NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | in_recoord | stage | program | type | subtype | subsubtype |
|
|
397360 |
1suh   |
cing | recoord | 4-filtered-FRED | Wattos | check | violation | distance |
data_1suh
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 1486
_Distance_constraint_stats_list.Viol_count 485
_Distance_constraint_stats_list.Viol_total 3021.782
_Distance_constraint_stats_list.Viol_max 2.543
_Distance_constraint_stats_list.Viol_rms 0.0743
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0051
_Distance_constraint_stats_list.Viol_average_violations_only 0.3115
_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 3 ASP 0.007 0.007 17 0 "[ . 1 . 2]"
1 4 TRP 138.906 2.543 8 20 [*******+***-********]
1 5 VAL 0.014 0.012 7 0 "[ . 1 . 2]"
1 6 ILE 1.415 0.114 17 0 "[ . 1 . 2]"
1 7 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 CYS 0.049 0.049 18 0 "[ . 1 . 2]"
1 12 PRO 0.049 0.049 18 0 "[ . 1 . 2]"
1 13 GLU 0.215 0.034 15 0 "[ . 1 . 2]"
1 14 ASN 0.608 0.095 13 0 "[ . 1 . 2]"
1 15 GLU 0.139 0.041 11 0 "[ . 1 . 2]"
1 16 LYS 0.041 0.041 11 0 "[ . 1 . 2]"
1 17 GLY 0.147 0.043 4 0 "[ . 1 . 2]"
1 18 GLU 0.147 0.043 4 0 "[ . 1 . 2]"
1 19 PHE 0.102 0.040 18 0 "[ . 1 . 2]"
1 20 PRO 0.025 0.025 3 0 "[ . 1 . 2]"
1 21 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 LEU 0.019 0.019 19 0 "[ . 1 . 2]"
1 24 VAL 0.063 0.019 19 0 "[ . 1 . 2]"
1 25 GLN 0.010 0.010 19 0 "[ . 1 . 2]"
1 26 ILE 47.184 1.779 7 19 "[*-****+******** ****]"
1 27 LYS 0.609 0.417 6 0 "[ . 1 . 2]"
1 28 SER 1.521 0.089 15 0 "[ . 1 . 2]"
1 29 ASN 0.224 0.070 15 0 "[ . 1 . 2]"
1 30 ARG 0.900 0.089 15 0 "[ . 1 . 2]"
1 31 ASP 0.418 0.071 7 0 "[ . 1 . 2]"
1 32 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 33 GLU 0.479 0.083 7 0 "[ . 1 . 2]"
1 34 THR 1.878 0.097 17 0 "[ . 1 . 2]"
1 35 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 VAL 0.022 0.017 7 0 "[ . 1 . 2]"
1 37 PHE 0.229 0.037 10 0 "[ . 1 . 2]"
1 38 TYR 9.018 0.755 20 10 "[* *. * **-**. * +]"
1 39 SER 0.053 0.019 9 0 "[ . 1 . 2]"
1 40 ILE 0.262 0.076 14 0 "[ . 1 . 2]"
1 41 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 GLY 0.044 0.024 3 0 "[ . 1 . 2]"
1 45 ALA 0.044 0.024 3 0 "[ . 1 . 2]"
1 46 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 47 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 49 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 VAL 0.062 0.033 6 0 "[ . 1 . 2]"
1 51 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 VAL 0.062 0.033 6 0 "[ . 1 . 2]"
1 53 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 57 ARG 0.471 0.097 20 0 "[ . 1 . 2]"
1 58 GLU 0.470 0.070 16 0 "[ . 1 . 2]"
1 59 THR 61.105 2.543 8 20 [******-+************]
1 60 GLY 20.718 1.934 4 16 "[***+-*** ****** * *]"
1 61 TRP 0.010 0.010 19 0 "[ . 1 . 2]"
1 62 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 VAL 0.025 0.020 15 0 "[ . 1 . 2]"
1 65 THR 0.047 0.025 3 0 "[ . 1 . 2]"
1 66 GLN 0.003 0.003 2 0 "[ . 1 . 2]"
1 67 PRO 0.003 0.003 13 0 "[ . 1 . 2]"
1 68 LEU 0.846 0.095 13 0 "[ . 1 . 2]"
1 69 ASP 0.494 0.072 15 0 "[ . 1 . 2]"
1 70 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 71 GLU 0.046 0.029 11 0 "[ . 1 . 2]"
1 72 ALA 0.046 0.029 11 0 "[ . 1 . 2]"
1 73 ILE 0.257 0.053 3 0 "[ . 1 . 2]"
1 74 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 LYS 0.794 0.075 7 0 "[ . 1 . 2]"
1 76 TYR 0.144 0.044 14 0 "[ . 1 . 2]"
1 77 ILE 0.023 0.013 18 0 "[ . 1 . 2]"
1 78 LEU 0.016 0.016 10 0 "[ . 1 . 2]"
1 79 TYR 0.033 0.018 1 0 "[ . 1 . 2]"
1 80 SER 0.550 0.075 19 0 "[ . 1 . 2]"
1 81 HIS 1.040 0.088 16 0 "[ . 1 . 2]"
1 82 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 VAL 1.270 0.099 16 0 "[ . 1 . 2]"
1 84 SER 2.639 0.188 14 0 "[ . 1 . 2]"
1 85 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 86 ASN 0.188 0.188 14 0 "[ . 1 . 2]"
1 87 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 88 GLU 0.014 0.014 16 0 "[ . 1 . 2]"
1 89 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 VAL 0.003 0.003 20 0 "[ . 1 . 2]"
1 91 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 PRO 0.708 0.088 16 0 "[ . 1 . 2]"
1 94 MET 0.550 0.075 19 0 "[ . 1 . 2]"
1 95 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 98 ILE 0.121 0.044 14 0 "[ . 1 . 2]"
1 99 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 VAL 0.794 0.075 7 0 "[ . 1 . 2]"
1 101 THR 0.107 0.034 15 0 "[ . 1 . 2]"
1 102 ASP 0.108 0.034 10 0 "[ . 1 . 2]"
1 103 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 104 ASN 0.412 0.164 10 0 "[ . 1 . 2]"
1 105 ASP 0.412 0.164 10 0 "[ . 1 . 2]"
1 106 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 3 ASP HA 1 4 TRP H 0.000 . 3.300 2.373 2.123 3.307 0.007 17 0 "[ . 1 . 2]" 1
2 1 3 ASP H 1 3 ASP QB 0.000 . 3.900 2.862 2.186 3.495 . 0 0 "[ . 1 . 2]" 1
3 1 3 ASP QB 1 5 VAL QG 0.000 . 8.400 2.670 2.032 3.951 . 0 0 "[ . 1 . 2]" 1
4 1 3 ASP QB 1 5 VAL H 0.000 . 6.000 4.386 3.841 5.018 . 0 0 "[ . 1 . 2]" 1
5 1 3 ASP HB3 1 4 TRP H 0.000 . 5.000 3.296 1.829 4.341 . 0 0 "[ . 1 . 2]" 1
6 1 3 ASP HB2 1 4 TRP H 0.000 . 5.000 3.608 2.376 4.541 . 0 0 "[ . 1 . 2]" 1
7 1 3 ASP H 1 4 TRP H 0.000 . 5.000 4.270 3.013 4.675 . 0 0 "[ . 1 . 2]" 1
8 1 4 TRP HA 1 5 VAL QG 0.000 . 7.400 3.610 3.287 4.088 . 0 0 "[ . 1 . 2]" 1
9 1 4 TRP HA 1 5 VAL H 0.000 . 2.700 2.251 2.182 2.325 . 0 0 "[ . 1 . 2]" 1
10 1 4 TRP H 1 4 TRP QB 0.000 . 3.900 2.110 2.034 2.183 . 0 0 "[ . 1 . 2]" 1
11 1 4 TRP QB 1 28 SER HA 0.000 . 6.000 4.120 3.604 5.025 . 0 0 "[ . 1 . 2]" 1
12 1 4 TRP HB3 1 5 VAL H 0.000 . 5.000 4.067 3.845 4.160 . 0 0 "[ . 1 . 2]" 1
13 1 4 TRP HB2 1 5 VAL H 0.000 . 5.000 4.631 4.584 4.672 . 0 0 "[ . 1 . 2]" 1
14 1 4 TRP HA 1 4 TRP HD1 0.000 . 5.000 2.110 2.057 2.152 . 0 0 "[ . 1 . 2]" 1
15 1 4 TRP H 1 4 TRP HD1 0.000 . 3.300 3.362 3.232 3.475 0.175 19 0 "[ . 1 . 2]" 1
16 1 4 TRP HD1 1 5 VAL H 0.000 . 5.000 4.207 4.088 4.308 . 0 0 "[ . 1 . 2]" 1
17 1 4 TRP HA 1 4 TRP HE3 0.000 . 5.000 4.778 4.648 4.895 . 0 0 "[ . 1 . 2]" 1
18 1 4 TRP HE3 1 27 LYS HA 0.000 . 5.000 3.281 2.795 3.783 . 0 0 "[ . 1 . 2]" 1
19 1 4 TRP HE3 1 27 LYS QB 0.000 . 6.000 3.907 3.661 4.172 . 0 0 "[ . 1 . 2]" 1
20 1 4 TRP HE3 1 27 LYS QD 0.000 . 6.000 5.605 4.547 6.417 0.417 6 0 "[ . 1 . 2]" 1
21 1 4 TRP HE3 1 27 LYS QG 0.000 . 6.000 4.910 4.329 5.965 . 0 0 "[ . 1 . 2]" 1
22 1 4 TRP HE3 1 28 SER HA 0.000 . 5.000 4.196 3.939 4.704 . 0 0 "[ . 1 . 2]" 1
23 1 4 TRP HE3 1 28 SER QB 0.000 . 6.000 2.697 2.208 3.444 . 0 0 "[ . 1 . 2]" 1
24 1 4 TRP HE3 1 28 SER H 0.000 . 5.000 1.802 1.618 2.085 . 0 0 "[ . 1 . 2]" 1
25 1 4 TRP HE3 1 36 VAL MG2 0.000 . 6.500 5.351 5.225 5.411 . 0 0 "[ . 1 . 2]" 1
26 1 4 TRP HE3 1 38 TYR QD 0.000 . 7.000 6.397 5.575 6.555 . 0 0 "[ . 1 . 2]" 1
27 1 4 TRP HE3 1 38 TYR QE 0.000 . 7.000 4.370 3.496 4.652 . 0 0 "[ . 1 . 2]" 1
28 1 4 TRP HH2 1 26 ILE MD 0.000 . 6.500 7.179 5.939 7.760 1.260 7 14 "[* *.*+*-** *** ** *]" 1
29 1 4 TRP HH2 1 27 LYS HA 0.000 . 5.000 4.378 4.082 4.907 . 0 0 "[ . 1 . 2]" 1
30 1 4 TRP HH2 1 38 TYR QD 0.000 . 7.000 4.117 3.757 4.513 . 0 0 "[ . 1 . 2]" 1
31 1 4 TRP HH2 1 38 TYR QE 0.000 . 7.000 2.205 2.128 2.788 . 0 0 "[ . 1 . 2]" 1
32 1 4 TRP HH2 1 59 THR HA 0.000 . 5.000 5.564 4.226 6.321 1.321 8 14 "[****.*-+ *** ** * *]" 1
33 1 4 TRP HH2 1 60 GLY QA 0.000 . 6.000 4.375 3.678 5.101 . 0 0 "[ . 1 . 2]" 1
34 1 4 TRP HH2 1 60 GLY H 0.000 . 5.000 6.010 4.527 6.934 1.934 4 16 "[***+-*** ****** * *]" 1
35 1 4 TRP H 1 5 VAL QG 0.000 . 7.400 3.378 3.101 3.634 . 0 0 "[ . 1 . 2]" 1
36 1 4 TRP H 1 5 VAL H 0.000 . 5.000 4.169 4.059 4.387 . 0 0 "[ . 1 . 2]" 1
37 1 4 TRP HZ2 1 26 ILE MD 0.000 . 6.500 7.375 6.655 7.784 1.284 11 18 "[* ******-*+**** ****]" 1
38 1 4 TRP HZ2 1 27 LYS QG 0.000 . 6.000 4.283 3.618 5.701 . 0 0 "[ . 1 . 2]" 1
39 1 4 TRP HZ2 1 38 TYR QE 0.000 . 7.000 3.938 3.380 4.393 . 0 0 "[ . 1 . 2]" 1
40 1 4 TRP HZ2 1 59 THR HA 0.000 . 5.000 5.661 4.384 6.593 1.593 8 14 "[****.* + **-*** * *]" 1
41 1 4 TRP HZ2 1 59 THR HB 0.000 . 5.000 6.705 5.581 7.543 2.543 8 20 [*******+**********-*] 1
42 1 4 TRP HZ2 1 60 GLY QA 0.000 . 6.000 4.853 4.369 5.270 . 0 0 "[ . 1 . 2]" 1
43 1 4 TRP HZ3 1 26 ILE MD 0.000 . 6.500 7.273 6.420 8.279 1.779 7 16 "[*- *.*+******** ** *]" 1
44 1 4 TRP HZ3 1 26 ILE MG 0.000 . 6.500 4.648 4.199 5.041 . 0 0 "[ . 1 . 2]" 1
45 1 4 TRP HZ3 1 27 LYS HA 0.000 . 5.000 4.000 3.565 4.408 . 0 0 "[ . 1 . 2]" 1
46 1 4 TRP HZ3 1 27 LYS QB 0.000 . 6.000 5.467 5.241 5.734 . 0 0 "[ . 1 . 2]" 1
47 1 4 TRP HZ3 1 28 SER QB 0.000 . 6.000 2.668 2.070 3.858 . 0 0 "[ . 1 . 2]" 1
48 1 4 TRP HZ3 1 36 VAL MG2 0.000 . 6.500 3.898 3.677 4.274 . 0 0 "[ . 1 . 2]" 1
49 1 4 TRP HZ3 1 38 TYR QB 0.000 . 6.000 6.403 5.530 6.755 0.755 20 10 "[* *. * **-**. * +]" 1
50 1 4 TRP HZ3 1 38 TYR QD 0.000 . 7.000 4.758 4.027 5.208 . 0 0 "[ . 1 . 2]" 1
51 1 4 TRP HZ3 1 38 TYR QE 0.000 . 5.300 2.790 2.168 3.541 . 0 0 "[ . 1 . 2]" 1
52 1 5 VAL HA 1 6 ILE HA 0.000 . 5.000 4.366 4.337 4.413 . 0 0 "[ . 1 . 2]" 1
53 1 5 VAL HA 1 6 ILE HB 0.000 . 5.000 4.734 4.538 4.860 . 0 0 "[ . 1 . 2]" 1
54 1 5 VAL HA 1 6 ILE H 0.000 . 2.700 2.288 2.202 2.311 . 0 0 "[ . 1 . 2]" 1
55 1 5 VAL HB 1 6 ILE HA 0.000 . 5.000 4.613 4.254 5.012 0.012 7 0 "[ . 1 . 2]" 1
56 1 5 VAL HB 1 6 ILE H 0.000 . 5.000 4.256 3.827 4.548 . 0 0 "[ . 1 . 2]" 1
57 1 5 VAL H 1 6 ILE H 0.000 . 5.000 3.513 3.413 3.811 . 0 0 "[ . 1 . 2]" 1
58 1 6 ILE HA 1 7 PRO HA 0.000 . 5.000 4.574 4.558 4.583 . 0 0 "[ . 1 . 2]" 1
59 1 6 ILE HA 1 7 PRO QD 0.000 . 3.700 1.990 1.962 2.011 . 0 0 "[ . 1 . 2]" 1
60 1 6 ILE HA 1 7 PRO QG 0.000 . 6.000 3.944 3.907 3.966 . 0 0 "[ . 1 . 2]" 1
61 1 6 ILE H 1 6 ILE HB 0.000 . 3.300 3.364 3.233 3.414 0.114 17 0 "[ . 1 . 2]" 1
62 1 6 ILE HB 1 7 PRO QD 0.000 . 6.000 4.121 4.100 4.175 . 0 0 "[ . 1 . 2]" 1
63 1 6 ILE MD 1 7 PRO QD 0.000 . 7.500 3.948 2.805 4.858 . 0 0 "[ . 1 . 2]" 1
64 1 6 ILE QG 1 7 PRO QD 0.000 . 7.000 3.498 3.300 3.782 . 0 0 "[ . 1 . 2]" 1
65 1 6 ILE H 1 6 ILE MG 0.000 . 4.800 2.232 2.050 2.582 . 0 0 "[ . 1 . 2]" 1
66 1 6 ILE MG 1 7 PRO QD 0.000 . 5.800 3.950 3.884 4.064 . 0 0 "[ . 1 . 2]" 1
67 1 6 ILE MG 1 26 ILE HA 0.000 . 6.500 4.376 2.666 5.391 . 0 0 "[ . 1 . 2]" 1
68 1 6 ILE H 1 7 PRO QD 0.000 . 6.000 2.928 2.806 3.115 . 0 0 "[ . 1 . 2]" 1
69 1 7 PRO QD 1 8 PRO QD 0.000 . 5.300 1.909 1.887 1.939 . 0 0 "[ . 1 . 2]" 1
70 1 8 PRO HA 1 9 ILE HA 0.000 . 5.000 4.475 4.450 4.491 . 0 0 "[ . 1 . 2]" 1
71 1 8 PRO HA 1 9 ILE HB 0.000 . 5.000 4.498 4.162 4.774 . 0 0 "[ . 1 . 2]" 1
72 1 8 PRO HA 1 9 ILE H 0.000 . 2.700 2.186 2.147 2.224 . 0 0 "[ . 1 . 2]" 1
73 1 8 PRO HA 1 97 VAL QG 0.000 . 5.700 3.010 1.926 3.413 . 0 0 "[ . 1 . 2]" 1
74 1 8 PRO HA 1 97 VAL H 0.000 . 5.000 3.579 2.971 3.682 . 0 0 "[ . 1 . 2]" 1
75 1 8 PRO QB 1 9 ILE H 0.000 . 3.700 3.129 3.005 3.261 . 0 0 "[ . 1 . 2]" 1
76 1 8 PRO QB 1 97 VAL QG 0.000 . 8.400 3.635 2.900 4.033 . 0 0 "[ . 1 . 2]" 1
77 1 8 PRO QB 1 97 VAL H 0.000 . 6.000 5.320 4.685 5.416 . 0 0 "[ . 1 . 2]" 1
78 1 9 ILE HA 1 10 SER HA 0.000 . 5.000 4.507 4.477 4.532 . 0 0 "[ . 1 . 2]" 1
79 1 9 ILE HA 1 10 SER QB 0.000 . 6.000 4.161 3.901 4.654 . 0 0 "[ . 1 . 2]" 1
80 1 9 ILE HA 1 10 SER H 0.000 . 3.300 2.469 2.392 2.525 . 0 0 "[ . 1 . 2]" 1
81 1 9 ILE H 1 9 ILE HB 0.000 . 3.300 2.797 2.622 2.973 . 0 0 "[ . 1 . 2]" 1
82 1 9 ILE HB 1 10 SER H 0.000 . 5.000 3.529 3.264 3.776 . 0 0 "[ . 1 . 2]" 1
83 1 9 ILE HB 1 96 ILE MG 0.000 . 6.500 3.243 2.774 3.669 . 0 0 "[ . 1 . 2]" 1
84 1 9 ILE HB 1 98 ILE MD 0.000 . 6.500 3.822 3.471 4.303 . 0 0 "[ . 1 . 2]" 1
85 1 9 ILE HB 1 98 ILE QG 0.000 . 6.000 2.198 1.959 2.675 . 0 0 "[ . 1 . 2]" 1
86 1 9 ILE HB 1 98 ILE MG 0.000 . 6.500 3.099 2.153 3.708 . 0 0 "[ . 1 . 2]" 1
87 1 9 ILE HB 1 99 THR H 0.000 . 5.000 4.021 3.758 4.392 . 0 0 "[ . 1 . 2]" 1
88 1 9 ILE MD 1 10 SER H 0.000 . 4.800 3.478 2.861 4.017 . 0 0 "[ . 1 . 2]" 1
89 1 9 ILE QG 1 98 ILE MG 0.000 . 7.500 4.452 3.564 5.045 . 0 0 "[ . 1 . 2]" 1
90 1 9 ILE MG 1 10 SER H 0.000 . 6.500 1.705 1.590 1.844 . 0 0 "[ . 1 . 2]" 1
91 1 9 ILE H 1 97 VAL H 0.000 . 5.000 4.395 4.024 4.720 . 0 0 "[ . 1 . 2]" 1
92 1 10 SER HA 1 11 CYS HA 0.000 . 5.000 4.450 4.422 4.479 . 0 0 "[ . 1 . 2]" 1
93 1 10 SER HA 1 11 CYS H 0.000 . 2.700 2.210 2.137 2.279 . 0 0 "[ . 1 . 2]" 1
94 1 10 SER HA 1 99 THR HA 0.000 . 5.000 4.739 4.502 4.897 . 0 0 "[ . 1 . 2]" 1
95 1 10 SER HA 1 99 THR HB 0.000 . 5.000 4.367 4.191 4.595 . 0 0 "[ . 1 . 2]" 1
96 1 10 SER HA 1 99 THR MG 0.000 . 6.500 2.161 2.085 2.289 . 0 0 "[ . 1 . 2]" 1
97 1 10 SER HA 1 99 THR H 0.000 . 3.300 2.703 2.236 3.003 . 0 0 "[ . 1 . 2]" 1
98 1 10 SER HA 1 100 VAL HA 0.000 . 5.000 4.512 4.334 4.756 . 0 0 "[ . 1 . 2]" 1
99 1 10 SER HA 1 101 THR MG 0.000 . 6.500 4.978 4.430 5.379 . 0 0 "[ . 1 . 2]" 1
100 1 10 SER H 1 10 SER QB 0.000 . 3.900 2.868 2.471 3.201 . 0 0 "[ . 1 . 2]" 1
101 1 10 SER QB 1 11 CYS HA 0.000 . 6.000 4.375 3.992 4.671 . 0 0 "[ . 1 . 2]" 1
102 1 10 SER QB 1 11 CYS H 0.000 . 4.300 3.218 2.860 3.692 . 0 0 "[ . 1 . 2]" 1
103 1 10 SER QB 1 12 PRO QD 0.000 . 7.000 4.422 3.616 4.874 . 0 0 "[ . 1 . 2]" 1
104 1 10 SER QB 1 99 THR HB 0.000 . 6.000 5.031 4.784 5.288 . 0 0 "[ . 1 . 2]" 1
105 1 10 SER QB 1 99 THR MG 0.000 . 5.200 2.610 2.178 2.915 . 0 0 "[ . 1 . 2]" 1
106 1 10 SER QB 1 99 THR H 0.000 . 6.000 4.275 3.834 4.599 . 0 0 "[ . 1 . 2]" 1
107 1 10 SER H 1 11 CYS H 0.000 . 5.000 4.435 4.367 4.530 . 0 0 "[ . 1 . 2]" 1
108 1 10 SER H 1 98 ILE HA 0.000 . 5.000 4.454 4.102 4.787 . 0 0 "[ . 1 . 2]" 1
109 1 11 CYS HA 1 12 PRO HA 0.000 . 5.000 4.485 4.395 4.525 . 0 0 "[ . 1 . 2]" 1
110 1 11 CYS HA 1 12 PRO QB 0.000 . 6.000 4.758 4.732 4.773 . 0 0 "[ . 1 . 2]" 1
111 1 11 CYS HA 1 12 PRO QD 0.000 . 3.700 1.927 1.915 1.950 . 0 0 "[ . 1 . 2]" 1
112 1 11 CYS HA 1 12 PRO QG 0.000 . 6.000 3.864 3.848 3.898 . 0 0 "[ . 1 . 2]" 1
113 1 11 CYS HA 1 23 LEU QD 0.000 . 7.400 2.800 2.088 3.522 . 0 0 "[ . 1 . 2]" 1
114 1 11 CYS QB 1 23 LEU QD 0.000 . 8.400 3.194 2.749 4.708 . 0 0 "[ . 1 . 2]" 1
115 1 11 CYS QB 1 53 PHE QE 0.000 . 8.000 3.576 2.755 4.759 . 0 0 "[ . 1 . 2]" 1
116 1 11 CYS QB 1 53 PHE HZ 0.000 . 6.000 3.845 2.844 4.893 . 0 0 "[ . 1 . 2]" 1
117 1 11 CYS QB 1 98 ILE MG 0.000 . 5.800 2.140 1.860 2.407 . 0 0 "[ . 1 . 2]" 1
118 1 11 CYS QB 1 100 VAL HA 0.000 . 6.000 3.427 2.993 4.049 . 0 0 "[ . 1 . 2]" 1
119 1 11 CYS QB 1 100 VAL MG1 0.000 . 5.800 4.041 3.692 4.167 . 0 0 "[ . 1 . 2]" 1
120 1 11 CYS QB 1 100 VAL MG2 0.000 . 7.500 3.442 2.821 3.749 . 0 0 "[ . 1 . 2]" 1
121 1 11 CYS H 1 12 PRO HA 0.000 . 5.000 4.808 4.632 5.049 0.049 18 0 "[ . 1 . 2]" 1
122 1 11 CYS H 1 12 PRO QD 0.000 . 6.000 3.996 3.728 4.286 . 0 0 "[ . 1 . 2]" 1
123 1 11 CYS H 1 98 ILE MG 0.000 . 6.500 3.041 2.734 3.441 . 0 0 "[ . 1 . 2]" 1
124 1 11 CYS H 1 100 VAL HA 0.000 . 5.000 2.898 2.648 3.137 . 0 0 "[ . 1 . 2]" 1
125 1 11 CYS H 1 100 VAL MG1 0.000 . 6.500 4.546 4.234 4.797 . 0 0 "[ . 1 . 2]" 1
126 1 11 CYS H 1 100 VAL MG2 0.000 . 6.500 4.268 3.886 4.580 . 0 0 "[ . 1 . 2]" 1
127 1 11 CYS H 1 101 THR H 0.000 . 5.000 3.770 3.209 4.539 . 0 0 "[ . 1 . 2]" 1
128 1 12 PRO HA 1 13 GLU HA 0.000 . 5.000 4.430 4.368 4.480 . 0 0 "[ . 1 . 2]" 1
129 1 12 PRO HA 1 13 GLU QG 0.000 . 6.000 4.251 3.269 5.512 . 0 0 "[ . 1 . 2]" 1
130 1 12 PRO HA 1 13 GLU H 0.000 . 3.300 2.314 2.135 2.418 . 0 0 "[ . 1 . 2]" 1
131 1 12 PRO HA 1 101 THR HB 0.000 . 5.000 3.480 2.303 4.605 . 0 0 "[ . 1 . 2]" 1
132 1 12 PRO HA 1 101 THR MG 0.000 . 6.500 4.557 3.773 5.150 . 0 0 "[ . 1 . 2]" 1
133 1 12 PRO QB 1 13 GLU H 0.000 . 4.300 2.745 2.477 3.040 . 0 0 "[ . 1 . 2]" 1
134 1 12 PRO QB 1 15 GLU QG 0.000 . 7.000 2.933 2.073 4.603 . 0 0 "[ . 1 . 2]" 1
135 1 12 PRO QB 1 15 GLU H 0.000 . 6.000 4.329 3.403 5.086 . 0 0 "[ . 1 . 2]" 1
136 1 12 PRO QB 1 101 THR H 0.000 . 6.000 4.876 4.222 5.444 . 0 0 "[ . 1 . 2]" 1
137 1 12 PRO QB 1 103 GLN QG 0.000 . 7.000 3.970 2.476 5.574 . 0 0 "[ . 1 . 2]" 1
138 1 13 GLU HA 1 14 ASN HA 0.000 . 5.000 4.498 4.412 4.559 . 0 0 "[ . 1 . 2]" 1
139 1 13 GLU HA 1 14 ASN H 0.000 . 3.300 2.326 2.181 2.434 . 0 0 "[ . 1 . 2]" 1
140 1 13 GLU HA 1 15 GLU H 0.000 . 5.000 3.657 3.058 4.809 . 0 0 "[ . 1 . 2]" 1
141 1 13 GLU HA 1 68 LEU HA 0.000 . 5.000 4.303 4.031 4.598 . 0 0 "[ . 1 . 2]" 1
142 1 13 GLU HA 1 68 LEU QB 0.000 . 6.000 2.386 2.118 2.685 . 0 0 "[ . 1 . 2]" 1
143 1 13 GLU HA 1 68 LEU MD2 0.000 . 6.500 4.319 3.247 4.780 . 0 0 "[ . 1 . 2]" 1
144 1 13 GLU HA 1 100 VAL QG 0.000 . 7.400 3.623 3.043 4.065 . 0 0 "[ . 1 . 2]" 1
145 1 13 GLU HA 1 100 VAL MG2 0.000 . 6.500 5.125 4.786 5.361 . 0 0 "[ . 1 . 2]" 1
146 1 13 GLU H 1 13 GLU QB 0.000 . 3.900 2.725 2.270 3.129 . 0 0 "[ . 1 . 2]" 1
147 1 13 GLU QB 1 14 ASN HA 0.000 . 6.000 4.557 4.118 5.110 . 0 0 "[ . 1 . 2]" 1
148 1 13 GLU QB 1 14 ASN HB3 0.000 . 6.000 5.002 4.732 5.184 . 0 0 "[ . 1 . 2]" 1
149 1 13 GLU QB 1 14 ASN H 0.000 . 4.300 2.784 2.289 3.552 . 0 0 "[ . 1 . 2]" 1
150 1 13 GLU QB 1 100 VAL MG1 0.000 . 7.500 2.432 2.061 3.492 . 0 0 "[ . 1 . 2]" 1
151 1 13 GLU HB3 1 14 ASN QD 0.000 . 6.000 4.275 2.742 5.386 . 0 0 "[ . 1 . 2]" 1
152 1 13 GLU H 1 13 GLU QG 0.000 . 4.300 2.621 1.660 3.998 . 0 0 "[ . 1 . 2]" 1
153 1 13 GLU QG 1 14 ASN H 0.000 . 6.000 3.261 1.761 4.155 . 0 0 "[ . 1 . 2]" 1
154 1 13 GLU H 1 14 ASN H 0.000 . 5.000 4.523 4.465 4.570 . 0 0 "[ . 1 . 2]" 1
155 1 13 GLU H 1 101 THR HB 0.000 . 5.000 4.719 3.263 5.034 0.034 15 0 "[ . 1 . 2]" 1
156 1 13 GLU H 1 102 ASP HA 0.000 . 5.000 4.649 3.749 5.034 0.034 10 0 "[ . 1 . 2]" 1
157 1 14 ASN HA 1 15 GLU HA 0.000 . 5.000 4.731 4.471 4.969 . 0 0 "[ . 1 . 2]" 1
158 1 14 ASN HA 1 15 GLU QB 0.000 . 6.000 4.723 4.452 5.039 . 0 0 "[ . 1 . 2]" 1
159 1 14 ASN HA 1 15 GLU H 0.000 . 5.000 2.846 2.330 3.436 . 0 0 "[ . 1 . 2]" 1
