NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
400787 |
1v5l   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1v5l
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 1784
_Distance_constraint_stats_list.Viol_count 1018
_Distance_constraint_stats_list.Viol_total 345.334
_Distance_constraint_stats_list.Viol_max 0.143
_Distance_constraint_stats_list.Viol_rms 0.0045
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0005
_Distance_constraint_stats_list.Viol_average_violations_only 0.0170
_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 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 4 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 5 SER 0.014 0.007 12 0 "[ . 1 . 2]"
1 6 SER 0.051 0.024 6 0 "[ . 1 . 2]"
1 7 GLY 0.011 0.009 14 0 "[ . 1 . 2]"
1 8 ASN 0.116 0.025 4 0 "[ . 1 . 2]"
1 9 VAL 0.391 0.030 15 0 "[ . 1 . 2]"
1 10 VAL 0.659 0.030 15 0 "[ . 1 . 2]"
1 11 LEU 0.589 0.049 10 0 "[ . 1 . 2]"
1 12 PRO 0.320 0.026 6 0 "[ . 1 . 2]"
1 13 GLY 0.009 0.004 16 0 "[ . 1 . 2]"
1 14 PRO 0.001 0.001 14 0 "[ . 1 . 2]"
1 15 ALA 0.012 0.008 11 0 "[ . 1 . 2]"
1 16 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 17 TRP 0.056 0.010 3 0 "[ . 1 . 2]"
1 18 GLY 0.004 0.004 14 0 "[ . 1 . 2]"
1 19 PHE 1.072 0.070 5 0 "[ . 1 . 2]"
1 20 ARG 1.019 0.138 20 0 "[ . 1 . 2]"
1 21 LEU 1.936 0.139 18 0 "[ . 1 . 2]"
1 22 SER 1.115 0.116 9 0 "[ . 1 . 2]"
1 23 GLY 0.563 0.067 19 0 "[ . 1 . 2]"
1 24 GLY 0.100 0.029 20 0 "[ . 1 . 2]"
1 25 ILE 0.223 0.037 10 0 "[ . 1 . 2]"
1 26 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 27 PHE 0.056 0.011 15 0 "[ . 1 . 2]"
1 28 ASN 0.028 0.008 7 0 "[ . 1 . 2]"
1 29 GLN 0.177 0.143 15 0 "[ . 1 . 2]"
1 30 PRO 0.084 0.027 15 0 "[ . 1 . 2]"
1 31 LEU 0.249 0.055 9 0 "[ . 1 . 2]"
1 32 VAL 1.404 0.131 12 0 "[ . 1 . 2]"
1 33 ILE 0.785 0.053 12 0 "[ . 1 . 2]"
1 34 THR 3.205 0.139 18 0 "[ . 1 . 2]"
1 35 ARG 0.738 0.086 12 0 "[ . 1 . 2]"
1 36 ILE 0.231 0.053 6 0 "[ . 1 . 2]"
1 37 THR 0.840 0.074 10 0 "[ . 1 . 2]"
1 38 PRO 0.322 0.035 10 0 "[ . 1 . 2]"
1 39 GLY 0.055 0.019 18 0 "[ . 1 . 2]"
1 40 SER 0.536 0.035 10 0 "[ . 1 . 2]"
1 41 LYS 0.197 0.029 10 0 "[ . 1 . 2]"
1 42 ALA 0.185 0.053 6 0 "[ . 1 . 2]"
1 43 ALA 0.041 0.018 9 0 "[ . 1 . 2]"
1 44 ALA 0.586 0.074 10 0 "[ . 1 . 2]"
1 45 ALA 0.058 0.018 9 0 "[ . 1 . 2]"
1 46 ASN 0.022 0.009 14 0 "[ . 1 . 2]"
1 47 LEU 0.420 0.049 10 0 "[ . 1 . 2]"
1 48 CYS 0.073 0.021 10 0 "[ . 1 . 2]"
1 49 PRO 0.331 0.035 18 0 "[ . 1 . 2]"
1 50 GLY 0.267 0.037 10 0 "[ . 1 . 2]"
1 51 ASP 0.255 0.034 14 0 "[ . 1 . 2]"
1 52 VAL 0.126 0.022 18 0 "[ . 1 . 2]"
1 53 ILE 0.399 0.034 14 0 "[ . 1 . 2]"
1 54 LEU 0.072 0.026 15 0 "[ . 1 . 2]"
1 55 ALA 0.318 0.040 15 0 "[ . 1 . 2]"
1 56 ILE 0.107 0.017 19 0 "[ . 1 . 2]"
1 57 ASP 0.063 0.024 7 0 "[ . 1 . 2]"
1 58 GLY 0.060 0.024 7 0 "[ . 1 . 2]"
1 59 PHE 0.048 0.010 20 0 "[ . 1 . 2]"
1 60 GLY 0.058 0.021 20 0 "[ . 1 . 2]"
1 61 THR 0.907 0.100 20 0 "[ . 1 . 2]"
1 62 GLU 0.560 0.104 18 0 "[ . 1 . 2]"
1 63 SER 0.028 0.022 20 0 "[ . 1 . 2]"
1 64 MET 1.519 0.100 20 0 "[ . 1 . 2]"
1 65 THR 0.248 0.031 10 0 "[ . 1 . 2]"
1 66 HIS 0.507 0.049 19 0 "[ . 1 . 2]"
1 67 ALA 0.162 0.033 10 0 "[ . 1 . 2]"
1 68 ASP 0.461 0.035 18 0 "[ . 1 . 2]"
1 69 ALA 0.329 0.035 18 0 "[ . 1 . 2]"
1 70 GLN 0.472 0.032 19 0 "[ . 1 . 2]"
1 71 ASP 0.187 0.029 19 0 "[ . 1 . 2]"
1 72 ARG 0.613 0.070 19 0 "[ . 1 . 2]"
1 73 ILE 0.439 0.060 10 0 "[ . 1 . 2]"
1 74 LYS 0.384 0.108 17 0 "[ . 1 . 2]"
1 75 ALA 0.004 0.004 15 0 "[ . 1 . 2]"
1 76 ALA 0.151 0.044 8 0 "[ . 1 . 2]"
1 77 SER 0.131 0.053 8 0 "[ . 1 . 2]"
1 78 TYR 0.193 0.053 8 0 "[ . 1 . 2]"
1 79 GLN 0.149 0.025 9 0 "[ . 1 . 2]"
1 80 LEU 0.039 0.024 18 0 "[ . 1 . 2]"
1 81 CYS 0.207 0.024 18 0 "[ . 1 . 2]"
1 82 LEU 0.036 0.011 8 0 "[ . 1 . 2]"
1 83 LYS 0.225 0.043 20 0 "[ . 1 . 2]"
1 84 ILE 0.271 0.024 6 0 "[ . 1 . 2]"
1 85 ASP 0.161 0.021 6 0 "[ . 1 . 2]"
1 86 ARG 0.114 0.023 18 0 "[ . 1 . 2]"
1 87 ALA 0.102 0.024 19 0 "[ . 1 . 2]"
1 88 GLU 0.345 0.055 7 0 "[ . 1 . 2]"
1 89 THR 0.446 0.074 11 0 "[ . 1 . 2]"
1 90 ARG 0.565 0.074 11 0 "[ . 1 . 2]"
1 91 LEU 0.217 0.048 20 0 "[ . 1 . 2]"
1 92 TRP 0.157 0.046 7 0 "[ . 1 . 2]"
1 93 SER 0.226 0.046 7 0 "[ . 1 . 2]"
1 94 PRO 0.136 0.041 17 0 "[ . 1 . 2]"
1 95 GLN 0.044 0.024 5 0 "[ . 1 . 2]"
1 96 VAL 0.155 0.089 19 0 "[ . 1 . 2]"
1 97 SER 0.160 0.089 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 3 SER QB 1 4 GLY H . . 4.860 3.251 2.222 4.052 . 0 0 "[ . 1 . 2]" 1
2 1 5 SER H 1 97 SER QB . . 4.520 3.869 2.607 4.527 0.007 12 0 "[ . 1 . 2]" 1
3 1 6 SER HA 1 7 GLY H . . 2.480 2.209 2.142 2.463 . 0 0 "[ . 1 . 2]" 1
4 1 6 SER HA 1 84 ILE H . . 5.500 5.406 4.950 5.524 0.024 6 0 "[ . 1 . 2]" 1
5 1 7 GLY H 1 8 ASN H . . 4.210 4.076 3.502 4.210 . 0 0 "[ . 1 . 2]" 1
6 1 7 GLY H 1 54 LEU MD1 . . 5.290 3.904 3.272 4.483 . 0 0 "[ . 1 . 2]" 1
7 1 7 GLY H 1 83 LYS QD . . 5.150 4.580 3.579 5.159 0.009 14 0 "[ . 1 . 2]" 1
8 1 7 GLY H 1 83 LYS HG2 . . 5.040 3.619 2.549 4.438 . 0 0 "[ . 1 . 2]" 1
9 1 7 GLY H 1 83 LYS QG . . 4.260 3.164 2.437 3.631 . 0 0 "[ . 1 . 2]" 1
10 1 7 GLY H 1 83 LYS HG3 . . 5.040 3.639 2.990 4.578 . 0 0 "[ . 1 . 2]" 1
11 1 7 GLY H 1 84 ILE H . . 4.200 3.596 2.907 3.981 . 0 0 "[ . 1 . 2]" 1
12 1 7 GLY H 1 97 SER QB . . 4.390 3.812 1.882 4.389 . 0 0 "[ . 1 . 2]" 1
13 1 7 GLY QA 1 8 ASN H . . 2.930 2.203 2.111 2.356 . 0 0 "[ . 1 . 2]" 1
14 1 7 GLY QA 1 8 ASN HB3 . . 5.340 4.494 4.106 4.787 . 0 0 "[ . 1 . 2]" 1
15 1 7 GLY QA 1 9 VAL MG2 . . 4.770 3.790 3.597 4.178 . 0 0 "[ . 1 . 2]" 1
16 1 7 GLY QA 1 83 LYS HA . . 5.340 4.678 4.392 4.975 . 0 0 "[ . 1 . 2]" 1
17 1 7 GLY QA 1 83 LYS QG . . 4.960 4.160 3.618 4.538 . 0 0 "[ . 1 . 2]" 1
18 1 7 GLY QA 1 84 ILE H . . 4.390 3.400 3.058 3.869 . 0 0 "[ . 1 . 2]" 1
19 1 8 ASN H 1 8 ASN HB2 . . 3.690 3.586 3.289 3.663 . 0 0 "[ . 1 . 2]" 1
20 1 8 ASN H 1 8 ASN HB3 . . 3.200 2.573 2.284 2.901 . 0 0 "[ . 1 . 2]" 1
21 1 8 ASN H 1 8 ASN HD21 . . 5.040 3.883 1.834 4.610 . 0 0 "[ . 1 . 2]" 1
22 1 8 ASN H 1 8 ASN QD . . 4.330 3.530 1.829 4.180 . 0 0 "[ . 1 . 2]" 1
23 1 8 ASN H 1 8 ASN HD22 . . 5.040 4.214 3.490 5.065 0.025 4 0 "[ . 1 . 2]" 1
24 1 8 ASN H 1 9 VAL H . . 4.660 4.584 4.527 4.618 . 0 0 "[ . 1 . 2]" 1
25 1 8 ASN H 1 9 VAL HA . . 5.500 5.438 5.180 5.519 0.019 18 0 "[ . 1 . 2]" 1
26 1 8 ASN H 1 9 VAL MG2 . . 4.590 4.166 3.977 4.297 . 0 0 "[ . 1 . 2]" 1
27 1 8 ASN H 1 83 LYS HA . . 5.230 5.104 4.810 5.243 0.013 7 0 "[ . 1 . 2]" 1
28 1 8 ASN H 1 84 ILE H . . 5.160 5.021 4.841 5.153 . 0 0 "[ . 1 . 2]" 1
29 1 8 ASN HA 1 9 VAL H . . 2.760 2.214 2.150 2.351 . 0 0 "[ . 1 . 2]" 1
30 1 8 ASN HA 1 9 VAL HB . . 4.930 4.475 4.392 4.576 . 0 0 "[ . 1 . 2]" 1
31 1 8 ASN HA 1 9 VAL MG2 . . 4.230 3.591 3.479 3.777 . 0 0 "[ . 1 . 2]" 1
32 1 8 ASN HA 1 83 LYS H . . 5.500 5.420 5.108 5.506 0.006 12 0 "[ . 1 . 2]" 1
33 1 8 ASN HA 1 83 LYS HA . . 3.490 2.977 2.629 3.195 . 0 0 "[ . 1 . 2]" 1
34 1 8 ASN HA 1 83 LYS QB . . 4.610 4.119 3.571 4.485 . 0 0 "[ . 1 . 2]" 1
35 1 8 ASN HA 1 84 ILE H . . 4.390 4.013 3.654 4.313 . 0 0 "[ . 1 . 2]" 1
36 1 8 ASN HB2 1 9 VAL H . . 3.790 3.056 2.585 3.690 . 0 0 "[ . 1 . 2]" 1
37 1 8 ASN HB2 1 9 VAL MG2 . . 5.210 4.815 4.630 5.185 . 0 0 "[ . 1 . 2]" 1
38 1 8 ASN HB2 1 10 VAL MG2 . . 4.390 3.494 3.198 4.404 0.014 4 0 "[ . 1 . 2]" 1
39 1 8 ASN HB3 1 8 ASN QD . . 3.370 3.187 2.325 3.343 . 0 0 "[ . 1 . 2]" 1
40 1 8 ASN HB3 1 9 VAL H . . 4.260 4.111 3.875 4.265 0.005 7 0 "[ . 1 . 2]" 1
41 1 8 ASN HB3 1 9 VAL MG2 . . 5.490 5.223 4.911 5.294 . 0 0 "[ . 1 . 2]" 1
42 1 8 ASN HB3 1 10 VAL MG2 . . 5.500 4.842 4.554 5.054 . 0 0 "[ . 1 . 2]" 1
43 1 8 ASN QD 1 9 VAL H . . 5.340 3.685 3.001 4.451 . 0 0 "[ . 1 . 2]" 1
44 1 8 ASN QD 1 9 VAL MG2 . . 4.490 4.119 3.942 4.399 . 0 0 "[ . 1 . 2]" 1
45 1 8 ASN HD21 1 9 VAL MG2 . . 5.240 4.363 4.090 4.735 . 0 0 "[ . 1 . 2]" 1
46 1 8 ASN HD21 1 10 VAL MG2 . . 5.500 3.225 2.182 5.295 . 0 0 "[ . 1 . 2]" 1
47 1 8 ASN HD22 1 9 VAL MG2 . . 5.240 5.074 4.815 5.243 0.003 1 0 "[ . 1 . 2]" 1
48 1 8 ASN HD22 1 10 VAL MG2 . . 5.500 4.051 1.870 4.993 . 0 0 "[ . 1 . 2]" 1
49 1 9 VAL H 1 9 VAL HB . . 3.280 2.821 2.769 2.860 . 0 0 "[ . 1 . 2]" 1
50 1 9 VAL H 1 9 VAL MG2 . . 3.420 3.044 2.953 3.142 . 0 0 "[ . 1 . 2]" 1
51 1 9 VAL H 1 10 VAL H . . 4.330 3.954 3.864 4.106 . 0 0 "[ . 1 . 2]" 1
52 1 9 VAL H 1 10 VAL MG1 . . 5.500 5.509 5.441 5.530 0.030 15 0 "[ . 1 . 2]" 1
53 1 9 VAL H 1 10 VAL MG2 . . 3.830 3.429 3.246 3.643 . 0 0 "[ . 1 . 2]" 1
54 1 9 VAL H 1 83 LYS HA . . 3.850 3.559 3.434 3.810 . 0 0 "[ . 1 . 2]" 1
55 1 9 VAL HA 1 9 VAL MG1 . . 3.390 2.470 2.425 2.504 . 0 0 "[ . 1 . 2]" 1
56 1 9 VAL HA 1 9 VAL MG2 . . 3.570 2.397 2.361 2.428 . 0 0 "[ . 1 . 2]" 1
57 1 9 VAL HA 1 10 VAL H . . 2.660 2.157 2.140 2.169 . 0 0 "[ . 1 . 2]" 1
58 1 9 VAL HA 1 10 VAL HB . . 5.240 4.932 4.901 5.004 . 0 0 "[ . 1 . 2]" 1
59 1 9 VAL HB 1 47 LEU MD2 . . 4.100 3.888 3.678 4.098 . 0 0 "[ . 1 . 2]" 1
60 1 9 VAL HB 1 53 ILE MD . . 5.500 5.261 4.943 5.487 . 0 0 "[ . 1 . 2]" 1
61 1 9 VAL HB 1 82 LEU H . . 4.040 3.141 2.777 3.485 . 0 0 "[ . 1 . 2]" 1
62 1 9 VAL HB 1 82 LEU HB2 . . 4.500 2.847 2.566 3.174 . 0 0 "[ . 1 . 2]" 1
63 1 9 VAL HB 1 82 LEU QB . . 3.640 2.798 2.532 3.095 . 0 0 "[ . 1 . 2]" 1
64 1 9 VAL HB 1 82 LEU HB3 . . 4.500 4.159 3.762 4.500 0.000 18 0 "[ . 1 . 2]" 1
65 1 9 VAL HB 1 82 LEU MD1 . . 4.590 4.283 3.968 4.597 0.007 10 0 "[ . 1 . 2]" 1
66 1 9 VAL HB 1 84 ILE MD . . 5.500 4.977 4.402 5.505 0.005 7 0 "[ . 1 . 2]" 1
67 1 9 VAL MG1 1 10 VAL H . . 3.210 3.041 2.843 3.163 . 0 0 "[ . 1 . 2]" 1
68 1 9 VAL MG1 1 10 VAL HA . . 3.720 3.619 3.508 3.714 . 0 0 "[ . 1 . 2]" 1
69 1 9 VAL MG1 1 11 LEU H . . 3.850 3.459 3.319 3.816 . 0 0 "[ . 1 . 2]" 1
70 1 9 VAL MG1 1 46 ASN QB . . 5.340 4.490 4.091 4.720 . 0 0 "[ . 1 . 2]" 1
71 1 9 VAL MG1 1 81 CYS HA . . 4.640 4.557 4.344 4.648 0.008 6 0 "[ . 1 . 2]" 1
72 1 9 VAL MG1 1 82 LEU H . . 3.870 3.595 3.410 3.747 . 0 0 "[ . 1 . 2]" 1
73 1 9 VAL MG2 1 46 ASN QB . . 4.310 4.123 3.644 4.319 0.009 14 0 "[ . 1 . 2]" 1
74 1 9 VAL MG2 1 84 ILE H . . 4.440 3.675 3.342 4.126 . 0 0 "[ . 1 . 2]" 1
75 1 9 VAL MG2 1 84 ILE MD . . 3.520 2.810 2.242 3.509 . 0 0 "[ . 1 . 2]" 1
76 1 9 VAL MG2 1 84 ILE HG12 . . 3.880 2.368 2.150 2.534 . 0 0 "[ . 1 . 2]" 1
77 1 9 VAL MG2 1 84 ILE QG . . 3.250 2.321 2.121 2.479 . 0 0 "[ . 1 . 2]" 1
78 1 9 VAL MG2 1 84 ILE HG13 . . 3.880 3.526 2.752 3.902 0.022 18 0 "[ . 1 . 2]" 1
79 1 10 VAL H 1 10 VAL HB . . 3.030 2.817 2.759 2.876 . 0 0 "[ . 1 . 2]" 1
80 1 10 VAL H 1 10 VAL MG1 . . 3.960 3.889 3.854 3.921 . 0 0 "[ . 1 . 2]" 1
81 1 10 VAL H 1 10 VAL MG2 . . 2.990 2.351 2.091 2.540 . 0 0 "[ . 1 . 2]" 1
82 1 10 VAL H 1 11 LEU H . . 4.590 4.131 4.035 4.287 . 0 0 "[ . 1 . 2]" 1
83 1 10 VAL H 1 11 LEU HG . . 5.040 4.816 4.626 4.980 . 0 0 "[ . 1 . 2]" 1
84 1 10 VAL H 1 81 CYS HA . . 5.040 4.832 4.592 5.008 . 0 0 "[ . 1 . 2]" 1
85 1 10 VAL HA 1 10 VAL MG1 . . 3.330 2.265 2.127 2.301 . 0 0 "[ . 1 . 2]" 1
86 1 10 VAL HA 1 11 LEU H . . 2.800 2.172 2.142 2.192 . 0 0 "[ . 1 . 2]" 1
87 1 10 VAL HA 1 79 GLN HB2 . . 5.090 4.645 4.252 5.097 0.007 14 0 "[ . 1 . 2]" 1
88 1 10 VAL HA 1 81 CYS HA . . 3.610 2.524 2.395 2.686 . 0 0 "[ . 1 . 2]" 1
89 1 10 VAL HA 1 82 LEU H . . 3.890 3.598 3.324 3.892 0.002 4 0 "[ . 1 . 2]" 1
90 1 10 VAL HB 1 11 LEU H . . 4.930 4.255 4.119 4.308 . 0 0 "[ . 1 . 2]" 1
91 1 10 VAL HB 1 12 PRO HD3 . . 5.500 5.358 5.110 5.508 0.008 5 0 "[ . 1 . 2]" 1
92 1 10 VAL MG1 1 11 LEU H . . 3.430 3.180 2.911 3.316 . 0 0 "[ . 1 . 2]" 1
93 1 10 VAL MG1 1 12 PRO HD3 . . 4.930 4.943 4.930 4.956 0.026 6 0 "[ . 1 . 2]" 1
94 1 10 VAL MG1 1 79 GLN HB2 . . 3.910 2.273 1.942 2.742 . 0 0 "[ . 1 . 2]" 1
95 1 10 VAL MG1 1 79 GLN HB3 . . 3.520 3.328 1.963 3.528 0.008 19 0 "[ . 1 . 2]" 1
96 1 10 VAL MG1 1 79 GLN HE21 . . 4.590 2.554 1.741 3.625 . 0 0 "[ . 1 . 2]" 1
97 1 10 VAL MG1 1 79 GLN HE22 . . 4.590 2.889 2.207 3.584 . 0 0 "[ . 1 . 2]" 1
98 1 10 VAL MG1 1 79 GLN HG2 . . 4.930 4.092 3.513 4.471 . 0 0 "[ . 1 . 2]" 1
99 1 10 VAL MG1 1 79 GLN QG . . 4.230 3.331 2.505 3.950 . 0 0 "[ . 1 . 2]" 1
100 1 10 VAL MG1 1 79 GLN HG3 . . 4.930 3.702 2.544 4.839 . 0 0 "[ . 1 . 2]" 1
101 1 10 VAL MG1 1 80 LEU H . . 4.540 3.687 3.343 3.920 . 0 0 "[ . 1 . 2]" 1
102 1 10 VAL MG1 1 81 CYS HA . . 4.390 3.176 2.839 3.480 . 0 0 "[ . 1 . 2]" 1
103 1 10 VAL MG1 1 81 CYS HB2 . . 4.610 3.847 2.924 4.632 0.022 4 0 "[ . 1 . 2]" 1
104 1 10 VAL MG1 1 81 CYS HB3 . . 4.610 4.493 4.229 4.616 0.006 4 0 "[ . 1 . 2]" 1
105 1 10 VAL MG2 1 79 GLN HE21 . . 5.040 4.078 3.342 4.887 . 0 0 "[ . 1 . 2]" 1
106 1 10 VAL MG2 1 79 GLN HE22 . . 5.040 4.122 3.223 4.794 . 0 0 "[ . 1 . 2]" 1
107 1 10 VAL MG2 1 81 CYS HA . . 4.000 3.223 2.936 3.487 . 0 0 "[ . 1 . 2]" 1
108 1 10 VAL MG2 1 81 CYS QB . . 4.020 3.704 3.387 4.023 0.003 2 0 "[ . 1 . 2]" 1
109 1 11 LEU H 1 11 LEU HB2 . . 3.310 2.685 2.599 2.763 . 0 0 "[ . 1 . 2]" 1
110 1 11 LEU H 1 11 LEU HB3 . . 3.850 3.648 3.602 3.700 . 0 0 "[ . 1 . 2]" 1
111 1 11 LEU H 1 11 LEU MD1 . . 4.390 3.599 3.415 3.795 . 0 0 "[ . 1 . 2]" 1
112 1 11 LEU H 1 11 LEU MD2 . . 4.040 3.210 3.017 3.454 . 0 0 "[ . 1 . 2]" 1
113 1 11 LEU H 1 11 LEU HG . . 3.480 2.156 1.946 2.393 . 0 0 "[ . 1 . 2]" 1
114 1 11 LEU H 1 12 PRO HD3 . . 5.160 4.891 4.816 4.927 . 0 0 "[ . 1 . 2]" 1
115 1 11 LEU H 1 17 TRP HZ3 . . 5.290 5.076 4.771 5.290 0.000 15 0 "[ . 1 . 2]" 1
116 1 11 LEU H 1 80 LEU H . . 3.660 3.394 3.010 3.579 . 0 0 "[ . 1 . 2]" 1
117 1 11 LEU H 1 80 LEU HB2 . . 5.350 4.880 4.614 5.185 . 0 0 "[ . 1 . 2]" 1
118 1 11 LEU H 1 81 CYS HA . . 3.850 3.829 3.711 3.864 0.014 4 0 "[ . 1 . 2]" 1
119 1 11 LEU H 1 82 LEU H . . 4.920 4.401 4.059 4.652 . 0 0 "[ . 1 . 2]" 1
120 1 11 LEU HA 1 11 LEU MD1 . . 4.440 3.952 3.910 4.001 . 0 0 "[ . 1 . 2]" 1
121 1 11 LEU HA 1 11 LEU MD2 . . 3.450 2.317 2.141 2.507 . 0 0 "[ . 1 . 2]" 1
122 1 11 LEU HA 1 12 PRO HB2 . . 5.500 5.494 5.468 5.509 0.009 9 0 "[ . 1 . 2]" 1
123 1 11 LEU HA 1 12 PRO HB3 . . 4.930 4.832 4.829 4.842 . 0 0 "[ . 1 . 2]" 1
124 1 11 LEU HA 1 12 PRO HD2 . . 3.260 2.160 2.082 2.205 . 0 0 "[ . 1 . 2]" 1
125 1 11 LEU HA 1 12 PRO HD3 . . 3.170 2.255 2.252 2.265 . 0 0 "[ . 1 . 2]" 1
126 1 11 LEU HA 1 12 PRO HG2 . . 4.610 4.320 4.258 4.355 . 0 0 "[ . 1 . 2]" 1
127 1 11 LEU HA 1 12 PRO HG3 . . 4.610 4.353 4.328 4.370 . 0 0 "[ . 1 . 2]" 1
128 1 11 LEU HA 1 17 TRP HE3 . . 5.500 4.924 4.678 5.138 . 0 0 "[ . 1 . 2]" 1
129 1 11 LEU HB2 1 11 LEU MD1 . . 3.490 2.220 2.093 2.313 . 0 0 "[ . 1 . 2]" 1
130 1 11 LEU HB2 1 12 PRO HD2 . . 4.800 3.804 3.724 3.942 . 0 0 "[ . 1 . 2]" 1
131 1 11 LEU HB2 1 12 PRO HD3 . . 5.500 4.775 4.724 4.848 . 0 0 "[ . 1 . 2]" 1
132 1 11 LEU HB2 1 17 TRP HE3 . . 3.840 2.759 2.467 2.963 . 0 0 "[ . 1 . 2]" 1
133 1 11 LEU HB2 1 17 TRP HZ3 . . 4.230 3.482 3.307 3.781 . 0 0 "[ . 1 . 2]" 1
134 1 11 LEU HB2 1 19 PHE QE . . 5.500 5.044 3.893 5.509 0.009 6 0 "[ . 1 . 2]" 1
