1.800 . 5.800 5.530 4.479 5.851 0.051 17 0 "[ . 1 . 2]" 1
84 1 17 ARG HA 1 17 ARG QG 1.800 . 3.300 2.399 2.174 3.128 . 0 0 "[ . 1 . 2]" 1
85 1 17 ARG HA 1 17 ARG QD 1.800 . 4.600 3.655 2.045 4.160 . 0 0 "[ . 1 . 2]" 1
86 1 17 ARG QB 1 18 THR H 1.800 . 3.700 1.950 1.772 2.410 0.028 14 0 "[ . 1 . 2]" 1
87 1 17 ARG QB 1 18 THR MG 1.800 . 3.600 2.466 2.059 2.920 . 0 0 "[ . 1 . 2]" 1
88 1 17 ARG QG 1 18 THR H 1.800 . 5.200 3.623 3.159 4.326 . 0 0 "[ . 1 . 2]" 1
89 1 17 ARG QG 1 18 THR MG 1.800 . 3.700 3.751 3.430 3.817 0.117 19 0 "[ . 1 . 2]" 1
90 1 17 ARG QD 1 18 THR MG 1.800 . 3.700 3.637 2.872 3.789 0.089 13 0 "[ . 1 . 2]" 1
91 1 17 ARG HA 1 42 GLU H 1.800 . 4.300 3.438 2.125 4.328 0.028 3 0 "[ . 1 . 2]" 1
92 1 18 THR H 1 18 THR MG 1.800 . 3.800 2.201 1.764 3.036 0.036 6 0 "[ . 1 . 2]" 1
93 1 18 THR HA 1 18 THR HB 1.800 . 2.800 2.289 2.225 2.371 . 0 0 "[ . 1 . 2]" 1
94 1 18 THR HA 1 18 THR MG 1.800 . 3.200 3.217 3.156 3.261 0.061 8 0 "[ . 1 . 2]" 1
95 1 18 THR HB 1 18 THR MG 1.800 . 2.600 2.111 2.081 2.147 . 0 0 "[ . 1 . 2]" 1
96 1 18 THR H 1 19 ILE H 1.800 . 3.600 3.359 2.421 3.679 0.079 7 0 "[ . 1 . 2]" 1
97 1 18 THR HA 1 19 ILE H 1.800 . 3.300 2.219 2.067 2.373 . 0 0 "[ . 1 . 2]" 1
98 1 18 THR HB 1 19 ILE H 1.800 . 5.200 4.370 4.205 4.527 . 0 0 "[ . 1 . 2]" 1
99 1 18 THR MG 1 19 ILE H 1.800 . 4.800 4.334 4.170 4.509 . 0 0 "[ . 1 . 2]" 1
100 1 18 THR H 1 41 ARG QD 1.800 . 5.100 5.085 4.841 5.258 0.158 4 0 "[ . 1 . 2]" 1
101 1 18 THR HA 1 42 GLU H 1.800 . 4.300 2.580 1.878 3.222 . 0 0 "[ . 1 . 2]" 1
102 1 18 THR HA 1 42 GLU QB 1.800 . 4.500 4.348 4.085 4.510 0.010 13 0 "[ . 1 . 2]" 1
103 1 18 THR MG 1 42 GLU H 1.800 . 5.100 3.920 3.569 4.517 . 0 0 "[ . 1 . 2]" 1
104 1 18 THR MG 1 42 GLU QB 1.800 . 3.500 3.647 3.608 3.695 0.195 20 0 "[ . 1 . 2]" 1
105 1 18 THR MG 1 42 GLU QG 1.800 . 3.800 1.898 1.831 1.955 . 0 0 "[ . 1 . 2]" 1
106 1 18 THR HB 1 44 GLU HA 1.800 . 3.900 3.874 3.534 4.016 0.116 11 0 "[ . 1 . 2]" 1
107 1 18 THR HB 1 44 GLU QB 1.800 . 4.100 3.125 2.607 3.790 . 0 0 "[ . 1 . 2]" 1
108 1 18 THR MG 1 44 GLU HA 1.800 . 3.100 3.101 2.472 3.191 0.091 5 0 "[ . 1 . 2]" 1
109 1 18 THR MG 1 44 GLU QG 1.800 . 3.900 3.816 3.523 3.945 0.045 12 0 "[ . 1 . 2]" 1
110 1 19 ILE H 1 19 ILE HB 1.800 . 3.600 2.395 2.232 2.530 . 0 0 "[ . 1 . 2]" 1
111 1 19 ILE H 1 19 ILE QG 1.800 . 4.300 3.947 3.861 4.002 . 0 0 "[ . 1 . 2]" 1
112 1 19 ILE H 1 19 ILE MG 1.800 . 3.300 2.275 1.955 2.535 . 0 0 "[ . 1 . 2]" 1
113 1 19 ILE H 1 19 ILE MD 1.800 . 4.600 4.318 4.206 4.464 . 0 0 "[ . 1 . 2]" 1
114 1 19 ILE HA 1 19 ILE HB 1.800 . 2.900 2.625 2.603 2.666 . 0 0 "[ . 1 . 2]" 1
115 1 19 ILE HA 1 19 ILE QG 1.800 . 3.000 2.367 2.308 2.451 . 0 0 "[ . 1 . 2]" 1
116 1 19 ILE HA 1 19 ILE MG 1.800 . 3.300 3.288 3.232 3.311 0.011 6 0 "[ . 1 . 2]" 1
117 1 19 ILE HA 1 19 ILE MD 1.800 . 4.000 3.898 3.866 3.924 . 0 0 "[ . 1 . 2]" 1
118 1 19 ILE HB 1 19 ILE MD 1.800 . 3.000 2.408 2.305 2.497 . 0 0 "[ . 1 . 2]" 1
119 1 19 ILE MD 1 19 ILE QG 1.800 . 2.600 1.962 1.952 1.968 . 0 0 "[ . 1 . 2]" 1
120 1 19 ILE MD 1 19 ILE MG 1.800 . 2.600 1.956 1.906 2.005 . 0 0 "[ . 1 . 2]" 1
121 1 19 ILE H 1 20 SER H 1.800 . 4.700 4.585 4.425 4.703 0.003 14 0 "[ . 1 . 2]" 1
122 1 19 ILE HA 1 20 SER H 1.800 . 3.200 2.535 2.388 2.903 . 0 0 "[ . 1 . 2]" 1
123 1 19 ILE HB 1 20 SER H 1.800 . 4.000 4.056 3.937 4.089 0.089 12 0 "[ . 1 . 2]" 1
124 1 19 ILE QG 1 20 SER H 1.800 . 3.900 2.066 1.915 2.196 . 0 0 "[ . 1 . 2]" 1
125 1 19 ILE MD 1 20 SER H 1.800 . 4.500 3.846 3.597 3.952 . 0 0 "[ . 1 . 2]" 1
126 1 19 ILE MG 1 21 ARG H 1.800 . 4.600 4.676 4.635 4.720 0.120 17 0 "[ . 1 . 2]" 1
127 1 19 ILE HB 1 23 ASP HB3 1.800 . 4.600 4.668 4.643 4.690 0.090 4 0 "[ . 1 . 2]" 1
128 1 19 ILE HB 1 23 ASP HB2 1.800 . 4.400 4.477 4.436 4.535 0.135 3 0 "[ . 1 . 2]" 1
129 1 19 ILE QG 1 23 ASP HB3 1.800 . 4.400 2.151 2.085 2.249 . 0 0 "[ . 1 . 2]" 1
130 1 19 ILE QG 1 23 ASP HB2 1.800 . 4.400 1.990 1.934 2.040 . 0 0 "[ . 1 . 2]" 1
131 1 19 ILE MD 1 23 ASP HB3 1.800 . 3.500 2.056 1.987 2.159 . 0 0 "[ . 1 . 2]" 1
132 1 19 ILE MD 1 23 ASP HB2 1.800 . 3.500 2.790 2.626 2.946 . 0 0 "[ . 1 . 2]" 1
133 1 19 ILE QG 1 24 ALA H 1.800 . 4.700 3.858 3.574 4.281 . 0 0 "[ . 1 . 2]" 1
134 1 19 ILE MG 1 24 ALA H 1.800 . 4.800 2.349 1.996 2.761 . 0 0 "[ . 1 . 2]" 1
135 1 19 ILE MG 1 24 ALA HA 1.800 . 4.300 2.804 2.438 3.076 . 0 0 "[ . 1 . 2]" 1
136 1 19 ILE QG 1 24 ALA MB 1.800 . 4.100 4.171 4.140 4.200 0.100 19 0 "[ . 1 . 2]" 1
137 1 19 ILE MG 1 24 ALA MB 1.800 . 2.800 1.843 1.785 1.947 0.015 11 0 "[ . 1 . 2]" 1
138 1 19 ILE MD 1 24 ALA H 1.800 . 4.000 3.164 2.813 3.547 . 0 0 "[ . 1 . 2]" 1
139 1 19 ILE MD 1 24 ALA HA 1.800 . 2.800 2.586 2.179 2.825 0.025 8 0 "[ . 1 . 2]" 1
140 1 19 ILE MD 1 24 ALA MB 1.800 . 3.000 3.048 2.978 3.102 0.102 12 0 "[ . 1 . 2]" 1
141 1 19 ILE MG 1 26 ARG QD 1.800 . 4.800 4.898 4.859 4.948 0.148 4 0 "[ . 1 . 2]" 1
142 1 19 ILE MD 1 27 GLN QG 1.800 . 3.300 3.043 2.728 3.347 0.047 18 0 "[ . 1 . 2]" 1
143 1 19 ILE MD 1 27 GLN QE 1.800 . 5.200 3.259 2.010 5.047 . 0 0 "[ . 1 . 2]" 1
144 1 19 ILE MG 1 39 LEU MD1 1.800 . 3.200 2.524 1.985 3.215 0.015 7 0 "[ . 1 . 2]" 1
145 1 19 ILE MG 1 39 LEU MD2 1.800 . 4.400 4.173 3.653 4.440 0.040 13 0 "[ . 1 . 2]" 1
146 1 19 ILE MD 1 39 LEU MD1 1.800 . 3.600 3.101 2.563 3.715 0.115 2 0 "[ . 1 . 2]" 1
147 1 19 ILE MG 1 41 ARG HA 1.800 . 4.000 4.024 3.882 4.166 0.166 13 0 "[ . 1 . 2]" 1
148 1 19 ILE MG 1 41 ARG HB3 1.800 . 3.800 2.533 2.263 2.754 . 0 0 "[ . 1 . 2]" 1
149 1 19 ILE MG 1 41 ARG HB2 1.800 . 3.800 2.512 2.123 3.967 0.167 4 0 "[ . 1 . 2]" 1
150 1 20 SER H 1 20 SER HA 1.800 . 3.000 2.939 2.903 2.978 . 0 0 "[ . 1 . 2]" 1
151 1 20 SER H 1 20 SER HB2 1.800 . 3.900 2.874 2.733 3.132 . 0 0 "[ . 1 . 2]" 1
152 1 20 SER HA 1 20 SER HB2 1.800 . 2.900 2.480 2.314 2.552 . 0 0 "[ . 1 . 2]" 1
153 1 20 SER HA 1 21 ARG H 1.800 . 3.000 2.243 2.158 2.451 . 0 0 "[ . 1 . 2]" 1
154 1 20 SER HB3 1 21 ARG H 1.800 . 3.900 3.797 3.585 3.942 0.042 10 0 "[ . 1 . 2]" 1
155 1 20 SER HB2 1 21 ARG H 1.800 . 3.900 3.758 3.436 3.861 . 0 0 "[ . 1 . 2]" 1
156 1 20 SER HA 1 22 LYS H 1.800 . 4.500 4.448 4.024 4.562 0.062 12 0 "[ . 1 . 2]" 1
157 1 20 SER HB3 1 22 LYS H 1.800 . 5.100 3.606 3.260 4.323 . 0 0 "[ . 1 . 2]" 1
158 1 20 SER H 1 23 ASP H 1.800 . 4.300 3.943 3.450 4.126 . 0 0 "[ . 1 . 2]" 1
159 1 20 SER H 1 23 ASP HB3 1.800 . 4.800 3.569 3.219 3.888 . 0 0 "[ . 1 . 2]" 1
160 1 20 SER H 1 23 ASP HB2 1.800 . 4.100 2.370 1.848 2.744 . 0 0 "[ . 1 . 2]" 1
161 1 21 ARG H 1 21 ARG HB2 1.800 . 4.000 2.307 2.212 2.507 . 0 0 "[ . 1 . 2]" 1
162 1 21 ARG H 1 21 ARG QD 1.800 . 5.300 4.411 3.788 4.814 . 0 0 "[ . 1 . 2]" 1
163 1 21 ARG HA 1 21 ARG HB2 1.800 . 3.100 2.605 2.510 2.699 . 0 0 "[ . 1 . 2]" 1
164 1 21 ARG HA 1 21 ARG QG 1.800 . 3.300 2.424 2.164 2.819 . 0 0 "[ . 1 . 2]" 1
165 1 21 ARG HA 1 21 ARG QD 1.800 . 4.300 3.574 2.243 4.238 . 0 0 "[ . 1 . 2]" 1
166 1 21 ARG HB2 1 21 ARG QD 1.800 . 2.800 2.515 2.325 2.821 0.021 16 0 "[ . 1 . 2]" 1
167 1 21 ARG QD 1 21 ARG QG 1.800 . 3.000 2.085 2.039 2.156 . 0 0 "[ . 1 . 2]" 1
168 1 21 ARG H 1 22 LYS H 1.800 . 3.300 2.991 2.702 3.202 . 0 0 "[ . 1 . 2]" 1
169 1 21 ARG HB2 1 22 LYS H 1.800 . 4.400 3.767 3.499 4.220 . 0 0 "[ . 1 . 2]" 1
170 1 21 ARG H 1 23 ASP H 1.800 . 4.300 4.036 3.904 4.280 . 0 0 "[ . 1 . 2]" 1
171 1 21 ARG HA 1 24 ALA H 1.800 . 4.800 3.901 3.630 4.156 . 0 0 "[ . 1 . 2]" 1
172 1 21 ARG HA 1 24 ALA MB 1.800 . 3.300 3.184 2.701 3.356 0.056 19 0 "[ . 1 . 2]" 1
173 1 21 ARG HA 1 25 GLU H 1.800 . 6.800 4.562 4.003 5.007 . 0 0 "[ . 1 . 2]" 1
174 1 22 LYS H 1 22 LYS QB 1.800 . 3.200 2.531 2.334 2.742 . 0 0 "[ . 1 . 2]" 1
175 1 22 LYS H 1 22 LYS QG 1.800 . 3.300 3.069 2.504 3.436 0.136 14 0 "[ . 1 . 2]" 1
176 1 22 LYS HA 1 22 LYS QB 1.800 . 2.600 2.112 2.076 2.138 . 0 0 "[ . 1 . 2]" 1
177 1 22 LYS HA 1 22 LYS QG 1.800 . 3.900 3.555 3.429 3.702 . 0 0 "[ . 1 . 2]" 1
178 1 22 LYS HA 1 22 LYS QD 1.800 . 3.500 3.591 3.513 3.633 0.133 6 0 "[ . 1 . 2]" 1
179 1 22 LYS QB 1 22 LYS QD 1.800 . 2.600 2.459 2.079 2.750 0.150 7 0 "[ . 1 . 2]" 1
180 1 22 LYS H 1 23 ASP H 1.800 . 3.100 2.524 2.307 2.723 . 0 0 "[ . 1 . 2]" 1
181 1 22 LYS QB 1 23 ASP H 1.800 . 3.700 3.705 3.569 3.764 0.064 8 0 "[ . 1 . 2]" 1
182 1 22 LYS QB 1 23 ASP HA 1.800 . 4.300 4.356 4.130 4.454 0.154 14 0 "[ . 1 . 2]" 1
183 1 22 LYS QG 1 23 ASP H 1.800 . 4.400 3.193 2.217 4.067 . 0 0 "[ . 1 . 2]" 1
184 1 22 LYS QD 1 23 ASP H 1.800 . 4.900 2.570 1.918 3.717 . 0 0 "[ . 1 . 2]" 1
185 1 22 LYS QG 1 23 ASP HA 1.800 . 4.100 3.581 3.033 4.334 0.234 1 0 "[ . 1 . 2]" 1
186 1 22 LYS H 1 24 ALA H 1.800 . 5.900 4.341 4.074 4.594 . 0 0 "[ . 1 . 2]" 1
187 1 22 LYS HA 1 24 ALA H 1.800 . 5.900 4.404 3.957 4.771 . 0 0 "[ . 1 . 2]" 1
188 1 22 LYS HA 1 25 GLU H 1.800 . 3.700 3.398 3.016 3.724 0.024 2 0 "[ . 1 . 2]" 1
189 1 22 LYS HA 1 25 GLU HB2 1.800 . 3.500 2.383 2.176 2.785 . 0 0 "[ . 1 . 2]" 1
190 1 23 ASP H 1 23 ASP HB3 1.800 . 3.800 3.613 3.550 3.661 . 0 0 "[ . 1 . 2]" 1
191 1 23 ASP H 1 23 ASP HB2 1.800 . 3.500 2.386 2.287 2.446 . 0 0 "[ . 1 . 2]" 1
192 1 23 ASP HA 1 23 ASP HB3 1.800 . 2.800 2.704 2.613 2.786 . 0 0 "[ . 1 . 2]" 1
193 1 23 ASP HA 1 23 ASP HB2 1.800 . 3.100 3.069 3.045 3.087 . 0 0 "[ . 1 . 2]" 1
194 1 23 ASP H 1 24 ALA H 1.800 . 3.000 2.317 2.195 2.464 . 0 0 "[ . 1 . 2]" 1
195 1 23 ASP H 1 24 ALA MB 1.800 . 3.900 3.929 3.903 3.971 0.071 18 0 "[ . 1 . 2]" 1
196 1 23 ASP HA 1 24 ALA H 1.800 . 3.300 3.381 3.359 3.399 0.099 17 0 "[ . 1 . 2]" 1
197 1 23 ASP HB3 1 24 ALA H 1.800 . 4.300 3.300 3.018 3.746 . 0 0 "[ . 1 . 2]" 1
198 1 23 ASP HB2 1 24 ALA H 1.800 . 3.900 2.492 2.219 3.029 . 0 0 "[ . 1 . 2]" 1
199 1 23 ASP H 1 25 GLU H 1.800 . 5.900 3.625 3.374 3.930 . 0 0 "[ . 1 . 2]" 1
200 1 23 ASP HA 1 26 ARG H 1.800 . 3.900 3.105 2.963 3.255 . 0 0 "[ . 1 . 2]" 1
201 1 23 ASP HA 1 26 ARG QB 1.800 . 2.600 2.578 2.354 2.662 0.062 10 0 "[ . 1 . 2]" 1
202 1 23 ASP HA 1 26 ARG QG 1.800 . 3.500 3.463 3.283 3.530 0.030 1 0 "[ . 1 . 2]" 1
203 1 24 ALA H 1 24 ALA MB 1.800 . 2.800 2.168 2.079 2.268 . 0 0 "[ . 1 . 2]" 1
204 1 24 ALA HA 1 24 ALA MB 1.800 . 2.600 2.139 2.122 2.170 . 0 0 "[ . 1 . 2]" 1
205 1 24 ALA H 1 25 GLU H 1.800 . 3.100 2.498 2.238 2.678 . 0 0 "[ . 1 . 2]" 1
206 1 24 ALA MB 1 25 GLU H 1.800 . 3.600 2.735 2.552 2.901 . 0 0 "[ . 1 . 2]" 1
207 1 24 ALA H 1 26 ARG H 1.800 . 5.300 3.807 3.632 4.010 . 0 0 "[ . 1 . 2]" 1
208 1 24 ALA HA 1 27 GLN H 1.800 . 3.700 3.550 3.357 3.703 0.003 20 0 "[ . 1 . 2]" 1
209 1 24 ALA HA 1 27 GLN HB2 1.800 . 3.600 3.242 2.820 3.605 0.005 18 0 "[ . 1 . 2]" 1
210 1 24 ALA HA 1 27 GLN QG 1.800 . 4.100 2.886 2.447 3.286 . 0 0 "[ . 1 . 2]" 1
211 1 24 ALA MB 1 28 LEU MD1 1.800 . 3.600 3.601 3.442 3.674 0.074 2 0 "[ . 1 . 2]" 1
212 1 24 ALA HA 1 39 LEU MD2 1.800 . 3.200 3.206 3.050 3.276 0.076 13 0 "[ . 1 . 2]" 1
213 1 24 ALA MB 1 39 LEU MD1 1.800 . 3.000 1.866 1.731 1.988 0.069 11 0 "[ . 1 . 2]" 1
214 1 24 ALA MB 1 39 LEU MD2 1.800 . 3.200 3.368 3.272 3.424 0.224 4 0 "[ . 1 . 2]" 1
215 1 24 ALA MB 1 53 SER QB 1.800 . 4.600 2.875 2.550 3.183 . 0 0 "[ . 1 . 2]" 1
216 1 24 ALA MB 1 64 VAL MG2 1.800 . 5.100 5.050 4.889 5.160 0.060 19 0 "[ . 1 . 2]" 1
217 1 25 GLU H 1 25 GLU HB2 1.800 . 3.800 2.323 2.100 2.563 . 0 0 "[ . 1 . 2]" 1
218 1 25 GLU H 1 25 GLU HB3 1.800 . 3.600 3.541 3.382 3.631 0.031 19 0 "[ . 1 . 2]" 1
219 1 25 GLU H 1 25 GLU QG 1.800 . 3.300 2.789 2.465 3.370 0.070 12 0 "[ . 1 . 2]" 1
220 1 25 GLU HA 1 25 GLU HB2 1.800 . 3.100 3.061 3.036 3.076 . 0 0 "[ . 1 . 2]" 1
221 1 25 GLU HA 1 25 GLU QG 1.800 . 3.300 2.531 2.379 2.941 . 0 0 "[ . 1 . 2]" 1
222 1 25 GLU H 1 26 ARG H 1.800 . 3.000 2.437 2.262 2.561 . 0 0 "[ . 1 . 2]" 1
223 1 25 GLU HB2 1 26 ARG H 1.800 . 3.800 2.925 2.681 3.250 . 0 0 "[ . 1 . 2]" 1
224 1 25 GLU QG 1 26 ARG H 1.800 . 5.100 4.423 4.215 4.811 . 0 0 "[ . 1 . 2]" 1
225 1 25 GLU H 1 27 GLN H 1.800 . 3.900 3.956 3.923 4.009 0.109 3 0 "[ . 1 . 2]" 1
226 1 25 GLU HA 1 28 LEU MD1 1.800 . 3.900 3.293 2.533 3.869 . 0 0 "[ . 1 . 2]" 1
227 1 25 GLU HB3 1 29 LEU MD1 1.800 . 3.600 2.244 2.010 2.515 . 0 0 "[ . 1 . 2]" 1
228 1 25 GLU HA 1 64 VAL HB 1.800 . 3.900 3.671 3.285 3.955 0.055 3 0 "[ . 1 . 2]" 1
229 1 25 GLU HA 1 64 VAL MG1 1.800 . 2.800 2.256 2.047 2.495 . 0 0 "[ . 1 . 2]" 1
230 1 25 GLU HA 1 64 VAL MG2 1.800 . 3.000 2.202 1.994 2.402 . 0 0 "[ . 1 . 2]" 1
231 1 25 GLU HB3 1 64 VAL MG1 1.800 . 3.800 3.594 3.057 3.819 0.019 1 0 "[ . 1 . 2]" 1
232 1 25 GLU QG 1 64 VAL HB 1.800 . 3.300 2.342 2.125 2.988 . 0 0 "[ . 1 . 2]" 1
233 1 25 GLU QG 1 64 VAL MG1 1.800 . 3.300 2.131 1.935 2.771 . 0 0 "[ . 1 . 2]" 1
234 1 25 GLU QG 1 64 VAL MG2 1.800 . 3.500 2.867 2.119 3.310 . 0 0 "[ . 1 . 2]" 1
235 1 26 ARG H 1 26 ARG QB 1.800 . 3.100 2.246 2.168 2.317 . 0 0 "[ . 1 . 2]" 1
236 1 26 ARG H 1 26 ARG QG 1.800 . 3.600 3.074 2.885 3.195 . 0 0 "[ . 1 . 2]" 1
237 1 26 ARG H 1 26 ARG QD 1.800 . 4.500 3.569 3.440 3.677 . 0 0 "[ . 1 . 2]" 1
238 1 26 ARG HA 1 26 ARG QB 1.800 . 2.600 2.198 2.166 2.234 . 0 0 "[ . 1 . 2]" 1
239 1 26 ARG HA 1 26 ARG QG 1.800 . 3.600 3.414 3.367 3.439 . 0 0 "[ . 1 . 2]" 1
240 1 26 ARG QB 1 26 ARG QG 1.800 . 2.600 2.093 2.063 2.112 . 0 0 "[ . 1 . 2]" 1
241 1 26 ARG QB 1 26 ARG QD 1.800 . 2.600 2.263 2.148 2.626 0.026 18 0 "[ . 1 . 2]" 1
242 1 26 ARG QD 1 26 ARG QG 1.800 . 2.600 2.105 1.994 2.132 . 0 0 "[ . 1 . 2]" 1
243 1 26 ARG H 1 27 GLN H 1.800 . 3.000 2.408 2.295 2.581 . 0 0 "[ . 1 . 2]" 1
244 1 26 ARG H 1 27 GLN QG 1.800 . 3.900 3.915 3.821 3.942 0.042 14 0 "[ . 1 . 2]" 1
245 1 26 ARG QB 1 27 GLN H 1.800 . 3.300 3.346 3.332 3.373 0.073 7 0 "[ . 1 . 2]" 1
246 1 26 ARG H 1 29 LEU MD1 1.800 . 5.200 4.005 3.627 4.260 . 0 0 "[ . 1 . 2]" 1
247 1 26 ARG HA 1 29 LEU H 1.800 . 3.800 3.796 3.626 3.861 0.061 4 0 "[ . 1 . 2]" 1
248 1 26 ARG HA 1 29 LEU HB2 1.800 . 3.700 2.882 2.590 3.288 . 0 0 "[ . 1 . 2]" 1
249 1 26 ARG HA 1 29 LEU MD1 1.800 . 3.100 2.755 2.429 3.129 0.029 18 0 "[ . 1 . 2]" 1
250 1 27 GLN H 1 27 GLN HA 1.800 . 3.100 2.873 2.806 2.937 . 0 0 "[ . 1 . 2]" 1
251 1 27 GLN H 1 27 GLN QB 1.800 . 3.500 2.559 2.331 2.681 . 0 0 "[ . 1 . 2]" 1
252 1 27 GLN H 1 27 GLN HB2 1.800 . 3.900 2.611 2.363 2.745 . 0 0 "[ . 1 . 2]" 1
253 1 27 GLN H 1 27 GLN QG 1.800 . 3.100 2.268 2.110 2.415 . 0 0 "[ . 1 . 2]" 1
254 1 27 GLN HA 1 27 GLN HB3 1.800 . 2.600 2.503 2.427 2.630 0.030 4 0 "[ . 1 . 2]" 1
255 1 27 GLN HA 1 27 GLN QG 1.800 . 2.600 2.540 2.355 2.733 0.133 12 0 "[ . 1 . 2]" 1
256 1 27 GLN HB3 1 27 GLN QG 1.800 . 2.600 2.465 2.410 2.544 . 0 0 "[ . 1 . 2]" 1