160 1 14 ASN HA 1 67 PRO QB 0.000 . 6.000 2.732 2.166 3.193 . 0 0 "[ . 1 . 2]" 1
161 1 14 ASN HA 1 67 PRO QG 0.000 . 6.000 3.269 2.518 4.123 . 0 0 "[ . 1 . 2]" 1
162 1 14 ASN HA 1 68 LEU H 0.000 . 5.000 4.989 4.731 5.095 0.095 13 0 "[ . 1 . 2]" 1
163 1 14 ASN HB3 1 15 GLU H 0.000 . 5.000 4.401 4.198 4.571 . 0 0 "[ . 1 . 2]" 1
164 1 14 ASN HB3 1 103 GLN QB 0.000 . 6.000 4.656 3.656 5.393 . 0 0 "[ . 1 . 2]" 1
165 1 14 ASN HB3 1 103 GLN QG 0.000 . 6.000 4.842 3.065 5.413 . 0 0 "[ . 1 . 2]" 1
166 1 14 ASN HB2 1 15 GLU H 0.000 . 5.000 4.076 3.111 4.464 . 0 0 "[ . 1 . 2]" 1
167 1 14 ASN HB2 1 103 GLN QG 0.000 . 6.000 3.565 2.188 4.551 . 0 0 "[ . 1 . 2]" 1
168 1 14 ASN QD 1 103 GLN QB 0.000 . 5.300 3.548 2.593 4.140 . 0 0 "[ . 1 . 2]" 1
169 1 14 ASN QD 1 105 ASP QB 0.000 . 7.000 5.024 3.313 5.448 . 0 0 "[ . 1 . 2]" 1
170 1 14 ASN H 1 67 PRO QB 0.000 . 6.000 2.367 1.677 3.207 . 0 0 "[ . 1 . 2]" 1
171 1 14 ASN H 1 68 LEU H 0.000 . 5.000 3.225 3.043 3.544 . 0 0 "[ . 1 . 2]" 1
172 1 15 GLU HA 1 16 LYS HA 0.000 . 5.000 4.441 4.373 4.569 . 0 0 "[ . 1 . 2]" 1
173 1 15 GLU HA 1 16 LYS QG 0.000 . 6.000 3.764 3.180 5.166 . 0 0 "[ . 1 . 2]" 1
174 1 15 GLU HA 1 16 LYS H 0.000 . 2.700 2.269 2.131 2.741 0.041 11 0 "[ . 1 . 2]" 1
175 1 15 GLU HA 1 67 PRO QB 0.000 . 6.000 4.099 3.776 4.459 . 0 0 "[ . 1 . 2]" 1
176 1 15 GLU HA 1 67 PRO QG 0.000 . 6.000 5.052 4.504 5.271 . 0 0 "[ . 1 . 2]" 1
177 1 15 GLU H 1 15 GLU QB 0.000 . 3.900 2.339 2.061 2.893 . 0 0 "[ . 1 . 2]" 1
178 1 15 GLU QB 1 16 LYS H 0.000 . 6.000 3.178 1.813 3.949 . 0 0 "[ . 1 . 2]" 1
179 1 15 GLU QB 1 21 LYS QE 0.000 . 7.000 3.632 2.488 4.770 . 0 0 "[ . 1 . 2]" 1
180 1 15 GLU QB 1 67 PRO HA 0.000 . 6.000 3.498 2.775 4.779 . 0 0 "[ . 1 . 2]" 1
181 1 15 GLU HB3 1 19 PHE QE 0.000 . 7.000 3.887 2.542 5.271 . 0 0 "[ . 1 . 2]" 1
182 1 15 GLU HB3 1 19 PHE HZ 0.000 . 5.000 3.521 2.202 5.022 0.022 19 0 "[ . 1 . 2]" 1
183 1 15 GLU HB2 1 19 PHE QE 0.000 . 7.000 4.022 2.191 5.539 . 0 0 "[ . 1 . 2]" 1
184 1 15 GLU HB2 1 19 PHE HZ 0.000 . 5.000 3.596 2.171 5.040 0.040 18 0 "[ . 1 . 2]" 1
185 1 15 GLU HB2 1 21 LYS QE 0.000 . 6.000 4.690 3.562 5.306 . 0 0 "[ . 1 . 2]" 1
186 1 15 GLU QG 1 16 LYS H 0.000 . 6.000 3.593 2.074 4.501 . 0 0 "[ . 1 . 2]" 1
187 1 15 GLU H 1 68 LEU H 0.000 . 5.000 3.816 3.321 4.508 . 0 0 "[ . 1 . 2]" 1
188 1 16 LYS HA 1 17 GLY QA 0.000 . 6.000 4.028 3.940 4.108 . 0 0 "[ . 1 . 2]" 1
189 1 16 LYS HA 1 17 GLY H 0.000 . 3.300 2.326 2.152 2.464 . 0 0 "[ . 1 . 2]" 1
190 1 16 LYS HA 1 19 PHE QE 0.000 . 7.000 3.816 2.173 5.064 . 0 0 "[ . 1 . 2]" 1
191 1 16 LYS HA 1 19 PHE HZ 0.000 . 5.000 4.138 2.760 4.975 . 0 0 "[ . 1 . 2]" 1
192 1 16 LYS H 1 16 LYS QB 0.000 . 3.900 2.905 2.549 3.234 . 0 0 "[ . 1 . 2]" 1
193 1 16 LYS QB 1 17 GLY QA 0.000 . 7.000 3.773 3.564 4.079 . 0 0 "[ . 1 . 2]" 1
194 1 16 LYS HB3 1 17 GLY H 0.000 . 5.000 3.856 3.521 4.231 . 0 0 "[ . 1 . 2]" 1
195 1 16 LYS HB2 1 17 GLY H 0.000 . 5.000 2.689 2.315 3.281 . 0 0 "[ . 1 . 2]" 1
196 1 16 LYS H 1 16 LYS QD 0.000 . 6.000 3.551 1.570 4.276 . 0 0 "[ . 1 . 2]" 1
197 1 16 LYS QD 1 17 GLY H 0.000 . 6.000 4.538 2.892 5.336 . 0 0 "[ . 1 . 2]" 1
198 1 16 LYS HA 1 16 LYS QE 0.000 . 6.000 4.830 4.138 5.432 . 0 0 "[ . 1 . 2]" 1
199 1 16 LYS H 1 16 LYS QG 0.000 . 4.300 2.065 1.641 3.296 . 0 0 "[ . 1 . 2]" 1
200 1 16 LYS QG 1 17 GLY H 0.000 . 6.000 3.804 2.946 4.338 . 0 0 "[ . 1 . 2]" 1
201 1 17 GLY QA 1 18 GLU HA 0.000 . 6.000 3.983 3.955 4.021 . 0 0 "[ . 1 . 2]" 1
202 1 17 GLY HA3 1 18 GLU H 0.000 . 3.300 2.325 2.140 2.794 . 0 0 "[ . 1 . 2]" 1
203 1 17 GLY HA2 1 18 GLU H 0.000 . 3.300 2.954 2.369 3.343 0.043 4 0 "[ . 1 . 2]" 1
204 1 17 GLY H 1 18 GLU H 0.000 . 5.000 4.313 3.837 4.578 . 0 0 "[ . 1 . 2]" 1
205 1 17 GLY H 1 19 PHE QE 0.000 . 7.000 4.300 2.215 6.089 . 0 0 "[ . 1 . 2]" 1
206 1 18 GLU HA 1 19 PHE HA 0.000 . 5.000 4.421 4.366 4.488 . 0 0 "[ . 1 . 2]" 1
207 1 18 GLU HA 1 19 PHE QB 0.000 . 6.000 4.226 3.973 4.350 . 0 0 "[ . 1 . 2]" 1
208 1 18 GLU HA 1 19 PHE QD 0.000 . 7.000 3.963 3.039 4.637 . 0 0 "[ . 1 . 2]" 1
209 1 18 GLU HA 1 19 PHE QE 0.000 . 7.000 5.227 4.041 5.985 . 0 0 "[ . 1 . 2]" 1
210 1 18 GLU HA 1 19 PHE H 0.000 . 3.300 2.181 2.123 2.252 . 0 0 "[ . 1 . 2]" 1
211 1 18 GLU H 1 18 GLU QB 0.000 . 3.900 2.578 2.238 3.005 . 0 0 "[ . 1 . 2]" 1
212 1 18 GLU QB 1 19 PHE HA 0.000 . 6.000 4.398 3.995 4.744 . 0 0 "[ . 1 . 2]" 1
213 1 18 GLU QB 1 19 PHE QB 0.000 . 7.000 4.954 4.707 5.363 . 0 0 "[ . 1 . 2]" 1
214 1 18 GLU QB 1 19 PHE H 0.000 . 4.300 3.301 2.776 3.848 . 0 0 "[ . 1 . 2]" 1
215 1 18 GLU QG 1 19 PHE QD 0.000 . 8.000 5.462 4.046 6.353 . 0 0 "[ . 1 . 2]" 1
216 1 18 GLU QG 1 19 PHE H 0.000 . 6.000 3.708 2.071 4.579 . 0 0 "[ . 1 . 2]" 1
217 1 18 GLU H 1 19 PHE H 0.000 . 5.000 4.437 3.947 4.619 . 0 0 "[ . 1 . 2]" 1
218 1 19 PHE HA 1 20 PRO HA 0.000 . 3.300 2.325 2.188 2.621 . 0 0 "[ . 1 . 2]" 1
219 1 19 PHE HA 1 20 PRO QB 0.000 . 6.000 3.990 3.928 4.115 . 0 0 "[ . 1 . 2]" 1
220 1 19 PHE HA 1 20 PRO QD 0.000 . 6.000 3.996 3.987 4.013 . 0 0 "[ . 1 . 2]" 1
221 1 19 PHE HA 1 21 LYS QB 0.000 . 6.000 3.175 2.686 3.893 . 0 0 "[ . 1 . 2]" 1
222 1 19 PHE HA 1 21 LYS H 0.000 . 5.000 3.291 2.737 3.812 . 0 0 "[ . 1 . 2]" 1
223 1 19 PHE HA 1 65 THR HA 0.000 . 5.000 4.291 4.057 4.908 . 0 0 "[ . 1 . 2]" 1
224 1 19 PHE QB 1 20 PRO HA 0.000 . 4.300 2.168 2.069 2.418 . 0 0 "[ . 1 . 2]" 1
225 1 19 PHE QB 1 21 LYS H 0.000 . 6.000 4.116 3.737 4.503 . 0 0 "[ . 1 . 2]" 1
226 1 19 PHE QB 1 65 THR HA 0.000 . 6.000 2.767 2.178 3.430 . 0 0 "[ . 1 . 2]" 1
227 1 19 PHE H 1 19 PHE QD 0.000 . 5.300 2.938 2.055 4.011 . 0 0 "[ . 1 . 2]" 1
228 1 19 PHE QD 1 20 PRO HA 0.000 . 7.000 2.419 2.122 3.025 . 0 0 "[ . 1 . 2]" 1
229 1 19 PHE QD 1 20 PRO QB 0.000 . 8.000 4.019 3.482 4.597 . 0 0 "[ . 1 . 2]" 1
230 1 19 PHE QD 1 21 LYS HA 0.000 . 7.000 4.789 3.985 5.459 . 0 0 "[ . 1 . 2]" 1
231 1 19 PHE QD 1 21 LYS H 0.000 . 7.000 2.733 1.912 3.590 . 0 0 "[ . 1 . 2]" 1
232 1 19 PHE QD 1 64 VAL MG1 0.000 . 8.500 5.287 3.938 5.802 . 0 0 "[ . 1 . 2]" 1
233 1 19 PHE QD 1 64 VAL MG2 0.000 . 6.800 3.324 2.751 4.347 . 0 0 "[ . 1 . 2]" 1
234 1 19 PHE QD 1 65 THR HA 0.000 . 7.000 2.911 2.185 3.565 . 0 0 "[ . 1 . 2]" 1
235 1 19 PHE QD 1 66 GLN HA 0.000 . 7.000 4.110 3.561 4.875 . 0 0 "[ . 1 . 2]" 1
236 1 19 PHE QD 1 67 PRO QD 0.000 . 8.000 3.796 3.287 4.347 . 0 0 "[ . 1 . 2]" 1
237 1 19 PHE QD 1 67 PRO QG 0.000 . 8.000 4.787 4.189 5.368 . 0 0 "[ . 1 . 2]" 1
238 1 19 PHE QE 1 20 PRO HA 0.000 . 7.000 4.694 4.272 5.317 . 0 0 "[ . 1 . 2]" 1
239 1 19 PHE QE 1 64 VAL MG1 0.000 . 8.500 4.850 3.419 5.388 . 0 0 "[ . 1 . 2]" 1
240 1 19 PHE QE 1 64 VAL MG2 0.000 . 6.800 2.795 2.128 3.920 . 0 0 "[ . 1 . 2]" 1
241 1 19 PHE QE 1 66 GLN HA 0.000 . 7.000 3.825 3.078 4.540 . 0 0 "[ . 1 . 2]" 1
242 1 19 PHE QE 1 67 PRO HA 0.000 . 7.000 3.744 3.156 4.498 . 0 0 "[ . 1 . 2]" 1
243 1 19 PHE QE 1 67 PRO QD 0.000 . 8.000 2.737 2.164 3.183 . 0 0 "[ . 1 . 2]" 1
244 1 19 PHE H 1 20 PRO HA 0.000 . 5.000 4.771 4.685 4.888 . 0 0 "[ . 1 . 2]" 1
245 1 19 PHE HZ 1 66 GLN HA 0.000 . 5.000 4.442 3.923 4.980 . 0 0 "[ . 1 . 2]" 1
246 1 19 PHE HZ 1 67 PRO HA 0.000 . 5.000 4.017 3.242 5.003 0.003 13 0 "[ . 1 . 2]" 1
247 1 19 PHE HZ 1 67 PRO QB 0.000 . 6.000 3.083 2.435 3.759 . 0 0 "[ . 1 . 2]" 1
248 1 19 PHE HZ 1 67 PRO QD 0.000 . 6.000 2.552 2.182 2.945 . 0 0 "[ . 1 . 2]" 1
249 1 19 PHE HZ 1 67 PRO QG 0.000 . 6.000 2.316 2.149 2.947 . 0 0 "[ . 1 . 2]" 1
250 1 20 PRO HA 1 21 LYS HA 0.000 . 5.000 4.490 4.419 4.558 . 0 0 "[ . 1 . 2]" 1
251 1 20 PRO HA 1 21 LYS H 0.000 . 3.300 2.380 2.217 2.597 . 0 0 "[ . 1 . 2]" 1
252 1 20 PRO HA 1 63 LYS QB 0.000 . 6.000 4.964 4.579 5.290 . 0 0 "[ . 1 . 2]" 1
253 1 20 PRO HA 1 65 THR HA 0.000 . 3.300 2.302 2.153 2.784 . 0 0 "[ . 1 . 2]" 1
254 1 20 PRO HA 1 65 THR HB 0.000 . 5.000 4.582 3.779 5.025 0.025 3 0 "[ . 1 . 2]" 1
255 1 20 PRO HA 1 65 THR MG 0.000 . 6.500 3.570 3.067 4.853 . 0 0 "[ . 1 . 2]" 1
256 1 20 PRO QB 1 21 LYS H 0.000 . 4.300 2.686 2.203 3.096 . 0 0 "[ . 1 . 2]" 1
257 1 20 PRO QB 1 65 THR HA 0.000 . 4.300 2.582 2.179 3.303 . 0 0 "[ . 1 . 2]" 1
258 1 20 PRO QB 1 65 THR HB 0.000 . 6.000 4.220 2.886 4.652 . 0 0 "[ . 1 . 2]" 1
259 1 20 PRO QD 1 21 LYS H 0.000 . 6.000 4.966 4.810 5.033 . 0 0 "[ . 1 . 2]" 1
260 1 21 LYS HA 1 22 ASN H 0.000 . 3.300 2.173 2.134 2.252 . 0 0 "[ . 1 . 2]" 1
261 1 21 LYS QB 1 22 ASN H 0.000 . 4.300 3.611 3.097 3.912 . 0 0 "[ . 1 . 2]" 1
262 1 21 LYS QB 1 64 VAL MG1 0.000 . 7.500 4.273 2.120 5.353 . 0 0 "[ . 1 . 2]" 1
263 1 21 LYS QB 1 64 VAL MG2 0.000 . 7.500 3.058 2.032 4.355 . 0 0 "[ . 1 . 2]" 1
264 1 21 LYS H 1 63 LYS QB 0.000 . 6.000 3.645 3.309 3.989 . 0 0 "[ . 1 . 2]" 1
265 1 21 LYS H 1 65 THR HA 0.000 . 5.000 3.519 3.180 3.688 . 0 0 "[ . 1 . 2]" 1
266 1 21 LYS H 1 65 THR MG 0.000 . 6.500 4.594 4.185 5.364 . 0 0 "[ . 1 . 2]" 1
267 1 22 ASN HA 1 23 LEU HA 0.000 . 5.000 4.452 4.416 4.488 . 0 0 "[ . 1 . 2]" 1
268 1 22 ASN HA 1 23 LEU QB 0.000 . 6.000 4.254 4.113 4.448 . 0 0 "[ . 1 . 2]" 1
269 1 22 ASN HA 1 23 LEU H 0.000 . 2.700 2.263 2.167 2.365 . 0 0 "[ . 1 . 2]" 1
270 1 22 ASN HA 1 24 VAL H 0.000 . 5.000 4.652 4.451 4.893 . 0 0 "[ . 1 . 2]" 1
271 1 22 ASN HA 1 61 TRP HE3 0.000 . 5.000 4.191 3.841 4.462 . 0 0 "[ . 1 . 2]" 1
272 1 22 ASN HA 1 61 TRP HZ3 0.000 . 5.000 4.374 3.911 4.803 . 0 0 "[ . 1 . 2]" 1
273 1 22 ASN HA 1 63 LYS HA 0.000 . 3.300 2.168 2.100 2.253 . 0 0 "[ . 1 . 2]" 1
274 1 22 ASN HA 1 63 LYS QB 0.000 . 6.000 2.206 2.029 2.688 . 0 0 "[ . 1 . 2]" 1
275 1 22 ASN HA 1 64 VAL H 0.000 . 5.000 3.562 3.487 3.641 . 0 0 "[ . 1 . 2]" 1
276 1 22 ASN H 1 22 ASN QB 0.000 . 3.900 2.498 2.202 2.765 . 0 0 "[ . 1 . 2]" 1
277 1 22 ASN QB 1 23 LEU HA 0.000 . 6.000 4.145 3.959 4.323 . 0 0 "[ . 1 . 2]" 1
278 1 22 ASN QB 1 23 LEU H 0.000 . 6.000 2.820 2.530 3.186 . 0 0 "[ . 1 . 2]" 1
279 1 22 ASN QB 1 24 VAL HA 0.000 . 6.000 5.058 4.879 5.283 . 0 0 "[ . 1 . 2]" 1
280 1 22 ASN QB 1 63 LYS HA 0.000 . 6.000 4.119 4.007 4.292 . 0 0 "[ . 1 . 2]" 1
281 1 22 ASN QB 1 64 VAL H 0.000 . 6.000 5.455 5.399 5.509 . 0 0 "[ . 1 . 2]" 1
282 1 22 ASN HB3 1 61 TRP HE3 0.000 . 5.000 3.168 2.717 3.476 . 0 0 "[ . 1 . 2]" 1
283 1 22 ASN H 1 23 LEU H 0.000 . 5.000 4.646 4.577 4.686 . 0 0 "[ . 1 . 2]" 1
284 1 23 LEU HA 1 24 VAL HA 0.000 . 5.000 4.621 4.580 4.658 . 0 0 "[ . 1 . 2]" 1
285 1 23 LEU HA 1 24 VAL HB 0.000 . 5.000 4.526 4.348 5.019 0.019 19 0 "[ . 1 . 2]" 1
286 1 23 LEU HA 1 24 VAL QG 0.000 . 7.400 4.542 3.751 4.713 . 0 0 "[ . 1 . 2]" 1
287 1 23 LEU HA 1 24 VAL H 0.000 . 5.000 3.573 3.564 3.584 . 0 0 "[ . 1 . 2]" 1
288 1 23 LEU H 1 23 LEU QB 0.000 . 3.900 2.497 2.332 2.604 . 0 0 "[ . 1 . 2]" 1
289 1 23 LEU QB 1 24 VAL HA 0.000 . 6.000 4.249 4.209 4.322 . 0 0 "[ . 1 . 2]" 1
290 1 23 LEU QB 1 24 VAL HB 0.000 . 6.000 3.328 3.176 3.483 . 0 0 "[ . 1 . 2]" 1
291 1 23 LEU QB 1 24 VAL MG1 0.000 . 7.500 3.068 2.697 4.491 . 0 0 "[ . 1 . 2]" 1
292 1 23 LEU QB 1 24 VAL MG2 0.000 . 7.500 4.499 3.147 4.622 . 0 0 "[ . 1 . 2]" 1
293 1 23 LEU QB 1 24 VAL H 0.000 . 3.700 2.076 1.897 2.255 . 0 0 "[ . 1 . 2]" 1
294 1 23 LEU QB 1 62 LEU QD 0.000 . 8.400 3.028 2.784 3.496 . 0 0 "[ . 1 . 2]" 1
295 1 23 LEU QB 1 62 LEU MD1 0.000 . 7.500 3.626 3.399 4.174 . 0 0 "[ . 1 . 2]" 1
296 1 23 LEU QB 1 63 LYS HA 0.000 . 6.000 3.417 3.096 3.682 . 0 0 "[ . 1 . 2]" 1
297 1 23 LEU QD 1 62 LEU QD 0.000 . 8.100 2.981 2.012 3.783 . 0 0 "[ . 1 . 2]" 1
298 1 23 LEU QD 1 63 LYS HA 0.000 . 7.400 3.262 2.163 4.025 . 0 0 "[ . 1 . 2]" 1
299 1 23 LEU QD 1 64 VAL HA 0.000 . 7.400 4.290 3.300 4.930 . 0 0 "[ . 1 . 2]" 1
300 1 23 LEU QD 1 64 VAL HB 0.000 . 7.400 3.468 2.113 3.937 . 0 0 "[ . 1 . 2]" 1
301 1 23 LEU H 1 24 VAL HA 0.000 . 5.000 4.510 4.360 4.730 . 0 0 "[ . 1 . 2]" 1
302 1 23 LEU H 1 24 VAL H 0.000 . 3.300 2.458 2.251 2.632 . 0 0 "[ . 1 . 2]" 1
303 1 23 LEU H 1 61 TRP HZ3 0.000 . 5.000 2.916 2.235 3.479 . 0 0 "[ . 1 . 2]" 1
304 1 23 LEU H 1 62 LEU H 0.000 . 5.000 4.459 4.238 4.631 . 0 0 "[ . 1 . 2]" 1
305 1 23 LEU H 1 63 LYS HA 0.000 . 5.000 2.568 2.198 2.924 . 0 0 "[ . 1 . 2]" 1
306 1 23 LEU H 1 63 LYS QB 0.000 . 6.000 3.928 3.521 4.356 . 0 0 "[ . 1 . 2]" 1
307 1 24 VAL HA 1 25 GLN HA 0.000 . 5.000 4.342 4.321 4.389 . 0 0 "[ . 1 . 2]" 1
308 1 24 VAL HA 1 25 GLN QG 0.000 . 6.000 4.657 3.731 5.400 . 0 0 "[ . 1 . 2]" 1
309 1 24 VAL HA 1 25 GLN H 0.000 . 2.700 2.341 2.255 2.369 . 0 0 "[ . 1 . 2]" 1
310 1 24 VAL HA 1 61 TRP HE3 0.000 . 5.000 4.328 3.875 4.563 . 0 0 "[ . 1 . 2]" 1
311 1 24 VAL HA 1 61 TRP HH2 0.000 . 5.000 3.130 2.752 3.532 . 0 0 "[ . 1 . 2]" 1
312 1 24 VAL HA 1 62 LEU H 0.000 . 5.000 4.653 4.493 4.761 . 0 0 "[ . 1 . 2]" 1
313 1 24 VAL H 1 24 VAL HB 0.000 . 3.300 3.221 2.750 3.319 0.019 12 0 "[ . 1 . 2]" 1
314 1 24 VAL HB 1 25 GLN H 0.000 . 5.000 3.988 3.897 4.059 . 0 0 "[ . 1 . 2]" 1
315 1 24 VAL QG 1 26 ILE HA 0.000 . 7.400 3.718 3.587 3.915 . 0 0 "[ . 1 . 2]" 1
316 1 24 VAL QG 1 61 TRP HZ3 0.000 . 7.400 3.880 3.638 4.212 . 0 0 "[ . 1 . 2]" 1
317 1 24 VAL H 1 24 VAL MG1 0.000 . 4.800 2.523 2.205 3.767 . 0 0 "[ . 1 . 2]" 1
318 1 24 VAL MG1 1 25 GLN HA 0.000 . 6.500 3.908 3.644 4.092 . 0 0 "[ . 1 . 2]" 1
319 1 24 VAL MG1 1 25 GLN QG 0.000 . 7.500 4.998 3.872 5.405 . 0 0 "[ . 1 . 2]" 1
320 1 24 VAL MG1 1 25 GLN H 0.000 . 6.500 3.132 1.739 3.439 . 0 0 "[ . 1 . 2]" 1
321 1 24 VAL MG1 1 62 LEU QB 0.000 . 7.500 2.523 2.045 3.606 . 0 0 "[ . 1 . 2]" 1
322 1 24 VAL MG2 1 25 GLN QG 0.000 . 7.500 4.517 3.770 4.974 . 0 0 "[ . 1 . 2]" 1
323 1 24 VAL MG2 1 25 GLN H 0.000 . 4.800 1.983 1.736 3.387 . 0 0 "[ . 1 . 2]" 1
324 1 24 VAL H 1 25 GLN H 0.000 . 5.000 4.408 4.390 4.435 . 0 0 "[ . 1 . 2]" 1
325 1 24 VAL H 1 61 TRP HE3 0.000 . 5.000 3.706 3.446 3.931 . 0 0 "[ . 1 . 2]" 1
326 1 24 VAL H 1 61 TRP HZ3 0.000 . 5.000 2.844 2.408 3.360 . 0 0 "[ . 1 . 2]" 1
327 1 24 VAL H 1 62 LEU QB 0.000 . 6.000 2.542 2.365 2.817 . 0 0 "[ . 1 . 2]" 1
328 1 24 VAL H 1 62 LEU QD 0.000 . 7.400 3.640 3.451 3.929 . 0 0 "[ . 1 . 2]" 1
329 1 24 VAL H 1 62 LEU H 0.000 . 5.000 3.503 3.288 3.844 . 0 0 "[ . 1 . 2]" 1
330 1 24 VAL H 1 63 LYS HA 0.000 . 5.000 4.320 4.133 4.465 . 0 0 "[ . 1 . 2]" 1
331 1 25 GLN HA 1 26 ILE HA 0.000 . 5.000 4.372 4.343 4.425 . 0 0 "[ . 1 . 2]" 1
332 1 25 GLN HA 1 26 ILE MG 0.000 . 6.500 5.406 5.335 5.469 . 0 0 "[ . 1 . 2]" 1
333 1 25 GLN HA 1 26 ILE H 0.000 . 2.700 2.286 2.187 2.397 . 0 0 "[ . 1 . 2]" 1
334 1 25 GLN HA 1 61 TRP HA 0.000 . 3.300 2.171 2.130 2.213 . 0 0 "[ . 1 . 2]" 1
335 1 25 GLN HA 1 61 TRP HE3 0.000 . 5.000 3.634 3.014 3.986 . 0 0 "[ . 1 . 2]" 1
336 1 25 GLN HA 1 61 TRP HZ3 0.000 . 5.000 4.510 3.769 4.985 . 0 0 "[ . 1 . 2]" 1
337 1 25 GLN HA 1 62 LEU H 0.000 . 3.300 2.435 1.983 2.720 . 0 0 "[ . 1 . 2]" 1
338 1 25 GLN H 1 25 GLN QB 0.000 . 3.900 2.198 2.107 2.341 . 0 0 "[ . 1 . 2]" 1
339 1 25 GLN QB 1 26 ILE HA 0.000 . 6.000 4.335 4.214 4.455 . 0 0 "[ . 1 . 2]" 1
340 1 25 GLN QB 1 26 ILE H 0.000 . 6.000 2.961 2.526 3.308 . 0 0 "[ . 1 . 2]" 1
341 1 25 GLN QB 1 61 TRP HA 0.000 . 6.000 3.932 3.640 4.146 . 0 0 "[ . 1 . 2]" 1
342 1 25 GLN QE 1 59 THR HA 0.000 . 7.000 3.506 2.994 4.148 . 0 0 "[ . 1 . 2]" 1
343 1 25 GLN QE 1 59 THR HB 0.000 . 7.000 3.159 2.585 4.467 . 0 0 "[ . 1 . 2]" 1
344 1 25 GLN QG 1 26 ILE H 0.000 . 6.000 2.987 2.119 3.838 . 0 0 "[ . 1 . 2]" 1
345 1 25 GLN QG 1 61 TRP HD1 0.000 . 6.000 3.805 3.318 4.088 . 0 0 "[ . 1 . 2]" 1
346 1 25 GLN QG 1 61 TRP HE1 0.000 . 6.000 3.594 3.063 3.970 . 0 0 "[ . 1 . 2]" 1
347 1 25 GLN QG 1 61 TRP HZ2 0.000 . 6.000 3.876 3.145 4.652 . 0 0 "[ . 1 . 2]" 1
348 1 25 GLN QG 1 62 LEU H 0.000 . 6.000 3.849 3.466 4.336 . 0 0 "[ . 1 . 2]" 1
349 1 25 GLN H 1 61 TRP HE3 0.000 . 5.000 4.764 4.544 5.010 0.010 19 0 "[ . 1 . 2]" 1
350 1 25 GLN H 1 61 TRP HZ3 0.000 . 5.000 3.954 3.359 4.463 . 0 0 "[ . 1 . 2]" 1
351 1 26 ILE HA 1 27 LYS HA 0.000 . 5.000 4.496 4.467 4.520 . 0 0 "[ . 1 . 2]" 1
352 1 26 ILE HA 1 27 LYS QG 0.000 . 6.000 3.356 2.872 4.537 . 0 0 "[ . 1 . 2]" 1
353 1 26 ILE HA 1 27 LYS H 0.000 . 2.700 2.355 2.267 2.488 . 0 0 "[ . 1 . 2]" 1
354 1 26 ILE HB 1 27 LYS H 0.000 . 5.000 3.937 3.769 4.169 . 0 0 "[ . 1 . 2]" 1
355 1 26 ILE HB 1 38 TYR QD 0.000 . 7.000 3.863 2.592 4.415 . 0 0 "[ . 1 . 2]" 1
356 1 26 ILE HB 1 96 ILE MD 0.000 . 6.500 5.010 4.463 5.377 . 0 0 "[ . 1 . 2]" 1
357 1 26 ILE MD 1 27 LYS H 0.000 . 6.500 3.303 2.434 4.805 . 0 0 "[ . 1 . 2]" 1
358 1 26 ILE MD 1 38 TYR QD 0.000 . 8.500 4.008 2.923 5.016 . 0 0 "[ . 1 . 2]" 1
359 1 26 ILE MD 1 38 TYR QE 0.000 . 8.500 4.310 3.634 5.577 . 0 0 "[ . 1 . 2]" 1
360 1 26 ILE MD 1 62 LEU QB 0.000 . 7.500 3.143 1.867 3.951 . 0 0 "[ . 1 . 2]" 1
361 1 26 ILE MD 1 80 SER HB3 0.000 . 6.500 4.148 3.069 5.296 . 0 0 "[ . 1 . 2]" 1
362 1 26 ILE MD 1 80 SER HB2 0.000 . 6.500 4.321 3.170 5.324 . 0 0 "[ . 1 . 2]" 1
363 1 26 ILE MG 1 27 LYS HA 0.000 . 6.500 3.117 3.026 3.339 . 0 0 "[ . 1 . 2]" 1
364 1 26 ILE MG 1 27 LYS H 0.000 . 6.500 1.777 1.576 2.032 . 0 0 "[ . 1 . 2]" 1
365 1 26 ILE MG 1 38 TYR QD 0.000 . 8.500 2.678 2.278 3.118 . 0 0 "[ . 1 . 2]" 1
366 1 26 ILE MG 1 38 TYR QE 0.000 . 6.800 2.348 2.077 2.617 . 0 0 "[ . 1 . 2]" 1
367 1 26 ILE MG 1 62 LEU HG 0.000 . 6.500 5.299 4.961 5.431 . 0 0 "[ . 1 . 2]" 1
368 1 26 ILE MG 1 80 SER HB3 0.000 . 6.500 4.616 4.013 5.009 . 0 0 "[ . 1 . 2]" 1
369 1 26 ILE MG 1 80 SER HB2 0.000 . 6.500 4.189 3.406 4.705 . 0 0 "[ . 1 . 2]" 1
370 1 26 ILE MG 1 96 ILE MD 0.000 . 8.000 3.076 2.741 3.539 . 0 0 "[ . 1 . 2]" 1
371 1 26 ILE H 1 61 TRP HA 0.000 . 5.000 3.492 3.251 3.732 . 0 0 "[ . 1 . 2]" 1
372 1 26 ILE H 1 62 LEU H 0.000 . 5.000 3.713 3.396 3.956 . 0 0 "[ . 1 . 2]" 1
373 1 27 LYS HA 1 28 SER HA 0.000 . 5.000 4.449 4.415 4.506 . 0 0 "[ . 1 . 2]" 1