135 1 11 LEU HB2 1 80 LEU H . . 3.680 3.425 3.049 3.631 . 0 0 "[ . 1 . 2]" 1
136 1 11 LEU HB2 1 80 LEU HB2 . . 4.610 4.073 3.741 4.610 0.000 18 0 "[ . 1 . 2]" 1
137 1 11 LEU HB2 1 80 LEU HB3 . . 4.000 2.609 2.290 3.208 . 0 0 "[ . 1 . 2]" 1
138 1 11 LEU HB2 1 80 LEU QD . . 4.470 3.463 3.193 4.026 . 0 0 "[ . 1 . 2]" 1
139 1 11 LEU HB2 1 82 LEU MD1 . . 5.110 4.703 4.200 5.087 . 0 0 "[ . 1 . 2]" 1
140 1 11 LEU HB3 1 11 LEU MD1 . . 3.650 2.463 2.388 2.541 . 0 0 "[ . 1 . 2]" 1
141 1 11 LEU HB3 1 12 PRO HA . . 5.500 5.220 5.145 5.293 . 0 0 "[ . 1 . 2]" 1
142 1 11 LEU HB3 1 12 PRO HD2 . . 4.230 2.485 2.373 2.690 . 0 0 "[ . 1 . 2]" 1
143 1 11 LEU HB3 1 12 PRO HD3 . . 4.390 3.847 3.754 4.016 . 0 0 "[ . 1 . 2]" 1
144 1 11 LEU HB3 1 12 PRO HG2 . . 5.360 4.292 4.194 4.477 . 0 0 "[ . 1 . 2]" 1
145 1 11 LEU HB3 1 17 TRP HE3 . . 3.910 3.094 2.790 3.312 . 0 0 "[ . 1 . 2]" 1
146 1 11 LEU HB3 1 17 TRP HZ3 . . 4.610 4.312 3.972 4.600 . 0 0 "[ . 1 . 2]" 1
147 1 11 LEU HB3 1 41 LYS HB2 . . 5.500 4.416 4.070 4.840 . 0 0 "[ . 1 . 2]" 1
148 1 11 LEU HB3 1 41 LYS HB3 . . 4.230 3.532 3.239 3.791 . 0 0 "[ . 1 . 2]" 1
149 1 11 LEU HB3 1 47 LEU MD1 . . 3.710 3.721 3.669 3.759 0.049 10 0 "[ . 1 . 2]" 1
150 1 11 LEU HB3 1 80 LEU HB3 . . 4.930 4.353 4.038 4.936 0.006 18 0 "[ . 1 . 2]" 1
151 1 11 LEU MD1 1 17 TRP HB2 . . 4.390 3.522 3.355 3.747 . 0 0 "[ . 1 . 2]" 1
152 1 11 LEU MD1 1 17 TRP HB3 . . 3.770 2.395 2.234 2.604 . 0 0 "[ . 1 . 2]" 1
153 1 11 LEU MD1 1 17 TRP HE3 . . 3.910 3.420 3.141 3.761 . 0 0 "[ . 1 . 2]" 1
154 1 11 LEU MD1 1 19 PHE QE . . 3.840 2.923 1.943 3.368 . 0 0 "[ . 1 . 2]" 1
155 1 11 LEU MD1 1 42 ALA H . . 5.500 5.145 4.773 5.505 0.005 14 0 "[ . 1 . 2]" 1
156 1 11 LEU MD1 1 42 ALA HA . . 4.100 3.040 2.649 3.486 . 0 0 "[ . 1 . 2]" 1
157 1 11 LEU MD1 1 80 LEU HB2 . . 4.930 4.247 3.843 4.717 . 0 0 "[ . 1 . 2]" 1
158 1 11 LEU MD1 1 80 LEU HB3 . . 3.420 3.047 2.616 3.388 . 0 0 "[ . 1 . 2]" 1
159 1 11 LEU MD1 1 80 LEU QD . . 3.600 2.260 1.960 3.148 . 0 0 "[ . 1 . 2]" 1
160 1 11 LEU MD1 1 82 LEU MD1 . . 3.840 2.472 2.021 2.986 . 0 0 "[ . 1 . 2]" 1
161 1 11 LEU MD2 1 12 PRO HD2 . . 4.930 3.264 3.067 3.434 . 0 0 "[ . 1 . 2]" 1
162 1 11 LEU MD2 1 12 PRO HD3 . . 4.930 3.896 3.725 4.104 . 0 0 "[ . 1 . 2]" 1
163 1 11 LEU MD2 1 12 PRO HG2 . . 5.500 5.148 4.919 5.302 . 0 0 "[ . 1 . 2]" 1
164 1 11 LEU MD2 1 17 TRP HB3 . . 4.610 4.470 4.251 4.593 . 0 0 "[ . 1 . 2]" 1
165 1 11 LEU MD2 1 17 TRP HE3 . . 5.210 4.812 4.632 5.025 . 0 0 "[ . 1 . 2]" 1
166 1 11 LEU MD2 1 19 PHE HB3 . . 5.380 4.784 4.350 5.150 . 0 0 "[ . 1 . 2]" 1
167 1 11 LEU MD2 1 41 LYS HB2 . . 5.500 4.983 4.854 5.273 . 0 0 "[ . 1 . 2]" 1
168 1 11 LEU MD2 1 41 LYS HB3 . . 4.320 4.297 4.172 4.349 0.029 10 0 "[ . 1 . 2]" 1
169 1 11 LEU MD2 1 42 ALA HA . . 3.330 2.977 2.697 3.351 0.021 8 0 "[ . 1 . 2]" 1
170 1 11 LEU MD2 1 45 ALA H . . 4.090 3.943 3.699 4.084 . 0 0 "[ . 1 . 2]" 1
171 1 11 LEU MD2 1 45 ALA MB . . 2.770 1.736 1.642 1.821 . 0 0 "[ . 1 . 2]" 1
172 1 11 LEU MD2 1 46 ASN H . . 5.300 5.228 5.071 5.305 0.005 5 0 "[ . 1 . 2]" 1
173 1 11 LEU MD2 1 47 LEU MD1 . . 3.610 1.796 1.658 1.946 . 0 0 "[ . 1 . 2]" 1
174 1 12 PRO HA 1 79 GLN HA . . 4.390 3.481 3.074 3.726 . 0 0 "[ . 1 . 2]" 1
175 1 12 PRO HA 1 79 GLN HB2 . . 5.340 4.312 3.767 5.047 . 0 0 "[ . 1 . 2]" 1
176 1 12 PRO HB2 1 13 GLY H . . 3.870 3.640 3.314 3.774 . 0 0 "[ . 1 . 2]" 1
177 1 12 PRO HB2 1 13 GLY HA2 . . 4.620 4.455 4.290 4.569 . 0 0 "[ . 1 . 2]" 1
178 1 12 PRO HB3 1 13 GLY H . . 4.210 4.077 3.859 4.170 . 0 0 "[ . 1 . 2]" 1
179 1 12 PRO HD2 1 41 LYS HA . . 4.930 3.942 3.665 4.200 . 0 0 "[ . 1 . 2]" 1
180 1 12 PRO HD2 1 41 LYS QD . . 4.940 3.649 3.311 3.901 . 0 0 "[ . 1 . 2]" 1
181 1 12 PRO HD3 1 41 LYS HA . . 5.470 5.025 4.591 5.378 . 0 0 "[ . 1 . 2]" 1
182 1 12 PRO HD3 1 41 LYS QD . . 5.340 4.617 4.248 4.961 . 0 0 "[ . 1 . 2]" 1
183 1 12 PRO HG2 1 17 TRP HE3 . . 5.500 4.919 4.653 5.234 . 0 0 "[ . 1 . 2]" 1
184 1 12 PRO HG2 1 41 LYS QD . . 4.010 1.951 1.779 2.265 . 0 0 "[ . 1 . 2]" 1
185 1 12 PRO HG2 1 41 LYS HE2 . . 4.740 3.492 2.102 4.361 . 0 0 "[ . 1 . 2]" 1
186 1 12 PRO HG2 1 41 LYS QE . . 4.090 3.207 2.089 3.829 . 0 0 "[ . 1 . 2]" 1
187 1 12 PRO HG2 1 41 LYS HE3 . . 4.740 4.160 3.354 4.735 . 0 0 "[ . 1 . 2]" 1
188 1 12 PRO HG2 1 41 LYS QG . . 4.180 2.963 2.003 3.943 . 0 0 "[ . 1 . 2]" 1
189 1 12 PRO HG3 1 41 LYS QE . . 4.810 3.952 2.911 4.524 . 0 0 "[ . 1 . 2]" 1
190 1 13 GLY H 1 17 TRP HE3 . . 5.500 4.941 4.639 5.265 . 0 0 "[ . 1 . 2]" 1
191 1 13 GLY H 1 17 TRP HH2 . . 4.260 3.797 3.321 4.199 . 0 0 "[ . 1 . 2]" 1
192 1 13 GLY H 1 17 TRP HZ3 . . 4.260 2.777 2.561 2.945 . 0 0 "[ . 1 . 2]" 1
193 1 13 GLY H 1 41 LYS QD . . 5.200 5.085 4.904 5.203 0.003 4 0 "[ . 1 . 2]" 1
194 1 13 GLY H 1 79 GLN H . . 5.000 4.768 4.590 4.956 . 0 0 "[ . 1 . 2]" 1
195 1 13 GLY H 1 79 GLN HA . . 3.170 2.678 2.384 2.971 . 0 0 "[ . 1 . 2]" 1
196 1 13 GLY H 1 79 GLN HB3 . . 4.260 3.762 3.487 4.030 . 0 0 "[ . 1 . 2]" 1
197 1 13 GLY H 1 80 LEU H . . 4.600 4.222 4.003 4.542 . 0 0 "[ . 1 . 2]" 1
198 1 13 GLY HA2 1 14 PRO HA . . 3.660 3.105 3.037 3.197 . 0 0 "[ . 1 . 2]" 1
199 1 13 GLY HA2 1 14 PRO QB . . 4.930 4.498 4.438 4.580 . 0 0 "[ . 1 . 2]" 1
200 1 13 GLY HA2 1 15 ALA H . . 4.600 4.372 4.220 4.498 . 0 0 "[ . 1 . 2]" 1
201 1 13 GLY HA2 1 15 ALA HA . . 5.500 3.957 3.883 4.040 . 0 0 "[ . 1 . 2]" 1
202 1 13 GLY HA2 1 17 TRP HE3 . . 4.930 3.562 3.404 3.804 . 0 0 "[ . 1 . 2]" 1
203 1 13 GLY HA2 1 17 TRP HH2 . . 4.250 3.766 3.472 4.100 . 0 0 "[ . 1 . 2]" 1
204 1 13 GLY HA2 1 17 TRP HZ3 . . 3.910 2.523 2.270 2.909 . 0 0 "[ . 1 . 2]" 1
205 1 13 GLY HA2 1 79 GLN HA . . 5.480 4.664 4.399 4.964 . 0 0 "[ . 1 . 2]" 1
206 1 13 GLY HA2 1 80 LEU H . . 5.500 5.323 5.132 5.504 0.004 16 0 "[ . 1 . 2]" 1
207 1 13 GLY HA3 1 14 PRO HA . . 3.520 1.969 1.921 2.009 . 0 0 "[ . 1 . 2]" 1
208 1 13 GLY HA3 1 14 PRO QB . . 4.610 3.840 3.798 3.874 . 0 0 "[ . 1 . 2]" 1
209 1 13 GLY HA3 1 15 ALA H . . 4.200 3.976 3.719 4.100 . 0 0 "[ . 1 . 2]" 1
210 1 13 GLY HA3 1 15 ALA HA . . 5.450 4.533 4.357 4.623 . 0 0 "[ . 1 . 2]" 1
211 1 13 GLY HA3 1 17 TRP HH2 . . 4.100 2.374 2.044 2.599 . 0 0 "[ . 1 . 2]" 1
212 1 13 GLY HA3 1 17 TRP HZ2 . . 4.930 4.315 4.063 4.666 . 0 0 "[ . 1 . 2]" 1
213 1 13 GLY HA3 1 17 TRP HZ3 . . 4.230 2.273 2.072 2.458 . 0 0 "[ . 1 . 2]" 1
214 1 14 PRO HA 1 15 ALA H . . 3.020 2.599 2.495 2.680 . 0 0 "[ . 1 . 2]" 1
215 1 14 PRO HA 1 15 ALA MB . . 4.610 4.244 4.194 4.319 . 0 0 "[ . 1 . 2]" 1
216 1 14 PRO HA 1 17 TRP HH2 . . 5.070 2.978 2.668 3.305 . 0 0 "[ . 1 . 2]" 1
217 1 14 PRO QB 1 15 ALA H . . 2.880 2.126 1.967 2.335 . 0 0 "[ . 1 . 2]" 1
218 1 14 PRO QB 1 15 ALA MB . . 4.610 3.502 3.414 3.603 . 0 0 "[ . 1 . 2]" 1
219 1 14 PRO QB 1 17 TRP HH2 . . 5.500 4.602 4.374 4.934 . 0 0 "[ . 1 . 2]" 1
220 1 14 PRO QB 1 17 TRP HZ2 . . 5.500 4.932 4.612 5.501 0.001 14 0 "[ . 1 . 2]" 1
221 1 14 PRO QD 1 15 ALA H . . 4.960 4.819 4.753 4.895 . 0 0 "[ . 1 . 2]" 1
222 1 14 PRO QG 1 15 ALA H . . 4.240 3.822 3.677 4.003 . 0 0 "[ . 1 . 2]" 1
223 1 14 PRO HG2 1 15 ALA H . . 5.000 4.035 3.871 4.240 . 0 0 "[ . 1 . 2]" 1
224 1 14 PRO HG3 1 15 ALA H . . 5.000 4.731 4.586 4.916 . 0 0 "[ . 1 . 2]" 1
225 1 15 ALA H 1 15 ALA MB . . 2.870 2.043 2.024 2.119 . 0 0 "[ . 1 . 2]" 1
226 1 15 ALA H 1 16 PRO HA . . 4.710 4.635 4.614 4.692 . 0 0 "[ . 1 . 2]" 1
227 1 15 ALA H 1 17 TRP HH2 . . 4.860 4.299 3.878 4.720 . 0 0 "[ . 1 . 2]" 1
228 1 15 ALA H 1 17 TRP HZ2 . . 4.680 3.841 3.325 4.255 . 0 0 "[ . 1 . 2]" 1
229 1 15 ALA HA 1 16 PRO HA . . 3.560 2.582 2.470 2.614 . 0 0 "[ . 1 . 2]" 1
230 1 15 ALA HA 1 17 TRP H . . 4.140 3.597 3.381 3.781 . 0 0 "[ . 1 . 2]" 1
231 1 15 ALA HA 1 17 TRP HE1 . . 5.040 4.484 4.213 4.751 . 0 0 "[ . 1 . 2]" 1
232 1 15 ALA HA 1 17 TRP HH2 . . 5.500 5.050 4.707 5.508 0.008 11 0 "[ . 1 . 2]" 1
233 1 15 ALA HA 1 17 TRP HZ2 . . 5.500 4.650 4.340 4.815 . 0 0 "[ . 1 . 2]" 1
234 1 15 ALA MB 1 16 PRO HA . . 2.970 1.895 1.866 1.940 . 0 0 "[ . 1 . 2]" 1
235 1 15 ALA MB 1 16 PRO HB2 . . 4.610 4.173 4.133 4.286 . 0 0 "[ . 1 . 2]" 1
236 1 15 ALA MB 1 16 PRO QB . . 3.910 3.351 3.311 3.486 . 0 0 "[ . 1 . 2]" 1
237 1 15 ALA MB 1 16 PRO HB3 . . 4.610 3.531 3.485 3.694 . 0 0 "[ . 1 . 2]" 1
238 1 15 ALA MB 1 16 PRO HD2 . . 5.180 4.323 4.306 4.384 . 0 0 "[ . 1 . 2]" 1
239 1 15 ALA MB 1 16 PRO QD . . 4.530 3.502 3.485 3.576 . 0 0 "[ . 1 . 2]" 1
240 1 15 ALA MB 1 16 PRO HD3 . . 5.180 3.701 3.682 3.790 . 0 0 "[ . 1 . 2]" 1
241 1 15 ALA MB 1 16 PRO QG . . 4.810 4.319 4.288 4.426 . 0 0 "[ . 1 . 2]" 1
242 1 15 ALA MB 1 17 TRP H . . 3.640 3.374 3.141 3.588 . 0 0 "[ . 1 . 2]" 1
243 1 15 ALA MB 1 17 TRP HD1 . . 4.230 3.452 3.110 3.724 . 0 0 "[ . 1 . 2]" 1
244 1 15 ALA MB 1 17 TRP HE1 . . 3.490 2.982 2.691 3.166 . 0 0 "[ . 1 . 2]" 1
245 1 15 ALA MB 1 17 TRP HZ2 . . 4.100 3.721 3.501 3.871 . 0 0 "[ . 1 . 2]" 1
246 1 15 ALA MB 1 18 GLY H . . 5.500 5.299 5.122 5.504 0.004 14 0 "[ . 1 . 2]" 1
247 1 15 ALA MB 1 76 ALA MB . . 4.930 3.849 3.157 4.441 . 0 0 "[ . 1 . 2]" 1
248 1 16 PRO HA 1 17 TRP H . . 2.960 2.447 2.353 2.532 . 0 0 "[ . 1 . 2]" 1
249 1 16 PRO HA 1 17 TRP HB2 . . 4.930 4.824 4.770 4.889 . 0 0 "[ . 1 . 2]" 1
250 1 16 PRO HA 1 17 TRP HD1 . . 4.610 4.277 3.982 4.494 . 0 0 "[ . 1 . 2]" 1
251 1 16 PRO HA 1 18 GLY H . . 4.870 4.611 4.268 4.859 . 0 0 "[ . 1 . 2]" 1
252 1 16 PRO QB 1 17 TRP H . . 3.540 2.441 2.257 2.645 . 0 0 "[ . 1 . 2]" 1
253 1 16 PRO QB 1 18 GLY H . . 3.900 3.375 2.915 3.529 . 0 0 "[ . 1 . 2]" 1
254 1 16 PRO HB2 1 17 TRP H . . 4.040 2.503 2.297 2.735 . 0 0 "[ . 1 . 2]" 1
255 1 16 PRO HB3 1 17 TRP H . . 4.040 3.401 3.302 3.516 . 0 0 "[ . 1 . 2]" 1
256 1 16 PRO QG 1 18 GLY H . . 5.150 4.999 4.566 5.116 . 0 0 "[ . 1 . 2]" 1
257 1 17 TRP H 1 17 TRP HB2 . . 3.490 2.622 2.569 2.702 . 0 0 "[ . 1 . 2]" 1
258 1 17 TRP H 1 17 TRP HD1 . . 3.850 3.204 2.868 3.492 . 0 0 "[ . 1 . 2]" 1
259 1 17 TRP H 1 17 TRP HE1 . . 5.350 4.995 4.756 5.215 . 0 0 "[ . 1 . 2]" 1
260 1 17 TRP H 1 17 TRP HE3 . . 5.500 4.923 4.796 5.125 . 0 0 "[ . 1 . 2]" 1
261 1 17 TRP H 1 18 GLY QA . . 4.910 4.042 3.916 4.141 . 0 0 "[ . 1 . 2]" 1
262 1 17 TRP HB2 1 17 TRP HD1 . . 3.520 2.566 2.549 2.600 . 0 0 "[ . 1 . 2]" 1
263 1 17 TRP HB2 1 18 GLY H . . 3.850 2.357 2.181 2.756 . 0 0 "[ . 1 . 2]" 1
264 1 17 TRP HB2 1 19 PHE H . . 3.920 2.665 2.448 3.085 . 0 0 "[ . 1 . 2]" 1
265 1 17 TRP HB2 1 19 PHE QD . . 4.390 2.258 1.992 3.260 . 0 0 "[ . 1 . 2]" 1
266 1 17 TRP HB2 1 19 PHE QE . . 4.230 3.053 2.709 3.518 . 0 0 "[ . 1 . 2]" 1
267 1 17 TRP HB2 1 42 ALA MB . . 4.930 4.340 3.783 4.721 . 0 0 "[ . 1 . 2]" 1
268 1 17 TRP HB2 1 80 LEU QD . . 4.890 3.747 3.357 4.179 . 0 0 "[ . 1 . 2]" 1
269 1 17 TRP HB3 1 17 TRP HE3 . . 4.100 2.826 2.696 2.934 . 0 0 "[ . 1 . 2]" 1
270 1 17 TRP HB3 1 18 GLY H . . 4.260 3.565 3.381 3.865 . 0 0 "[ . 1 . 2]" 1
271 1 17 TRP HB3 1 19 PHE H . . 4.330 3.744 3.344 4.290 . 0 0 "[ . 1 . 2]" 1
272 1 17 TRP HB3 1 19 PHE QD . . 4.230 2.529 2.365 3.069 . 0 0 "[ . 1 . 2]" 1
273 1 17 TRP HB3 1 19 PHE QE . . 3.910 3.345 2.721 3.678 . 0 0 "[ . 1 . 2]" 1
274 1 17 TRP HB3 1 41 LYS HB2 . . 5.500 4.745 3.857 5.501 0.001 6 0 "[ . 1 . 2]" 1
275 1 17 TRP HB3 1 42 ALA MB . . 4.610 4.133 3.508 4.528 . 0 0 "[ . 1 . 2]" 1
276 1 17 TRP HB3 1 80 LEU QD . . 4.580 3.442 2.998 3.933 . 0 0 "[ . 1 . 2]" 1
277 1 17 TRP HD1 1 73 ILE MG . . 3.310 2.191 1.880 2.705 . 0 0 "[ . 1 . 2]" 1
278 1 17 TRP HD1 1 80 LEU QD . . 4.580 3.128 2.778 3.385 . 0 0 "[ . 1 . 2]" 1
279 1 17 TRP HE1 1 73 ILE HA . . 5.500 3.437 3.052 4.297 . 0 0 "[ . 1 . 2]" 1
280 1 17 TRP HE1 1 73 ILE HB . . 5.290 4.662 4.197 5.206 . 0 0 "[ . 1 . 2]" 1
281 1 17 TRP HE1 1 73 ILE MG . . 3.370 2.164 1.804 2.746 . 0 0 "[ . 1 . 2]" 1
282 1 17 TRP HE1 1 74 LYS HA . . 4.950 4.203 3.277 4.707 . 0 0 "[ . 1 . 2]" 1
283 1 17 TRP HE1 1 76 ALA H . . 5.290 4.343 3.492 4.814 . 0 0 "[ . 1 . 2]" 1
284 1 17 TRP HE1 1 76 ALA MB . . 3.960 2.797 1.908 3.451 . 0 0 "[ . 1 . 2]" 1
285 1 17 TRP HE1 1 80 LEU HB2 . . 5.040 3.743 3.122 3.977 . 0 0 "[ . 1 . 2]" 1
286 1 17 TRP HE1 1 80 LEU MD1 . . 4.510 3.497 3.019 4.232 . 0 0 "[ . 1 . 2]" 1
287 1 17 TRP HE1 1 80 LEU QD . . 3.900 2.784 2.453 3.087 . 0 0 "[ . 1 . 2]" 1
288 1 17 TRP HE1 1 80 LEU MD2 . . 4.510 2.972 2.469 3.423 . 0 0 "[ . 1 . 2]" 1
289 1 17 TRP HE3 1 41 LYS HB2 . . 5.500 4.447 3.614 5.116 . 0 0 "[ . 1 . 2]" 1
290 1 17 TRP HE3 1 41 LYS HB3 . . 4.940 4.267 3.432 4.937 . 0 0 "[ . 1 . 2]" 1
291 1 17 TRP HE3 1 41 LYS QD . . 4.570 4.379 3.969 4.580 0.010 3 0 "[ . 1 . 2]" 1
292 1 17 TRP HE3 1 80 LEU HB3 . . 4.930 3.953 3.512 4.246 . 0 0 "[ . 1 . 2]" 1
293 1 17 TRP HH2 1 76 ALA MB . . 4.390 3.495 3.101 3.786 . 0 0 "[ . 1 . 2]" 1
294 1 17 TRP HH2 1 77 SER HA . . 5.500 5.376 5.122 5.502 0.002 6 0 "[ . 1 . 2]" 1
295 1 17 TRP HH2 1 79 GLN H . . 4.490 3.763 3.478 4.138 . 0 0 "[ . 1 . 2]" 1
296 1 17 TRP HH2 1 79 GLN HA . . 4.230 2.796 2.016 3.116 . 0 0 "[ . 1 . 2]" 1
297 1 17 TRP HH2 1 79 GLN HB2 . . 5.500 5.117 4.761 5.418 . 0 0 "[ . 1 . 2]" 1
298 1 17 TRP HH2 1 80 LEU H . . 4.330 2.918 2.678 3.166 . 0 0 "[ . 1 . 2]" 1
299 1 17 TRP HH2 1 80 LEU HB2 . . 5.500 3.139 2.919 3.640 . 0 0 "[ . 1 . 2]" 1
300 1 17 TRP HH2 1 80 LEU HB3 . . 5.050 4.022 3.548 4.345 . 0 0 "[ . 1 . 2]" 1
301 1 17 TRP HZ2 1 73 ILE MG . . 5.270 4.409 4.000 5.058 . 0 0 "[ . 1 . 2]" 1
302 1 17 TRP HZ2 1 76 ALA MB . . 3.010 1.878 1.768 1.979 . 0 0 "[ . 1 . 2]" 1
303 1 17 TRP HZ2 1 77 SER H . . 4.330 3.781 3.156 4.304 . 0 0 "[ . 1 . 2]" 1
304 1 17 TRP HZ2 1 79 GLN H . . 5.500 5.351 4.653 5.508 0.008 4 0 "[ . 1 . 2]" 1
305 1 17 TRP HZ2 1 80 LEU HB2 . . 4.610 2.642 2.278 2.873 . 0 0 "[ . 1 . 2]" 1
306 1 17 TRP HZ2 1 80 LEU HB3 . . 4.810 4.212 3.567 4.583 . 0 0 "[ . 1 . 2]" 1
307 1 17 TRP HZ2 1 80 LEU MD1 . . 5.500 3.384 2.765 3.904 . 0 0 "[ . 1 . 2]" 1
308 1 17 TRP HZ2 1 80 LEU QD . . 4.450 3.141 2.701 3.502 . 0 0 "[ . 1 . 2]" 1
309 1 17 TRP HZ2 1 80 LEU MD2 . . 5.500 3.807 3.086 4.127 . 0 0 "[ . 1 . 2]" 1
310 1 17 TRP HZ3 1 80 LEU H . . 4.330 2.928 2.488 3.369 . 0 0 "[ . 1 . 2]" 1
311 1 18 GLY H 1 19 PHE H . . 3.140 2.104 1.934 2.277 . 0 0 "[ . 1 . 2]" 1
312 1 18 GLY H 1 19 PHE QD . . 5.040 3.740 3.259 4.411 . 0 0 "[ . 1 . 2]" 1
313 1 18 GLY H 1 42 ALA MB . . 5.040 3.864 3.599 4.273 . 0 0 "[ . 1 . 2]" 1
314 1 18 GLY QA 1 42 ALA MB . . 4.310 1.987 1.905 2.190 . 0 0 "[ . 1 . 2]" 1
315 1 19 PHE H 1 19 PHE HB3 . . 4.000 2.803 2.548 3.079 . 0 0 "[ . 1 . 2]" 1
316 1 19 PHE H 1 20 ARG QD . . 4.930 4.292 3.884 4.721 . 0 0 "[ . 1 . 2]" 1
317 1 19 PHE H 1 33 ILE MG . . 5.500 5.388 5.123 5.553 0.053 12 0 "[ . 1 . 2]" 1
318 1 19 PHE H 1 36 ILE MD . . 5.320 4.283 3.895 4.511 . 0 0 "[ . 1 . 2]" 1
319 1 19 PHE H 1 36 ILE MG . . 5.500 5.405 5.001 5.514 0.014 15 0 "[ . 1 . 2]" 1
320 1 19 PHE H 1 42 ALA MB . . 4.140 3.186 2.742 3.692 . 0 0 "[ . 1 . 2]" 1
321 1 19 PHE H 1 47 LEU MD1 . . 5.500 4.394 3.749 5.131 . 0 0 "[ . 1 . 2]" 1