257 1 27 GLN H 1 28 LEU H 1.800 . 3.600 2.735 2.599 2.953 . 0 0 "[ . 1 . 2]" 1
258 1 27 GLN HA 1 30 ALA H 1.800 . 3.800 3.763 3.514 3.880 0.080 4 0 "[ . 1 . 2]" 1
259 1 27 GLN HA 1 30 ALA MB 1.800 . 3.500 2.975 2.583 3.489 . 0 0 "[ . 1 . 2]" 1
260 1 28 LEU H 1 28 LEU HA 1.800 . 3.100 2.868 2.816 2.916 . 0 0 "[ . 1 . 2]" 1
261 1 28 LEU H 1 28 LEU HB2 1.800 . 3.200 2.461 2.294 2.565 . 0 0 "[ . 1 . 2]" 1
262 1 28 LEU H 1 28 LEU HG 1.800 . 3.700 2.226 2.017 2.488 . 0 0 "[ . 1 . 2]" 1
263 1 28 LEU H 1 28 LEU MD1 1.800 . 3.600 3.411 3.037 3.594 . 0 0 "[ . 1 . 2]" 1
264 1 28 LEU H 1 28 LEU MD2 1.800 . 3.800 3.508 3.312 3.827 0.027 7 0 "[ . 1 . 2]" 1
265 1 28 LEU HA 1 28 LEU HG 1.800 . 2.800 2.857 2.604 2.916 0.116 18 0 "[ . 1 . 2]" 1
266 1 28 LEU HA 1 28 LEU MD2 1.800 . 2.600 2.058 1.980 2.156 . 0 0 "[ . 1 . 2]" 1
267 1 28 LEU HB3 1 28 LEU MD1 1.800 . 3.700 2.404 2.218 2.488 . 0 0 "[ . 1 . 2]" 1
268 1 28 LEU HB3 1 28 LEU MD2 1.800 . 3.700 2.271 2.146 2.392 . 0 0 "[ . 1 . 2]" 1
269 1 28 LEU HB2 1 28 LEU MD1 1.800 . 3.500 2.250 2.173 2.312 . 0 0 "[ . 1 . 2]" 1
270 1 28 LEU HB2 1 28 LEU MD2 1.800 . 3.500 3.217 3.149 3.262 . 0 0 "[ . 1 . 2]" 1
271 1 28 LEU HB2 1 29 LEU H 1.800 . 4.500 2.974 2.616 3.306 . 0 0 "[ . 1 . 2]" 1
272 1 28 LEU H 1 30 ALA H 1.800 . 4.400 3.899 3.699 4.208 . 0 0 "[ . 1 . 2]" 1
273 1 28 LEU HA 1 30 ALA H 1.800 . 4.500 3.660 3.434 3.885 . 0 0 "[ . 1 . 2]" 1
274 1 28 LEU MD2 1 37 SER QB 1.800 . 3.200 2.322 1.924 2.919 . 0 0 "[ . 1 . 2]" 1
275 1 28 LEU HB3 1 38 PHE HA 1.800 . 4.600 4.697 4.641 4.757 0.157 11 0 "[ . 1 . 2]" 1
276 1 28 LEU MD2 1 38 PHE H 1.800 . 3.300 3.188 2.855 3.339 0.039 20 0 "[ . 1 . 2]" 1
277 1 28 LEU MD1 1 38 PHE HA 1.800 . 3.500 2.367 2.128 2.795 . 0 0 "[ . 1 . 2]" 1
278 1 28 LEU MD2 1 38 PHE HA 1.800 . 3.500 2.597 2.261 2.866 . 0 0 "[ . 1 . 2]" 1
279 1 28 LEU HG 1 39 LEU MD2 1.800 . 3.300 2.327 2.164 2.649 . 0 0 "[ . 1 . 2]" 1
280 1 28 LEU MD1 1 39 LEU H 1.800 . 3.900 2.830 2.560 3.180 . 0 0 "[ . 1 . 2]" 1
281 1 28 LEU MD1 1 39 LEU HG 1.800 . 2.900 2.511 1.873 2.928 0.028 10 0 "[ . 1 . 2]" 1
282 1 28 LEU MD1 1 39 LEU MD2 1.800 . 2.900 2.548 2.068 3.081 0.181 7 0 "[ . 1 . 2]" 1
283 1 28 LEU MD2 1 39 LEU MD2 1.800 . 3.500 2.327 1.979 3.433 . 0 0 "[ . 1 . 2]" 1
284 1 28 LEU MD1 1 53 SER HB3 1.800 . 3.200 2.437 2.064 2.768 . 0 0 "[ . 1 . 2]" 1
285 1 28 LEU MD1 1 53 SER HB2 1.800 . 4.600 1.951 1.900 2.109 . 0 0 "[ . 1 . 2]" 1
286 1 28 LEU MD1 1 54 VAL HA 1.800 . 4.000 2.330 2.092 2.719 . 0 0 "[ . 1 . 2]" 1
287 1 28 LEU MD2 1 54 VAL HA 1.800 . 4.000 3.599 2.817 4.003 0.003 10 0 "[ . 1 . 2]" 1
288 1 28 LEU MD2 1 55 LYS H 1.800 . 4.000 3.649 3.146 3.978 . 0 0 "[ . 1 . 2]" 1
289 1 28 LEU MD2 1 55 LYS HB3 1.800 . 4.700 4.529 4.069 4.758 0.058 11 0 "[ . 1 . 2]" 1
290 1 28 LEU MD2 1 55 LYS HB2 1.800 . 3.800 3.601 2.746 3.856 0.056 11 0 "[ . 1 . 2]" 1
291 1 28 LEU H 1 64 VAL MG1 1.800 . 4.300 4.355 4.324 4.393 0.093 5 0 "[ . 1 . 2]" 1
292 1 28 LEU HB2 1 64 VAL MG1 1.800 . 3.500 2.913 2.661 3.185 . 0 0 "[ . 1 . 2]" 1
293 1 28 LEU MD1 1 64 VAL MG1 1.800 . 3.000 2.331 1.910 2.585 . 0 0 "[ . 1 . 2]" 1
294 1 28 LEU MD1 1 64 VAL MG2 1.800 . 2.900 2.849 2.549 2.999 0.099 1 0 "[ . 1 . 2]" 1
295 1 28 LEU MD2 1 110 CYS H 1.800 . 4.400 3.364 2.811 4.208 . 0 0 "[ . 1 . 2]" 1
296 1 28 LEU MD2 1 110 CYS HA 1.800 . 3.700 3.535 2.844 3.786 0.086 10 0 "[ . 1 . 2]" 1
297 1 28 LEU MD2 1 110 CYS HB3 1.800 . 4.600 3.247 1.983 4.296 . 0 0 "[ . 1 . 2]" 1
298 1 28 LEU MD2 1 110 CYS HB2 1.800 . 3.300 2.367 1.871 4.042 0.742 1 1 "[+ . 1 . 2]" 1
299 1 29 LEU H 1 29 LEU HB3 1.800 . 3.700 3.522 3.475 3.552 . 0 0 "[ . 1 . 2]" 1
300 1 29 LEU H 1 29 LEU HB2 1.800 . 3.600 2.326 2.227 2.383 . 0 0 "[ . 1 . 2]" 1
301 1 29 LEU H 1 29 LEU HG 1.800 . 3.300 2.357 2.158 2.499 . 0 0 "[ . 1 . 2]" 1
302 1 29 LEU H 1 29 LEU MD1 1.800 . 3.200 3.267 3.220 3.290 0.090 15 0 "[ . 1 . 2]" 1
303 1 29 LEU H 1 29 LEU MD2 1.800 . 4.000 3.722 3.548 3.862 . 0 0 "[ . 1 . 2]" 1
304 1 29 LEU HA 1 29 LEU HG 1.800 . 3.800 2.810 2.688 2.891 . 0 0 "[ . 1 . 2]" 1
305 1 29 LEU HA 1 29 LEU MD1 1.800 . 4.400 3.879 3.827 3.927 . 0 0 "[ . 1 . 2]" 1
306 1 29 LEU HA 1 29 LEU MD2 1.800 . 2.600 2.222 2.147 2.386 . 0 0 "[ . 1 . 2]" 1
307 1 29 LEU HB3 1 29 LEU MD1 1.800 . 3.000 2.554 2.504 2.617 . 0 0 "[ . 1 . 2]" 1
308 1 29 LEU HB3 1 29 LEU MD2 1.800 . 2.800 2.322 2.286 2.356 . 0 0 "[ . 1 . 2]" 1
309 1 29 LEU HB2 1 29 LEU MD1 1.800 . 2.900 2.219 2.177 2.243 . 0 0 "[ . 1 . 2]" 1
310 1 29 LEU HB2 1 29 LEU MD2 1.800 . 3.500 3.244 3.212 3.258 . 0 0 "[ . 1 . 2]" 1
311 1 29 LEU H 1 30 ALA H 1.800 . 3.100 2.655 2.457 2.833 . 0 0 "[ . 1 . 2]" 1
312 1 29 LEU HA 1 30 ALA H 1.800 . 3.900 3.470 3.401 3.539 . 0 0 "[ . 1 . 2]" 1
313 1 29 LEU HB2 1 30 ALA H 1.800 . 5.300 3.242 3.006 3.363 . 0 0 "[ . 1 . 2]" 1
314 1 29 LEU HG 1 30 ALA H 1.800 . 6.600 4.674 4.534 4.773 . 0 0 "[ . 1 . 2]" 1
315 1 29 LEU MD1 1 30 ALA H 1.800 . 4.900 4.870 4.711 4.936 0.036 7 0 "[ . 1 . 2]" 1
316 1 29 LEU MD2 1 62 GLU HB3 1.800 . 3.200 3.247 3.211 3.286 0.086 19 0 "[ . 1 . 2]" 1
317 1 29 LEU MD2 1 62 GLU HB2 1.800 . 5.800 4.611 4.382 4.747 . 0 0 "[ . 1 . 2]" 1
318 1 29 LEU MD2 1 62 GLU QG 1.800 . 4.800 3.054 2.205 4.052 . 0 0 "[ . 1 . 2]" 1
319 1 29 LEU HG 1 64 VAL MG1 1.800 . 3.900 3.991 3.952 4.035 0.135 20 0 "[ . 1 . 2]" 1
320 1 30 ALA H 1 30 ALA MB 1.800 . 2.900 2.238 2.205 2.322 . 0 0 "[ . 1 . 2]" 1
321 1 30 ALA HA 1 30 ALA MB 1.800 . 2.600 2.192 2.177 2.205 . 0 0 "[ . 1 . 2]" 1
322 1 30 ALA H 1 31 PRO QD 1.800 . 4.600 4.321 4.291 4.357 . 0 0 "[ . 1 . 2]" 1
323 1 30 ALA HA 1 31 PRO QG 1.800 . 3.900 3.949 3.927 3.965 0.065 12 0 "[ . 1 . 2]" 1
324 1 30 ALA HA 1 31 PRO QD 1.800 . 2.600 2.015 1.998 2.036 . 0 0 "[ . 1 . 2]" 1
325 1 30 ALA MB 1 31 PRO QG 1.800 . 3.900 3.770 3.605 3.918 0.018 7 0 "[ . 1 . 2]" 1
326 1 30 ALA MB 1 31 PRO QD 1.800 . 2.600 2.329 2.140 2.572 . 0 0 "[ . 1 . 2]" 1
327 1 30 ALA MB 1 32 MET H 1.800 . 3.700 2.486 2.395 2.536 . 0 0 "[ . 1 . 2]" 1
328 1 30 ALA MB 1 32 MET HB3 1.800 . 3.900 3.919 3.824 3.938 0.038 15 0 "[ . 1 . 2]" 1
329 1 30 ALA MB 1 32 MET ME 1.800 . 3.000 2.135 1.889 3.009 0.009 19 0 "[ . 1 . 2]" 1
330 1 30 ALA MB 1 33 ASN H 1.800 . 4.600 3.522 3.032 4.013 . 0 0 "[ . 1 . 2]" 1
331 1 31 PRO HA 1 31 PRO QG 1.800 . 3.500 3.530 3.525 3.533 0.033 11 0 "[ . 1 . 2]" 1
332 1 31 PRO HA 1 31 PRO QD 1.800 . 3.300 3.329 3.321 3.341 0.041 9 0 "[ . 1 . 2]" 1
333 1 31 PRO QB 1 31 PRO QD 1.800 . 2.900 2.746 2.724 2.758 . 0 0 "[ . 1 . 2]" 1
334 1 31 PRO QD 1 31 PRO QG 1.800 . 2.600 1.994 1.988 1.998 . 0 0 "[ . 1 . 2]" 1
335 1 31 PRO HA 1 32 MET H 1.800 . 3.500 3.376 3.317 3.438 . 0 0 "[ . 1 . 2]" 1
336 1 31 PRO QB 1 32 MET H 1.800 . 4.100 3.849 3.735 3.929 . 0 0 "[ . 1 . 2]" 1
337 1 31 PRO QG 1 32 MET H 1.800 . 3.500 3.333 3.045 3.506 0.006 19 0 "[ . 1 . 2]" 1
338 1 31 PRO QD 1 32 MET H 1.800 . 4.100 3.072 2.892 3.213 . 0 0 "[ . 1 . 2]" 1
339 1 31 PRO HA 1 33 ASN H 1.800 . 3.900 3.837 3.549 3.940 0.040 11 0 "[ . 1 . 2]" 1
340 1 32 MET H 1 32 MET HA 1.800 . 2.800 2.771 2.714 2.808 0.008 15 0 "[ . 1 . 2]" 1
341 1 32 MET H 1 32 MET HB3 1.800 . 3.200 3.287 3.267 3.306 0.106 14 0 "[ . 1 . 2]" 1
342 1 32 MET H 1 32 MET HB2 1.800 . 3.300 2.059 1.959 2.184 . 0 0 "[ . 1 . 2]" 1
343 1 32 MET H 1 32 MET QG 1.800 . 3.300 2.579 2.049 3.315 0.015 10 0 "[ . 1 . 2]" 1
344 1 32 MET H 1 32 MET ME 1.800 . 4.500 3.523 3.261 4.072 . 0 0 "[ . 1 . 2]" 1
345 1 32 MET HA 1 32 MET HB2 1.800 . 3.000 3.040 3.018 3.049 0.049 4 0 "[ . 1 . 2]" 1
346 1 32 MET HA 1 32 MET QG 1.800 . 3.000 2.337 2.193 2.494 . 0 0 "[ . 1 . 2]" 1
347 1 32 MET HB3 1 32 MET QG 1.800 . 2.600 2.350 2.169 2.484 . 0 0 "[ . 1 . 2]" 1
348 1 32 MET HB3 1 32 MET ME 1.800 . 3.700 3.206 2.288 3.707 0.007 10 0 "[ . 1 . 2]" 1
349 1 32 MET ME 1 32 MET QG 1.800 . 3.200 2.293 2.088 2.536 . 0 0 "[ . 1 . 2]" 1
350 1 32 MET H 1 33 ASN H 1.800 . 2.800 2.509 2.319 2.683 . 0 0 "[ . 1 . 2]" 1
351 1 32 MET HA 1 33 ASN H 1.800 . 3.900 3.498 3.416 3.550 . 0 0 "[ . 1 . 2]" 1
352 1 32 MET HB3 1 33 ASN H 1.800 . 3.900 3.536 3.118 3.917 0.017 7 0 "[ . 1 . 2]" 1
353 1 32 MET QG 1 33 ASN H 1.800 . 4.400 4.274 3.978 4.460 0.060 9 0 "[ . 1 . 2]" 1
354 1 32 MET HB3 1 111 VAL QG 1.800 . 3.200 2.207 1.939 2.939 . 0 0 "[ . 1 . 2]" 1
355 1 32 MET HB2 1 111 VAL QG 1.800 . 3.300 2.932 2.284 3.328 0.028 14 0 "[ . 1 . 2]" 1
356 1 32 MET QG 1 111 VAL QG 1.800 . 3.300 2.903 2.044 3.314 0.014 6 0 "[ . 1 . 2]" 1
357 1 32 MET ME 1 111 VAL QG 1.800 . 3.200 2.632 1.959 3.216 0.016 10 0 "[ . 1 . 2]" 1
358 1 32 MET ME 1 113 LEU QD 1.800 . 3.700 2.795 2.026 3.713 0.013 14 0 "[ . 1 . 2]" 1
359 1 33 ASN H 1 33 ASN HB3 1.800 . 4.000 3.895 3.767 4.004 0.004 15 0 "[ . 1 . 2]" 1
360 1 33 ASN H 1 33 ASN HB2 1.800 . 4.000 2.872 2.761 3.058 . 0 0 "[ . 1 . 2]" 1
361 1 33 ASN H 1 34 LYS H 1.800 . 5.300 4.383 4.240 4.474 . 0 0 "[ . 1 . 2]" 1
362 1 33 ASN HA 1 34 LYS H 1.800 . 2.900 2.601 2.329 2.909 0.009 12 0 "[ . 1 . 2]" 1
363 1 33 ASN HB2 1 34 LYS H 1.800 . 4.600 3.050 2.673 3.485 . 0 0 "[ . 1 . 2]" 1
364 1 33 ASN HB2 1 37 SER QB 1.800 . 3.900 2.847 2.269 3.897 . 0 0 "[ . 1 . 2]" 1
365 1 34 LYS H 1 34 LYS HB3 1.800 . 3.700 3.505 3.197 3.714 0.014 19 0 "[ . 1 . 2]" 1
366 1 34 LYS H 1 34 LYS QG 1.800 . 3.700 2.628 2.147 3.714 0.014 5 0 "[ . 1 . 2]" 1
367 1 34 LYS H 1 34 LYS QD 1.800 . 4.100 2.684 1.967 3.563 . 0 0 "[ . 1 . 2]" 1
368 1 34 LYS HA 1 34 LYS HB2 1.800 . 3.000 2.558 2.353 2.726 . 0 0 "[ . 1 . 2]" 1
369 1 34 LYS HA 1 34 LYS QG 1.800 . 3.500 3.497 3.382 3.532 0.032 14 0 "[ . 1 . 2]" 1
370 1 34 LYS HA 1 34 LYS QD 1.800 . 3.700 3.686 3.250 3.821 0.121 3 0 "[ . 1 . 2]" 1
371 1 34 LYS HB2 1 34 LYS QD 1.800 . 3.100 2.698 2.332 3.246 0.146 5 0 "[ . 1 . 2]" 1
372 1 34 LYS H 1 35 ALA H 1.800 . 4.900 4.355 4.143 4.485 . 0 0 "[ . 1 . 2]" 1
373 1 34 LYS HA 1 35 ALA H 1.800 . 3.100 2.389 2.180 2.788 . 0 0 "[ . 1 . 2]" 1
374 1 34 LYS HA 1 35 ALA MB 1.800 . 4.600 4.264 4.081 4.565 . 0 0 "[ . 1 . 2]" 1
375 1 34 LYS HB3 1 35 ALA H 1.800 . 3.700 3.522 2.875 3.746 0.046 6 0 "[ . 1 . 2]" 1
376 1 34 LYS HB2 1 35 ALA H 1.800 . 3.000 2.349 1.793 2.618 0.007 15 0 "[ . 1 . 2]" 1
377 1 34 LYS HB2 1 35 ALA MB 1.800 . 4.600 3.472 3.083 3.716 . 0 0 "[ . 1 . 2]" 1
378 1 34 LYS QG 1 35 ALA H 1.800 . 4.300 4.059 2.675 4.353 0.053 19 0 "[ . 1 . 2]" 1
379 1 34 LYS QD 1 35 ALA H 1.800 . 4.100 3.638 2.972 4.301 0.201 15 0 "[ . 1 . 2]" 1
380 1 34 LYS H 1 37 SER H 1.800 . 6.800 3.797 3.458 4.225 . 0 0 "[ . 1 . 2]" 1
381 1 34 LYS H 1 37 SER QB 1.800 . 4.400 3.204 2.775 3.917 . 0 0 "[ . 1 . 2]" 1
382 1 34 LYS HA 1 57 ILE MD 1.800 . 3.500 2.679 2.231 3.415 . 0 0 "[ . 1 . 2]" 1
383 1 35 ALA HA 1 35 ALA MB 1.800 . 2.600 2.172 2.139 2.208 . 0 0 "[ . 1 . 2]" 1
384 1 35 ALA HA 1 36 GLY H 1.800 . 3.100 2.059 1.951 2.134 . 0 0 "[ . 1 . 2]" 1
385 1 35 ALA MB 1 36 GLY H 1.800 . 4.100 3.250 2.963 3.428 . 0 0 "[ . 1 . 2]" 1
386 1 35 ALA HA 1 37 SER H 1.800 . 4.100 3.777 3.531 4.153 0.053 11 0 "[ . 1 . 2]" 1
387 1 35 ALA H 1 55 LYS H 1.800 . 4.900 4.967 4.932 5.029 0.129 11 0 "[ . 1 . 2]" 1
388 1 35 ALA MB 1 56 ASP HA 1.800 . 3.500 3.415 2.943 3.527 0.027 3 0 "[ . 1 . 2]" 1
389 1 35 ALA H 1 57 ILE QG 1.800 . 2.800 2.773 2.593 2.867 0.067 3 0 "[ . 1 . 2]" 1
390 1 35 ALA H 1 57 ILE MD 1.800 . 3.800 2.069 1.900 2.761 . 0 0 "[ . 1 . 2]" 1
391 1 35 ALA HA 1 57 ILE QG 1.800 . 4.000 3.627 3.322 4.041 0.041 12 0 "[ . 1 . 2]" 1
392 1 35 ALA HA 1 57 ILE MD 1.800 . 3.900 3.885 3.440 3.954 0.054 15 0 "[ . 1 . 2]" 1
393 1 35 ALA MB 1 57 ILE QG 1.800 . 3.900 2.120 1.896 2.391 . 0 0 "[ . 1 . 2]" 1
394 1 35 ALA MB 1 57 ILE MG 1.800 . 4.100 3.935 3.606 4.172 0.072 18 0 "[ . 1 . 2]" 1
395 1 35 ALA MB 1 57 ILE MD 1.800 . 3.000 2.611 2.403 2.904 . 0 0 "[ . 1 . 2]" 1
396 1 36 GLY H 1 36 GLY HA2 1.800 . 3.000 2.326 2.224 2.490 . 0 0 "[ . 1 . 2]" 1
397 1 36 GLY H 1 37 SER H 1.800 . 3.500 2.765 2.373 3.312 . 0 0 "[ . 1 . 2]" 1
398 1 36 GLY HA3 1 37 SER H 1.800 . 4.700 2.961 2.498 3.288 . 0 0 "[ . 1 . 2]" 1
399 1 36 GLY H 1 54 VAL MG1 1.800 . 6.300 2.139 1.955 2.269 . 0 0 "[ . 1 . 2]" 1
400 1 36 GLY H 1 54 VAL MG2 1.800 . 4.600 4.618 4.277 4.695 0.095 11 0 "[ . 1 . 2]" 1
401 1 36 GLY HA3 1 54 VAL MG1 1.800 . 4.400 3.973 3.401 4.296 . 0 0 "[ . 1 . 2]" 1
402 1 36 GLY HA2 1 54 VAL MG1 1.800 . 3.300 2.667 1.984 3.030 . 0 0 "[ . 1 . 2]" 1
403 1 36 GLY H 1 55 LYS H 1.800 . 8.000 2.870 2.336 3.043 . 0 0 "[ . 1 . 2]" 1
404 1 36 GLY HA3 1 107 THR H 1.800 . 4.400 2.746 2.243 3.222 . 0 0 "[ . 1 . 2]" 1
405 1 36 GLY HA2 1 107 THR H 1.800 . 5.400 3.475 3.188 4.014 . 0 0 "[ . 1 . 2]" 1
406 1 36 GLY HA3 1 107 THR MG 1.800 . 3.100 1.973 1.919 2.076 . 0 0 "[ . 1 . 2]" 1
407 1 36 GLY HA2 1 107 THR MG 1.800 . 3.500 3.409 3.167 3.542 0.042 9 0 "[ . 1 . 2]" 1
408 1 37 SER H 1 37 SER QB 1.800 . 3.000 2.768 2.357 2.974 . 0 0 "[ . 1 . 2]" 1
409 1 37 SER HA 1 37 SER QB 1.800 . 2.800 2.213 2.106 2.268 . 0 0 "[ . 1 . 2]" 1
410 1 37 SER H 1 38 PHE H 1.800 . 4.600 4.529 4.318 4.660 0.060 14 0 "[ . 1 . 2]" 1
411 1 37 SER HA 1 38 PHE H 1.800 . 3.200 2.214 2.108 2.385 . 0 0 "[ . 1 . 2]" 1
412 1 37 SER QB 1 38 PHE H 1.800 . 3.500 3.187 2.504 3.612 0.112 11 0 "[ . 1 . 2]" 1
413 1 37 SER H 1 55 LYS H 1.800 . 4.300 4.288 3.811 4.403 0.103 3 0 "[ . 1 . 2]" 1
414 1 37 SER H 1 55 LYS HB3 1.800 . 4.500 4.422 4.028 4.618 0.118 11 0 "[ . 1 . 2]" 1
415 1 37 SER H 1 108 LEU H 1.800 . 3.300 3.438 3.394 3.481 0.181 3 0 "[ . 1 . 2]" 1
416 1 37 SER HA 1 108 LEU H 1.800 . 3.900 3.100 2.509 3.667 . 0 0 "[ . 1 . 2]" 1
417 1 38 PHE H 1 38 PHE QD 1.800 . 4.900 3.120 1.904 3.532 . 0 0 "[ . 1 . 2]" 1
418 1 38 PHE HA 1 39 LEU H 1.800 . 3.300 2.307 2.126 2.446 . 0 0 "[ . 1 . 2]" 1
419 1 38 PHE QB 1 39 LEU H 1.800 . 3.600 1.996 1.792 2.255 0.008 12 0 "[ . 1 . 2]" 1
420 1 38 PHE HA 1 52 LEU MD1 1.800 . 4.600 3.828 3.361 4.149 . 0 0 "[ . 1 . 2]" 1
421 1 38 PHE QB 1 52 LEU MD1 1.800 . 3.200 2.150 2.002 2.437 . 0 0 "[ . 1 . 2]" 1
422 1 38 PHE QE 1 52 LEU MD1 1.800 . 4.800 3.500 2.733 4.338 . 0 0 "[ . 1 . 2]" 1
423 1 38 PHE HZ 1 52 LEU MD1 1.800 . 5.400 5.145 3.793 5.533 0.133 4 0 "[ . 1 . 2]" 1
424 1 38 PHE HA 1 53 SER H 1.800 . 7.100 4.654 4.170 5.004 . 0 0 "[ . 1 . 2]" 1
425 1 38 PHE HA 1 54 VAL HA 1.800 . 3.000 2.706 2.614 2.827 . 0 0 "[ . 1 . 2]" 1
426 1 38 PHE HA 1 54 VAL MG1 1.800 . 4.000 4.001 3.802 4.161 0.161 11 0 "[ . 1 . 2]" 1
427 1 38 PHE QB 1 54 VAL HA 1.800 . 4.300 4.310 4.139 4.361 0.061 16 0 "[ . 1 . 2]" 1
428 1 38 PHE QB 1 54 VAL MG2 1.800 . 3.300 3.309 2.998 3.402 0.102 12 0 "[ . 1 . 2]" 1