374 1 27 LYS HA 1 28 SER H 0.000 . 2.700 2.169 2.121 2.250 . 0 0 "[ . 1 . 2]" 1
375 1 27 LYS HA 1 38 TYR QD 0.000 . 7.000 5.672 4.883 6.041 . 0 0 "[ . 1 . 2]" 1
376 1 27 LYS HA 1 38 TYR QE 0.000 . 5.300 3.835 2.788 4.276 . 0 0 "[ . 1 . 2]" 1
377 1 27 LYS H 1 27 LYS QB 0.000 . 3.900 2.734 2.553 2.895 . 0 0 "[ . 1 . 2]" 1
378 1 27 LYS QB 1 28 SER HA 0.000 . 6.000 4.309 4.177 4.382 . 0 0 "[ . 1 . 2]" 1
379 1 27 LYS HB3 1 28 SER H 0.000 . 5.000 3.405 3.200 3.710 . 0 0 "[ . 1 . 2]" 1
380 1 27 LYS HB2 1 28 SER H 0.000 . 5.000 4.189 3.922 4.347 . 0 0 "[ . 1 . 2]" 1
381 1 27 LYS H 1 27 LYS QD 0.000 . 6.000 4.136 2.142 4.715 . 0 0 "[ . 1 . 2]" 1
382 1 27 LYS HA 1 27 LYS QE 0.000 . 6.000 4.651 4.176 5.335 . 0 0 "[ . 1 . 2]" 1
383 1 27 LYS QG 1 28 SER H 0.000 . 6.000 4.261 3.820 4.766 . 0 0 "[ . 1 . 2]" 1
384 1 27 LYS QG 1 38 TYR QE 0.000 . 8.000 5.190 4.278 5.721 . 0 0 "[ . 1 . 2]" 1
385 1 27 LYS H 1 28 SER H 0.000 . 5.000 4.260 4.084 4.388 . 0 0 "[ . 1 . 2]" 1
386 1 28 SER HA 1 29 ASN HA 0.000 . 5.000 4.651 4.343 4.847 . 0 0 "[ . 1 . 2]" 1
387 1 28 SER HA 1 29 ASN QB 0.000 . 6.000 4.164 3.806 4.895 . 0 0 "[ . 1 . 2]" 1
388 1 28 SER HA 1 29 ASN H 0.000 . 3.300 3.124 2.536 3.370 0.070 15 0 "[ . 1 . 2]" 1
389 1 28 SER HA 1 30 ARG H 0.000 . 5.000 5.028 4.845 5.089 0.089 15 0 "[ . 1 . 2]" 1
390 1 28 SER HA 1 38 TYR QE 0.000 . 7.000 3.375 2.570 4.504 . 0 0 "[ . 1 . 2]" 1
391 1 28 SER H 1 28 SER QB 0.000 . 3.900 2.404 2.332 2.632 . 0 0 "[ . 1 . 2]" 1
392 1 28 SER QB 1 30 ARG H 0.000 . 6.000 3.578 3.315 4.075 . 0 0 "[ . 1 . 2]" 1
393 1 28 SER QB 1 36 VAL HB 0.000 . 6.000 4.824 4.302 5.220 . 0 0 "[ . 1 . 2]" 1
394 1 28 SER QB 1 36 VAL MG1 0.000 . 7.500 2.781 2.237 3.216 . 0 0 "[ . 1 . 2]" 1
395 1 28 SER QB 1 36 VAL MG2 0.000 . 7.500 3.307 2.622 3.691 . 0 0 "[ . 1 . 2]" 1
396 1 28 SER QB 1 38 TYR QD 0.000 . 8.000 3.944 3.696 4.207 . 0 0 "[ . 1 . 2]" 1
397 1 28 SER QB 1 38 TYR QE 0.000 . 6.300 2.146 1.982 2.350 . 0 0 "[ . 1 . 2]" 1
398 1 28 SER QB 1 82 ALA MB 0.000 . 7.500 3.183 2.127 3.627 . 0 0 "[ . 1 . 2]" 1
399 1 28 SER QB 1 90 VAL QG 0.000 . 8.400 4.869 3.992 5.201 . 0 0 "[ . 1 . 2]" 1
400 1 28 SER QB 1 90 VAL MG2 0.000 . 7.500 4.983 4.040 5.429 . 0 0 "[ . 1 . 2]" 1
401 1 28 SER HB3 1 29 ASN H 0.000 . 5.000 2.127 1.664 3.520 . 0 0 "[ . 1 . 2]" 1
402 1 28 SER H 1 31 ASP HB3 0.000 . 5.000 3.711 3.410 3.889 . 0 0 "[ . 1 . 2]" 1
403 1 28 SER H 1 31 ASP HB2 0.000 . 5.000 4.974 4.638 5.071 0.071 7 0 "[ . 1 . 2]" 1
404 1 28 SER H 1 36 VAL MG1 0.000 . 6.500 4.173 3.896 4.539 . 0 0 "[ . 1 . 2]" 1
405 1 28 SER H 1 38 TYR QE 0.000 . 5.300 3.499 3.229 3.631 . 0 0 "[ . 1 . 2]" 1
406 1 29 ASN HA 1 30 ARG H 0.000 . 5.000 3.563 3.552 3.585 . 0 0 "[ . 1 . 2]" 1
407 1 29 ASN H 1 29 ASN QB 0.000 . 3.900 2.837 2.160 3.411 . 0 0 "[ . 1 . 2]" 1
408 1 29 ASN QB 1 30 ARG HA 0.000 . 6.000 3.983 3.699 4.662 . 0 0 "[ . 1 . 2]" 1
409 1 29 ASN QB 1 30 ARG QB 0.000 . 7.000 4.457 4.017 5.098 . 0 0 "[ . 1 . 2]" 1
410 1 29 ASN QB 1 30 ARG QG 0.000 . 7.000 3.348 2.762 4.097 . 0 0 "[ . 1 . 2]" 1
411 1 29 ASN QB 1 30 ARG H 0.000 . 6.000 2.520 2.183 3.160 . 0 0 "[ . 1 . 2]" 1
412 1 29 ASN H 1 30 ARG H 0.000 . 3.300 2.210 1.981 2.658 . 0 0 "[ . 1 . 2]" 1
413 1 30 ARG HA 1 31 ASP HA 0.000 . 5.000 4.813 4.779 4.859 . 0 0 "[ . 1 . 2]" 1
414 1 30 ARG HA 1 31 ASP H 0.000 . 5.000 3.300 3.115 3.493 . 0 0 "[ . 1 . 2]" 1
415 1 30 ARG H 1 30 ARG QB 0.000 . 3.900 2.480 2.214 2.727 . 0 0 "[ . 1 . 2]" 1
416 1 30 ARG QB 1 31 ASP HA 0.000 . 6.000 4.017 3.871 4.157 . 0 0 "[ . 1 . 2]" 1
417 1 30 ARG QB 1 90 VAL MG1 0.000 . 7.500 3.674 3.053 4.093 . 0 0 "[ . 1 . 2]" 1
418 1 30 ARG QB 1 90 VAL MG2 0.000 . 7.500 2.600 1.934 3.137 . 0 0 "[ . 1 . 2]" 1
419 1 30 ARG HB3 1 31 ASP H 0.000 . 5.000 4.161 3.692 4.362 . 0 0 "[ . 1 . 2]" 1
420 1 30 ARG HB3 1 34 THR MG 0.000 . 6.500 4.325 3.040 5.111 . 0 0 "[ . 1 . 2]" 1
421 1 30 ARG HB3 1 36 VAL MG1 0.000 . 6.500 4.669 3.960 5.337 . 0 0 "[ . 1 . 2]" 1
422 1 30 ARG HB3 1 82 ALA MB 0.000 . 6.500 4.878 4.124 5.384 . 0 0 "[ . 1 . 2]" 1
423 1 30 ARG HB3 1 90 VAL HB 0.000 . 5.000 3.510 2.826 4.695 . 0 0 "[ . 1 . 2]" 1
424 1 30 ARG HB2 1 31 ASP H 0.000 . 5.000 3.377 2.835 3.789 . 0 0 "[ . 1 . 2]" 1
425 1 30 ARG HB2 1 33 GLU QG 0.000 . 6.000 4.183 3.658 5.065 . 0 0 "[ . 1 . 2]" 1
426 1 30 ARG HB2 1 34 THR MG 0.000 . 6.500 4.984 4.118 5.307 . 0 0 "[ . 1 . 2]" 1
427 1 30 ARG HB2 1 36 VAL MG1 0.000 . 6.500 3.695 2.756 4.441 . 0 0 "[ . 1 . 2]" 1
428 1 30 ARG HB2 1 36 VAL MG2 0.000 . 6.500 3.144 2.375 3.944 . 0 0 "[ . 1 . 2]" 1
429 1 30 ARG H 1 30 ARG QD 0.000 . 6.000 3.371 1.915 4.225 . 0 0 "[ . 1 . 2]" 1
430 1 30 ARG QD 1 90 VAL HB 0.000 . 6.000 3.406 1.992 5.097 . 0 0 "[ . 1 . 2]" 1
431 1 30 ARG QD 1 90 VAL MG1 0.000 . 7.500 4.287 2.615 5.578 . 0 0 "[ . 1 . 2]" 1
432 1 30 ARG QD 1 90 VAL MG2 0.000 . 7.500 3.803 2.551 5.166 . 0 0 "[ . 1 . 2]" 1
433 1 30 ARG QG 1 90 VAL HA 0.000 . 6.000 4.558 3.848 5.386 . 0 0 "[ . 1 . 2]" 1
434 1 30 ARG QG 1 90 VAL MG1 0.000 . 7.500 4.233 2.899 5.043 . 0 0 "[ . 1 . 2]" 1
435 1 30 ARG QG 1 90 VAL MG2 0.000 . 7.500 2.998 1.976 4.147 . 0 0 "[ . 1 . 2]" 1
436 1 30 ARG H 1 31 ASP H 0.000 . 3.300 2.758 2.668 3.005 . 0 0 "[ . 1 . 2]" 1
437 1 30 ARG H 1 36 VAL QG 0.000 . 7.400 3.969 3.632 4.677 . 0 0 "[ . 1 . 2]" 1
438 1 31 ASP HA 1 32 LYS HA 0.000 . 5.000 4.584 4.491 4.667 . 0 0 "[ . 1 . 2]" 1
439 1 31 ASP HA 1 32 LYS H 0.000 . 5.000 3.117 3.032 3.209 . 0 0 "[ . 1 . 2]" 1
440 1 31 ASP HA 1 36 VAL QG 0.000 . 5.100 2.387 2.075 2.660 . 0 0 "[ . 1 . 2]" 1
441 1 31 ASP H 1 31 ASP QB 0.000 . 3.900 2.245 2.145 2.385 . 0 0 "[ . 1 . 2]" 1
442 1 31 ASP QB 1 35 LYS HA 0.000 . 6.000 4.538 3.609 5.200 . 0 0 "[ . 1 . 2]" 1
443 1 31 ASP QB 1 36 VAL MG1 0.000 . 5.800 2.178 2.006 2.372 . 0 0 "[ . 1 . 2]" 1
444 1 31 ASP HB3 1 32 LYS H 0.000 . 5.000 4.328 4.240 4.415 . 0 0 "[ . 1 . 2]" 1
445 1 31 ASP HB3 1 36 VAL HB 0.000 . 5.000 4.484 4.131 4.759 . 0 0 "[ . 1 . 2]" 1
446 1 31 ASP HB2 1 32 LYS H 0.000 . 5.000 4.529 4.454 4.589 . 0 0 "[ . 1 . 2]" 1
447 1 31 ASP HB2 1 36 VAL HB 0.000 . 5.000 4.794 4.247 5.017 0.017 7 0 "[ . 1 . 2]" 1
448 1 31 ASP H 1 32 LYS H 0.000 . 3.300 2.914 2.844 2.981 . 0 0 "[ . 1 . 2]" 1
449 1 31 ASP H 1 33 GLU H 0.000 . 5.000 4.665 4.586 4.752 . 0 0 "[ . 1 . 2]" 1
450 1 31 ASP H 1 36 VAL MG1 0.000 . 6.500 3.097 2.703 3.628 . 0 0 "[ . 1 . 2]" 1
451 1 32 LYS HA 1 33 GLU HA 0.000 . 5.000 4.563 4.453 4.632 . 0 0 "[ . 1 . 2]" 1
452 1 32 LYS HA 1 33 GLU H 0.000 . 5.000 3.371 3.253 3.464 . 0 0 "[ . 1 . 2]" 1
453 1 32 LYS H 1 32 LYS QB 0.000 . 3.900 2.378 2.254 2.631 . 0 0 "[ . 1 . 2]" 1
454 1 32 LYS QB 1 33 GLU HA 0.000 . 6.000 4.139 3.992 4.326 . 0 0 "[ . 1 . 2]" 1
455 1 32 LYS HB3 1 33 GLU H 0.000 . 5.000 4.064 3.791 4.261 . 0 0 "[ . 1 . 2]" 1
456 1 32 LYS HB2 1 33 GLU H 0.000 . 5.000 3.326 2.987 3.646 . 0 0 "[ . 1 . 2]" 1
457 1 32 LYS HA 1 32 LYS QE 0.000 . 6.000 4.268 2.517 5.083 . 0 0 "[ . 1 . 2]" 1
458 1 32 LYS H 1 32 LYS QG 0.000 . 4.300 2.808 2.368 3.174 . 0 0 "[ . 1 . 2]" 1
459 1 32 LYS QG 1 33 GLU QG 0.000 . 7.000 4.962 4.469 5.379 . 0 0 "[ . 1 . 2]" 1
460 1 32 LYS QG 1 33 GLU H 0.000 . 6.000 4.313 3.962 4.477 . 0 0 "[ . 1 . 2]" 1
461 1 32 LYS H 1 33 GLU H 0.000 . 3.300 2.172 1.933 2.442 . 0 0 "[ . 1 . 2]" 1
462 1 33 GLU HA 1 34 THR HA 0.000 . 5.000 4.557 4.481 4.598 . 0 0 "[ . 1 . 2]" 1
463 1 33 GLU HA 1 34 THR H 0.000 . 5.000 3.532 3.451 3.571 . 0 0 "[ . 1 . 2]" 1
464 1 33 GLU HB3 1 34 THR HB 0.000 . 5.000 5.022 4.976 5.083 0.083 7 0 "[ . 1 . 2]" 1
465 1 33 GLU HB3 1 34 THR MG 0.000 . 6.500 5.181 4.962 5.334 . 0 0 "[ . 1 . 2]" 1
466 1 33 GLU HB3 1 34 THR H 0.000 . 5.000 4.062 3.972 4.249 . 0 0 "[ . 1 . 2]" 1
467 1 33 GLU HB2 1 34 THR HB 0.000 . 5.000 3.418 3.291 3.626 . 0 0 "[ . 1 . 2]" 1
468 1 33 GLU HB2 1 34 THR H 0.000 . 5.000 3.480 3.169 3.855 . 0 0 "[ . 1 . 2]" 1
469 1 33 GLU H 1 33 GLU QG 0.000 . 4.300 1.900 1.686 2.075 . 0 0 "[ . 1 . 2]" 1
470 1 33 GLU QG 1 34 THR H 0.000 . 6.000 1.865 1.646 2.468 . 0 0 "[ . 1 . 2]" 1
471 1 33 GLU H 1 34 THR H 0.000 . 2.700 2.097 1.736 2.398 . 0 0 "[ . 1 . 2]" 1
472 1 34 THR HA 1 35 LYS HA 0.000 . 5.000 4.347 4.328 4.380 . 0 0 "[ . 1 . 2]" 1
473 1 34 THR HA 1 35 LYS QB 0.000 . 6.000 4.221 4.116 4.324 . 0 0 "[ . 1 . 2]" 1
474 1 34 THR HA 1 35 LYS H 0.000 . 3.300 2.292 2.180 2.406 . 0 0 "[ . 1 . 2]" 1
475 1 34 THR HB 1 35 LYS H 0.000 . 5.000 4.175 4.034 4.380 . 0 0 "[ . 1 . 2]" 1
476 1 34 THR HB 1 84 SER HB3 0.000 . 5.000 5.070 5.024 5.097 0.097 17 0 "[ . 1 . 2]" 1
477 1 34 THR HB 1 84 SER HB2 0.000 . 5.000 4.403 4.165 4.649 . 0 0 "[ . 1 . 2]" 1
478 1 34 THR H 1 34 THR MG 0.000 . 4.800 2.664 2.527 2.770 . 0 0 "[ . 1 . 2]" 1
479 1 34 THR MG 1 35 LYS H 0.000 . 4.800 3.217 2.952 3.590 . 0 0 "[ . 1 . 2]" 1
480 1 34 THR MG 1 36 VAL MG1 0.000 . 8.000 4.332 4.050 4.701 . 0 0 "[ . 1 . 2]" 1
481 1 34 THR MG 1 36 VAL H 0.000 . 6.500 4.161 3.906 4.729 . 0 0 "[ . 1 . 2]" 1
482 1 34 THR MG 1 84 SER HA 0.000 . 6.500 2.769 2.616 2.901 . 0 0 "[ . 1 . 2]" 1
483 1 34 THR MG 1 84 SER HB3 0.000 . 6.500 2.561 2.469 2.684 . 0 0 "[ . 1 . 2]" 1
484 1 34 THR MG 1 84 SER HB2 0.000 . 6.500 2.039 1.932 2.241 . 0 0 "[ . 1 . 2]" 1
485 1 34 THR MG 1 90 VAL QG 0.000 . 8.900 3.047 2.658 3.395 . 0 0 "[ . 1 . 2]" 1
486 1 34 THR H 1 35 LYS HA 0.000 . 5.000 4.909 4.738 4.995 . 0 0 "[ . 1 . 2]" 1
487 1 34 THR H 1 35 LYS H 0.000 . 5.000 4.361 4.214 4.426 . 0 0 "[ . 1 . 2]" 1
488 1 34 THR H 1 36 VAL MG1 0.000 . 6.500 4.899 4.475 5.263 . 0 0 "[ . 1 . 2]" 1
489 1 35 LYS HA 1 36 VAL HA 0.000 . 5.000 4.427 4.408 4.469 . 0 0 "[ . 1 . 2]" 1
490 1 35 LYS HA 1 36 VAL HB 0.000 . 5.000 4.610 4.443 4.779 . 0 0 "[ . 1 . 2]" 1
491 1 35 LYS HA 1 36 VAL MG1 0.000 . 6.500 3.505 3.116 3.870 . 0 0 "[ . 1 . 2]" 1
492 1 35 LYS HA 1 36 VAL H 0.000 . 2.700 2.156 2.118 2.299 . 0 0 "[ . 1 . 2]" 1
493 1 35 LYS H 1 35 LYS QB 0.000 . 3.900 2.191 2.083 2.280 . 0 0 "[ . 1 . 2]" 1
494 1 35 LYS QB 1 36 VAL H 0.000 . 4.300 3.808 3.457 3.911 . 0 0 "[ . 1 . 2]" 1
495 1 35 LYS QB 1 37 PHE QE 0.000 . 8.000 3.611 3.132 4.151 . 0 0 "[ . 1 . 2]" 1
496 1 35 LYS H 1 35 LYS QD 0.000 . 6.000 4.425 4.019 4.797 . 0 0 "[ . 1 . 2]" 1
497 1 35 LYS QD 1 37 PHE QE 0.000 . 8.000 2.862 1.970 4.034 . 0 0 "[ . 1 . 2]" 1
498 1 35 LYS QD 1 37 PHE HZ 0.000 . 6.000 4.216 3.219 5.394 . 0 0 "[ . 1 . 2]" 1
499 1 35 LYS QE 1 37 PHE QD 0.000 . 8.000 5.085 4.000 5.972 . 0 0 "[ . 1 . 2]" 1
500 1 35 LYS QE 1 37 PHE QE 0.000 . 8.000 3.415 2.230 4.323 . 0 0 "[ . 1 . 2]" 1
501 1 35 LYS QE 1 37 PHE HZ 0.000 . 6.000 4.455 3.218 5.296 . 0 0 "[ . 1 . 2]" 1
502 1 35 LYS QG 1 36 VAL HA 0.000 . 6.000 4.379 3.899 4.886 . 0 0 "[ . 1 . 2]" 1
503 1 35 LYS QG 1 36 VAL H 0.000 . 4.300 2.984 2.345 3.299 . 0 0 "[ . 1 . 2]" 1
504 1 35 LYS QG 1 37 PHE QD 0.000 . 8.000 3.268 2.897 3.799 . 0 0 "[ . 1 . 2]" 1
505 1 35 LYS QG 1 37 PHE QE 0.000 . 8.000 2.485 2.158 3.037 . 0 0 "[ . 1 . 2]" 1
506 1 35 LYS QG 1 37 PHE HZ 0.000 . 6.000 4.637 4.240 5.183 . 0 0 "[ . 1 . 2]" 1
507 1 35 LYS QG 1 85 SER QB 0.000 . 7.000 3.119 2.405 4.329 . 0 0 "[ . 1 . 2]" 1
508 1 35 LYS H 1 36 VAL H 0.000 . 5.000 4.457 4.368 4.690 . 0 0 "[ . 1 . 2]" 1
509 1 36 VAL HA 1 37 PHE HA 0.000 . 5.000 4.395 4.376 4.415 . 0 0 "[ . 1 . 2]" 1
510 1 36 VAL HA 1 37 PHE QD 0.000 . 5.300 3.573 3.483 3.920 . 0 0 "[ . 1 . 2]" 1
511 1 36 VAL HA 1 37 PHE QE 0.000 . 7.000 5.195 4.888 5.370 . 0 0 "[ . 1 . 2]" 1
512 1 36 VAL HA 1 37 PHE H 0.000 . 2.700 2.136 2.085 2.200 . 0 0 "[ . 1 . 2]" 1
513 1 36 VAL HA 1 83 VAL H 0.000 . 5.000 4.398 4.108 4.645 . 0 0 "[ . 1 . 2]" 1
514 1 36 VAL HA 1 84 SER HA 0.000 . 3.300 2.244 2.148 2.387 . 0 0 "[ . 1 . 2]" 1
515 1 36 VAL HA 1 84 SER HB3 0.000 . 5.000 4.580 4.378 4.793 . 0 0 "[ . 1 . 2]" 1
516 1 36 VAL HA 1 84 SER HB2 0.000 . 5.000 4.469 4.322 4.746 . 0 0 "[ . 1 . 2]" 1
517 1 36 VAL HA 1 85 SER H 0.000 . 5.000 2.709 2.304 3.149 . 0 0 "[ . 1 . 2]" 1
518 1 36 VAL HA 1 90 VAL MG2 0.000 . 6.500 3.797 3.413 4.932 . 0 0 "[ . 1 . 2]" 1
519 1 36 VAL HB 1 37 PHE H 0.000 . 5.000 4.053 3.875 4.233 . 0 0 "[ . 1 . 2]" 1
520 1 36 VAL HB 1 38 TYR QE 0.000 . 7.000 5.870 5.023 6.540 . 0 0 "[ . 1 . 2]" 1
521 1 36 VAL HB 1 82 ALA MB 0.000 . 6.500 4.061 3.882 4.215 . 0 0 "[ . 1 . 2]" 1
522 1 36 VAL QG 1 37 PHE H 0.000 . 7.400 2.344 2.118 2.537 . 0 0 "[ . 1 . 2]" 1
523 1 36 VAL QG 1 38 TYR HA 0.000 . 7.400 3.807 3.662 3.930 . 0 0 "[ . 1 . 2]" 1
524 1 36 VAL QG 1 38 TYR QB 0.000 . 8.400 4.641 4.442 4.838 . 0 0 "[ . 1 . 2]" 1
525 1 36 VAL QG 1 83 VAL HA 0.000 . 7.400 3.774 3.327 4.056 . 0 0 "[ . 1 . 2]" 1
526 1 36 VAL MG1 1 37 PHE HA 0.000 . 6.500 4.145 3.833 4.385 . 0 0 "[ . 1 . 2]" 1
527 1 36 VAL MG1 1 37 PHE H 0.000 . 6.500 3.885 3.671 4.058 . 0 0 "[ . 1 . 2]" 1
528 1 36 VAL MG1 1 38 TYR QD 0.000 . 8.500 4.152 3.735 4.435 . 0 0 "[ . 1 . 2]" 1
529 1 36 VAL MG1 1 38 TYR QE 0.000 . 8.500 3.134 2.457 3.701 . 0 0 "[ . 1 . 2]" 1
530 1 36 VAL MG1 1 82 ALA MB 0.000 . 8.000 3.541 3.115 3.808 . 0 0 "[ . 1 . 2]" 1
531 1 36 VAL MG1 1 83 VAL H 0.000 . 6.500 4.907 4.390 5.340 . 0 0 "[ . 1 . 2]" 1
532 1 36 VAL MG1 1 84 SER HA 0.000 . 6.500 4.844 4.444 5.128 . 0 0 "[ . 1 . 2]" 1
533 1 36 VAL MG1 1 90 VAL MG1 0.000 . 8.000 5.456 4.645 5.573 . 0 0 "[ . 1 . 2]" 1
534 1 36 VAL MG1 1 90 VAL MG2 0.000 . 8.000 4.039 3.785 4.886 . 0 0 "[ . 1 . 2]" 1
535 1 36 VAL MG2 1 37 PHE HA 0.000 . 6.500 3.780 3.619 4.073 . 0 0 "[ . 1 . 2]" 1
536 1 36 VAL MG2 1 37 PHE H 0.000 . 4.800 2.364 2.130 2.565 . 0 0 "[ . 1 . 2]" 1
537 1 36 VAL MG2 1 38 TYR QD 0.000 . 6.800 4.071 3.264 4.689 . 0 0 "[ . 1 . 2]" 1
538 1 36 VAL MG2 1 38 TYR QE 0.000 . 6.800 3.831 2.779 4.605 . 0 0 "[ . 1 . 2]" 1
539 1 36 VAL MG2 1 82 ALA HA 0.000 . 6.500 3.161 2.772 3.461 . 0 0 "[ . 1 . 2]" 1
540 1 36 VAL MG2 1 82 ALA MB 0.000 . 6.300 1.913 1.781 2.046 . 0 0 "[ . 1 . 2]" 1
541 1 36 VAL MG2 1 83 VAL H 0.000 . 4.800 2.543 2.075 2.918 . 0 0 "[ . 1 . 2]" 1
542 1 36 VAL MG2 1 84 SER HA 0.000 . 6.500 3.322 3.092 3.558 . 0 0 "[ . 1 . 2]" 1
543 1 36 VAL MG2 1 84 SER HB3 0.000 . 6.500 4.663 4.490 4.841 . 0 0 "[ . 1 . 2]" 1
544 1 36 VAL MG2 1 84 SER HB2 0.000 . 6.500 5.283 5.209 5.361 . 0 0 "[ . 1 . 2]" 1
545 1 36 VAL MG2 1 90 VAL MG1 0.000 . 8.000 3.816 2.431 4.286 . 0 0 "[ . 1 . 2]" 1
546 1 36 VAL MG2 1 90 VAL MG2 0.000 . 6.300 2.219 1.969 2.827 . 0 0 "[ . 1 . 2]" 1
547 1 36 VAL H 1 36 VAL MG1 0.000 . 4.800 1.800 1.646 2.159 . 0 0 "[ . 1 . 2]" 1
548 1 36 VAL H 1 37 PHE H 0.000 . 5.000 4.491 4.365 4.549 . 0 0 "[ . 1 . 2]" 1
549 1 37 PHE HA 1 38 TYR HA 0.000 . 5.000 4.420 4.371 4.481 . 0 0 "[ . 1 . 2]" 1
550 1 37 PHE HA 1 38 TYR QB 0.000 . 6.000 4.271 4.173 4.420 . 0 0 "[ . 1 . 2]" 1
551 1 37 PHE HA 1 38 TYR QD 0.000 . 7.000 3.579 2.775 4.431 . 0 0 "[ . 1 . 2]" 1
552 1 37 PHE HA 1 38 TYR H 0.000 . 2.700 2.378 2.226 2.447 . 0 0 "[ . 1 . 2]" 1
553 1 37 PHE HA 1 58 GLU HA 0.000 . 5.000 3.509 3.279 3.694 . 0 0 "[ . 1 . 2]" 1
554 1 37 PHE QB 1 38 TYR HA 0.000 . 6.000 4.212 4.121 4.292 . 0 0 "[ . 1 . 2]" 1
555 1 37 PHE QB 1 58 GLU HA 0.000 . 6.000 4.031 3.655 4.640 . 0 0 "[ . 1 . 2]" 1
556 1 37 PHE HB3 1 38 TYR H 0.000 . 5.000 2.684 2.576 2.974 . 0 0 "[ . 1 . 2]" 1
557 1 37 PHE HB3 1 83 VAL HB 0.000 . 5.000 4.852 4.095 5.037 0.037 10 0 "[ . 1 . 2]" 1
558 1 37 PHE HB2 1 38 TYR H 0.000 . 5.000 3.939 3.677 4.138 . 0 0 "[ . 1 . 2]" 1
559 1 37 PHE HB2 1 57 ARG QD 0.000 . 6.000 4.611 3.922 5.361 . 0 0 "[ . 1 . 2]" 1
560 1 37 PHE HB2 1 57 ARG QG 0.000 . 6.000 4.159 3.264 5.140 . 0 0 "[ . 1 . 2]" 1
561 1 37 PHE HB2 1 83 VAL HB 0.000 . 5.000 3.510 2.745 3.765 . 0 0 "[ . 1 . 2]" 1
562 1 37 PHE QD 1 38 TYR H 0.000 . 5.300 4.148 4.097 4.181 . 0 0 "[ . 1 . 2]" 1
563 1 37 PHE QD 1 57 ARG QB 0.000 . 6.300 3.852 2.662 4.658 . 0 0 "[ . 1 . 2]" 1
564 1 37 PHE QD 1 57 ARG QD 0.000 . 6.300 2.955 2.141 4.599 . 0 0 "[ . 1 . 2]" 1
565 1 37 PHE QD 1 57 ARG QG 0.000 . 8.000 2.790 2.146 4.257 . 0 0 "[ . 1 . 2]" 1
566 1 37 PHE QD 1 58 GLU HA 0.000 . 5.300 3.459 3.213 3.827 . 0 0 "[ . 1 . 2]" 1
567 1 37 PHE QD 1 58 GLU QG 0.000 . 8.000 3.765 3.278 4.603 . 0 0 "[ . 1 . 2]" 1
568 1 37 PHE QD 1 83 VAL MG1 0.000 . 8.500 5.823 5.107 6.000 . 0 0 "[ . 1 . 2]" 1
569 1 37 PHE QD 1 83 VAL MG2 0.000 . 8.500 4.013 3.643 4.586 . 0 0 "[ . 1 . 2]" 1
570 1 37 PHE QD 1 84 SER HA 0.000 . 7.000 4.927 4.663 5.474 . 0 0 "[ . 1 . 2]" 1
571 1 37 PHE QD 1 85 SER QB 0.000 . 8.000 3.088 2.586 4.070 . 0 0 "[ . 1 . 2]" 1
572 1 37 PHE QD 1 85 SER H 0.000 . 7.000 3.867 3.535 4.530 . 0 0 "[ . 1 . 2]" 1
573 1 37 PHE QE 1 57 ARG QB 0.000 . 8.000 5.164 4.014 5.882 . 0 0 "[ . 1 . 2]" 1
574 1 37 PHE QE 1 57 ARG QD 0.000 . 8.000 4.349 3.544 5.874 . 0 0 "[ . 1 . 2]" 1
575 1 37 PHE QE 1 57 ARG QG 0.000 . 8.000 4.060 3.606 5.857 . 0 0 "[ . 1 . 2]" 1
576 1 37 PHE QE 1 58 GLU HA 0.000 . 7.000 3.595 3.335 4.014 . 0 0 "[ . 1 . 2]" 1
577 1 37 PHE QE 1 58 GLU QB 0.000 . 8.000 4.232 3.738 4.915 . 0 0 "[ . 1 . 2]" 1
578 1 37 PHE QE 1 58 GLU QG 0.000 . 8.000 3.154 2.359 4.150 . 0 0 "[ . 1 . 2]" 1
579 1 37 PHE QE 1 85 SER HA 0.000 . 7.000 3.762 2.963 4.223 . 0 0 "[ . 1 . 2]" 1
580 1 37 PHE QE 1 85 SER QB 0.000 . 8.000 2.481 2.217 3.421 . 0 0 "[ . 1 . 2]" 1
581 1 37 PHE QE 1 85 SER H 0.000 . 7.000 4.476 4.249 4.856 . 0 0 "[ . 1 . 2]" 1
582 1 37 PHE H 1 38 TYR H 0.000 . 5.000 4.579 4.542 4.601 . 0 0 "[ . 1 . 2]" 1
583 1 37 PHE H 1 83 VAL QG 0.000 . 7.400 3.293 2.893 3.896 . 0 0 "[ . 1 . 2]" 1
584 1 37 PHE H 1 83 VAL H 0.000 . 5.000 2.914 2.686 3.244 . 0 0 "[ . 1 . 2]" 1
585 1 37 PHE H 1 84 SER HA 0.000 . 5.000 3.256 3.007 3.596 . 0 0 "[ . 1 . 2]" 1
586 1 37 PHE HZ 1 58 GLU QG 0.000 . 6.000 3.623 2.591 5.018 . 0 0 "[ . 1 . 2]" 1