322 1 19 PHE HA 1 20 ARG H . . 2.880 2.288 2.193 2.440 . 0 0 "[ . 1 . 2]" 1
323 1 19 PHE HA 1 33 ILE MG . . 4.250 3.292 3.095 3.456 . 0 0 "[ . 1 . 2]" 1
324 1 19 PHE HA 1 35 ARG H . . 4.880 4.634 4.450 4.826 . 0 0 "[ . 1 . 2]" 1
325 1 19 PHE HA 1 36 ILE HA . . 3.520 2.563 2.327 2.777 . 0 0 "[ . 1 . 2]" 1
326 1 19 PHE HA 1 36 ILE MD . . 4.100 2.166 1.926 2.411 . 0 0 "[ . 1 . 2]" 1
327 1 19 PHE HA 1 36 ILE MG . . 4.820 3.854 3.576 4.034 . 0 0 "[ . 1 . 2]" 1
328 1 19 PHE HA 1 37 THR H . . 3.960 3.569 3.190 3.739 . 0 0 "[ . 1 . 2]" 1
329 1 19 PHE HA 1 42 ALA MB . . 4.610 3.240 2.977 3.648 . 0 0 "[ . 1 . 2]" 1
330 1 19 PHE HB2 1 20 ARG H . . 3.250 2.873 2.519 3.173 . 0 0 "[ . 1 . 2]" 1
331 1 19 PHE HB2 1 33 ILE MD . . 4.390 2.843 2.203 3.472 . 0 0 "[ . 1 . 2]" 1
332 1 19 PHE HB2 1 33 ILE HG12 . . 4.210 3.082 2.561 3.547 . 0 0 "[ . 1 . 2]" 1
333 1 19 PHE HB2 1 33 ILE MG . . 3.490 2.455 2.154 2.886 . 0 0 "[ . 1 . 2]" 1
334 1 19 PHE HB2 1 34 THR H . . 5.500 5.516 5.433 5.570 0.070 5 0 "[ . 1 . 2]" 1
335 1 19 PHE HB2 1 35 ARG H . . 5.300 5.170 4.975 5.311 0.011 13 0 "[ . 1 . 2]" 1
336 1 19 PHE HB2 1 36 ILE MD . . 3.770 2.006 1.838 2.335 . 0 0 "[ . 1 . 2]" 1
337 1 19 PHE HB2 1 42 ALA MB . . 4.000 3.704 3.317 3.991 . 0 0 "[ . 1 . 2]" 1
338 1 19 PHE HB3 1 20 ARG H . . 4.280 4.118 3.898 4.298 0.018 7 0 "[ . 1 . 2]" 1
339 1 19 PHE HB3 1 33 ILE HG12 . . 5.190 4.652 4.198 5.061 . 0 0 "[ . 1 . 2]" 1
340 1 19 PHE HB3 1 33 ILE MG . . 4.710 3.995 3.715 4.316 . 0 0 "[ . 1 . 2]" 1
341 1 19 PHE HB3 1 36 ILE MD . . 3.520 2.619 2.234 3.008 . 0 0 "[ . 1 . 2]" 1
342 1 19 PHE HB3 1 36 ILE MG . . 4.610 4.133 3.551 4.555 . 0 0 "[ . 1 . 2]" 1
343 1 19 PHE HB3 1 37 THR H . . 5.160 4.875 4.515 5.165 0.005 17 0 "[ . 1 . 2]" 1
344 1 19 PHE HB3 1 42 ALA MB . . 3.710 2.569 1.967 2.983 . 0 0 "[ . 1 . 2]" 1
345 1 19 PHE HB3 1 47 LEU HB3 . . 4.930 3.919 3.207 4.306 . 0 0 "[ . 1 . 2]" 1
346 1 19 PHE HB3 1 47 LEU MD1 . . 4.610 2.394 1.959 2.833 . 0 0 "[ . 1 . 2]" 1
347 1 19 PHE HB3 1 47 LEU MD2 . . 4.810 4.198 3.584 4.690 . 0 0 "[ . 1 . 2]" 1
348 1 19 PHE QD 1 20 ARG H . . 4.400 3.115 2.702 3.500 . 0 0 "[ . 1 . 2]" 1
349 1 19 PHE QD 1 33 ILE MD . . 4.230 3.236 2.836 3.697 . 0 0 "[ . 1 . 2]" 1
350 1 19 PHE QD 1 33 ILE HG12 . . 3.650 2.138 1.990 2.485 . 0 0 "[ . 1 . 2]" 1
351 1 19 PHE QD 1 33 ILE HG13 . . 3.940 3.730 3.470 3.945 0.005 6 0 "[ . 1 . 2]" 1
352 1 19 PHE QD 1 33 ILE MG . . 4.230 2.819 2.257 3.258 . 0 0 "[ . 1 . 2]" 1
353 1 19 PHE QD 1 34 THR H . . 5.290 4.615 4.314 4.898 . 0 0 "[ . 1 . 2]" 1
354 1 19 PHE QD 1 36 ILE MD . . 4.930 3.510 3.303 3.805 . 0 0 "[ . 1 . 2]" 1
355 1 19 PHE QD 1 42 ALA HA . . 4.930 4.512 3.727 4.932 0.002 2 0 "[ . 1 . 2]" 1
356 1 19 PHE QD 1 42 ALA MB . . 4.180 3.648 2.723 4.177 . 0 0 "[ . 1 . 2]" 1
357 1 19 PHE QD 1 47 LEU MD1 . . 4.170 3.237 2.058 3.695 . 0 0 "[ . 1 . 2]" 1
358 1 19 PHE QE 1 21 LEU HB2 . . 5.070 4.800 4.293 5.085 0.015 9 0 "[ . 1 . 2]" 1
359 1 19 PHE QE 1 21 LEU HB3 . . 4.610 3.098 2.642 3.384 . 0 0 "[ . 1 . 2]" 1
360 1 19 PHE QE 1 21 LEU HG . . 5.090 4.209 3.575 4.592 . 0 0 "[ . 1 . 2]" 1
361 1 19 PHE QE 1 33 ILE HG12 . . 4.050 3.681 3.067 4.079 0.029 4 0 "[ . 1 . 2]" 1
362 1 19 PHE QE 1 33 ILE HG13 . . 5.400 4.607 4.295 4.871 . 0 0 "[ . 1 . 2]" 1
363 1 19 PHE QE 1 53 ILE MD . . 4.230 3.245 3.012 3.818 . 0 0 "[ . 1 . 2]" 1
364 1 19 PHE QE 1 73 ILE HB . . 5.500 5.231 4.687 5.511 0.011 9 0 "[ . 1 . 2]" 1
365 1 19 PHE QE 1 73 ILE MD . . 4.210 2.827 2.253 3.376 . 0 0 "[ . 1 . 2]" 1
366 1 19 PHE QE 1 80 LEU QD . . 3.480 1.962 1.838 2.253 . 0 0 "[ . 1 . 2]" 1
367 1 19 PHE QE 1 82 LEU MD1 . . 4.390 2.671 2.289 2.873 . 0 0 "[ . 1 . 2]" 1
368 1 19 PHE HZ 1 53 ILE MD . . 4.100 4.105 4.070 4.120 0.020 18 0 "[ . 1 . 2]" 1
369 1 19 PHE HZ 1 73 ILE MD . . 3.330 2.447 1.901 2.983 . 0 0 "[ . 1 . 2]" 1
370 1 19 PHE HZ 1 73 ILE HG12 . . 4.430 2.497 1.997 2.853 . 0 0 "[ . 1 . 2]" 1
371 1 19 PHE HZ 1 73 ILE MG . . 3.710 2.949 2.389 3.451 . 0 0 "[ . 1 . 2]" 1
372 1 19 PHE HZ 1 80 LEU MD1 . . 4.610 3.979 3.258 4.302 . 0 0 "[ . 1 . 2]" 1
373 1 19 PHE HZ 1 80 LEU QD . . 3.530 2.481 1.928 2.917 . 0 0 "[ . 1 . 2]" 1
374 1 19 PHE HZ 1 80 LEU MD2 . . 4.610 2.512 1.932 2.991 . 0 0 "[ . 1 . 2]" 1
375 1 19 PHE HZ 1 82 LEU MD1 . . 3.840 2.356 2.023 2.720 . 0 0 "[ . 1 . 2]" 1
376 1 19 PHE HZ 1 82 LEU MD2 . . 4.100 3.275 2.775 3.922 . 0 0 "[ . 1 . 2]" 1
377 1 20 ARG H 1 20 ARG HB2 . . 3.180 2.703 2.572 2.848 . 0 0 "[ . 1 . 2]" 1
378 1 20 ARG H 1 20 ARG HB3 . . 3.970 3.731 3.689 3.821 . 0 0 "[ . 1 . 2]" 1
379 1 20 ARG H 1 20 ARG QD . . 4.000 3.301 3.012 3.657 . 0 0 "[ . 1 . 2]" 1
380 1 20 ARG H 1 20 ARG HG3 . . 4.610 3.904 3.637 4.105 . 0 0 "[ . 1 . 2]" 1
381 1 20 ARG H 1 21 LEU H . . 4.710 4.488 4.448 4.511 . 0 0 "[ . 1 . 2]" 1
382 1 20 ARG H 1 33 ILE HA . . 4.710 4.158 3.881 4.492 . 0 0 "[ . 1 . 2]" 1
383 1 20 ARG H 1 33 ILE MG . . 3.660 2.253 1.873 2.652 . 0 0 "[ . 1 . 2]" 1
384 1 20 ARG H 1 34 THR H . . 4.490 3.536 3.433 3.640 . 0 0 "[ . 1 . 2]" 1
385 1 20 ARG H 1 35 ARG H . . 3.430 2.850 2.588 3.133 . 0 0 "[ . 1 . 2]" 1
386 1 20 ARG H 1 36 ILE MD . . 4.610 2.901 2.540 3.315 . 0 0 "[ . 1 . 2]" 1
387 1 20 ARG H 1 37 THR H . . 5.500 5.444 5.149 5.528 0.028 13 0 "[ . 1 . 2]" 1
388 1 20 ARG HA 1 21 LEU H . . 2.730 2.533 2.523 2.542 . 0 0 "[ . 1 . 2]" 1
389 1 20 ARG HA 1 34 THR H . . 4.460 4.368 4.252 4.598 0.138 20 0 "[ . 1 . 2]" 1
390 1 20 ARG HB2 1 21 LEU H . . 3.270 3.157 3.023 3.258 . 0 0 "[ . 1 . 2]" 1
391 1 20 ARG HB2 1 22 SER QB . . 5.340 5.116 4.835 5.438 0.098 6 0 "[ . 1 . 2]" 1
392 1 20 ARG HB2 1 34 THR H . . 3.920 2.241 1.975 2.593 . 0 0 "[ . 1 . 2]" 1
393 1 20 ARG HB2 1 34 THR HB . . 4.390 3.720 2.948 4.436 0.046 12 0 "[ . 1 . 2]" 1
394 1 20 ARG HB2 1 34 THR MG . . 4.000 2.715 1.841 4.022 0.022 7 0 "[ . 1 . 2]" 1
395 1 20 ARG HB2 1 35 ARG H . . 3.240 1.942 1.882 2.287 . 0 0 "[ . 1 . 2]" 1
396 1 20 ARG HB3 1 21 LEU H . . 3.490 2.269 2.185 2.355 . 0 0 "[ . 1 . 2]" 1
397 1 20 ARG HB3 1 34 THR H . . 4.860 3.541 3.228 3.806 . 0 0 "[ . 1 . 2]" 1
398 1 20 ARG HB3 1 34 THR MG . . 4.610 2.801 1.971 4.217 . 0 0 "[ . 1 . 2]" 1
399 1 20 ARG HB3 1 35 ARG H . . 4.160 3.648 3.524 4.030 . 0 0 "[ . 1 . 2]" 1
400 1 20 ARG QD 1 21 LEU H . . 4.710 3.956 3.682 4.355 . 0 0 "[ . 1 . 2]" 1
401 1 20 ARG QD 1 21 LEU MD1 . . 5.240 4.733 4.387 5.239 . 0 0 "[ . 1 . 2]" 1
402 1 20 ARG QD 1 35 ARG H . . 5.170 4.515 4.208 5.085 . 0 0 "[ . 1 . 2]" 1
403 1 20 ARG HG2 1 35 ARG H . . 4.610 2.909 2.510 3.652 . 0 0 "[ . 1 . 2]" 1
404 1 20 ARG HG2 1 35 ARG HA . . 4.450 4.424 4.300 4.536 0.086 12 0 "[ . 1 . 2]" 1
405 1 20 ARG HG2 1 36 ILE H . . 5.020 4.717 4.461 4.896 . 0 0 "[ . 1 . 2]" 1
406 1 20 ARG HG3 1 35 ARG H . . 4.610 3.376 2.766 4.041 . 0 0 "[ . 1 . 2]" 1
407 1 21 LEU H 1 21 LEU HB2 . . 4.000 3.698 3.582 3.844 . 0 0 "[ . 1 . 2]" 1
408 1 21 LEU H 1 21 LEU HB3 . . 3.820 3.481 3.357 3.599 . 0 0 "[ . 1 . 2]" 1
409 1 21 LEU H 1 21 LEU MD1 . . 3.890 1.943 1.840 2.724 . 0 0 "[ . 1 . 2]" 1
410 1 21 LEU H 1 21 LEU HG . . 4.230 2.473 2.276 2.842 . 0 0 "[ . 1 . 2]" 1
411 1 21 LEU H 1 22 SER H . . 4.490 4.422 4.368 4.478 . 0 0 "[ . 1 . 2]" 1
412 1 21 LEU H 1 70 GLN QE . . 5.180 4.746 3.874 5.205 0.025 19 0 "[ . 1 . 2]" 1
413 1 21 LEU HA 1 21 LEU MD1 . . 3.560 3.480 3.360 3.541 . 0 0 "[ . 1 . 2]" 1
414 1 21 LEU HA 1 22 SER H . . 2.770 2.292 2.219 2.366 . 0 0 "[ . 1 . 2]" 1
415 1 21 LEU HA 1 32 VAL H . . 4.880 4.676 4.273 4.861 . 0 0 "[ . 1 . 2]" 1
416 1 21 LEU HA 1 33 ILE HA . . 3.490 2.397 2.098 2.637 . 0 0 "[ . 1 . 2]" 1
417 1 21 LEU HA 1 34 THR H . . 3.320 3.194 2.711 3.376 0.056 5 0 "[ . 1 . 2]" 1
418 1 21 LEU HA 1 34 THR MG . . 4.100 3.260 2.647 4.085 . 0 0 "[ . 1 . 2]" 1
419 1 21 LEU HA 1 35 ARG H . . 5.450 5.238 4.694 5.478 0.028 15 0 "[ . 1 . 2]" 1
420 1 21 LEU HB2 1 22 SER H . . 3.460 2.751 2.502 2.931 . 0 0 "[ . 1 . 2]" 1
421 1 21 LEU HB2 1 31 LEU HA . . 5.240 4.836 4.374 5.251 0.011 5 0 "[ . 1 . 2]" 1
422 1 21 LEU HB2 1 32 VAL H . . 5.240 5.060 4.575 5.254 0.014 2 0 "[ . 1 . 2]" 1
423 1 21 LEU HB2 1 66 HIS HE1 . . 4.390 2.495 2.001 3.892 . 0 0 "[ . 1 . 2]" 1
424 1 21 LEU HB2 1 70 GLN QE . . 4.570 4.429 4.140 4.589 0.019 9 0 "[ . 1 . 2]" 1
425 1 21 LEU HB3 1 21 LEU MD2 . . 3.340 2.309 2.143 2.475 . 0 0 "[ . 1 . 2]" 1
426 1 21 LEU HB3 1 22 SER H . . 3.850 3.643 3.437 3.915 0.065 20 0 "[ . 1 . 2]" 1
427 1 21 LEU HB3 1 70 GLN QE . . 5.340 5.104 4.369 5.360 0.020 5 0 "[ . 1 . 2]" 1
428 1 21 LEU MD1 1 22 SER H . . 4.230 3.784 3.402 4.006 . 0 0 "[ . 1 . 2]" 1
429 1 21 LEU MD1 1 34 THR HB . . 5.500 5.531 5.253 5.639 0.139 18 0 "[ . 1 . 2]" 1
430 1 21 LEU MD1 1 66 HIS HD2 . . 4.610 3.885 3.549 4.349 . 0 0 "[ . 1 . 2]" 1
431 1 21 LEU MD1 1 66 HIS HE1 . . 4.320 2.204 1.928 2.669 . 0 0 "[ . 1 . 2]" 1
432 1 21 LEU MD1 1 70 GLN QE . . 3.650 1.825 1.698 2.027 . 0 0 "[ . 1 . 2]" 1
433 1 21 LEU MD1 1 70 GLN HG2 . . 5.340 3.746 2.123 4.730 . 0 0 "[ . 1 . 2]" 1
434 1 21 LEU MD1 1 70 GLN HG3 . . 5.340 4.440 3.221 4.920 . 0 0 "[ . 1 . 2]" 1
435 1 21 LEU MD2 1 22 SER H . . 5.180 4.660 4.220 4.911 . 0 0 "[ . 1 . 2]" 1
436 1 21 LEU MD2 1 70 GLN H . . 4.260 3.569 2.610 4.266 0.006 6 0 "[ . 1 . 2]" 1
437 1 21 LEU MD2 1 70 GLN QE . . 4.060 2.374 1.613 3.056 . 0 0 "[ . 1 . 2]" 1
438 1 21 LEU MD2 1 70 GLN QG . . 4.440 2.729 1.770 3.400 . 0 0 "[ . 1 . 2]" 1
439 1 21 LEU HG 1 70 GLN HE21 . . 5.500 4.490 2.717 5.336 . 0 0 "[ . 1 . 2]" 1
440 1 21 LEU HG 1 70 GLN QE . . 4.830 3.688 2.283 4.197 . 0 0 "[ . 1 . 2]" 1
441 1 21 LEU HG 1 70 GLN HE22 . . 5.500 4.175 2.305 5.531 0.031 19 0 "[ . 1 . 2]" 1
442 1 22 SER H 1 22 SER HB2 . . 4.000 3.122 2.804 3.535 . 0 0 "[ . 1 . 2]" 1
443 1 22 SER H 1 22 SER QB . . 3.430 2.720 2.583 2.791 . 0 0 "[ . 1 . 2]" 1
444 1 22 SER H 1 22 SER HB3 . . 4.000 3.102 2.657 3.784 . 0 0 "[ . 1 . 2]" 1
445 1 22 SER H 1 23 GLY H . . 4.710 4.331 4.185 4.420 . 0 0 "[ . 1 . 2]" 1
446 1 22 SER H 1 31 LEU HA . . 4.140 3.690 3.518 3.905 . 0 0 "[ . 1 . 2]" 1
447 1 22 SER H 1 31 LEU QD . . 4.480 3.641 3.144 3.977 . 0 0 "[ . 1 . 2]" 1
448 1 22 SER H 1 32 VAL H . . 3.210 2.870 2.533 3.019 . 0 0 "[ . 1 . 2]" 1
449 1 22 SER H 1 33 ILE HA . . 4.090 3.750 3.433 4.027 . 0 0 "[ . 1 . 2]" 1
450 1 22 SER H 1 34 THR H . . 4.500 4.417 4.174 4.514 0.014 1 0 "[ . 1 . 2]" 1
451 1 22 SER H 1 34 THR MG . . 3.530 3.336 2.829 3.646 0.116 9 0 "[ . 1 . 2]" 1
452 1 22 SER H 1 66 HIS HE1 . . 5.290 3.030 2.540 3.984 . 0 0 "[ . 1 . 2]" 1
453 1 22 SER HA 1 23 GLY H . . 2.960 2.300 2.157 2.583 . 0 0 "[ . 1 . 2]" 1
454 1 22 SER HA 1 66 HIS HE1 . . 3.450 2.402 1.971 2.834 . 0 0 "[ . 1 . 2]" 1
455 1 22 SER QB 1 23 GLY H . . 3.630 3.305 2.754 3.697 0.067 19 0 "[ . 1 . 2]" 1
456 1 22 SER QB 1 23 GLY QA . . 5.180 3.909 3.630 4.356 . 0 0 "[ . 1 . 2]" 1
457 1 22 SER QB 1 32 VAL H . . 4.910 3.319 2.679 3.990 . 0 0 "[ . 1 . 2]" 1
458 1 22 SER QB 1 32 VAL HB . . 5.340 4.400 2.956 5.347 0.007 6 0 "[ . 1 . 2]" 1
459 1 22 SER HB2 1 23 GLY H . . 4.320 4.065 3.688 4.357 0.037 19 0 "[ . 1 . 2]" 1
460 1 22 SER HB2 1 34 THR MG . . 3.390 1.896 1.747 2.531 . 0 0 "[ . 1 . 2]" 1
461 1 22 SER HB3 1 23 GLY H . . 4.320 3.556 2.830 4.347 0.027 20 0 "[ . 1 . 2]" 1
462 1 22 SER HB3 1 34 THR MG . . 3.390 3.041 1.952 3.427 0.037 16 0 "[ . 1 . 2]" 1
463 1 23 GLY H 1 24 GLY H . . 4.770 4.566 4.382 4.652 . 0 0 "[ . 1 . 2]" 1
464 1 23 GLY H 1 27 PHE HB2 . . 5.300 5.244 5.014 5.311 0.011 7 0 "[ . 1 . 2]" 1
465 1 23 GLY H 1 29 GLN QB . . 5.340 4.566 4.206 4.835 . 0 0 "[ . 1 . 2]" 1
466 1 23 GLY H 1 31 LEU QD . . 4.560 4.288 3.634 4.615 0.055 9 0 "[ . 1 . 2]" 1
467 1 23 GLY H 1 66 HIS HD2 . . 5.500 5.497 5.410 5.549 0.049 19 0 "[ . 1 . 2]" 1
468 1 23 GLY H 1 66 HIS HE1 . . 4.330 3.553 2.387 4.256 . 0 0 "[ . 1 . 2]" 1
469 1 23 GLY QA 1 24 GLY H . . 2.690 2.208 2.152 2.271 . 0 0 "[ . 1 . 2]" 1
470 1 23 GLY QA 1 27 PHE HB2 . . 3.900 3.377 3.170 3.808 . 0 0 "[ . 1 . 2]" 1
471 1 23 GLY QA 1 27 PHE HB3 . . 5.340 4.240 3.886 4.759 . 0 0 "[ . 1 . 2]" 1
472 1 23 GLY QA 1 29 GLN QB . . 3.500 2.368 2.136 2.538 . 0 0 "[ . 1 . 2]" 1
473 1 23 GLY QA 1 29 GLN QE . . 4.630 3.845 2.825 4.633 0.003 5 0 "[ . 1 . 2]" 1
474 1 23 GLY QA 1 29 GLN QG . . 4.380 3.853 1.804 4.360 . 0 0 "[ . 1 . 2]" 1
475 1 23 GLY HA2 1 24 GLY H . . 3.200 2.886 2.692 3.039 . 0 0 "[ . 1 . 2]" 1
476 1 23 GLY HA3 1 24 GLY H . . 3.200 2.297 2.201 2.447 . 0 0 "[ . 1 . 2]" 1
477 1 24 GLY H 1 25 ILE H . . 4.260 3.991 3.608 4.217 . 0 0 "[ . 1 . 2]" 1
478 1 24 GLY H 1 27 PHE HB2 . . 4.250 3.684 3.210 4.252 0.002 19 0 "[ . 1 . 2]" 1
479 1 24 GLY H 1 27 PHE QD . . 4.860 4.358 3.880 4.763 . 0 0 "[ . 1 . 2]" 1
480 1 24 GLY H 1 29 GLN HB2 . . 4.200 3.128 2.675 4.036 . 0 0 "[ . 1 . 2]" 1
481 1 24 GLY H 1 29 GLN QB . . 3.530 2.856 2.397 3.527 . 0 0 "[ . 1 . 2]" 1
482 1 24 GLY H 1 29 GLN HB3 . . 4.200 3.433 2.415 4.059 . 0 0 "[ . 1 . 2]" 1
483 1 24 GLY H 1 30 PRO HA . . 4.400 4.168 3.749 4.419 0.019 9 0 "[ . 1 . 2]" 1
484 1 24 GLY H 1 31 LEU H . . 4.860 4.359 3.719 4.736 . 0 0 "[ . 1 . 2]" 1
485 1 24 GLY H 1 31 LEU QD . . 4.020 3.166 2.447 3.599 . 0 0 "[ . 1 . 2]" 1
486 1 24 GLY HA2 1 25 ILE H . . 3.110 2.196 2.139 2.284 . 0 0 "[ . 1 . 2]" 1
487 1 24 GLY HA2 1 26 ASP H . . 5.040 3.759 3.510 3.949 . 0 0 "[ . 1 . 2]" 1
488 1 24 GLY HA2 1 31 LEU QD . . 3.900 2.089 1.879 2.633 . 0 0 "[ . 1 . 2]" 1
489 1 24 GLY HA2 1 31 LEU HG . . 3.920 2.584 2.060 3.384 . 0 0 "[ . 1 . 2]" 1
490 1 24 GLY HA2 1 66 HIS H . . 4.930 3.405 2.570 3.782 . 0 0 "[ . 1 . 2]" 1
491 1 24 GLY HA3 1 25 ILE H . . 3.310 3.069 2.891 3.290 . 0 0 "[ . 1 . 2]" 1
492 1 24 GLY HA3 1 25 ILE HA . . 4.890 4.832 4.740 4.919 0.029 20 0 "[ . 1 . 2]" 1
493 1 24 GLY HA3 1 26 ASP H . . 5.040 3.130 2.924 3.398 . 0 0 "[ . 1 . 2]" 1
494 1 24 GLY HA3 1 27 PHE H . . 4.490 3.196 3.058 3.302 . 0 0 "[ . 1 . 2]" 1
495 1 24 GLY HA3 1 27 PHE HB2 . . 5.120 3.633 3.390 3.800 . 0 0 "[ . 1 . 2]" 1
496 1 24 GLY HA3 1 27 PHE HB3 . . 5.500 5.349 5.082 5.508 0.008 10 0 "[ . 1 . 2]" 1
497 1 24 GLY HA3 1 27 PHE QD . . 4.960 2.590 2.163 2.996 . 0 0 "[ . 1 . 2]" 1
498 1 24 GLY HA3 1 28 ASN H . . 5.500 5.357 5.241 5.508 0.008 15 0 "[ . 1 . 2]" 1
499 1 24 GLY HA3 1 66 HIS H . . 3.740 2.725 2.377 2.990 . 0 0 "[ . 1 . 2]" 1
500 1 24 GLY HA3 1 66 HIS HA . . 4.230 3.741 3.300 4.125 . 0 0 "[ . 1 . 2]" 1
501 1 24 GLY HA3 1 66 HIS QB . . 4.810 2.384 2.018 2.704 . 0 0 "[ . 1 . 2]" 1
502 1 25 ILE H 1 25 ILE HB . . 3.660 3.615 3.608 3.622 . 0 0 "[ . 1 . 2]" 1
503 1 25 ILE H 1 25 ILE MD . . 4.230 3.852 3.686 3.964 . 0 0 "[ . 1 . 2]" 1
504 1 25 ILE H 1 25 ILE HG12 . . 3.790 2.323 2.082 2.499 . 0 0 "[ . 1 . 2]" 1
505 1 25 ILE H 1 25 ILE QG . . 3.180 2.243 2.033 2.436 . 0 0 "[ . 1 . 2]" 1
506 1 25 ILE H 1 25 ILE HG13 . . 3.790 3.008 2.720 3.374 . 0 0 "[ . 1 . 2]" 1
507 1 25 ILE H 1 25 ILE MG . . 2.950 2.303 2.091 2.501 . 0 0 "[ . 1 . 2]" 1
508 1 25 ILE H 1 26 ASP H . . 3.600 2.754 2.629 2.895 . 0 0 "[ . 1 . 2]" 1