429 1 38 PHE HA 1 55 LYS H 1.800 . 4.900 4.421 4.265 4.732 . 0 0 "[ . 1 . 2]" 1
430 1 38 PHE QB 1 106 LEU MD2 1.800 . 3.500 3.401 3.194 3.675 0.175 7 0 "[ . 1 . 2]" 1
431 1 38 PHE QD 1 106 LEU MD2 1.800 . 4.600 2.630 1.998 2.876 . 0 0 "[ . 1 . 2]" 1
432 1 38 PHE H 1 109 PRO HA 1.800 . 4.300 2.184 1.795 2.970 0.005 11 0 "[ . 1 . 2]" 1
433 1 38 PHE H 1 110 CYS H 1.800 . 3.800 2.978 1.781 3.607 0.019 11 0 "[ . 1 . 2]" 1
434 1 39 LEU H 1 39 LEU HG 1.800 . 4.700 3.804 2.587 4.525 . 0 0 "[ . 1 . 2]" 1
435 1 39 LEU H 1 39 LEU MD2 1.800 . 5.100 3.602 3.256 4.190 . 0 0 "[ . 1 . 2]" 1
436 1 39 LEU HA 1 39 LEU HG 1.800 . 3.900 3.649 3.267 3.881 . 0 0 "[ . 1 . 2]" 1
437 1 39 LEU HA 1 39 LEU MD1 1.800 . 4.400 3.059 2.339 4.161 . 0 0 "[ . 1 . 2]" 1
438 1 39 LEU HA 1 39 LEU MD2 1.800 . 4.400 2.551 2.231 3.112 . 0 0 "[ . 1 . 2]" 1
439 1 39 LEU HB3 1 39 LEU MD1 1.800 . 3.000 2.219 1.937 2.767 . 0 0 "[ . 1 . 2]" 1
440 1 39 LEU HB2 1 39 LEU MD2 1.800 . 3.000 2.871 2.677 3.104 0.104 11 0 "[ . 1 . 2]" 1
441 1 39 LEU H 1 40 ILE H 1.800 . 4.600 4.307 4.133 4.459 . 0 0 "[ . 1 . 2]" 1
442 1 39 LEU HA 1 40 ILE H 1.800 . 3.300 2.486 2.361 2.789 . 0 0 "[ . 1 . 2]" 1
443 1 39 LEU QB 1 40 ILE H 1.800 . 4.400 3.025 2.315 3.672 . 0 0 "[ . 1 . 2]" 1
444 1 39 LEU MD1 1 41 ARG H 1.800 . 5.100 4.085 3.260 4.854 . 0 0 "[ . 1 . 2]" 1
445 1 39 LEU H 1 52 LEU MD1 1.800 . 3.600 2.656 2.237 3.199 . 0 0 "[ . 1 . 2]" 1
446 1 39 LEU MD1 1 52 LEU HA 1.800 . 5.300 5.419 5.155 5.642 0.342 13 0 "[ . 1 . 2]" 1
447 1 39 LEU H 1 53 SER H 1.800 . 3.500 3.091 2.891 3.411 . 0 0 "[ . 1 . 2]" 1
448 1 39 LEU MD2 1 53 SER QB 1.800 . 3.800 3.753 3.421 3.927 0.127 2 0 "[ . 1 . 2]" 1
449 1 39 LEU H 1 54 VAL HA 1.800 . 4.400 4.332 4.174 4.443 0.043 6 0 "[ . 1 . 2]" 1
450 1 39 LEU H 1 54 VAL MG2 1.800 . 4.800 3.957 3.716 4.268 . 0 0 "[ . 1 . 2]" 1
451 1 39 LEU MD2 1 110 CYS QB 1.800 . 4.000 2.827 2.306 3.355 . 0 0 "[ . 1 . 2]" 1
452 1 40 ILE H 1 40 ILE HB 1.800 . 4.400 2.895 2.472 3.189 . 0 0 "[ . 1 . 2]" 1
453 1 40 ILE H 1 40 ILE MG 1.800 . 4.700 2.862 2.546 3.068 . 0 0 "[ . 1 . 2]" 1
454 1 40 ILE HA 1 40 ILE QG 1.800 . 3.300 2.189 2.101 2.257 . 0 0 "[ . 1 . 2]" 1
455 1 40 ILE HA 1 40 ILE MG 1.800 . 3.100 3.164 3.142 3.182 0.082 2 0 "[ . 1 . 2]" 1
456 1 40 ILE HA 1 40 ILE MD 1.800 . 4.000 3.631 3.509 3.737 . 0 0 "[ . 1 . 2]" 1
457 1 40 ILE HB 1 40 ILE MD 1.800 . 3.300 2.175 2.073 2.312 . 0 0 "[ . 1 . 2]" 1
458 1 40 ILE MD 1 40 ILE QG 1.800 . 2.900 1.953 1.936 1.974 . 0 0 "[ . 1 . 2]" 1
459 1 40 ILE MD 1 40 ILE MG 1.800 . 2.600 2.204 2.054 2.488 . 0 0 "[ . 1 . 2]" 1
460 1 40 ILE HA 1 41 ARG H 1.800 . 3.200 2.269 2.165 2.427 . 0 0 "[ . 1 . 2]" 1
461 1 40 ILE MG 1 41 ARG H 1.800 . 4.100 4.096 3.829 4.139 0.039 6 0 "[ . 1 . 2]" 1
462 1 40 ILE MG 1 50 PHE HB3 1.800 . 3.300 3.120 2.901 3.323 0.023 17 0 "[ . 1 . 2]" 1
463 1 40 ILE MG 1 50 PHE HB2 1.800 . 4.000 4.055 4.007 4.091 0.091 3 0 "[ . 1 . 2]" 1
464 1 40 ILE MG 1 50 PHE QD 1.800 . 3.200 2.446 2.081 3.108 . 0 0 "[ . 1 . 2]" 1
465 1 40 ILE MG 1 50 PHE QE 1.800 . 6.900 3.403 3.035 4.062 . 0 0 "[ . 1 . 2]" 1
466 1 40 ILE MG 1 51 SER H 1.800 . 4.600 4.203 3.869 4.620 0.020 3 0 "[ . 1 . 2]" 1
467 1 40 ILE HA 1 52 LEU HA 1.800 . 3.300 2.305 1.993 2.633 . 0 0 "[ . 1 . 2]" 1
468 1 40 ILE HA 1 52 LEU MD1 1.800 . 3.900 2.619 2.012 3.539 . 0 0 "[ . 1 . 2]" 1
469 1 40 ILE QG 1 52 LEU HA 1.800 . 3.900 2.792 2.031 3.462 . 0 0 "[ . 1 . 2]" 1
470 1 40 ILE HG13 1 52 LEU MD1 1.800 . 3.100 2.100 1.920 2.626 . 0 0 "[ . 1 . 2]" 1
471 1 40 ILE MD 1 52 LEU HA 1.800 . 4.400 4.072 3.462 4.428 0.028 17 0 "[ . 1 . 2]" 1
472 1 40 ILE MD 1 52 LEU MD1 1.800 . 3.000 1.963 1.852 2.103 . 0 0 "[ . 1 . 2]" 1
473 1 40 ILE HA 1 53 SER H 1.800 . 4.100 3.455 2.938 3.930 . 0 0 "[ . 1 . 2]" 1
474 1 40 ILE QG 1 69 ILE MD 1.800 . 3.600 1.890 1.764 2.003 0.036 3 0 "[ . 1 . 2]" 1
475 1 40 ILE MG 1 69 ILE MD 1.800 . 3.600 3.548 3.248 3.721 0.121 19 0 "[ . 1 . 2]" 1
476 1 40 ILE MD 1 69 ILE MD 1.800 . 2.600 2.302 2.086 2.560 . 0 0 "[ . 1 . 2]" 1
477 1 40 ILE MG 1 88 LEU MD1 1.800 . 2.900 2.346 1.805 3.087 0.187 9 0 "[ . 1 . 2]" 1
478 1 40 ILE MG 1 88 LEU MD2 1.800 . 3.300 3.282 2.758 3.438 0.138 8 0 "[ . 1 . 2]" 1
479 1 40 ILE MD 1 88 LEU HB3 1.800 . 4.100 2.549 2.321 2.750 . 0 0 "[ . 1 . 2]" 1
480 1 40 ILE MD 1 88 LEU MD1 1.800 . 3.500 1.889 1.698 2.066 0.102 15 0 "[ . 1 . 2]" 1
481 1 40 ILE MD 1 88 LEU MD2 1.800 . 3.000 2.562 2.026 3.310 0.310 20 0 "[ . 1 . 2]" 1
482 1 40 ILE MD 1 91 LEU MD2 1.800 . 2.900 2.230 1.939 2.613 . 0 0 "[ . 1 . 2]" 1
483 1 40 ILE MD 1 92 VAL MG1 1.800 . 3.300 3.444 3.358 3.515 0.215 12 0 "[ . 1 . 2]" 1
484 1 40 ILE MD 1 92 VAL MG2 1.800 . 3.800 2.574 2.204 2.754 . 0 0 "[ . 1 . 2]" 1
485 1 41 ARG H 1 41 ARG HB2 1.800 . 3.500 3.544 3.506 3.572 0.072 8 0 "[ . 1 . 2]" 1
486 1 41 ARG HA 1 42 GLU H 1.800 . 3.000 2.259 2.065 2.724 . 0 0 "[ . 1 . 2]" 1
487 1 41 ARG H 1 51 SER H 1.800 . 3.800 3.530 2.576 3.823 0.023 16 0 "[ . 1 . 2]" 1
488 1 41 ARG H 1 52 LEU H 1.800 . 6.600 5.091 4.560 5.564 . 0 0 "[ . 1 . 2]" 1
489 1 42 GLU H 1 42 GLU QB 1.800 . 3.500 2.515 2.274 3.153 . 0 0 "[ . 1 . 2]" 1
490 1 42 GLU H 1 42 GLU QG 1.800 . 4.100 2.775 2.359 3.088 . 0 0 "[ . 1 . 2]" 1
491 1 42 GLU HA 1 42 GLU QG 1.800 . 3.600 3.387 3.316 3.457 . 0 0 "[ . 1 . 2]" 1
492 1 42 GLU QB 1 42 GLU QG 1.800 . 2.600 2.085 2.032 2.113 . 0 0 "[ . 1 . 2]" 1
493 1 42 GLU HA 1 43 SER H 1.800 . 3.100 2.341 2.119 2.510 . 0 0 "[ . 1 . 2]" 1
494 1 42 GLU QB 1 43 SER H 1.800 . 4.300 2.545 2.054 2.856 . 0 0 "[ . 1 . 2]" 1
495 1 42 GLU QG 1 43 SER H 1.800 . 4.100 3.216 2.910 3.635 . 0 0 "[ . 1 . 2]" 1
496 1 42 GLU QG 1 44 GLU QB 1.800 . 3.300 3.313 3.125 3.400 0.100 14 0 "[ . 1 . 2]" 1
497 1 42 GLU HA 1 50 PHE HA 1.800 . 2.900 1.962 1.863 2.237 . 0 0 "[ . 1 . 2]" 1
498 1 42 GLU HB3 1 50 PHE QD 1.800 . 5.800 3.447 2.801 3.865 . 0 0 "[ . 1 . 2]" 1
499 1 43 SER H 1 43 SER HB3 1.800 . 3.700 2.247 2.100 2.369 . 0 0 "[ . 1 . 2]" 1
500 1 43 SER H 1 43 SER HB2 1.800 . 3.300 2.901 2.562 3.230 . 0 0 "[ . 1 . 2]" 1
501 1 43 SER HA 1 43 SER HB3 1.800 . 3.100 3.074 3.010 3.120 0.020 13 0 "[ . 1 . 2]" 1
502 1 43 SER HA 1 43 SER HB2 1.800 . 3.000 2.573 2.480 2.697 . 0 0 "[ . 1 . 2]" 1
503 1 43 SER HA 1 44 GLU H 1.800 . 3.200 2.246 2.127 2.534 . 0 0 "[ . 1 . 2]" 1
504 1 43 SER HB2 1 44 GLU H 1.800 . 4.800 4.491 3.972 4.758 . 0 0 "[ . 1 . 2]" 1
505 1 43 SER HB3 1 46 ASN H 1.800 . 5.100 3.811 3.149 4.223 . 0 0 "[ . 1 . 2]" 1
506 1 43 SER H 1 49 ALA H 1.800 . 4.300 4.331 4.043 4.458 0.158 1 0 "[ . 1 . 2]" 1
507 1 43 SER H 1 49 ALA MB 1.800 . 3.800 3.594 2.984 3.853 0.053 15 0 "[ . 1 . 2]" 1
508 1 43 SER HB3 1 49 ALA H 1.800 . 4.800 3.941 3.582 4.289 . 0 0 "[ . 1 . 2]" 1
509 1 43 SER HB3 1 49 ALA MB 1.800 . 2.900 2.188 2.088 2.621 . 0 0 "[ . 1 . 2]" 1
510 1 43 SER HB2 1 49 ALA MB 1.800 . 2.900 2.972 2.816 3.031 0.131 9 0 "[ . 1 . 2]" 1
511 1 43 SER H 1 50 PHE HA 1.800 . 3.800 2.757 2.156 3.482 . 0 0 "[ . 1 . 2]" 1
512 1 43 SER H 1 51 SER H 1.800 . 5.900 4.997 4.513 5.314 . 0 0 "[ . 1 . 2]" 1
513 1 44 GLU H 1 44 GLU QB 1.800 . 3.800 2.669 2.474 2.899 . 0 0 "[ . 1 . 2]" 1
514 1 44 GLU H 1 44 GLU QG 1.800 . 4.100 2.034 1.785 3.060 0.015 2 0 "[ . 1 . 2]" 1
515 1 44 GLU HA 1 44 GLU QB 1.800 . 2.600 2.091 2.038 2.154 . 0 0 "[ . 1 . 2]" 1
516 1 44 GLU HA 1 44 GLU QG 1.800 . 3.500 3.430 3.303 3.535 0.035 10 0 "[ . 1 . 2]" 1
517 1 44 GLU QB 1 44 GLU QG 1.800 . 2.600 2.089 2.006 2.168 . 0 0 "[ . 1 . 2]" 1
518 1 44 GLU H 1 45 SER H 1.800 . 3.300 2.973 2.538 3.305 0.005 11 0 "[ . 1 . 2]" 1
519 1 44 GLU HA 1 45 SER H 1.800 . 3.700 3.242 2.746 3.493 . 0 0 "[ . 1 . 2]" 1
520 1 44 GLU QB 1 45 SER H 1.800 . 4.400 3.771 3.257 4.040 . 0 0 "[ . 1 . 2]" 1
521 1 44 GLU QG 1 45 SER H 1.800 . 4.300 3.426 2.163 4.332 0.032 16 0 "[ . 1 . 2]" 1
522 1 44 GLU H 1 46 ASN H 1.800 . 6.000 4.596 4.357 4.902 . 0 0 "[ . 1 . 2]" 1
523 1 44 GLU HA 1 46 ASN H 1.800 . 3.900 3.830 3.455 4.006 0.106 4 0 "[ . 1 . 2]" 1
524 1 45 SER H 1 45 SER QB 1.800 . 3.100 2.718 2.410 3.158 0.058 16 0 "[ . 1 . 2]" 1
525 1 45 SER HA 1 45 SER QB 1.800 . 2.600 2.203 2.139 2.256 . 0 0 "[ . 1 . 2]" 1
526 1 45 SER H 1 46 ASN H 1.800 . 2.800 2.386 1.789 2.845 0.045 9 0 "[ . 1 . 2]" 1
527 1 45 SER HA 1 46 ASN H 1.800 . 3.600 3.377 2.984 3.619 0.019 10 0 "[ . 1 . 2]" 1
528 1 45 SER QB 1 46 ASN H 1.800 . 4.000 3.787 3.396 4.020 0.020 4 0 "[ . 1 . 2]" 1
529 1 46 ASN H 1 46 ASN HB3 1.800 . 3.300 2.981 2.389 3.451 0.151 17 0 "[ . 1 . 2]" 1
530 1 46 ASN H 1 46 ASN HB2 1.800 . 3.600 3.621 3.500 3.755 0.155 4 0 "[ . 1 . 2]" 1
531 1 46 ASN HA 1 46 ASN HB3 1.800 . 2.800 2.498 2.305 2.806 0.006 10 0 "[ . 1 . 2]" 1
532 1 46 ASN HA 1 46 ASN HB2 1.800 . 2.600 2.521 2.283 2.656 0.056 17 0 "[ . 1 . 2]" 1
533 1 46 ASN H 1 47 LYS H 1.800 . 4.500 4.387 4.013 4.512 0.012 16 0 "[ . 1 . 2]" 1
534 1 46 ASN HA 1 47 LYS H 1.800 . 2.900 2.309 2.011 2.673 . 0 0 "[ . 1 . 2]" 1
535 1 46 ASN HB3 1 47 LYS H 1.800 . 4.000 3.508 3.205 4.015 0.015 17 0 "[ . 1 . 2]" 1
536 1 46 ASN HB2 1 47 LYS H 1.800 . 4.400 2.319 1.861 3.593 . 0 0 "[ . 1 . 2]" 1
537 1 46 ASN H 1 49 ALA MB 1.800 . 4.700 4.428 3.840 4.719 0.019 8 0 "[ . 1 . 2]" 1
538 1 46 ASN HB3 1 49 ALA H 1.800 . 4.600 3.828 3.062 4.638 0.038 17 0 "[ . 1 . 2]" 1
539 1 46 ASN HB3 1 49 ALA MB 1.800 . 2.900 2.773 2.246 3.142 0.242 17 0 "[ . 1 . 2]" 1
540 1 46 ASN HB2 1 49 ALA MB 1.800 . 3.100 2.485 2.078 3.266 0.166 2 0 "[ . 1 . 2]" 1
541 1 46 ASN QD 1 49 ALA MB 1.800 . 4.700 3.065 1.987 4.703 0.003 16 0 "[ . 1 . 2]" 1
542 1 47 LYS H 1 47 LYS QB 1.800 . 2.900 2.897 2.575 2.987 0.087 8 0 "[ . 1 . 2]" 1
543 1 47 LYS H 1 47 LYS QG 1.800 . 3.300 2.207 1.806 3.348 0.048 2 0 "[ . 1 . 2]" 1
544 1 47 LYS H 1 47 LYS QD 1.800 . 4.300 2.154 1.773 3.359 0.027 5 0 "[ . 1 . 2]" 1
545 1 47 LYS HA 1 47 LYS QB 1.800 . 2.600 2.145 2.096 2.213 . 0 0 "[ . 1 . 2]" 1
546 1 47 LYS HA 1 47 LYS QG 1.800 . 3.200 3.343 3.293 3.381 0.181 3 0 "[ . 1 . 2]" 1
547 1 47 LYS HA 1 47 LYS QD 1.800 . 3.500 3.561 3.503 3.597 0.097 8 0 "[ . 1 . 2]" 1
548 1 47 LYS QB 1 47 LYS QG 1.800 . 2.600 2.011 1.948 2.068 . 0 0 "[ . 1 . 2]" 1
549 1 47 LYS QB 1 47 LYS QE 1.800 . 3.500 3.015 2.146 3.609 0.109 5 0 "[ . 1 . 2]" 1
550 1 47 LYS QE 1 47 LYS QG 1.800 . 2.600 2.339 2.120 2.646 0.046 8 0 "[ . 1 . 2]" 1
551 1 47 LYS H 1 48 GLY H 1.800 . 4.300 3.124 2.099 3.886 . 0 0 "[ . 1 . 2]" 1
552 1 47 LYS HA 1 48 GLY H 1.800 . 3.100 2.636 2.245 3.203 0.103 20 0 "[ . 1 . 2]" 1
553 1 47 LYS HA 1 48 GLY QA 1.800 . 4.500 3.930 3.791 4.231 . 0 0 "[ . 1 . 2]" 1
554 1 47 LYS QB 1 48 GLY H 1.800 . 4.300 3.896 1.999 4.060 . 0 0 "[ . 1 . 2]" 1
555 1 47 LYS QG 1 48 GLY H 1.800 . 4.800 4.078 1.815 4.747 . 0 0 "[ . 1 . 2]" 1
556 1 47 LYS QD 1 48 GLY H 1.800 . 5.600 4.181 2.964 5.330 . 0 0 "[ . 1 . 2]" 1
557 1 47 LYS H 1 49 ALA H 1.800 . 4.300 3.612 2.839 4.354 0.054 3 0 "[ . 1 . 2]" 1
558 1 47 LYS HA 1 49 ALA H 1.800 . 4.100 4.187 3.525 4.305 0.205 19 0 "[ . 1 . 2]" 1
559 1 48 GLY H 1 48 GLY HA2 1.800 . 2.900 2.490 2.229 2.933 0.033 17 0 "[ . 1 . 2]" 1
560 1 48 GLY H 1 49 ALA H 1.800 . 3.100 2.190 1.764 3.113 0.036 15 0 "[ . 1 . 2]" 1
561 1 48 GLY HA3 1 49 ALA H 1.800 . 3.500 3.372 3.092 3.523 0.023 20 0 "[ . 1 . 2]" 1
562 1 48 GLY HA2 1 49 ALA H 1.800 . 3.200 3.035 2.682 3.265 0.065 12 0 "[ . 1 . 2]" 1
563 1 49 ALA H 1 49 ALA MB 1.800 . 2.900 2.494 2.327 2.844 . 0 0 "[ . 1 . 2]" 1
564 1 49 ALA HA 1 49 ALA MB 1.800 . 2.600 2.171 2.107 2.257 . 0 0 "[ . 1 . 2]" 1
565 1 49 ALA H 1 50 PHE H 1.800 . 4.600 4.510 3.997 4.645 0.045 13 0 "[ . 1 . 2]" 1
566 1 49 ALA HA 1 50 PHE H 1.800 . 2.900 2.254 1.996 2.558 . 0 0 "[ . 1 . 2]" 1
567 1 49 ALA MB 1 50 PHE H 1.800 . 3.700 2.733 2.105 3.571 . 0 0 "[ . 1 . 2]" 1
568 1 49 ALA MB 1 70 ARG QG 1.800 . 3.300 3.310 2.766 3.385 0.085 14 0 "[ . 1 . 2]" 1
569 1 50 PHE H 1 50 PHE HB2 1.800 . 4.300 2.706 2.251 3.113 . 0 0 "[ . 1 . 2]" 1
570 1 50 PHE H 1 50 PHE QD 1.800 . 4.700 3.121 2.505 3.670 . 0 0 "[ . 1 . 2]" 1
571 1 50 PHE HA 1 50 PHE QD 1.800 . 4.000 3.005 2.296 3.234 . 0 0 "[ . 1 . 2]" 1
572 1 50 PHE HA 1 50 PHE QE 1.800 . 5.800 4.578 4.368 4.804 . 0 0 "[ . 1 . 2]" 1
573 1 50 PHE HA 1 51 SER H 1.800 . 3.200 2.605 2.293 2.755 . 0 0 "[ . 1 . 2]" 1
574 1 50 PHE HB3 1 51 SER H 1.800 . 4.100 2.095 1.811 2.773 . 0 0 "[ . 1 . 2]" 1
575 1 50 PHE HB2 1 51 SER H 1.800 . 4.900 3.432 2.965 4.050 . 0 0 "[ . 1 . 2]" 1
576 1 50 PHE H 1 69 ILE H 1.800 . 7.600 3.920 3.197 4.877 . 0 0 "[ . 1 . 2]" 1
577 1 50 PHE H 1 69 ILE HB 1.800 . 4.600 3.549 3.183 3.960 . 0 0 "[ . 1 . 2]" 1
578 1 50 PHE HB3 1 69 ILE HB 1.800 . 4.300 4.296 4.132 4.360 0.060 16 0 "[ . 1 . 2]" 1
579 1 50 PHE HB2 1 69 ILE HB 1.800 . 3.600 2.954 2.621 3.194 . 0 0 "[ . 1 . 2]" 1
580 1 50 PHE HB2 1 69 ILE MG 1.800 . 3.900 3.956 3.845 4.007 0.107 9 0 "[ . 1 . 2]" 1
581 1 50 PHE HB3 1 69 ILE MD 1.800 . 3.600 2.787 2.375 3.337 . 0 0 "[ . 1 . 2]" 1
582 1 50 PHE HB2 1 69 ILE MD 1.800 . 3.600 2.937 2.044 3.605 0.005 9 0 "[ . 1 . 2]" 1
583 1 50 PHE QD 1 77 TYR QE 1.800 . 5.200 2.341 2.062 3.463 . 0 0 "[ . 1 . 2]" 1
584 1 50 PHE QE 1 77 TYR QE 1.800 . 5.800 3.273 2.352 4.471 . 0 0 "[ . 1 . 2]" 1
585 1 50 PHE QD 1 88 LEU MD1 1.800 . 5.800 3.677 2.980 4.614 . 0 0 "[ . 1 . 2]" 1
586 1 50 PHE QD 1 88 LEU MD2 1.800 . 5.200 3.592 2.152 4.331 . 0 0 "[ . 1 . 2]" 1
587 1 50 PHE QE 1 88 LEU MD2 1.800 . 5.800 4.564 3.264 5.296 . 0 0 "[ . 1 . 2]" 1
588 1 51 SER H 1 51 SER HB2 1.800 . 4.400 3.299 3.020 3.528 . 0 0 "[ . 1 . 2]" 1
589 1 51 SER HA 1 51 SER HB3 1.800 . 2.900 2.377 2.230 2.607 . 0 0 "[ . 1 . 2]" 1
590 1 51 SER HA 1 52 LEU H 1.800 . 3.100 2.343 1.929 2.727 . 0 0 "[ . 1 . 2]" 1
591 1 51 SER HB3 1 52 LEU H 1.800 . 4.400 3.081 2.137 3.816 . 0 0 "[ . 1 . 2]" 1
592 1 51 SER HA 1 68 LYS HA 1.800 . 3.000 2.830 2.080 3.107 0.107 3 0 "[ . 1 . 2]" 1
593 1 51 SER H 1 69 ILE MD 1.800 . 6.400 3.190 2.755 3.596 . 0 0 "[ . 1 . 2]" 1
594 1 51 SER HA 1 69 ILE H 1.800 . 4.000 2.809 2.295 3.644 . 0 0 "[ . 1 . 2]" 1
595 1 51 SER HA 1 69 ILE QG 1.800 . 4.400 2.836 2.153 4.022 . 0 0 "[ . 1 . 2]" 1
596 1 51 SER HA 1 69 ILE MD 1.800 . 3.900 3.159 2.331 3.924 0.024 3 0 "[ . 1 . 2]" 1
597 1 52 LEU H 1 52 LEU HB3 1.800 . 4.300 2.542 2.153 2.909 . 0 0 "[ . 1 . 2]" 1
598 1 52 LEU HA 1 52 LEU MD1 1.800 . 2.900 2.192 2.002 2.703 . 0 0 "[ . 1 . 2]" 1
599 1 52 LEU HB3 1 52 LEU MD1 1.800 . 4.400 3.227 3.200 3.256 . 0 0 "[ . 1 . 2]" 1
600 1 52 LEU HB3 1 52 LEU MD2 1.800 . 3.200 2.436 2.289 2.504 . 0 0 "[ . 1 . 2]" 1