587 1 38 TYR HA 1 39 SER HA 0.000 . 5.000 4.550 4.474 4.586 . 0 0 "[ . 1 . 2]" 1
588 1 38 TYR HA 1 39 SER H 0.000 . 2.700 2.345 2.226 2.453 . 0 0 "[ . 1 . 2]" 1
589 1 38 TYR HA 1 82 ALA HA 0.000 . 3.300 2.612 2.234 2.922 . 0 0 "[ . 1 . 2]" 1
590 1 38 TYR HA 1 82 ALA MB 0.000 . 6.500 3.588 3.004 4.097 . 0 0 "[ . 1 . 2]" 1
591 1 38 TYR HA 1 83 VAL H 0.000 . 5.000 3.735 3.427 3.992 . 0 0 "[ . 1 . 2]" 1
592 1 38 TYR QB 1 39 SER HA 0.000 . 6.000 3.802 3.718 3.880 . 0 0 "[ . 1 . 2]" 1
593 1 38 TYR QB 1 39 SER QB 0.000 . 7.000 4.462 4.293 4.788 . 0 0 "[ . 1 . 2]" 1
594 1 38 TYR QB 1 55 ILE HB 0.000 . 6.000 4.297 3.200 5.313 . 0 0 "[ . 1 . 2]" 1
595 1 38 TYR HB3 1 39 SER H 0.000 . 5.000 2.230 1.993 2.562 . 0 0 "[ . 1 . 2]" 1
596 1 38 TYR HB2 1 39 SER H 0.000 . 5.000 3.603 3.306 3.897 . 0 0 "[ . 1 . 2]" 1
597 1 38 TYR QD 1 39 SER QB 0.000 . 8.000 5.226 4.804 5.864 . 0 0 "[ . 1 . 2]" 1
598 1 38 TYR QD 1 39 SER H 0.000 . 7.000 3.045 2.671 3.480 . 0 0 "[ . 1 . 2]" 1
599 1 38 TYR QD 1 57 ARG HA 0.000 . 7.000 4.190 3.507 4.793 . 0 0 "[ . 1 . 2]" 1
600 1 38 TYR QD 1 60 GLY QA 0.000 . 8.000 2.514 1.975 3.148 . 0 0 "[ . 1 . 2]" 1
601 1 38 TYR QD 1 60 GLY H 0.000 . 7.000 3.715 2.896 4.388 . 0 0 "[ . 1 . 2]" 1
602 1 38 TYR QD 1 82 ALA HA 0.000 . 5.300 4.024 2.330 4.631 . 0 0 "[ . 1 . 2]" 1
603 1 38 TYR QD 1 82 ALA MB 0.000 . 6.800 3.717 2.505 4.342 . 0 0 "[ . 1 . 2]" 1
604 1 38 TYR H 1 38 TYR QE 0.000 . 7.000 4.939 4.602 5.315 . 0 0 "[ . 1 . 2]" 1
605 1 38 TYR QE 1 60 GLY QA 0.000 . 8.000 3.322 2.565 3.949 . 0 0 "[ . 1 . 2]" 1
606 1 38 TYR QE 1 60 GLY H 0.000 . 7.000 5.222 4.326 5.961 . 0 0 "[ . 1 . 2]" 1
607 1 38 TYR QE 1 82 ALA HA 0.000 . 7.000 5.023 3.870 5.582 . 0 0 "[ . 1 . 2]" 1
608 1 38 TYR QE 1 82 ALA MB 0.000 . 6.800 3.615 2.262 4.450 . 0 0 "[ . 1 . 2]" 1
609 1 38 TYR H 1 39 SER H 0.000 . 5.000 4.514 4.463 4.556 . 0 0 "[ . 1 . 2]" 1
610 1 38 TYR H 1 57 ARG HA 0.000 . 5.000 2.315 2.046 2.466 . 0 0 "[ . 1 . 2]" 1
611 1 38 TYR H 1 57 ARG QB 0.000 . 6.000 3.557 2.719 4.172 . 0 0 "[ . 1 . 2]" 1
612 1 38 TYR H 1 57 ARG H 0.000 . 5.000 4.963 4.750 5.097 0.097 20 0 "[ . 1 . 2]" 1
613 1 39 SER HA 1 40 ILE HA 0.000 . 5.000 4.482 4.444 4.513 . 0 0 "[ . 1 . 2]" 1
614 1 39 SER HA 1 40 ILE MG 0.000 . 4.800 3.361 2.946 3.759 . 0 0 "[ . 1 . 2]" 1
615 1 39 SER HA 1 40 ILE H 0.000 . 2.700 2.290 2.157 2.387 . 0 0 "[ . 1 . 2]" 1
616 1 39 SER HA 1 81 HIS H 0.000 . 5.000 4.569 4.273 4.789 . 0 0 "[ . 1 . 2]" 1
617 1 39 SER QB 1 40 ILE MG 0.000 . 7.500 4.490 4.129 5.009 . 0 0 "[ . 1 . 2]" 1
618 1 39 SER QB 1 40 ILE H 0.000 . 4.300 3.222 2.777 3.803 . 0 0 "[ . 1 . 2]" 1
619 1 39 SER H 1 40 ILE H 0.000 . 5.000 4.230 3.811 4.387 . 0 0 "[ . 1 . 2]" 1
620 1 39 SER H 1 81 HIS HD2 0.000 . 5.000 4.765 4.104 5.019 0.019 9 0 "[ . 1 . 2]" 1
621 1 39 SER H 1 81 HIS H 0.000 . 5.000 2.912 2.660 3.169 . 0 0 "[ . 1 . 2]" 1
622 1 39 SER H 1 82 ALA HA 0.000 . 5.000 3.977 3.769 4.282 . 0 0 "[ . 1 . 2]" 1
623 1 40 ILE HA 1 41 THR HA 0.000 . 5.000 4.476 4.460 4.495 . 0 0 "[ . 1 . 2]" 1
624 1 40 ILE HA 1 41 THR MG 0.000 . 6.500 3.564 3.157 4.094 . 0 0 "[ . 1 . 2]" 1
625 1 40 ILE HA 1 41 THR H 0.000 . 2.700 2.196 2.146 2.221 . 0 0 "[ . 1 . 2]" 1
626 1 40 ILE HA 1 80 SER HA 0.000 . 3.300 2.255 2.160 2.417 . 0 0 "[ . 1 . 2]" 1
627 1 40 ILE HA 1 80 SER HB3 0.000 . 5.000 3.774 2.900 4.347 . 0 0 "[ . 1 . 2]" 1
628 1 40 ILE HA 1 80 SER HB2 0.000 . 5.000 3.722 3.290 4.097 . 0 0 "[ . 1 . 2]" 1
629 1 40 ILE HA 1 81 HIS HD2 0.000 . 3.300 3.151 2.602 3.376 0.076 14 0 "[ . 1 . 2]" 1
630 1 40 ILE HA 1 81 HIS H 0.000 . 5.000 3.556 3.296 3.719 . 0 0 "[ . 1 . 2]" 1
631 1 40 ILE HB 1 41 THR H 0.000 . 5.000 3.808 3.557 3.992 . 0 0 "[ . 1 . 2]" 1
632 1 40 ILE HB 1 45 ALA MB 0.000 . 6.500 4.827 4.338 5.260 . 0 0 "[ . 1 . 2]" 1
633 1 40 ILE HB 1 78 LEU QB 0.000 . 6.000 4.886 4.489 5.277 . 0 0 "[ . 1 . 2]" 1
634 1 40 ILE HB 1 78 LEU MD1 0.000 . 6.500 5.103 4.680 5.480 . 0 0 "[ . 1 . 2]" 1
635 1 40 ILE HB 1 80 SER HA 0.000 . 5.000 4.112 3.508 4.555 . 0 0 "[ . 1 . 2]" 1
636 1 40 ILE MD 1 53 PHE HB3 0.000 . 6.500 3.021 2.407 3.907 . 0 0 "[ . 1 . 2]" 1
637 1 40 ILE MD 1 53 PHE HB2 0.000 . 6.500 2.808 2.229 3.534 . 0 0 "[ . 1 . 2]" 1
638 1 40 ILE MD 1 54 ILE HA 0.000 . 6.500 3.682 2.484 5.232 . 0 0 "[ . 1 . 2]" 1
639 1 40 ILE MG 1 80 SER HB2 0.000 . 6.500 5.404 5.238 5.481 . 0 0 "[ . 1 . 2]" 1
640 1 40 ILE H 1 81 HIS H 0.000 . 5.000 4.745 4.529 4.932 . 0 0 "[ . 1 . 2]" 1
641 1 41 THR HA 1 42 GLY QA 0.000 . 6.000 4.038 3.983 4.071 . 0 0 "[ . 1 . 2]" 1
642 1 41 THR HA 1 42 GLY H 0.000 . 2.700 2.310 2.204 2.374 . 0 0 "[ . 1 . 2]" 1
643 1 41 THR HA 1 45 ALA MB 0.000 . 4.800 2.387 2.006 2.962 . 0 0 "[ . 1 . 2]" 1
644 1 41 THR HA 1 46 ASP H 0.000 . 5.000 3.474 3.090 3.799 . 0 0 "[ . 1 . 2]" 1
645 1 41 THR HB 1 42 GLY QA 0.000 . 6.000 5.158 5.061 5.261 . 0 0 "[ . 1 . 2]" 1
646 1 41 THR HB 1 42 GLY H 0.000 . 5.000 3.967 3.683 4.274 . 0 0 "[ . 1 . 2]" 1
647 1 41 THR HB 1 45 ALA MB 0.000 . 6.500 4.421 3.930 5.131 . 0 0 "[ . 1 . 2]" 1
648 1 41 THR HB 1 81 HIS HD2 0.000 . 5.000 4.024 3.301 4.616 . 0 0 "[ . 1 . 2]" 1
649 1 41 THR H 1 41 THR MG 0.000 . 4.800 2.466 2.212 2.745 . 0 0 "[ . 1 . 2]" 1
650 1 41 THR MG 1 42 GLY H 0.000 . 6.500 3.518 3.005 3.962 . 0 0 "[ . 1 . 2]" 1
651 1 41 THR MG 1 79 TYR HB3 0.000 . 6.500 2.785 2.307 3.241 . 0 0 "[ . 1 . 2]" 1
652 1 41 THR MG 1 80 SER HA 0.000 . 6.500 3.568 3.044 4.024 . 0 0 "[ . 1 . 2]" 1
653 1 41 THR MG 1 81 HIS HD2 0.000 . 4.800 2.790 2.163 3.714 . 0 0 "[ . 1 . 2]" 1
654 1 41 THR H 1 79 TYR HB3 0.000 . 5.000 4.532 4.389 4.662 . 0 0 "[ . 1 . 2]" 1
655 1 41 THR H 1 79 TYR HB2 0.000 . 5.000 3.724 3.460 3.969 . 0 0 "[ . 1 . 2]" 1
656 1 41 THR H 1 79 TYR H 0.000 . 5.000 3.221 3.007 3.422 . 0 0 "[ . 1 . 2]" 1
657 1 41 THR H 1 80 SER HA 0.000 . 5.000 3.339 3.148 3.551 . 0 0 "[ . 1 . 2]" 1
658 1 41 THR H 1 81 HIS HD2 0.000 . 5.000 3.869 3.412 4.303 . 0 0 "[ . 1 . 2]" 1
659 1 42 GLY QA 1 43 GLN HA 0.000 . 6.000 3.996 3.986 4.006 . 0 0 "[ . 1 . 2]" 1
660 1 42 GLY QA 1 43 GLN H 0.000 . 4.300 2.278 2.259 2.307 . 0 0 "[ . 1 . 2]" 1
661 1 42 GLY QA 1 45 ALA MB 0.000 . 7.500 3.905 3.532 4.313 . 0 0 "[ . 1 . 2]" 1
662 1 42 GLY QA 1 45 ALA H 0.000 . 6.000 4.338 4.200 4.456 . 0 0 "[ . 1 . 2]" 1
663 1 42 GLY QA 1 78 LEU HA 0.000 . 6.000 3.334 2.972 3.735 . 0 0 "[ . 1 . 2]" 1
664 1 42 GLY QA 1 78 LEU QB 0.000 . 7.000 4.820 3.518 5.416 . 0 0 "[ . 1 . 2]" 1
665 1 42 GLY QA 1 78 LEU MD1 0.000 . 7.500 3.742 2.686 5.404 . 0 0 "[ . 1 . 2]" 1
666 1 42 GLY H 1 43 GLN H 0.000 . 5.000 4.493 4.436 4.545 . 0 0 "[ . 1 . 2]" 1
667 1 42 GLY H 1 45 ALA MB 0.000 . 4.800 2.681 2.249 3.195 . 0 0 "[ . 1 . 2]" 1
668 1 42 GLY H 1 45 ALA H 0.000 . 5.000 4.001 3.552 4.410 . 0 0 "[ . 1 . 2]" 1
669 1 42 GLY H 1 46 ASP H 0.000 . 5.000 2.515 2.056 2.848 . 0 0 "[ . 1 . 2]" 1
670 1 42 GLY H 1 47 LYS H 0.000 . 5.000 3.369 2.964 3.716 . 0 0 "[ . 1 . 2]" 1
671 1 43 GLN HA 1 44 GLY QA 0.000 . 6.000 3.948 3.901 3.983 . 0 0 "[ . 1 . 2]" 1
672 1 43 GLN HA 1 44 GLY H 0.000 . 3.300 2.150 2.119 2.188 . 0 0 "[ . 1 . 2]" 1
673 1 43 GLN HA 1 45 ALA H 0.000 . 5.000 3.466 3.221 3.701 . 0 0 "[ . 1 . 2]" 1
674 1 43 GLN HA 1 47 LYS HA 0.000 . 5.000 4.236 3.957 4.433 . 0 0 "[ . 1 . 2]" 1
675 1 43 GLN HA 1 47 LYS QB 0.000 . 6.000 2.079 1.942 2.283 . 0 0 "[ . 1 . 2]" 1
676 1 43 GLN HA 1 47 LYS QD 0.000 . 6.000 4.016 3.260 4.787 . 0 0 "[ . 1 . 2]" 1
677 1 43 GLN HA 1 47 LYS QG 0.000 . 6.000 4.034 2.129 4.402 . 0 0 "[ . 1 . 2]" 1
678 1 43 GLN HA 1 47 LYS H 0.000 . 5.000 3.176 2.782 3.431 . 0 0 "[ . 1 . 2]" 1
679 1 43 GLN HA 1 48 PRO QD 0.000 . 6.000 4.343 4.115 4.889 . 0 0 "[ . 1 . 2]" 1
680 1 43 GLN HA 1 49 PRO QD 0.000 . 6.000 3.798 3.470 4.125 . 0 0 "[ . 1 . 2]" 1
681 1 43 GLN H 1 43 GLN QB 0.000 . 3.300 2.554 2.094 2.925 . 0 0 "[ . 1 . 2]" 1
682 1 43 GLN QB 1 44 GLY QA 0.000 . 7.000 4.009 3.683 4.378 . 0 0 "[ . 1 . 2]" 1
683 1 43 GLN QB 1 44 GLY H 0.000 . 6.000 3.445 2.988 3.980 . 0 0 "[ . 1 . 2]" 1
684 1 43 GLN QB 1 45 ALA H 0.000 . 6.000 4.795 4.513 5.106 . 0 0 "[ . 1 . 2]" 1
685 1 43 GLN QB 1 47 LYS QB 0.000 . 7.000 2.993 2.568 3.470 . 0 0 "[ . 1 . 2]" 1
686 1 43 GLN QB 1 47 LYS QG 0.000 . 7.000 4.514 2.475 5.167 . 0 0 "[ . 1 . 2]" 1
687 1 43 GLN QG 1 47 LYS QB 0.000 . 7.000 3.773 2.871 4.398 . 0 0 "[ . 1 . 2]" 1
688 1 43 GLN H 1 44 GLY H 0.000 . 5.000 4.488 4.220 4.622 . 0 0 "[ . 1 . 2]" 1
689 1 43 GLN H 1 47 LYS H 0.000 . 5.000 4.450 4.222 4.650 . 0 0 "[ . 1 . 2]" 1
690 1 43 GLN H 1 78 LEU HA 0.000 . 5.000 4.300 3.473 4.871 . 0 0 "[ . 1 . 2]" 1
691 1 44 GLY QA 1 45 ALA HA 0.000 . 6.000 4.043 4.021 4.058 . 0 0 "[ . 1 . 2]" 1
692 1 44 GLY QA 1 45 ALA H 0.000 . 6.000 2.852 2.805 2.894 . 0 0 "[ . 1 . 2]" 1
693 1 44 GLY QA 1 52 VAL MG1 0.000 . 7.500 3.225 1.857 3.743 . 0 0 "[ . 1 . 2]" 1
694 1 44 GLY QA 1 52 VAL MG2 0.000 . 7.500 2.472 1.832 3.758 . 0 0 "[ . 1 . 2]" 1
695 1 44 GLY QA 1 53 PHE QD 0.000 . 8.000 2.468 2.096 4.305 . 0 0 "[ . 1 . 2]" 1
696 1 44 GLY H 1 45 ALA HA 0.000 . 5.000 4.775 4.337 5.014 0.014 16 0 "[ . 1 . 2]" 1
697 1 44 GLY H 1 45 ALA H 0.000 . 2.700 2.363 1.788 2.724 0.024 3 0 "[ . 1 . 2]" 1
698 1 44 GLY H 1 47 LYS QB 0.000 . 6.000 3.531 3.235 3.850 . 0 0 "[ . 1 . 2]" 1
699 1 44 GLY H 1 47 LYS H 0.000 . 5.000 3.368 2.872 3.862 . 0 0 "[ . 1 . 2]" 1
700 1 44 GLY H 1 49 PRO QD 0.000 . 6.000 3.354 2.883 3.788 . 0 0 "[ . 1 . 2]" 1
701 1 45 ALA HA 1 46 ASP HA 0.000 . 5.000 4.559 4.539 4.586 . 0 0 "[ . 1 . 2]" 1
702 1 45 ALA HA 1 46 ASP H 0.000 . 5.000 3.547 3.510 3.564 . 0 0 "[ . 1 . 2]" 1
703 1 45 ALA HA 1 50 VAL HA 0.000 . 5.000 4.337 3.845 4.621 . 0 0 "[ . 1 . 2]" 1
704 1 45 ALA HA 1 51 GLY QA 0.000 . 6.000 3.300 2.555 4.031 . 0 0 "[ . 1 . 2]" 1
705 1 45 ALA HA 1 51 GLY H 0.000 . 5.000 2.852 2.145 3.279 . 0 0 "[ . 1 . 2]" 1
706 1 45 ALA HA 1 52 VAL H 0.000 . 5.000 2.958 2.631 3.212 . 0 0 "[ . 1 . 2]" 1
707 1 45 ALA HA 1 53 PHE H 0.000 . 5.000 3.306 2.931 3.722 . 0 0 "[ . 1 . 2]" 1
708 1 45 ALA HA 1 78 LEU QD 0.000 . 7.400 4.635 4.306 4.910 . 0 0 "[ . 1 . 2]" 1
709 1 45 ALA MB 1 46 ASP HA 0.000 . 6.500 3.897 3.822 3.971 . 0 0 "[ . 1 . 2]" 1
710 1 45 ALA MB 1 46 ASP H 0.000 . 4.200 1.932 1.665 2.233 . 0 0 "[ . 1 . 2]" 1
711 1 45 ALA MB 1 47 LYS H 0.000 . 6.500 3.575 3.340 3.904 . 0 0 "[ . 1 . 2]" 1
712 1 45 ALA MB 1 52 VAL H 0.000 . 6.500 4.387 4.057 4.737 . 0 0 "[ . 1 . 2]" 1
713 1 45 ALA MB 1 53 PHE HB3 0.000 . 6.500 4.751 4.102 5.283 . 0 0 "[ . 1 . 2]" 1
714 1 45 ALA MB 1 53 PHE HB2 0.000 . 6.500 3.629 3.106 4.139 . 0 0 "[ . 1 . 2]" 1
715 1 45 ALA MB 1 53 PHE H 0.000 . 6.500 4.012 3.632 4.425 . 0 0 "[ . 1 . 2]" 1
716 1 45 ALA MB 1 78 LEU MD1 0.000 . 6.300 3.365 2.637 4.078 . 0 0 "[ . 1 . 2]" 1
717 1 45 ALA MB 1 78 LEU MD2 0.000 . 8.000 3.988 2.818 5.397 . 0 0 "[ . 1 . 2]" 1
718 1 45 ALA H 1 46 ASP H 0.000 . 3.300 2.531 2.178 2.880 . 0 0 "[ . 1 . 2]" 1
719 1 45 ALA H 1 47 LYS H 0.000 . 3.300 2.867 2.677 3.072 . 0 0 "[ . 1 . 2]" 1
720 1 45 ALA H 1 78 LEU MD1 0.000 . 6.500 3.950 3.277 5.309 . 0 0 "[ . 1 . 2]" 1
721 1 46 ASP HA 1 47 LYS HA 0.000 . 5.000 4.600 4.584 4.616 . 0 0 "[ . 1 . 2]" 1
722 1 46 ASP HA 1 47 LYS H 0.000 . 5.000 3.470 3.428 3.499 . 0 0 "[ . 1 . 2]" 1
723 1 46 ASP HA 1 50 VAL MG1 0.000 . 6.500 4.818 3.342 5.441 . 0 0 "[ . 1 . 2]" 1
724 1 46 ASP HA 1 50 VAL MG2 0.000 . 4.800 2.768 2.153 3.244 . 0 0 "[ . 1 . 2]" 1
725 1 46 ASP H 1 46 ASP QB 0.000 . 3.900 2.735 2.547 3.003 . 0 0 "[ . 1 . 2]" 1
726 1 46 ASP QB 1 47 LYS HA 0.000 . 6.000 4.460 4.198 4.630 . 0 0 "[ . 1 . 2]" 1
727 1 46 ASP HB3 1 47 LYS H 0.000 . 5.000 3.997 3.816 4.199 . 0 0 "[ . 1 . 2]" 1
728 1 46 ASP HB3 1 50 VAL MG2 0.000 . 6.500 4.927 4.453 5.269 . 0 0 "[ . 1 . 2]" 1
729 1 46 ASP HB2 1 47 LYS H 0.000 . 5.000 3.967 3.686 4.138 . 0 0 "[ . 1 . 2]" 1
730 1 46 ASP H 1 47 LYS HA 0.000 . 5.000 4.846 4.714 4.950 . 0 0 "[ . 1 . 2]" 1
731 1 46 ASP H 1 47 LYS H 0.000 . 2.700 2.065 1.909 2.179 . 0 0 "[ . 1 . 2]" 1
732 1 47 LYS HA 1 48 PRO QD 0.000 . 3.700 1.973 1.934 1.991 . 0 0 "[ . 1 . 2]" 1
733 1 47 LYS HA 1 50 VAL HA 0.000 . 5.000 4.551 4.272 4.846 . 0 0 "[ . 1 . 2]" 1
734 1 47 LYS HA 1 50 VAL MG1 0.000 . 6.500 5.086 4.678 5.402 . 0 0 "[ . 1 . 2]" 1
735 1 47 LYS HA 1 50 VAL MG2 0.000 . 6.500 4.303 2.600 5.205 . 0 0 "[ . 1 . 2]" 1
736 1 47 LYS QB 1 48 PRO QD 0.000 . 7.000 2.480 2.155 3.175 . 0 0 "[ . 1 . 2]" 1
737 1 47 LYS H 1 47 LYS QD 0.000 . 6.000 3.895 2.550 4.920 . 0 0 "[ . 1 . 2]" 1
738 1 47 LYS QD 1 48 PRO QD 0.000 . 7.000 3.672 1.926 4.335 . 0 0 "[ . 1 . 2]" 1
739 1 47 LYS H 1 47 LYS QG 0.000 . 4.300 3.457 2.816 3.905 . 0 0 "[ . 1 . 2]" 1
740 1 47 LYS QG 1 48 PRO QD 0.000 . 7.000 2.344 2.049 3.470 . 0 0 "[ . 1 . 2]" 1
741 1 49 PRO HA 1 50 VAL HA 0.000 . 5.000 4.448 4.410 4.474 . 0 0 "[ . 1 . 2]" 1
742 1 49 PRO HA 1 50 VAL H 0.000 . 3.300 2.174 2.145 2.187 . 0 0 "[ . 1 . 2]" 1
743 1 49 PRO HA 1 50 VAL MG1 0.000 . 6.500 3.868 3.310 5.382 . 0 0 "[ . 1 . 2]" 1
744 1 49 PRO HA 1 50 VAL MG2 0.000 . 6.500 5.209 4.179 5.487 . 0 0 "[ . 1 . 2]" 1
745 1 49 PRO QB 1 50 VAL H 0.000 . 6.000 3.465 3.364 3.542 . 0 0 "[ . 1 . 2]" 1
746 1 49 PRO QB 1 52 VAL MG1 0.000 . 7.500 3.486 1.894 4.041 . 0 0 "[ . 1 . 2]" 1
747 1 49 PRO QB 1 52 VAL MG2 0.000 . 7.500 2.091 1.906 3.534 . 0 0 "[ . 1 . 2]" 1
748 1 49 PRO QD 1 76 TYR QD 0.000 . 8.000 4.382 3.459 5.287 . 0 0 "[ . 1 . 2]" 1
749 1 49 PRO QD 1 76 TYR QE 0.000 . 8.000 4.150 2.979 5.286 . 0 0 "[ . 1 . 2]" 1
750 1 49 PRO QG 1 52 VAL MG1 0.000 . 7.500 3.468 2.363 3.894 . 0 0 "[ . 1 . 2]" 1
751 1 50 VAL HA 1 51 GLY QA 0.000 . 6.000 3.960 3.912 4.027 . 0 0 "[ . 1 . 2]" 1
752 1 50 VAL HA 1 51 GLY H 0.000 . 2.700 2.165 2.136 2.255 . 0 0 "[ . 1 . 2]" 1
753 1 50 VAL HA 1 52 VAL H 0.000 . 5.000 4.849 4.456 5.033 0.033 6 0 "[ . 1 . 2]" 1
754 1 50 VAL H 1 50 VAL HB 0.000 . 3.300 2.691 2.140 2.998 . 0 0 "[ . 1 . 2]" 1
755 1 50 VAL HB 1 51 GLY H 0.000 . 5.000 4.190 3.734 4.582 . 0 0 "[ . 1 . 2]" 1
756 1 50 VAL QG 1 52 VAL QG 0.000 . 9.800 4.091 3.876 4.556 . 0 0 "[ . 1 . 2]" 1
757 1 50 VAL QG 1 52 VAL H 0.000 . 7.400 4.830 4.522 5.111 . 0 0 "[ . 1 . 2]" 1
758 1 50 VAL H 1 50 VAL MG1 0.000 . 4.200 2.139 1.663 3.622 . 0 0 "[ . 1 . 2]" 1
759 1 50 VAL MG1 1 51 GLY QA 0.000 . 7.500 3.730 2.809 4.239 . 0 0 "[ . 1 . 2]" 1
760 1 50 VAL MG1 1 51 GLY H 0.000 . 6.500 3.802 2.298 4.290 . 0 0 "[ . 1 . 2]" 1
761 1 50 VAL H 1 50 VAL MG2 0.000 . 4.800 3.530 2.718 3.774 . 0 0 "[ . 1 . 2]" 1
762 1 50 VAL MG2 1 51 GLY H 0.000 . 4.800 2.798 1.913 3.871 . 0 0 "[ . 1 . 2]" 1
763 1 51 GLY QA 1 52 VAL HA 0.000 . 6.000 3.972 3.950 3.994 . 0 0 "[ . 1 . 2]" 1
764 1 51 GLY QA 1 52 VAL HB 0.000 . 6.000 4.760 4.474 5.466 . 0 0 "[ . 1 . 2]" 1
765 1 51 GLY QA 1 52 VAL MG2 0.000 . 7.500 3.607 3.329 5.165 . 0 0 "[ . 1 . 2]" 1
766 1 51 GLY QA 1 52 VAL H 0.000 . 6.000 2.331 2.265 2.460 . 0 0 "[ . 1 . 2]" 1
767 1 51 GLY QA 1 53 PHE H 0.000 . 6.000 3.993 3.814 4.365 . 0 0 "[ . 1 . 2]" 1
768 1 51 GLY H 1 52 VAL H 0.000 . 5.000 3.039 2.773 3.297 . 0 0 "[ . 1 . 2]" 1
769 1 51 GLY H 1 53 PHE H 0.000 . 5.000 4.516 4.191 4.931 . 0 0 "[ . 1 . 2]" 1
770 1 52 VAL HA 1 53 PHE HA 0.000 . 5.000 4.581 4.565 4.599 . 0 0 "[ . 1 . 2]" 1
771 1 52 VAL HA 1 53 PHE H 0.000 . 5.000 3.543 3.517 3.576 . 0 0 "[ . 1 . 2]" 1
772 1 52 VAL HA 1 65 THR MG 0.000 . 6.500 4.044 2.202 4.712 . 0 0 "[ . 1 . 2]" 1
773 1 52 VAL HA 1 65 THR H 0.000 . 5.000 3.569 3.250 3.923 . 0 0 "[ . 1 . 2]" 1
774 1 52 VAL HA 1 66 GLN QE 0.000 . 6.000 3.121 1.999 4.046 . 0 0 "[ . 1 . 2]" 1
775 1 52 VAL HB 1 53 PHE H 0.000 . 5.000 2.709 2.118 4.110 . 0 0 "[ . 1 . 2]" 1
776 1 52 VAL HB 1 66 GLN QE 0.000 . 6.000 4.557 3.069 5.359 . 0 0 "[ . 1 . 2]" 1
777 1 52 VAL QG 1 53 PHE QB 0.000 . 8.400 3.806 3.014 4.203 . 0 0 "[ . 1 . 2]" 1
778 1 52 VAL QG 1 54 ILE MG 0.000 . 8.900 5.042 4.704 5.310 . 0 0 "[ . 1 . 2]" 1
779 1 52 VAL QG 1 64 VAL HA 0.000 . 7.400 4.459 4.000 5.245 . 0 0 "[ . 1 . 2]" 1
780 1 52 VAL QG 1 65 THR H 0.000 . 7.400 3.748 3.346 4.490 . 0 0 "[ . 1 . 2]" 1
781 1 52 VAL QG 1 66 GLN HB2 0.000 . 7.400 2.101 1.924 2.393 . 0 0 "[ . 1 . 2]" 1
782 1 52 VAL MG1 1 53 PHE HA 0.000 . 6.500 3.985 3.459 5.493 . 0 0 "[ . 1 . 2]" 1
783 1 52 VAL MG1 1 53 PHE QD 0.000 . 6.800 2.899 2.208 4.426 . 0 0 "[ . 1 . 2]" 1
784 1 52 VAL MG1 1 53 PHE QE 0.000 . 6.800 2.790 2.100 4.354 . 0 0 "[ . 1 . 2]" 1
785 1 52 VAL MG1 1 53 PHE H 0.000 . 6.500 3.439 2.102 4.012 . 0 0 "[ . 1 . 2]" 1
786 1 52 VAL MG1 1 66 GLN QE 0.000 . 7.500 3.093 1.962 4.365 . 0 0 "[ . 1 . 2]" 1
787 1 52 VAL MG1 1 66 GLN H 0.000 . 6.500 3.113 2.470 5.035 . 0 0 "[ . 1 . 2]" 1
788 1 52 VAL MG1 1 76 TYR QE 0.000 . 8.500 3.722 2.827 5.322 . 0 0 "[ . 1 . 2]" 1
789 1 52 VAL H 1 52 VAL MG2 0.000 . 4.800 2.952 2.182 3.775 . 0 0 "[ . 1 . 2]" 1
790 1 52 VAL MG2 1 53 PHE QD 0.000 . 8.500 3.873 2.722 4.626 . 0 0 "[ . 1 . 2]" 1
791 1 52 VAL MG2 1 53 PHE H 0.000 . 4.800 3.523 1.852 4.055 . 0 0 "[ . 1 . 2]" 1
792 1 52 VAL MG2 1 66 GLN QE 0.000 . 7.500 2.517 1.704 4.363 . 0 0 "[ . 1 . 2]" 1
793 1 52 VAL MG2 1 66 GLN H 0.000 . 6.500 4.512 2.641 5.064 . 0 0 "[ . 1 . 2]" 1
794 1 52 VAL H 1 53 PHE QB 0.000 . 6.000 4.202 4.053 4.462 . 0 0 "[ . 1 . 2]" 1
795 1 52 VAL H 1 53 PHE QD 0.000 . 7.000 4.290 3.513 5.108 . 0 0 "[ . 1 . 2]" 1
796 1 52 VAL H 1 53 PHE H 0.000 . 5.000 1.891 1.745 2.159 . 0 0 "[ . 1 . 2]" 1
797 1 53 PHE HA 1 54 ILE HA 0.000 . 5.000 4.463 4.432 4.483 . 0 0 "[ . 1 . 2]" 1
798 1 53 PHE HA 1 54 ILE MD 0.000 . 6.500 4.424 2.504 5.107 . 0 0 "[ . 1 . 2]" 1
799 1 53 PHE HA 1 54 ILE QG 0.000 . 6.000 3.470 3.110 4.468 . 0 0 "[ . 1 . 2]" 1
800 1 53 PHE HA 1 54 ILE H 0.000 . 2.700 2.196 2.145 2.238 . 0 0 "[ . 1 . 2]" 1
801 1 53 PHE HA 1 62 LEU QD 0.000 . 7.400 3.695 3.516 3.935 . 0 0 "[ . 1 . 2]" 1