509 1 25 ILE H 1 27 PHE H . . 4.590 4.303 4.161 4.464 . 0 0 "[ . 1 . 2]" 1
510 1 25 ILE H 1 28 ASN H . . 5.500 5.350 5.275 5.423 . 0 0 "[ . 1 . 2]" 1
511 1 25 ILE H 1 31 LEU QD . . 4.890 3.260 2.937 3.566 . 0 0 "[ . 1 . 2]" 1
512 1 25 ILE H 1 31 LEU HG . . 4.000 3.552 3.020 3.978 . 0 0 "[ . 1 . 2]" 1
513 1 25 ILE H 1 64 MET H . . 5.500 5.444 4.982 5.537 0.037 10 0 "[ . 1 . 2]" 1
514 1 25 ILE H 1 65 THR HA . . 3.260 2.956 2.753 3.171 . 0 0 "[ . 1 . 2]" 1
515 1 25 ILE H 1 65 THR HB . . 5.060 4.861 4.491 5.072 0.012 20 0 "[ . 1 . 2]" 1
516 1 25 ILE H 1 65 THR MG . . 4.600 4.333 3.968 4.589 . 0 0 "[ . 1 . 2]" 1
517 1 25 ILE H 1 66 HIS H . . 4.400 3.745 3.311 4.029 . 0 0 "[ . 1 . 2]" 1
518 1 25 ILE HA 1 25 ILE MD . . 4.510 4.134 4.087 4.180 . 0 0 "[ . 1 . 2]" 1
519 1 25 ILE HA 1 25 ILE QG . . 3.530 3.305 3.286 3.310 . 0 0 "[ . 1 . 2]" 1
520 1 25 ILE HA 1 25 ILE MG . . 3.140 2.248 2.131 2.342 . 0 0 "[ . 1 . 2]" 1
521 1 25 ILE HA 1 28 ASN H . . 3.840 3.768 3.636 3.838 . 0 0 "[ . 1 . 2]" 1
522 1 25 ILE HA 1 29 GLN H . . 3.890 3.484 3.288 3.645 . 0 0 "[ . 1 . 2]" 1
523 1 25 ILE HB 1 25 ILE MD . . 3.310 2.261 2.135 2.450 . 0 0 "[ . 1 . 2]" 1
524 1 25 ILE HB 1 26 ASP H . . 5.040 4.000 3.640 4.229 . 0 0 "[ . 1 . 2]" 1
525 1 25 ILE HB 1 65 THR MG . . 4.610 4.244 3.921 4.532 . 0 0 "[ . 1 . 2]" 1
526 1 25 ILE MD 1 26 ASP H . . 4.770 4.008 3.753 4.275 . 0 0 "[ . 1 . 2]" 1
527 1 25 ILE MD 1 26 ASP HA . . 4.610 4.339 4.100 4.571 . 0 0 "[ . 1 . 2]" 1
528 1 25 ILE MD 1 63 SER H . . 4.400 3.800 3.473 4.395 . 0 0 "[ . 1 . 2]" 1
529 1 25 ILE MD 1 63 SER QB . . 4.230 3.690 2.919 4.084 . 0 0 "[ . 1 . 2]" 1
530 1 25 ILE MD 1 64 MET H . . 4.440 2.540 2.186 3.448 . 0 0 "[ . 1 . 2]" 1
531 1 25 ILE MD 1 65 THR H . . 4.090 3.007 2.524 3.598 . 0 0 "[ . 1 . 2]" 1
532 1 25 ILE MD 1 65 THR MG . . 3.210 2.038 1.830 2.300 . 0 0 "[ . 1 . 2]" 1
533 1 25 ILE MD 1 66 HIS H . . 5.500 5.033 4.745 5.333 . 0 0 "[ . 1 . 2]" 1
534 1 25 ILE QG 1 25 ILE MG . . 3.030 2.074 2.003 2.203 . 0 0 "[ . 1 . 2]" 1
535 1 25 ILE QG 1 26 ASP H . . 3.910 2.305 2.014 2.604 . 0 0 "[ . 1 . 2]" 1
536 1 25 ILE QG 1 26 ASP HA . . 4.350 3.407 3.112 3.663 . 0 0 "[ . 1 . 2]" 1
537 1 25 ILE QG 1 65 THR H . . 4.740 3.494 3.292 3.787 . 0 0 "[ . 1 . 2]" 1
538 1 25 ILE QG 1 65 THR HA . . 3.840 1.906 1.786 2.035 . 0 0 "[ . 1 . 2]" 1
539 1 25 ILE QG 1 66 HIS H . . 5.150 3.726 3.441 4.009 . 0 0 "[ . 1 . 2]" 1
540 1 25 ILE HG12 1 25 ILE MG . . 3.710 2.104 2.027 2.246 . 0 0 "[ . 1 . 2]" 1
541 1 25 ILE HG12 1 26 ASP H . . 4.610 3.284 2.770 3.615 . 0 0 "[ . 1 . 2]" 1
542 1 25 ILE HG12 1 65 THR HA . . 4.390 2.003 1.988 2.062 . 0 0 "[ . 1 . 2]" 1
543 1 25 ILE HG13 1 25 ILE MG . . 3.710 3.149 3.123 3.189 . 0 0 "[ . 1 . 2]" 1
544 1 25 ILE HG13 1 26 ASP H . . 4.610 2.361 2.035 2.670 . 0 0 "[ . 1 . 2]" 1
545 1 25 ILE HG13 1 65 THR HA . . 4.390 2.514 2.013 3.199 . 0 0 "[ . 1 . 2]" 1
546 1 25 ILE MG 1 26 ASP H . . 4.250 4.054 3.894 4.139 . 0 0 "[ . 1 . 2]" 1
547 1 25 ILE MG 1 27 PHE H . . 5.500 5.423 5.303 5.506 0.006 15 0 "[ . 1 . 2]" 1
548 1 25 ILE MG 1 28 ASN H . . 5.500 5.464 5.381 5.508 0.008 7 0 "[ . 1 . 2]" 1
549 1 25 ILE MG 1 29 GLN H . . 5.040 4.936 4.812 5.061 0.021 15 0 "[ . 1 . 2]" 1
550 1 25 ILE MG 1 63 SER QB . . 5.490 5.168 4.192 5.490 . 1 0 "[ . 1 . 2]" 1
551 1 25 ILE MG 1 64 MET H . . 4.230 3.119 2.625 3.302 . 0 0 "[ . 1 . 2]" 1
552 1 25 ILE MG 1 64 MET HB3 . . 5.240 4.330 3.879 5.090 . 0 0 "[ . 1 . 2]" 1
553 1 25 ILE MG 1 64 MET QG . . 4.930 4.302 3.708 4.676 . 0 0 "[ . 1 . 2]" 1
554 1 25 ILE MG 1 65 THR H . . 5.500 4.926 4.228 5.134 . 0 0 "[ . 1 . 2]" 1
555 1 25 ILE MG 1 65 THR HA . . 3.940 3.688 3.393 3.921 . 0 0 "[ . 1 . 2]" 1
556 1 25 ILE MG 1 65 THR MG . . 4.360 4.201 3.683 4.349 . 0 0 "[ . 1 . 2]" 1
557 1 25 ILE MG 1 66 HIS H . . 5.500 5.155 4.879 5.505 0.005 15 0 "[ . 1 . 2]" 1
558 1 26 ASP H 1 27 PHE H . . 3.690 2.393 2.213 2.589 . 0 0 "[ . 1 . 2]" 1
559 1 26 ASP H 1 65 THR HA . . 3.920 3.083 2.845 3.408 . 0 0 "[ . 1 . 2]" 1
560 1 26 ASP H 1 65 THR HB . . 4.860 3.521 3.146 4.062 . 0 0 "[ . 1 . 2]" 1
561 1 26 ASP H 1 65 THR MG . . 4.590 3.303 2.715 3.674 . 0 0 "[ . 1 . 2]" 1
562 1 26 ASP H 1 66 HIS H . . 4.090 3.375 2.984 3.819 . 0 0 "[ . 1 . 2]" 1
563 1 26 ASP HA 1 28 ASN H . . 4.320 3.600 3.530 3.708 . 0 0 "[ . 1 . 2]" 1
564 1 26 ASP HA 1 65 THR MG . . 4.610 3.613 3.145 4.316 . 0 0 "[ . 1 . 2]" 1
565 1 26 ASP QB 1 27 PHE QD . . 4.810 3.250 2.508 4.610 . 0 0 "[ . 1 . 2]" 1
566 1 26 ASP QB 1 65 THR HA . . 4.810 3.489 3.183 3.945 . 0 0 "[ . 1 . 2]" 1
567 1 26 ASP QB 1 65 THR MG . . 3.520 2.153 1.845 2.641 . 0 0 "[ . 1 . 2]" 1
568 1 26 ASP QB 1 66 HIS H . . 5.150 3.373 2.858 4.066 . 0 0 "[ . 1 . 2]" 1
569 1 26 ASP HB2 1 65 THR MG . . 4.390 2.289 1.860 3.273 . 0 0 "[ . 1 . 2]" 1
570 1 26 ASP HB3 1 65 THR MG . . 4.390 3.309 2.015 3.899 . 0 0 "[ . 1 . 2]" 1
571 1 27 PHE H 1 27 PHE HB2 . . 3.180 2.435 2.371 2.503 . 0 0 "[ . 1 . 2]" 1
572 1 27 PHE H 1 27 PHE HB3 . . 3.810 3.632 3.606 3.673 . 0 0 "[ . 1 . 2]" 1
573 1 27 PHE H 1 27 PHE QD . . 3.710 2.515 2.210 2.909 . 0 0 "[ . 1 . 2]" 1
574 1 27 PHE H 1 27 PHE QE . . 4.610 4.516 4.344 4.617 0.007 15 0 "[ . 1 . 2]" 1
575 1 27 PHE H 1 29 GLN H . . 4.000 3.564 3.322 3.756 . 0 0 "[ . 1 . 2]" 1
576 1 27 PHE H 1 29 GLN QB . . 5.150 4.544 4.410 4.690 . 0 0 "[ . 1 . 2]" 1
577 1 27 PHE H 1 66 HIS H . . 5.010 4.609 4.359 4.986 . 0 0 "[ . 1 . 2]" 1
578 1 27 PHE HA 1 27 PHE QD . . 4.230 2.859 2.480 3.116 . 0 0 "[ . 1 . 2]" 1
579 1 27 PHE HA 1 27 PHE QE . . 4.890 4.599 4.480 4.706 . 0 0 "[ . 1 . 2]" 1
580 1 27 PHE HB2 1 28 ASN H . . 4.140 3.840 3.745 3.962 . 0 0 "[ . 1 . 2]" 1
581 1 27 PHE HB2 1 29 GLN H . . 4.530 3.529 3.294 3.675 . 0 0 "[ . 1 . 2]" 1
582 1 27 PHE HB2 1 29 GLN QB . . 4.300 2.964 2.843 3.071 . 0 0 "[ . 1 . 2]" 1
583 1 27 PHE HB3 1 28 ASN H . . 4.590 4.374 4.315 4.438 . 0 0 "[ . 1 . 2]" 1
584 1 27 PHE HB3 1 29 GLN H . . 4.660 4.471 4.033 4.655 . 0 0 "[ . 1 . 2]" 1
585 1 27 PHE HB3 1 29 GLN QB . . 4.300 3.507 3.219 3.745 . 0 0 "[ . 1 . 2]" 1
586 1 27 PHE HB3 1 29 GLN QG . . 4.790 3.994 3.476 4.801 0.011 15 0 "[ . 1 . 2]" 1
587 1 27 PHE QD 1 28 ASN H . . 5.040 4.728 4.535 4.856 . 0 0 "[ . 1 . 2]" 1
588 1 27 PHE QD 1 66 HIS H . . 4.330 3.858 3.533 4.197 . 0 0 "[ . 1 . 2]" 1
589 1 27 PHE QD 1 66 HIS QB . . 3.930 2.789 2.443 3.235 . 0 0 "[ . 1 . 2]" 1
590 1 27 PHE QE 1 66 HIS H . . 4.930 4.064 3.324 4.744 . 0 0 "[ . 1 . 2]" 1
591 1 27 PHE QE 1 66 HIS HB2 . . 4.000 2.813 2.117 3.826 . 0 0 "[ . 1 . 2]" 1
592 1 27 PHE QE 1 66 HIS HB3 . . 4.000 2.728 2.012 3.655 . 0 0 "[ . 1 . 2]" 1
593 1 28 ASN H 1 28 ASN HA . . 2.720 2.277 2.274 2.287 . 0 0 "[ . 1 . 2]" 1
594 1 28 ASN H 1 28 ASN QB . . 3.520 3.270 2.877 3.408 . 0 0 "[ . 1 . 2]" 1
595 1 28 ASN H 1 28 ASN HD21 . . 5.290 4.317 2.988 5.073 . 0 0 "[ . 1 . 2]" 1
596 1 28 ASN H 1 28 ASN QD . . 4.590 3.943 2.891 4.558 . 0 0 "[ . 1 . 2]" 1
597 1 28 ASN H 1 28 ASN HD22 . . 5.290 4.636 3.849 5.290 0.000 7 0 "[ . 1 . 2]" 1
598 1 28 ASN H 1 29 GLN H . . 3.260 2.763 2.641 2.906 . 0 0 "[ . 1 . 2]" 1
599 1 28 ASN H 1 29 GLN HA . . 5.500 5.362 5.279 5.454 . 0 0 "[ . 1 . 2]" 1
600 1 28 ASN HA 1 29 GLN H . . 3.140 2.808 2.721 2.945 . 0 0 "[ . 1 . 2]" 1
601 1 28 ASN QB 1 29 GLN H . . 4.160 3.866 3.772 4.045 . 0 0 "[ . 1 . 2]" 1
602 1 28 ASN HB2 1 29 GLN H . . 4.770 4.252 4.075 4.570 . 0 0 "[ . 1 . 2]" 1
603 1 28 ASN HB3 1 29 GLN H . . 4.770 4.453 4.232 4.638 . 0 0 "[ . 1 . 2]" 1
604 1 29 GLN H 1 29 GLN HB2 . . 3.820 2.751 2.671 3.337 . 0 0 "[ . 1 . 2]" 1
605 1 29 GLN H 1 29 GLN QB . . 3.190 2.653 2.506 2.703 . 0 0 "[ . 1 . 2]" 1
606 1 29 GLN H 1 29 GLN HB3 . . 3.820 3.705 2.590 3.810 . 0 0 "[ . 1 . 2]" 1
607 1 29 GLN H 1 29 GLN QG . . 3.790 3.537 3.350 3.933 0.143 15 0 "[ . 1 . 2]" 1
608 1 29 GLN H 1 30 PRO HD2 . . 5.500 4.807 4.791 4.817 . 0 0 "[ . 1 . 2]" 1
609 1 29 GLN H 1 30 PRO HD3 . . 5.290 4.792 4.669 4.924 . 0 0 "[ . 1 . 2]" 1
610 1 29 GLN HA 1 29 GLN QE . . 5.340 3.868 3.225 4.406 . 0 0 "[ . 1 . 2]" 1
611 1 29 GLN HA 1 29 GLN QG . . 3.490 2.417 2.147 2.869 . 0 0 "[ . 1 . 2]" 1
612 1 29 GLN HA 1 30 PRO HD2 . . 3.120 2.300 2.162 2.468 . 0 0 "[ . 1 . 2]" 1
613 1 29 GLN HA 1 30 PRO HD3 . . 3.120 2.273 2.252 2.327 . 0 0 "[ . 1 . 2]" 1
614 1 29 GLN HA 1 30 PRO HG2 . . 4.610 4.431 4.321 4.569 . 0 0 "[ . 1 . 2]" 1
615 1 29 GLN HA 1 30 PRO HG3 . . 4.610 4.418 4.352 4.514 . 0 0 "[ . 1 . 2]" 1
616 1 29 GLN QB 1 30 PRO HD2 . . 3.380 2.419 2.085 3.260 . 0 0 "[ . 1 . 2]" 1
617 1 29 GLN QB 1 30 PRO HD3 . . 5.000 3.676 3.434 4.123 . 0 0 "[ . 1 . 2]" 1
618 1 29 GLN QB 1 30 PRO QG . . 5.180 3.817 3.536 4.714 . 0 0 "[ . 1 . 2]" 1
619 1 29 GLN QE 1 32 VAL QG . . 4.850 4.335 3.783 4.834 . 0 0 "[ . 1 . 2]" 1
620 1 29 GLN QG 1 30 PRO HD2 . . 3.910 3.047 2.342 3.731 . 0 0 "[ . 1 . 2]" 1
621 1 29 GLN QG 1 30 PRO HD3 . . 4.610 3.926 3.447 4.590 . 0 0 "[ . 1 . 2]" 1
622 1 30 PRO HA 1 31 LEU H . . 2.780 2.200 2.182 2.253 . 0 0 "[ . 1 . 2]" 1
623 1 30 PRO HA 1 31 LEU HB2 . . 4.930 4.534 4.365 4.751 . 0 0 "[ . 1 . 2]" 1
624 1 30 PRO HA 1 52 VAL MG1 . . 4.390 3.992 3.772 4.353 . 0 0 "[ . 1 . 2]" 1
625 1 30 PRO HB2 1 31 LEU H . . 3.910 3.242 3.036 3.328 . 0 0 "[ . 1 . 2]" 1
626 1 30 PRO HB2 1 32 VAL QG . . 3.820 2.714 2.559 3.025 . 0 0 "[ . 1 . 2]" 1
627 1 30 PRO HB2 1 52 VAL MG1 . . 3.490 2.456 1.976 2.945 . 0 0 "[ . 1 . 2]" 1
628 1 30 PRO HB2 1 52 VAL MG2 . . 3.710 2.996 2.687 3.422 . 0 0 "[ . 1 . 2]" 1
629 1 30 PRO HB3 1 31 LEU H . . 3.840 3.812 3.687 3.867 0.027 15 0 "[ . 1 . 2]" 1
630 1 30 PRO HB3 1 32 VAL QG . . 4.970 4.073 3.906 4.287 . 0 0 "[ . 1 . 2]" 1
631 1 30 PRO HB3 1 52 VAL MG1 . . 3.560 3.105 2.761 3.567 0.007 20 0 "[ . 1 . 2]" 1
632 1 30 PRO HB3 1 52 VAL MG2 . . 4.100 3.835 3.430 4.099 . 0 0 "[ . 1 . 2]" 1
633 1 30 PRO HD2 1 32 VAL QG . . 5.080 4.159 3.936 4.379 . 0 0 "[ . 1 . 2]" 1
634 1 30 PRO QG 1 31 LEU H . . 4.600 4.534 4.427 4.575 . 0 0 "[ . 1 . 2]" 1
635 1 30 PRO QG 1 32 VAL QG . . 3.750 2.604 2.418 2.789 . 0 0 "[ . 1 . 2]" 1
636 1 30 PRO QG 1 52 VAL MG1 . . 4.230 3.797 3.349 4.240 0.010 9 0 "[ . 1 . 2]" 1
637 1 30 PRO QG 1 52 VAL MG2 . . 4.510 3.462 3.008 3.913 . 0 0 "[ . 1 . 2]" 1
638 1 30 PRO HG2 1 52 VAL MG1 . . 4.930 4.312 3.857 4.736 . 0 0 "[ . 1 . 2]" 1
639 1 30 PRO HG3 1 52 VAL MG1 . . 4.930 4.221 3.676 4.787 . 0 0 "[ . 1 . 2]" 1
640 1 31 LEU H 1 31 LEU HB2 . . 2.990 2.359 2.194 2.566 . 0 0 "[ . 1 . 2]" 1
641 1 31 LEU H 1 31 LEU HB3 . . 3.700 3.564 3.500 3.604 . 0 0 "[ . 1 . 2]" 1
642 1 31 LEU H 1 31 LEU MD1 . . 4.060 3.520 3.146 3.847 . 0 0 "[ . 1 . 2]" 1
643 1 31 LEU H 1 31 LEU QD . . 3.450 3.230 2.961 3.436 . 0 0 "[ . 1 . 2]" 1
644 1 31 LEU H 1 31 LEU MD2 . . 4.060 3.779 3.576 4.041 . 0 0 "[ . 1 . 2]" 1
645 1 31 LEU H 1 31 LEU HG . . 3.450 2.598 2.157 2.962 . 0 0 "[ . 1 . 2]" 1
646 1 31 LEU H 1 52 VAL MG1 . . 4.230 3.605 3.197 4.231 0.001 15 0 "[ . 1 . 2]" 1
647 1 31 LEU HA 1 31 LEU MD1 . . 4.710 3.883 3.810 3.961 . 0 0 "[ . 1 . 2]" 1
648 1 31 LEU HA 1 31 LEU QD . . 3.270 2.270 1.970 2.568 . 0 0 "[ . 1 . 2]" 1
649 1 31 LEU HA 1 31 LEU MD2 . . 4.710 2.287 1.976 2.602 . 0 0 "[ . 1 . 2]" 1
650 1 31 LEU HA 1 32 VAL H . . 2.500 2.184 2.143 2.213 . 0 0 "[ . 1 . 2]" 1
651 1 31 LEU HB2 1 31 LEU MD1 . . 3.560 2.196 2.050 2.313 . 0 0 "[ . 1 . 2]" 1
652 1 31 LEU HB2 1 31 LEU QD . . 3.090 2.157 2.025 2.260 . 0 0 "[ . 1 . 2]" 1
653 1 31 LEU HB2 1 31 LEU MD2 . . 3.560 3.163 3.118 3.193 . 0 0 "[ . 1 . 2]" 1
654 1 31 LEU HB3 1 32 VAL H . . 3.970 3.813 3.580 3.922 . 0 0 "[ . 1 . 2]" 1
655 1 31 LEU QD 1 32 VAL H . . 4.200 3.760 3.392 4.060 . 0 0 "[ . 1 . 2]" 1
656 1 31 LEU QD 1 61 THR H . . 5.440 4.760 4.474 5.091 . 0 0 "[ . 1 . 2]" 1
657 1 31 LEU QD 1 61 THR HB . . 3.470 2.091 1.889 2.492 . 0 0 "[ . 1 . 2]" 1
658 1 31 LEU QD 1 64 MET QG . . 3.770 2.643 1.934 3.006 . 0 0 "[ . 1 . 2]" 1
659 1 31 LEU QD 1 66 HIS H . . 5.240 3.598 3.266 3.869 . 0 0 "[ . 1 . 2]" 1
660 1 31 LEU QD 1 66 HIS HA . . 3.610 2.366 2.009 2.766 . 0 0 "[ . 1 . 2]" 1
661 1 31 LEU QD 1 69 ALA MB . . 2.730 2.357 1.947 2.690 . 0 0 "[ . 1 . 2]" 1
662 1 31 LEU MD1 1 61 THR HB . . 4.760 2.095 1.891 2.500 . 0 0 "[ . 1 . 2]" 1
663 1 31 LEU MD1 1 64 MET QG . . 4.610 2.682 1.945 3.069 . 0 0 "[ . 1 . 2]" 1
664 1 31 LEU MD1 1 66 HIS HA . . 4.390 3.724 3.328 4.031 . 0 0 "[ . 1 . 2]" 1
665 1 31 LEU MD1 1 69 ALA H . . 4.720 4.383 3.868 4.732 0.012 10 0 "[ . 1 . 2]" 1
666 1 31 LEU MD1 1 69 ALA MB . . 3.310 2.550 2.016 3.072 . 0 0 "[ . 1 . 2]" 1
667 1 31 LEU MD2 1 61 THR HB . . 4.760 4.597 4.348 4.791 0.031 9 0 "[ . 1 . 2]" 1
668 1 31 LEU MD2 1 64 MET QG . . 4.610 4.038 3.416 4.300 . 0 0 "[ . 1 . 2]" 1
669 1 31 LEU MD2 1 66 HIS HA . . 4.390 2.396 2.025 2.821 . 0 0 "[ . 1 . 2]" 1
670 1 31 LEU MD2 1 69 ALA H . . 4.720 4.518 4.189 4.737 0.017 14 0 "[ . 1 . 2]" 1
671 1 31 LEU MD2 1 69 ALA MB . . 3.310 2.807 2.457 3.023 . 0 0 "[ . 1 . 2]" 1
672 1 32 VAL H 1 32 VAL HB . . 3.710 3.669 2.762 3.841 0.131 12 0 "[ . 1 . 2]" 1
673 1 32 VAL H 1 32 VAL QG . . 3.550 1.963 1.843 2.680 . 0 0 "[ . 1 . 2]" 1
674 1 32 VAL H 1 34 THR MG . . 5.350 5.127 4.927 5.420 0.070 12 0 "[ . 1 . 2]" 1
675 1 32 VAL H 1 52 VAL MG2 . . 5.500 5.410 5.271 5.521 0.021 7 0 "[ . 1 . 2]" 1
676 1 32 VAL HA 1 33 ILE HG13 . . 4.000 3.733 3.632 3.900 . 0 0 "[ . 1 . 2]" 1
677 1 32 VAL HA 1 52 VAL H . . 5.300 4.953 4.752 5.078 . 0 0 "[ . 1 . 2]" 1
678 1 32 VAL HA 1 52 VAL HA . . 3.910 2.800 2.524 3.053 . 0 0 "[ . 1 . 2]" 1
679 1 32 VAL HA 1 52 VAL MG1 . . 4.890 4.383 4.058 4.813 . 0 0 "[ . 1 . 2]" 1
680 1 32 VAL HA 1 52 VAL MG2 . . 4.360 4.199 4.043 4.349 . 0 0 "[ . 1 . 2]" 1
681 1 32 VAL HA 1 53 ILE H . . 3.640 3.113 2.659 3.498 . 0 0 "[ . 1 . 2]" 1
682 1 32 VAL HA 1 53 ILE MD . . 4.610 4.224 3.872 4.577 . 0 0 "[ . 1 . 2]" 1
683 1 32 VAL HA 1 53 ILE QG . . 4.810 2.895 2.471 3.216 . 0 0 "[ . 1 . 2]" 1
684 1 32 VAL HB 1 33 ILE H . . 3.450 2.635 2.050 3.474 0.024 4 0 "[ . 1 . 2]" 1
685 1 32 VAL HB 1 50 GLY H . . 5.050 3.644 3.261 5.019 . 0 0 "[ . 1 . 2]" 1
686 1 32 VAL QG 1 33 ILE H . . 3.560 3.082 1.808 3.473 . 0 0 "[ . 1 . 2]" 1
687 1 32 VAL QG 1 49 PRO HA . . 5.440 4.919 3.737 5.305 . 0 0 "[ . 1 . 2]" 1
688 1 32 VAL QG 1 50 GLY H . . 3.980 3.834 2.445 4.017 0.037 10 0 "[ . 1 . 2]" 1
689 1 32 VAL QG 1 50 GLY QA . . 3.340 2.970 1.840 3.270 . 0 0 "[ . 1 . 2]" 1
690 1 32 VAL QG 1 51 ASP H . . 4.300 4.078 2.892 4.311 0.011 12 0 "[ . 1 . 2]" 1
691 1 32 VAL QG 1 52 VAL HA . . 3.750 1.987 1.781 2.437 . 0 0 "[ . 1 . 2]" 1
692 1 32 VAL QG 1 52 VAL MG2 . . 3.060 2.002 1.788 2.296 . 0 0 "[ . 1 . 2]" 1
693 1 32 VAL QG 1 53 ILE H . . 3.440 3.229 2.854 3.461 0.021 9 0 "[ . 1 . 2]" 1
694 1 32 VAL QG 1 90 ARG QG . . 5.280 4.580 3.737 5.274 . 0 0 "[ . 1 . 2]" 1
695 1 33 ILE H 1 33 ILE HB . . 3.110 2.503 2.392 2.678 . 0 0 "[ . 1 . 2]" 1
696 1 33 ILE H 1 33 ILE MD . . 4.090 3.434 3.149 3.730 . 0 0 "[ . 1 . 2]" 1