601 1 52 LEU HB2 1 52 LEU MD1 1.800 . 3.500 2.417 2.328 2.521 . 0 0 "[ . 1 . 2]" 1
602 1 52 LEU HB2 1 52 LEU MD2 1.800 . 3.500 2.319 2.234 2.562 . 0 0 "[ . 1 . 2]" 1
603 1 52 LEU HA 1 53 SER H 1.800 . 3.100 2.003 1.911 2.169 . 0 0 "[ . 1 . 2]" 1
604 1 52 LEU HG 1 53 SER H 1.800 . 5.200 3.664 2.735 4.027 . 0 0 "[ . 1 . 2]" 1
605 1 52 LEU MD1 1 53 SER H 1.800 . 3.300 2.651 2.204 3.091 . 0 0 "[ . 1 . 2]" 1
606 1 52 LEU HG 1 54 VAL MG2 1.800 . 2.900 2.433 2.029 2.775 . 0 0 "[ . 1 . 2]" 1
607 1 52 LEU MD1 1 54 VAL MG2 1.800 . 3.500 2.915 2.256 3.338 . 0 0 "[ . 1 . 2]" 1
608 1 52 LEU MD2 1 54 VAL MG2 1.800 . 3.700 3.280 2.733 3.702 0.002 20 0 "[ . 1 . 2]" 1
609 1 52 LEU H 1 67 TYR H 1.800 . 3.700 2.533 1.975 3.306 . 0 0 "[ . 1 . 2]" 1
610 1 52 LEU H 1 67 TYR HB3 1.800 . 5.100 4.813 4.030 5.115 0.015 5 0 "[ . 1 . 2]" 1
611 1 52 LEU HB3 1 67 TYR HB3 1.800 . 4.100 3.858 3.680 4.112 0.012 18 0 "[ . 1 . 2]" 1
612 1 52 LEU HG 1 67 TYR QD 1.800 . 5.800 2.669 2.130 3.113 . 0 0 "[ . 1 . 2]" 1
613 1 52 LEU MD2 1 67 TYR QD 1.800 . 3.300 2.969 2.191 3.340 0.040 6 0 "[ . 1 . 2]" 1
614 1 52 LEU H 1 68 LYS HA 1.800 . 5.200 4.149 3.475 4.758 . 0 0 "[ . 1 . 2]" 1
615 1 52 LEU H 1 69 ILE H 1.800 . 5.400 4.269 3.310 5.358 . 0 0 "[ . 1 . 2]" 1
616 1 52 LEU H 1 69 ILE QG 1.800 . 4.700 3.889 3.330 4.669 . 0 0 "[ . 1 . 2]" 1
617 1 52 LEU H 1 69 ILE MD 1.800 . 4.400 3.230 2.042 4.257 . 0 0 "[ . 1 . 2]" 1
618 1 52 LEU HB3 1 69 ILE MD 1.800 . 3.700 3.055 2.405 3.702 0.002 3 0 "[ . 1 . 2]" 1
619 1 52 LEU HB2 1 69 ILE MD 1.800 . 3.500 2.069 1.882 2.345 . 0 0 "[ . 1 . 2]" 1
620 1 52 LEU MD1 1 69 ILE MD 1.800 . 3.200 3.251 3.124 3.355 0.155 14 0 "[ . 1 . 2]" 1
621 1 52 LEU MD2 1 69 ILE MD 1.800 . 3.500 2.662 2.305 3.217 . 0 0 "[ . 1 . 2]" 1
622 1 52 LEU MD2 1 79 ILE MD 1.800 . 2.900 2.599 2.075 2.906 0.006 12 0 "[ . 1 . 2]" 1
623 1 52 LEU MD2 1 91 LEU MD2 1.800 . 2.600 2.585 2.284 2.713 0.113 4 0 "[ . 1 . 2]" 1
624 1 52 LEU MD1 1 92 VAL MG1 1.800 . 4.100 3.914 3.344 4.142 0.042 18 0 "[ . 1 . 2]" 1
625 1 52 LEU MD2 1 102 LEU MD1 1.800 . 3.000 2.554 2.080 3.050 0.050 4 0 "[ . 1 . 2]" 1
626 1 52 LEU MD2 1 102 LEU MD2 1.800 . 4.700 3.086 1.989 3.975 . 0 0 "[ . 1 . 2]" 1
627 1 52 LEU MD1 1 106 LEU MD1 1.800 . 4.400 3.854 2.772 4.458 0.058 12 0 "[ . 1 . 2]" 1
628 1 52 LEU MD1 1 106 LEU MD2 1.800 . 4.100 3.753 2.399 4.238 0.138 13 0 "[ . 1 . 2]" 1
629 1 52 LEU MD2 1 106 LEU MD1 1.800 . 4.100 3.796 2.199 4.208 0.108 6 0 "[ . 1 . 2]" 1
630 1 52 LEU MD2 1 106 LEU MD2 1.800 . 4.100 3.394 2.210 4.252 0.152 12 0 "[ . 1 . 2]" 1
631 1 53 SER H 1 54 VAL H 1.800 . 5.300 4.408 4.260 4.510 . 0 0 "[ . 1 . 2]" 1
632 1 53 SER HA 1 54 VAL H 1.800 . 3.000 2.108 1.924 2.239 . 0 0 "[ . 1 . 2]" 1
633 1 53 SER HA 1 54 VAL MG2 1.800 . 6.900 3.409 3.147 3.693 . 0 0 "[ . 1 . 2]" 1
634 1 53 SER HA 1 64 VAL MG2 1.800 . 4.900 4.971 4.923 5.039 0.139 1 0 "[ . 1 . 2]" 1
635 1 53 SER QB 1 64 VAL MG2 1.800 . 3.500 3.579 3.436 3.674 0.174 20 0 "[ . 1 . 2]" 1
636 1 53 SER HA 1 66 HIS HA 1.800 . 3.100 3.116 2.890 3.209 0.109 2 0 "[ . 1 . 2]" 1
637 1 53 SER HA 1 67 TYR H 1.800 . 5.100 4.364 3.968 4.719 . 0 0 "[ . 1 . 2]" 1
638 1 54 VAL H 1 54 VAL HB 1.800 . 3.800 2.928 2.637 3.091 . 0 0 "[ . 1 . 2]" 1
639 1 54 VAL H 1 54 VAL MG2 1.800 . 3.500 2.814 2.714 3.065 . 0 0 "[ . 1 . 2]" 1
640 1 54 VAL HA 1 54 VAL MG1 1.800 . 2.600 2.428 2.371 2.528 . 0 0 "[ . 1 . 2]" 1
641 1 54 VAL HB 1 54 VAL MG1 1.800 . 2.600 2.092 2.040 2.169 . 0 0 "[ . 1 . 2]" 1
642 1 54 VAL HB 1 54 VAL MG2 1.800 . 2.600 2.105 2.053 2.165 . 0 0 "[ . 1 . 2]" 1
643 1 54 VAL HA 1 55 LYS H 1.800 . 3.100 2.443 2.357 2.737 . 0 0 "[ . 1 . 2]" 1
644 1 54 VAL MG1 1 55 LYS H 1.800 . 3.100 2.372 2.263 2.597 . 0 0 "[ . 1 . 2]" 1
645 1 54 VAL MG2 1 55 LYS H 1.800 . 4.400 4.212 4.051 4.335 . 0 0 "[ . 1 . 2]" 1
646 1 54 VAL H 1 64 VAL MG1 1.800 . 3.200 2.237 1.895 2.630 . 0 0 "[ . 1 . 2]" 1
647 1 54 VAL H 1 64 VAL MG2 1.800 . 4.300 4.079 3.747 4.353 0.053 1 0 "[ . 1 . 2]" 1
648 1 54 VAL H 1 65 LYS H 1.800 . 3.600 2.081 1.836 2.304 . 0 0 "[ . 1 . 2]" 1
649 1 54 VAL H 1 66 HIS HA 1.800 . 4.900 4.581 4.369 4.764 . 0 0 "[ . 1 . 2]" 1
650 1 54 VAL H 1 67 TYR H 1.800 . 6.700 5.747 5.066 6.114 . 0 0 "[ . 1 . 2]" 1
651 1 54 VAL HB 1 67 TYR QE 1.800 . 3.600 3.067 2.171 3.660 0.060 13 0 "[ . 1 . 2]" 1
652 1 54 VAL QG 1 67 TYR QD 1.800 . 4.600 3.064 2.716 3.519 . 0 0 "[ . 1 . 2]" 1
653 1 54 VAL MG2 1 67 TYR QE 1.800 . 3.500 2.092 1.830 2.720 . 0 0 "[ . 1 . 2]" 1
654 1 54 VAL MG2 1 102 LEU MD1 1.800 . 3.600 2.819 2.500 3.534 . 0 0 "[ . 1 . 2]" 1
655 1 54 VAL MG1 1 104 GLN HB2 1.800 . 3.600 2.877 2.001 3.629 0.029 12 0 "[ . 1 . 2]" 1
656 1 54 VAL HB 1 106 LEU MD2 1.800 . 5.500 5.345 3.767 5.762 0.262 18 0 "[ . 1 . 2]" 1
657 1 54 VAL MG1 1 106 LEU HA 1.800 . 4.300 4.212 3.335 4.465 0.165 6 0 "[ . 1 . 2]" 1
658 1 54 VAL MG1 1 106 LEU MD2 1.800 . 3.800 3.412 2.220 3.837 0.037 19 0 "[ . 1 . 2]" 1
659 1 54 VAL MG2 1 106 LEU MD2 1.800 . 3.500 3.265 1.839 3.671 0.171 12 0 "[ . 1 . 2]" 1
660 1 55 LYS H 1 55 LYS HB3 1.800 . 3.900 2.385 1.910 2.625 . 0 0 "[ . 1 . 2]" 1
661 1 55 LYS H 1 56 ASP H 1.800 . 5.100 4.561 4.343 4.756 . 0 0 "[ . 1 . 2]" 1
662 1 55 LYS HA 1 56 ASP H 1.800 . 2.900 2.490 2.418 2.618 . 0 0 "[ . 1 . 2]" 1
663 1 55 LYS HA 1 64 VAL MG1 1.800 . 3.700 3.354 2.902 3.713 0.013 7 0 "[ . 1 . 2]" 1
664 1 55 LYS HA 1 64 VAL MG2 1.800 . 3.500 2.410 2.052 3.186 . 0 0 "[ . 1 . 2]" 1
665 1 55 LYS HA 1 65 LYS H 1.800 . 4.900 4.087 3.964 4.223 . 0 0 "[ . 1 . 2]" 1
666 1 56 ASP H 1 56 ASP QB 1.800 . 3.900 2.375 2.202 3.050 . 0 0 "[ . 1 . 2]" 1
667 1 56 ASP H 1 63 VAL H 1.800 . 3.800 3.856 3.810 3.904 0.104 10 0 "[ . 1 . 2]" 1
668 1 56 ASP H 1 63 VAL QG 1.800 . 3.600 2.545 2.234 3.110 . 0 0 "[ . 1 . 2]" 1
669 1 56 ASP HA 1 63 VAL QG 1.800 . 3.700 3.807 3.750 3.940 0.240 20 0 "[ . 1 . 2]" 1
670 1 56 ASP QB 1 63 VAL QG 1.800 . 2.900 1.883 1.795 1.993 0.005 3 0 "[ . 1 . 2]" 1
671 1 56 ASP H 1 64 VAL HA 1.800 . 4.100 2.089 1.819 2.415 . 0 0 "[ . 1 . 2]" 1
672 1 56 ASP H 1 64 VAL MG1 1.800 . 4.600 4.219 3.979 4.418 . 0 0 "[ . 1 . 2]" 1
673 1 56 ASP H 1 65 LYS H 1.800 . 3.900 3.929 3.815 3.967 0.067 3 0 "[ . 1 . 2]" 1
674 1 56 ASP HA 1 104 GLN QG 1.800 . 4.000 3.303 2.028 4.043 0.043 19 0 "[ . 1 . 2]" 1
675 1 57 ILE HA 1 57 ILE QG 1.800 . 3.200 2.480 2.286 3.249 0.049 12 0 "[ . 1 . 2]" 1
676 1 57 ILE HA 1 57 ILE MG 1.800 . 2.600 2.444 2.383 2.527 . 0 0 "[ . 1 . 2]" 1
677 1 57 ILE HA 1 57 ILE MD 1.800 . 3.700 3.494 2.036 3.784 0.084 16 0 "[ . 1 . 2]" 1
678 1 57 ILE HB 1 57 ILE MD 1.800 . 2.900 2.639 2.419 3.105 0.205 15 0 "[ . 1 . 2]" 1
679 1 57 ILE MD 1 57 ILE QG 1.800 . 2.600 1.905 1.853 1.923 . 0 0 "[ . 1 . 2]" 1
680 1 57 ILE MD 1 57 ILE MG 1.800 . 2.600 2.067 1.976 2.641 0.041 12 0 "[ . 1 . 2]" 1
681 1 57 ILE HA 1 58 THR H 1.800 . 3.300 2.050 1.987 2.140 . 0 0 "[ . 1 . 2]" 1
682 1 57 ILE HA 1 58 THR MG 1.800 . 3.300 3.300 3.222 3.353 0.053 7 0 "[ . 1 . 2]" 1
683 1 57 ILE MG 1 58 THR H 1.800 . 4.100 3.038 2.419 3.702 . 0 0 "[ . 1 . 2]" 1
684 1 57 ILE HA 1 62 GLU HA 1.800 . 3.100 2.836 2.429 3.151 0.051 12 0 "[ . 1 . 2]" 1
685 1 57 ILE HA 1 62 GLU QG 1.800 . 4.400 3.350 2.096 3.957 . 0 0 "[ . 1 . 2]" 1
686 1 57 ILE QG 1 62 GLU QG 1.800 . 3.700 2.564 2.033 3.826 0.126 18 0 "[ . 1 . 2]" 1
687 1 57 ILE MG 1 62 GLU QG 1.800 . 3.500 3.126 2.368 3.551 0.051 15 0 "[ . 1 . 2]" 1
688 1 57 ILE MD 1 62 GLU HA 1.800 . 4.700 4.433 2.559 4.754 0.054 13 0 "[ . 1 . 2]" 1
689 1 57 ILE MD 1 62 GLU QG 1.800 . 3.100 2.866 1.871 3.152 0.052 10 0 "[ . 1 . 2]" 1
690 1 57 ILE HA 1 63 VAL H 1.800 . 4.900 3.496 2.915 3.957 . 0 0 "[ . 1 . 2]" 1
691 1 58 THR H 1 58 THR MG 1.800 . 4.100 2.116 1.781 2.464 0.019 1 0 "[ . 1 . 2]" 1
692 1 58 THR HA 1 58 THR MG 1.800 . 5.400 3.300 3.216 3.324 . 0 0 "[ . 1 . 2]" 1
693 1 58 THR HB 1 58 THR MG 1.800 . 2.600 2.117 2.083 2.131 . 0 0 "[ . 1 . 2]" 1
694 1 58 THR HB 1 60 GLN H 1.800 . 4.000 4.047 4.017 4.147 0.147 16 0 "[ . 1 . 2]" 1
695 1 58 THR MG 1 60 GLN H 1.800 . 4.000 2.426 1.856 2.917 . 0 0 "[ . 1 . 2]" 1
696 1 59 THR HA 1 59 THR HB 1.800 . 2.600 2.299 2.246 2.330 . 0 0 "[ . 1 . 2]" 1
697 1 59 THR HA 1 59 THR MG 1.800 . 3.300 3.293 3.266 3.332 0.032 3 0 "[ . 1 . 2]" 1
698 1 59 THR HB 1 59 THR MG 1.800 . 2.600 2.114 2.109 2.125 . 0 0 "[ . 1 . 2]" 1
699 1 59 THR HA 1 60 GLN H 1.800 . 3.900 3.316 3.112 3.402 . 0 0 "[ . 1 . 2]" 1
700 1 59 THR HB 1 60 GLN H 1.800 . 4.500 4.519 4.500 4.545 0.045 4 0 "[ . 1 . 2]" 1
701 1 59 THR MG 1 60 GLN H 1.800 . 4.700 3.309 3.175 3.576 . 0 0 "[ . 1 . 2]" 1
702 1 60 GLN H 1 60 GLN HA 1.800 . 3.000 2.965 2.912 3.005 0.005 16 0 "[ . 1 . 2]" 1
703 1 60 GLN H 1 60 GLN HB3 1.800 . 3.800 3.723 3.597 3.855 0.055 12 0 "[ . 1 . 2]" 1
704 1 60 GLN H 1 60 GLN HB2 1.800 . 3.500 2.588 2.350 2.844 . 0 0 "[ . 1 . 2]" 1
705 1 60 GLN H 1 60 GLN QG 1.800 . 3.200 2.959 2.749 3.213 0.013 19 0 "[ . 1 . 2]" 1
706 1 60 GLN HA 1 60 GLN HB3 1.800 . 2.600 2.503 2.375 2.611 0.011 6 0 "[ . 1 . 2]" 1
707 1 60 GLN HA 1 60 GLN HB2 1.800 . 3.000 3.029 3.013 3.043 0.043 1 0 "[ . 1 . 2]" 1
708 1 60 GLN HA 1 60 GLN QG 1.800 . 2.800 2.488 2.313 2.846 0.046 16 0 "[ . 1 . 2]" 1
709 1 60 GLN HB3 1 60 GLN QG 1.800 . 2.600 2.350 2.165 2.570 . 0 0 "[ . 1 . 2]" 1
710 1 60 GLN HB2 1 60 GLN QG 1.800 . 2.600 2.444 2.211 2.612 0.012 3 0 "[ . 1 . 2]" 1
711 1 60 GLN H 1 61 GLY H 1.800 . 3.000 2.398 2.163 3.016 0.016 12 0 "[ . 1 . 2]" 1
712 1 60 GLN HA 1 61 GLY H 1.800 . 4.000 3.271 2.460 3.572 . 0 0 "[ . 1 . 2]" 1
713 1 61 GLY HA2 1 62 GLU H 1.800 . 3.000 2.306 2.035 2.654 . 0 0 "[ . 1 . 2]" 1
714 1 62 GLU H 1 62 GLU QB 1.800 . 3.800 2.059 1.913 2.295 . 0 0 "[ . 1 . 2]" 1
715 1 62 GLU H 1 62 GLU QG 1.800 . 3.700 3.759 3.642 3.818 0.118 15 0 "[ . 1 . 2]" 1
716 1 62 GLU HA 1 62 GLU QG 1.800 . 3.700 2.259 2.091 2.376 . 0 0 "[ . 1 . 2]" 1
717 1 62 GLU H 1 63 VAL QG 1.800 . 4.700 4.216 3.763 4.807 0.107 11 0 "[ . 1 . 2]" 1
718 1 62 GLU HA 1 63 VAL H 1.800 . 3.700 2.242 2.095 2.364 . 0 0 "[ . 1 . 2]" 1
719 1 62 GLU HA 1 63 VAL QG 1.800 . 3.700 3.377 3.107 3.583 . 0 0 "[ . 1 . 2]" 1
720 1 63 VAL H 1 63 VAL QG 1.800 . 3.700 2.217 1.949 2.418 . 0 0 "[ . 1 . 2]" 1
721 1 63 VAL HB 1 63 VAL QG 1.800 . 2.600 1.912 1.903 1.931 . 0 0 "[ . 1 . 2]" 1
722 1 63 VAL HB 1 64 VAL H 1.800 . 4.100 2.450 1.787 4.100 0.013 12 0 "[ . 1 . 2]" 1
723 1 63 VAL QG 1 64 VAL H 1.800 . 4.800 2.477 1.776 3.390 0.024 11 0 "[ . 1 . 2]" 1
724 1 63 VAL QG 1 65 LYS H 1.800 . 4.500 4.571 4.504 4.660 0.160 20 0 "[ . 1 . 2]" 1
725 1 63 VAL QG 1 65 LYS QG 1.800 . 4.600 3.537 2.911 4.683 0.083 3 0 "[ . 1 . 2]" 1
726 1 63 VAL QG 1 65 LYS QD 1.800 . 3.800 3.460 2.878 3.894 0.094 16 0 "[ . 1 . 2]" 1
727 1 64 VAL H 1 64 VAL MG1 1.800 . 4.900 3.856 3.613 4.060 . 0 0 "[ . 1 . 2]" 1
728 1 64 VAL HA 1 64 VAL MG1 1.800 . 2.600 2.611 2.378 2.721 0.121 15 0 "[ . 1 . 2]" 1
729 1 64 VAL HA 1 64 VAL MG2 1.800 . 2.900 2.273 2.189 2.489 . 0 0 "[ . 1 . 2]" 1
730 1 64 VAL HB 1 64 VAL MG1 1.800 . 2.600 2.178 2.140 2.216 . 0 0 "[ . 1 . 2]" 1
731 1 64 VAL HA 1 65 LYS H 1.800 . 2.800 2.649 2.501 2.803 0.003 10 0 "[ . 1 . 2]" 1
732 1 64 VAL MG1 1 65 LYS H 1.800 . 3.600 1.755 1.716 1.797 0.084 1 0 "[ . 1 . 2]" 1
733 1 64 VAL MG2 1 65 LYS H 1.800 . 3.500 3.449 3.204 3.598 0.098 5 0 "[ . 1 . 2]" 1
734 1 65 LYS H 1 65 LYS HB3 1.800 . 4.300 3.907 3.733 4.207 . 0 0 "[ . 1 . 2]" 1
735 1 65 LYS H 1 65 LYS HB2 1.800 . 3.700 2.888 2.606 3.498 . 0 0 "[ . 1 . 2]" 1
736 1 65 LYS H 1 65 LYS QG 1.800 . 4.300 3.561 3.078 4.309 0.009 18 0 "[ . 1 . 2]" 1
737 1 65 LYS H 1 65 LYS QD 1.800 . 5.400 3.923 2.459 4.828 . 0 0 "[ . 1 . 2]" 1
738 1 65 LYS HA 1 65 LYS HB3 1.800 . 3.000 2.615 2.288 2.796 . 0 0 "[ . 1 . 2]" 1
739 1 65 LYS HA 1 65 LYS QG 1.800 . 3.500 2.672 2.204 3.013 . 0 0 "[ . 1 . 2]" 1
740 1 65 LYS HA 1 65 LYS QD 1.800 . 3.000 2.567 2.059 3.243 0.243 12 0 "[ . 1 . 2]" 1
741 1 65 LYS QE 1 65 LYS QG 1.800 . 3.100 2.319 2.108 2.885 . 0 0 "[ . 1 . 2]" 1
742 1 65 LYS QD 1 65 LYS QE 1.800 . 2.900 2.089 1.990 2.157 . 0 0 "[ . 1 . 2]" 1
743 1 65 LYS HA 1 66 HIS H 1.800 . 2.600 2.429 2.027 2.631 0.031 12 0 "[ . 1 . 2]" 1
744 1 65 LYS HA 1 66 HIS HD1 1.800 . 6.900 4.245 3.162 5.032 . 0 0 "[ . 1 . 2]" 1
745 1 65 LYS HB3 1 66 HIS H 1.800 . 3.800 2.357 1.768 3.396 0.032 10 0 "[ . 1 . 2]" 1
746 1 65 LYS HB2 1 66 HIS H 1.800 . 4.300 3.519 2.532 4.331 0.031 20 0 "[ . 1 . 2]" 1
747 1 65 LYS QD 1 66 HIS H 1.800 . 4.100 3.580 2.935 4.296 0.196 11 0 "[ . 1 . 2]" 1
748 1 65 LYS HB3 1 67 TYR QE 1.800 . 3.800 3.026 2.323 3.824 0.024 10 0 "[ . 1 . 2]" 1
749 1 65 LYS HB2 1 67 TYR QE 1.800 . 3.800 2.929 2.288 3.875 0.075 20 0 "[ . 1 . 2]" 1
750 1 65 LYS QD 1 67 TYR QE 1.800 . 5.800 4.014 2.732 4.749 . 0 0 "[ . 1 . 2]" 1
751 1 66 HIS H 1 66 HIS HB3 1.800 . 3.800 3.826 3.700 3.880 0.080 18 0 "[ . 1 . 2]" 1
752 1 66 HIS H 1 66 HIS HD1 1.800 . 4.100 3.858 2.716 4.182 0.082 11 0 "[ . 1 . 2]" 1
753 1 66 HIS HA 1 67 TYR H 1.800 . 3.000 2.194 2.035 2.311 . 0 0 "[ . 1 . 2]" 1
754 1 66 HIS HA 1 67 TYR QD 1.800 . 4.300 3.914 3.362 4.374 0.074 18 0 "[ . 1 . 2]" 1
755 1 66 HIS HB3 1 67 TYR H 1.800 . 4.100 3.553 3.038 4.111 0.011 4 0 "[ . 1 . 2]" 1
756 1 66 HIS HB2 1 67 TYR H 1.800 . 4.800 4.338 3.956 4.655 . 0 0 "[ . 1 . 2]" 1
757 1 67 TYR H 1 67 TYR HB3 1.800 . 4.300 3.876 3.675 3.999 . 0 0 "[ . 1 . 2]" 1
758 1 67 TYR H 1 67 TYR QD 1.800 . 4.000 2.772 2.160 3.460 . 0 0 "[ . 1 . 2]" 1
759 1 67 TYR HB3 1 67 TYR QD 1.800 . 3.300 2.423 2.312 2.765 . 0 0 "[ . 1 . 2]" 1
760 1 67 TYR HA 1 68 LYS H 1.800 . 2.900 2.260 2.018 2.572 . 0 0 "[ . 1 . 2]" 1
761 1 67 TYR HB2 1 68 LYS H 1.800 . 4.300 3.734 3.202 4.193 . 0 0 "[ . 1 . 2]" 1
762 1 67 TYR QD 1 68 LYS H 1.800 . 5.400 4.209 3.533 4.751 . 0 0 "[ . 1 . 2]" 1
763 1 67 TYR HB3 1 79 ILE MG 1.800 . 3.900 2.162 1.961 2.830 . 0 0 "[ . 1 . 2]" 1
764 1 67 TYR HB2 1 79 ILE MG 1.800 . 3.600 2.381 1.965 2.783 . 0 0 "[ . 1 . 2]" 1
765 1 67 TYR HB3 1 79 ILE MD 1.800 . 4.600 3.418 2.566 3.925 . 0 0 "[ . 1 . 2]" 1
766 1 67 TYR HB2 1 79 ILE MD 1.800 . 3.700 3.477 2.659 3.759 0.059 3 0 "[ . 1 . 2]" 1
767 1 67 TYR QD 1 79 ILE MG 1.800 . 3.500 3.509 3.042 3.604 0.104 7 0 "[ . 1 . 2]" 1
768 1 67 TYR QD 1 79 ILE MD 1.800 . 5.800 3.834 3.346 4.154 . 0 0 "[ . 1 . 2]" 1
769 1 67 TYR QD 1 102 LEU MD2 1.800 . 4.000 3.072 2.817 3.436 . 0 0 "[ . 1 . 2]" 1
770 1 67 TYR QE 1 102 LEU HA 1.800 . 4.600 3.118 2.482 4.268 . 0 0 "[ . 1 . 2]" 1
771 1 67 TYR QE 1 102 LEU HG 1.800 . 5.800 5.178 4.866 5.502 . 0 0 "[ . 1 . 2]" 1
772 1 67 TYR QE 1 102 LEU MD1 1.800 . 4.400 3.359 2.285 4.427 0.027 11 0 "[ . 1 . 2]" 1