802 1 53 PHE HA 1 64 VAL HA 0.000 . 3.300 2.237 2.175 2.368 . 0 0 "[ . 1 . 2]" 1
803 1 53 PHE HA 1 64 VAL HB 0.000 . 5.000 3.525 2.622 4.347 . 0 0 "[ . 1 . 2]" 1
804 1 53 PHE HA 1 64 VAL MG1 0.000 . 6.500 3.259 2.186 4.950 . 0 0 "[ . 1 . 2]" 1
805 1 53 PHE HA 1 64 VAL MG2 0.000 . 6.500 4.416 3.237 5.017 . 0 0 "[ . 1 . 2]" 1
806 1 53 PHE HA 1 65 THR MG 0.000 . 6.500 4.353 2.821 5.333 . 0 0 "[ . 1 . 2]" 1
807 1 53 PHE HA 1 65 THR H 0.000 . 5.000 3.152 2.770 3.440 . 0 0 "[ . 1 . 2]" 1
808 1 53 PHE HA 1 78 LEU QD 0.000 . 7.400 4.908 4.214 5.395 . 0 0 "[ . 1 . 2]" 1
809 1 53 PHE QB 1 54 ILE HA 0.000 . 6.000 4.015 3.944 4.229 . 0 0 "[ . 1 . 2]" 1
810 1 53 PHE QB 1 64 VAL HA 0.000 . 6.000 4.165 3.836 4.366 . 0 0 "[ . 1 . 2]" 1
811 1 53 PHE HB3 1 54 ILE H 0.000 . 5.000 3.023 2.768 3.601 . 0 0 "[ . 1 . 2]" 1
812 1 53 PHE HB3 1 62 LEU MD1 0.000 . 6.500 4.083 3.978 4.209 . 0 0 "[ . 1 . 2]" 1
813 1 53 PHE HB3 1 62 LEU MD2 0.000 . 6.500 2.631 2.502 2.790 . 0 0 "[ . 1 . 2]" 1
814 1 53 PHE HB3 1 78 LEU MD1 0.000 . 6.500 3.883 2.997 4.491 . 0 0 "[ . 1 . 2]" 1
815 1 53 PHE HB3 1 78 LEU MD2 0.000 . 6.500 3.741 2.157 4.887 . 0 0 "[ . 1 . 2]" 1
816 1 53 PHE HB3 1 98 ILE MD 0.000 . 6.500 4.487 3.973 5.055 . 0 0 "[ . 1 . 2]" 1
817 1 53 PHE HB2 1 54 ILE H 0.000 . 5.000 4.063 3.815 4.398 . 0 0 "[ . 1 . 2]" 1
818 1 53 PHE HB2 1 62 LEU MD1 0.000 . 6.500 5.288 5.225 5.363 . 0 0 "[ . 1 . 2]" 1
819 1 53 PHE HB2 1 62 LEU MD2 0.000 . 6.500 4.130 3.948 4.291 . 0 0 "[ . 1 . 2]" 1
820 1 53 PHE HB2 1 78 LEU MD1 0.000 . 6.500 3.102 2.568 3.683 . 0 0 "[ . 1 . 2]" 1
821 1 53 PHE HB2 1 78 LEU MD2 0.000 . 6.500 3.365 2.462 4.480 . 0 0 "[ . 1 . 2]" 1
822 1 53 PHE HB2 1 98 ILE MD 0.000 . 6.500 4.922 4.312 5.388 . 0 0 "[ . 1 . 2]" 1
823 1 53 PHE H 1 53 PHE QD 0.000 . 5.300 2.864 2.178 3.559 . 0 0 "[ . 1 . 2]" 1
824 1 53 PHE QD 1 54 ILE H 0.000 . 7.000 3.900 3.222 4.446 . 0 0 "[ . 1 . 2]" 1
825 1 53 PHE QD 1 62 LEU MD1 0.000 . 8.500 3.687 2.640 4.533 . 0 0 "[ . 1 . 2]" 1
826 1 53 PHE QD 1 62 LEU MD2 0.000 . 6.800 2.660 2.134 4.113 . 0 0 "[ . 1 . 2]" 1
827 1 53 PHE QD 1 64 VAL HA 0.000 . 5.300 3.626 2.489 4.420 . 0 0 "[ . 1 . 2]" 1
828 1 53 PHE QD 1 64 VAL HB 0.000 . 5.300 3.469 2.196 4.819 . 0 0 "[ . 1 . 2]" 1
829 1 53 PHE QD 1 64 VAL MG1 0.000 . 8.500 2.621 2.085 3.895 . 0 0 "[ . 1 . 2]" 1
830 1 53 PHE QD 1 64 VAL MG2 0.000 . 8.500 4.311 3.350 4.882 . 0 0 "[ . 1 . 2]" 1
831 1 53 PHE QD 1 76 TYR HB3 0.000 . 7.000 4.815 3.787 5.540 . 0 0 "[ . 1 . 2]" 1
832 1 53 PHE QD 1 76 TYR HB2 0.000 . 7.000 5.355 4.725 5.917 . 0 0 "[ . 1 . 2]" 1
833 1 53 PHE QD 1 76 TYR QD 0.000 . 9.000 4.324 3.482 5.396 . 0 0 "[ . 1 . 2]" 1
834 1 53 PHE QD 1 76 TYR QE 0.000 . 9.000 5.309 4.732 6.037 . 0 0 "[ . 1 . 2]" 1
835 1 53 PHE QD 1 78 LEU MD1 0.000 . 6.800 3.077 2.085 3.755 . 0 0 "[ . 1 . 2]" 1
836 1 53 PHE QD 1 78 LEU MD2 0.000 . 8.500 3.352 2.165 4.179 . 0 0 "[ . 1 . 2]" 1
837 1 53 PHE QD 1 96 ILE MG 0.000 . 8.500 5.941 5.153 6.361 . 0 0 "[ . 1 . 2]" 1
838 1 53 PHE QD 1 98 ILE MD 0.000 . 6.800 3.562 2.791 4.107 . 0 0 "[ . 1 . 2]" 1
839 1 53 PHE QD 1 98 ILE MG 0.000 . 8.500 4.728 4.332 5.192 . 0 0 "[ . 1 . 2]" 1
840 1 53 PHE QE 1 62 LEU MD2 0.000 . 8.500 4.195 3.403 5.320 . 0 0 "[ . 1 . 2]" 1
841 1 53 PHE QE 1 64 VAL HA 0.000 . 7.000 5.017 3.949 5.742 . 0 0 "[ . 1 . 2]" 1
842 1 53 PHE QE 1 64 VAL HB 0.000 . 5.300 3.742 2.176 4.931 . 0 0 "[ . 1 . 2]" 1
843 1 53 PHE QE 1 64 VAL MG1 0.000 . 6.200 2.795 2.057 4.141 . 0 0 "[ . 1 . 2]" 1
844 1 53 PHE QE 1 64 VAL MG2 0.000 . 8.500 4.106 2.907 4.951 . 0 0 "[ . 1 . 2]" 1
845 1 53 PHE QE 1 68 LEU QD 0.000 . 9.400 2.468 2.051 2.920 . 0 0 "[ . 1 . 2]" 1
846 1 53 PHE QE 1 76 TYR HB3 0.000 . 7.000 3.507 2.292 5.064 . 0 0 "[ . 1 . 2]" 1
847 1 53 PHE QE 1 76 TYR HB2 0.000 . 7.000 3.818 2.823 4.702 . 0 0 "[ . 1 . 2]" 1
848 1 53 PHE QE 1 76 TYR QD 0.000 . 7.300 2.690 2.158 4.811 . 0 0 "[ . 1 . 2]" 1
849 1 53 PHE QE 1 76 TYR QE 0.000 . 7.300 3.547 2.701 5.069 . 0 0 "[ . 1 . 2]" 1
850 1 53 PHE QE 1 78 LEU MD1 0.000 . 8.500 3.999 2.727 4.803 . 0 0 "[ . 1 . 2]" 1
851 1 53 PHE QE 1 96 ILE MG 0.000 . 8.500 6.087 5.405 6.441 . 0 0 "[ . 1 . 2]" 1
852 1 53 PHE QE 1 98 ILE MD 0.000 . 6.800 3.214 2.539 3.713 . 0 0 "[ . 1 . 2]" 1
853 1 53 PHE QE 1 98 ILE MG 0.000 . 8.500 3.362 2.517 4.234 . 0 0 "[ . 1 . 2]" 1
854 1 53 PHE HZ 1 64 VAL MG1 0.000 . 6.500 4.252 2.973 5.318 . 0 0 "[ . 1 . 2]" 1
855 1 53 PHE HZ 1 68 LEU QD 0.000 . 7.400 2.043 1.815 2.550 . 0 0 "[ . 1 . 2]" 1
856 1 53 PHE HZ 1 76 TYR QB 0.000 . 6.000 3.553 3.096 4.531 . 0 0 "[ . 1 . 2]" 1
857 1 53 PHE HZ 1 78 LEU QD 0.000 . 7.400 4.540 3.889 5.149 . 0 0 "[ . 1 . 2]" 1
858 1 53 PHE HZ 1 98 ILE MD 0.000 . 6.500 3.974 3.208 4.725 . 0 0 "[ . 1 . 2]" 1
859 1 53 PHE HZ 1 98 ILE MG 0.000 . 6.500 3.737 3.049 4.721 . 0 0 "[ . 1 . 2]" 1
860 1 54 ILE HA 1 55 ILE HA 0.000 . 5.000 4.440 4.358 4.500 . 0 0 "[ . 1 . 2]" 1
861 1 54 ILE HA 1 55 ILE QG 0.000 . 6.000 4.421 3.154 5.586 . 0 0 "[ . 1 . 2]" 1
862 1 54 ILE HA 1 55 ILE H 0.000 . 2.700 2.217 2.083 2.338 . 0 0 "[ . 1 . 2]" 1
863 1 54 ILE HB 1 55 ILE H 0.000 . 5.000 3.045 2.695 3.628 . 0 0 "[ . 1 . 2]" 1
864 1 54 ILE HB 1 55 ILE HA 0.000 . 5.000 4.438 4.216 4.802 . 0 0 "[ . 1 . 2]" 1
865 1 54 ILE H 1 54 ILE MD 0.000 . 4.800 3.473 1.673 3.887 . 0 0 "[ . 1 . 2]" 1
866 1 54 ILE MD 1 63 LYS HA 0.000 . 6.500 4.892 4.310 5.248 . 0 0 "[ . 1 . 2]" 1
867 1 54 ILE MD 1 63 LYS H 0.000 . 6.500 4.438 4.051 4.919 . 0 0 "[ . 1 . 2]" 1
868 1 54 ILE QG 1 55 ILE H 0.000 . 6.000 4.139 3.652 4.419 . 0 0 "[ . 1 . 2]" 1
869 1 54 ILE MG 1 55 ILE H 0.000 . 6.500 3.705 3.485 4.057 . 0 0 "[ . 1 . 2]" 1
870 1 54 ILE H 1 55 ILE H 0.000 . 5.000 4.353 4.095 4.565 . 0 0 "[ . 1 . 2]" 1
871 1 54 ILE H 1 63 LYS H 0.000 . 5.000 3.525 3.196 3.859 . 0 0 "[ . 1 . 2]" 1
872 1 54 ILE H 1 64 VAL HA 0.000 . 5.000 2.795 2.425 3.169 . 0 0 "[ . 1 . 2]" 1
873 1 54 ILE H 1 65 THR H 0.000 . 5.000 4.222 3.839 4.510 . 0 0 "[ . 1 . 2]" 1
874 1 55 ILE HA 1 56 GLU HA 0.000 . 5.000 4.350 4.339 4.366 . 0 0 "[ . 1 . 2]" 1
875 1 55 ILE HA 1 56 GLU QB 0.000 . 6.000 4.020 3.966 4.100 . 0 0 "[ . 1 . 2]" 1
876 1 55 ILE HA 1 56 GLU H 0.000 . 2.700 2.218 2.153 2.251 . 0 0 "[ . 1 . 2]" 1
877 1 55 ILE HA 1 62 LEU HA 0.000 . 3.300 2.398 2.178 2.578 . 0 0 "[ . 1 . 2]" 1
878 1 55 ILE HA 1 62 LEU MD1 0.000 . 6.500 5.311 5.008 5.523 . 0 0 "[ . 1 . 2]" 1
879 1 55 ILE HA 1 62 LEU MD2 0.000 . 4.800 3.275 2.781 3.643 . 0 0 "[ . 1 . 2]" 1
880 1 55 ILE HA 1 62 LEU HG 0.000 . 5.000 3.974 3.628 4.283 . 0 0 "[ . 1 . 2]" 1
881 1 55 ILE HA 1 63 LYS QB 0.000 . 6.000 4.761 4.109 5.218 . 0 0 "[ . 1 . 2]" 1
882 1 55 ILE HA 1 63 LYS QG 0.000 . 6.000 3.237 2.688 4.054 . 0 0 "[ . 1 . 2]" 1
883 1 55 ILE HA 1 63 LYS H 0.000 . 5.000 2.788 2.457 3.294 . 0 0 "[ . 1 . 2]" 1
884 1 55 ILE HB 1 56 GLU H 0.000 . 5.000 3.734 2.851 4.387 . 0 0 "[ . 1 . 2]" 1
885 1 55 ILE QG 1 96 ILE MD 0.000 . 7.500 5.010 3.931 5.591 . 0 0 "[ . 1 . 2]" 1
886 1 55 ILE MG 1 56 GLU H 0.000 . 4.800 3.156 1.977 4.051 . 0 0 "[ . 1 . 2]" 1
887 1 55 ILE MG 1 62 LEU QB 0.000 . 7.500 4.343 2.982 5.554 . 0 0 "[ . 1 . 2]" 1
888 1 55 ILE MG 1 62 LEU HG 0.000 . 6.500 3.420 1.956 4.853 . 0 0 "[ . 1 . 2]" 1
889 1 55 ILE H 1 56 GLU H 0.000 . 5.000 4.476 4.386 4.563 . 0 0 "[ . 1 . 2]" 1
890 1 56 GLU HA 1 57 ARG HA 0.000 . 5.000 4.481 4.451 4.518 . 0 0 "[ . 1 . 2]" 1
891 1 56 GLU HA 1 57 ARG H 0.000 . 2.700 2.158 2.128 2.202 . 0 0 "[ . 1 . 2]" 1
892 1 56 GLU HA 1 58 GLU H 0.000 . 5.000 3.454 3.310 3.662 . 0 0 "[ . 1 . 2]" 1
893 1 56 GLU H 1 56 GLU QB 0.000 . 3.900 2.144 2.052 2.281 . 0 0 "[ . 1 . 2]" 1
894 1 56 GLU QB 1 57 ARG H 0.000 . 4.300 3.829 3.731 3.949 . 0 0 "[ . 1 . 2]" 1
895 1 56 GLU QB 1 58 GLU H 0.000 . 6.000 3.048 2.663 3.683 . 0 0 "[ . 1 . 2]" 1
896 1 56 GLU QB 1 59 THR MG 0.000 . 7.500 3.419 2.821 3.957 . 0 0 "[ . 1 . 2]" 1
897 1 56 GLU QB 1 59 THR H 0.000 . 6.000 2.489 2.118 3.192 . 0 0 "[ . 1 . 2]" 1
898 1 56 GLU QB 1 60 GLY QA 0.000 . 7.000 3.512 3.124 3.921 . 0 0 "[ . 1 . 2]" 1
899 1 56 GLU QB 1 61 TRP QB 0.000 . 7.000 2.157 2.014 2.403 . 0 0 "[ . 1 . 2]" 1
900 1 56 GLU QB 1 61 TRP H 0.000 . 6.000 2.050 1.635 2.484 . 0 0 "[ . 1 . 2]" 1
901 1 56 GLU QG 1 57 ARG H 0.000 . 6.000 4.038 3.420 4.365 . 0 0 "[ . 1 . 2]" 1
902 1 56 GLU QG 1 59 THR MG 0.000 . 7.500 3.220 2.144 4.173 . 0 0 "[ . 1 . 2]" 1
903 1 56 GLU QG 1 59 THR H 0.000 . 6.000 3.218 1.639 3.944 . 0 0 "[ . 1 . 2]" 1
904 1 56 GLU QG 1 60 GLY H 0.000 . 6.000 4.294 2.449 5.182 . 0 0 "[ . 1 . 2]" 1
905 1 56 GLU QG 1 61 TRP QB 0.000 . 7.000 3.110 2.502 3.490 . 0 0 "[ . 1 . 2]" 1
906 1 56 GLU H 1 61 TRP H 0.000 . 5.000 3.122 2.823 3.333 . 0 0 "[ . 1 . 2]" 1
907 1 56 GLU H 1 62 LEU HA 0.000 . 5.000 3.656 3.342 3.893 . 0 0 "[ . 1 . 2]" 1
908 1 57 ARG HA 1 58 GLU HA 0.000 . 5.000 4.634 4.622 4.665 . 0 0 "[ . 1 . 2]" 1
909 1 57 ARG HA 1 58 GLU QG 0.000 . 6.000 4.873 4.649 5.149 . 0 0 "[ . 1 . 2]" 1
910 1 57 ARG HA 1 58 GLU H 0.000 . 5.000 3.452 3.362 3.533 . 0 0 "[ . 1 . 2]" 1
911 1 57 ARG HA 1 60 GLY H 0.000 . 5.000 4.283 3.989 4.703 . 0 0 "[ . 1 . 2]" 1
912 1 57 ARG H 1 57 ARG QB 0.000 . 3.300 2.291 2.173 2.439 . 0 0 "[ . 1 . 2]" 1
913 1 57 ARG QB 1 58 GLU HA 0.000 . 6.000 4.397 3.944 4.584 . 0 0 "[ . 1 . 2]" 1
914 1 57 ARG QB 1 58 GLU QG 0.000 . 7.000 3.504 2.793 4.227 . 0 0 "[ . 1 . 2]" 1
915 1 57 ARG QB 1 58 GLU H 0.000 . 6.000 3.266 2.742 3.775 . 0 0 "[ . 1 . 2]" 1
916 1 57 ARG H 1 57 ARG QD 0.000 . 6.000 4.272 3.584 4.967 . 0 0 "[ . 1 . 2]" 1
917 1 57 ARG QG 1 58 GLU QG 0.000 . 7.000 2.882 1.941 5.058 . 0 0 "[ . 1 . 2]" 1
918 1 57 ARG QG 1 58 GLU H 0.000 . 6.000 3.162 2.192 4.384 . 0 0 "[ . 1 . 2]" 1
919 1 57 ARG H 1 58 GLU H 0.000 . 5.000 2.860 2.741 2.951 . 0 0 "[ . 1 . 2]" 1
920 1 58 GLU HA 1 59 THR MG 0.000 . 6.500 4.539 4.388 4.704 . 0 0 "[ . 1 . 2]" 1
921 1 58 GLU HA 1 59 THR H 0.000 . 5.000 3.566 3.549 3.579 . 0 0 "[ . 1 . 2]" 1
922 1 58 GLU H 1 58 GLU QB 0.000 . 3.900 2.395 2.253 2.624 . 0 0 "[ . 1 . 2]" 1
923 1 58 GLU QB 1 59 THR HA 0.000 . 6.000 3.855 3.820 3.898 . 0 0 "[ . 1 . 2]" 1
924 1 58 GLU HB3 1 59 THR MG 0.000 . 6.500 3.041 2.551 3.437 . 0 0 "[ . 1 . 2]" 1
925 1 58 GLU HB3 1 59 THR H 0.000 . 3.300 2.926 2.599 3.216 . 0 0 "[ . 1 . 2]" 1
926 1 58 GLU HB2 1 59 THR MG 0.000 . 6.500 2.767 2.430 3.159 . 0 0 "[ . 1 . 2]" 1
927 1 58 GLU HB2 1 59 THR H 0.000 . 5.000 2.021 1.843 2.212 . 0 0 "[ . 1 . 2]" 1
928 1 58 GLU H 1 58 GLU QG 0.000 . 4.300 2.514 1.942 2.857 . 0 0 "[ . 1 . 2]" 1
929 1 58 GLU QG 1 59 THR MG 0.000 . 7.500 4.355 3.984 4.599 . 0 0 "[ . 1 . 2]" 1
930 1 58 GLU QG 1 59 THR H 0.000 . 6.000 3.834 3.463 4.058 . 0 0 "[ . 1 . 2]" 1
931 1 58 GLU H 1 59 THR MG 0.000 . 6.500 4.288 3.971 4.586 . 0 0 "[ . 1 . 2]" 1
932 1 58 GLU H 1 59 THR H 0.000 . 2.700 2.723 2.691 2.770 0.070 16 0 "[ . 1 . 2]" 1
933 1 58 GLU H 1 60 GLY H 0.000 . 5.000 3.278 3.071 3.464 . 0 0 "[ . 1 . 2]" 1
934 1 59 THR HA 1 60 GLY QA 0.000 . 6.000 4.236 4.208 4.262 . 0 0 "[ . 1 . 2]" 1
935 1 59 THR HA 1 60 GLY H 0.000 . 5.000 3.282 3.131 3.495 . 0 0 "[ . 1 . 2]" 1
936 1 59 THR HA 1 61 TRP HD1 0.000 . 5.000 4.675 4.517 4.979 . 0 0 "[ . 1 . 2]" 1
937 1 59 THR HB 1 60 GLY H 0.000 . 5.000 4.255 3.768 4.464 . 0 0 "[ . 1 . 2]" 1
938 1 59 THR HB 1 61 TRP HD1 0.000 . 3.300 2.267 2.184 2.576 . 0 0 "[ . 1 . 2]" 1
939 1 59 THR H 1 59 THR MG 0.000 . 4.800 2.064 1.751 2.388 . 0 0 "[ . 1 . 2]" 1
940 1 59 THR MG 1 60 GLY H 0.000 . 6.500 3.986 3.703 4.177 . 0 0 "[ . 1 . 2]" 1
941 1 59 THR MG 1 61 TRP HD1 0.000 . 6.500 2.974 2.706 3.263 . 0 0 "[ . 1 . 2]" 1
942 1 59 THR MG 1 61 TRP HE1 0.000 . 6.500 4.528 4.141 4.932 . 0 0 "[ . 1 . 2]" 1
943 1 59 THR MG 1 61 TRP H 0.000 . 6.500 4.148 3.989 4.293 . 0 0 "[ . 1 . 2]" 1
944 1 59 THR H 1 60 GLY QA 0.000 . 6.000 4.464 4.378 4.531 . 0 0 "[ . 1 . 2]" 1
945 1 59 THR H 1 60 GLY H 0.000 . 2.700 2.585 2.398 2.721 0.021 20 0 "[ . 1 . 2]" 1
946 1 59 THR H 1 61 TRP H 0.000 . 5.000 3.729 3.533 3.964 . 0 0 "[ . 1 . 2]" 1
947 1 60 GLY QA 1 61 TRP HA 0.000 . 6.000 4.148 4.124 4.184 . 0 0 "[ . 1 . 2]" 1
948 1 60 GLY QA 1 61 TRP H 0.000 . 4.300 2.869 2.817 2.899 . 0 0 "[ . 1 . 2]" 1
949 1 60 GLY H 1 61 TRP H 0.000 . 3.300 2.625 2.210 2.885 . 0 0 "[ . 1 . 2]" 1
950 1 61 TRP HA 1 61 TRP HE3 0.000 . 3.300 2.519 2.213 2.741 . 0 0 "[ . 1 . 2]" 1
951 1 61 TRP HA 1 62 LEU HA 0.000 . 5.000 4.423 4.398 4.447 . 0 0 "[ . 1 . 2]" 1
952 1 61 TRP HA 1 62 LEU QB 0.000 . 6.000 4.091 4.014 4.134 . 0 0 "[ . 1 . 2]" 1
953 1 61 TRP HA 1 62 LEU H 0.000 . 2.700 2.156 2.137 2.177 . 0 0 "[ . 1 . 2]" 1
954 1 61 TRP H 1 61 TRP QB 0.000 . 3.900 2.076 2.052 2.119 . 0 0 "[ . 1 . 2]" 1
955 1 61 TRP QB 1 62 LEU HA 0.000 . 6.000 4.393 4.307 4.471 . 0 0 "[ . 1 . 2]" 1
956 1 61 TRP QB 1 62 LEU H 0.000 . 6.000 3.585 3.453 3.738 . 0 0 "[ . 1 . 2]" 1
957 1 61 TRP QB 1 63 LYS QB 0.000 . 7.000 4.584 3.924 4.866 . 0 0 "[ . 1 . 2]" 1
958 1 61 TRP H 1 61 TRP HD1 0.000 . 5.000 3.639 3.321 3.841 . 0 0 "[ . 1 . 2]" 1
959 1 61 TRP H 1 62 LEU H 0.000 . 5.000 4.477 4.390 4.543 . 0 0 "[ . 1 . 2]" 1
960 1 62 LEU HA 1 63 LYS HA 0.000 . 5.000 4.414 4.397 4.429 . 0 0 "[ . 1 . 2]" 1
961 1 62 LEU HA 1 63 LYS QB 0.000 . 6.000 4.659 4.390 4.825 . 0 0 "[ . 1 . 2]" 1
962 1 62 LEU HA 1 63 LYS H 0.000 . 2.700 2.102 2.081 2.135 . 0 0 "[ . 1 . 2]" 1
963 1 62 LEU H 1 62 LEU QB 0.000 . 3.900 2.265 2.184 2.339 . 0 0 "[ . 1 . 2]" 1
964 1 62 LEU QB 1 63 LYS HA 0.000 . 6.000 4.304 4.200 4.410 . 0 0 "[ . 1 . 2]" 1
965 1 62 LEU QB 1 63 LYS H 0.000 . 6.000 3.776 3.688 3.863 . 0 0 "[ . 1 . 2]" 1
966 1 62 LEU QD 1 64 VAL QG 0.000 . 9.800 2.826 2.280 3.875 . 0 0 "[ . 1 . 2]" 1
967 1 62 LEU QD 1 98 ILE HB 0.000 . 7.400 5.252 4.945 5.406 . 0 0 "[ . 1 . 2]" 1
968 1 62 LEU QD 1 98 ILE MD 0.000 . 8.900 2.612 2.265 2.927 . 0 0 "[ . 1 . 2]" 1
969 1 62 LEU QD 1 98 ILE MG 0.000 . 7.200 3.885 3.376 4.267 . 0 0 "[ . 1 . 2]" 1
970 1 62 LEU HA 1 62 LEU MD1 0.000 . 4.800 3.762 3.740 3.803 . 0 0 "[ . 1 . 2]" 1
971 1 62 LEU MD1 1 63 LYS HA 0.000 . 6.500 5.289 4.970 5.379 . 0 0 "[ . 1 . 2]" 1
972 1 62 LEU MD1 1 63 LYS H 0.000 . 6.500 4.633 4.440 4.805 . 0 0 "[ . 1 . 2]" 1
973 1 62 LEU MD1 1 78 LEU MD1 0.000 . 8.000 4.687 3.018 5.379 . 0 0 "[ . 1 . 2]" 1
974 1 62 LEU MD1 1 96 ILE MG 0.000 . 8.000 3.270 2.819 3.595 . 0 0 "[ . 1 . 2]" 1
975 1 62 LEU MD1 1 98 ILE MD 0.000 . 5.700 2.663 2.284 2.991 . 0 0 "[ . 1 . 2]" 1
976 1 62 LEU HA 1 62 LEU MD2 0.000 . 4.800 2.130 2.077 2.213 . 0 0 "[ . 1 . 2]" 1
977 1 62 LEU MD2 1 63 LYS HA 0.000 . 6.500 3.288 3.019 3.476 . 0 0 "[ . 1 . 2]" 1
978 1 62 LEU MD2 1 63 LYS H 0.000 . 4.800 2.062 1.782 2.314 . 0 0 "[ . 1 . 2]" 1
979 1 62 LEU MD2 1 78 LEU MD1 0.000 . 8.000 4.875 3.565 5.345 . 0 0 "[ . 1 . 2]" 1
980 1 62 LEU MD2 1 78 LEU MD2 0.000 . 8.000 4.449 3.199 5.375 . 0 0 "[ . 1 . 2]" 1
981 1 62 LEU MD2 1 96 ILE MG 0.000 . 8.000 5.143 4.681 5.426 . 0 0 "[ . 1 . 2]" 1
982 1 62 LEU MD2 1 98 ILE MD 0.000 . 8.000 3.824 3.352 4.174 . 0 0 "[ . 1 . 2]" 1
983 1 62 LEU HG 1 63 LYS H 0.000 . 5.000 3.984 3.773 4.221 . 0 0 "[ . 1 . 2]" 1
984 1 62 LEU H 1 63 LYS H 0.000 . 5.000 4.396 4.307 4.474 . 0 0 "[ . 1 . 2]" 1
985 1 63 LYS HA 1 64 VAL HA 0.000 . 5.000 4.454 4.410 4.490 . 0 0 "[ . 1 . 2]" 1
986 1 63 LYS HA 1 64 VAL MG1 0.000 . 6.500 3.218 2.855 3.804 . 0 0 "[ . 1 . 2]" 1
987 1 63 LYS HA 1 64 VAL MG2 0.000 . 6.500 4.113 3.140 5.413 . 0 0 "[ . 1 . 2]" 1
988 1 63 LYS HA 1 64 VAL H 0.000 . 2.700 2.346 2.292 2.401 . 0 0 "[ . 1 . 2]" 1
989 1 63 LYS QB 1 64 VAL H 0.000 . 6.000 2.675 2.555 2.873 . 0 0 "[ . 1 . 2]" 1
990 1 63 LYS QD 1 64 VAL H 0.000 . 6.000 4.964 4.787 5.277 . 0 0 "[ . 1 . 2]" 1
991 1 63 LYS QG 1 64 VAL H 0.000 . 6.000 4.274 3.609 4.474 . 0 0 "[ . 1 . 2]" 1
992 1 63 LYS H 1 64 VAL H 0.000 . 5.000 4.492 4.457 4.527 . 0 0 "[ . 1 . 2]" 1
993 1 64 VAL HA 1 65 THR HA 0.000 . 5.000 4.355 4.320 4.386 . 0 0 "[ . 1 . 2]" 1
994 1 64 VAL HA 1 65 THR H 0.000 . 2.700 2.189 2.154 2.223 . 0 0 "[ . 1 . 2]" 1
995 1 64 VAL HA 1 66 GLN H 0.000 . 5.000 3.840 3.636 4.189 . 0 0 "[ . 1 . 2]" 1
996 1 64 VAL HB 1 65 THR H 0.000 . 5.000 3.128 2.759 3.919 . 0 0 "[ . 1 . 2]" 1
997 1 64 VAL HB 1 66 GLN H 0.000 . 5.000 3.272 2.572 5.003 0.003 2 0 "[ . 1 . 2]" 1
998 1 64 VAL QG 1 65 THR HA 0.000 . 7.400 3.812 3.372 4.316 . 0 0 "[ . 1 . 2]" 1
999 1 64 VAL QG 1 66 GLN QB 0.000 . 8.400 4.221 3.234 4.901 . 0 0 "[ . 1 . 2]" 1
1000 1 64 VAL QG 1 67 PRO HA 0.000 . 7.400 3.195 2.588 3.891 . 0 0 "[ . 1 . 2]" 1
1001 1 64 VAL QG 1 68 LEU QD 0.000 . 9.800 2.856 2.294 3.430 . 0 0 "[ . 1 . 2]" 1
1002 1 64 VAL QG 1 76 TYR QD 0.000 . 9.400 6.065 5.719 6.322 . 0 0 "[ . 1 . 2]" 1
1003 1 64 VAL QG 1 76 TYR QE 0.000 . 9.400 6.127 5.525 6.364 . 0 0 "[ . 1 . 2]" 1
1004 1 64 VAL H 1 64 VAL MG1 0.000 . 4.800 2.498 1.758 3.159 . 0 0 "[ . 1 . 2]" 1
1005 1 64 VAL MG1 1 65 THR H 0.000 . 6.500 3.930 3.510 4.283 . 0 0 "[ . 1 . 2]" 1
1006 1 64 VAL MG1 1 66 GLN H 0.000 . 6.500 4.408 3.855 5.086 . 0 0 "[ . 1 . 2]" 1
1007 1 64 VAL MG1 1 98 ILE MD 0.000 . 8.000 4.839 4.083 5.444 . 0 0 "[ . 1 . 2]" 1
1008 1 64 VAL H 1 64 VAL MG2 0.000 . 4.800 2.482 1.766 3.755 . 0 0 "[ . 1 . 2]" 1
1009 1 64 VAL MG2 1 65 THR H 0.000 . 6.500 3.295 1.886 4.095 . 0 0 "[ . 1 . 2]" 1
1010 1 64 VAL MG2 1 66 GLN H 0.000 . 6.500 3.050 1.808 4.176 . 0 0 "[ . 1 . 2]" 1
1011 1 64 VAL H 1 65 THR HA 0.000 . 5.000 4.909 4.828 5.020 0.020 15 0 "[ . 1 . 2]" 1
1012 1 65 THR HA 1 66 GLN HA 0.000 . 5.000 4.532 4.493 4.586 . 0 0 "[ . 1 . 2]" 1
1013 1 65 THR HA 1 66 GLN H 0.000 . 5.000 3.475 3.417 3.556 . 0 0 "[ . 1 . 2]" 1
1014 1 65 THR HB 1 66 GLN H 0.000 . 5.000 3.702 3.242 4.303 . 0 0 "[ . 1 . 2]" 1
1015 1 65 THR H 1 65 THR MG 0.000 . 4.800 2.642 1.708 3.367 . 0 0 "[ . 1 . 2]" 1