697 1 33 ILE H 1 33 ILE HG12 . . 4.230 3.624 3.315 3.949 . 0 0 "[ . 1 . 2]" 1
698 1 33 ILE H 1 33 ILE HG13 . . 3.230 2.253 1.890 2.566 . 0 0 "[ . 1 . 2]" 1
699 1 33 ILE H 1 33 ILE MG . . 4.390 3.761 3.737 3.776 . 0 0 "[ . 1 . 2]" 1
700 1 33 ILE H 1 34 THR H . . 4.710 4.587 4.549 4.624 . 0 0 "[ . 1 . 2]" 1
701 1 33 ILE H 1 34 THR MG . . 5.500 5.230 4.985 5.538 0.038 3 0 "[ . 1 . 2]" 1
702 1 33 ILE H 1 49 PRO HA . . 4.860 4.007 3.719 4.422 . 0 0 "[ . 1 . 2]" 1
703 1 33 ILE H 1 50 GLY H . . 4.400 2.943 2.660 3.457 . 0 0 "[ . 1 . 2]" 1
704 1 33 ILE H 1 51 ASP H . . 4.330 3.593 3.301 3.884 . 0 0 "[ . 1 . 2]" 1
705 1 33 ILE H 1 51 ASP HB2 . . 5.040 4.047 3.736 4.662 . 0 0 "[ . 1 . 2]" 1
706 1 33 ILE H 1 51 ASP QB . . 4.200 3.831 3.612 4.023 . 0 0 "[ . 1 . 2]" 1
707 1 33 ILE H 1 51 ASP HB3 . . 5.040 4.847 3.865 5.049 0.009 4 0 "[ . 1 . 2]" 1
708 1 33 ILE H 1 52 VAL MG2 . . 5.500 5.411 5.291 5.508 0.008 4 0 "[ . 1 . 2]" 1
709 1 33 ILE HA 1 33 ILE MD . . 4.230 3.853 3.812 3.880 . 0 0 "[ . 1 . 2]" 1
710 1 33 ILE HA 1 33 ILE HG12 . . 3.910 2.644 2.500 2.781 . 0 0 "[ . 1 . 2]" 1
711 1 33 ILE HA 1 33 ILE HG13 . . 4.100 2.821 2.612 3.025 . 0 0 "[ . 1 . 2]" 1
712 1 33 ILE HA 1 33 ILE MG . . 3.500 2.411 2.296 2.500 . 0 0 "[ . 1 . 2]" 1
713 1 33 ILE HA 1 34 THR H . . 2.790 2.196 2.170 2.231 . 0 0 "[ . 1 . 2]" 1
714 1 33 ILE HA 1 49 PRO HB3 . . 5.500 5.483 5.130 5.535 0.035 18 0 "[ . 1 . 2]" 1
715 1 33 ILE HA 1 53 ILE MD . . 4.930 4.846 4.584 4.950 0.020 4 0 "[ . 1 . 2]" 1
716 1 33 ILE HB 1 33 ILE MD . . 3.520 2.301 2.112 2.410 . 0 0 "[ . 1 . 2]" 1
717 1 33 ILE HB 1 34 THR H . . 4.710 4.051 3.947 4.123 . 0 0 "[ . 1 . 2]" 1
718 1 33 ILE HB 1 36 ILE MD . . 4.930 3.676 3.255 4.050 . 0 0 "[ . 1 . 2]" 1
719 1 33 ILE HB 1 49 PRO HA . . 4.230 1.988 1.969 1.996 . 0 0 "[ . 1 . 2]" 1
720 1 33 ILE HB 1 50 GLY H . . 3.620 2.233 1.905 2.519 . 0 0 "[ . 1 . 2]" 1
721 1 33 ILE HB 1 50 GLY QA . . 4.810 4.360 4.060 4.632 . 0 0 "[ . 1 . 2]" 1
722 1 33 ILE HB 1 51 ASP H . . 3.890 3.344 3.036 3.580 . 0 0 "[ . 1 . 2]" 1
723 1 33 ILE HB 1 51 ASP QB . . 3.990 3.853 3.601 4.012 0.022 18 0 "[ . 1 . 2]" 1
724 1 33 ILE HB 1 53 ILE MD . . 5.500 5.216 4.832 5.446 . 0 0 "[ . 1 . 2]" 1
725 1 33 ILE MD 1 33 ILE MG . . 3.030 2.224 1.930 2.458 . 0 0 "[ . 1 . 2]" 1
726 1 33 ILE MD 1 34 THR H . . 5.290 4.992 4.779 5.109 . 0 0 "[ . 1 . 2]" 1
727 1 33 ILE MD 1 36 ILE HG13 . . 4.230 3.389 2.966 3.735 . 0 0 "[ . 1 . 2]" 1
728 1 33 ILE MD 1 47 LEU HA . . 4.610 3.614 3.109 4.207 . 0 0 "[ . 1 . 2]" 1
729 1 33 ILE MD 1 47 LEU HB3 . . 3.610 2.687 2.341 3.089 . 0 0 "[ . 1 . 2]" 1
730 1 33 ILE MD 1 48 CYS H . . 4.140 2.700 2.190 3.223 . 0 0 "[ . 1 . 2]" 1
731 1 33 ILE MD 1 49 PRO HA . . 4.930 3.478 3.337 3.673 . 0 0 "[ . 1 . 2]" 1
732 1 33 ILE MD 1 51 ASP H . . 4.610 3.392 3.006 3.739 . 0 0 "[ . 1 . 2]" 1
733 1 33 ILE MD 1 51 ASP HB2 . . 4.000 2.435 1.978 3.150 . 0 0 "[ . 1 . 2]" 1
734 1 33 ILE MD 1 51 ASP QB . . 3.260 2.369 1.964 2.758 . 0 0 "[ . 1 . 2]" 1
735 1 33 ILE MD 1 51 ASP HB3 . . 4.000 3.493 2.740 3.889 . 0 0 "[ . 1 . 2]" 1
736 1 33 ILE HG12 1 51 ASP QB . . 5.340 4.758 4.353 5.067 . 0 0 "[ . 1 . 2]" 1
737 1 33 ILE HG13 1 33 ILE MG . . 3.520 3.171 3.140 3.200 . 0 0 "[ . 1 . 2]" 1
738 1 33 ILE HG13 1 50 GLY H . . 4.400 4.097 3.704 4.344 . 0 0 "[ . 1 . 2]" 1
739 1 33 ILE HG13 1 51 ASP H . . 4.860 4.326 3.935 4.672 . 0 0 "[ . 1 . 2]" 1
740 1 33 ILE HG13 1 51 ASP HB2 . . 4.930 3.724 3.062 4.268 . 0 0 "[ . 1 . 2]" 1
741 1 33 ILE HG13 1 51 ASP QB . . 4.230 3.530 2.984 3.964 . 0 0 "[ . 1 . 2]" 1
742 1 33 ILE HG13 1 51 ASP HB3 . . 4.930 4.551 3.237 4.934 0.004 9 0 "[ . 1 . 2]" 1
743 1 33 ILE HG13 1 53 ILE MD . . 3.420 3.008 2.633 3.210 . 0 0 "[ . 1 . 2]" 1
744 1 33 ILE MG 1 34 THR H . . 3.310 2.102 1.879 2.308 . 0 0 "[ . 1 . 2]" 1
745 1 33 ILE MG 1 35 ARG H . . 3.180 2.007 1.782 2.593 . 0 0 "[ . 1 . 2]" 1
746 1 33 ILE MG 1 36 ILE HA . . 4.610 3.657 3.507 3.810 . 0 0 "[ . 1 . 2]" 1
747 1 33 ILE MG 1 36 ILE MD . . 3.210 1.890 1.746 2.117 . 0 0 "[ . 1 . 2]" 1
748 1 33 ILE MG 1 36 ILE HG12 . . 3.660 2.165 1.924 2.394 . 0 0 "[ . 1 . 2]" 1
749 1 33 ILE MG 1 36 ILE HG13 . . 4.100 3.175 2.587 3.604 . 0 0 "[ . 1 . 2]" 1
750 1 33 ILE MG 1 49 PRO HA . . 3.390 2.126 1.914 2.486 . 0 0 "[ . 1 . 2]" 1
751 1 33 ILE MG 1 49 PRO HB2 . . 4.930 3.905 3.561 4.284 . 0 0 "[ . 1 . 2]" 1
752 1 33 ILE MG 1 50 GLY H . . 4.390 3.652 3.405 3.965 . 0 0 "[ . 1 . 2]" 1
753 1 33 ILE MG 1 51 ASP H . . 4.930 4.703 4.415 4.934 0.004 5 0 "[ . 1 . 2]" 1
754 1 34 THR H 1 34 THR MG . . 3.490 2.308 1.814 3.304 . 0 0 "[ . 1 . 2]" 1
755 1 34 THR H 1 35 ARG H . . 2.930 2.238 1.831 2.533 . 0 0 "[ . 1 . 2]" 1
756 1 34 THR HA 1 34 THR MG . . 3.240 2.539 1.961 3.190 . 0 0 "[ . 1 . 2]" 1
757 1 34 THR HB 1 35 ARG H . . 4.330 3.904 3.376 4.366 0.036 12 0 "[ . 1 . 2]" 1
758 1 34 THR MG 1 35 ARG H . . 4.260 3.548 2.752 4.296 0.036 10 0 "[ . 1 . 2]" 1
759 1 35 ARG H 1 35 ARG QB . . 3.480 2.811 2.677 2.911 . 0 0 "[ . 1 . 2]" 1
760 1 35 ARG H 1 35 ARG QD . . 5.500 4.658 4.331 5.322 . 0 0 "[ . 1 . 2]" 1
761 1 35 ARG H 1 36 ILE H . . 4.400 4.347 4.226 4.408 0.008 8 0 "[ . 1 . 2]" 1
762 1 35 ARG H 1 49 PRO HB3 . . 4.530 3.450 2.984 3.829 . 0 0 "[ . 1 . 2]" 1
763 1 35 ARG HA 1 35 ARG QD . . 3.840 2.817 1.982 3.920 0.080 5 0 "[ . 1 . 2]" 1
764 1 35 ARG HA 1 36 ILE H . . 2.700 2.349 2.219 2.443 . 0 0 "[ . 1 . 2]" 1
765 1 35 ARG HA 1 36 ILE HB . . 4.610 4.449 4.332 4.540 . 0 0 "[ . 1 . 2]" 1
766 1 35 ARG HA 1 36 ILE HG13 . . 5.500 5.277 4.996 5.512 0.012 16 0 "[ . 1 . 2]" 1
767 1 35 ARG HA 1 49 PRO HB2 . . 4.230 3.693 3.296 4.089 . 0 0 "[ . 1 . 2]" 1
768 1 35 ARG HA 1 49 PRO HG2 . . 5.020 4.533 4.266 4.919 . 0 0 "[ . 1 . 2]" 1
769 1 35 ARG HA 1 49 PRO HG3 . . 4.610 3.051 2.802 3.384 . 0 0 "[ . 1 . 2]" 1
770 1 35 ARG QB 1 35 ARG QD . . 3.060 2.264 2.019 2.622 . 0 0 "[ . 1 . 2]" 1
771 1 35 ARG QB 1 36 ILE H . . 3.420 2.914 2.365 3.432 0.012 20 0 "[ . 1 . 2]" 1
772 1 35 ARG QB 1 36 ILE HG12 . . 5.340 4.844 4.510 5.199 . 0 0 "[ . 1 . 2]" 1
773 1 35 ARG HB2 1 35 ARG QD . . 3.840 2.781 2.190 3.487 . 0 0 "[ . 1 . 2]" 1
774 1 35 ARG HB3 1 35 ARG QD . . 3.840 2.664 2.051 3.481 . 0 0 "[ . 1 . 2]" 1
775 1 35 ARG QD 1 36 ILE H . . 4.590 3.424 1.889 4.387 . 0 0 "[ . 1 . 2]" 1
776 1 36 ILE H 1 36 ILE HB . . 3.090 2.696 2.595 2.812 . 0 0 "[ . 1 . 2]" 1
777 1 36 ILE H 1 36 ILE MD . . 4.330 3.938 3.662 4.198 . 0 0 "[ . 1 . 2]" 1
778 1 36 ILE H 1 36 ILE HG12 . . 3.740 3.163 3.012 3.403 . 0 0 "[ . 1 . 2]" 1
779 1 36 ILE H 1 36 ILE HG13 . . 4.610 4.378 4.244 4.578 . 0 0 "[ . 1 . 2]" 1
780 1 36 ILE H 1 36 ILE MG . . 3.890 3.835 3.757 3.908 0.018 14 0 "[ . 1 . 2]" 1
781 1 36 ILE H 1 37 THR H . . 4.490 4.358 4.239 4.430 . 0 0 "[ . 1 . 2]" 1
782 1 36 ILE H 1 49 PRO HB2 . . 5.500 5.397 5.118 5.517 0.017 20 0 "[ . 1 . 2]" 1
783 1 36 ILE H 1 49 PRO HD3 . . 4.710 3.469 3.072 3.842 . 0 0 "[ . 1 . 2]" 1
784 1 36 ILE H 1 49 PRO HG2 . . 5.500 5.342 5.007 5.509 0.009 7 0 "[ . 1 . 2]" 1
785 1 36 ILE H 1 49 PRO HG3 . . 4.710 3.656 3.344 3.830 . 0 0 "[ . 1 . 2]" 1
786 1 36 ILE HA 1 36 ILE MD . . 3.390 2.028 1.908 2.131 . 0 0 "[ . 1 . 2]" 1
787 1 36 ILE HA 1 36 ILE MG . . 3.450 2.422 2.323 2.516 . 0 0 "[ . 1 . 2]" 1
788 1 36 ILE HB 1 37 THR H . . 4.260 4.090 3.916 4.253 . 0 0 "[ . 1 . 2]" 1
789 1 36 ILE HB 1 42 ALA MB . . 4.930 4.570 4.260 4.703 . 0 0 "[ . 1 . 2]" 1
790 1 36 ILE HB 1 43 ALA MB . . 5.130 3.850 3.329 4.014 . 0 0 "[ . 1 . 2]" 1
791 1 36 ILE HB 1 49 PRO HD3 . . 3.950 2.532 2.243 2.734 . 0 0 "[ . 1 . 2]" 1
792 1 36 ILE MD 1 36 ILE MG . . 2.760 1.989 1.916 2.079 . 0 0 "[ . 1 . 2]" 1
793 1 36 ILE MD 1 37 THR H . . 4.610 3.320 2.981 3.505 . 0 0 "[ . 1 . 2]" 1
794 1 36 ILE MD 1 42 ALA HA . . 4.890 4.124 3.752 4.511 . 0 0 "[ . 1 . 2]" 1
795 1 36 ILE MD 1 42 ALA MB . . 2.980 2.502 2.190 2.921 . 0 0 "[ . 1 . 2]" 1
796 1 36 ILE MD 1 43 ALA H . . 4.860 4.300 3.867 4.634 . 0 0 "[ . 1 . 2]" 1
797 1 36 ILE MD 1 43 ALA HA . . 4.390 4.060 3.740 4.297 . 0 0 "[ . 1 . 2]" 1
798 1 36 ILE MD 1 47 LEU H . . 4.890 4.492 4.182 4.844 . 0 0 "[ . 1 . 2]" 1
799 1 36 ILE MD 1 47 LEU HB3 . . 3.460 1.971 1.795 2.194 . 0 0 "[ . 1 . 2]" 1
800 1 36 ILE MD 1 48 CYS H . . 4.000 3.419 3.078 3.725 . 0 0 "[ . 1 . 2]" 1
801 1 36 ILE MD 1 49 PRO HA . . 4.930 4.062 3.693 4.468 . 0 0 "[ . 1 . 2]" 1
802 1 36 ILE MD 1 49 PRO HD2 . . 5.240 4.994 4.786 5.158 . 0 0 "[ . 1 . 2]" 1
803 1 36 ILE MD 1 49 PRO HD3 . . 4.230 3.854 3.644 4.024 . 0 0 "[ . 1 . 2]" 1
804 1 36 ILE HG12 1 48 CYS HA . . 4.100 3.102 2.615 3.562 . 0 0 "[ . 1 . 2]" 1
805 1 36 ILE HG12 1 49 PRO HD2 . . 4.390 3.907 3.606 4.364 . 0 0 "[ . 1 . 2]" 1
806 1 36 ILE HG12 1 49 PRO HD3 . . 4.100 2.311 2.026 2.724 . 0 0 "[ . 1 . 2]" 1
807 1 36 ILE HG12 1 49 PRO HG2 . . 5.210 4.895 4.701 5.212 0.002 12 0 "[ . 1 . 2]" 1
808 1 36 ILE HG12 1 49 PRO HG3 . . 4.930 3.998 3.726 4.228 . 0 0 "[ . 1 . 2]" 1
809 1 36 ILE HG13 1 36 ILE MG . . 3.490 2.344 2.239 2.517 . 0 0 "[ . 1 . 2]" 1
810 1 36 ILE HG13 1 48 CYS HA . . 4.000 2.030 1.989 2.240 . 0 0 "[ . 1 . 2]" 1
811 1 36 ILE HG13 1 49 PRO HD2 . . 4.390 3.777 3.484 3.993 . 0 0 "[ . 1 . 2]" 1
812 1 36 ILE HG13 1 49 PRO HD3 . . 4.100 2.661 2.251 3.017 . 0 0 "[ . 1 . 2]" 1
813 1 36 ILE MG 1 37 THR H . . 3.350 2.235 1.869 2.638 . 0 0 "[ . 1 . 2]" 1
814 1 36 ILE MG 1 37 THR HA . . 4.610 3.911 3.680 4.098 . 0 0 "[ . 1 . 2]" 1
815 1 36 ILE MG 1 37 THR HB . . 4.610 3.710 3.474 3.970 . 0 0 "[ . 1 . 2]" 1
816 1 36 ILE MG 1 38 PRO HA . . 4.930 3.880 3.679 4.402 . 0 0 "[ . 1 . 2]" 1
817 1 36 ILE MG 1 40 SER H . . 5.050 4.898 4.628 5.069 0.019 7 0 "[ . 1 . 2]" 1
818 1 36 ILE MG 1 40 SER HG . . 4.230 4.018 3.698 4.210 . 0 0 "[ . 1 . 2]" 1
819 1 36 ILE MG 1 42 ALA H . . 4.660 4.513 4.295 4.713 0.053 6 0 "[ . 1 . 2]" 1
820 1 36 ILE MG 1 42 ALA MB . . 3.080 1.962 1.781 2.147 . 0 0 "[ . 1 . 2]" 1
821 1 36 ILE MG 1 43 ALA H . . 3.620 2.563 2.352 2.789 . 0 0 "[ . 1 . 2]" 1
822 1 36 ILE MG 1 43 ALA HA . . 3.330 2.171 1.953 2.415 . 0 0 "[ . 1 . 2]" 1
823 1 36 ILE MG 1 43 ALA MB . . 3.140 1.923 1.752 2.118 . 0 0 "[ . 1 . 2]" 1
824 1 36 ILE MG 1 44 ALA H . . 4.680 4.480 4.274 4.574 . 0 0 "[ . 1 . 2]" 1
825 1 36 ILE MG 1 47 LEU HB3 . . 4.280 3.257 2.759 3.655 . 0 0 "[ . 1 . 2]" 1
826 1 36 ILE MG 1 49 PRO HD3 . . 4.930 3.893 3.615 4.098 . 0 0 "[ . 1 . 2]" 1
827 1 37 THR H 1 37 THR HB . . 3.110 2.651 2.491 2.829 . 0 0 "[ . 1 . 2]" 1
828 1 37 THR H 1 37 THR MG . . 3.920 3.768 3.716 3.787 . 0 0 "[ . 1 . 2]" 1
829 1 37 THR H 1 38 PRO QD . . 4.760 4.191 4.100 4.331 . 0 0 "[ . 1 . 2]" 1
830 1 37 THR H 1 40 SER HG . . 4.200 4.064 3.751 4.207 0.007 6 0 "[ . 1 . 2]" 1
831 1 37 THR H 1 42 ALA MB . . 4.010 2.458 2.022 2.891 . 0 0 "[ . 1 . 2]" 1
832 1 37 THR HA 1 37 THR MG . . 3.310 2.305 2.130 2.476 . 0 0 "[ . 1 . 2]" 1
833 1 37 THR HA 1 38 PRO HD2 . . 3.240 2.000 1.934 2.185 . 0 0 "[ . 1 . 2]" 1
834 1 37 THR HA 1 38 PRO QD . . 2.800 1.886 1.856 1.976 . 0 0 "[ . 1 . 2]" 1
835 1 37 THR HA 1 38 PRO HD3 . . 3.240 2.326 2.254 2.394 . 0 0 "[ . 1 . 2]" 1
836 1 37 THR HB 1 40 SER H . . 4.660 4.453 3.972 4.687 0.027 15 0 "[ . 1 . 2]" 1
837 1 37 THR HB 1 40 SER HB2 . . 4.160 3.740 3.288 4.028 . 0 0 "[ . 1 . 2]" 1
838 1 37 THR HB 1 40 SER HB3 . . 3.390 2.907 2.145 3.413 0.023 20 0 "[ . 1 . 2]" 1
839 1 37 THR HB 1 40 SER HG . . 4.100 2.124 1.999 2.311 . 0 0 "[ . 1 . 2]" 1
840 1 37 THR HB 1 42 ALA MB . . 4.620 2.517 1.968 3.431 . 0 0 "[ . 1 . 2]" 1
841 1 37 THR HB 1 44 ALA H . . 5.500 5.529 5.504 5.574 0.074 10 0 "[ . 1 . 2]" 1
842 1 37 THR MG 1 38 PRO QB . . 5.100 4.355 3.885 4.630 . 0 0 "[ . 1 . 2]" 1
843 1 37 THR MG 1 38 PRO HD2 . . 3.840 2.211 1.813 2.498 . 0 0 "[ . 1 . 2]" 1
844 1 37 THR MG 1 38 PRO QD . . 3.260 2.189 1.802 2.463 . 0 0 "[ . 1 . 2]" 1
845 1 37 THR MG 1 38 PRO HD3 . . 3.840 3.547 3.150 3.757 . 0 0 "[ . 1 . 2]" 1
846 1 37 THR MG 1 38 PRO HG3 . . 4.930 4.422 3.885 4.696 . 0 0 "[ . 1 . 2]" 1
847 1 37 THR MG 1 39 GLY QA . . 4.810 4.478 4.236 4.707 . 0 0 "[ . 1 . 2]" 1
848 1 37 THR MG 1 40 SER H . . 4.460 4.287 4.009 4.474 0.014 10 0 "[ . 1 . 2]" 1
849 1 37 THR MG 1 40 SER HB3 . . 3.770 2.104 1.904 2.405 . 0 0 "[ . 1 . 2]" 1
850 1 37 THR MG 1 40 SER HG . . 4.930 3.089 2.564 3.779 . 0 0 "[ . 1 . 2]" 1
851 1 38 PRO HA 1 39 GLY H . . 2.860 2.217 2.155 2.324 . 0 0 "[ . 1 . 2]" 1
852 1 38 PRO HA 1 39 GLY QA . . 4.510 3.905 3.898 3.923 . 0 0 "[ . 1 . 2]" 1
853 1 38 PRO HA 1 40 SER H . . 4.610 4.582 4.084 4.645 0.035 10 0 "[ . 1 . 2]" 1
854 1 38 PRO HA 1 43 ALA MB . . 3.610 2.701 1.940 3.241 . 0 0 "[ . 1 . 2]" 1
855 1 38 PRO QB 1 39 GLY H . . 3.830 3.621 3.307 3.837 0.007 18 0 "[ . 1 . 2]" 1
856 1 38 PRO QB 1 43 ALA MB . . 4.770 4.124 3.348 4.623 . 0 0 "[ . 1 . 2]" 1
857 1 38 PRO HB2 1 39 GLY H . . 4.460 3.911 3.527 4.172 . 0 0 "[ . 1 . 2]" 1
858 1 38 PRO HB3 1 39 GLY H . . 4.460 4.276 3.998 4.479 0.019 18 0 "[ . 1 . 2]" 1
859 1 39 GLY H 1 40 SER H . . 3.530 2.717 2.292 3.387 . 0 0 "[ . 1 . 2]" 1
860 1 39 GLY H 1 43 ALA MB . . 3.420 2.116 1.847 2.660 . 0 0 "[ . 1 . 2]" 1
861 1 39 GLY QA 1 40 SER H . . 3.000 2.505 2.407 2.668 . 0 0 "[ . 1 . 2]" 1
862 1 39 GLY QA 1 40 SER HA . . 4.400 3.973 3.958 3.989 . 0 0 "[ . 1 . 2]" 1
863 1 39 GLY QA 1 43 ALA MB . . 4.010 3.303 2.828 3.772 . 0 0 "[ . 1 . 2]" 1
864 1 39 GLY QA 1 44 ALA MB . . 4.710 3.744 3.355 4.613 . 0 0 "[ . 1 . 2]" 1
865 1 40 SER H 1 40 SER HB3 . . 3.700 3.133 2.994 3.231 . 0 0 "[ . 1 . 2]" 1
866 1 40 SER H 1 40 SER HG . . 3.310 2.882 2.709 2.997 . 0 0 "[ . 1 . 2]" 1
867 1 40 SER H 1 41 LYS H . . 5.040 4.357 4.352 4.365 . 0 0 "[ . 1 . 2]" 1
868 1 40 SER H 1 43 ALA HA . . 5.380 5.038 4.839 5.385 0.005 6 0 "[ . 1 . 2]" 1
869 1 40 SER H 1 43 ALA MB . . 2.980 2.458 2.263 2.875 . 0 0 "[ . 1 . 2]" 1
870 1 40 SER H 1 44 ALA H . . 5.040 2.538 2.173 3.085 . 0 0 "[ . 1 . 2]" 1
871 1 40 SER H 1 44 ALA HA . . 5.500 4.494 4.167 5.025 . 0 0 "[ . 1 . 2]" 1
872 1 40 SER HA 1 41 LYS H . . 3.280 2.629 2.473 2.651 . 0 0 "[ . 1 . 2]" 1
873 1 40 SER HA 1 43 ALA H . . 5.500 5.269 5.139 5.362 . 0 0 "[ . 1 . 2]" 1
874 1 40 SER HA 1 44 ALA MB . . 4.610 3.728 3.525 3.982 . 0 0 "[ . 1 . 2]" 1
875 1 40 SER HB2 1 41 LYS H . . 3.470 2.359 2.314 2.567 . 0 0 "[ . 1 . 2]" 1
876 1 40 SER HB2 1 42 ALA H . . 3.790 3.591 3.503 3.674 . 0 0 "[ . 1 . 2]" 1
877 1 40 SER HB2 1 42 ALA MB . . 4.930 4.418 4.100 4.579 . 0 0 "[ . 1 . 2]" 1
878 1 40 SER HB2 1 43 ALA H . . 5.500 5.153 5.016 5.254 . 0 0 "[ . 1 . 2]" 1
879 1 40 SER HB3 1 41 LYS H . . 3.920 3.717 3.691 3.906 . 0 0 "[ . 1 . 2]" 1
880 1 40 SER HB3 1 42 ALA H . . 4.040 4.027 3.946 4.058 0.018 9 0 "[ . 1 . 2]" 1
881 1 40 SER HB3 1 42 ALA MB . . 5.190 4.301 3.994 4.425 . 0 0 "[ . 1 . 2]" 1
882 1 40 SER HB3 1 43 ALA H . . 4.680 4.492 4.279 4.665 . 0 0 "[ . 1 . 2]" 1
883 1 40 SER HB3 1 43 ALA MB . . 5.500 4.404 4.021 4.830 . 0 0 "[ . 1 . 2]" 1
884 1 40 SER HG 1 41 LYS H . . 5.040 3.369 3.269 3.520 . 0 0 "[ . 1 . 2]" 1