773 1 67 TYR QE 1 102 LEU MD2 1.800 . 3.500 2.822 2.557 3.392 . 0 0 "[ . 1 . 2]" 1
774 1 68 LYS H 1 68 LYS QB 1.800 . 3.000 2.893 2.332 3.090 0.090 10 0 "[ . 1 . 2]" 1
775 1 68 LYS H 1 68 LYS QG 1.800 . 3.800 2.628 1.785 3.554 0.015 7 0 "[ . 1 . 2]" 1
776 1 68 LYS H 1 68 LYS QD 1.800 . 4.300 2.255 1.773 4.066 0.027 15 0 "[ . 1 . 2]" 1
777 1 68 LYS HA 1 68 LYS QG 1.800 . 3.300 3.400 3.313 3.450 0.150 9 0 "[ . 1 . 2]" 1
778 1 68 LYS HA 1 68 LYS QD 1.800 . 3.600 3.627 3.506 3.689 0.089 4 0 "[ . 1 . 2]" 1
779 1 68 LYS QB 1 68 LYS QG 1.800 . 2.600 2.001 1.954 2.055 . 0 0 "[ . 1 . 2]" 1
780 1 68 LYS QB 1 68 LYS QE 1.800 . 3.500 3.252 2.277 3.620 0.120 6 0 "[ . 1 . 2]" 1
781 1 68 LYS H 1 69 ILE H 1.800 . 4.900 4.056 3.654 4.577 . 0 0 "[ . 1 . 2]" 1
782 1 68 LYS HA 1 69 ILE H 1.800 . 2.900 2.039 1.850 2.296 . 0 0 "[ . 1 . 2]" 1
783 1 68 LYS QB 1 69 ILE H 1.800 . 4.000 3.428 2.532 3.856 . 0 0 "[ . 1 . 2]" 1
784 1 68 LYS QG 1 69 ILE H 1.800 . 4.700 4.424 3.839 4.800 0.100 7 0 "[ . 1 . 2]" 1
785 1 68 LYS QD 1 69 ILE H 1.800 . 4.900 4.567 3.441 4.990 0.090 9 0 "[ . 1 . 2]" 1
786 1 68 LYS QB 1 70 ARG QG 1.800 . 4.500 4.271 3.136 4.554 0.054 3 0 "[ . 1 . 2]" 1
787 1 69 ILE H 1 69 ILE HB 1.800 . 3.900 3.558 3.405 3.756 . 0 0 "[ . 1 . 2]" 1
788 1 69 ILE H 1 69 ILE QG 1.800 . 4.100 2.109 1.809 2.736 . 0 0 "[ . 1 . 2]" 1
789 1 69 ILE H 1 69 ILE MG 1.800 . 4.700 3.676 3.385 4.078 . 0 0 "[ . 1 . 2]" 1
790 1 69 ILE H 1 69 ILE MD 1.800 . 4.800 3.076 1.981 4.398 . 0 0 "[ . 1 . 2]" 1
791 1 69 ILE HA 1 69 ILE QG 1.800 . 4.100 3.318 3.078 3.491 . 0 0 "[ . 1 . 2]" 1
792 1 69 ILE HA 1 69 ILE MG 1.800 . 2.800 2.198 2.091 2.363 . 0 0 "[ . 1 . 2]" 1
793 1 69 ILE HA 1 69 ILE MD 1.800 . 3.800 3.779 3.543 3.987 0.187 3 0 "[ . 1 . 2]" 1
794 1 69 ILE HB 1 69 ILE MD 1.800 . 3.500 2.866 2.264 3.271 . 0 0 "[ . 1 . 2]" 1
795 1 69 ILE MD 1 69 ILE QG 1.800 . 2.600 1.898 1.858 1.917 . 0 0 "[ . 1 . 2]" 1
796 1 69 ILE MD 1 69 ILE MG 1.800 . 2.600 2.014 1.887 2.251 . 0 0 "[ . 1 . 2]" 1
797 1 69 ILE HA 1 70 ARG H 1.800 . 3.100 2.062 1.913 2.171 . 0 0 "[ . 1 . 2]" 1
798 1 69 ILE MG 1 70 ARG H 1.800 . 3.900 3.238 2.022 3.683 . 0 0 "[ . 1 . 2]" 1
799 1 69 ILE MG 1 77 TYR HA 1.800 . 3.900 3.825 3.299 3.934 0.034 14 0 "[ . 1 . 2]" 1
800 1 69 ILE MG 1 77 TYR HB3 1.800 . 3.100 2.065 1.913 2.324 . 0 0 "[ . 1 . 2]" 1
801 1 69 ILE MG 1 77 TYR HB2 1.800 . 3.500 3.070 2.550 3.541 0.041 17 0 "[ . 1 . 2]" 1
802 1 69 ILE MG 1 77 TYR QD 1.800 . 3.000 3.037 2.845 3.112 0.112 6 0 "[ . 1 . 2]" 1
803 1 69 ILE MG 1 77 TYR QE 1.800 . 5.200 4.629 4.437 4.858 . 0 0 "[ . 1 . 2]" 1
804 1 69 ILE HA 1 78 TYR H 1.800 . 5.200 3.733 3.331 4.128 . 0 0 "[ . 1 . 2]" 1
805 1 69 ILE MG 1 78 TYR H 1.800 . 3.300 3.087 2.298 3.333 0.033 9 0 "[ . 1 . 2]" 1
806 1 69 ILE MG 1 79 ILE QG 1.800 . 4.000 2.761 1.987 3.656 . 0 0 "[ . 1 . 2]" 1
807 1 69 ILE MG 1 79 ILE MD 1.800 . 3.900 2.810 2.113 3.790 . 0 0 "[ . 1 . 2]" 1
808 1 69 ILE MG 1 88 LEU MD2 1.800 . 3.000 2.480 1.925 3.101 0.101 20 0 "[ . 1 . 2]" 1
809 1 69 ILE MD 1 88 LEU MD2 1.800 . 3.100 2.647 1.895 3.266 0.166 5 0 "[ . 1 . 2]" 1
810 1 69 ILE MG 1 91 LEU MD1 1.800 . 3.100 2.027 1.804 2.484 . 0 0 "[ . 1 . 2]" 1
811 1 69 ILE MD 1 91 LEU MD1 1.800 . 3.100 3.018 2.634 3.180 0.080 20 0 "[ . 1 . 2]" 1
812 1 69 ILE MD 1 91 LEU MD2 1.800 . 3.800 3.262 3.059 3.429 . 0 0 "[ . 1 . 2]" 1
813 1 70 ARG H 1 70 ARG HB2 1.800 . 4.000 2.385 2.106 2.581 . 0 0 "[ . 1 . 2]" 1
814 1 70 ARG H 1 70 ARG QG 1.800 . 3.700 3.219 2.483 3.702 0.002 7 0 "[ . 1 . 2]" 1
815 1 70 ARG H 1 70 ARG QD 1.800 . 4.800 3.516 2.186 4.736 . 0 0 "[ . 1 . 2]" 1
816 1 70 ARG HA 1 70 ARG HB3 1.800 . 3.000 2.590 2.486 2.758 . 0 0 "[ . 1 . 2]" 1
817 1 70 ARG HA 1 70 ARG QG 1.800 . 2.800 2.267 2.144 2.394 . 0 0 "[ . 1 . 2]" 1
818 1 70 ARG HA 1 70 ARG QD 1.800 . 3.300 3.240 2.892 3.430 0.130 5 0 "[ . 1 . 2]" 1
819 1 70 ARG HB3 1 70 ARG QG 1.800 . 2.600 2.371 2.142 2.570 . 0 0 "[ . 1 . 2]" 1
820 1 70 ARG HB2 1 70 ARG QG 1.800 . 2.600 2.346 2.199 2.515 . 0 0 "[ . 1 . 2]" 1
821 1 70 ARG HB3 1 70 ARG QD 1.800 . 3.200 2.635 2.068 3.273 0.073 2 0 "[ . 1 . 2]" 1
822 1 70 ARG HB2 1 70 ARG QD 1.800 . 3.200 2.535 2.147 3.048 . 0 0 "[ . 1 . 2]" 1
823 1 70 ARG QD 1 70 ARG QG 1.800 . 2.600 2.117 2.100 2.151 . 0 0 "[ . 1 . 2]" 1
824 1 70 ARG H 1 71 SER H 1.800 . 4.500 4.438 4.246 4.537 0.037 12 0 "[ . 1 . 2]" 1
825 1 70 ARG HA 1 71 SER H 1.800 . 2.600 2.327 1.984 2.611 0.011 16 0 "[ . 1 . 2]" 1
826 1 70 ARG HB3 1 71 SER H 1.800 . 3.300 2.460 1.953 3.196 . 0 0 "[ . 1 . 2]" 1
827 1 70 ARG HB2 1 71 SER H 1.800 . 4.100 3.678 3.205 4.125 0.025 5 0 "[ . 1 . 2]" 1
828 1 70 ARG QG 1 71 SER H 1.800 . 3.900 3.691 3.310 3.979 0.079 9 0 "[ . 1 . 2]" 1
829 1 70 ARG QD 1 71 SER H 1.800 . 4.600 4.143 2.921 4.720 0.120 3 0 "[ . 1 . 2]" 1
830 1 70 ARG H 1 78 TYR H 1.800 . 2.900 2.782 2.339 2.905 0.005 14 0 "[ . 1 . 2]" 1
831 1 70 ARG HB3 1 78 TYR H 1.800 . 4.800 4.529 3.953 4.844 0.044 1 0 "[ . 1 . 2]" 1
832 1 70 ARG HB3 1 78 TYR QE 1.800 . 5.800 3.400 2.841 4.489 . 0 0 "[ . 1 . 2]" 1
833 1 70 ARG HB2 1 78 TYR QE 1.800 . 5.800 3.004 2.484 3.664 . 0 0 "[ . 1 . 2]" 1
834 1 70 ARG QG 1 78 TYR QE 1.800 . 4.500 3.627 3.181 4.362 . 0 0 "[ . 1 . 2]" 1
835 1 70 ARG QD 1 78 TYR QD 1.800 . 4.000 4.025 3.730 4.110 0.110 5 0 "[ . 1 . 2]" 1
836 1 70 ARG QD 1 78 TYR QE 1.800 . 3.600 2.796 2.224 3.610 0.010 1 0 "[ . 1 . 2]" 1
837 1 70 ARG H 1 79 ILE HA 1.800 . 5.400 4.055 3.737 4.356 . 0 0 "[ . 1 . 2]" 1
838 1 71 SER H 1 71 SER QB 1.800 . 3.100 3.061 2.768 3.169 0.069 20 0 "[ . 1 . 2]" 1
839 1 71 SER HA 1 71 SER QB 1.800 . 2.600 2.184 2.140 2.234 . 0 0 "[ . 1 . 2]" 1
840 1 71 SER H 1 72 LEU H 1.800 . 4.300 4.236 4.043 4.359 0.059 4 0 "[ . 1 . 2]" 1
841 1 71 SER HA 1 72 LEU H 1.800 . 2.600 2.144 2.025 2.262 . 0 0 "[ . 1 . 2]" 1
842 1 71 SER QB 1 72 LEU H 1.800 . 3.500 3.452 3.316 3.536 0.036 14 0 "[ . 1 . 2]" 1
843 1 71 SER HA 1 77 TYR HA 1.800 . 3.000 2.728 2.460 2.912 . 0 0 "[ . 1 . 2]" 1
844 1 71 SER HA 1 77 TYR QD 1.800 . 4.300 3.427 3.003 3.879 . 0 0 "[ . 1 . 2]" 1
845 1 71 SER HB3 1 77 TYR QD 1.800 . 5.800 3.666 3.284 4.265 . 0 0 "[ . 1 . 2]" 1
846 1 71 SER QB 1 77 TYR QE 1.800 . 4.100 2.799 2.232 3.742 . 0 0 "[ . 1 . 2]" 1
847 1 71 SER HA 1 78 TYR H 1.800 . 4.100 4.163 4.077 4.206 0.106 20 0 "[ . 1 . 2]" 1
848 1 72 LEU H 1 72 LEU QB 1.800 . 3.100 2.678 2.564 2.859 . 0 0 "[ . 1 . 2]" 1
849 1 72 LEU H 1 72 LEU HG 1.800 . 3.700 3.761 3.733 3.791 0.091 4 0 "[ . 1 . 2]" 1
850 1 72 LEU H 1 72 LEU MD1 1.800 . 3.000 2.917 2.697 3.037 0.037 16 0 "[ . 1 . 2]" 1
851 1 72 LEU H 1 72 LEU MD2 1.800 . 3.300 1.824 1.760 1.879 0.040 4 0 "[ . 1 . 2]" 1
852 1 72 LEU HA 1 72 LEU HG 1.800 . 3.700 3.739 3.722 3.765 0.065 8 0 "[ . 1 . 2]" 1
853 1 72 LEU HA 1 72 LEU MD1 1.800 . 2.600 2.077 1.996 2.187 . 0 0 "[ . 1 . 2]" 1
854 1 72 LEU QB 1 72 LEU MD1 1.800 . 3.200 2.410 2.332 2.490 . 0 0 "[ . 1 . 2]" 1
855 1 72 LEU QB 1 72 LEU MD2 1.800 . 2.800 2.125 2.100 2.154 . 0 0 "[ . 1 . 2]" 1
856 1 72 LEU H 1 73 ASP H 1.800 . 4.400 4.337 4.248 4.404 0.004 20 0 "[ . 1 . 2]" 1
857 1 72 LEU HA 1 73 ASP H 1.800 . 3.000 2.003 1.924 2.105 . 0 0 "[ . 1 . 2]" 1
858 1 72 LEU QB 1 73 ASP H 1.800 . 4.400 2.774 2.198 3.046 . 0 0 "[ . 1 . 2]" 1
859 1 72 LEU MD1 1 73 ASP H 1.800 . 3.600 3.677 3.657 3.695 0.095 6 0 "[ . 1 . 2]" 1
860 1 72 LEU QB 1 74 ASN H 1.800 . 4.000 2.709 2.276 2.800 . 0 0 "[ . 1 . 2]" 1
861 1 72 LEU QD 1 74 ASN H 1.800 . 4.300 4.275 3.936 4.358 0.058 20 0 "[ . 1 . 2]" 1
862 1 72 LEU H 1 75 GLY H 1.800 . 5.600 4.162 4.003 4.349 . 0 0 "[ . 1 . 2]" 1
863 1 72 LEU QB 1 75 GLY H 1.800 . 3.900 2.304 1.906 3.433 . 0 0 "[ . 1 . 2]" 1
864 1 72 LEU MD2 1 75 GLY H 1.800 . 3.900 3.792 3.597 3.992 0.092 11 0 "[ . 1 . 2]" 1
865 1 72 LEU H 1 76 GLY H 1.800 . 3.700 3.652 3.165 3.774 0.074 3 0 "[ . 1 . 2]" 1
866 1 72 LEU QB 1 76 GLY H 1.800 . 4.000 2.984 2.583 3.801 . 0 0 "[ . 1 . 2]" 1
867 1 72 LEU MD2 1 76 GLY H 1.800 . 3.600 3.362 2.956 3.610 0.010 17 0 "[ . 1 . 2]" 1
868 1 72 LEU MD2 1 76 GLY HA3 1.800 . 3.600 3.535 2.790 3.739 0.139 17 0 "[ . 1 . 2]" 1
869 1 72 LEU MD2 1 76 GLY HA2 1.800 . 3.900 3.850 3.738 3.937 0.037 11 0 "[ . 1 . 2]" 1
870 1 72 LEU H 1 77 TYR HA 1.800 . 4.700 3.212 2.915 3.579 . 0 0 "[ . 1 . 2]" 1
871 1 72 LEU MD2 1 77 TYR H 1.800 . 3.700 2.834 2.622 3.232 . 0 0 "[ . 1 . 2]" 1
872 1 72 LEU HA 1 78 TYR QE 1.800 . 5.800 5.579 5.366 5.813 0.013 14 0 "[ . 1 . 2]" 1
873 1 72 LEU HB3 1 78 TYR QD 1.800 . 4.400 4.489 4.460 4.532 0.132 1 0 "[ . 1 . 2]" 1
874 1 72 LEU HB3 1 78 TYR QE 1.800 . 5.800 5.174 4.896 5.351 . 0 0 "[ . 1 . 2]" 1
875 1 72 LEU HG 1 78 TYR QD 1.800 . 3.700 2.407 2.279 2.532 . 0 0 "[ . 1 . 2]" 1
876 1 72 LEU HG 1 78 TYR QE 1.800 . 3.700 3.690 3.337 3.778 0.078 7 0 "[ . 1 . 2]" 1
877 1 72 LEU MD1 1 78 TYR QD 1.800 . 4.600 2.159 1.991 2.350 . 0 0 "[ . 1 . 2]" 1
878 1 72 LEU MD2 1 78 TYR QD 1.800 . 3.900 2.061 1.969 2.290 . 0 0 "[ . 1 . 2]" 1
879 1 72 LEU MD1 1 78 TYR QE 1.800 . 3.500 2.039 1.962 2.110 . 0 0 "[ . 1 . 2]" 1
880 1 72 LEU MD2 1 78 TYR QE 1.800 . 4.000 3.851 3.667 4.011 0.011 9 0 "[ . 1 . 2]" 1
881 1 73 ASP H 1 73 ASP QB 1.800 . 3.200 2.658 2.462 2.766 . 0 0 "[ . 1 . 2]" 1
882 1 73 ASP HA 1 73 ASP QB 1.800 . 2.600 2.220 2.204 2.228 . 0 0 "[ . 1 . 2]" 1
883 1 73 ASP H 1 74 ASN H 1.800 . 3.900 2.582 2.365 3.060 . 0 0 "[ . 1 . 2]" 1
884 1 73 ASP HA 1 74 ASN H 1.800 . 3.500 3.458 3.403 3.527 0.027 11 0 "[ . 1 . 2]" 1
885 1 73 ASP HA 1 74 ASN HA 1.800 . 4.700 4.614 4.478 4.707 0.007 8 0 "[ . 1 . 2]" 1
886 1 73 ASP QB 1 74 ASN H 1.800 . 3.600 3.499 3.397 3.645 0.045 9 0 "[ . 1 . 2]" 1
887 1 73 ASP QB 1 74 ASN HA 1.800 . 4.400 4.423 4.254 4.466 0.066 20 0 "[ . 1 . 2]" 1
888 1 73 ASP HA 1 75 GLY H 1.800 . 4.400 4.130 3.869 4.442 0.042 20 0 "[ . 1 . 2]" 1
889 1 73 ASP QB 1 75 GLY H 1.800 . 5.100 4.951 4.869 5.132 0.032 7 0 "[ . 1 . 2]" 1
890 1 74 ASN H 1 74 ASN HA 1.800 . 3.000 2.945 2.844 2.985 . 0 0 "[ . 1 . 2]" 1
891 1 74 ASN H 1 74 ASN QB 1.800 . 3.100 2.825 2.527 3.123 0.023 7 0 "[ . 1 . 2]" 1
892 1 74 ASN HA 1 74 ASN QB 1.800 . 2.600 2.208 2.145 2.228 . 0 0 "[ . 1 . 2]" 1
893 1 74 ASN H 1 75 GLY H 1.800 . 2.600 2.270 1.886 2.463 . 0 0 "[ . 1 . 2]" 1
894 1 74 ASN HA 1 75 GLY H 1.800 . 3.200 3.206 2.760 3.296 0.096 11 0 "[ . 1 . 2]" 1
895 1 74 ASN QB 1 75 GLY H 1.800 . 3.900 3.851 3.445 3.970 0.070 7 0 "[ . 1 . 2]" 1
896 1 74 ASN H 1 76 GLY H 1.800 . 4.400 4.092 3.576 4.448 0.048 5 0 "[ . 1 . 2]" 1
897 1 75 GLY H 1 75 GLY HA3 1.800 . 3.100 2.767 2.519 3.008 . 0 0 "[ . 1 . 2]" 1
898 1 75 GLY H 1 76 GLY H 1.800 . 3.100 2.099 1.789 2.581 0.011 7 0 "[ . 1 . 2]" 1
899 1 75 GLY HA2 1 76 GLY H 1.800 . 3.000 2.968 2.291 3.120 0.120 7 0 "[ . 1 . 2]" 1
900 1 76 GLY H 1 77 TYR H 1.800 . 4.100 4.134 4.105 4.172 0.072 5 0 "[ . 1 . 2]" 1
901 1 76 GLY QA 1 77 TYR H 1.800 . 3.200 2.213 2.050 2.329 . 0 0 "[ . 1 . 2]" 1
902 1 76 GLY HA3 1 77 TYR QD 1.800 . 5.800 3.500 3.128 4.976 . 0 0 "[ . 1 . 2]" 1
903 1 76 GLY HA2 1 77 TYR QD 1.800 . 5.800 3.668 2.868 4.021 . 0 0 "[ . 1 . 2]" 1
904 1 76 GLY H 1 86 PRO HA 1.800 . 3.900 3.934 3.805 4.003 0.103 9 0 "[ . 1 . 2]" 1
905 1 76 GLY QA 1 86 PRO HA 1.800 . 3.200 2.527 1.976 2.908 . 0 0 "[ . 1 . 2]" 1
906 1 77 TYR H 1 77 TYR HB3 1.800 . 4.300 3.980 3.861 4.051 . 0 0 "[ . 1 . 2]" 1
907 1 77 TYR H 1 77 TYR HB2 1.800 . 3.800 3.061 2.890 3.202 . 0 0 "[ . 1 . 2]" 1
908 1 77 TYR H 1 77 TYR QD 1.800 . 4.100 3.216 3.047 3.669 . 0 0 "[ . 1 . 2]" 1
909 1 77 TYR HB3 1 77 TYR QD 1.800 . 3.200 2.334 2.293 2.415 . 0 0 "[ . 1 . 2]" 1
910 1 77 TYR H 1 78 TYR H 1.800 . 4.400 4.181 4.016 4.277 . 0 0 "[ . 1 . 2]" 1
911 1 77 TYR HA 1 78 TYR H 1.800 . 3.000 2.062 1.960 2.195 . 0 0 "[ . 1 . 2]" 1
912 1 77 TYR HA 1 78 TYR QD 1.800 . 4.300 4.347 4.325 4.383 0.083 20 0 "[ . 1 . 2]" 1
913 1 77 TYR HB3 1 78 TYR H 1.800 . 3.800 2.884 2.506 3.337 . 0 0 "[ . 1 . 2]" 1
914 1 77 TYR HB2 1 78 TYR H 1.800 . 4.600 3.951 3.673 4.266 . 0 0 "[ . 1 . 2]" 1
915 1 77 TYR QD 1 78 TYR H 1.800 . 4.900 3.884 3.430 4.272 . 0 0 "[ . 1 . 2]" 1
916 1 77 TYR H 1 84 THR HB 1.800 . 6.000 5.237 4.344 5.584 . 0 0 "[ . 1 . 2]" 1
917 1 77 TYR H 1 84 THR MG 1.800 . 5.400 2.957 2.142 3.407 . 0 0 "[ . 1 . 2]" 1
918 1 77 TYR H 1 85 PHE H 1.800 . 2.600 2.620 2.144 2.728 0.128 13 0 "[ . 1 . 2]" 1
919 1 77 TYR H 1 85 PHE QB 1.800 . 4.900 3.658 3.212 4.145 . 0 0 "[ . 1 . 2]" 1
920 1 77 TYR H 1 86 PRO HA 1.800 . 4.900 4.193 3.865 4.401 . 0 0 "[ . 1 . 2]" 1
921 1 77 TYR QD 1 87 THR HA 1.800 . 4.000 2.054 1.940 2.145 . 0 0 "[ . 1 . 2]" 1
922 1 77 TYR QE 1 87 THR HA 1.800 . 3.200 2.212 2.040 2.596 . 0 0 "[ . 1 . 2]" 1
923 1 77 TYR QE 1 87 THR MG 1.800 . 4.500 4.619 4.580 4.693 0.193 4 0 "[ . 1 . 2]" 1
924 1 77 TYR HB3 1 88 LEU MD2 1.800 . 3.800 2.880 2.149 3.634 . 0 0 "[ . 1 . 2]" 1
925 1 77 TYR HB2 1 88 LEU MD2 1.800 . 6.900 2.801 2.245 3.651 . 0 0 "[ . 1 . 2]" 1
926 1 77 TYR QD 1 88 LEU MD2 1.800 . 4.000 2.659 2.467 2.940 . 0 0 "[ . 1 . 2]" 1
927 1 77 TYR QE 1 88 LEU H 1.800 . 5.500 2.556 2.211 3.596 . 0 0 "[ . 1 . 2]" 1
928 1 77 TYR QE 1 88 LEU HG 1.800 . 5.200 3.852 2.845 5.224 0.024 2 0 "[ . 1 . 2]" 1
929 1 77 TYR QE 1 88 LEU MD1 1.800 . 5.200 3.859 3.201 4.557 . 0 0 "[ . 1 . 2]" 1
930 1 77 TYR QE 1 88 LEU MD2 1.800 . 4.600 3.089 2.646 3.682 . 0 0 "[ . 1 . 2]" 1
931 1 77 TYR HB3 1 91 LEU MD1 1.800 . 4.300 3.028 2.698 3.328 . 0 0 "[ . 1 . 2]" 1
932 1 77 TYR HB2 1 91 LEU MD2 1.800 . 4.500 4.550 4.470 4.594 0.094 4 0 "[ . 1 . 2]" 1
933 1 78 TYR H 1 78 TYR QD 1.800 . 3.900 3.347 2.995 3.582 . 0 0 "[ . 1 . 2]" 1
934 1 78 TYR HA 1 78 TYR QD 1.800 . 4.000 3.661 3.608 3.713 . 0 0 "[ . 1 . 2]" 1
935 1 78 TYR HA 1 79 ILE H 1.800 . 4.000 2.072 1.956 2.149 . 0 0 "[ . 1 . 2]" 1
936 1 78 TYR QD 1 79 ILE HA 1.800 . 4.400 3.659 3.349 4.007 . 0 0 "[ . 1 . 2]" 1
937 1 78 TYR HA 1 80 SER H 1.800 . 5.300 3.663 3.255 4.467 . 0 0 "[ . 1 . 2]" 1
938 1 78 TYR QD 1 80 SER HA 1.800 . 4.000 3.381 2.915 3.882 . 0 0 "[ . 1 . 2]" 1
939 1 78 TYR QE 1 80 SER HA 1.800 . 4.000 3.919 3.136 4.056 0.056 4 0 "[ . 1 . 2]" 1
940 1 78 TYR QD 1 81 PRO HA 1.800 . 3.700 2.691 2.390 2.939 . 0 0 "[ . 1 . 2]" 1
941 1 78 TYR QD 1 81 PRO HB3 1.800 . 4.000 4.018 3.363 4.072 0.072 8 0 "[ . 1 . 2]" 1
942 1 78 TYR QD 1 81 PRO QG 1.800 . 4.000 3.567 3.259 4.022 0.022 11 0 "[ . 1 . 2]" 1
943 1 78 TYR QD 1 81 PRO QD 1.800 . 4.000 3.367 2.664 3.718 . 0 0 "[ . 1 . 2]" 1
944 1 78 TYR QE 1 81 PRO HA 1.800 . 4.600 3.578 2.981 4.065 . 0 0 "[ . 1 . 2]" 1
945 1 78 TYR QE 1 81 PRO HB3 1.800 . 4.600 3.638 3.149 4.213 . 0 0 "[ . 1 . 2]" 1