1016 1 65 THR MG 1 66 GLN H 0.000 . 6.500 3.904 2.403 4.318 . 0 0 "[ . 1 . 2]" 1
1017 1 65 THR H 1 66 GLN HB2 0.000 . 5.000 4.475 4.213 4.733 . 0 0 "[ . 1 . 2]" 1
1018 1 65 THR H 1 66 GLN H 0.000 . 3.300 2.162 1.964 2.362 . 0 0 "[ . 1 . 2]" 1
1019 1 66 GLN HA 1 67 PRO HA 0.000 . 5.000 4.434 4.404 4.477 . 0 0 "[ . 1 . 2]" 1
1020 1 66 GLN HA 1 67 PRO QD 0.000 . 3.700 1.942 1.924 1.965 . 0 0 "[ . 1 . 2]" 1
1021 1 66 GLN HA 1 67 PRO QG 0.000 . 6.000 3.884 3.860 3.925 . 0 0 "[ . 1 . 2]" 1
1022 1 66 GLN H 1 66 GLN QB 0.000 . 3.900 2.563 2.277 2.775 . 0 0 "[ . 1 . 2]" 1
1023 1 66 GLN HB3 1 67 PRO QD 0.000 . 4.300 2.685 2.392 3.050 . 0 0 "[ . 1 . 2]" 1
1024 1 66 GLN HB2 1 67 PRO QD 0.000 . 6.000 3.899 3.667 4.126 . 0 0 "[ . 1 . 2]" 1
1025 1 66 GLN QG 1 67 PRO QD 0.000 . 7.000 3.256 2.908 3.598 . 0 0 "[ . 1 . 2]" 1
1026 1 67 PRO HA 1 68 LEU HA 0.000 . 5.000 4.390 4.364 4.444 . 0 0 "[ . 1 . 2]" 1
1027 1 67 PRO HA 1 68 LEU QB 0.000 . 6.000 4.542 4.358 4.677 . 0 0 "[ . 1 . 2]" 1
1028 1 67 PRO HA 1 68 LEU H 0.000 . 3.300 2.454 2.377 2.602 . 0 0 "[ . 1 . 2]" 1
1029 1 67 PRO QB 1 68 LEU HA 0.000 . 6.000 4.273 4.182 4.327 . 0 0 "[ . 1 . 2]" 1
1030 1 67 PRO QB 1 68 LEU H 0.000 . 6.000 2.629 2.370 2.847 . 0 0 "[ . 1 . 2]" 1
1031 1 68 LEU HA 1 69 ASP HA 0.000 . 5.000 4.490 4.407 4.531 . 0 0 "[ . 1 . 2]" 1
1032 1 68 LEU HA 1 69 ASP HB3 0.000 . 5.000 4.494 4.306 4.679 . 0 0 "[ . 1 . 2]" 1
1033 1 68 LEU HA 1 69 ASP HB2 0.000 . 5.000 4.295 4.085 4.468 . 0 0 "[ . 1 . 2]" 1
1034 1 68 LEU HA 1 69 ASP H 0.000 . 3.300 2.406 2.199 2.488 . 0 0 "[ . 1 . 2]" 1
1035 1 68 LEU HA 1 100 VAL MG1 0.000 . 6.500 4.710 4.292 5.025 . 0 0 "[ . 1 . 2]" 1
1036 1 68 LEU HA 1 100 VAL MG2 0.000 . 6.500 4.469 4.204 4.728 . 0 0 "[ . 1 . 2]" 1
1037 1 68 LEU H 1 68 LEU QB 0.000 . 3.900 2.405 2.213 2.558 . 0 0 "[ . 1 . 2]" 1
1038 1 68 LEU QB 1 69 ASP H 0.000 . 4.300 2.419 2.297 2.813 . 0 0 "[ . 1 . 2]" 1
1039 1 68 LEU QD 1 73 ILE MG 0.000 . 8.900 4.134 3.728 4.606 . 0 0 "[ . 1 . 2]" 1
1040 1 68 LEU QD 1 76 TYR QD 0.000 . 9.400 2.627 2.433 2.854 . 0 0 "[ . 1 . 2]" 1
1041 1 68 LEU QD 1 76 TYR QE 0.000 . 9.400 2.397 2.083 2.943 . 0 0 "[ . 1 . 2]" 1
1042 1 68 LEU HA 1 68 LEU MD1 0.000 . 4.800 3.166 2.122 3.721 . 0 0 "[ . 1 . 2]" 1
1043 1 68 LEU MD1 1 69 ASP H 0.000 . 6.500 4.039 2.475 4.690 . 0 0 "[ . 1 . 2]" 1
1044 1 68 LEU HA 1 68 LEU MD2 0.000 . 4.200 2.458 1.919 3.618 . 0 0 "[ . 1 . 2]" 1
1045 1 68 LEU MD2 1 69 ASP H 0.000 . 4.800 3.727 3.321 4.018 . 0 0 "[ . 1 . 2]" 1
1046 1 68 LEU HG 1 69 ASP H 0.000 . 5.000 4.579 3.533 5.072 0.072 15 0 "[ . 1 . 2]" 1
1047 1 69 ASP HA 1 70 ARG HA 0.000 . 5.000 4.492 4.436 4.546 . 0 0 "[ . 1 . 2]" 1
1048 1 69 ASP HA 1 70 ARG QB 0.000 . 6.000 4.117 3.997 4.321 . 0 0 "[ . 1 . 2]" 1
1049 1 69 ASP HA 1 70 ARG H 0.000 . 3.300 2.190 2.133 2.264 . 0 0 "[ . 1 . 2]" 1
1050 1 69 ASP HA 1 71 GLU QB 0.000 . 6.000 4.659 4.471 4.779 . 0 0 "[ . 1 . 2]" 1
1051 1 69 ASP HA 1 71 GLU H 0.000 . 5.000 3.436 3.212 3.657 . 0 0 "[ . 1 . 2]" 1
1052 1 69 ASP HA 1 72 ALA MB 0.000 . 6.500 4.743 4.410 5.032 . 0 0 "[ . 1 . 2]" 1
1053 1 69 ASP HA 1 73 ILE H 0.000 . 5.000 5.000 4.928 5.053 0.053 3 0 "[ . 1 . 2]" 1
1054 1 69 ASP QB 1 70 ARG HA 0.000 . 6.000 4.960 4.857 5.109 . 0 0 "[ . 1 . 2]" 1
1055 1 69 ASP HB3 1 70 ARG H 0.000 . 5.000 4.423 4.268 4.503 . 0 0 "[ . 1 . 2]" 1
1056 1 69 ASP HB3 1 71 GLU H 0.000 . 5.000 4.214 3.671 4.482 . 0 0 "[ . 1 . 2]" 1
1057 1 69 ASP HB3 1 72 ALA MB 0.000 . 6.500 2.429 2.095 2.804 . 0 0 "[ . 1 . 2]" 1
1058 1 69 ASP HB3 1 72 ALA H 0.000 . 5.000 3.095 2.575 3.549 . 0 0 "[ . 1 . 2]" 1
1059 1 69 ASP HB2 1 70 ARG H 0.000 . 5.000 4.510 4.431 4.587 . 0 0 "[ . 1 . 2]" 1
1060 1 69 ASP HB2 1 71 GLU H 0.000 . 5.000 4.675 4.557 4.853 . 0 0 "[ . 1 . 2]" 1
1061 1 69 ASP HB2 1 72 ALA MB 0.000 . 6.500 3.775 3.398 4.177 . 0 0 "[ . 1 . 2]" 1
1062 1 69 ASP HB2 1 72 ALA H 0.000 . 5.000 4.391 4.195 4.724 . 0 0 "[ . 1 . 2]" 1
1063 1 69 ASP H 1 70 ARG H 0.000 . 5.000 3.891 3.729 4.024 . 0 0 "[ . 1 . 2]" 1
1064 1 70 ARG HA 1 71 GLU HA 0.000 . 5.000 4.791 4.724 4.900 . 0 0 "[ . 1 . 2]" 1
1065 1 70 ARG HA 1 71 GLU H 0.000 . 5.000 3.483 3.419 3.527 . 0 0 "[ . 1 . 2]" 1
1066 1 70 ARG HA 1 73 ILE MG 0.000 . 6.500 4.970 4.784 5.273 . 0 0 "[ . 1 . 2]" 1
1067 1 70 ARG HA 1 74 ALA HA 0.000 . 5.000 2.652 2.225 3.312 . 0 0 "[ . 1 . 2]" 1
1068 1 70 ARG HA 1 100 VAL HB 0.000 . 5.000 3.739 3.228 4.143 . 0 0 "[ . 1 . 2]" 1
1069 1 70 ARG HA 1 100 VAL MG1 0.000 . 6.500 2.953 2.162 3.724 . 0 0 "[ . 1 . 2]" 1
1070 1 70 ARG HA 1 100 VAL MG2 0.000 . 6.500 3.505 3.050 4.322 . 0 0 "[ . 1 . 2]" 1
1071 1 70 ARG QB 1 71 GLU HA 0.000 . 6.000 3.888 3.774 4.015 . 0 0 "[ . 1 . 2]" 1
1072 1 70 ARG QB 1 71 GLU H 0.000 . 3.700 2.840 2.631 3.056 . 0 0 "[ . 1 . 2]" 1
1073 1 70 ARG QB 1 74 ALA HA 0.000 . 6.000 4.237 3.626 4.992 . 0 0 "[ . 1 . 2]" 1
1074 1 70 ARG QB 1 100 VAL MG1 0.000 . 5.800 2.985 2.037 4.175 . 0 0 "[ . 1 . 2]" 1
1075 1 70 ARG QB 1 100 VAL MG2 0.000 . 7.500 4.596 3.951 5.454 . 0 0 "[ . 1 . 2]" 1
1076 1 70 ARG QB 1 102 ASP HA 0.000 . 6.000 4.265 2.893 5.381 . 0 0 "[ . 1 . 2]" 1
1077 1 70 ARG QD 1 74 ALA HA 0.000 . 6.000 4.521 3.484 5.151 . 0 0 "[ . 1 . 2]" 1
1078 1 70 ARG QD 1 74 ALA MB 0.000 . 7.500 3.918 2.649 4.850 . 0 0 "[ . 1 . 2]" 1
1079 1 70 ARG QD 1 100 VAL HB 0.000 . 6.000 4.243 3.119 4.836 . 0 0 "[ . 1 . 2]" 1
1080 1 70 ARG QD 1 100 VAL MG1 0.000 . 7.500 3.408 2.373 4.349 . 0 0 "[ . 1 . 2]" 1
1081 1 70 ARG QD 1 100 VAL MG2 0.000 . 7.500 5.140 4.286 5.600 . 0 0 "[ . 1 . 2]" 1
1082 1 70 ARG QD 1 101 THR HA 0.000 . 6.000 4.482 3.492 5.277 . 0 0 "[ . 1 . 2]" 1
1083 1 70 ARG QD 1 102 ASP HA 0.000 . 6.000 3.456 2.183 5.002 . 0 0 "[ . 1 . 2]" 1
1084 1 70 ARG QG 1 71 GLU H 0.000 . 6.000 4.298 3.932 4.526 . 0 0 "[ . 1 . 2]" 1
1085 1 70 ARG QG 1 73 ILE H 0.000 . 6.000 5.163 4.690 5.393 . 0 0 "[ . 1 . 2]" 1
1086 1 70 ARG QG 1 100 VAL HB 0.000 . 6.000 2.738 2.265 3.202 . 0 0 "[ . 1 . 2]" 1
1087 1 70 ARG QG 1 101 THR HA 0.000 . 6.000 4.897 3.673 5.172 . 0 0 "[ . 1 . 2]" 1
1088 1 70 ARG H 1 71 GLU H 0.000 . 3.300 2.730 2.620 2.862 . 0 0 "[ . 1 . 2]" 1
1089 1 70 ARG H 1 100 VAL QG 0.000 . 7.400 2.965 2.507 3.440 . 0 0 "[ . 1 . 2]" 1
1090 1 71 GLU HA 1 72 ALA HA 0.000 . 5.000 4.600 4.540 4.628 . 0 0 "[ . 1 . 2]" 1
1091 1 71 GLU HA 1 72 ALA H 0.000 . 5.000 3.473 3.399 3.519 . 0 0 "[ . 1 . 2]" 1
1092 1 71 GLU H 1 71 GLU QB 0.000 . 3.900 2.446 2.255 2.654 . 0 0 "[ . 1 . 2]" 1
1093 1 71 GLU HB3 1 72 ALA HA 0.000 . 5.000 4.574 4.307 4.895 . 0 0 "[ . 1 . 2]" 1
1094 1 71 GLU HB3 1 72 ALA MB 0.000 . 6.500 4.486 4.225 4.817 . 0 0 "[ . 1 . 2]" 1
1095 1 71 GLU HB3 1 72 ALA H 0.000 . 5.000 3.857 3.546 4.159 . 0 0 "[ . 1 . 2]" 1
1096 1 71 GLU HB2 1 72 ALA HA 0.000 . 5.000 4.543 4.207 4.878 . 0 0 "[ . 1 . 2]" 1
1097 1 71 GLU HB2 1 72 ALA H 0.000 . 5.000 2.895 2.696 3.203 . 0 0 "[ . 1 . 2]" 1
1098 1 71 GLU QG 1 72 ALA MB 0.000 . 7.500 5.075 4.724 5.300 . 0 0 "[ . 1 . 2]" 1
1099 1 71 GLU QG 1 72 ALA H 0.000 . 6.000 4.060 3.678 4.388 . 0 0 "[ . 1 . 2]" 1
1100 1 71 GLU H 1 72 ALA H 0.000 . 2.700 2.580 2.449 2.729 0.029 11 0 "[ . 1 . 2]" 1
1101 1 71 GLU H 1 73 ILE H 0.000 . 5.000 4.268 4.051 4.496 . 0 0 "[ . 1 . 2]" 1
1102 1 72 ALA HA 1 73 ILE HA 0.000 . 5.000 4.565 4.541 4.580 . 0 0 "[ . 1 . 2]" 1
1103 1 72 ALA HA 1 73 ILE H 0.000 . 5.000 3.552 3.534 3.567 . 0 0 "[ . 1 . 2]" 1
1104 1 72 ALA MB 1 73 ILE HA 0.000 . 6.500 4.122 3.993 4.197 . 0 0 "[ . 1 . 2]" 1
1105 1 72 ALA MB 1 73 ILE HB 0.000 . 6.500 3.531 3.206 3.868 . 0 0 "[ . 1 . 2]" 1
1106 1 72 ALA MB 1 73 ILE MG 0.000 . 8.000 4.523 4.458 4.574 . 0 0 "[ . 1 . 2]" 1
1107 1 72 ALA MB 1 73 ILE H 0.000 . 4.200 2.260 2.053 2.559 . 0 0 "[ . 1 . 2]" 1
1108 1 73 ILE HA 1 74 ALA HA 0.000 . 5.000 4.428 4.393 4.587 . 0 0 "[ . 1 . 2]" 1
1109 1 73 ILE HA 1 74 ALA MB 0.000 . 6.500 3.938 3.757 4.037 . 0 0 "[ . 1 . 2]" 1
1110 1 73 ILE HA 1 74 ALA H 0.000 . 2.700 2.213 2.131 2.686 . 0 0 "[ . 1 . 2]" 1
1111 1 73 ILE HA 1 75 LYS H 0.000 . 5.000 3.608 3.306 4.221 . 0 0 "[ . 1 . 2]" 1
1112 1 73 ILE HB 1 74 ALA H 0.000 . 5.000 4.103 2.923 4.411 . 0 0 "[ . 1 . 2]" 1
1113 1 73 ILE HB 1 75 LYS H 0.000 . 5.000 4.074 3.705 4.501 . 0 0 "[ . 1 . 2]" 1
1114 1 73 ILE HA 1 73 ILE MD 0.000 . 4.800 3.574 2.155 3.874 . 0 0 "[ . 1 . 2]" 1
1115 1 73 ILE MD 1 74 ALA H 0.000 . 6.500 4.808 3.501 5.329 . 0 0 "[ . 1 . 2]" 1
1116 1 73 ILE MD 1 75 LYS H 0.000 . 6.500 4.621 3.876 5.002 . 0 0 "[ . 1 . 2]" 1
1117 1 73 ILE MD 1 76 TYR HA 0.000 . 6.500 4.118 3.555 5.169 . 0 0 "[ . 1 . 2]" 1
1118 1 73 ILE MD 1 76 TYR QD 0.000 . 8.500 3.702 3.122 5.108 . 0 0 "[ . 1 . 2]" 1
1119 1 73 ILE MD 1 76 TYR QE 0.000 . 8.500 3.026 2.283 4.514 . 0 0 "[ . 1 . 2]" 1
1120 1 73 ILE MD 1 100 VAL QG 0.000 . 8.900 4.849 4.117 5.182 . 0 0 "[ . 1 . 2]" 1
1121 1 73 ILE QG 1 74 ALA H 0.000 . 6.000 4.101 3.870 4.714 . 0 0 "[ . 1 . 2]" 1
1122 1 73 ILE MG 1 74 ALA HA 0.000 . 6.500 3.830 3.632 4.203 . 0 0 "[ . 1 . 2]" 1
1123 1 73 ILE MG 1 74 ALA MB 0.000 . 8.000 3.849 3.355 4.270 . 0 0 "[ . 1 . 2]" 1
1124 1 73 ILE MG 1 74 ALA H 0.000 . 4.800 2.494 1.506 3.107 . 0 0 "[ . 1 . 2]" 1
1125 1 73 ILE MG 1 75 LYS HB2 0.000 . 6.500 4.625 4.282 4.993 . 0 0 "[ . 1 . 2]" 1
1126 1 73 ILE MG 1 75 LYS H 0.000 . 4.200 1.793 1.646 2.234 . 0 0 "[ . 1 . 2]" 1
1127 1 73 ILE MG 1 76 TYR HA 0.000 . 6.500 2.962 2.661 3.579 . 0 0 "[ . 1 . 2]" 1
1128 1 73 ILE MG 1 76 TYR QD 0.000 . 8.500 2.805 2.405 3.381 . 0 0 "[ . 1 . 2]" 1
1129 1 73 ILE MG 1 76 TYR QE 0.000 . 6.800 2.729 2.395 3.179 . 0 0 "[ . 1 . 2]" 1
1130 1 73 ILE MG 1 100 VAL HB 0.000 . 6.500 5.057 4.720 5.261 . 0 0 "[ . 1 . 2]" 1
1131 1 73 ILE MG 1 100 VAL MG2 0.000 . 8.000 3.130 2.886 3.482 . 0 0 "[ . 1 . 2]" 1
1132 1 73 ILE H 1 74 ALA H 0.000 . 5.000 4.261 4.098 4.459 . 0 0 "[ . 1 . 2]" 1
1133 1 73 ILE H 1 76 TYR QE 0.000 . 7.000 4.262 3.677 4.897 . 0 0 "[ . 1 . 2]" 1
1134 1 74 ALA HA 1 75 LYS HA 0.000 . 5.000 4.473 4.412 4.526 . 0 0 "[ . 1 . 2]" 1
1135 1 74 ALA HA 1 75 LYS H 0.000 . 5.000 3.330 3.203 3.466 . 0 0 "[ . 1 . 2]" 1
1136 1 74 ALA HA 1 100 VAL HB 0.000 . 3.300 2.377 2.199 2.691 . 0 0 "[ . 1 . 2]" 1
1137 1 74 ALA HA 1 100 VAL MG1 0.000 . 4.800 3.350 2.977 3.580 . 0 0 "[ . 1 . 2]" 1
1138 1 74 ALA HA 1 100 VAL MG2 0.000 . 4.800 2.495 2.082 3.249 . 0 0 "[ . 1 . 2]" 1
1139 1 74 ALA MB 1 75 LYS HA 0.000 . 6.500 4.332 4.229 4.382 . 0 0 "[ . 1 . 2]" 1
1140 1 74 ALA MB 1 75 LYS QG 0.000 . 7.500 5.058 4.885 5.191 . 0 0 "[ . 1 . 2]" 1
1141 1 74 ALA MB 1 75 LYS H 0.000 . 4.800 3.120 2.752 3.352 . 0 0 "[ . 1 . 2]" 1
1142 1 74 ALA MB 1 100 VAL HB 0.000 . 6.500 3.396 2.793 3.662 . 0 0 "[ . 1 . 2]" 1
1143 1 74 ALA H 1 75 LYS H 0.000 . 2.700 2.209 1.543 2.448 . 0 0 "[ . 1 . 2]" 1
1144 1 75 LYS HA 1 76 TYR HA 0.000 . 5.000 4.425 4.409 4.451 . 0 0 "[ . 1 . 2]" 1
1145 1 75 LYS HA 1 76 TYR QB 0.000 . 6.000 4.329 4.247 4.424 . 0 0 "[ . 1 . 2]" 1
1146 1 75 LYS HA 1 76 TYR QD 0.000 . 7.000 2.898 2.674 3.103 . 0 0 "[ . 1 . 2]" 1
1147 1 75 LYS HA 1 76 TYR H 0.000 . 2.700 2.137 2.112 2.158 . 0 0 "[ . 1 . 2]" 1
1148 1 75 LYS HA 1 99 THR HA 0.000 . 2.700 2.275 2.162 2.459 . 0 0 "[ . 1 . 2]" 1
1149 1 75 LYS HA 1 99 THR HB 0.000 . 5.000 4.824 4.626 4.970 . 0 0 "[ . 1 . 2]" 1
1150 1 75 LYS HA 1 100 VAL MG2 0.000 . 6.500 2.623 2.274 2.908 . 0 0 "[ . 1 . 2]" 1
1151 1 75 LYS HA 1 100 VAL H 0.000 . 3.300 2.869 2.664 3.087 . 0 0 "[ . 1 . 2]" 1
1152 1 75 LYS H 1 75 LYS QB 0.000 . 3.900 2.746 2.613 2.809 . 0 0 "[ . 1 . 2]" 1
1153 1 75 LYS QB 1 76 TYR HA 0.000 . 6.000 4.785 4.610 4.864 . 0 0 "[ . 1 . 2]" 1
1154 1 75 LYS QB 1 97 VAL QG 0.000 . 8.400 4.102 3.694 4.490 . 0 0 "[ . 1 . 2]" 1
1155 1 75 LYS HB3 1 76 TYR H 0.000 . 5.000 4.348 4.158 4.454 . 0 0 "[ . 1 . 2]" 1
1156 1 75 LYS HB3 1 99 THR HA 0.000 . 5.000 4.363 4.238 4.532 . 0 0 "[ . 1 . 2]" 1
1157 1 75 LYS HB3 1 100 VAL H 0.000 . 5.000 5.040 5.004 5.075 0.075 7 0 "[ . 1 . 2]" 1
1158 1 75 LYS HB2 1 76 TYR H 0.000 . 5.000 4.207 4.052 4.430 . 0 0 "[ . 1 . 2]" 1
1159 1 75 LYS HB2 1 99 THR HA 0.000 . 5.000 2.920 2.768 3.343 . 0 0 "[ . 1 . 2]" 1
1160 1 75 LYS HA 1 75 LYS QE 0.000 . 6.000 4.436 3.568 5.067 . 0 0 "[ . 1 . 2]" 1
1161 1 75 LYS QG 1 76 TYR HA 0.000 . 6.000 3.816 3.663 4.328 . 0 0 "[ . 1 . 2]" 1
1162 1 75 LYS QG 1 76 TYR H 0.000 . 6.000 2.755 2.365 2.954 . 0 0 "[ . 1 . 2]" 1
1163 1 75 LYS QG 1 77 ILE H 0.000 . 6.000 4.498 4.061 5.127 . 0 0 "[ . 1 . 2]" 1
1164 1 75 LYS QG 1 99 THR HA 0.000 . 6.000 2.854 2.171 3.344 . 0 0 "[ . 1 . 2]" 1
1165 1 75 LYS H 1 76 TYR HA 0.000 . 5.000 4.535 4.465 4.676 . 0 0 "[ . 1 . 2]" 1
1166 1 75 LYS H 1 76 TYR H 0.000 . 5.000 4.073 3.980 4.187 . 0 0 "[ . 1 . 2]" 1
1167 1 76 TYR HA 1 77 ILE HA 0.000 . 5.000 4.434 4.415 4.466 . 0 0 "[ . 1 . 2]" 1
1168 1 76 TYR HA 1 77 ILE HB 0.000 . 5.000 4.573 4.358 4.775 . 0 0 "[ . 1 . 2]" 1
1169 1 76 TYR HA 1 77 ILE H 0.000 . 2.700 2.190 2.130 2.265 . 0 0 "[ . 1 . 2]" 1
1170 1 76 TYR HA 1 98 ILE HB 0.000 . 5.000 4.710 4.600 4.845 . 0 0 "[ . 1 . 2]" 1
1171 1 76 TYR HA 1 98 ILE MD 0.000 . 6.500 5.186 4.994 5.300 . 0 0 "[ . 1 . 2]" 1
1172 1 76 TYR QB 1 77 ILE H 0.000 . 6.000 2.972 2.767 3.206 . 0 0 "[ . 1 . 2]" 1
1173 1 76 TYR QB 1 98 ILE MD 0.000 . 7.500 2.814 2.592 3.057 . 0 0 "[ . 1 . 2]" 1
1174 1 76 TYR QB 1 98 ILE MG 0.000 . 7.500 3.020 2.493 3.466 . 0 0 "[ . 1 . 2]" 1
1175 1 76 TYR QB 1 100 VAL QG 0.000 . 8.400 4.150 3.677 4.687 . 0 0 "[ . 1 . 2]" 1
1176 1 76 TYR HB3 1 77 ILE HA 0.000 . 5.000 4.612 4.376 4.865 . 0 0 "[ . 1 . 2]" 1
1177 1 76 TYR HB3 1 78 LEU MD1 0.000 . 6.500 3.750 3.083 4.422 . 0 0 "[ . 1 . 2]" 1
1178 1 76 TYR HB3 1 98 ILE HB 0.000 . 5.000 3.652 3.456 3.938 . 0 0 "[ . 1 . 2]" 1
1179 1 76 TYR HB3 1 98 ILE H 0.000 . 5.000 4.925 4.804 5.044 0.044 14 0 "[ . 1 . 2]" 1
1180 1 76 TYR HB2 1 77 ILE HA 0.000 . 5.000 4.906 4.755 5.013 0.013 18 0 "[ . 1 . 2]" 1
1181 1 76 TYR HB2 1 78 LEU MD1 0.000 . 6.500 4.628 3.870 5.416 . 0 0 "[ . 1 . 2]" 1
1182 1 76 TYR HB2 1 98 ILE HB 0.000 . 5.000 2.275 2.178 2.386 . 0 0 "[ . 1 . 2]" 1
1183 1 76 TYR HB2 1 98 ILE H 0.000 . 5.000 4.022 3.761 4.182 . 0 0 "[ . 1 . 2]" 1
1184 1 76 TYR QD 1 77 ILE H 0.000 . 7.000 4.300 4.093 4.609 . 0 0 "[ . 1 . 2]" 1
1185 1 76 TYR QD 1 78 LEU MD1 0.000 . 8.500 4.500 3.907 5.031 . 0 0 "[ . 1 . 2]" 1
1186 1 76 TYR QD 1 98 ILE HB 0.000 . 7.000 4.071 3.394 4.403 . 0 0 "[ . 1 . 2]" 1
1187 1 76 TYR QD 1 98 ILE MD 0.000 . 8.500 4.510 4.254 4.726 . 0 0 "[ . 1 . 2]" 1
1188 1 76 TYR QD 1 98 ILE QG 0.000 . 8.000 5.646 5.237 5.883 . 0 0 "[ . 1 . 2]" 1
1189 1 76 TYR QD 1 98 ILE MG 0.000 . 8.500 3.733 2.927 4.583 . 0 0 "[ . 1 . 2]" 1
1190 1 76 TYR QD 1 99 THR HA 0.000 . 7.000 4.554 4.174 4.864 . 0 0 "[ . 1 . 2]" 1
1191 1 76 TYR QD 1 100 VAL MG2 0.000 . 8.500 2.427 2.131 2.850 . 0 0 "[ . 1 . 2]" 1
1192 1 76 TYR QD 1 100 VAL H 0.000 . 7.000 4.587 4.468 4.759 . 0 0 "[ . 1 . 2]" 1
1193 1 76 TYR QE 1 98 ILE MD 0.000 . 8.500 6.021 5.700 6.290 . 0 0 "[ . 1 . 2]" 1
1194 1 76 TYR QE 1 98 ILE MG 0.000 . 8.500 5.124 4.535 5.851 . 0 0 "[ . 1 . 2]" 1
1195 1 76 TYR QE 1 100 VAL MG2 0.000 . 8.500 2.022 1.902 2.159 . 0 0 "[ . 1 . 2]" 1
1196 1 76 TYR H 1 77 ILE H 0.000 . 5.000 4.537 4.412 4.577 . 0 0 "[ . 1 . 2]" 1
1197 1 76 TYR H 1 98 ILE MG 0.000 . 6.500 3.428 2.649 4.086 . 0 0 "[ . 1 . 2]" 1
1198 1 76 TYR H 1 98 ILE H 0.000 . 5.000 3.655 3.364 3.932 . 0 0 "[ . 1 . 2]" 1
1199 1 77 ILE HA 1 78 LEU QB 0.000 . 6.000 4.132 3.858 4.668 . 0 0 "[ . 1 . 2]" 1
1200 1 77 ILE HA 1 78 LEU QD 0.000 . 7.400 3.900 3.043 4.593 . 0 0 "[ . 1 . 2]" 1
1201 1 77 ILE HA 1 78 LEU H 0.000 . 5.000 2.179 2.136 2.238 . 0 0 "[ . 1 . 2]" 1
1202 1 77 ILE HA 1 96 ILE MG 0.000 . 6.500 4.366 3.799 4.707 . 0 0 "[ . 1 . 2]" 1
1203 1 77 ILE H 1 77 ILE HB 0.000 . 3.300 2.569 2.343 2.688 . 0 0 "[ . 1 . 2]" 1
1204 1 77 ILE HB 1 78 LEU H 0.000 . 5.000 4.199 3.843 4.422 . 0 0 "[ . 1 . 2]" 1
1205 1 77 ILE HA 1 77 ILE MD 0.000 . 4.800 3.660 2.151 3.948 . 0 0 "[ . 1 . 2]" 1
1206 1 77 ILE MD 1 78 LEU H 0.000 . 6.500 4.963 3.265 5.442 . 0 0 "[ . 1 . 2]" 1
1207 1 77 ILE MD 1 79 TYR QD 0.000 . 8.500 5.803 5.257 6.295 . 0 0 "[ . 1 . 2]" 1
1208 1 77 ILE QG 1 97 VAL HA 0.000 . 6.000 3.601 2.780 4.442 . 0 0 "[ . 1 . 2]" 1
1209 1 77 ILE MG 1 78 LEU HA 0.000 . 6.500 3.703 3.324 4.196 . 0 0 "[ . 1 . 2]" 1
1210 1 77 ILE MG 1 78 LEU H 0.000 . 6.500 2.668 2.196 3.212 . 0 0 "[ . 1 . 2]" 1
1211 1 77 ILE MG 1 79 TYR QB 0.000 . 7.500 5.123 4.650 5.379 . 0 0 "[ . 1 . 2]" 1
1212 1 77 ILE MG 1 79 TYR QD 0.000 . 6.800 3.552 2.869 4.192 . 0 0 "[ . 1 . 2]" 1
1213 1 77 ILE MG 1 95 GLU HA 0.000 . 6.500 4.092 3.666 4.382 . 0 0 "[ . 1 . 2]" 1
1214 1 77 ILE H 1 78 LEU H 0.000 . 5.000 4.376 4.124 4.549 . 0 0 "[ . 1 . 2]" 1
1215 1 78 LEU HA 1 79 TYR HA 0.000 . 5.000 4.443 4.394 4.497 . 0 0 "[ . 1 . 2]" 1
1216 1 78 LEU HA 1 79 TYR QD 0.000 . 7.000 3.193 2.701 3.733 . 0 0 "[ . 1 . 2]" 1
1217 1 78 LEU HA 1 79 TYR H 0.000 . 2.700 2.285 2.144 2.450 . 0 0 "[ . 1 . 2]" 1
1218 1 78 LEU HA 1 96 ILE MG 0.000 . 6.500 5.127 4.758 5.334 . 0 0 "[ . 1 . 2]" 1
1219 1 78 LEU HA 1 98 ILE MD 0.000 . 6.500 4.860 4.490 5.294 . 0 0 "[ . 1 . 2]" 1
1220 1 78 LEU H 1 78 LEU QB 0.000 . 3.900 2.513 2.259 2.846 . 0 0 "[ . 1 . 2]" 1
1221 1 78 LEU QB 1 79 TYR HA 0.000 . 6.000 4.164 3.967 4.360 . 0 0 "[ . 1 . 2]" 1
1222 1 78 LEU QB 1 79 TYR H 0.000 . 4.300 2.926 2.267 3.556 . 0 0 "[ . 1 . 2]" 1
1223 1 78 LEU QB 1 96 ILE MD 0.000 . 7.500 3.059 2.564 3.415 . 0 0 "[ . 1 . 2]" 1
1224 1 78 LEU QB 1 96 ILE MG 0.000 . 5.800 2.722 2.414 3.291 . 0 0 "[ . 1 . 2]" 1
1225 1 78 LEU QB 1 98 ILE MD 0.000 . 7.500 2.661 2.178 3.524 . 0 0 "[ . 1 . 2]" 1
1226 1 78 LEU QD 1 79 TYR HA 0.000 . 7.400 5.002 4.767 5.372 . 0 0 "[ . 1 . 2]" 1