885 1 40 SER HG 1 42 ALA H . . 5.040 2.049 1.899 2.153 . 0 0 "[ . 1 . 2]" 1
886 1 40 SER HG 1 43 ALA H . . 3.770 2.382 2.223 2.521 . 0 0 "[ . 1 . 2]" 1
887 1 40 SER HG 1 43 ALA MB . . 4.000 3.388 3.122 3.646 . 0 0 "[ . 1 . 2]" 1
888 1 40 SER HG 1 44 ALA H . . 5.290 3.727 3.491 3.982 . 0 0 "[ . 1 . 2]" 1
889 1 41 LYS H 1 41 LYS HB2 . . 3.380 2.617 2.513 2.679 . 0 0 "[ . 1 . 2]" 1
890 1 41 LYS H 1 41 LYS HB3 . . 3.910 3.587 3.582 3.592 . 0 0 "[ . 1 . 2]" 1
891 1 41 LYS H 1 41 LYS QD . . 4.180 3.662 3.279 4.045 . 0 0 "[ . 1 . 2]" 1
892 1 41 LYS H 1 41 LYS HG2 . . 3.790 2.743 1.894 3.589 . 0 0 "[ . 1 . 2]" 1
893 1 41 LYS H 1 41 LYS QG . . 3.130 1.971 1.880 2.148 . 0 0 "[ . 1 . 2]" 1
894 1 41 LYS H 1 41 LYS HG3 . . 3.790 2.497 1.897 3.172 . 0 0 "[ . 1 . 2]" 1
895 1 41 LYS H 1 42 ALA H . . 3.600 2.719 2.671 2.819 . 0 0 "[ . 1 . 2]" 1
896 1 41 LYS H 1 43 ALA H . . 5.160 5.092 4.934 5.151 . 0 0 "[ . 1 . 2]" 1
897 1 41 LYS HA 1 41 LYS QD . . 4.510 3.448 2.442 4.123 . 0 0 "[ . 1 . 2]" 1
898 1 41 LYS HA 1 41 LYS HE2 . . 5.500 4.831 1.999 5.475 . 0 0 "[ . 1 . 2]" 1
899 1 41 LYS HA 1 41 LYS HE3 . . 5.500 4.884 2.570 5.517 0.017 19 0 "[ . 1 . 2]" 1
900 1 41 LYS HA 1 41 LYS HG2 . . 3.910 2.747 2.466 2.920 . 0 0 "[ . 1 . 2]" 1
901 1 41 LYS HA 1 41 LYS QG . . 3.360 2.606 2.420 2.794 . 0 0 "[ . 1 . 2]" 1
902 1 41 LYS HA 1 41 LYS HG3 . . 3.910 3.359 2.806 3.857 . 0 0 "[ . 1 . 2]" 1
903 1 41 LYS HA 1 44 ALA H . . 4.500 4.217 3.781 4.426 . 0 0 "[ . 1 . 2]" 1
904 1 41 LYS HA 1 44 ALA MB . . 3.280 2.728 2.457 2.879 . 0 0 "[ . 1 . 2]" 1
905 1 41 LYS HB2 1 42 ALA H . . 3.560 2.997 2.893 3.155 . 0 0 "[ . 1 . 2]" 1
906 1 41 LYS HB3 1 42 ALA H . . 4.130 4.011 3.915 4.119 . 0 0 "[ . 1 . 2]" 1
907 1 41 LYS HB3 1 44 ALA MB . . 4.940 4.810 4.400 4.945 0.005 4 0 "[ . 1 . 2]" 1
908 1 41 LYS QE 1 41 LYS QG . . 3.080 2.183 2.073 2.500 . 0 0 "[ . 1 . 2]" 1
909 1 41 LYS HE2 1 41 LYS HG2 . . 4.030 2.812 2.238 3.597 . 0 0 "[ . 1 . 2]" 1
910 1 41 LYS HE2 1 41 LYS HG3 . . 4.030 3.180 2.399 3.875 . 0 0 "[ . 1 . 2]" 1
911 1 41 LYS HE3 1 41 LYS HG2 . . 4.030 2.970 2.210 3.680 . 0 0 "[ . 1 . 2]" 1
912 1 41 LYS HE3 1 41 LYS HG3 . . 4.030 2.978 2.216 3.946 . 0 0 "[ . 1 . 2]" 1
913 1 41 LYS QG 1 42 ALA H . . 4.310 4.077 3.956 4.226 . 0 0 "[ . 1 . 2]" 1
914 1 42 ALA H 1 42 ALA MB . . 2.910 2.136 2.044 2.263 . 0 0 "[ . 1 . 2]" 1
915 1 42 ALA H 1 43 ALA H . . 3.460 2.888 2.786 2.982 . 0 0 "[ . 1 . 2]" 1
916 1 42 ALA H 1 45 ALA MB . . 4.860 4.591 4.425 4.798 . 0 0 "[ . 1 . 2]" 1
917 1 42 ALA H 1 47 LEU MD1 . . 4.710 4.173 4.089 4.391 . 0 0 "[ . 1 . 2]" 1
918 1 42 ALA HA 1 43 ALA MB . . 5.500 5.037 5.017 5.044 . 0 0 "[ . 1 . 2]" 1
919 1 42 ALA HA 1 44 ALA H . . 4.880 4.702 4.514 4.862 . 0 0 "[ . 1 . 2]" 1
920 1 42 ALA HA 1 44 ALA MB . . 5.500 5.175 5.084 5.263 . 0 0 "[ . 1 . 2]" 1
921 1 42 ALA HA 1 45 ALA H . . 4.100 3.858 3.611 4.070 . 0 0 "[ . 1 . 2]" 1
922 1 42 ALA HA 1 45 ALA MB . . 3.520 2.991 2.755 3.252 . 0 0 "[ . 1 . 2]" 1
923 1 42 ALA HA 1 47 LEU H . . 5.160 4.991 4.685 5.173 0.013 9 0 "[ . 1 . 2]" 1
924 1 42 ALA HA 1 47 LEU MD1 . . 3.450 1.833 1.771 1.929 . 0 0 "[ . 1 . 2]" 1
925 1 42 ALA MB 1 43 ALA H . . 2.890 2.060 1.872 2.228 . 0 0 "[ . 1 . 2]" 1
926 1 42 ALA MB 1 45 ALA H . . 5.200 4.515 4.410 4.644 . 0 0 "[ . 1 . 2]" 1
927 1 42 ALA MB 1 47 LEU H . . 5.500 4.830 4.550 5.034 . 0 0 "[ . 1 . 2]" 1
928 1 42 ALA MB 1 47 LEU HB3 . . 4.500 3.895 3.467 4.260 . 0 0 "[ . 1 . 2]" 1
929 1 42 ALA MB 1 47 LEU MD1 . . 3.240 2.262 2.028 2.755 . 0 0 "[ . 1 . 2]" 1
930 1 43 ALA H 1 43 ALA MB . . 3.090 2.182 2.042 2.233 . 0 0 "[ . 1 . 2]" 1
931 1 43 ALA H 1 44 ALA H . . 3.230 2.769 2.610 2.842 . 0 0 "[ . 1 . 2]" 1
932 1 43 ALA H 1 45 ALA MB . . 4.860 4.830 4.745 4.878 0.018 9 0 "[ . 1 . 2]" 1
933 1 43 ALA HA 1 47 LEU H . . 3.960 2.684 2.349 2.939 . 0 0 "[ . 1 . 2]" 1
934 1 43 ALA MB 1 44 ALA H . . 3.240 2.551 2.450 2.736 . 0 0 "[ . 1 . 2]" 1
935 1 44 ALA H 1 44 ALA MB . . 2.680 2.200 2.024 2.235 . 0 0 "[ . 1 . 2]" 1
936 1 44 ALA H 1 45 ALA H . . 3.230 2.700 2.605 2.791 . 0 0 "[ . 1 . 2]" 1
937 1 44 ALA HA 1 45 ALA H . . 3.550 3.425 3.384 3.471 . 0 0 "[ . 1 . 2]" 1
938 1 44 ALA HA 1 46 ASN H . . 3.600 3.469 3.382 3.558 . 0 0 "[ . 1 . 2]" 1
939 1 44 ALA MB 1 45 ALA H . . 3.170 2.974 2.834 3.107 . 0 0 "[ . 1 . 2]" 1
940 1 44 ALA MB 1 45 ALA HA . . 4.570 3.967 3.902 4.022 . 0 0 "[ . 1 . 2]" 1
941 1 44 ALA MB 1 46 ASN H . . 4.490 4.284 4.197 4.377 . 0 0 "[ . 1 . 2]" 1
942 1 45 ALA H 1 45 ALA MB . . 2.840 2.173 2.137 2.225 . 0 0 "[ . 1 . 2]" 1
943 1 45 ALA H 1 46 ASN H . . 2.920 2.687 2.547 2.836 . 0 0 "[ . 1 . 2]" 1
944 1 45 ALA H 1 47 LEU MD1 . . 4.750 3.815 3.511 4.064 . 0 0 "[ . 1 . 2]" 1
945 1 45 ALA HA 1 47 LEU HG . . 4.500 4.452 4.343 4.507 0.007 15 0 "[ . 1 . 2]" 1
946 1 45 ALA MB 1 46 ASN H . . 3.690 3.548 3.480 3.622 . 0 0 "[ . 1 . 2]" 1
947 1 45 ALA MB 1 47 LEU MD1 . . 3.770 2.365 2.050 2.622 . 0 0 "[ . 1 . 2]" 1
948 1 46 ASN H 1 46 ASN HA . . 2.640 2.275 2.273 2.282 . 0 0 "[ . 1 . 2]" 1
949 1 46 ASN H 1 46 ASN HB2 . . 4.100 3.661 3.061 3.761 . 0 0 "[ . 1 . 2]" 1
950 1 46 ASN H 1 46 ASN QB . . 3.530 3.381 2.942 3.457 . 0 0 "[ . 1 . 2]" 1
951 1 46 ASN H 1 46 ASN HB3 . . 4.100 3.986 3.811 4.055 . 0 0 "[ . 1 . 2]" 1
952 1 46 ASN H 1 47 LEU H . . 3.250 2.629 2.484 2.753 . 0 0 "[ . 1 . 2]" 1
953 1 46 ASN H 1 47 LEU HG . . 4.770 4.150 3.944 4.358 . 0 0 "[ . 1 . 2]" 1
954 1 46 ASN HA 1 47 LEU H . . 3.180 2.865 2.736 2.970 . 0 0 "[ . 1 . 2]" 1
955 1 46 ASN HB2 1 47 LEU H . . 4.710 4.183 4.030 4.476 . 0 0 "[ . 1 . 2]" 1
956 1 46 ASN HB3 1 47 LEU H . . 4.710 4.486 4.063 4.548 . 0 0 "[ . 1 . 2]" 1
957 1 47 LEU H 1 47 LEU HB2 . . 2.900 2.471 2.390 2.579 . 0 0 "[ . 1 . 2]" 1
958 1 47 LEU H 1 47 LEU HB3 . . 3.790 3.642 3.607 3.715 . 0 0 "[ . 1 . 2]" 1
959 1 47 LEU H 1 47 LEU MD1 . . 4.000 3.776 3.604 4.005 0.005 18 0 "[ . 1 . 2]" 1
960 1 47 LEU H 1 47 LEU MD2 . . 3.890 3.601 3.416 3.840 . 0 0 "[ . 1 . 2]" 1
961 1 47 LEU H 1 47 LEU HG . . 3.820 2.599 2.402 2.854 . 0 0 "[ . 1 . 2]" 1
962 1 47 LEU H 1 48 CYS H . . 4.710 4.551 4.506 4.589 . 0 0 "[ . 1 . 2]" 1
963 1 47 LEU HA 1 47 LEU MD1 . . 4.230 3.880 3.829 3.923 . 0 0 "[ . 1 . 2]" 1
964 1 47 LEU HA 1 47 LEU MD2 . . 3.140 2.087 1.965 2.307 . 0 0 "[ . 1 . 2]" 1
965 1 47 LEU HA 1 47 LEU HG . . 4.230 3.113 2.921 3.265 . 0 0 "[ . 1 . 2]" 1
966 1 47 LEU HA 1 48 CYS H . . 2.840 2.219 2.183 2.321 . 0 0 "[ . 1 . 2]" 1
967 1 47 LEU HA 1 48 CYS QB . . 4.810 4.061 3.890 4.300 . 0 0 "[ . 1 . 2]" 1
968 1 47 LEU HB2 1 47 LEU MD1 . . 3.420 2.216 2.138 2.303 . 0 0 "[ . 1 . 2]" 1
969 1 47 LEU HB2 1 48 CYS H . . 4.060 3.986 3.832 4.081 0.021 10 0 "[ . 1 . 2]" 1
970 1 47 LEU HB3 1 47 LEU MD1 . . 3.420 2.427 2.352 2.491 . 0 0 "[ . 1 . 2]" 1
971 1 47 LEU HB3 1 47 LEU MD2 . . 3.630 2.316 2.192 2.373 . 0 0 "[ . 1 . 2]" 1
972 1 47 LEU HB3 1 48 CYS H . . 3.480 2.939 2.615 3.091 . 0 0 "[ . 1 . 2]" 1
973 1 47 LEU MD1 1 48 CYS H . . 4.930 4.841 4.561 4.947 0.017 5 0 "[ . 1 . 2]" 1
974 1 47 LEU MD2 1 48 CYS H . . 3.670 3.398 3.076 3.563 . 0 0 "[ . 1 . 2]" 1
975 1 47 LEU MD2 1 51 ASP HB2 . . 5.500 4.672 4.238 5.014 . 0 0 "[ . 1 . 2]" 1
976 1 47 LEU MD2 1 51 ASP QB . . 4.840 4.334 3.944 4.582 . 0 0 "[ . 1 . 2]" 1
977 1 47 LEU MD2 1 51 ASP HB3 . . 5.500 5.145 4.696 5.491 . 0 0 "[ . 1 . 2]" 1
978 1 48 CYS H 1 48 CYS HB2 . . 4.000 3.179 2.669 3.984 . 0 0 "[ . 1 . 2]" 1
979 1 48 CYS H 1 48 CYS QB . . 3.150 2.743 2.588 3.162 0.012 9 0 "[ . 1 . 2]" 1
980 1 48 CYS H 1 48 CYS HB3 . . 4.000 3.384 2.663 3.937 . 0 0 "[ . 1 . 2]" 1
981 1 48 CYS H 1 49 PRO HD2 . . 5.500 4.804 4.778 4.816 . 0 0 "[ . 1 . 2]" 1
982 1 48 CYS H 1 49 PRO HD3 . . 5.230 4.769 4.640 4.875 . 0 0 "[ . 1 . 2]" 1
983 1 48 CYS H 1 51 ASP H . . 4.710 4.420 4.225 4.714 0.004 19 0 "[ . 1 . 2]" 1
984 1 48 CYS H 1 51 ASP QB . . 5.300 3.755 3.348 4.030 . 0 0 "[ . 1 . 2]" 1
985 1 48 CYS HA 1 49 PRO HD3 . . 3.240 2.268 2.253 2.293 . 0 0 "[ . 1 . 2]" 1
986 1 48 CYS HA 1 49 PRO HG2 . . 4.930 4.430 4.363 4.502 . 0 0 "[ . 1 . 2]" 1
987 1 48 CYS HA 1 49 PRO HG3 . . 4.930 4.414 4.374 4.463 . 0 0 "[ . 1 . 2]" 1
988 1 48 CYS QB 1 49 PRO HD2 . . 3.450 2.542 1.978 3.104 . 0 0 "[ . 1 . 2]" 1
989 1 48 CYS QB 1 49 PRO HD3 . . 4.020 3.716 3.311 4.017 . 0 0 "[ . 1 . 2]" 1
990 1 48 CYS HB2 1 49 PRO HD2 . . 4.160 3.400 1.989 4.011 . 0 0 "[ . 1 . 2]" 1
991 1 48 CYS HB3 1 49 PRO HD2 . . 4.160 3.055 2.187 4.044 . 0 0 "[ . 1 . 2]" 1
992 1 49 PRO HA 1 50 GLY H . . 2.800 2.257 2.194 2.332 . 0 0 "[ . 1 . 2]" 1
993 1 49 PRO HA 1 50 GLY HA2 . . 4.610 4.323 4.310 4.343 . 0 0 "[ . 1 . 2]" 1
994 1 49 PRO HA 1 50 GLY HA3 . . 4.610 4.478 4.438 4.517 . 0 0 "[ . 1 . 2]" 1
995 1 49 PRO HA 1 51 ASP H . . 4.230 3.870 3.693 4.102 . 0 0 "[ . 1 . 2]" 1
996 1 49 PRO HB3 1 50 GLY H . . 4.600 4.394 4.284 4.486 . 0 0 "[ . 1 . 2]" 1
997 1 50 GLY H 1 51 ASP H . . 3.350 1.914 1.807 2.026 . 0 0 "[ . 1 . 2]" 1
998 1 50 GLY H 1 51 ASP HA . . 4.550 4.528 4.475 4.574 0.024 10 0 "[ . 1 . 2]" 1
999 1 50 GLY H 1 51 ASP QB . . 4.600 3.617 3.536 3.721 . 0 0 "[ . 1 . 2]" 1
1000 1 51 ASP H 1 51 ASP HB2 . . 3.920 2.223 2.177 2.374 . 0 0 "[ . 1 . 2]" 1
1001 1 51 ASP H 1 51 ASP QB . . 3.220 2.198 2.126 2.342 . 0 0 "[ . 1 . 2]" 1
1002 1 51 ASP H 1 51 ASP HB3 . . 3.920 3.487 2.962 3.575 . 0 0 "[ . 1 . 2]" 1
1003 1 51 ASP H 1 52 VAL H . . 4.860 4.624 4.580 4.646 . 0 0 "[ . 1 . 2]" 1
1004 1 51 ASP HA 1 52 VAL H . . 2.750 2.285 2.171 2.431 . 0 0 "[ . 1 . 2]" 1
1005 1 51 ASP HA 1 84 ILE MG . . 4.390 4.192 3.917 4.399 0.009 20 0 "[ . 1 . 2]" 1
1006 1 51 ASP QB 1 52 VAL H . . 3.600 2.805 2.398 3.299 . 0 0 "[ . 1 . 2]" 1
1007 1 51 ASP QB 1 53 ILE HA . . 5.100 4.846 4.461 5.134 0.034 14 0 "[ . 1 . 2]" 1
1008 1 51 ASP QB 1 53 ILE MD . . 4.690 3.823 3.471 4.057 . 0 0 "[ . 1 . 2]" 1
1009 1 51 ASP QB 1 84 ILE HB . . 4.100 3.113 2.410 3.928 . 0 0 "[ . 1 . 2]" 1
1010 1 51 ASP QB 1 84 ILE MD . . 4.850 3.552 2.234 4.295 . 0 0 "[ . 1 . 2]" 1
1011 1 51 ASP QB 1 84 ILE MG . . 3.330 2.062 1.922 2.473 . 0 0 "[ . 1 . 2]" 1
1012 1 51 ASP QB 1 85 ASP H . . 5.150 4.661 4.027 5.003 . 0 0 "[ . 1 . 2]" 1
1013 1 51 ASP HB2 1 84 ILE HB . . 4.930 4.753 4.165 4.949 0.019 18 0 "[ . 1 . 2]" 1
1014 1 51 ASP HB2 1 84 ILE MG . . 4.000 3.285 3.076 3.521 . 0 0 "[ . 1 . 2]" 1
1015 1 51 ASP HB3 1 84 ILE HB . . 4.930 3.163 2.426 4.168 . 0 0 "[ . 1 . 2]" 1
1016 1 51 ASP HB3 1 84 ILE MG . . 4.000 2.085 1.936 2.527 . 0 0 "[ . 1 . 2]" 1
1017 1 52 VAL H 1 52 VAL HB . . 3.010 2.535 2.404 2.614 . 0 0 "[ . 1 . 2]" 1
1018 1 52 VAL H 1 52 VAL MG1 . . 3.960 3.798 3.720 3.841 . 0 0 "[ . 1 . 2]" 1
1019 1 52 VAL H 1 52 VAL MG2 . . 3.260 2.579 2.122 2.883 . 0 0 "[ . 1 . 2]" 1
1020 1 52 VAL H 1 53 ILE H . . 4.710 4.413 4.152 4.579 . 0 0 "[ . 1 . 2]" 1
1021 1 52 VAL H 1 84 ILE HA . . 4.860 4.323 3.953 4.637 . 0 0 "[ . 1 . 2]" 1
1022 1 52 VAL H 1 84 ILE HB . . 4.590 3.551 3.142 3.880 . 0 0 "[ . 1 . 2]" 1
1023 1 52 VAL H 1 84 ILE MD . . 5.160 4.719 4.100 5.107 . 0 0 "[ . 1 . 2]" 1
1024 1 52 VAL H 1 84 ILE MG . . 3.850 3.506 2.826 3.858 0.008 4 0 "[ . 1 . 2]" 1
1025 1 52 VAL H 1 85 ASP H . . 3.770 3.401 2.829 3.695 . 0 0 "[ . 1 . 2]" 1
1026 1 52 VAL H 1 85 ASP HB2 . . 5.450 5.279 4.953 5.471 0.021 6 0 "[ . 1 . 2]" 1
1027 1 52 VAL H 1 85 ASP HB3 . . 5.020 4.284 3.856 4.780 . 0 0 "[ . 1 . 2]" 1
1028 1 52 VAL H 1 87 ALA H . . 4.680 4.053 3.115 4.607 . 0 0 "[ . 1 . 2]" 1
1029 1 52 VAL H 1 87 ALA MB . . 5.040 3.904 1.921 5.041 0.001 8 0 "[ . 1 . 2]" 1
1030 1 52 VAL H 1 90 ARG QG . . 5.340 4.836 3.543 5.344 0.004 20 0 "[ . 1 . 2]" 1
1031 1 52 VAL HA 1 52 VAL MG1 . . 3.420 2.384 2.272 2.509 . 0 0 "[ . 1 . 2]" 1
1032 1 52 VAL HA 1 52 VAL MG2 . . 3.240 2.333 2.155 2.511 . 0 0 "[ . 1 . 2]" 1
1033 1 52 VAL HA 1 53 ILE H . . 2.780 2.175 2.140 2.265 . 0 0 "[ . 1 . 2]" 1
1034 1 52 VAL HA 1 53 ILE HB . . 4.930 4.713 4.629 4.842 . 0 0 "[ . 1 . 2]" 1
1035 1 52 VAL HA 1 53 ILE QG . . 4.810 3.517 3.240 3.704 . 0 0 "[ . 1 . 2]" 1
1036 1 52 VAL HB 1 53 ILE H . . 4.490 4.175 3.814 4.436 . 0 0 "[ . 1 . 2]" 1
1037 1 52 VAL HB 1 54 LEU MD2 . . 4.390 4.044 3.258 4.321 . 0 0 "[ . 1 . 2]" 1
1038 1 52 VAL HB 1 85 ASP H . . 4.230 3.009 2.482 3.440 . 0 0 "[ . 1 . 2]" 1
1039 1 52 VAL HB 1 85 ASP HB2 . . 3.910 3.549 3.093 3.907 . 0 0 "[ . 1 . 2]" 1
1040 1 52 VAL HB 1 85 ASP HB3 . . 3.360 2.875 2.316 3.271 . 0 0 "[ . 1 . 2]" 1
1041 1 52 VAL HB 1 87 ALA MB . . 4.890 3.974 2.515 4.802 . 0 0 "[ . 1 . 2]" 1
1042 1 52 VAL MG1 1 53 ILE H . . 3.250 2.566 1.916 3.104 . 0 0 "[ . 1 . 2]" 1
1043 1 52 VAL MG1 1 54 LEU H . . 4.930 3.940 3.447 4.431 . 0 0 "[ . 1 . 2]" 1
1044 1 52 VAL MG1 1 54 LEU HA . . 4.900 3.618 3.242 3.912 . 0 0 "[ . 1 . 2]" 1
1045 1 52 VAL MG1 1 54 LEU HG . . 3.910 3.340 2.768 3.758 . 0 0 "[ . 1 . 2]" 1
1046 1 52 VAL MG1 1 85 ASP H . . 4.610 4.009 3.518 4.402 . 0 0 "[ . 1 . 2]" 1
1047 1 52 VAL MG1 1 85 ASP HB3 . . 4.400 3.773 2.878 4.324 . 0 0 "[ . 1 . 2]" 1
1048 1 52 VAL MG2 1 53 ILE H . . 4.170 4.030 3.910 4.192 0.022 18 0 "[ . 1 . 2]" 1
1049 1 52 VAL MG2 1 85 ASP H . . 4.930 4.349 3.854 4.651 . 0 0 "[ . 1 . 2]" 1
1050 1 52 VAL MG2 1 85 ASP HB3 . . 4.100 3.689 3.226 4.002 . 0 0 "[ . 1 . 2]" 1
1051 1 52 VAL MG2 1 90 ARG QG . . 4.510 3.151 1.952 4.516 0.006 18 0 "[ . 1 . 2]" 1
1052 1 53 ILE H 1 53 ILE HB . . 3.050 2.607 2.527 2.702 . 0 0 "[ . 1 . 2]" 1
1053 1 53 ILE H 1 53 ILE MD . . 4.090 3.663 3.373 3.968 . 0 0 "[ . 1 . 2]" 1
1054 1 53 ILE H 1 53 ILE QG . . 3.330 2.169 1.876 2.580 . 0 0 "[ . 1 . 2]" 1
1055 1 53 ILE H 1 53 ILE MG . . 4.610 3.796 3.761 3.859 . 0 0 "[ . 1 . 2]" 1
1056 1 53 ILE H 1 54 LEU H . . 4.710 4.281 4.008 4.482 . 0 0 "[ . 1 . 2]" 1
1057 1 53 ILE HA 1 53 ILE MD . . 3.710 2.365 2.085 2.476 . 0 0 "[ . 1 . 2]" 1
1058 1 53 ILE HA 1 53 ILE HG12 . . 4.100 2.853 2.748 3.003 . 0 0 "[ . 1 . 2]" 1
1059 1 53 ILE HA 1 53 ILE HG13 . . 4.100 3.810 3.762 3.867 . 0 0 "[ . 1 . 2]" 1
1060 1 53 ILE HA 1 53 ILE MG . . 3.260 2.244 2.157 2.376 . 0 0 "[ . 1 . 2]" 1
1061 1 53 ILE HA 1 54 LEU H . . 2.860 2.173 2.140 2.246 . 0 0 "[ . 1 . 2]" 1
1062 1 53 ILE HA 1 54 LEU HG . . 4.500 4.243 3.896 4.500 . 0 0 "[ . 1 . 2]" 1
1063 1 53 ILE HA 1 55 ALA H . . 4.230 3.896 3.581 4.165 . 0 0 "[ . 1 . 2]" 1
1064 1 53 ILE HA 1 61 THR MG . . 4.890 4.718 4.351 4.892 0.002 17 0 "[ . 1 . 2]" 1
1065 1 53 ILE HA 1 84 ILE HA . . 3.770 3.208 2.913 3.380 . 0 0 "[ . 1 . 2]" 1
1066 1 53 ILE HA 1 84 ILE HB . . 5.500 5.011 4.423 5.303 . 0 0 "[ . 1 . 2]" 1
1067 1 53 ILE HA 1 85 ASP H . . 4.930 4.822 4.596 4.942 0.012 15 0 "[ . 1 . 2]" 1
1068 1 53 ILE HB 1 53 ILE MD . . 3.420 3.185 3.173 3.215 . 0 0 "[ . 1 . 2]" 1
1069 1 53 ILE HB 1 56 ILE HG13 . . 4.930 4.393 3.527 4.871 . 0 0 "[ . 1 . 2]" 1
1070 1 53 ILE HB 1 61 THR MG . . 3.770 3.300 2.841 3.598 . 0 0 "[ . 1 . 2]" 1
1071 1 53 ILE MD 1 53 ILE MG . . 2.690 1.864 1.832 1.928 . 0 0 "[ . 1 . 2]" 1
1072 1 53 ILE MD 1 54 LEU H . . 4.330 4.069 3.719 4.291 . 0 0 "[ . 1 . 2]" 1