946 1 78 TYR QE 1 81 PRO QG 1.800 . 3.600 2.350 2.138 3.198 . 0 0 "[ . 1 . 2]" 1
947 1 78 TYR QE 1 81 PRO QD 1.800 . 3.600 2.924 2.323 3.283 . 0 0 "[ . 1 . 2]" 1
948 1 78 TYR HA 1 84 THR MG 1.800 . 3.800 3.428 2.786 3.777 . 0 0 "[ . 1 . 2]" 1
949 1 78 TYR HB3 1 84 THR HA 1.800 . 5.100 3.001 2.560 3.642 . 0 0 "[ . 1 . 2]" 1
950 1 78 TYR HB3 1 84 THR MG 1.800 . 3.600 1.986 1.933 2.040 . 0 0 "[ . 1 . 2]" 1
951 1 78 TYR HB2 1 84 THR MG 1.800 . 3.100 3.116 2.859 3.154 0.054 16 0 "[ . 1 . 2]" 1
952 1 78 TYR QD 1 84 THR MG 1.800 . 3.500 3.379 2.860 3.546 0.046 19 0 "[ . 1 . 2]" 1
953 1 78 TYR HA 1 85 PHE H 1.800 . 3.900 3.937 3.908 3.978 0.078 1 0 "[ . 1 . 2]" 1
954 1 78 TYR HA 1 85 PHE QD 1.800 . 5.200 3.590 3.088 4.594 . 0 0 "[ . 1 . 2]" 1
955 1 78 TYR HA 1 91 LEU MD1 1.800 . 4.000 3.770 3.469 4.037 0.037 8 0 "[ . 1 . 2]" 1
956 1 79 ILE HA 1 79 ILE QG 1.800 . 3.200 3.217 3.166 3.278 0.078 7 0 "[ . 1 . 2]" 1
957 1 79 ILE HA 1 79 ILE MG 1.800 . 2.800 2.180 2.114 2.243 . 0 0 "[ . 1 . 2]" 1
958 1 79 ILE HA 1 79 ILE MD 1.800 . 4.100 4.112 4.065 4.143 0.043 20 0 "[ . 1 . 2]" 1
959 1 79 ILE HB 1 79 ILE MD 1.800 . 3.100 2.474 2.237 2.681 . 0 0 "[ . 1 . 2]" 1
960 1 79 ILE MD 1 79 ILE QG 1.800 . 2.900 1.918 1.893 1.978 . 0 0 "[ . 1 . 2]" 1
961 1 79 ILE MD 1 79 ILE MG 1.800 . 2.600 1.959 1.851 2.021 . 0 0 "[ . 1 . 2]" 1
962 1 79 ILE H 1 80 SER H 1.800 . 3.300 1.962 1.771 2.541 0.029 9 0 "[ . 1 . 2]" 1
963 1 79 ILE HB 1 80 SER H 1.800 . 4.000 3.633 2.855 4.042 0.042 4 0 "[ . 1 . 2]" 1
964 1 79 ILE MG 1 80 SER H 1.800 . 4.700 4.337 4.066 4.528 . 0 0 "[ . 1 . 2]" 1
965 1 79 ILE MD 1 80 SER H 1.800 . 6.300 4.444 3.542 5.017 . 0 0 "[ . 1 . 2]" 1
966 1 79 ILE QG 1 91 LEU MD1 1.800 . 3.300 2.461 2.152 3.020 . 0 0 "[ . 1 . 2]" 1
967 1 79 ILE QG 1 91 LEU MD2 1.800 . 5.100 4.429 3.982 4.745 . 0 0 "[ . 1 . 2]" 1
968 1 79 ILE MD 1 91 LEU MD1 1.800 . 2.800 2.235 1.950 2.838 0.038 13 0 "[ . 1 . 2]" 1
969 1 79 ILE MD 1 91 LEU MD2 1.800 . 3.200 3.201 2.737 3.298 0.098 1 0 "[ . 1 . 2]" 1
970 1 79 ILE MD 1 95 TYR QE 1.800 . 3.900 1.986 1.897 2.174 . 0 0 "[ . 1 . 2]" 1
971 1 79 ILE MG 1 102 LEU MD2 1.800 . 3.600 3.627 3.375 3.715 0.115 7 0 "[ . 1 . 2]" 1
972 1 79 ILE MD 1 102 LEU MD1 1.800 . 3.500 3.058 2.144 3.529 0.029 14 0 "[ . 1 . 2]" 1
973 1 79 ILE MD 1 102 LEU MD2 1.800 . 3.000 2.037 1.802 2.290 . 0 0 "[ . 1 . 2]" 1
974 1 80 SER H 1 80 SER QB 1.800 . 3.800 2.784 2.162 3.187 . 0 0 "[ . 1 . 2]" 1
975 1 80 SER HA 1 81 PRO QG 1.800 . 3.800 3.841 3.812 3.898 0.098 11 0 "[ . 1 . 2]" 1
976 1 80 SER HA 1 81 PRO QD 1.800 . 2.600 1.991 1.968 2.066 . 0 0 "[ . 1 . 2]" 1
977 1 80 SER QB 1 81 PRO QD 1.800 . 4.300 3.267 2.767 3.819 . 0 0 "[ . 1 . 2]" 1
978 1 80 SER HA 1 82 ARG H 1.800 . 5.100 4.048 3.756 4.414 . 0 0 "[ . 1 . 2]" 1
979 1 80 SER QB 1 82 ARG H 1.800 . 5.400 3.311 2.663 4.399 . 0 0 "[ . 1 . 2]" 1
980 1 80 SER QB 1 83 ILE H 1.800 . 5.400 2.886 2.209 3.708 . 0 0 "[ . 1 . 2]" 1
981 1 80 SER QB 1 83 ILE MG 1.800 . 4.000 3.893 2.880 4.154 0.154 7 0 "[ . 1 . 2]" 1
982 1 80 SER QB 1 83 ILE MD 1.800 . 5.100 2.836 2.028 3.459 . 0 0 "[ . 1 . 2]" 1
983 1 81 PRO HA 1 81 PRO QG 1.800 . 3.500 3.113 2.985 3.521 0.021 11 0 "[ . 1 . 2]" 1
984 1 81 PRO HA 1 81 PRO QD 1.800 . 3.800 3.433 3.339 3.478 . 0 0 "[ . 1 . 2]" 1
985 1 81 PRO QB 1 81 PRO QD 1.800 . 2.800 2.840 2.820 2.863 0.063 4 0 "[ . 1 . 2]" 1
986 1 81 PRO QD 1 81 PRO QG 1.800 . 2.600 1.969 1.941 1.993 . 0 0 "[ . 1 . 2]" 1
987 1 81 PRO HA 1 82 ARG H 1.800 . 3.500 3.431 3.346 3.505 0.005 19 0 "[ . 1 . 2]" 1
988 1 81 PRO QB 1 82 ARG H 1.800 . 3.600 3.250 3.108 3.602 0.002 11 0 "[ . 1 . 2]" 1
989 1 81 PRO QG 1 82 ARG H 1.800 . 4.000 3.994 3.190 4.068 0.068 8 0 "[ . 1 . 2]" 1
990 1 81 PRO QD 1 82 ARG H 1.800 . 2.800 2.714 2.532 2.842 0.042 11 0 "[ . 1 . 2]" 1
991 1 81 PRO HA 1 83 ILE H 1.800 . 4.700 3.946 3.523 4.663 . 0 0 "[ . 1 . 2]" 1
992 1 82 ARG H 1 82 ARG QG 1.800 . 3.200 2.633 1.921 3.256 0.056 2 0 "[ . 1 . 2]" 1
993 1 82 ARG H 1 82 ARG QD 1.800 . 4.900 3.215 1.766 4.806 0.034 17 0 "[ . 1 . 2]" 1
994 1 82 ARG HA 1 82 ARG QB 1.800 . 2.600 2.132 2.070 2.167 . 0 0 "[ . 1 . 2]" 1
995 1 82 ARG HA 1 82 ARG QG 1.800 . 3.600 3.493 3.449 3.564 . 0 0 "[ . 1 . 2]" 1
996 1 82 ARG HA 1 82 ARG QD 1.800 . 3.700 3.732 3.618 3.783 0.083 4 0 "[ . 1 . 2]" 1
997 1 82 ARG QB 1 82 ARG QG 1.800 . 2.600 2.050 2.008 2.114 . 0 0 "[ . 1 . 2]" 1
998 1 82 ARG QB 1 82 ARG QD 1.800 . 2.600 2.311 2.168 2.640 0.040 17 0 "[ . 1 . 2]" 1
999 1 82 ARG QD 1 82 ARG QG 1.800 . 2.600 2.096 2.009 2.157 . 0 0 "[ . 1 . 2]" 1
1000 1 82 ARG H 1 83 ILE H 1.800 . 3.100 2.480 2.296 2.589 . 0 0 "[ . 1 . 2]" 1
1001 1 82 ARG HA 1 83 ILE H 1.800 . 3.600 3.458 3.334 3.592 . 0 0 "[ . 1 . 2]" 1
1002 1 82 ARG QB 1 83 ILE H 1.800 . 4.600 3.738 3.271 3.952 . 0 0 "[ . 1 . 2]" 1
1003 1 82 ARG QG 1 83 ILE MG 1.800 . 3.800 2.863 2.016 3.876 0.076 4 0 "[ . 1 . 2]" 1
1004 1 83 ILE H 1 83 ILE HB 1.800 . 3.800 3.787 3.667 3.839 0.039 13 0 "[ . 1 . 2]" 1
1005 1 83 ILE H 1 83 ILE QG 1.800 . 4.400 2.223 1.986 2.457 . 0 0 "[ . 1 . 2]" 1
1006 1 83 ILE H 1 83 ILE MG 1.800 . 3.300 3.216 2.872 3.348 0.048 3 0 "[ . 1 . 2]" 1
1007 1 83 ILE H 1 83 ILE MD 1.800 . 4.700 3.896 3.674 4.049 . 0 0 "[ . 1 . 2]" 1
1008 1 83 ILE HA 1 83 ILE HB 1.800 . 3.000 2.407 2.211 2.544 . 0 0 "[ . 1 . 2]" 1
1009 1 83 ILE HA 1 83 ILE QG 1.800 . 3.300 3.296 3.258 3.348 0.048 9 0 "[ . 1 . 2]" 1
1010 1 83 ILE HA 1 83 ILE MG 1.800 . 3.000 2.199 2.067 2.351 . 0 0 "[ . 1 . 2]" 1
1011 1 83 ILE HA 1 83 ILE MD 1.800 . 3.800 3.936 3.846 3.986 0.186 4 0 "[ . 1 . 2]" 1
1012 1 83 ILE HB 1 83 ILE MD 1.800 . 2.900 2.175 2.057 2.644 . 0 0 "[ . 1 . 2]" 1
1013 1 83 ILE MD 1 83 ILE QG 1.800 . 2.600 1.910 1.877 1.934 . 0 0 "[ . 1 . 2]" 1
1014 1 83 ILE MD 1 83 ILE MG 1.800 . 2.600 2.137 1.808 2.637 0.037 9 0 "[ . 1 . 2]" 1
1015 1 83 ILE HA 1 84 THR H 1.800 . 2.600 1.886 1.781 2.018 0.019 20 0 "[ . 1 . 2]" 1
1016 1 83 ILE HB 1 84 THR H 1.800 . 4.300 3.421 2.998 3.927 . 0 0 "[ . 1 . 2]" 1
1017 1 83 ILE QG 1 84 THR H 1.800 . 4.300 4.278 4.076 4.342 0.042 15 0 "[ . 1 . 2]" 1
1018 1 83 ILE MG 1 84 THR H 1.800 . 4.300 3.662 3.256 3.960 . 0 0 "[ . 1 . 2]" 1
1019 1 83 ILE MD 1 84 THR H 1.800 . 4.900 4.869 4.105 4.987 0.087 7 0 "[ . 1 . 2]" 1
1020 1 83 ILE MG 1 85 PHE QE 1.800 . 6.900 3.741 2.972 4.116 . 0 0 "[ . 1 . 2]" 1
1021 1 83 ILE MG 1 85 PHE HZ 1.800 . 3.500 3.526 3.465 3.562 0.062 11 0 "[ . 1 . 2]" 1
1022 1 83 ILE MD 1 85 PHE QE 1.800 . 6.900 2.660 2.040 3.691 . 0 0 "[ . 1 . 2]" 1
1023 1 83 ILE MD 1 85 PHE HZ 1.800 . 4.000 3.234 2.326 4.053 0.053 1 0 "[ . 1 . 2]" 1
1024 1 83 ILE MD 1 94 HIS HE1 1.800 . 4.000 3.869 2.944 4.053 0.053 3 0 "[ . 1 . 2]" 1
1025 1 83 ILE MG 1 95 TYR QE 1.800 . 5.200 4.721 3.661 5.242 0.042 2 0 "[ . 1 . 2]" 1
1026 1 84 THR H 1 84 THR MG 1.800 . 4.000 3.875 3.774 3.992 . 0 0 "[ . 1 . 2]" 1
1027 1 84 THR HA 1 84 THR HB 1.800 . 3.100 3.029 3.010 3.044 . 0 0 "[ . 1 . 2]" 1
1028 1 84 THR HA 1 84 THR MG 1.800 . 3.100 2.296 2.208 2.371 . 0 0 "[ . 1 . 2]" 1
1029 1 84 THR HB 1 84 THR MG 1.800 . 2.600 2.059 2.030 2.100 . 0 0 "[ . 1 . 2]" 1
1030 1 84 THR HA 1 85 PHE H 1.800 . 3.100 2.232 2.026 2.383 . 0 0 "[ . 1 . 2]" 1
1031 1 84 THR HA 1 85 PHE QD 1.800 . 5.800 3.019 2.693 3.444 . 0 0 "[ . 1 . 2]" 1
1032 1 84 THR HB 1 85 PHE H 1.800 . 3.100 3.220 3.140 3.262 0.162 13 0 "[ . 1 . 2]" 1
1033 1 84 THR MG 1 85 PHE H 1.800 . 3.600 2.060 1.890 2.209 . 0 0 "[ . 1 . 2]" 1
1034 1 85 PHE H 1 85 PHE QD 1.800 . 4.600 3.137 2.830 3.552 . 0 0 "[ . 1 . 2]" 1
1035 1 85 PHE HA 1 85 PHE QD 1.800 . 4.600 2.979 2.799 3.117 . 0 0 "[ . 1 . 2]" 1
1036 1 85 PHE HA 1 86 PRO QG 1.800 . 4.100 4.068 4.006 4.119 0.019 3 0 "[ . 1 . 2]" 1
1037 1 85 PHE HA 1 86 PRO QD 1.800 . 2.600 2.109 2.060 2.156 . 0 0 "[ . 1 . 2]" 1
1038 1 85 PHE QB 1 86 PRO QD 1.800 . 3.500 2.354 2.138 2.532 . 0 0 "[ . 1 . 2]" 1
1039 1 85 PHE QD 1 86 PRO QD 1.800 . 4.600 3.080 2.582 3.543 . 0 0 "[ . 1 . 2]" 1
1040 1 85 PHE HA 1 87 THR H 1.800 . 4.700 4.024 3.897 4.173 . 0 0 "[ . 1 . 2]" 1
1041 1 85 PHE QB 1 87 THR H 1.800 . 4.400 2.712 2.551 2.896 . 0 0 "[ . 1 . 2]" 1
1042 1 85 PHE HA 1 90 ALA MB 1.800 . 3.700 3.707 3.570 3.754 0.054 6 0 "[ . 1 . 2]" 1
1043 1 85 PHE QB 1 90 ALA MB 1.800 . 3.100 2.187 1.975 2.459 . 0 0 "[ . 1 . 2]" 1
1044 1 85 PHE QD 1 90 ALA MB 1.800 . 4.000 2.632 2.200 3.460 . 0 0 "[ . 1 . 2]" 1
1045 1 85 PHE HB2 1 91 LEU MD1 1.800 . 4.600 3.371 3.028 3.726 . 0 0 "[ . 1 . 2]" 1
1046 1 85 PHE QD 1 91 LEU MD2 1.800 . 5.200 4.945 4.643 5.214 0.014 17 0 "[ . 1 . 2]" 1
1047 1 85 PHE QD 1 91 LEU MD1 1.800 . 4.600 2.848 2.343 3.488 . 0 0 "[ . 1 . 2]" 1
1048 1 85 PHE QE 1 95 TYR QE 1.800 . 5.200 3.901 2.990 4.748 . 0 0 "[ . 1 . 2]" 1
1049 1 85 PHE HZ 1 95 TYR QE 1.800 . 5.200 3.893 2.870 4.969 . 0 0 "[ . 1 . 2]" 1
1050 1 86 PRO HA 1 86 PRO QG 1.800 . 3.700 3.556 3.523 3.598 . 0 0 "[ . 1 . 2]" 1
1051 1 86 PRO HA 1 86 PRO QD 1.800 . 4.000 3.353 3.259 3.451 . 0 0 "[ . 1 . 2]" 1
1052 1 86 PRO QB 1 86 PRO QD 1.800 . 3.300 2.784 2.756 2.842 . 0 0 "[ . 1 . 2]" 1
1053 1 86 PRO QD 1 86 PRO QG 1.800 . 2.600 2.013 2.006 2.021 . 0 0 "[ . 1 . 2]" 1
1054 1 86 PRO QB 1 87 THR H 1.800 . 4.400 3.550 3.352 3.715 . 0 0 "[ . 1 . 2]" 1
1055 1 86 PRO QB 1 87 THR MG 1.800 . 3.000 2.975 2.670 3.041 0.041 8 0 "[ . 1 . 2]" 1
1056 1 86 PRO QG 1 87 THR H 1.800 . 3.700 2.950 2.629 3.266 . 0 0 "[ . 1 . 2]" 1
1057 1 86 PRO QG 1 87 THR MG 1.800 . 3.100 2.563 2.356 2.892 . 0 0 "[ . 1 . 2]" 1
1058 1 86 PRO QD 1 87 THR H 1.800 . 3.500 2.896 2.583 3.104 . 0 0 "[ . 1 . 2]" 1
1059 1 86 PRO QG 1 90 ALA MB 1.800 . 3.000 2.500 2.205 2.797 . 0 0 "[ . 1 . 2]" 1
1060 1 86 PRO QD 1 90 ALA H 1.800 . 4.800 4.579 4.196 4.806 0.006 11 0 "[ . 1 . 2]" 1
1061 1 86 PRO QD 1 90 ALA MB 1.800 . 2.900 2.167 2.045 2.386 . 0 0 "[ . 1 . 2]" 1
1062 1 87 THR H 1 87 THR MG 1.800 . 3.500 2.616 2.458 2.771 . 0 0 "[ . 1 . 2]" 1
1063 1 87 THR HA 1 87 THR HB 1.800 . 2.800 2.341 2.215 2.417 . 0 0 "[ . 1 . 2]" 1
1064 1 87 THR HA 1 87 THR MG 1.800 . 3.200 3.218 3.170 3.240 0.040 15 0 "[ . 1 . 2]" 1
1065 1 87 THR HB 1 87 THR MG 1.800 . 2.600 2.067 2.036 2.091 . 0 0 "[ . 1 . 2]" 1
1066 1 87 THR H 1 88 LEU H 1.800 . 4.400 4.331 4.271 4.406 0.006 2 0 "[ . 1 . 2]" 1
1067 1 87 THR HA 1 88 LEU H 1.800 . 2.900 2.538 2.404 2.659 . 0 0 "[ . 1 . 2]" 1
1068 1 87 THR HB 1 88 LEU H 1.800 . 4.000 3.608 3.359 3.749 . 0 0 "[ . 1 . 2]" 1
1069 1 87 THR MG 1 88 LEU H 1.800 . 4.000 3.659 3.402 3.934 . 0 0 "[ . 1 . 2]" 1
1070 1 87 THR HA 1 89 GLN H 1.800 . 4.800 4.248 4.128 4.398 . 0 0 "[ . 1 . 2]" 1
1071 1 87 THR HB 1 89 GLN H 1.800 . 3.900 4.035 4.005 4.077 0.177 4 0 "[ . 1 . 2]" 1
1072 1 87 THR MG 1 89 GLN H 1.800 . 4.400 2.478 2.059 3.112 . 0 0 "[ . 1 . 2]" 1
1073 1 87 THR H 1 90 ALA H 1.800 . 4.500 3.786 3.579 4.013 . 0 0 "[ . 1 . 2]" 1
1074 1 87 THR H 1 90 ALA MB 1.800 . 3.200 2.874 2.503 3.197 . 0 0 "[ . 1 . 2]" 1
1075 1 87 THR MG 1 90 ALA H 1.800 . 4.000 2.034 1.857 2.657 . 0 0 "[ . 1 . 2]" 1
1076 1 87 THR MG 1 90 ALA MB 1.800 . 3.700 2.629 2.141 3.097 . 0 0 "[ . 1 . 2]" 1
1077 1 88 LEU H 1 88 LEU HB2 1.800 . 4.000 2.649 2.523 2.779 . 0 0 "[ . 1 . 2]" 1
1078 1 88 LEU H 1 88 LEU HG 1.800 . 4.100 3.108 2.200 4.145 0.045 2 0 "[ . 1 . 2]" 1
1079 1 88 LEU H 1 88 LEU MD1 1.800 . 4.600 3.799 3.577 3.953 . 0 0 "[ . 1 . 2]" 1
1080 1 88 LEU HA 1 88 LEU HB2 1.800 . 3.100 3.064 3.028 3.088 . 0 0 "[ . 1 . 2]" 1
1081 1 88 LEU HA 1 88 LEU HG 1.800 . 4.100 3.372 3.022 3.786 . 0 0 "[ . 1 . 2]" 1
1082 1 88 LEU HA 1 88 LEU MD1 1.800 . 4.000 3.223 2.211 3.914 . 0 0 "[ . 1 . 2]" 1
1083 1 88 LEU HA 1 88 LEU MD2 1.800 . 2.800 2.464 2.104 2.833 0.033 2 0 "[ . 1 . 2]" 1
1084 1 88 LEU HB2 1 88 LEU HG 1.800 . 3.000 2.390 2.241 2.525 . 0 0 "[ . 1 . 2]" 1
1085 1 88 LEU HB3 1 88 LEU MD1 1.800 . 3.200 2.275 2.153 2.347 . 0 0 "[ . 1 . 2]" 1
1086 1 88 LEU HB3 1 88 LEU MD2 1.800 . 3.200 2.694 2.322 3.228 0.028 7 0 "[ . 1 . 2]" 1
1087 1 88 LEU HB2 1 88 LEU MD1 1.800 . 3.200 2.575 2.119 3.214 0.014 4 0 "[ . 1 . 2]" 1
1088 1 88 LEU HB2 1 88 LEU MD2 1.800 . 3.200 2.913 2.320 3.227 0.027 16 0 "[ . 1 . 2]" 1
1089 1 88 LEU H 1 89 GLN H 1.800 . 3.300 2.768 2.640 2.856 . 0 0 "[ . 1 . 2]" 1
1090 1 88 LEU HB3 1 89 GLN H 1.800 . 5.300 3.909 3.577 4.209 . 0 0 "[ . 1 . 2]" 1
1091 1 88 LEU HB2 1 89 GLN H 1.800 . 4.400 3.151 2.924 3.298 . 0 0 "[ . 1 . 2]" 1
1092 1 88 LEU HA 1 91 LEU H 1.800 . 4.000 3.395 3.245 3.577 . 0 0 "[ . 1 . 2]" 1
1093 1 88 LEU HA 1 91 LEU HB3 1.800 . 3.700 2.177 2.044 2.377 . 0 0 "[ . 1 . 2]" 1
1094 1 88 LEU HB2 1 91 LEU MD2 1.800 . 3.800 3.793 3.611 3.908 0.108 7 0 "[ . 1 . 2]" 1
1095 1 88 LEU MD2 1 91 LEU H 1.800 . 6.700 5.271 4.774 5.856 . 0 0 "[ . 1 . 2]" 1
1096 1 88 LEU MD1 1 91 LEU MD1 1.800 . 4.000 3.323 2.100 4.118 0.118 8 0 "[ . 1 . 2]" 1
1097 1 88 LEU MD1 1 91 LEU MD2 1.800 . 3.700 2.796 1.768 3.672 0.032 2 0 "[ . 1 . 2]" 1
1098 1 88 LEU MD2 1 91 LEU MD2 1.800 . 3.700 2.933 2.131 3.774 0.074 12 0 "[ . 1 . 2]" 1
1099 1 88 LEU MD1 1 92 VAL MG1 1.800 . 4.800 4.811 4.453 4.990 0.190 11 0 "[ . 1 . 2]" 1
1100 1 89 GLN H 1 89 GLN HB2 1.800 . 4.000 3.833 3.706 3.939 . 0 0 "[ . 1 . 2]" 1
1101 1 89 GLN H 1 89 GLN HB3 1.800 . 4.000 2.962 2.556 3.508 . 0 0 "[ . 1 . 2]" 1
1102 1 89 GLN H 1 89 GLN QG 1.800 . 4.400 2.507 2.101 3.661 . 0 0 "[ . 1 . 2]" 1
1103 1 89 GLN HA 1 89 GLN HB3 1.800 . 3.100 2.280 2.065 2.499 . 0 0 "[ . 1 . 2]" 1
1104 1 89 GLN HA 1 89 GLN HB2 1.800 . 2.600 2.351 2.151 2.606 0.006 18 0 "[ . 1 . 2]" 1
1105 1 89 GLN HA 1 89 GLN QG 1.800 . 3.300 3.337 3.287 3.393 0.093 14 0 "[ . 1 . 2]" 1
1106 1 89 GLN HB3 1 89 GLN QG 1.800 . 2.800 2.243 2.047 2.548 . 0 0 "[ . 1 . 2]" 1
1107 1 89 GLN H 1 90 ALA H 1.800 . 3.500 2.603 2.381 2.759 . 0 0 "[ . 1 . 2]" 1
1108 1 89 GLN HB3 1 90 ALA H 1.800 . 4.800 4.223 4.000 4.524 . 0 0 "[ . 1 . 2]" 1
1109 1 89 GLN QB 1 90 ALA H 1.800 . 3.600 3.650 3.628 3.668 0.068 17 0 "[ . 1 . 2]" 1
1110 1 89 GLN QG 1 90 ALA H 1.800 . 6.000 3.112 2.345 3.912 . 0 0 "[ . 1 . 2]" 1
1111 1 89 GLN QE 1 90 ALA H 1.800 . 3.500 2.993 2.027 3.546 0.046 1 0 "[ . 1 . 2]" 1
1112 1 89 GLN HA 1 91 LEU H 1.800 . 6.100 3.640 3.454 3.866 . 0 0 "[ . 1 . 2]" 1
1113 1 89 GLN QE 1 91 LEU QD 1.800 . 5.800 5.869 5.832 5.929 0.129 3 0 "[ . 1 . 2]" 1
1114 1 89 GLN HA 1 92 VAL H 1.800 . 4.800 2.853 2.655 3.147 . 0 0 "[ . 1 . 2]" 1
1115 1 89 GLN HA 1 92 VAL HB 1.800 . 3.300 2.639 2.425 2.801 . 0 0 "[ . 1 . 2]" 1
1116 1 89 GLN HA 1 92 VAL MG1 1.800 . 3.900 3.978 3.911 4.037 0.137 7 0 "[ . 1 . 2]" 1