1227 1 78 LEU QD 1 96 ILE HB 0.000 . 7.400 3.786 3.290 4.337 . 0 0 "[ . 1 . 2]" 1
1228 1 78 LEU QD 1 96 ILE MD 0.000 . 8.900 3.667 3.006 4.652 . 0 0 "[ . 1 . 2]" 1
1229 1 78 LEU QD 1 96 ILE QG 0.000 . 8.400 4.968 4.427 5.558 . 0 0 "[ . 1 . 2]" 1
1230 1 78 LEU HA 1 78 LEU MD1 0.000 . 4.800 2.450 1.989 3.989 . 0 0 "[ . 1 . 2]" 1
1231 1 78 LEU H 1 78 LEU MD1 0.000 . 4.800 3.806 3.278 4.016 . 0 0 "[ . 1 . 2]" 1
1232 1 78 LEU MD1 1 79 TYR H 0.000 . 6.500 3.456 2.518 4.936 . 0 0 "[ . 1 . 2]" 1
1233 1 78 LEU MD1 1 96 ILE MD 0.000 . 8.000 4.743 3.211 5.388 . 0 0 "[ . 1 . 2]" 1
1234 1 78 LEU MD1 1 96 ILE MG 0.000 . 8.000 4.229 2.120 4.999 . 0 0 "[ . 1 . 2]" 1
1235 1 78 LEU MD1 1 98 ILE MD 0.000 . 8.000 3.074 1.750 4.044 . 0 0 "[ . 1 . 2]" 1
1236 1 78 LEU MD2 1 79 TYR H 0.000 . 6.500 4.097 3.289 4.607 . 0 0 "[ . 1 . 2]" 1
1237 1 78 LEU MD2 1 96 ILE MD 0.000 . 8.000 4.191 3.033 5.411 . 0 0 "[ . 1 . 2]" 1
1238 1 78 LEU MD2 1 96 ILE MG 0.000 . 8.000 3.684 3.126 4.903 . 0 0 "[ . 1 . 2]" 1
1239 1 78 LEU MD2 1 98 ILE HB 0.000 . 6.500 4.660 3.400 5.461 . 0 0 "[ . 1 . 2]" 1
1240 1 78 LEU MD2 1 98 ILE MD 0.000 . 6.300 2.625 2.053 3.699 . 0 0 "[ . 1 . 2]" 1
1241 1 78 LEU H 1 78 LEU HG 0.000 . 5.000 4.139 2.199 4.794 . 0 0 "[ . 1 . 2]" 1
1242 1 78 LEU HG 1 79 TYR H 0.000 . 5.000 3.694 2.257 5.016 0.016 10 0 "[ . 1 . 2]" 1
1243 1 78 LEU HG 1 98 ILE MD 0.000 . 6.500 3.622 2.264 4.700 . 0 0 "[ . 1 . 2]" 1
1244 1 78 LEU H 1 96 ILE H 0.000 . 5.000 3.386 2.587 3.829 . 0 0 "[ . 1 . 2]" 1
1245 1 78 LEU H 1 97 VAL HA 0.000 . 5.000 3.694 3.476 3.949 . 0 0 "[ . 1 . 2]" 1
1246 1 79 TYR HA 1 80 SER HA 0.000 . 5.000 4.444 4.415 4.487 . 0 0 "[ . 1 . 2]" 1
1247 1 79 TYR HA 1 80 SER H 0.000 . 3.300 2.218 2.150 2.331 . 0 0 "[ . 1 . 2]" 1
1248 1 79 TYR HA 1 94 MET QB 0.000 . 6.000 4.612 4.413 4.788 . 0 0 "[ . 1 . 2]" 1
1249 1 79 TYR HA 1 94 MET H 0.000 . 5.000 4.679 4.304 4.953 . 0 0 "[ . 1 . 2]" 1
1250 1 79 TYR HA 1 95 GLU HA 0.000 . 2.700 2.397 2.198 2.619 . 0 0 "[ . 1 . 2]" 1
1251 1 79 TYR HA 1 95 GLU QB 0.000 . 6.000 4.089 3.803 4.595 . 0 0 "[ . 1 . 2]" 1
1252 1 79 TYR HA 1 96 ILE H 0.000 . 5.000 2.983 2.690 3.499 . 0 0 "[ . 1 . 2]" 1
1253 1 79 TYR QB 1 80 SER HA 0.000 . 6.000 4.150 3.956 4.318 . 0 0 "[ . 1 . 2]" 1
1254 1 79 TYR HB3 1 80 SER H 0.000 . 5.000 3.228 2.878 3.555 . 0 0 "[ . 1 . 2]" 1
1255 1 79 TYR HB3 1 81 HIS HE1 0.000 . 5.000 4.342 3.706 5.018 0.018 1 0 "[ . 1 . 2]" 1
1256 1 79 TYR HB2 1 80 SER H 0.000 . 5.000 4.258 4.087 4.400 . 0 0 "[ . 1 . 2]" 1
1257 1 79 TYR QD 1 80 SER H 0.000 . 7.000 4.015 3.476 4.503 . 0 0 "[ . 1 . 2]" 1
1258 1 79 TYR QD 1 94 MET HA 0.000 . 7.000 5.337 4.744 6.382 . 0 0 "[ . 1 . 2]" 1
1259 1 79 TYR QD 1 95 GLU HA 0.000 . 5.300 3.561 3.074 3.975 . 0 0 "[ . 1 . 2]" 1
1260 1 79 TYR QD 1 95 GLU QB 0.000 . 6.300 3.825 3.012 4.698 . 0 0 "[ . 1 . 2]" 1
1261 1 79 TYR QD 1 95 GLU QG 0.000 . 6.300 4.101 2.913 5.072 . 0 0 "[ . 1 . 2]" 1
1262 1 79 TYR QE 1 95 GLU HA 0.000 . 7.000 4.174 3.710 4.582 . 0 0 "[ . 1 . 2]" 1
1263 1 80 SER HA 1 81 HIS HA 0.000 . 5.000 4.456 4.436 4.484 . 0 0 "[ . 1 . 2]" 1
1264 1 80 SER HA 1 81 HIS QB 0.000 . 6.000 4.400 4.281 4.560 . 0 0 "[ . 1 . 2]" 1
1265 1 80 SER HA 1 81 HIS HD2 0.000 . 3.300 2.488 2.181 3.079 . 0 0 "[ . 1 . 2]" 1
1266 1 80 SER HA 1 81 HIS H 0.000 . 2.700 2.253 2.197 2.300 . 0 0 "[ . 1 . 2]" 1
1267 1 80 SER HA 1 96 ILE MD 0.000 . 6.500 4.379 4.030 4.793 . 0 0 "[ . 1 . 2]" 1
1268 1 80 SER HB3 1 81 HIS H 0.000 . 5.000 3.912 3.648 4.004 . 0 0 "[ . 1 . 2]" 1
1269 1 80 SER HB3 1 94 MET QB 0.000 . 6.000 4.004 3.655 4.485 . 0 0 "[ . 1 . 2]" 1
1270 1 80 SER HB3 1 96 ILE MD 0.000 . 6.500 2.278 2.040 2.674 . 0 0 "[ . 1 . 2]" 1
1271 1 80 SER HB2 1 81 HIS H 0.000 . 5.000 2.617 2.520 2.727 . 0 0 "[ . 1 . 2]" 1
1272 1 80 SER HB2 1 94 MET QB 0.000 . 6.000 4.214 3.798 4.707 . 0 0 "[ . 1 . 2]" 1
1273 1 80 SER HB2 1 96 ILE MD 0.000 . 6.500 3.303 2.767 3.676 . 0 0 "[ . 1 . 2]" 1
1274 1 80 SER HB2 1 96 ILE QG 0.000 . 6.000 4.793 3.866 5.270 . 0 0 "[ . 1 . 2]" 1
1275 1 80 SER H 1 81 HIS H 0.000 . 5.000 4.503 4.441 4.552 . 0 0 "[ . 1 . 2]" 1
1276 1 80 SER H 1 94 MET H 0.000 . 3.300 3.305 3.135 3.375 0.075 19 0 "[ . 1 . 2]" 1
1277 1 80 SER H 1 95 GLU HA 0.000 . 5.000 3.624 3.455 3.803 . 0 0 "[ . 1 . 2]" 1
1278 1 80 SER H 1 95 GLU QB 0.000 . 6.000 5.335 5.070 5.484 . 0 0 "[ . 1 . 2]" 1
1279 1 81 HIS HA 1 81 HIS HD2 0.000 . 5.000 4.071 3.819 4.400 . 0 0 "[ . 1 . 2]" 1
1280 1 81 HIS HA 1 82 ALA HA 0.000 . 5.000 4.479 4.431 4.509 . 0 0 "[ . 1 . 2]" 1
1281 1 81 HIS HA 1 82 ALA MB 0.000 . 6.500 3.862 3.787 3.952 . 0 0 "[ . 1 . 2]" 1
1282 1 81 HIS HA 1 82 ALA H 0.000 . 2.700 2.310 2.217 2.364 . 0 0 "[ . 1 . 2]" 1
1283 1 81 HIS HA 1 93 PRO HA 0.000 . 5.000 4.979 4.326 5.088 0.088 16 0 "[ . 1 . 2]" 1
1284 1 81 HIS QB 1 82 ALA HA 0.000 . 6.000 4.168 4.063 4.326 . 0 0 "[ . 1 . 2]" 1
1285 1 81 HIS QB 1 83 VAL QG 0.000 . 8.400 3.606 3.327 3.821 . 0 0 "[ . 1 . 2]" 1
1286 1 81 HIS QB 1 83 VAL MG2 0.000 . 7.500 3.943 3.493 4.358 . 0 0 "[ . 1 . 2]" 1
1287 1 81 HIS HB3 1 82 ALA H 0.000 . 5.000 2.989 2.859 3.272 . 0 0 "[ . 1 . 2]" 1
1288 1 81 HIS HB2 1 82 ALA H 0.000 . 5.000 3.760 3.548 3.979 . 0 0 "[ . 1 . 2]" 1
1289 1 81 HIS H 1 81 HIS HD2 0.000 . 5.000 2.435 1.867 2.861 . 0 0 "[ . 1 . 2]" 1
1290 1 81 HIS H 1 82 ALA H 0.000 . 5.000 4.439 4.353 4.478 . 0 0 "[ . 1 . 2]" 1
1291 1 82 ALA HA 1 83 VAL HA 0.000 . 5.000 4.467 4.449 4.485 . 0 0 "[ . 1 . 2]" 1
1292 1 82 ALA HA 1 83 VAL QG 0.000 . 7.400 2.989 2.854 3.197 . 0 0 "[ . 1 . 2]" 1
1293 1 82 ALA HA 1 83 VAL H 0.000 . 2.700 2.194 2.153 2.219 . 0 0 "[ . 1 . 2]" 1
1294 1 82 ALA HA 1 90 VAL MG2 0.000 . 6.500 3.995 3.787 5.243 . 0 0 "[ . 1 . 2]" 1
1295 1 82 ALA MB 1 83 VAL HA 0.000 . 6.500 3.927 3.868 4.081 . 0 0 "[ . 1 . 2]" 1
1296 1 82 ALA MB 1 83 VAL H 0.000 . 6.500 2.918 2.775 3.297 . 0 0 "[ . 1 . 2]" 1
1297 1 82 ALA MB 1 90 VAL QG 0.000 . 7.200 2.065 1.947 2.389 . 0 0 "[ . 1 . 2]" 1
1298 1 82 ALA MB 1 91 GLU H 0.000 . 6.500 4.145 3.957 4.346 . 0 0 "[ . 1 . 2]" 1
1299 1 82 ALA H 1 83 VAL H 0.000 . 5.000 4.499 4.349 4.585 . 0 0 "[ . 1 . 2]" 1
1300 1 83 VAL HA 1 84 SER HA 0.000 . 5.000 4.374 4.357 4.401 . 0 0 "[ . 1 . 2]" 1
1301 1 83 VAL HA 1 84 SER QB 0.000 . 6.000 4.365 4.236 4.478 . 0 0 "[ . 1 . 2]" 1
1302 1 83 VAL HA 1 84 SER H 0.000 . 2.700 2.214 2.153 2.348 . 0 0 "[ . 1 . 2]" 1
1303 1 83 VAL HA 1 89 ALA HA 0.000 . 3.300 2.648 2.409 2.934 . 0 0 "[ . 1 . 2]" 1
1304 1 83 VAL HA 1 89 ALA MB 0.000 . 6.500 4.135 3.799 4.460 . 0 0 "[ . 1 . 2]" 1
1305 1 83 VAL HA 1 90 VAL HA 0.000 . 5.000 4.740 4.582 5.003 0.003 20 0 "[ . 1 . 2]" 1
1306 1 83 VAL HA 1 90 VAL MG2 0.000 . 6.500 2.446 2.119 4.382 . 0 0 "[ . 1 . 2]" 1
1307 1 83 VAL HA 1 90 VAL H 0.000 . 3.300 1.923 1.687 2.171 . 0 0 "[ . 1 . 2]" 1
1308 1 83 VAL HA 1 91 GLU H 0.000 . 5.000 3.738 3.650 3.854 . 0 0 "[ . 1 . 2]" 1
1309 1 83 VAL HB 1 84 SER H 0.000 . 3.300 3.315 2.909 3.399 0.099 16 0 "[ . 1 . 2]" 1
1310 1 83 VAL HB 1 89 ALA HA 0.000 . 5.000 3.970 3.526 4.341 . 0 0 "[ . 1 . 2]" 1
1311 1 83 VAL HB 1 89 ALA MB 0.000 . 6.500 5.101 4.642 5.416 . 0 0 "[ . 1 . 2]" 1
1312 1 83 VAL HB 1 90 VAL QG 0.000 . 7.400 4.155 3.927 4.323 . 0 0 "[ . 1 . 2]" 1
1313 1 83 VAL QG 1 85 SER HA 0.000 . 7.400 4.857 4.608 5.247 . 0 0 "[ . 1 . 2]" 1
1314 1 83 VAL QG 1 87 GLY QA 0.000 . 8.400 4.617 4.147 5.382 . 0 0 "[ . 1 . 2]" 1
1315 1 83 VAL QG 1 87 GLY H 0.000 . 7.400 4.935 4.440 5.286 . 0 0 "[ . 1 . 2]" 1
1316 1 83 VAL QG 1 88 GLU HA 0.000 . 7.400 4.916 4.641 5.079 . 0 0 "[ . 1 . 2]" 1
1317 1 83 VAL QG 1 88 GLU H 0.000 . 7.400 4.774 4.349 5.187 . 0 0 "[ . 1 . 2]" 1
1318 1 83 VAL QG 1 89 ALA MB 0.000 . 8.900 2.806 2.458 3.244 . 0 0 "[ . 1 . 2]" 1
1319 1 83 VAL H 1 83 VAL MG1 0.000 . 4.800 3.603 3.248 3.920 . 0 0 "[ . 1 . 2]" 1
1320 1 83 VAL MG1 1 84 SER H 0.000 . 6.500 3.318 2.446 3.633 . 0 0 "[ . 1 . 2]" 1
1321 1 83 VAL MG1 1 89 ALA HA 0.000 . 6.500 2.046 1.934 2.229 . 0 0 "[ . 1 . 2]" 1
1322 1 83 VAL MG1 1 89 ALA MB 0.000 . 8.000 2.824 2.469 3.268 . 0 0 "[ . 1 . 2]" 1
1323 1 83 VAL MG1 1 89 ALA H 0.000 . 6.500 4.066 3.813 4.356 . 0 0 "[ . 1 . 2]" 1
1324 1 83 VAL H 1 83 VAL MG2 0.000 . 4.800 1.961 1.749 2.199 . 0 0 "[ . 1 . 2]" 1
1325 1 83 VAL MG2 1 84 SER HA 0.000 . 6.500 5.032 4.668 5.403 . 0 0 "[ . 1 . 2]" 1
1326 1 83 VAL MG2 1 84 SER H 0.000 . 6.500 4.283 4.080 4.346 . 0 0 "[ . 1 . 2]" 1
1327 1 83 VAL MG2 1 89 ALA HA 0.000 . 6.500 4.453 4.086 4.832 . 0 0 "[ . 1 . 2]" 1
1328 1 83 VAL MG2 1 89 ALA MB 0.000 . 8.000 4.905 4.237 5.477 . 0 0 "[ . 1 . 2]" 1
1329 1 83 VAL H 1 84 SER H 0.000 . 5.000 4.371 4.266 4.555 . 0 0 "[ . 1 . 2]" 1
1330 1 84 SER HA 1 85 SER HA 0.000 . 5.000 4.367 4.339 4.389 . 0 0 "[ . 1 . 2]" 1
1331 1 84 SER HA 1 85 SER H 0.000 . 3.300 2.138 2.097 2.236 . 0 0 "[ . 1 . 2]" 1
1332 1 84 SER HA 1 90 VAL QG 0.000 . 7.400 2.987 2.749 3.195 . 0 0 "[ . 1 . 2]" 1
1333 1 84 SER H 1 84 SER QB 0.000 . 3.900 2.485 2.326 2.728 . 0 0 "[ . 1 . 2]" 1
1334 1 84 SER HB3 1 85 SER H 0.000 . 5.000 4.264 4.085 4.417 . 0 0 "[ . 1 . 2]" 1
1335 1 84 SER HB3 1 86 ASN H 0.000 . 5.000 4.070 3.937 5.188 0.188 14 0 "[ . 1 . 2]" 1
1336 1 84 SER HB3 1 90 VAL MG1 0.000 . 6.500 2.106 1.942 2.632 . 0 0 "[ . 1 . 2]" 1
1337 1 84 SER HB3 1 90 VAL MG2 0.000 . 6.500 3.230 2.830 4.242 . 0 0 "[ . 1 . 2]" 1
1338 1 84 SER HB2 1 85 SER H 0.000 . 5.000 3.275 2.884 3.459 . 0 0 "[ . 1 . 2]" 1
1339 1 84 SER HB2 1 86 ASN H 0.000 . 5.000 2.737 2.422 3.992 . 0 0 "[ . 1 . 2]" 1
1340 1 84 SER H 1 85 SER H 0.000 . 5.000 4.567 4.488 4.629 . 0 0 "[ . 1 . 2]" 1
1341 1 84 SER H 1 88 GLU HB3 0.000 . 5.000 4.783 4.644 5.014 0.014 16 0 "[ . 1 . 2]" 1
1342 1 84 SER H 1 88 GLU H 0.000 . 5.000 3.768 3.348 4.157 . 0 0 "[ . 1 . 2]" 1
1343 1 84 SER H 1 89 ALA HA 0.000 . 5.000 3.275 2.789 3.672 . 0 0 "[ . 1 . 2]" 1
1344 1 84 SER H 1 89 ALA MB 0.000 . 6.500 4.785 4.435 5.062 . 0 0 "[ . 1 . 2]" 1
1345 1 84 SER H 1 90 VAL MG2 0.000 . 6.500 2.796 1.958 4.462 . 0 0 "[ . 1 . 2]" 1
1346 1 84 SER H 1 90 VAL H 0.000 . 5.000 3.110 2.803 3.408 . 0 0 "[ . 1 . 2]" 1
1347 1 85 SER HA 1 86 ASN H 0.000 . 5.000 3.251 3.152 3.549 . 0 0 "[ . 1 . 2]" 1
1348 1 86 ASN HA 1 87 GLY QA 0.000 . 6.000 4.205 4.066 4.242 . 0 0 "[ . 1 . 2]" 1
1349 1 86 ASN HA 1 87 GLY H 0.000 . 5.000 3.383 2.693 3.523 . 0 0 "[ . 1 . 2]" 1
1350 1 86 ASN HB3 1 87 GLY H 0.000 . 5.000 4.121 3.705 4.677 . 0 0 "[ . 1 . 2]" 1
1351 1 86 ASN HB2 1 87 GLY H 0.000 . 5.000 4.075 3.862 4.417 . 0 0 "[ . 1 . 2]" 1
1352 1 87 GLY QA 1 88 GLU HA 0.000 . 6.000 4.038 3.981 4.053 . 0 0 "[ . 1 . 2]" 1
1353 1 87 GLY QA 1 88 GLU H 0.000 . 4.300 2.876 2.340 2.939 . 0 0 "[ . 1 . 2]" 1
1354 1 87 GLY H 1 88 GLU H 0.000 . 3.300 2.018 1.720 2.827 . 0 0 "[ . 1 . 2]" 1
1355 1 88 GLU HA 1 89 ALA MB 0.000 . 6.500 3.955 3.892 3.988 . 0 0 "[ . 1 . 2]" 1
1356 1 88 GLU HA 1 89 ALA H 0.000 . 2.700 2.131 2.103 2.165 . 0 0 "[ . 1 . 2]" 1
1357 1 88 GLU QB 1 89 ALA HA 0.000 . 6.000 4.555 4.496 4.658 . 0 0 "[ . 1 . 2]" 1
1358 1 88 GLU HB3 1 89 ALA H 0.000 . 5.000 3.350 3.161 3.706 . 0 0 "[ . 1 . 2]" 1
1359 1 88 GLU HB3 1 90 VAL MG1 0.000 . 6.500 3.299 3.075 4.697 . 0 0 "[ . 1 . 2]" 1
1360 1 88 GLU HB2 1 89 ALA H 0.000 . 5.000 4.281 4.139 4.386 . 0 0 "[ . 1 . 2]" 1
1361 1 88 GLU H 1 88 GLU QB 0.000 . 3.300 2.420 2.302 2.628 . 0 0 "[ . 1 . 2]" 1
1362 1 88 GLU H 1 89 ALA H 0.000 . 5.000 4.422 4.288 4.522 . 0 0 "[ . 1 . 2]" 1
1363 1 89 ALA HA 1 90 VAL HA 0.000 . 5.000 4.437 4.411 4.455 . 0 0 "[ . 1 . 2]" 1
1364 1 89 ALA HA 1 90 VAL MG1 0.000 . 4.800 3.433 3.207 3.755 . 0 0 "[ . 1 . 2]" 1
1365 1 89 ALA HA 1 90 VAL MG2 0.000 . 6.500 4.035 3.592 5.415 . 0 0 "[ . 1 . 2]" 1
1366 1 89 ALA HA 1 90 VAL H 0.000 . 2.700 2.127 2.099 2.164 . 0 0 "[ . 1 . 2]" 1
1367 1 89 ALA MB 1 90 VAL HA 0.000 . 6.500 4.023 3.936 4.159 . 0 0 "[ . 1 . 2]" 1
1368 1 89 ALA MB 1 90 VAL MG1 0.000 . 8.000 4.047 3.927 4.355 . 0 0 "[ . 1 . 2]" 1
1369 1 89 ALA MB 1 90 VAL MG2 0.000 . 8.000 4.712 4.463 5.363 . 0 0 "[ . 1 . 2]" 1
1370 1 89 ALA MB 1 90 VAL H 0.000 . 4.800 3.165 3.008 3.365 . 0 0 "[ . 1 . 2]" 1
1371 1 89 ALA MB 1 91 GLU H 0.000 . 4.800 3.086 2.951 3.253 . 0 0 "[ . 1 . 2]" 1
1372 1 89 ALA H 1 90 VAL H 0.000 . 5.000 4.537 4.433 4.612 . 0 0 "[ . 1 . 2]" 1
1373 1 90 VAL HA 1 91 GLU H 0.000 . 5.000 2.932 2.871 3.009 . 0 0 "[ . 1 . 2]" 1
1374 1 90 VAL HB 1 91 GLU H 0.000 . 5.000 4.518 4.419 4.599 . 0 0 "[ . 1 . 2]" 1
1375 1 90 VAL QG 1 91 GLU HA 0.000 . 7.400 3.356 3.238 3.493 . 0 0 "[ . 1 . 2]" 1
1376 1 90 VAL H 1 90 VAL MG1 0.000 . 4.200 2.631 2.162 2.930 . 0 0 "[ . 1 . 2]" 1
1377 1 90 VAL MG1 1 91 GLU H 0.000 . 6.500 4.071 3.287 4.246 . 0 0 "[ . 1 . 2]" 1
1378 1 90 VAL H 1 90 VAL MG2 0.000 . 4.800 2.384 2.052 3.845 . 0 0 "[ . 1 . 2]" 1
1379 1 90 VAL MG2 1 91 GLU QB 0.000 . 7.500 4.153 3.968 5.143 . 0 0 "[ . 1 . 2]" 1
1380 1 90 VAL MG2 1 91 GLU H 0.000 . 6.500 3.378 3.291 4.080 . 0 0 "[ . 1 . 2]" 1
1381 1 90 VAL MG2 1 92 ASP H 0.000 . 6.500 5.218 4.944 5.296 . 0 0 "[ . 1 . 2]" 1
1382 1 90 VAL H 1 91 GLU H 0.000 . 3.300 2.213 2.009 2.507 . 0 0 "[ . 1 . 2]" 1
1383 1 91 GLU HA 1 92 ASP HA 0.000 . 5.000 4.474 4.412 4.527 . 0 0 "[ . 1 . 2]" 1
1384 1 91 GLU HA 1 92 ASP QB 0.000 . 6.000 4.059 3.954 4.304 . 0 0 "[ . 1 . 2]" 1
1385 1 91 GLU HA 1 92 ASP H 0.000 . 2.700 2.261 2.137 2.361 . 0 0 "[ . 1 . 2]" 1
1386 1 91 GLU QB 1 92 ASP HA 0.000 . 6.000 4.011 3.823 4.328 . 0 0 "[ . 1 . 2]" 1
1387 1 91 GLU QB 1 92 ASP H 0.000 . 4.300 2.509 2.200 2.893 . 0 0 "[ . 1 . 2]" 1
1388 1 91 GLU H 1 92 ASP H 0.000 . 5.000 4.567 4.530 4.593 . 0 0 "[ . 1 . 2]" 1
1389 1 92 ASP HA 1 93 PRO HA 0.000 . 5.000 4.369 4.331 4.450 . 0 0 "[ . 1 . 2]" 1
1390 1 92 ASP HA 1 93 PRO QD 0.000 . 3.700 1.968 1.933 1.997 . 0 0 "[ . 1 . 2]" 1
1391 1 92 ASP HA 1 93 PRO QG 0.000 . 6.000 3.912 3.871 3.944 . 0 0 "[ . 1 . 2]" 1
1392 1 92 ASP H 1 92 ASP QB 0.000 . 3.900 2.731 2.577 2.945 . 0 0 "[ . 1 . 2]" 1
1393 1 92 ASP HB3 1 93 PRO QD 0.000 . 6.000 2.454 2.176 3.110 . 0 0 "[ . 1 . 2]" 1
1394 1 92 ASP HB2 1 93 PRO QD 0.000 . 6.000 3.765 3.545 4.157 . 0 0 "[ . 1 . 2]" 1
1395 1 93 PRO HA 1 94 MET HA 0.000 . 5.000 4.486 4.451 4.501 . 0 0 "[ . 1 . 2]" 1
1396 1 93 PRO HA 1 94 MET QB 0.000 . 6.000 4.443 4.242 4.606 . 0 0 "[ . 1 . 2]" 1
1397 1 93 PRO HA 1 94 MET H 0.000 . 3.300 2.294 2.216 2.329 . 0 0 "[ . 1 . 2]" 1
1398 1 93 PRO QB 1 94 MET HA 0.000 . 6.000 4.359 4.218 4.410 . 0 0 "[ . 1 . 2]" 1
1399 1 93 PRO QB 1 94 MET H 0.000 . 6.000 3.845 3.696 3.888 . 0 0 "[ . 1 . 2]" 1
1400 1 94 MET HA 1 95 GLU HA 0.000 . 5.000 4.406 4.365 4.434 . 0 0 "[ . 1 . 2]" 1
1401 1 94 MET HA 1 95 GLU H 0.000 . 2.700 2.132 2.114 2.169 . 0 0 "[ . 1 . 2]" 1
1402 1 94 MET QB 1 95 GLU HA 0.000 . 6.000 4.345 4.275 4.494 . 0 0 "[ . 1 . 2]" 1
1403 1 94 MET QB 1 95 GLU H 0.000 . 6.000 3.446 3.278 3.819 . 0 0 "[ . 1 . 2]" 1
1404 1 94 MET QB 1 96 ILE HA 0.000 . 6.000 5.126 4.996 5.314 . 0 0 "[ . 1 . 2]" 1
1405 1 95 GLU HA 1 96 ILE HA 0.000 . 5.000 4.427 4.395 4.481 . 0 0 "[ . 1 . 2]" 1
1406 1 95 GLU HA 1 96 ILE HB 0.000 . 5.000 4.283 4.111 4.400 . 0 0 "[ . 1 . 2]" 1
1407 1 95 GLU HA 1 96 ILE QG 0.000 . 6.000 4.306 3.982 4.492 . 0 0 "[ . 1 . 2]" 1
1408 1 95 GLU HA 1 96 ILE MG 0.000 . 6.500 5.353 5.295 5.419 . 0 0 "[ . 1 . 2]" 1
1409 1 95 GLU HA 1 96 ILE H 0.000 . 2.700 2.141 2.110 2.329 . 0 0 "[ . 1 . 2]" 1
1410 1 95 GLU QB 1 96 ILE H 0.000 . 6.000 3.392 2.651 3.552 . 0 0 "[ . 1 . 2]" 1
1411 1 95 GLU QG 1 96 ILE H 0.000 . 6.000 4.474 3.977 4.856 . 0 0 "[ . 1 . 2]" 1
1412 1 95 GLU H 1 96 ILE H 0.000 . 5.000 4.363 4.255 4.604 . 0 0 "[ . 1 . 2]" 1
1413 1 96 ILE HA 1 97 VAL HA 0.000 . 5.000 4.423 4.408 4.453 . 0 0 "[ . 1 . 2]" 1
1414 1 96 ILE HA 1 97 VAL HB 0.000 . 5.000 4.607 4.322 4.996 . 0 0 "[ . 1 . 2]" 1
1415 1 96 ILE HA 1 97 VAL QG 0.000 . 5.700 3.510 3.232 3.944 . 0 0 "[ . 1 . 2]" 1
1416 1 96 ILE HA 1 97 VAL H 0.000 . 2.700 2.151 2.124 2.207 . 0 0 "[ . 1 . 2]" 1
1417 1 96 ILE H 1 96 ILE HB 0.000 . 3.300 2.240 2.149 2.577 . 0 0 "[ . 1 . 2]" 1
1418 1 96 ILE HB 1 97 VAL H 0.000 . 5.000 4.386 4.251 4.510 . 0 0 "[ . 1 . 2]" 1
1419 1 96 ILE MD 1 98 ILE MD 0.000 . 6.300 3.939 3.559 4.105 . 0 0 "[ . 1 . 2]" 1
1420 1 96 ILE QG 1 97 VAL H 0.000 . 6.000 3.791 3.666 4.007 . 0 0 "[ . 1 . 2]" 1
1421 1 96 ILE MG 1 97 VAL HA 0.000 . 6.500 3.600 3.473 3.679 . 0 0 "[ . 1 . 2]" 1
1422 1 96 ILE MG 1 97 VAL HB 0.000 . 6.500 4.468 4.203 4.899 . 0 0 "[ . 1 . 2]" 1
1423 1 96 ILE MG 1 97 VAL H 0.000 . 4.800 2.594 2.283 2.902 . 0 0 "[ . 1 . 2]" 1
1424 1 96 ILE MG 1 98 ILE HA 0.000 . 6.500 4.031 3.809 4.323 . 0 0 "[ . 1 . 2]" 1
1425 1 96 ILE MG 1 98 ILE HB 0.000 . 6.500 4.101 3.649 4.533 . 0 0 "[ . 1 . 2]" 1
1426 1 96 ILE MG 1 98 ILE MD 0.000 . 6.300 2.318 1.934 2.724 . 0 0 "[ . 1 . 2]" 1
1427 1 96 ILE MG 1 98 ILE QG 0.000 . 7.500 2.142 1.952 2.492 . 0 0 "[ . 1 . 2]" 1
1428 1 96 ILE MG 1 98 ILE H 0.000 . 6.500 3.702 3.374 4.168 . 0 0 "[ . 1 . 2]" 1
1429 1 96 ILE H 1 97 VAL H 0.000 . 5.000 4.480 4.199 4.573 . 0 0 "[ . 1 . 2]" 1
1430 1 97 VAL HA 1 98 ILE HA 0.000 . 5.000 4.437 4.421 4.453 . 0 0 "[ . 1 . 2]" 1
1431 1 97 VAL HA 1 98 ILE HB 0.000 . 5.000 4.555 4.378 4.812 . 0 0 "[ . 1 . 2]" 1
1432 1 97 VAL HA 1 98 ILE MD 0.000 . 6.500 4.575 4.017 5.098 . 0 0 "[ . 1 . 2]" 1
1433 1 97 VAL HA 1 98 ILE QG 0.000 . 6.000 3.813 3.163 4.306 . 0 0 "[ . 1 . 2]" 1
1434 1 97 VAL HA 1 98 ILE H 0.000 . 2.700 2.144 2.122 2.186 . 0 0 "[ . 1 . 2]" 1
1435 1 97 VAL H 1 97 VAL HB 0.000 . 3.300 2.574 2.293 2.959 . 0 0 "[ . 1 . 2]" 1
1436 1 97 VAL HB 1 98 ILE H 0.000 . 5.000 4.276 4.005 4.513 . 0 0 "[ . 1 . 2]" 1
1437 1 97 VAL QG 1 98 ILE H 0.000 . 5.100 2.794 2.389 3.095 . 0 0 "[ . 1 . 2]" 1
1438 1 97 VAL H 1 98 ILE H 0.000 . 5.000 4.383 4.258 4.515 . 0 0 "[ . 1 . 2]" 1