1073 1 53 ILE MD 1 55 ALA H . . 5.000 4.776 4.517 4.943 . 0 0 "[ . 1 . 2]" 1
1074 1 53 ILE MD 1 82 LEU HB2 . . 4.230 3.566 3.301 3.918 . 0 0 "[ . 1 . 2]" 1
1075 1 53 ILE MD 1 82 LEU QB . . 3.710 2.416 2.211 2.731 . 0 0 "[ . 1 . 2]" 1
1076 1 53 ILE MD 1 82 LEU HB3 . . 4.230 2.461 2.235 2.815 . 0 0 "[ . 1 . 2]" 1
1077 1 53 ILE MD 1 82 LEU MD1 . . 3.160 2.392 1.938 2.893 . 0 0 "[ . 1 . 2]" 1
1078 1 53 ILE MD 1 84 ILE HA . . 4.640 4.424 3.955 4.652 0.012 17 0 "[ . 1 . 2]" 1
1079 1 53 ILE MG 1 54 LEU H . . 3.370 3.013 2.546 3.348 . 0 0 "[ . 1 . 2]" 1
1080 1 53 ILE MG 1 55 ALA H . . 3.090 2.947 2.661 3.095 0.005 8 0 "[ . 1 . 2]" 1
1081 1 53 ILE MG 1 55 ALA HA . . 4.000 3.782 3.654 3.935 . 0 0 "[ . 1 . 2]" 1
1082 1 53 ILE MG 1 56 ILE HG12 . . 3.380 2.379 1.988 2.864 . 0 0 "[ . 1 . 2]" 1
1083 1 53 ILE MG 1 56 ILE HG13 . . 3.250 2.244 1.972 2.600 . 0 0 "[ . 1 . 2]" 1
1084 1 53 ILE MG 1 61 THR MG . . 2.930 2.328 2.119 2.709 . 0 0 "[ . 1 . 2]" 1
1085 1 53 ILE MG 1 83 LYS H . . 4.230 3.586 2.883 3.846 . 0 0 "[ . 1 . 2]" 1
1086 1 53 ILE MG 1 83 LYS QB . . 4.610 4.504 3.947 4.622 0.012 18 0 "[ . 1 . 2]" 1
1087 1 53 ILE MG 1 84 ILE HA . . 4.930 4.677 4.368 4.933 0.003 7 0 "[ . 1 . 2]" 1
1088 1 54 LEU H 1 54 LEU QB . . 3.190 2.352 2.236 2.498 . 0 0 "[ . 1 . 2]" 1
1089 1 54 LEU H 1 54 LEU MD1 . . 4.930 3.549 3.264 3.757 . 0 0 "[ . 1 . 2]" 1
1090 1 54 LEU H 1 54 LEU MD2 . . 4.390 3.748 3.264 4.000 . 0 0 "[ . 1 . 2]" 1
1091 1 54 LEU H 1 54 LEU HG . . 3.140 2.574 2.167 2.841 . 0 0 "[ . 1 . 2]" 1
1092 1 54 LEU H 1 55 ALA H . . 2.970 2.530 2.332 2.760 . 0 0 "[ . 1 . 2]" 1
1093 1 54 LEU H 1 55 ALA HA . . 5.330 5.042 4.796 5.274 . 0 0 "[ . 1 . 2]" 1
1094 1 54 LEU H 1 55 ALA MB . . 5.360 4.610 4.469 4.773 . 0 0 "[ . 1 . 2]" 1
1095 1 54 LEU H 1 61 THR MG . . 4.930 4.568 4.225 4.927 . 0 0 "[ . 1 . 2]" 1
1096 1 54 LEU H 1 83 LYS H . . 4.590 4.201 3.829 4.507 . 0 0 "[ . 1 . 2]" 1
1097 1 54 LEU H 1 83 LYS QB . . 4.090 3.694 3.008 4.001 . 0 0 "[ . 1 . 2]" 1
1098 1 54 LEU H 1 83 LYS QG . . 5.340 4.352 3.590 4.923 . 0 0 "[ . 1 . 2]" 1
1099 1 54 LEU H 1 84 ILE H . . 5.290 4.719 4.421 4.903 . 0 0 "[ . 1 . 2]" 1
1100 1 54 LEU H 1 84 ILE HA . . 3.640 2.854 2.601 3.091 . 0 0 "[ . 1 . 2]" 1
1101 1 54 LEU H 1 84 ILE MG . . 4.930 3.850 3.356 4.163 . 0 0 "[ . 1 . 2]" 1
1102 1 54 LEU H 1 85 ASP H . . 4.680 4.321 3.753 4.682 0.002 8 0 "[ . 1 . 2]" 1
1103 1 54 LEU HA 1 54 LEU MD1 . . 4.390 3.887 3.844 3.934 . 0 0 "[ . 1 . 2]" 1
1104 1 54 LEU HA 1 54 LEU MD2 . . 2.990 2.160 1.977 2.574 . 0 0 "[ . 1 . 2]" 1
1105 1 54 LEU HA 1 54 LEU HG . . 4.020 2.917 2.782 3.179 . 0 0 "[ . 1 . 2]" 1
1106 1 54 LEU HA 1 55 ALA HA . . 5.090 4.558 4.548 4.574 . 0 0 "[ . 1 . 2]" 1
1107 1 54 LEU QB 1 54 LEU MD2 . . 3.020 2.215 2.022 2.337 . 0 0 "[ . 1 . 2]" 1
1108 1 54 LEU QB 1 55 ALA MB . . 3.630 3.175 3.088 3.231 . 0 0 "[ . 1 . 2]" 1
1109 1 54 LEU QB 1 61 THR H . . 5.340 4.767 4.471 5.050 . 0 0 "[ . 1 . 2]" 1
1110 1 54 LEU QB 1 83 LYS QB . . 3.680 2.410 1.972 2.828 . 0 0 "[ . 1 . 2]" 1
1111 1 54 LEU QB 1 83 LYS QG . . 4.460 2.871 2.023 3.461 . 0 0 "[ . 1 . 2]" 1
1112 1 54 LEU QB 1 84 ILE HA . . 4.920 3.830 3.352 4.163 . 0 0 "[ . 1 . 2]" 1
1113 1 54 LEU HB2 1 54 LEU MD1 . . 3.420 2.199 1.990 2.364 . 0 0 "[ . 1 . 2]" 1
1114 1 54 LEU HB2 1 55 ALA H . . 3.560 2.497 2.321 2.705 . 0 0 "[ . 1 . 2]" 1
1115 1 54 LEU HB2 1 55 ALA MB . . 4.490 3.521 3.289 3.711 . 0 0 "[ . 1 . 2]" 1
1116 1 54 LEU HB3 1 54 LEU MD1 . . 3.420 2.478 2.330 2.665 . 0 0 "[ . 1 . 2]" 1
1117 1 54 LEU HB3 1 55 ALA H . . 3.560 3.442 3.145 3.586 0.026 15 0 "[ . 1 . 2]" 1
1118 1 54 LEU HB3 1 55 ALA MB . . 4.490 3.634 3.371 3.793 . 0 0 "[ . 1 . 2]" 1
1119 1 54 LEU MD1 1 83 LYS QB . . 4.610 3.356 2.907 3.733 . 0 0 "[ . 1 . 2]" 1
1120 1 54 LEU MD1 1 83 LYS HD2 . . 4.390 3.684 2.359 4.307 . 0 0 "[ . 1 . 2]" 1
1121 1 54 LEU MD1 1 83 LYS QD . . 3.840 2.794 1.893 3.843 0.003 16 0 "[ . 1 . 2]" 1
1122 1 54 LEU MD1 1 83 LYS HD3 . . 4.390 3.027 1.909 4.408 0.018 15 0 "[ . 1 . 2]" 1
1123 1 54 LEU MD1 1 83 LYS QE . . 3.660 2.620 1.825 3.652 . 0 0 "[ . 1 . 2]" 1
1124 1 54 LEU MD1 1 83 LYS QG . . 3.650 2.264 1.895 3.084 . 0 0 "[ . 1 . 2]" 1
1125 1 54 LEU MD1 1 84 ILE H . . 4.720 3.864 3.202 4.452 . 0 0 "[ . 1 . 2]" 1
1126 1 54 LEU MD1 1 85 ASP H . . 4.420 3.107 2.687 3.496 . 0 0 "[ . 1 . 2]" 1
1127 1 54 LEU MD1 1 85 ASP HA . . 4.100 2.240 1.963 2.650 . 0 0 "[ . 1 . 2]" 1
1128 1 54 LEU MD1 1 85 ASP HB2 . . 3.520 2.513 2.014 3.157 . 0 0 "[ . 1 . 2]" 1
1129 1 54 LEU MD1 1 85 ASP HB3 . . 4.100 3.585 2.442 4.049 . 0 0 "[ . 1 . 2]" 1
1130 1 54 LEU MD1 1 86 ARG H . . 4.710 4.402 3.889 4.712 0.002 17 0 "[ . 1 . 2]" 1
1131 1 54 LEU MD1 1 97 SER QB . . 4.140 2.584 1.904 4.147 0.007 18 0 "[ . 1 . 2]" 1
1132 1 54 LEU MD2 1 61 THR H . . 5.500 5.285 4.844 5.504 0.004 7 0 "[ . 1 . 2]" 1
1133 1 54 LEU MD2 1 85 ASP HB2 . . 3.710 2.603 1.945 3.467 . 0 0 "[ . 1 . 2]" 1
1134 1 54 LEU MD2 1 85 ASP HB3 . . 4.230 3.644 2.531 4.225 . 0 0 "[ . 1 . 2]" 1
1135 1 54 LEU HG 1 55 ALA H . . 4.930 4.419 4.107 4.581 . 0 0 "[ . 1 . 2]" 1
1136 1 54 LEU HG 1 84 ILE H . . 5.500 5.178 4.520 5.503 0.003 1 0 "[ . 1 . 2]" 1
1137 1 54 LEU HG 1 84 ILE HA . . 4.230 3.159 2.485 3.484 . 0 0 "[ . 1 . 2]" 1
1138 1 54 LEU HG 1 85 ASP H . . 4.330 3.125 2.655 3.431 . 0 0 "[ . 1 . 2]" 1
1139 1 54 LEU HG 1 85 ASP HB2 . . 4.000 3.054 1.997 4.005 0.005 6 0 "[ . 1 . 2]" 1
1140 1 54 LEU HG 1 85 ASP HB3 . . 4.500 3.941 2.491 4.479 . 0 0 "[ . 1 . 2]" 1
1141 1 55 ALA H 1 55 ALA MB . . 3.150 2.578 2.491 2.702 . 0 0 "[ . 1 . 2]" 1
1142 1 55 ALA H 1 56 ILE H . . 4.490 4.354 4.247 4.422 . 0 0 "[ . 1 . 2]" 1
1143 1 55 ALA H 1 83 LYS H . . 3.380 2.850 2.601 3.060 . 0 0 "[ . 1 . 2]" 1
1144 1 55 ALA H 1 83 LYS QB . . 3.220 2.511 1.862 2.753 . 0 0 "[ . 1 . 2]" 1
1145 1 55 ALA H 1 84 ILE HA . . 5.000 4.862 4.616 5.014 0.014 5 0 "[ . 1 . 2]" 1
1146 1 55 ALA HA 1 56 ILE H . . 2.790 2.258 2.149 2.400 . 0 0 "[ . 1 . 2]" 1
1147 1 55 ALA HA 1 59 PHE H . . 4.590 3.956 3.774 4.250 . 0 0 "[ . 1 . 2]" 1
1148 1 55 ALA HA 1 60 GLY H . . 4.880 4.263 4.029 4.708 . 0 0 "[ . 1 . 2]" 1
1149 1 55 ALA HA 1 60 GLY HA2 . . 4.230 2.231 1.993 2.797 . 0 0 "[ . 1 . 2]" 1
1150 1 55 ALA HA 1 60 GLY HA3 . . 4.620 3.949 3.728 4.473 . 0 0 "[ . 1 . 2]" 1
1151 1 55 ALA HA 1 61 THR H . . 3.220 2.776 2.448 2.985 . 0 0 "[ . 1 . 2]" 1
1152 1 55 ALA HA 1 61 THR MG . . 3.230 2.475 1.938 2.743 . 0 0 "[ . 1 . 2]" 1
1153 1 55 ALA HA 1 62 GLU H . . 5.460 5.414 4.632 5.489 0.029 7 0 "[ . 1 . 2]" 1
1154 1 55 ALA HA 1 64 MET ME . . 4.610 4.171 3.852 4.601 . 0 0 "[ . 1 . 2]" 1
1155 1 55 ALA MB 1 56 ILE H . . 3.340 2.780 2.383 3.152 . 0 0 "[ . 1 . 2]" 1
1156 1 55 ALA MB 1 58 GLY H . . 3.710 3.294 3.017 3.630 . 0 0 "[ . 1 . 2]" 1
1157 1 55 ALA MB 1 58 GLY HA2 . . 4.670 3.230 3.063 3.372 . 0 0 "[ . 1 . 2]" 1
1158 1 55 ALA MB 1 58 GLY QA . . 3.930 3.168 3.008 3.299 . 0 0 "[ . 1 . 2]" 1
1159 1 55 ALA MB 1 58 GLY HA3 . . 4.670 4.583 4.400 4.681 0.011 20 0 "[ . 1 . 2]" 1
1160 1 55 ALA MB 1 59 PHE H . . 3.710 2.481 2.225 2.922 . 0 0 "[ . 1 . 2]" 1
1161 1 55 ALA MB 1 60 GLY H . . 4.200 3.092 2.589 3.707 . 0 0 "[ . 1 . 2]" 1
1162 1 55 ALA MB 1 60 GLY HA2 . . 4.250 2.051 1.958 2.454 . 0 0 "[ . 1 . 2]" 1
1163 1 55 ALA MB 1 60 GLY HA3 . . 4.000 3.274 3.025 3.920 . 0 0 "[ . 1 . 2]" 1
1164 1 55 ALA MB 1 83 LYS H . . 3.880 3.411 3.088 3.756 . 0 0 "[ . 1 . 2]" 1
1165 1 55 ALA MB 1 83 LYS QB . . 2.960 2.472 2.082 2.829 . 0 0 "[ . 1 . 2]" 1
1166 1 55 ALA MB 1 83 LYS QD . . 3.820 3.123 2.554 3.763 . 0 0 "[ . 1 . 2]" 1
1167 1 55 ALA MB 1 83 LYS QE . . 4.670 4.175 2.384 4.710 0.040 15 0 "[ . 1 . 2]" 1
1168 1 56 ILE H 1 56 ILE HB . . 3.280 2.556 2.475 2.650 . 0 0 "[ . 1 . 2]" 1
1169 1 56 ILE H 1 56 ILE HG13 . . 3.640 2.808 2.480 3.100 . 0 0 "[ . 1 . 2]" 1
1170 1 56 ILE H 1 56 ILE MG . . 3.870 3.803 3.764 3.846 . 0 0 "[ . 1 . 2]" 1
1171 1 56 ILE H 1 57 ASP H . . 4.860 4.387 4.170 4.515 . 0 0 "[ . 1 . 2]" 1
1172 1 56 ILE H 1 58 GLY H . . 4.710 4.114 3.675 4.531 . 0 0 "[ . 1 . 2]" 1
1173 1 56 ILE H 1 59 PHE H . . 3.390 2.614 2.260 3.009 . 0 0 "[ . 1 . 2]" 1
1174 1 56 ILE H 1 59 PHE QB . . 3.890 3.186 2.761 3.460 . 0 0 "[ . 1 . 2]" 1
1175 1 56 ILE H 1 60 GLY HA2 . . 4.590 3.756 3.528 4.028 . 0 0 "[ . 1 . 2]" 1
1176 1 56 ILE H 1 61 THR H . . 4.680 4.409 4.170 4.624 . 0 0 "[ . 1 . 2]" 1
1177 1 56 ILE H 1 61 THR MG . . 3.500 2.938 2.552 3.388 . 0 0 "[ . 1 . 2]" 1
1178 1 56 ILE H 1 64 MET ME . . 4.040 3.174 2.751 3.938 . 0 0 "[ . 1 . 2]" 1
1179 1 56 ILE HA 1 56 ILE MD . . 4.310 3.845 3.812 3.880 . 0 0 "[ . 1 . 2]" 1
1180 1 56 ILE HA 1 56 ILE HG12 . . 4.100 2.589 2.508 2.709 . 0 0 "[ . 1 . 2]" 1
1181 1 56 ILE HA 1 56 ILE HG13 . . 4.100 2.853 2.759 2.960 . 0 0 "[ . 1 . 2]" 1
1182 1 56 ILE HA 1 56 ILE MG . . 3.330 2.410 2.329 2.503 . 0 0 "[ . 1 . 2]" 1
1183 1 56 ILE HA 1 57 ASP H . . 3.120 2.156 2.139 2.192 . 0 0 "[ . 1 . 2]" 1
1184 1 56 ILE HA 1 59 PHE H . . 4.670 4.071 3.972 4.208 . 0 0 "[ . 1 . 2]" 1
1185 1 56 ILE HA 1 80 LEU QD . . 4.580 3.894 3.487 4.580 0.000 15 0 "[ . 1 . 2]" 1
1186 1 56 ILE HA 1 82 LEU HA . . 4.000 2.905 2.695 3.154 . 0 0 "[ . 1 . 2]" 1
1187 1 56 ILE HA 1 82 LEU MD2 . . 3.520 1.979 1.782 2.367 . 0 0 "[ . 1 . 2]" 1
1188 1 56 ILE HA 1 83 LYS H . . 4.200 4.038 3.752 4.205 0.005 10 0 "[ . 1 . 2]" 1
1189 1 56 ILE HB 1 59 PHE H . . 4.590 4.160 3.794 4.361 . 0 0 "[ . 1 . 2]" 1
1190 1 56 ILE HB 1 59 PHE QB . . 4.930 3.199 2.506 3.587 . 0 0 "[ . 1 . 2]" 1
1191 1 56 ILE HB 1 61 THR MG . . 4.390 3.515 3.097 4.103 . 0 0 "[ . 1 . 2]" 1
1192 1 56 ILE HB 1 64 MET ME . . 3.710 2.257 1.909 3.093 . 0 0 "[ . 1 . 2]" 1
1193 1 56 ILE HB 1 72 ARG QD . . 4.220 3.720 2.789 4.237 0.017 19 0 "[ . 1 . 2]" 1
1194 1 56 ILE HB 1 72 ARG HE . . 5.160 5.041 4.561 5.171 0.011 19 0 "[ . 1 . 2]" 1
1195 1 56 ILE MD 1 61 THR H . . 5.500 5.359 5.000 5.507 0.007 20 0 "[ . 1 . 2]" 1
1196 1 56 ILE MD 1 61 THR HA . . 4.760 4.359 4.020 4.747 . 0 0 "[ . 1 . 2]" 1
1197 1 56 ILE MD 1 61 THR MG . . 3.250 2.108 1.917 2.518 . 0 0 "[ . 1 . 2]" 1
1198 1 56 ILE MD 1 64 MET ME . . 3.450 2.253 1.813 3.287 . 0 0 "[ . 1 . 2]" 1
1199 1 56 ILE MD 1 64 MET QG . . 5.060 3.127 2.763 3.700 . 0 0 "[ . 1 . 2]" 1
1200 1 56 ILE MD 1 69 ALA H . . 4.850 4.362 3.743 4.658 . 0 0 "[ . 1 . 2]" 1
1201 1 56 ILE MD 1 69 ALA HA . . 3.190 2.563 1.947 2.828 . 0 0 "[ . 1 . 2]" 1
1202 1 56 ILE MD 1 69 ALA MB . . 3.290 2.105 1.670 2.493 . 0 0 "[ . 1 . 2]" 1
1203 1 56 ILE MD 1 72 ARG H . . 4.870 4.713 4.067 4.877 0.007 14 0 "[ . 1 . 2]" 1
1204 1 56 ILE MD 1 72 ARG HB2 . . 3.910 3.134 2.403 3.429 . 0 0 "[ . 1 . 2]" 1
1205 1 56 ILE HG12 1 61 THR MG . . 4.390 3.630 3.126 4.192 . 0 0 "[ . 1 . 2]" 1
1206 1 56 ILE HG12 1 73 ILE HG13 . . 4.620 4.438 3.791 4.624 0.004 8 0 "[ . 1 . 2]" 1
1207 1 56 ILE HG13 1 61 THR H . . 5.500 5.143 4.892 5.464 . 0 0 "[ . 1 . 2]" 1
1208 1 56 ILE HG13 1 61 THR MG . . 3.910 2.347 1.879 2.904 . 0 0 "[ . 1 . 2]" 1
1209 1 56 ILE HG13 1 64 MET ME . . 4.090 3.165 2.591 4.104 0.014 6 0 "[ . 1 . 2]" 1
1210 1 56 ILE MG 1 57 ASP H . . 4.000 2.443 2.029 2.805 . 0 0 "[ . 1 . 2]" 1
1211 1 56 ILE MG 1 57 ASP HA . . 4.800 3.891 3.698 4.167 . 0 0 "[ . 1 . 2]" 1
1212 1 56 ILE MG 1 57 ASP HB2 . . 4.390 2.826 2.201 4.079 . 0 0 "[ . 1 . 2]" 1
1213 1 56 ILE MG 1 57 ASP QB . . 3.770 2.555 2.188 3.290 . 0 0 "[ . 1 . 2]" 1
1214 1 56 ILE MG 1 57 ASP HB3 . . 4.390 3.360 2.630 4.092 . 0 0 "[ . 1 . 2]" 1
1215 1 56 ILE MG 1 58 GLY H . . 5.040 4.461 4.246 4.732 . 0 0 "[ . 1 . 2]" 1
1216 1 56 ILE MG 1 59 PHE QB . . 4.390 3.885 3.224 4.177 . 0 0 "[ . 1 . 2]" 1
1217 1 56 ILE MG 1 64 MET ME . . 4.070 3.342 2.940 4.010 . 0 0 "[ . 1 . 2]" 1
1218 1 56 ILE MG 1 72 ARG HA . . 4.610 4.365 3.856 4.604 . 0 0 "[ . 1 . 2]" 1
1219 1 56 ILE MG 1 72 ARG HB2 . . 4.260 3.007 2.342 3.693 . 0 0 "[ . 1 . 2]" 1
1220 1 56 ILE MG 1 72 ARG HB3 . . 3.180 2.177 1.826 2.619 . 0 0 "[ . 1 . 2]" 1
1221 1 56 ILE MG 1 72 ARG QD . . 4.170 3.065 2.245 4.034 . 0 0 "[ . 1 . 2]" 1
1222 1 56 ILE MG 1 72 ARG HE . . 5.460 4.805 3.587 5.193 . 0 0 "[ . 1 . 2]" 1
1223 1 56 ILE MG 1 73 ILE H . . 4.610 3.987 3.522 4.422 . 0 0 "[ . 1 . 2]" 1
1224 1 56 ILE MG 1 73 ILE HA . . 4.230 3.579 2.891 3.884 . 0 0 "[ . 1 . 2]" 1
1225 1 57 ASP H 1 58 GLY H . . 3.550 2.897 2.780 3.041 . 0 0 "[ . 1 . 2]" 1
1226 1 57 ASP H 1 59 PHE H . . 4.710 4.259 4.085 4.423 . 0 0 "[ . 1 . 2]" 1
1227 1 57 ASP H 1 80 LEU QD . . 5.280 2.926 2.298 3.750 . 0 0 "[ . 1 . 2]" 1
1228 1 57 ASP H 1 81 CYS H . . 4.140 3.448 2.949 3.961 . 0 0 "[ . 1 . 2]" 1
1229 1 57 ASP H 1 81 CYS HB2 . . 4.940 4.417 3.821 4.945 0.005 15 0 "[ . 1 . 2]" 1
1230 1 57 ASP H 1 81 CYS QB . . 4.110 3.687 3.382 4.078 . 0 0 "[ . 1 . 2]" 1
1231 1 57 ASP H 1 81 CYS HB3 . . 4.940 4.175 3.445 4.844 . 0 0 "[ . 1 . 2]" 1
1232 1 57 ASP H 1 82 LEU HA . . 4.590 3.217 2.821 3.476 . 0 0 "[ . 1 . 2]" 1
1233 1 57 ASP H 1 82 LEU MD2 . . 4.440 2.575 1.981 3.199 . 0 0 "[ . 1 . 2]" 1
1234 1 57 ASP H 1 83 LYS H . . 5.290 4.851 4.482 5.201 . 0 0 "[ . 1 . 2]" 1
1235 1 57 ASP HA 1 58 GLY H . . 3.240 2.839 2.748 2.944 . 0 0 "[ . 1 . 2]" 1
1236 1 57 ASP HA 1 59 PHE H . . 5.180 4.761 4.489 4.898 . 0 0 "[ . 1 . 2]" 1
1237 1 57 ASP HA 1 81 CYS H . . 3.960 2.483 1.892 3.487 . 0 0 "[ . 1 . 2]" 1
1238 1 57 ASP HA 1 81 CYS HB2 . . 3.830 2.896 2.318 3.555 . 0 0 "[ . 1 . 2]" 1
1239 1 57 ASP HA 1 81 CYS QB . . 3.280 2.416 2.137 2.790 . 0 0 "[ . 1 . 2]" 1
1240 1 57 ASP HA 1 81 CYS HB3 . . 3.830 3.182 2.154 3.832 0.002 1 0 "[ . 1 . 2]" 1
1241 1 57 ASP HA 1 82 LEU H . . 5.500 5.359 5.008 5.506 0.006 17 0 "[ . 1 . 2]" 1
1242 1 57 ASP HA 1 82 LEU MD2 . . 5.380 4.436 3.841 5.096 . 0 0 "[ . 1 . 2]" 1
1243 1 57 ASP QB 1 58 GLY H . . 4.040 3.884 3.770 4.064 0.024 7 0 "[ . 1 . 2]" 1
1244 1 57 ASP QB 1 59 PHE H . . 5.160 4.437 4.034 5.122 . 0 0 "[ . 1 . 2]" 1
1245 1 57 ASP QB 1 59 PHE QD . . 4.220 2.823 2.253 3.987 . 0 0 "[ . 1 . 2]" 1
1246 1 57 ASP HB2 1 58 GLY H . . 4.710 4.431 4.102 4.639 . 0 0 "[ . 1 . 2]" 1
1247 1 57 ASP HB2 1 59 PHE QD . . 4.890 3.774 2.500 4.763 . 0 0 "[ . 1 . 2]" 1
1248 1 57 ASP HB3 1 58 GLY H . . 4.710 4.326 4.109 4.672 . 0 0 "[ . 1 . 2]" 1
1249 1 57 ASP HB3 1 59 PHE QD . . 4.890 3.214 2.266 4.895 0.005 17 0 "[ . 1 . 2]" 1
1250 1 58 GLY H 1 59 PHE H . . 3.390 2.459 2.329 2.590 . 0 0 "[ . 1 . 2]" 1
1251 1 58 GLY H 1 81 CYS QB . . 4.460 3.401 2.735 4.339 . 0 0 "[ . 1 . 2]" 1
1252 1 59 PHE H 1 59 PHE QB . . 2.910 2.721 2.607 2.889 . 0 0 "[ . 1 . 2]" 1
1253 1 59 PHE H 1 59 PHE QD . . 4.000 3.590 3.272 4.000 . 0 0 "[ . 1 . 2]" 1
1254 1 59 PHE H 1 60 GLY H . . 4.400 3.903 3.799 4.083 . 0 0 "[ . 1 . 2]" 1
1255 1 59 PHE H 1 64 MET ME . . 4.890 4.521 4.137 4.897 0.007 17 0 "[ . 1 . 2]" 1
1256 1 59 PHE HA 1 59 PHE QD . . 4.390 2.561 2.096 3.051 . 0 0 "[ . 1 . 2]" 1
1257 1 59 PHE HA 1 60 GLY H . . 2.620 2.171 2.146 2.229 . 0 0 "[ . 1 . 2]" 1
1258 1 59 PHE QB 1 60 GLY H . . 3.710 3.582 3.421 3.712 0.002 19 0 "[ . 1 . 2]" 1