1117 1 90 ALA H 1 90 ALA MB 1.800 . 3.100 2.296 2.269 2.321 . 0 0 "[ . 1 . 2]" 1
1118 1 90 ALA HA 1 90 ALA MB 1.800 . 2.600 2.211 2.187 2.234 . 0 0 "[ . 1 . 2]" 1
1119 1 90 ALA H 1 91 LEU H 1.800 . 3.100 2.499 2.415 2.595 . 0 0 "[ . 1 . 2]" 1
1120 1 90 ALA MB 1 91 LEU H 1.800 . 3.500 3.017 2.829 3.175 . 0 0 "[ . 1 . 2]" 1
1121 1 90 ALA HA 1 93 GLN H 1.800 . 3.800 3.437 3.265 3.601 . 0 0 "[ . 1 . 2]" 1
1122 1 90 ALA HA 1 93 GLN QB 1.800 . 2.600 2.673 2.648 2.703 0.103 7 0 "[ . 1 . 2]" 1
1123 1 90 ALA HA 1 93 GLN QG 1.800 . 2.900 2.453 2.168 2.730 . 0 0 "[ . 1 . 2]" 1
1124 1 91 LEU H 1 91 LEU HB3 1.800 . 4.400 2.038 1.973 2.105 . 0 0 "[ . 1 . 2]" 1
1125 1 91 LEU H 1 91 LEU HB2 1.800 . 3.800 3.007 2.755 3.102 . 0 0 "[ . 1 . 2]" 1
1126 1 91 LEU H 1 91 LEU HG 1.800 . 6.100 4.418 4.329 4.489 . 0 0 "[ . 1 . 2]" 1
1127 1 91 LEU H 1 91 LEU MD2 1.800 . 4.400 3.390 3.242 3.557 . 0 0 "[ . 1 . 2]" 1
1128 1 91 LEU HA 1 91 LEU HG 1.800 . 3.600 3.057 2.992 3.182 . 0 0 "[ . 1 . 2]" 1
1129 1 91 LEU HA 1 91 LEU MD1 1.800 . 4.100 3.862 3.772 3.943 . 0 0 "[ . 1 . 2]" 1
1130 1 91 LEU HA 1 91 LEU MD2 1.800 . 3.700 3.687 3.620 3.758 0.058 17 0 "[ . 1 . 2]" 1
1131 1 91 LEU HB3 1 91 LEU MD1 1.800 . 3.500 2.490 2.373 2.602 . 0 0 "[ . 1 . 2]" 1
1132 1 91 LEU HB3 1 91 LEU MD2 1.800 . 3.500 2.305 2.221 2.466 . 0 0 "[ . 1 . 2]" 1
1133 1 91 LEU HB2 1 91 LEU MD1 1.800 . 3.300 2.233 2.156 2.271 . 0 0 "[ . 1 . 2]" 1
1134 1 91 LEU HB2 1 91 LEU MD2 1.800 . 3.300 3.204 3.169 3.254 . 0 0 "[ . 1 . 2]" 1
1135 1 91 LEU H 1 92 VAL H 1.800 . 3.200 2.256 2.121 2.349 . 0 0 "[ . 1 . 2]" 1
1136 1 91 LEU H 1 92 VAL MG1 1.800 . 5.500 5.477 5.389 5.530 0.030 3 0 "[ . 1 . 2]" 1
1137 1 91 LEU HB3 1 92 VAL H 1.800 . 4.800 3.090 2.838 3.258 . 0 0 "[ . 1 . 2]" 1
1138 1 91 LEU HB2 1 92 VAL H 1.800 . 5.100 4.200 4.052 4.315 . 0 0 "[ . 1 . 2]" 1
1139 1 91 LEU MD2 1 92 VAL H 1.800 . 3.800 2.641 2.464 2.758 . 0 0 "[ . 1 . 2]" 1
1140 1 91 LEU MD2 1 92 VAL HA 1.800 . 3.200 2.741 2.583 2.851 . 0 0 "[ . 1 . 2]" 1
1141 1 91 LEU MD2 1 92 VAL MG1 1.800 . 3.300 3.260 3.100 3.424 0.124 5 0 "[ . 1 . 2]" 1
1142 1 91 LEU HA 1 94 HIS H 1.800 . 6.000 3.656 3.138 4.012 . 0 0 "[ . 1 . 2]" 1
1143 1 91 LEU HG 1 95 TYR QD 1.800 . 4.000 3.391 2.289 3.865 . 0 0 "[ . 1 . 2]" 1
1144 1 91 LEU HG 1 95 TYR QE 1.800 . 3.500 2.464 2.032 3.165 . 0 0 "[ . 1 . 2]" 1
1145 1 91 LEU MD1 1 95 TYR QD 1.800 . 5.200 4.554 3.868 4.938 . 0 0 "[ . 1 . 2]" 1
1146 1 91 LEU MD2 1 95 TYR QD 1.800 . 3.500 3.235 2.819 3.503 0.003 15 0 "[ . 1 . 2]" 1
1147 1 91 LEU MD1 1 95 TYR QE 1.800 . 4.000 3.312 2.820 4.005 0.005 3 0 "[ . 1 . 2]" 1
1148 1 91 LEU MD2 1 95 TYR QE 1.800 . 3.500 3.327 2.705 3.587 0.087 3 0 "[ . 1 . 2]" 1
1149 1 91 LEU MD2 1 106 LEU MD1 1.800 . 4.300 3.774 2.792 4.361 0.061 13 0 "[ . 1 . 2]" 1
1150 1 92 VAL H 1 92 VAL HB 1.800 . 3.500 2.694 2.382 2.867 . 0 0 "[ . 1 . 2]" 1
1151 1 92 VAL H 1 92 VAL MG1 1.800 . 3.600 3.665 3.635 3.683 0.083 12 0 "[ . 1 . 2]" 1
1152 1 92 VAL H 1 92 VAL MG2 1.800 . 4.000 2.134 1.843 2.368 . 0 0 "[ . 1 . 2]" 1
1153 1 92 VAL HA 1 92 VAL MG1 1.800 . 2.800 2.360 2.113 2.484 . 0 0 "[ . 1 . 2]" 1
1154 1 92 VAL HA 1 92 VAL MG2 1.800 . 3.000 2.736 2.528 2.870 . 0 0 "[ . 1 . 2]" 1
1155 1 92 VAL H 1 93 GLN H 1.800 . 3.200 2.490 2.375 2.622 . 0 0 "[ . 1 . 2]" 1
1156 1 92 VAL HB 1 93 GLN H 1.800 . 3.600 3.534 3.287 3.616 0.016 6 0 "[ . 1 . 2]" 1
1157 1 92 VAL MG1 1 93 GLN H 1.800 . 4.500 4.360 4.265 4.418 . 0 0 "[ . 1 . 2]" 1
1158 1 92 VAL MG2 1 93 GLN H 1.800 . 4.100 4.026 3.858 4.142 0.042 5 0 "[ . 1 . 2]" 1
1159 1 92 VAL MG2 1 93 GLN HA 1.800 . 5.500 5.524 5.457 5.587 0.087 3 0 "[ . 1 . 2]" 1
1160 1 92 VAL H 1 95 TYR H 1.800 . 4.800 4.762 4.555 4.855 0.055 7 0 "[ . 1 . 2]" 1
1161 1 92 VAL HA 1 95 TYR H 1.800 . 4.400 3.521 3.229 3.888 . 0 0 "[ . 1 . 2]" 1
1162 1 92 VAL MG2 1 95 TYR QE 1.800 . 6.900 5.276 4.216 5.729 . 0 0 "[ . 1 . 2]" 1
1163 1 92 VAL HA 1 106 LEU MD1 1.800 . 3.100 2.381 1.975 3.149 0.049 8 0 "[ . 1 . 2]" 1
1164 1 92 VAL MG1 1 106 LEU MD1 1.800 . 3.600 1.902 1.777 2.720 0.023 8 0 "[ . 1 . 2]" 1
1165 1 92 VAL MG2 1 106 LEU MD1 1.800 . 3.600 3.454 2.934 3.682 0.082 10 0 "[ . 1 . 2]" 1
1166 1 93 GLN H 1 93 GLN QB 1.800 . 2.900 2.579 2.431 2.753 . 0 0 "[ . 1 . 2]" 1
1167 1 93 GLN H 1 93 GLN QG 1.800 . 3.100 2.745 2.675 2.945 . 0 0 "[ . 1 . 2]" 1
1168 1 93 GLN HA 1 93 GLN QB 1.800 . 2.600 2.143 2.101 2.167 . 0 0 "[ . 1 . 2]" 1
1169 1 93 GLN HA 1 93 GLN QG 1.800 . 3.500 3.393 3.351 3.557 0.057 3 0 "[ . 1 . 2]" 1
1170 1 93 GLN QB 1 93 GLN QG 1.800 . 2.600 2.123 2.016 2.151 . 0 0 "[ . 1 . 2]" 1
1171 1 93 GLN QB 1 93 GLN QE 1.800 . 5.100 3.118 1.887 3.739 . 0 0 "[ . 1 . 2]" 1
1172 1 93 GLN H 1 94 HIS H 1.800 . 3.000 2.101 1.886 2.314 . 0 0 "[ . 1 . 2]" 1
1173 1 93 GLN QB 1 94 HIS H 1.800 . 3.300 3.235 3.134 3.309 0.009 17 0 "[ . 1 . 2]" 1
1174 1 93 GLN H 1 96 SER H 1.800 . 4.100 4.183 4.144 4.209 0.109 13 0 "[ . 1 . 2]" 1
1175 1 93 GLN HA 1 96 SER H 1.800 . 4.600 3.338 3.066 3.609 . 0 0 "[ . 1 . 2]" 1
1176 1 94 HIS H 1 94 HIS HB3 1.800 . 3.600 2.462 2.251 2.820 . 0 0 "[ . 1 . 2]" 1
1177 1 94 HIS H 1 94 HIS HB2 1.800 . 3.600 2.453 2.262 2.584 . 0 0 "[ . 1 . 2]" 1
1178 1 94 HIS HA 1 94 HIS HB2 1.800 . 3.100 2.511 2.454 2.611 . 0 0 "[ . 1 . 2]" 1
1179 1 94 HIS HB3 1 95 TYR H 1.800 . 3.900 2.507 2.235 2.824 . 0 0 "[ . 1 . 2]" 1
1180 1 94 HIS HB2 1 95 TYR H 1.800 . 4.000 3.787 3.569 3.927 . 0 0 "[ . 1 . 2]" 1
1181 1 94 HIS H 1 96 SER H 1.800 . 4.500 3.899 3.754 4.028 . 0 0 "[ . 1 . 2]" 1
1182 1 94 HIS HA 1 97 LYS H 1.800 . 5.900 3.974 3.784 4.453 . 0 0 "[ . 1 . 2]" 1
1183 1 95 TYR H 1 95 TYR HB3 1.800 . 4.400 3.653 3.521 3.769 . 0 0 "[ . 1 . 2]" 1
1184 1 95 TYR H 1 95 TYR HB2 1.800 . 3.900 2.531 2.284 2.709 . 0 0 "[ . 1 . 2]" 1
1185 1 95 TYR H 1 95 TYR QD 1.800 . 4.100 3.043 2.782 3.433 . 0 0 "[ . 1 . 2]" 1
1186 1 95 TYR HA 1 95 TYR QD 1.800 . 3.500 2.142 1.999 2.248 . 0 0 "[ . 1 . 2]" 1
1187 1 95 TYR HA 1 95 TYR QE 1.800 . 5.800 4.295 4.125 4.491 . 0 0 "[ . 1 . 2]" 1
1188 1 95 TYR H 1 96 SER H 1.800 . 3.000 2.614 2.444 2.702 . 0 0 "[ . 1 . 2]" 1
1189 1 95 TYR HA 1 97 LYS H 1.800 . 4.500 3.667 3.319 4.217 . 0 0 "[ . 1 . 2]" 1
1190 1 95 TYR HA 1 98 LYS H 1.800 . 3.800 2.994 2.631 3.562 . 0 0 "[ . 1 . 2]" 1
1191 1 95 TYR QD 1 100 ASP HB3 1.800 . 5.800 3.609 2.703 4.574 . 0 0 "[ . 1 . 2]" 1
1192 1 95 TYR QE 1 100 ASP HB3 1.800 . 3.500 2.618 2.104 3.249 . 0 0 "[ . 1 . 2]" 1
1193 1 95 TYR QE 1 100 ASP HB2 1.800 . 4.000 3.799 3.135 4.049 0.049 8 0 "[ . 1 . 2]" 1
1194 1 95 TYR HB3 1 102 LEU MD1 1.800 . 4.500 2.865 2.166 4.505 0.005 17 0 "[ . 1 . 2]" 1
1195 1 95 TYR QD 1 102 LEU HG 1.800 . 4.600 3.499 3.211 4.209 . 0 0 "[ . 1 . 2]" 1
1196 1 95 TYR QD 1 102 LEU MD1 1.800 . 5.200 2.432 2.162 3.340 . 0 0 "[ . 1 . 2]" 1
1197 1 95 TYR QD 1 102 LEU MD2 1.800 . 4.000 3.953 3.586 4.116 0.116 13 0 "[ . 1 . 2]" 1
1198 1 95 TYR QE 1 102 LEU HG 1.800 . 4.000 3.262 2.922 4.003 0.003 7 0 "[ . 1 . 2]" 1
1199 1 95 TYR QE 1 102 LEU MD1 1.800 . 4.600 2.742 2.169 3.397 . 0 0 "[ . 1 . 2]" 1
1200 1 95 TYR QE 1 102 LEU MD2 1.800 . 4.600 3.038 2.309 3.604 . 0 0 "[ . 1 . 2]" 1
1201 1 95 TYR HB3 1 106 LEU QD 1.800 . 4.400 2.378 2.008 3.181 . 0 0 "[ . 1 . 2]" 1
1202 1 95 TYR HB2 1 106 LEU QD 1.800 . 4.000 2.261 1.954 2.882 . 0 0 "[ . 1 . 2]" 1
1203 1 96 SER H 1 96 SER QB 1.800 . 3.500 2.688 2.563 2.786 . 0 0 "[ . 1 . 2]" 1
1204 1 96 SER HA 1 96 SER QB 1.800 . 2.600 2.441 2.387 2.518 . 0 0 "[ . 1 . 2]" 1
1205 1 96 SER H 1 97 LYS H 1.800 . 3.700 2.733 2.573 2.903 . 0 0 "[ . 1 . 2]" 1
1206 1 96 SER QB 1 97 LYS H 1.800 . 4.600 2.882 2.390 3.266 . 0 0 "[ . 1 . 2]" 1
1207 1 96 SER H 1 98 LYS H 1.800 . 4.800 4.372 3.966 4.746 . 0 0 "[ . 1 . 2]" 1
1208 1 96 SER HA 1 106 LEU H 1.800 . 4.000 3.222 2.327 3.878 . 0 0 "[ . 1 . 2]" 1
1209 1 96 SER HA 1 106 LEU HB2 1.800 . 3.800 2.173 1.925 2.969 . 0 0 "[ . 1 . 2]" 1
1210 1 96 SER HA 1 106 LEU MD1 1.800 . 4.700 3.966 2.965 4.741 0.041 9 0 "[ . 1 . 2]" 1
1211 1 97 LYS H 1 97 LYS QB 1.800 . 3.200 2.358 2.221 2.630 . 0 0 "[ . 1 . 2]" 1
1212 1 97 LYS H 1 97 LYS QG 1.800 . 3.800 3.435 2.201 3.832 0.032 15 0 "[ . 1 . 2]" 1
1213 1 97 LYS H 1 97 LYS QD 1.800 . 4.600 2.787 2.091 4.169 . 0 0 "[ . 1 . 2]" 1
1214 1 97 LYS HA 1 97 LYS QB 1.800 . 2.600 2.494 2.342 2.569 . 0 0 "[ . 1 . 2]" 1
1215 1 97 LYS HA 1 97 LYS QG 1.800 . 2.800 2.613 2.397 2.972 0.172 1 0 "[ . 1 . 2]" 1
1216 1 97 LYS HA 1 97 LYS QD 1.800 . 2.800 2.590 1.960 2.851 0.051 15 0 "[ . 1 . 2]" 1
1217 1 97 LYS H 1 98 LYS H 1.800 . 2.600 2.401 2.218 2.610 0.010 2 0 "[ . 1 . 2]" 1
1218 1 97 LYS HA 1 98 LYS H 1.800 . 4.000 3.526 3.288 3.631 . 0 0 "[ . 1 . 2]" 1
1219 1 97 LYS QB 1 98 LYS H 1.800 . 3.200 2.627 1.962 3.205 0.005 15 0 "[ . 1 . 2]" 1
1220 1 97 LYS QD 1 98 LYS H 1.800 . 4.400 4.316 4.027 4.529 0.129 6 0 "[ . 1 . 2]" 1
1221 1 97 LYS HA 1 105 LYS QG 1.800 . 4.600 4.616 4.035 4.793 0.193 12 0 "[ . 1 . 2]" 1
1222 1 98 LYS H 1 98 LYS HA 1.800 . 3.100 2.933 2.832 3.028 . 0 0 "[ . 1 . 2]" 1
1223 1 98 LYS H 1 98 LYS QB 1.800 . 3.700 2.796 2.291 3.508 . 0 0 "[ . 1 . 2]" 1
1224 1 98 LYS H 1 98 LYS QG 1.800 . 4.100 3.878 2.355 4.211 0.111 1 0 "[ . 1 . 2]" 1
1225 1 98 LYS H 1 98 LYS QD 1.800 . 4.400 4.059 2.690 4.469 0.069 8 0 "[ . 1 . 2]" 1
1226 1 98 LYS HA 1 98 LYS QB 1.800 . 2.800 2.359 2.046 2.564 . 0 0 "[ . 1 . 2]" 1
1227 1 98 LYS HA 1 98 LYS QG 1.800 . 3.200 2.541 2.118 3.353 0.153 2 0 "[ . 1 . 2]" 1
1228 1 98 LYS HA 1 98 LYS QD 1.800 . 3.800 3.364 2.345 3.965 0.165 3 0 "[ . 1 . 2]" 1
1229 1 98 LYS HA 1 98 LYS QE 1.800 . 3.800 3.869 3.795 3.962 0.162 5 0 "[ . 1 . 2]" 1
1230 1 98 LYS QB 1 98 LYS QG 1.800 . 3.000 2.009 1.924 2.142 . 0 0 "[ . 1 . 2]" 1
1231 1 98 LYS QB 1 98 LYS QD 1.800 . 3.000 2.377 2.018 2.907 . 0 0 "[ . 1 . 2]" 1
1232 1 98 LYS QB 1 98 LYS QE 1.800 . 4.300 3.320 2.008 3.912 . 0 0 "[ . 1 . 2]" 1
1233 1 98 LYS H 1 99 GLY H 1.800 . 4.500 3.917 1.775 4.526 0.026 3 0 "[ . 1 . 2]" 1
1234 1 98 LYS HA 1 99 GLY H 1.800 . 2.800 2.209 1.902 2.885 0.085 10 0 "[ . 1 . 2]" 1
1235 1 98 LYS HA 1 99 GLY QA 1.800 . 4.500 3.908 3.731 4.063 . 0 0 "[ . 1 . 2]" 1
1236 1 98 LYS QB 1 99 GLY H 1.800 . 4.400 3.496 2.033 3.992 . 0 0 "[ . 1 . 2]" 1
1237 1 98 LYS QG 1 99 GLY H 1.800 . 4.000 3.403 2.000 4.082 0.082 10 0 "[ . 1 . 2]" 1
1238 1 98 LYS QD 1 99 GLY H 1.800 . 4.400 3.638 2.554 4.439 0.039 12 0 "[ . 1 . 2]" 1
1239 1 98 LYS QB 1 100 ASP H 1.800 . 4.300 3.820 2.550 4.327 0.027 7 0 "[ . 1 . 2]" 1
1240 1 98 LYS QG 1 100 ASP H 1.800 . 3.700 3.330 2.075 3.808 0.108 10 0 "[ . 1 . 2]" 1
1241 1 98 LYS QD 1 100 ASP H 1.800 . 4.500 2.479 1.743 4.229 0.057 13 0 "[ . 1 . 2]" 1
1242 1 98 LYS QD 1 100 ASP HB3 1.800 . 4.000 3.708 3.333 4.104 0.104 10 0 "[ . 1 . 2]" 1
1243 1 98 LYS QD 1 100 ASP HB2 1.800 . 3.700 2.297 1.987 3.005 . 0 0 "[ . 1 . 2]" 1
1244 1 98 LYS H 1 105 LYS QE 1.800 . 4.900 4.192 3.079 4.994 0.094 6 0 "[ . 1 . 2]" 1
1245 1 98 LYS HA 1 105 LYS QD 1.800 . 4.300 3.923 2.177 4.457 0.157 15 0 "[ . 1 . 2]" 1
1246 1 99 GLY H 1 99 GLY HA3 1.800 . 3.000 2.344 2.262 2.917 . 0 0 "[ . 1 . 2]" 1
1247 1 99 GLY H 1 100 ASP H 1.800 . 3.000 2.772 2.155 3.038 0.038 6 0 "[ . 1 . 2]" 1
1248 1 99 GLY HA3 1 100 ASP H 1.800 . 3.700 2.889 2.460 3.424 . 0 0 "[ . 1 . 2]" 1
1249 1 99 GLY HA2 1 100 ASP H 1.800 . 3.700 3.238 2.341 3.547 . 0 0 "[ . 1 . 2]" 1
1250 1 99 GLY HA3 1 102 LEU H 1.800 . 4.900 3.572 2.990 4.464 . 0 0 "[ . 1 . 2]" 1
1251 1 99 GLY H 1 105 LYS QB 1.800 . 4.000 2.301 1.763 3.271 0.037 1 0 "[ . 1 . 2]" 1
1252 1 99 GLY HA2 1 105 LYS H 1.800 . 5.500 4.578 3.409 5.509 0.009 19 0 "[ . 1 . 2]" 1
1253 1 99 GLY HA3 1 105 LYS HA 1.800 . 4.100 3.066 2.231 4.139 0.039 12 0 "[ . 1 . 2]" 1
1254 1 99 GLY HA2 1 105 LYS HA 1.800 . 3.300 2.812 2.141 3.339 0.039 20 0 "[ . 1 . 2]" 1
1255 1 100 ASP H 1 100 ASP HA 1.800 . 2.800 2.353 2.140 2.857 0.057 12 0 "[ . 1 . 2]" 1
1256 1 100 ASP H 1 100 ASP HB3 1.800 . 4.000 3.486 2.646 3.815 . 0 0 "[ . 1 . 2]" 1
1257 1 100 ASP H 1 100 ASP HB2 1.800 . 3.600 2.780 2.153 3.035 . 0 0 "[ . 1 . 2]" 1
1258 1 100 ASP HA 1 100 ASP HB3 1.800 . 3.100 3.063 3.026 3.077 . 0 0 "[ . 1 . 2]" 1
1259 1 100 ASP HA 1 100 ASP HB2 1.800 . 3.000 2.599 2.494 2.727 . 0 0 "[ . 1 . 2]" 1
1260 1 100 ASP H 1 101 GLY H 1.800 . 2.900 2.939 2.902 2.989 0.089 18 0 "[ . 1 . 2]" 1
1261 1 100 ASP HA 1 101 GLY H 1.800 . 3.000 2.646 2.031 3.163 0.163 6 0 "[ . 1 . 2]" 1
1262 1 100 ASP HB3 1 101 GLY H 1.800 . 4.500 4.078 1.806 4.431 . 0 0 "[ . 1 . 2]" 1
1263 1 100 ASP HB2 1 101 GLY H 1.800 . 4.500 4.413 3.157 4.526 0.026 17 0 "[ . 1 . 2]" 1
1264 1 100 ASP H 1 105 LYS QE 1.800 . 5.400 5.478 5.410 5.568 0.168 10 0 "[ . 1 . 2]" 1
1265 1 101 GLY H 1 101 GLY HA2 1.800 . 3.000 2.609 2.355 3.024 0.024 6 0 "[ . 1 . 2]" 1
1266 1 101 GLY H 1 102 LEU H 1.800 . 2.800 2.326 1.783 2.803 0.017 12 0 "[ . 1 . 2]" 1
1267 1 101 GLY HA3 1 102 LEU H 1.800 . 3.700 3.108 2.753 3.521 . 0 0 "[ . 1 . 2]" 1
1268 1 102 LEU H 1 102 LEU HB2 1.800 . 3.700 2.368 2.050 2.757 . 0 0 "[ . 1 . 2]" 1
1269 1 102 LEU H 1 102 LEU HG 1.800 . 3.500 2.783 2.178 3.524 0.024 17 0 "[ . 1 . 2]" 1
1270 1 102 LEU H 1 102 LEU MD1 1.800 . 4.900 4.030 3.744 4.495 . 0 0 "[ . 1 . 2]" 1
1271 1 102 LEU H 1 102 LEU MD2 1.800 . 3.800 3.227 2.473 3.861 0.061 6 0 "[ . 1 . 2]" 1
1272 1 102 LEU HA 1 102 LEU MD1 1.800 . 3.900 3.662 2.692 3.913 0.013 12 0 "[ . 1 . 2]" 1
1273 1 102 LEU HA 1 102 LEU MD2 1.800 . 2.800 2.064 1.961 2.251 . 0 0 "[ . 1 . 2]" 1
1274 1 102 LEU HB3 1 102 LEU MD1 1.800 . 3.600 2.202 2.127 2.335 . 0 0 "[ . 1 . 2]" 1
1275 1 102 LEU HB3 1 102 LEU MD2 1.800 . 3.800 2.751 2.467 3.298 . 0 0 "[ . 1 . 2]" 1
1276 1 102 LEU HB2 1 102 LEU MD1 1.800 . 3.100 2.569 2.364 3.134 0.034 17 0 "[ . 1 . 2]" 1
1277 1 102 LEU HB2 1 102 LEU MD2 1.800 . 3.500 3.240 2.787 3.301 . 0 0 "[ . 1 . 2]" 1
1278 1 102 LEU H 1 103 CYS H 1.800 . 4.300 2.995 2.453 4.375 0.075 19 0 "[ . 1 . 2]" 1
1279 1 102 LEU HA 1 103 CYS H 1.800 . 3.600 3.190 1.932 3.516 . 0 0 "[ . 1 . 2]" 1
1280 1 102 LEU HB3 1 103 CYS H 1.800 . 4.700 3.329 2.081 4.243 . 0 0 "[ . 1 . 2]" 1
1281 1 102 LEU HB2 1 103 CYS H 1.800 . 4.700 2.989 1.810 4.069 . 0 0 "[ . 1 . 2]" 1
1282 1 102 LEU MD2 1 103 CYS H 1.800 . 4.700 4.364 3.559 4.739 0.039 11 0 "[ . 1 . 2]" 1
1283 1 102 LEU H 1 104 GLN H 1.800 . 5.500 4.626 3.930 5.505 0.005 20 0 "[ . 1 . 2]" 1
1284 1 102 LEU HB3 1 104 GLN H 1.800 . 4.400 2.990 2.537 3.590 . 0 0 "[ . 1 . 2]" 1
1285 1 102 LEU HB2 1 104 GLN H 1.800 . 3.900 3.220 2.275 3.902 0.002 20 0 "[ . 1 . 2]" 1
1286 1 102 LEU MD1 1 104 GLN H 1.800 . 4.800 4.353 3.883 4.854 0.054 7 0 "[ . 1 . 2]" 1