1439 1 98 ILE HA 1 99 THR HA 0.000 . 5.000 4.425 4.411 4.441 . 0 0 "[ . 1 . 2]" 1
1440 1 98 ILE HA 1 99 THR MG 0.000 . 6.500 4.201 3.833 4.494 . 0 0 "[ . 1 . 2]" 1
1441 1 98 ILE HA 1 99 THR H 0.000 . 2.700 2.145 2.133 2.162 . 0 0 "[ . 1 . 2]" 1
1442 1 98 ILE H 1 98 ILE HB 0.000 . 3.300 2.546 2.322 2.874 . 0 0 "[ . 1 . 2]" 1
1443 1 98 ILE HB 1 99 THR H 0.000 . 5.000 4.356 4.173 4.499 . 0 0 "[ . 1 . 2]" 1
1444 1 98 ILE QG 1 99 THR H 0.000 . 6.000 4.225 3.956 4.435 . 0 0 "[ . 1 . 2]" 1
1445 1 98 ILE MG 1 99 THR HA 0.000 . 6.500 3.959 3.600 4.379 . 0 0 "[ . 1 . 2]" 1
1446 1 98 ILE MG 1 99 THR H 0.000 . 6.500 2.906 2.697 3.045 . 0 0 "[ . 1 . 2]" 1
1447 1 98 ILE MG 1 100 VAL HA 0.000 . 6.500 4.139 3.873 4.550 . 0 0 "[ . 1 . 2]" 1
1448 1 98 ILE MG 1 100 VAL MG1 0.000 . 8.000 5.107 4.683 5.379 . 0 0 "[ . 1 . 2]" 1
1449 1 99 THR HA 1 100 VAL HA 0.000 . 5.000 4.374 4.352 4.419 . 0 0 "[ . 1 . 2]" 1
1450 1 99 THR HA 1 100 VAL HB 0.000 . 5.000 4.674 4.585 4.803 . 0 0 "[ . 1 . 2]" 1
1451 1 99 THR HA 1 100 VAL MG1 0.000 . 6.500 5.441 5.390 5.481 . 0 0 "[ . 1 . 2]" 1
1452 1 99 THR HA 1 100 VAL MG2 0.000 . 6.500 3.449 3.213 3.699 . 0 0 "[ . 1 . 2]" 1
1453 1 99 THR HA 1 100 VAL H 0.000 . 2.700 2.250 2.216 2.283 . 0 0 "[ . 1 . 2]" 1
1454 1 99 THR HB 1 100 VAL H 0.000 . 5.000 4.163 4.008 4.276 . 0 0 "[ . 1 . 2]" 1
1455 1 99 THR H 1 100 VAL H 0.000 . 5.000 4.598 4.561 4.617 . 0 0 "[ . 1 . 2]" 1
1456 1 100 VAL HA 1 101 THR HA 0.000 . 5.000 4.443 4.391 4.481 . 0 0 "[ . 1 . 2]" 1
1457 1 100 VAL HA 1 101 THR H 0.000 . 2.700 2.212 2.132 2.260 . 0 0 "[ . 1 . 2]" 1
1458 1 100 VAL H 1 100 VAL HB 0.000 . 3.300 2.501 2.398 2.653 . 0 0 "[ . 1 . 2]" 1
1459 1 100 VAL HB 1 101 THR HA 0.000 . 5.000 4.738 4.553 4.942 . 0 0 "[ . 1 . 2]" 1
1460 1 100 VAL HB 1 101 THR H 0.000 . 5.000 3.954 3.803 4.163 . 0 0 "[ . 1 . 2]" 1
1461 1 100 VAL QG 1 101 THR HA 0.000 . 7.400 3.609 3.208 3.895 . 0 0 "[ . 1 . 2]" 1
1462 1 100 VAL QG 1 101 THR H 0.000 . 5.700 2.249 2.054 2.561 . 0 0 "[ . 1 . 2]" 1
1463 1 100 VAL H 1 100 VAL MG1 0.000 . 4.800 3.793 3.755 3.833 . 0 0 "[ . 1 . 2]" 1
1464 1 100 VAL H 1 100 VAL MG2 0.000 . 4.800 2.393 2.186 2.634 . 0 0 "[ . 1 . 2]" 1
1465 1 100 VAL H 1 101 THR H 0.000 . 5.000 4.582 4.507 4.620 . 0 0 "[ . 1 . 2]" 1
1466 1 101 THR HA 1 102 ASP HA 0.000 . 5.000 4.364 4.324 4.474 . 0 0 "[ . 1 . 2]" 1
1467 1 101 THR HA 1 102 ASP QB 0.000 . 6.000 4.361 4.110 4.709 . 0 0 "[ . 1 . 2]" 1
1468 1 101 THR HA 1 102 ASP H 0.000 . 5.000 2.215 2.124 2.270 . 0 0 "[ . 1 . 2]" 1
1469 1 101 THR HB 1 102 ASP H 0.000 . 5.000 3.503 3.056 4.211 . 0 0 "[ . 1 . 2]" 1
1470 1 101 THR H 1 101 THR MG 0.000 . 4.800 3.610 2.992 4.007 . 0 0 "[ . 1 . 2]" 1
1471 1 101 THR MG 1 102 ASP H 0.000 . 4.800 2.985 2.175 3.867 . 0 0 "[ . 1 . 2]" 1
1472 1 101 THR H 1 102 ASP H 0.000 . 5.000 4.441 4.234 4.599 . 0 0 "[ . 1 . 2]" 1
1473 1 102 ASP HA 1 103 GLN HA 0.000 . 5.000 4.485 4.342 4.685 . 0 0 "[ . 1 . 2]" 1
1474 1 102 ASP HA 1 103 GLN QG 0.000 . 6.000 4.657 3.219 5.431 . 0 0 "[ . 1 . 2]" 1
1475 1 102 ASP HA 1 103 GLN H 0.000 . 3.300 2.408 2.148 2.779 . 0 0 "[ . 1 . 2]" 1
1476 1 102 ASP H 1 102 ASP QB 0.000 . 3.900 2.409 2.118 2.860 . 0 0 "[ . 1 . 2]" 1
1477 1 102 ASP QB 1 103 GLN H 0.000 . 6.000 2.788 1.765 3.912 . 0 0 "[ . 1 . 2]" 1
1478 1 103 GLN HA 1 104 ASN QB 0.000 . 6.000 4.369 3.671 5.330 . 0 0 "[ . 1 . 2]" 1
1479 1 103 GLN H 1 103 GLN QB 0.000 . 3.900 2.647 2.067 3.011 . 0 0 "[ . 1 . 2]" 1
1480 1 103 GLN QG 1 104 ASN QB 0.000 . 7.000 4.754 3.090 5.529 . 0 0 "[ . 1 . 2]" 1
1481 1 104 ASN HA 1 105 ASP HA 0.000 . 5.000 4.645 4.321 5.142 0.142 2 0 "[ . 1 . 2]" 1
1482 1 104 ASN HA 1 105 ASP H 0.000 . 3.300 2.753 2.186 3.464 0.164 10 0 "[ . 1 . 2]" 1
1483 1 104 ASN QB 1 105 ASP H 0.000 . 6.000 3.371 1.617 4.042 . 0 0 "[ . 1 . 2]" 1
1484 1 105 ASP HA 1 106 ASN H 0.000 . 5.000 2.643 2.136 3.571 . 0 0 "[ . 1 . 2]" 1
1485 1 105 ASP H 1 105 ASP QB 0.000 . 3.300 2.549 2.115 2.981 . 0 0 "[ . 1 . 2]" 1
1486 1 105 ASP QB 1 106 ASN H 0.000 . 6.000 3.151 1.732 4.002 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 122
_Distance_constraint_stats_list.Viol_count 899
_Distance_constraint_stats_list.Viol_total 4496.628
_Distance_constraint_stats_list.Viol_max 3.798
_Distance_constraint_stats_list.Viol_rms 0.4190
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0921
_Distance_constraint_stats_list.Viol_average_violations_only 0.2501
_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 6 ILE 173.047 3.798 17 20 [****-***********+***]
1 7 PRO 0.344 0.071 2 0 "[ . 1 . 2]"
1 9 ILE 0.054 0.017 5 0 "[ . 1 . 2]"
1 11 CYS 0.677 0.099 15 0 "[ . 1 . 2]"
1 12 PRO 2.785 0.208 13 0 "[ . 1 . 2]"
1 14 ASN 0.117 0.035 3 0 "[ . 1 . 2]"
1 21 LYS 0.913 0.079 1 0 "[ . 1 . 2]"
1 23 LEU 0.665 0.070 10 0 "[ . 1 . 2]"
1 24 VAL 1.354 0.115 11 0 "[ . 1 . 2]"
1 25 GLN 0.142 0.035 8 0 "[ . 1 . 2]"
1 26 ILE 0.641 0.075 11 0 "[ . 1 . 2]"
1 27 LYS 173.047 3.798 17 20 [****-***********+***]
1 28 SER 0.566 0.102 17 0 "[ . 1 . 2]"
1 29 ASN 0.477 0.049 2 0 "[ . 1 . 2]"
1 30 ARG 1.085 0.081 5 0 "[ . 1 . 2]"
1 31 ASP 0.477 0.049 2 0 "[ . 1 . 2]"
1 32 LYS 0.006 0.006 18 0 "[ . 1 . 2]"
1 33 GLU 1.078 0.081 5 0 "[ . 1 . 2]"
1 35 LYS 0.119 0.027 16 0 "[ . 1 . 2]"
1 37 PHE 2.314 0.112 8 0 "[ . 1 . 2]"
1 38 TYR 1.642 0.102 17 0 "[ . 1 . 2]"
1 39 SER 0.390 0.065 18 0 "[ . 1 . 2]"
1 41 THR 1.562 0.120 4 0 "[ . 1 . 2]"
1 42 GLY 11.371 1.860 15 3 "[ * . 1 + * 2]"
1 43 GLN 0.149 0.047 5 0 "[ . 1 . 2]"
1 44 GLY 2.163 0.093 20 0 "[ . 1 . 2]"
1 45 ALA 1.346 0.104 12 0 "[ . 1 . 2]"
1 46 ASP 10.471 1.860 15 3 "[ * . 1 + * 2]"
1 47 LYS 1.181 0.093 20 0 "[ . 1 . 2]"
1 51 GLY 0.644 0.074 18 0 "[ . 1 . 2]"
1 52 VAL 2.790 0.135 16 0 "[ . 1 . 2]"
1 53 PHE 0.853 0.068 17 0 "[ . 1 . 2]"
1 54 ILE 0.345 0.073 9 0 "[ . 1 . 2]"
1 56 GLU 11.194 1.764 14 3 "[ * . 1- +. 2]"
1 57 ARG 1.077 0.102 2 0 "[ . 1 . 2]"
1 58 GLU 10.250 1.764 14 3 "[ * . 1- +. 2]"
1 59 THR 0.220 0.035 8 0 "[ . 1 . 2]"
1 60 GLY 0.785 0.075 11 0 "[ . 1 . 2]"
1 61 TRP 0.878 0.123 4 0 "[ . 1 . 2]"
1 62 LEU 2.020 0.115 11 0 "[ . 1 . 2]"
1 63 LYS 0.345 0.073 9 0 "[ . 1 . 2]"
1 64 VAL 0.913 0.079 1 0 "[ . 1 . 2]"
1 65 THR 0.040 0.017 14 0 "[ . 1 . 2]"
1 66 GLN 2.422 0.135 16 0 "[ . 1 . 2]"
1 68 LEU 2.903 0.208 13 0 "[ . 1 . 2]"
1 69 ASP 1.378 0.068 5 0 "[ . 1 . 2]"
1 71 GLU 0.273 0.051 18 0 "[ . 1 . 2]"
1 72 ALA 0.524 0.050 4 0 "[ . 1 . 2]"
1 73 ILE 0.014 0.012 15 0 "[ . 1 . 2]"
1 74 ALA 0.117 0.027 19 0 "[ . 1 . 2]"
1 76 TYR 1.208 0.074 18 0 "[ . 1 . 2]"
1 77 ILE 0.149 0.047 5 0 "[ . 1 . 2]"
1 78 LEU 1.237 0.096 12 0 "[ . 1 . 2]"
1 79 TYR 1.562 0.120 4 0 "[ . 1 . 2]"
1 80 SER 1.788 0.088 17 0 "[ . 1 . 2]"
1 81 HIS 0.390 0.065 18 0 "[ . 1 . 2]"
1 82 ALA 1.690 0.139 9 0 "[ . 1 . 2]"
1 83 VAL 2.314 0.112 8 0 "[ . 1 . 2]"
1 84 SER 1.243 0.062 14 0 "[ . 1 . 2]"
1 85 SER 0.119 0.027 16 0 "[ . 1 . 2]"
1 86 ASN 0.343 0.039 13 0 "[ . 1 . 2]"
1 87 GLY 0.443 0.062 14 0 "[ . 1 . 2]"
1 88 GLU 0.458 0.055 4 0 "[ . 1 . 2]"
1 90 VAL 1.233 0.139 9 0 "[ . 1 . 2]"
1 91 GLU 0.456 0.062 17 0 "[ . 1 . 2]"
1 94 MET 1.788 0.088 17 0 "[ . 1 . 2]"
1 96 ILE 1.237 0.096 12 0 "[ . 1 . 2]"
1 97 VAL 0.344 0.071 2 0 "[ . 1 . 2]"
1 98 ILE 0.642 0.074 18 0 "[ . 1 . 2]"
1 99 THR 0.731 0.099 15 0 "[ . 1 . 2]"
1 100 VAL 0.117 0.027 19 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 9 ILE O 1 99 THR N 0.000 . 2.900 2.831 2.739 2.892 . 0 0 "[ . 1 . 2]" 2
2 1 9 ILE O 1 99 THR H 0.000 . 1.900 1.870 1.806 1.917 0.017 5 0 "[ . 1 . 2]" 2
3 1 11 CYS N 1 99 THR O 0.000 . 2.900 2.851 2.751 2.911 0.011 15 0 "[ . 1 . 2]" 2
4 1 11 CYS H 1 99 THR O 0.000 . 1.900 1.930 1.866 1.999 0.099 15 0 "[ . 1 . 2]" 2
5 1 21 LYS N 1 64 VAL O 0.000 . 2.900 2.880 2.789 2.953 0.053 1 0 "[ . 1 . 2]" 2
6 1 21 LYS H 1 64 VAL O 0.000 . 1.900 1.930 1.860 1.979 0.079 1 0 "[ . 1 . 2]" 2
7 1 21 LYS O 1 64 VAL N 0.000 . 3.000 2.842 2.764 2.964 . 0 0 "[ . 1 . 2]" 2
8 1 21 LYS O 1 64 VAL H 0.000 . 2.000 1.877 1.802 2.002 0.002 10 0 "[ . 1 . 2]" 2
9 1 23 LEU N 1 62 LEU O 0.000 . 2.900 2.809 2.697 2.924 0.024 10 0 "[ . 1 . 2]" 2
10 1 23 LEU H 1 62 LEU O 0.000 . 1.900 1.930 1.874 1.970 0.070 10 0 "[ . 1 . 2]" 2
11 1 24 VAL N 1 62 LEU O 0.000 . 3.300 3.249 3.154 3.301 0.001 17 0 "[ . 1 . 2]" 2
12 1 24 VAL H 1 62 LEU O 0.000 . 2.300 2.367 2.311 2.415 0.115 11 0 "[ . 1 . 2]" 2
13 1 24 VAL O 1 62 LEU N 0.000 . 2.900 2.711 2.555 2.803 . 0 0 "[ . 1 . 2]" 2
14 1 24 VAL O 1 62 LEU H 0.000 . 1.900 1.860 1.807 1.917 0.017 3 0 "[ . 1 . 2]" 2
15 1 25 GLN NE2 1 59 THR O 0.000 . 2.900 2.752 2.423 2.916 0.016 8 0 "[ . 1 . 2]" 2
16 1 25 GLN HE21 1 59 THR O 0.000 . 1.900 1.891 1.841 1.935 0.035 8 0 "[ . 1 . 2]" 2
17 1 26 ILE N 1 60 GLY O 0.000 . 2.900 2.763 2.686 2.923 0.023 11 0 "[ . 1 . 2]" 2
18 1 26 ILE H 1 60 GLY O 0.000 . 1.900 1.931 1.901 1.975 0.075 11 0 "[ . 1 . 2]" 2
19 1 28 SER N 1 38 TYR OH 0.000 . 2.900 2.327 2.250 2.589 . 0 0 "[ . 1 . 2]" 2
20 1 28 SER H 1 38 TYR OH 0.000 . 1.900 1.922 1.851 2.002 0.102 17 0 "[ . 1 . 2]" 2
21 1 29 ASN O 1 31 ASP N 0.000 . 3.300 2.650 2.400 2.882 . 0 0 "[ . 1 . 2]" 2
22 1 29 ASN O 1 31 ASP H 0.000 . 2.300 2.318 2.232 2.349 0.049 2 0 "[ . 1 . 2]" 2
23 1 30 ARG O 1 32 LYS N 0.000 . 3.000 2.507 2.429 2.561 . 0 0 "[ . 1 . 2]" 2
24 1 30 ARG O 1 32 LYS H 0.000 . 2.000 1.894 1.836 2.006 0.006 18 0 "[ . 1 . 2]" 2
25 1 30 ARG O 1 33 GLU N 0.000 . 3.000 3.002 2.950 3.029 0.029 13 0 "[ . 1 . 2]" 2
26 1 30 ARG O 1 33 GLU H 0.000 . 2.000 2.044 2.016 2.081 0.081 5 0 "[ . 1 . 2]" 2
27 1 35 LYS O 1 85 SER N 0.000 . 3.000 2.880 2.753 3.007 0.007 16 0 "[ . 1 . 2]" 2
28 1 35 LYS O 1 85 SER H 0.000 . 2.000 1.941 1.849 2.027 0.027 16 0 "[ . 1 . 2]" 2
29 1 37 PHE N 1 83 VAL O 0.000 . 2.900 2.672 2.556 2.733 . 0 0 "[ . 1 . 2]" 2
30 1 37 PHE H 1 83 VAL O 0.000 . 1.900 1.734 1.620 1.786 . 0 0 "[ . 1 . 2]" 2
31 1 37 PHE O 1 83 VAL N 0.000 . 2.900 2.931 2.814 2.974 0.074 11 0 "[ . 1 . 2]" 2
32 1 37 PHE O 1 83 VAL H 0.000 . 1.900 1.976 1.859 2.012 0.112 8 0 "[ . 1 . 2]" 2
33 1 38 TYR N 1 57 ARG O 0.000 . 2.900 2.852 2.784 2.898 . 0 0 "[ . 1 . 2]" 2
34 1 38 TYR H 1 57 ARG O 0.000 . 1.900 1.954 1.917 2.002 0.102 2 0 "[ . 1 . 2]" 2
35 1 39 SER O 1 81 HIS N 0.000 . 3.000 2.885 2.738 3.003 0.003 12 0 "[ . 1 . 2]" 2
36 1 39 SER O 1 81 HIS H 0.000 . 2.000 1.953 1.808 2.065 0.065 18 0 "[ . 1 . 2]" 2
37 1 39 SER N 1 81 HIS O 0.000 . 3.500 2.898 2.651 3.043 . 0 0 "[ . 1 . 2]" 2
38 1 39 SER H 1 81 HIS O 0.000 . 2.500 2.419 2.189 2.549 0.049 1 0 "[ . 1 . 2]" 2
39 1 41 THR N 1 79 TYR O 0.000 . 2.900 2.800 2.671 2.878 . 0 0 "[ . 1 . 2]" 2
40 1 41 THR H 1 79 TYR O 0.000 . 1.900 1.900 1.834 1.987 0.087 12 0 "[ . 1 . 2]" 2
41 1 42 GLY N 1 46 ASP OD1 0.000 . 2.900 2.891 2.367 4.496 1.596 3 3 "[ + . 1 - * 2]" 2
42 1 42 GLY H 1 46 ASP OD1 0.000 . 1.900 2.128 1.746 3.760 1.860 15 3 "[ - . 1 + * 2]" 2
43 1 42 GLY O 1 45 ALA N 0.000 . 2.900 2.852 2.785 2.920 0.020 12 0 "[ . 1 . 2]" 2
44 1 42 GLY O 1 45 ALA H 0.000 . 1.900 1.925 1.847 2.004 0.104 12 0 "[ . 1 . 2]" 2
45 1 44 GLY N 1 47 LYS O 0.000 . 3.000 2.974 2.901 3.047 0.047 4 0 "[ . 1 . 2]" 2
46 1 44 GLY H 1 47 LYS O 0.000 . 2.000 2.041 1.944 2.093 0.093 20 0 "[ . 1 . 2]" 2
47 1 44 GLY O 1 53 PHE N 0.000 . 2.900 2.879 2.794 2.951 0.051 9 0 "[ . 1 . 2]" 2
48 1 44 GLY O 1 53 PHE H 0.000 . 1.900 1.938 1.901 1.968 0.068 17 0 "[ . 1 . 2]" 2
49 1 45 ALA O 1 51 GLY N 0.000 . 3.000 3.030 2.970 3.074 0.074 18 0 "[ . 1 . 2]" 2
50 1 45 ALA O 1 51 GLY H 0.000 . 3.000 2.241 2.058 2.491 . 0 0 "[ . 1 . 2]" 2
51 1 52 VAL O 1 65 THR N 0.000 . 2.900 2.788 2.744 2.871 . 0 0 "[ . 1 . 2]" 2
52 1 52 VAL O 1 65 THR H 0.000 . 1.900 1.854 1.804 1.917 0.017 14 0 "[ . 1 . 2]" 2
53 1 54 ILE O 1 63 LYS N 0.000 . 2.900 2.786 2.692 2.912 0.012 10 0 "[ . 1 . 2]" 2
54 1 54 ILE O 1 63 LYS H 0.000 . 1.900 1.874 1.806 1.973 0.073 9 0 "[ . 1 . 2]" 2
55 1 54 ILE N 1 63 LYS O 0.000 . 2.900 2.781 2.675 2.903 0.003 10 0 "[ . 1 . 2]" 2
56 1 54 ILE H 1 63 LYS O 0.000 . 1.900 1.842 1.738 1.937 0.037 9 0 "[ . 1 . 2]" 2
57 1 56 GLU O 1 60 GLY N 0.000 . 2.900 2.559 2.480 2.671 . 0 0 "[ . 1 . 2]" 2
58 1 56 GLU O 1 60 GLY H 0.000 . 1.900 1.878 1.827 1.938 0.038 6 0 "[ . 1 . 2]" 2
59 1 69 ASP O 1 72 ALA N 0.000 . 2.900 2.780 2.683 2.878 . 0 0 "[ . 1 . 2]" 2
60 1 69 ASP O 1 72 ALA H 0.000 . 1.900 1.925 1.889 1.950 0.050 4 0 "[ . 1 . 2]" 2
61 1 69 ASP OD1 1 71 GLU N 0.000 . 2.900 2.667 2.436 2.810 . 0 0 "[ . 1 . 2]" 2
62 1 69 ASP OD1 1 71 GLU H 0.000 . 1.900 1.911 1.857 1.951 0.051 18 0 "[ . 1 . 2]" 2
63 1 74 ALA O 1 100 VAL N 0.000 . 2.900 2.808 2.708 2.862 . 0 0 "[ . 1 . 2]" 2
64 1 74 ALA O 1 100 VAL H 0.000 . 1.900 1.885 1.821 1.927 0.027 19 0 "[ . 1 . 2]" 2
65 1 76 TYR N 1 98 ILE O 0.000 . 2.900 2.684 2.606 2.815 . 0 0 "[ . 1 . 2]" 2
66 1 76 TYR H 1 98 ILE O 0.000 . 1.900 1.837 1.795 1.872 . 0 0 "[ . 1 . 2]" 2
67 1 76 TYR O 1 98 ILE N 0.000 . 2.900 2.842 2.750 2.926 0.026 20 0 "[ . 1 . 2]" 2
68 1 76 TYR O 1 98 ILE H 0.000 . 1.900 1.921 1.843 1.974 0.074 18 0 "[ . 1 . 2]" 2
69 1 78 LEU N 1 96 ILE O 0.000 . 2.900 2.882 2.799 2.932 0.032 16 0 "[ . 1 . 2]" 2
70 1 78 LEU H 1 96 ILE O 0.000 . 1.900 1.953 1.918 1.996 0.096 12 0 "[ . 1 . 2]" 2
71 1 78 LEU O 1 96 ILE N 0.000 . 2.900 2.635 2.463 2.703 . 0 0 "[ . 1 . 2]" 2
72 1 78 LEU O 1 96 ILE H 0.000 . 1.900 1.792 1.749 1.833 . 0 0 "[ . 1 . 2]" 2
73 1 80 SER N 1 94 MET O 0.000 . 2.900 2.834 2.688 2.916 0.016 9 0 "[ . 1 . 2]" 2
74 1 80 SER H 1 94 MET O 0.000 . 1.900 1.888 1.814 1.957 0.057 8 0 "[ . 1 . 2]" 2
75 1 82 ALA O 1 90 VAL N 0.000 . 3.300 3.119 2.999 3.221 . 0 0 "[ . 1 . 2]" 2
76 1 82 ALA O 1 90 VAL H 0.000 . 2.300 2.360 2.267 2.439 0.139 9 0 "[ . 1 . 2]" 2
77 1 84 SER N 1 88 GLU O 0.000 . 2.900 2.785 2.666 2.885 . 0 0 "[ . 1 . 2]" 2
78 1 84 SER H 1 88 GLU O 0.000 . 1.900 1.907 1.838 1.955 0.055 4 0 "[ . 1 . 2]" 2
79 1 84 SER O 1 86 ASN N 0.000 . 3.000 2.481 2.186 2.581 . 0 0 "[ . 1 . 2]" 2
80 1 84 SER O 1 86 ASN H 0.000 . 2.000 2.002 1.861 2.039 0.039 13 0 "[ . 1 . 2]" 2
81 1 84 SER O 1 87 GLY N 0.000 . 2.900 2.840 2.736 2.930 0.030 16 0 "[ . 1 . 2]" 2
82 1 84 SER O 1 87 GLY H 0.000 . 1.900 1.908 1.846 1.962 0.062 14 0 "[ . 1 . 2]" 2
83 1 84 SER OG 1 88 GLU N 0.000 . 3.000 2.652 2.457 2.805 . 0 0 "[ . 1 . 2]" 2
84 1 84 SER OG 1 88 GLU H 0.000 . 2.000 1.890 1.730 2.042 0.042 10 0 "[ . 1 . 2]" 2
85 1 42 GLY O 1 46 ASP N 0.000 . 3.500 3.208 3.016 3.323 . 0 0 "[ . 1 . 2]" 2
86 1 42 GLY O 1 46 ASP H 0.000 . 2.500 2.427 2.163 2.555 0.055 5 0 "[ . 1 . 2]" 2
87 1 42 GLY O 1 47 LYS N 0.000 . 3.300 3.211 2.949 3.312 0.012 12 0 "[ . 1 . 2]" 2
88 1 42 GLY O 1 47 LYS H 0.000 . 2.300 2.255 1.991 2.342 0.042 12 0 "[ . 1 . 2]" 2
89 1 44 GLY O 1 52 VAL N 0.000 . 3.000 2.635 2.409 2.949 . 0 0 "[ . 1 . 2]" 2
90 1 44 GLY O 1 52 VAL H 0.000 . 2.000 1.970 1.850 2.072 0.072 9 0 "[ . 1 . 2]" 2
91 1 56 GLU N 1 61 TRP O 0.000 . 3.000 2.934 2.840 3.015 0.015 7 0 "[ . 1 . 2]" 2
92 1 56 GLU H 1 61 TRP O 0.000 . 2.000 2.034 1.937 2.123 0.123 4 0 "[ . 1 . 2]" 2
93 1 59 THR OG1 1 61 TRP N 0.000 . 3.500 3.286 3.075 3.409 . 0 0 "[ . 1 . 2]" 2
94 1 59 THR OG1 1 61 TRP H 0.000 . 2.500 2.431 2.163 2.524 0.024 13 0 "[ . 1 . 2]" 2
95 1 69 ASP O 1 73 ILE N 0.000 . 2.900 2.790 2.754 2.826 . 0 0 "[ . 1 . 2]" 2
96 1 69 ASP O 1 73 ILE H 0.000 . 1.900 1.855 1.823 1.912 0.012 15 0 "[ . 1 . 2]" 2
97 1 41 THR O 1 79 TYR N 0.000 . 3.000 2.921 2.840 3.004 0.004 4 0 "[ . 1 . 2]" 2
98 1 41 THR O 1 79 TYR H 0.000 . 2.000 2.064 2.027 2.120 0.120 4 0 "[ . 1 . 2]" 2
99 1 80 SER O 1 94 MET N 0.000 . 3.500 3.490 3.390 3.546 0.046 6 0 "[ . 1 . 2]" 2
100 1 80 SER O 1 94 MET H 0.000 . 2.500 2.563 2.435 2.588 0.088 17 0 "[ . 1 . 2]" 2
101 1 9 ILE N 1 97 VAL O 0.000 . 3.300 2.733 2.528 2.949 . 0 0 "[ . 1 . 2]" 2
102 1 9 ILE H 1 97 VAL O 0.000 . 2.300 2.010 1.835 2.206 . 0 0 "[ . 1 . 2]" 2
103 1 6 ILE O 1 27 LYS N 0.000 . 3.500 5.916 5.339 6.652 3.152 17 20 [****************+*-*] 2
104 1 6 ILE O 1 27 LYS H 0.000 . 2.500 5.225 4.502 6.298 3.798 17 20 [****************+*-*] 2
105 1 6 ILE N 1 27 LYS O 0.000 . 3.300 5.021 4.032 6.919 3.619 17 20 [****-***********+***] 2
106 1 6 ILE H 1 27 LYS O 0.000 . 2.300 4.089 3.129 5.959 3.659 17 20 [****-***********+***] 2
107 1 52 VAL O 1 66 GLN N 0.000 . 3.500 3.527 3.441 3.577 0.077 16 0 "[ . 1 . 2]" 2
108 1 52 VAL O 1 66 GLN H 0.000 . 2.500 2.590 2.529 2.635 0.135 16 0 "[ . 1 . 2]" 2
109 1 12 PRO O 1 68 LEU N 0.000 . 3.500 3.511 3.452 3.550 0.050 5 0 "[ . 1 . 2]" 2
110 1 12 PRO O 1 68 LEU H 0.000 . 2.500 2.621 2.580 2.708 0.208 13 0 "[ . 1 . 2]" 2
111 1 69 ASP N 1 76 TYR OH 0.000 . 3.500 3.457 3.277 3.526 0.026 17 0 "[ . 1 . 2]" 2
112 1 69 ASP H 1 76 TYR OH 0.000 . 2.500 2.518 2.355 2.568 0.068 5 0 "[ . 1 . 2]" 2
113 1 43 GLN OE1 1 77 ILE N 0.000 . 3.500 3.200 2.732 3.483 . 0 0 "[ . 1 . 2]" 2
114 1 43 GLN OE1 1 77 ILE H 0.000 . 2.500 2.307 1.875 2.547 0.047 5 0 "[ . 1 . 2]" 2
115 1 7 PRO O 1 97 VAL N 0.000 . 3.500 3.270 2.739 3.514 0.014 5 0 "[ . 1 . 2]" 2
116 1 7 PRO O 1 97 VAL H 0.000 . 2.500 2.383 1.871 2.571 0.071 2 0 "[ . 1 . 2]" 2
117 1 82 ALA O 1 91 GLU N 0.000 . 3.500 2.398 2.367 2.420 . 0 0 "[ . 1 . 2]" 2
118 1 82 ALA O 1 91 GLU H 0.000 . 2.500 2.519 2.473 2.562 0.062 17 0 "[ . 1 . 2]" 2
119 1 56 GLU OE1 1 58 GLU N 0.000 . 3.500 3.345 2.501 5.218 1.718 14 3 "[ * . 1- +. 2]" 2
120 1 56 GLU OE1 1 58 GLU H 0.000 . 2.500 2.442 1.750 4.264 1.764 14 3 "[ * . 1- +. 2]" 2
121 1 14 ASN N 1 68 LEU O 0.000 . 3.500 3.195 2.831 3.436 . 0 0 "[ . 1 . 2]" 2
122 1 14 ASN H 1 68 LEU O 0.000 . 2.500 2.293 1.933 2.535 0.035 3 0 "[ . 1 . 2]" 2
stop_
save_
Contact the webmaster for help, if required. Tuesday, May 14, 2024 11:24:21 AM GMT (wattos1)