1287 1 102 LEU MD2 1 104 GLN H 1.800 . 5.200 5.014 4.487 5.284 0.084 12 0 "[ . 1 . 2]" 1
1288 1 102 LEU MD1 1 106 LEU MD1 1.800 . 5.100 3.927 2.274 5.144 0.044 17 0 "[ . 1 . 2]" 1
1289 1 102 LEU MD1 1 106 LEU MD2 1.800 . 3.700 2.687 1.875 3.592 . 0 0 "[ . 1 . 2]" 1
1290 1 103 CYS H 1 103 CYS HB3 1.800 . 4.300 3.321 2.567 3.824 . 0 0 "[ . 1 . 2]" 1
1291 1 103 CYS HA 1 103 CYS HB3 1.800 . 2.900 2.493 2.346 2.633 . 0 0 "[ . 1 . 2]" 1
1292 1 103 CYS HA 1 103 CYS HB2 1.800 . 2.900 2.437 2.301 2.639 . 0 0 "[ . 1 . 2]" 1
1293 1 103 CYS H 1 104 GLN H 1.800 . 3.500 2.737 1.791 3.437 0.009 8 0 "[ . 1 . 2]" 1
1294 1 104 GLN HA 1 104 GLN QG 1.800 . 4.300 2.807 2.379 3.272 . 0 0 "[ . 1 . 2]" 1
1295 1 104 GLN H 1 105 LYS H 1.800 . 3.500 3.557 3.526 3.598 0.098 6 0 "[ . 1 . 2]" 1
1296 1 104 GLN HA 1 105 LYS H 1.800 . 2.800 2.076 1.885 2.877 0.077 19 0 "[ . 1 . 2]" 1
1297 1 104 GLN HA 1 105 LYS QB 1.800 . 3.800 3.883 3.837 3.959 0.159 11 0 "[ . 1 . 2]" 1
1298 1 104 GLN HB3 1 105 LYS H 1.800 . 3.900 3.403 1.783 3.925 0.025 5 0 "[ . 1 . 2]" 1
1299 1 105 LYS H 1 105 LYS QB 1.800 . 3.000 2.283 2.033 3.104 0.104 17 0 "[ . 1 . 2]" 1
1300 1 105 LYS H 1 105 LYS QG 1.800 . 3.700 2.836 2.248 3.540 . 0 0 "[ . 1 . 2]" 1
1301 1 105 LYS H 1 105 LYS QD 1.800 . 4.400 3.571 2.189 4.419 0.019 4 0 "[ . 1 . 2]" 1
1302 1 105 LYS H 1 105 LYS QE 1.800 . 5.100 4.170 1.962 5.117 0.017 19 0 "[ . 1 . 2]" 1
1303 1 105 LYS HA 1 105 LYS QB 1.800 . 2.600 2.167 2.082 2.226 . 0 0 "[ . 1 . 2]" 1
1304 1 105 LYS QB 1 105 LYS QD 1.800 . 2.900 2.438 2.162 2.953 0.053 13 0 "[ . 1 . 2]" 1
1305 1 105 LYS HA 1 105 LYS QG 1.800 . 3.900 3.473 3.361 3.627 . 0 0 "[ . 1 . 2]" 1
1306 1 105 LYS QB 1 105 LYS QE 1.800 . 3.200 2.234 1.972 3.285 0.085 20 0 "[ . 1 . 2]" 1
1307 1 105 LYS QE 1 105 LYS QG 1.800 . 2.600 2.239 2.044 2.526 . 0 0 "[ . 1 . 2]" 1
1308 1 105 LYS H 1 106 LEU H 1.800 . 4.400 4.431 4.240 4.484 0.084 2 0 "[ . 1 . 2]" 1
1309 1 105 LYS HA 1 106 LEU H 1.800 . 3.200 2.384 2.086 2.965 . 0 0 "[ . 1 . 2]" 1
1310 1 105 LYS QB 1 106 LEU H 1.800 . 4.600 2.536 2.024 3.038 . 0 0 "[ . 1 . 2]" 1
1311 1 105 LYS QB 1 106 LEU HA 1.800 . 4.900 4.814 4.580 4.938 0.038 1 0 "[ . 1 . 2]" 1
1312 1 105 LYS QG 1 106 LEU H 1.800 . 4.400 3.202 2.049 4.249 . 0 0 "[ . 1 . 2]" 1
1313 1 105 LYS QE 1 107 THR MG 1.800 . 4.100 4.191 4.114 4.246 0.146 3 0 "[ . 1 . 2]" 1
1314 1 106 LEU H 1 106 LEU HB2 1.800 . 3.700 2.742 2.238 3.249 . 0 0 "[ . 1 . 2]" 1
1315 1 106 LEU H 1 106 LEU HG 1.800 . 4.300 2.666 1.931 3.389 . 0 0 "[ . 1 . 2]" 1
1316 1 106 LEU H 1 106 LEU QD 1.800 . 3.900 2.535 1.962 3.610 . 0 0 "[ . 1 . 2]" 1
1317 1 106 LEU HA 1 106 LEU QD 1.800 . 2.800 2.170 1.978 2.405 . 0 0 "[ . 1 . 2]" 1
1318 1 106 LEU HB3 1 106 LEU QD 1.800 . 3.300 2.149 2.080 2.267 . 0 0 "[ . 1 . 2]" 1
1319 1 106 LEU HB2 1 106 LEU QD 1.800 . 3.600 2.495 2.353 2.681 . 0 0 "[ . 1 . 2]" 1
1320 1 106 LEU QD 1 106 LEU HG 1.800 . 3.200 1.917 1.882 1.942 . 0 0 "[ . 1 . 2]" 1
1321 1 106 LEU HA 1 107 THR H 1.800 . 3.200 2.252 1.942 2.376 . 0 0 "[ . 1 . 2]" 1
1322 1 106 LEU HB3 1 107 THR H 1.800 . 5.400 2.726 2.236 3.303 . 0 0 "[ . 1 . 2]" 1
1323 1 106 LEU QD 1 107 THR H 1.800 . 3.800 3.481 2.698 3.804 0.004 11 0 "[ . 1 . 2]" 1
1324 1 106 LEU QD 1 107 THR MG 1.800 . 4.400 4.490 4.297 4.545 0.145 3 0 "[ . 1 . 2]" 1
1325 1 107 THR H 1 107 THR HB 1.800 . 4.400 3.966 3.687 4.107 . 0 0 "[ . 1 . 2]" 1
1326 1 107 THR H 1 107 THR MG 1.800 . 3.800 2.941 2.197 3.132 . 0 0 "[ . 1 . 2]" 1
1327 1 107 THR HA 1 107 THR HB 1.800 . 2.600 2.292 2.213 2.360 . 0 0 "[ . 1 . 2]" 1
1328 1 107 THR HA 1 107 THR MG 1.800 . 2.600 2.442 2.390 2.507 . 0 0 "[ . 1 . 2]" 1
1329 1 107 THR HB 1 107 THR MG 1.800 . 2.600 2.117 2.074 2.159 . 0 0 "[ . 1 . 2]" 1
1330 1 107 THR H 1 108 LEU H 1.800 . 3.300 2.540 2.253 3.111 . 0 0 "[ . 1 . 2]" 1
1331 1 107 THR HB 1 108 LEU H 1.800 . 3.200 3.263 3.210 3.294 0.094 18 0 "[ . 1 . 2]" 1
1332 1 107 THR HB 1 108 LEU HG 1.800 . 3.900 2.854 2.652 3.234 . 0 0 "[ . 1 . 2]" 1
1333 1 107 THR HB 1 108 LEU QD 1.800 . 3.500 3.497 3.384 3.582 0.082 9 0 "[ . 1 . 2]" 1
1334 1 107 THR MG 1 108 LEU H 1.800 . 3.900 3.610 3.378 3.753 . 0 0 "[ . 1 . 2]" 1
1335 1 108 LEU H 1 108 LEU HB2 1.800 . 3.600 2.840 2.546 2.943 . 0 0 "[ . 1 . 2]" 1
1336 1 108 LEU H 1 108 LEU HG 1.800 . 3.800 2.929 2.734 3.014 . 0 0 "[ . 1 . 2]" 1
1337 1 108 LEU H 1 108 LEU QD 1.800 . 3.500 3.468 3.126 3.547 0.047 3 0 "[ . 1 . 2]" 1
1338 1 108 LEU HA 1 108 LEU HB3 1.800 . 3.100 2.457 2.421 2.538 . 0 0 "[ . 1 . 2]" 1
1339 1 108 LEU HA 1 108 LEU HG 1.800 . 3.900 3.069 2.626 3.195 . 0 0 "[ . 1 . 2]" 1
1340 1 108 LEU HA 1 108 LEU QD 1.800 . 2.800 2.348 2.207 2.581 . 0 0 "[ . 1 . 2]" 1
1341 1 108 LEU HB3 1 108 LEU HG 1.800 . 3.000 3.031 2.994 3.040 0.040 19 0 "[ . 1 . 2]" 1
1342 1 108 LEU HB3 1 108 LEU QD 1.800 . 2.800 2.163 2.143 2.178 . 0 0 "[ . 1 . 2]" 1
1343 1 108 LEU HB2 1 108 LEU QD 1.800 . 2.900 2.207 2.106 2.252 . 0 0 "[ . 1 . 2]" 1
1344 1 108 LEU QD 1 108 LEU HG 1.800 . 2.600 1.904 1.890 1.924 . 0 0 "[ . 1 . 2]" 1
1345 1 108 LEU HA 1 109 PRO QD 1.800 . 2.800 1.980 1.915 2.165 . 0 0 "[ . 1 . 2]" 1
1346 1 108 LEU HB3 1 109 PRO QD 1.800 . 3.500 3.010 2.148 3.449 . 0 0 "[ . 1 . 2]" 1
1347 1 108 LEU HB2 1 109 PRO QD 1.800 . 3.900 3.954 3.459 4.102 0.202 19 0 "[ . 1 . 2]" 1
1348 1 108 LEU QD 1 109 PRO QD 1.800 . 3.300 3.238 2.687 3.341 0.041 13 0 "[ . 1 . 2]" 1
1349 1 109 PRO HA 1 109 PRO QG 1.800 . 3.600 3.393 2.893 3.590 . 0 0 "[ . 1 . 2]" 1
1350 1 109 PRO QD 1 109 PRO QG 1.800 . 3.100 2.025 1.986 2.053 . 0 0 "[ . 1 . 2]" 1
1351 1 109 PRO HA 1 110 CYS H 1.800 . 3.300 2.167 1.872 3.211 . 0 0 "[ . 1 . 2]" 1
1352 1 109 PRO QB 1 110 CYS H 1.800 . 4.000 3.425 2.894 3.904 . 0 0 "[ . 1 . 2]" 1
1353 1 109 PRO QG 1 110 CYS H 1.800 . 4.600 4.530 3.563 4.660 0.060 17 0 "[ . 1 . 2]" 1
1354 1 110 CYS H 1 110 CYS HA 1.800 . 2.900 2.455 2.183 2.824 . 0 0 "[ . 1 . 2]" 1
1355 1 110 CYS H 1 110 CYS QB 1.800 . 3.800 2.561 2.174 3.301 . 0 0 "[ . 1 . 2]" 1
1356 1 110 CYS HA 1 111 VAL H 1.800 . 3.000 2.559 2.166 3.047 0.047 16 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 70
_Distance_constraint_stats_list.Viol_count 161
_Distance_constraint_stats_list.Viol_total 158.663
_Distance_constraint_stats_list.Viol_max 0.176
_Distance_constraint_stats_list.Viol_rms 0.0213
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0057
_Distance_constraint_stats_list.Viol_average_violations_only 0.0493
_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 TRP 0.010 0.006 9 0 "[ . 1 . 2]"
1 17 ARG 0.166 0.051 6 0 "[ . 1 . 2]"
1 20 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 21 ARG 0.073 0.040 2 0 "[ . 1 . 2]"
1 22 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 ASP 0.022 0.014 9 0 "[ . 1 . 2]"
1 24 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 GLU 0.073 0.040 2 0 "[ . 1 . 2]"
1 26 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 27 GLN 0.022 0.014 9 0 "[ . 1 . 2]"
1 28 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 SER 1.231 0.150 11 0 "[ . 1 . 2]"
1 39 LEU 0.012 0.011 20 0 "[ . 1 . 2]"
1 40 ILE 0.010 0.006 9 0 "[ . 1 . 2]"
1 41 ARG 0.087 0.025 20 0 "[ . 1 . 2]"
1 42 GLU 0.166 0.051 6 0 "[ . 1 . 2]"
1 43 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 49 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 PHE 0.089 0.023 20 0 "[ . 1 . 2]"
1 51 SER 0.087 0.025 20 0 "[ . 1 . 2]"
1 52 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 SER 0.012 0.011 20 0 "[ . 1 . 2]"
1 54 VAL 0.704 0.106 18 0 "[ . 1 . 2]"
1 55 LYS 1.231 0.150 11 0 "[ . 1 . 2]"
1 56 ASP 2.538 0.176 15 0 "[ . 1 . 2]"
1 64 VAL 2.538 0.176 15 0 "[ . 1 . 2]"
1 65 LYS 0.704 0.106 18 0 "[ . 1 . 2]"
1 67 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 ILE 0.089 0.023 20 0 "[ . 1 . 2]"
1 70 ARG 0.032 0.016 11 0 "[ . 1 . 2]"
1 72 LEU 0.240 0.091 8 0 "[ . 1 . 2]"
1 76 GLY 0.240 0.091 8 0 "[ . 1 . 2]"
1 77 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 TYR 0.032 0.016 11 0 "[ . 1 . 2]"
1 79 ILE 1.413 0.129 7 0 "[ . 1 . 2]"
1 83 ILE 1.413 0.129 7 0 "[ . 1 . 2]"
1 85 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 88 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 ALA 0.081 0.026 16 0 "[ . 1 . 2]"
1 91 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 VAL 0.188 0.034 7 0 "[ . 1 . 2]"
1 93 GLN 1.000 0.114 10 0 "[ . 1 . 2]"
1 94 HIS 0.128 0.038 2 0 "[ . 1 . 2]"
1 95 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 SER 0.188 0.034 7 0 "[ . 1 . 2]"
1 97 LYS 1.000 0.114 10 0 "[ . 1 . 2]"
1 98 LYS 0.047 0.038 2 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 14 TRP O 1 40 ILE N 3.000 2.600 3.900 2.827 2.676 3.091 . 0 0 "[ . 1 . 2]" 2
2 1 14 TRP O 1 40 ILE H 2.000 . 2.800 2.398 1.906 2.806 0.006 9 0 "[ . 1 . 2]" 2
3 1 17 ARG O 1 42 GLU N 3.000 2.600 3.900 3.184 2.666 3.656 . 0 0 "[ . 1 . 2]" 2
4 1 17 ARG O 1 42 GLU H 2.000 . 2.800 2.349 1.853 2.851 0.051 6 0 "[ . 1 . 2]" 2
5 1 37 SER O 1 55 LYS N 3.000 2.600 3.900 3.711 3.648 3.787 . 0 0 "[ . 1 . 2]" 2
6 1 37 SER O 1 55 LYS H 2.000 . 2.800 2.862 2.822 2.950 0.150 11 0 "[ . 1 . 2]" 2
7 1 39 LEU N 1 53 SER O 3.000 2.600 3.900 3.241 3.018 3.421 . 0 0 "[ . 1 . 2]" 2
8 1 39 LEU H 1 53 SER O 2.000 . 2.800 2.375 2.172 2.544 . 0 0 "[ . 1 . 2]" 2
9 1 39 LEU O 1 53 SER N 3.000 2.600 3.900 3.182 2.911 3.656 . 0 0 "[ . 1 . 2]" 2
10 1 39 LEU O 1 53 SER H 2.000 . 2.800 2.251 1.971 2.811 0.011 20 0 "[ . 1 . 2]" 2
11 1 41 ARG N 1 51 SER O 3.000 2.600 3.900 3.065 2.787 3.339 . 0 0 "[ . 1 . 2]" 2
12 1 41 ARG H 1 51 SER O 2.000 . 2.800 2.509 1.946 2.825 0.025 20 0 "[ . 1 . 2]" 2
13 1 41 ARG O 1 51 SER N 3.000 2.600 3.900 2.745 2.651 2.927 . 0 0 "[ . 1 . 2]" 2
14 1 41 ARG O 1 51 SER H 2.000 . 2.800 2.099 1.933 2.303 . 0 0 "[ . 1 . 2]" 2
15 1 43 SER N 1 49 ALA O 3.000 2.600 3.900 3.021 2.709 3.498 . 0 0 "[ . 1 . 2]" 2
16 1 43 SER H 1 49 ALA O 2.000 . 2.800 2.075 1.844 2.599 . 0 0 "[ . 1 . 2]" 2
17 1 56 ASP N 1 64 VAL O 3.000 2.600 3.900 3.839 3.770 3.920 0.020 11 0 "[ . 1 . 2]" 2
18 1 56 ASP H 1 64 VAL O 2.000 . 2.800 2.926 2.881 2.976 0.176 15 0 "[ . 1 . 2]" 2
19 1 54 VAL O 1 65 LYS N 3.000 2.600 3.900 2.748 2.656 2.956 . 0 0 "[ . 1 . 2]" 2
20 1 54 VAL O 1 65 LYS H 2.000 . 2.800 2.238 2.098 2.460 . 0 0 "[ . 1 . 2]" 2
21 1 54 VAL N 1 65 LYS O 3.000 2.600 3.900 3.640 2.980 3.798 . 0 0 "[ . 1 . 2]" 2
22 1 54 VAL H 1 65 LYS O 2.000 . 2.800 2.776 2.265 2.906 0.106 18 0 "[ . 1 . 2]" 2
23 1 52 LEU O 1 67 TYR N 3.000 2.600 3.900 3.022 2.903 3.165 . 0 0 "[ . 1 . 2]" 2
24 1 52 LEU O 1 67 TYR H 2.000 . 2.800 2.201 1.985 2.567 . 0 0 "[ . 1 . 2]" 2
25 1 52 LEU N 1 67 TYR O 3.000 2.600 3.900 3.103 2.838 3.429 . 0 0 "[ . 1 . 2]" 2
26 1 52 LEU H 1 67 TYR O 2.000 . 2.800 2.275 1.999 2.661 . 0 0 "[ . 1 . 2]" 2
27 1 50 PHE O 1 69 ILE N 3.000 2.600 3.900 3.349 2.969 3.634 . 0 0 "[ . 1 . 2]" 2
28 1 50 PHE O 1 69 ILE H 2.000 . 2.800 2.615 2.221 2.823 0.023 20 0 "[ . 1 . 2]" 2
29 1 50 PHE N 1 69 ILE O 3.000 2.600 3.900 2.852 2.679 3.009 . 0 0 "[ . 1 . 2]" 2
30 1 50 PHE H 1 69 ILE O 2.000 . 2.800 1.957 1.847 2.125 . 0 0 "[ . 1 . 2]" 2
31 1 70 ARG N 1 78 TYR O 3.000 2.600 3.900 3.174 2.965 3.696 . 0 0 "[ . 1 . 2]" 2
32 1 70 ARG H 1 78 TYR O 2.000 . 2.800 2.218 1.976 2.816 0.016 17 0 "[ . 1 . 2]" 2
33 1 70 ARG O 1 78 TYR N 3.000 2.600 3.900 3.396 3.038 3.665 . 0 0 "[ . 1 . 2]" 2
34 1 70 ARG O 1 78 TYR H 2.000 . 2.800 2.475 2.098 2.816 0.016 11 0 "[ . 1 . 2]" 2
35 1 72 LEU N 1 76 GLY O 3.000 2.600 3.900 2.997 2.801 3.397 . 0 0 "[ . 1 . 2]" 2
36 1 72 LEU H 1 76 GLY O 2.000 . 2.800 2.119 1.987 2.476 . 0 0 "[ . 1 . 2]" 2
37 1 72 LEU O 1 76 GLY N 3.000 2.600 3.900 3.143 2.861 3.751 . 0 0 "[ . 1 . 2]" 2
38 1 72 LEU O 1 76 GLY H 2.000 . 2.800 2.471 2.221 2.891 0.091 8 0 "[ . 1 . 2]" 2
39 1 77 TYR N 1 85 PHE O 3.000 2.600 3.900 2.826 2.648 2.976 . 0 0 "[ . 1 . 2]" 2
40 1 77 TYR H 1 85 PHE O 2.000 . 2.800 1.953 1.882 2.046 . 0 0 "[ . 1 . 2]" 2
41 1 77 TYR O 1 85 PHE N 3.000 2.600 3.900 2.959 2.821 3.421 . 0 0 "[ . 1 . 2]" 2
42 1 77 TYR O 1 85 PHE H 2.000 . 2.800 2.171 2.060 2.494 . 0 0 "[ . 1 . 2]" 2
43 1 79 ILE N 1 83 ILE O 3.000 2.600 3.900 3.802 3.662 3.910 0.010 14 0 "[ . 1 . 2]" 2
44 1 79 ILE H 1 83 ILE O 2.000 . 2.800 2.870 2.814 2.929 0.129 7 0 "[ . 1 . 2]" 2
45 1 20 SER O 1 24 ALA N 3.000 2.600 3.900 3.052 2.879 3.251 . 0 0 "[ . 1 . 2]" 2
46 1 20 SER O 1 24 ALA H 2.000 . 2.800 2.092 1.951 2.275 . 0 0 "[ . 1 . 2]" 2
47 1 21 ARG O 1 25 GLU N 3.000 2.600 3.900 3.333 2.912 3.720 . 0 0 "[ . 1 . 2]" 2
48 1 21 ARG O 1 25 GLU H 2.000 . 2.800 2.499 2.044 2.840 0.040 2 0 "[ . 1 . 2]" 2
49 1 22 LYS O 1 26 ARG N 3.000 2.600 3.900 2.925 2.773 3.095 . 0 0 "[ . 1 . 2]" 2
50 1 22 LYS O 1 26 ARG H 2.000 . 2.800 2.231 2.111 2.371 . 0 0 "[ . 1 . 2]" 2
51 1 23 ASP O 1 27 GLN N 3.000 2.600 3.900 3.260 3.011 3.708 . 0 0 "[ . 1 . 2]" 2
52 1 23 ASP O 1 27 GLN H 2.000 . 2.800 2.368 2.097 2.814 0.014 9 0 "[ . 1 . 2]" 2
53 1 24 ALA O 1 28 LEU N 3.000 2.600 3.900 3.309 2.995 3.565 . 0 0 "[ . 1 . 2]" 2
54 1 24 ALA O 1 28 LEU H 2.000 . 2.800 2.386 2.059 2.717 . 0 0 "[ . 1 . 2]" 2
55 1 25 GLU O 1 29 LEU N 3.000 2.600 3.900 2.900 2.826 3.004 . 0 0 "[ . 1 . 2]" 2
56 1 25 GLU O 1 29 LEU H 2.000 . 2.800 1.926 1.858 2.012 . 0 0 "[ . 1 . 2]" 2
57 1 88 LEU O 1 92 VAL H 2.000 . 2.800 1.883 1.852 2.023 . 0 0 "[ . 1 . 2]" 2
58 1 88 LEU O 1 92 VAL N 3.000 2.600 3.900 2.756 2.673 2.970 . 0 0 "[ . 1 . 2]" 2
59 1 89 GLN O 1 93 GLN H 2.000 . 2.800 2.438 2.054 2.786 . 0 0 "[ . 1 . 2]" 2
60 1 89 GLN O 1 93 GLN N 3.000 2.600 3.900 2.856 2.694 3.131 . 0 0 "[ . 1 . 2]" 2
61 1 90 ALA O 1 94 HIS H 2.000 . 2.800 2.595 2.201 2.826 0.026 16 0 "[ . 1 . 2]" 2
62 1 90 ALA O 1 94 HIS N 3.000 2.600 3.900 3.521 3.167 3.788 . 0 0 "[ . 1 . 2]" 2
63 1 91 LEU O 1 95 TYR H 2.000 . 2.800 2.237 2.091 2.406 . 0 0 "[ . 1 . 2]" 2
64 1 91 LEU O 1 95 TYR N 3.000 2.600 3.900 3.158 2.965 3.316 . 0 0 "[ . 1 . 2]" 2
65 1 92 VAL O 1 96 SER H 2.000 . 2.800 2.679 2.107 2.834 0.034 7 0 "[ . 1 . 2]" 2
66 1 92 VAL O 1 96 SER N 3.000 2.600 3.900 3.387 2.784 3.647 . 0 0 "[ . 1 . 2]" 2
67 1 93 GLN O 1 97 LYS H 2.000 . 2.800 2.850 2.811 2.914 0.114 10 0 "[ . 1 . 2]" 2
68 1 93 GLN O 1 97 LYS N 3.000 2.600 3.900 3.673 3.491 3.775 . 0 0 "[ . 1 . 2]" 2
69 1 94 HIS O 1 98 LYS H 2.000 . 2.800 2.184 1.882 2.838 0.038 2 0 "[ . 1 . 2]" 2
70 1 94 HIS O 1 98 LYS N 3.000 2.600 3.900 3.114 2.756 3.809 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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