1259 1 59 PHE QB 1 64 MET ME . . 3.130 2.589 1.758 3.046 . 0 0 "[ . 1 . 2]" 1
1260 1 59 PHE QD 1 60 GLY H . . 4.590 4.198 3.781 4.462 . 0 0 "[ . 1 . 2]" 1
1261 1 59 PHE QD 1 64 MET ME . . 4.390 4.047 3.150 4.400 0.010 20 0 "[ . 1 . 2]" 1
1262 1 59 PHE QD 1 72 ARG HD2 . . 4.930 3.621 2.675 4.935 0.005 19 0 "[ . 1 . 2]" 1
1263 1 59 PHE QD 1 72 ARG HD3 . . 4.930 4.290 3.680 4.936 0.006 4 0 "[ . 1 . 2]" 1
1264 1 59 PHE QE 1 72 ARG QD . . 5.340 4.428 3.670 5.118 . 0 0 "[ . 1 . 2]" 1
1265 1 60 GLY H 1 60 GLY HA2 . . 2.870 2.749 2.699 2.792 . 0 0 "[ . 1 . 2]" 1
1266 1 60 GLY H 1 61 THR H . . 4.720 4.617 4.531 4.643 . 0 0 "[ . 1 . 2]" 1
1267 1 60 GLY H 1 64 MET ME . . 5.240 4.926 4.431 5.250 0.010 12 0 "[ . 1 . 2]" 1
1268 1 60 GLY HA2 1 61 THR H . . 3.180 2.213 2.140 2.273 . 0 0 "[ . 1 . 2]" 1
1269 1 60 GLY HA2 1 64 MET ME . . 4.930 4.645 4.436 4.951 0.021 20 0 "[ . 1 . 2]" 1
1270 1 60 GLY HA3 1 61 THR H . . 3.190 3.014 2.904 3.207 0.017 17 0 "[ . 1 . 2]" 1
1271 1 61 THR H 1 61 THR HB . . 4.140 3.687 3.656 3.727 . 0 0 "[ . 1 . 2]" 1
1272 1 61 THR H 1 61 THR MG . . 3.010 2.419 2.181 2.588 . 0 0 "[ . 1 . 2]" 1
1273 1 61 THR H 1 62 GLU H . . 3.290 2.983 2.241 3.179 . 0 0 "[ . 1 . 2]" 1
1274 1 61 THR H 1 62 GLU HB3 . . 4.860 4.692 4.415 4.873 0.013 2 0 "[ . 1 . 2]" 1
1275 1 61 THR H 1 64 MET H . . 5.460 5.488 5.372 5.552 0.092 2 0 "[ . 1 . 2]" 1
1276 1 61 THR H 1 64 MET ME . . 4.800 4.252 3.939 4.795 . 0 0 "[ . 1 . 2]" 1
1277 1 61 THR HA 1 61 THR MG . . 3.100 2.421 2.259 2.545 . 0 0 "[ . 1 . 2]" 1
1278 1 61 THR HA 1 63 SER H . . 4.330 3.581 3.278 4.016 . 0 0 "[ . 1 . 2]" 1
1279 1 61 THR HA 1 64 MET H . . 3.890 3.060 2.964 3.325 . 0 0 "[ . 1 . 2]" 1
1280 1 61 THR HA 1 64 MET HB2 . . 4.100 3.474 2.696 4.106 0.006 17 0 "[ . 1 . 2]" 1
1281 1 61 THR HA 1 64 MET HB3 . . 3.450 2.019 1.915 2.748 . 0 0 "[ . 1 . 2]" 1
1282 1 61 THR HA 1 64 MET ME . . 3.280 2.580 2.016 3.276 . 0 0 "[ . 1 . 2]" 1
1283 1 61 THR HA 1 64 MET QG . . 3.710 3.444 2.040 3.810 0.100 20 0 "[ . 1 . 2]" 1
1284 1 61 THR HB 1 69 ALA MB . . 4.930 4.743 3.914 4.948 0.018 4 0 "[ . 1 . 2]" 1
1285 1 61 THR MG 1 62 GLU H . . 4.400 4.269 4.061 4.336 . 0 0 "[ . 1 . 2]" 1
1286 1 61 THR MG 1 64 MET H . . 5.160 4.765 4.575 5.084 . 0 0 "[ . 1 . 2]" 1
1287 1 61 THR MG 1 64 MET HB3 . . 4.390 3.413 3.080 4.211 . 0 0 "[ . 1 . 2]" 1
1288 1 61 THR MG 1 64 MET ME . . 3.360 2.361 1.749 3.373 0.013 3 0 "[ . 1 . 2]" 1
1289 1 61 THR MG 1 64 MET QG . . 4.230 3.176 2.758 3.664 . 0 0 "[ . 1 . 2]" 1
1290 1 62 GLU H 1 62 GLU HB2 . . 3.710 3.537 3.142 3.631 . 0 0 "[ . 1 . 2]" 1
1291 1 62 GLU H 1 62 GLU HB3 . . 3.140 2.540 2.169 2.735 . 0 0 "[ . 1 . 2]" 1
1292 1 62 GLU H 1 62 GLU HG2 . . 4.390 2.629 2.020 4.441 0.051 16 0 "[ . 1 . 2]" 1
1293 1 62 GLU H 1 62 GLU QG . . 3.560 2.403 1.889 3.664 0.104 18 0 "[ . 1 . 2]" 1
1294 1 62 GLU H 1 62 GLU HG3 . . 4.390 3.343 1.903 4.348 . 0 0 "[ . 1 . 2]" 1
1295 1 62 GLU H 1 63 SER H . . 3.490 2.506 2.324 2.850 . 0 0 "[ . 1 . 2]" 1
1296 1 62 GLU H 1 63 SER HA . . 5.320 5.142 5.007 5.326 0.006 20 0 "[ . 1 . 2]" 1
1297 1 62 GLU H 1 64 MET H . . 4.710 3.764 3.461 4.271 . 0 0 "[ . 1 . 2]" 1
1298 1 62 GLU HA 1 62 GLU QG . . 3.490 3.300 2.785 3.444 . 0 0 "[ . 1 . 2]" 1
1299 1 62 GLU HB2 1 63 SER H . . 4.610 3.881 3.309 4.258 . 0 0 "[ . 1 . 2]" 1
1300 1 62 GLU HB3 1 63 SER H . . 4.300 3.828 2.912 4.252 . 0 0 "[ . 1 . 2]" 1
1301 1 62 GLU QG 1 63 SER H . . 3.560 2.304 1.917 3.223 . 0 0 "[ . 1 . 2]" 1
1302 1 63 SER H 1 63 SER QB . . 3.280 2.668 2.386 3.071 . 0 0 "[ . 1 . 2]" 1
1303 1 63 SER H 1 64 MET H . . 3.010 2.303 2.157 2.622 . 0 0 "[ . 1 . 2]" 1
1304 1 63 SER H 1 64 MET HB3 . . 4.200 3.756 3.604 4.222 0.022 20 0 "[ . 1 . 2]" 1
1305 1 63 SER QB 1 64 MET H . . 4.200 3.794 3.592 4.046 . 0 0 "[ . 1 . 2]" 1
1306 1 64 MET H 1 64 MET HB3 . . 3.380 2.367 2.232 2.861 . 0 0 "[ . 1 . 2]" 1
1307 1 64 MET H 1 64 MET ME . . 4.400 4.137 4.020 4.391 . 0 0 "[ . 1 . 2]" 1
1308 1 64 MET H 1 64 MET QG . . 3.710 3.678 2.684 3.777 0.067 5 0 "[ . 1 . 2]" 1
1309 1 64 MET H 1 65 THR H . . 4.400 4.226 4.065 4.416 0.016 2 0 "[ . 1 . 2]" 1
1310 1 64 MET H 1 68 ASP QB . . 5.340 5.096 4.840 5.373 0.033 20 0 "[ . 1 . 2]" 1
1311 1 64 MET HA 1 69 ALA H . . 5.300 5.121 4.681 5.308 0.008 17 0 "[ . 1 . 2]" 1
1312 1 64 MET HB2 1 64 MET ME . . 3.440 2.099 1.922 2.382 . 0 0 "[ . 1 . 2]" 1
1313 1 64 MET HB2 1 65 THR H . . 4.930 4.141 3.244 4.326 . 0 0 "[ . 1 . 2]" 1
1314 1 64 MET HB2 1 68 ASP QB . . 4.300 3.229 1.842 3.667 . 0 0 "[ . 1 . 2]" 1
1315 1 64 MET HB3 1 64 MET ME . . 3.600 2.176 1.879 2.754 . 0 0 "[ . 1 . 2]" 1
1316 1 64 MET HB3 1 65 THR H . . 4.930 4.521 4.335 4.585 . 0 0 "[ . 1 . 2]" 1
1317 1 64 MET HB3 1 68 ASP QB . . 4.770 4.208 3.280 4.548 . 0 0 "[ . 1 . 2]" 1
1318 1 64 MET ME 1 69 ALA H . . 5.390 4.824 4.202 5.208 . 0 0 "[ . 1 . 2]" 1
1319 1 64 MET ME 1 69 ALA HA . . 4.230 3.602 2.881 3.984 . 0 0 "[ . 1 . 2]" 1
1320 1 64 MET ME 1 72 ARG QD . . 3.380 3.110 2.291 3.376 . 0 0 "[ . 1 . 2]" 1
1321 1 64 MET ME 1 72 ARG HE . . 3.900 3.363 2.029 3.886 . 0 0 "[ . 1 . 2]" 1
1322 1 64 MET ME 1 72 ARG QG . . 3.560 2.788 2.148 3.158 . 0 0 "[ . 1 . 2]" 1
1323 1 64 MET QG 1 65 THR H . . 3.580 3.175 2.676 3.460 . 0 0 "[ . 1 . 2]" 1
1324 1 64 MET QG 1 66 HIS HA . . 5.270 4.440 4.281 4.565 . 0 0 "[ . 1 . 2]" 1
1325 1 64 MET QG 1 68 ASP HA . . 4.930 4.441 4.112 4.944 0.014 17 0 "[ . 1 . 2]" 1
1326 1 64 MET QG 1 68 ASP HB2 . . 3.840 2.436 1.988 3.583 . 0 0 "[ . 1 . 2]" 1
1327 1 64 MET QG 1 68 ASP QB . . 3.330 1.991 1.807 2.325 . 0 0 "[ . 1 . 2]" 1
1328 1 64 MET QG 1 68 ASP HB3 . . 3.840 2.331 1.979 3.177 . 0 0 "[ . 1 . 2]" 1
1329 1 64 MET QG 1 69 ALA H . . 3.580 2.612 2.372 2.806 . 0 0 "[ . 1 . 2]" 1
1330 1 64 MET QG 1 69 ALA MB . . 3.770 2.661 2.404 2.914 . 0 0 "[ . 1 . 2]" 1
1331 1 65 THR H 1 65 THR HG1 . . 4.330 3.141 2.179 3.713 . 0 0 "[ . 1 . 2]" 1
1332 1 65 THR H 1 65 THR MG . . 3.110 2.220 1.987 2.624 . 0 0 "[ . 1 . 2]" 1
1333 1 65 THR H 1 66 HIS H . . 5.040 4.604 4.580 4.625 . 0 0 "[ . 1 . 2]" 1
1334 1 65 THR H 1 68 ASP H . . 3.850 3.717 3.483 3.880 0.030 19 0 "[ . 1 . 2]" 1
1335 1 65 THR H 1 68 ASP HA . . 5.160 5.115 4.818 5.191 0.031 10 0 "[ . 1 . 2]" 1
1336 1 65 THR H 1 68 ASP QB . . 3.070 2.356 2.007 2.627 . 0 0 "[ . 1 . 2]" 1
1337 1 65 THR H 1 69 ALA H . . 4.710 4.548 4.020 4.727 0.017 13 0 "[ . 1 . 2]" 1
1338 1 65 THR HA 1 65 THR MG . . 3.390 2.389 2.174 2.497 . 0 0 "[ . 1 . 2]" 1
1339 1 65 THR HA 1 66 HIS H . . 3.140 2.396 2.283 2.468 . 0 0 "[ . 1 . 2]" 1
1340 1 65 THR HA 1 66 HIS HA . . 4.610 4.296 4.295 4.300 . 0 0 "[ . 1 . 2]" 1
1341 1 65 THR HA 1 67 ALA H . . 4.770 4.653 4.394 4.764 . 0 0 "[ . 1 . 2]" 1
1342 1 65 THR HB 1 66 HIS H . . 3.070 2.448 2.303 2.709 . 0 0 "[ . 1 . 2]" 1
1343 1 65 THR HB 1 67 ALA H . . 3.510 3.378 3.026 3.520 0.010 4 0 "[ . 1 . 2]" 1
1344 1 65 THR HG1 1 66 HIS H . . 5.290 4.000 3.100 4.741 . 0 0 "[ . 1 . 2]" 1
1345 1 65 THR HG1 1 67 ALA H . . 4.860 3.249 2.204 4.097 . 0 0 "[ . 1 . 2]" 1
1346 1 65 THR HG1 1 67 ALA MB . . 4.390 2.916 2.378 3.440 . 0 0 "[ . 1 . 2]" 1
1347 1 65 THR HG1 1 68 ASP H . . 4.200 2.618 1.887 3.429 . 0 0 "[ . 1 . 2]" 1
1348 1 65 THR MG 1 66 HIS H . . 3.890 3.788 3.627 3.895 0.005 9 0 "[ . 1 . 2]" 1
1349 1 65 THR MG 1 68 ASP H . . 4.610 4.329 4.120 4.526 . 0 0 "[ . 1 . 2]" 1
1350 1 65 THR MG 1 68 ASP QB . . 4.510 3.843 3.519 4.377 . 0 0 "[ . 1 . 2]" 1
1351 1 66 HIS H 1 66 HIS HB2 . . 3.320 2.211 2.163 2.471 . 0 0 "[ . 1 . 2]" 1
1352 1 66 HIS H 1 66 HIS HB3 . . 3.320 2.974 2.601 3.088 . 0 0 "[ . 1 . 2]" 1
1353 1 66 HIS H 1 67 ALA H . . 3.580 3.043 2.931 3.155 . 0 0 "[ . 1 . 2]" 1
1354 1 66 HIS H 1 67 ALA MB . . 5.500 4.609 4.467 4.714 . 0 0 "[ . 1 . 2]" 1
1355 1 66 HIS H 1 68 ASP H . . 5.300 4.317 4.134 4.769 . 0 0 "[ . 1 . 2]" 1
1356 1 66 HIS HA 1 66 HIS HD2 . . 4.930 4.490 4.263 4.630 . 0 0 "[ . 1 . 2]" 1
1357 1 66 HIS HA 1 69 ALA H . . 4.340 3.587 3.387 3.906 . 0 0 "[ . 1 . 2]" 1
1358 1 66 HIS HA 1 69 ALA MB . . 3.770 2.825 2.632 3.132 . 0 0 "[ . 1 . 2]" 1
1359 1 66 HIS HA 1 70 GLN QG . . 5.340 4.278 3.978 4.849 . 0 0 "[ . 1 . 2]" 1
1360 1 66 HIS QB 1 67 ALA H . . 3.040 2.280 2.156 2.456 . 0 0 "[ . 1 . 2]" 1
1361 1 66 HIS QB 1 67 ALA MB . . 4.810 3.650 3.569 3.760 . 0 0 "[ . 1 . 2]" 1
1362 1 66 HIS HB2 1 67 ALA H . . 3.690 3.464 3.375 3.702 0.012 19 0 "[ . 1 . 2]" 1
1363 1 66 HIS HB3 1 67 ALA H . . 3.690 2.313 2.181 2.507 . 0 0 "[ . 1 . 2]" 1
1364 1 66 HIS HD2 1 67 ALA H . . 4.710 4.558 3.483 4.720 0.010 14 0 "[ . 1 . 2]" 1
1365 1 66 HIS HD2 1 67 ALA HA . . 5.320 4.667 3.235 5.100 . 0 0 "[ . 1 . 2]" 1
1366 1 66 HIS HD2 1 67 ALA MB . . 5.240 5.031 3.761 5.273 0.033 10 0 "[ . 1 . 2]" 1
1367 1 66 HIS HD2 1 70 GLN HG2 . . 5.020 4.831 3.997 5.041 0.021 20 0 "[ . 1 . 2]" 1
1368 1 66 HIS HD2 1 70 GLN QG . . 4.400 4.226 3.373 4.426 0.026 9 0 "[ . 1 . 2]" 1
1369 1 66 HIS HD2 1 70 GLN HG3 . . 5.020 4.698 3.634 5.050 0.030 19 0 "[ . 1 . 2]" 1
1370 1 66 HIS HE1 1 70 GLN HE21 . . 5.290 4.525 3.775 4.984 . 0 0 "[ . 1 . 2]" 1
1371 1 66 HIS HE1 1 70 GLN QE . . 4.510 4.187 3.571 4.525 0.015 14 0 "[ . 1 . 2]" 1
1372 1 66 HIS HE1 1 70 GLN HE22 . . 5.290 5.020 4.074 5.297 0.007 9 0 "[ . 1 . 2]" 1
1373 1 67 ALA H 1 67 ALA MB . . 2.830 2.168 2.026 2.233 . 0 0 "[ . 1 . 2]" 1
1374 1 67 ALA H 1 68 ASP H . . 3.410 2.813 2.719 3.007 . 0 0 "[ . 1 . 2]" 1
1375 1 67 ALA H 1 68 ASP HA . . 5.500 5.387 5.320 5.510 0.010 2 0 "[ . 1 . 2]" 1
1376 1 67 ALA H 1 68 ASP QB . . 5.150 4.597 4.425 4.765 . 0 0 "[ . 1 . 2]" 1
1377 1 67 ALA H 1 69 ALA H . . 4.860 4.385 4.204 4.636 . 0 0 "[ . 1 . 2]" 1
1378 1 67 ALA H 1 70 GLN QG . . 4.910 4.301 3.917 4.806 . 0 0 "[ . 1 . 2]" 1
1379 1 67 ALA HA 1 70 GLN H . . 4.360 3.613 3.462 3.807 . 0 0 "[ . 1 . 2]" 1
1380 1 67 ALA HA 1 70 GLN QG . . 3.120 2.370 1.993 2.851 . 0 0 "[ . 1 . 2]" 1
1381 1 67 ALA MB 1 68 ASP H . . 3.520 2.517 2.151 2.731 . 0 0 "[ . 1 . 2]" 1
1382 1 67 ALA MB 1 68 ASP HA . . 4.390 3.764 3.590 3.843 . 0 0 "[ . 1 . 2]" 1
1383 1 67 ALA MB 1 68 ASP QB . . 4.810 4.108 3.775 4.291 . 0 0 "[ . 1 . 2]" 1
1384 1 67 ALA MB 1 69 ALA H . . 4.770 4.618 4.469 4.773 0.003 3 0 "[ . 1 . 2]" 1
1385 1 67 ALA MB 1 70 GLN H . . 4.880 4.655 4.439 4.912 0.032 19 0 "[ . 1 . 2]" 1
1386 1 67 ALA MB 1 70 GLN QB . . 5.080 4.238 3.987 5.012 . 0 0 "[ . 1 . 2]" 1
1387 1 67 ALA MB 1 70 GLN HG2 . . 5.490 4.774 3.712 5.489 . 0 0 "[ . 1 . 2]" 1
1388 1 67 ALA MB 1 70 GLN QG . . 4.770 3.812 3.329 4.150 . 0 0 "[ . 1 . 2]" 1
1389 1 67 ALA MB 1 70 GLN HG3 . . 5.490 4.055 3.737 4.862 . 0 0 "[ . 1 . 2]" 1
1390 1 67 ALA MB 1 71 ASP H . . 5.290 5.013 4.636 5.310 0.020 18 0 "[ . 1 . 2]" 1
1391 1 68 ASP H 1 68 ASP HB2 . . 4.000 2.262 2.168 2.398 . 0 0 "[ . 1 . 2]" 1
1392 1 68 ASP H 1 68 ASP QB . . 3.330 2.229 2.121 2.364 . 0 0 "[ . 1 . 2]" 1
1393 1 68 ASP H 1 68 ASP HB3 . . 4.000 3.419 2.890 3.581 . 0 0 "[ . 1 . 2]" 1
1394 1 68 ASP HA 1 70 GLN H . . 4.860 4.270 3.902 4.886 0.026 19 0 "[ . 1 . 2]" 1
1395 1 68 ASP HA 1 71 ASP H . . 4.100 3.427 3.270 3.558 . 0 0 "[ . 1 . 2]" 1
1396 1 68 ASP HA 1 71 ASP HB2 . . 3.450 3.068 2.407 3.474 0.024 18 0 "[ . 1 . 2]" 1
1397 1 68 ASP HA 1 71 ASP HB3 . . 4.500 3.992 3.180 4.526 0.026 9 0 "[ . 1 . 2]" 1
1398 1 68 ASP HA 1 72 ARG H . . 5.140 4.807 4.441 5.146 0.006 3 0 "[ . 1 . 2]" 1
1399 1 68 ASP QB 1 69 ALA H . . 3.120 2.512 2.272 2.707 . 0 0 "[ . 1 . 2]" 1
1400 1 68 ASP QB 1 69 ALA HA . . 4.810 3.808 3.738 3.892 . 0 0 "[ . 1 . 2]" 1
1401 1 68 ASP HB2 1 69 ALA H . . 3.620 2.819 2.347 3.471 . 0 0 "[ . 1 . 2]" 1
1402 1 68 ASP HB2 1 69 ALA MB . . 4.930 4.343 3.952 4.965 0.035 18 0 "[ . 1 . 2]" 1
1403 1 68 ASP HB3 1 69 ALA H . . 3.620 3.105 2.341 3.576 . 0 0 "[ . 1 . 2]" 1
1404 1 68 ASP HB3 1 69 ALA MB . . 4.930 4.401 3.815 4.785 . 0 0 "[ . 1 . 2]" 1
1405 1 69 ALA H 1 69 ALA MB . . 2.850 2.159 2.040 2.241 . 0 0 "[ . 1 . 2]" 1
1406 1 69 ALA H 1 70 GLN H . . 3.170 2.799 2.640 2.997 . 0 0 "[ . 1 . 2]" 1
1407 1 69 ALA H 1 71 ASP H . . 4.590 4.240 3.871 4.592 0.002 17 0 "[ . 1 . 2]" 1
1408 1 69 ALA H 1 72 ARG HB2 . . 5.500 4.860 4.415 5.282 . 0 0 "[ . 1 . 2]" 1
1409 1 69 ALA HA 1 72 ARG HB2 . . 3.820 2.400 2.081 2.809 . 0 0 "[ . 1 . 2]" 1
1410 1 69 ALA HA 1 72 ARG HB3 . . 4.390 3.933 3.521 4.422 0.032 19 0 "[ . 1 . 2]" 1
1411 1 69 ALA MB 1 70 GLN H . . 3.180 2.617 2.370 2.894 . 0 0 "[ . 1 . 2]" 1
1412 1 69 ALA MB 1 70 GLN HA . . 4.610 3.778 3.671 3.863 . 0 0 "[ . 1 . 2]" 1
1413 1 69 ALA MB 1 70 GLN QG . . 4.260 3.211 3.008 3.678 . 0 0 "[ . 1 . 2]" 1
1414 1 69 ALA MB 1 71 ASP H . . 5.290 4.484 4.146 4.738 . 0 0 "[ . 1 . 2]" 1
1415 1 69 ALA MB 1 72 ARG H . . 4.860 4.340 4.236 4.446 . 0 0 "[ . 1 . 2]" 1
1416 1 70 GLN H 1 70 GLN QB . . 3.420 2.587 2.441 2.763 . 0 0 "[ . 1 . 2]" 1
1417 1 70 GLN H 1 70 GLN HG2 . . 3.620 2.086 1.845 2.583 . 0 0 "[ . 1 . 2]" 1
1418 1 70 GLN H 1 70 GLN QG . . 2.750 1.987 1.836 2.215 . 0 0 "[ . 1 . 2]" 1
1419 1 70 GLN H 1 70 GLN HG3 . . 3.620 3.000 2.136 3.565 . 0 0 "[ . 1 . 2]" 1
1420 1 70 GLN H 1 71 ASP H . . 3.260 2.676 2.519 2.792 . 0 0 "[ . 1 . 2]" 1
1421 1 70 GLN H 1 71 ASP HB2 . . 4.860 4.683 4.530 4.852 . 0 0 "[ . 1 . 2]" 1
1422 1 70 GLN HA 1 70 GLN HG2 . . 4.230 2.875 2.542 3.611 . 0 0 "[ . 1 . 2]" 1
1423 1 70 GLN HA 1 70 GLN QG . . 3.610 2.784 2.489 3.326 . 0 0 "[ . 1 . 2]" 1
1424 1 70 GLN HA 1 70 GLN HG3 . . 4.230 3.783 3.559 3.893 . 0 0 "[ . 1 . 2]" 1
1425 1 70 GLN HA 1 73 ILE H . . 3.740 3.419 3.118 3.704 . 0 0 "[ . 1 . 2]" 1
1426 1 70 GLN HA 1 73 ILE HB . . 3.660 3.002 2.621 3.296 . 0 0 "[ . 1 . 2]" 1
1427 1 70 GLN HA 1 73 ILE MD . . 3.660 2.873 2.200 3.412 . 0 0 "[ . 1 . 2]" 1
1428 1 70 GLN HA 1 73 ILE HG13 . . 4.610 4.222 3.846 4.612 0.002 16 0 "[ . 1 . 2]" 1
1429 1 70 GLN HA 1 73 ILE MG . . 4.610 4.373 3.980 4.572 . 0 0 "[ . 1 . 2]" 1
1430 1 70 GLN HA 1 74 LYS H . . 4.090 3.959 3.668 4.097 0.007 10 0 "[ . 1 . 2]" 1
1431 1 70 GLN HA 1 74 LYS QB . . 4.930 4.575 4.118 4.932 0.002 19 0 "[ . 1 . 2]" 1
1432 1 70 GLN QB 1 71 ASP H . . 3.530 2.693 2.313 3.559 0.029 19 0 "[ . 1 . 2]" 1
1433 1 70 GLN QB 1 71 ASP HA . . 4.610 3.928 3.819 4.284 . 0 0 "[ . 1 . 2]" 1
1434 1 70 GLN QE 1 70 GLN QG . . 3.080 2.192 2.082 2.542 . 0 0 "[ . 1 . 2]" 1
1435 1 70 GLN QG 1 71 ASP H . . 4.530 3.790 2.490 4.042 . 0 0 "[ . 1 . 2]" 1
1436 1 70 GLN HG2 1 71 ASP H . . 5.290 4.190 2.736 4.588 . 0 0 "[ . 1 . 2]" 1
1437 1 70 GLN HG3 1 71 ASP H . . 5.290 4.431 2.864 4.913 . 0 0 "[ . 1 . 2]" 1
1438 1 71 ASP H 1 71 ASP HB2 . . 3.340 2.253 2.178 2.443 . 0 0 "[ . 1 . 2]" 1
1439 1 71 ASP H 1 71 ASP HB3 . . 3.770 3.210 2.842 3.541 . 0 0 "[ . 1 . 2]" 1
1440 1 71 ASP H 1 72 ARG H . . 3.280 2.457 2.244 2.680 . 0 0 "[ . 1 . 2]" 1
1441 1 71 ASP H 1 73 ILE H . . 5.040 4.120 3.861 4.377 . 0 0 "[ . 1 . 2]" 1
1442 1 71 ASP HA 1 73 ILE H . . 4.710 4.395 4.186 4.584 . 0 0 "[ . 1 . 2]" 1
1443 1 71 ASP HA 1 74 LYS H . . 3.850 3.788 3.734 3.860 0.010 6 0 "[ . 1 . 2]" 1
1444 1 71 ASP HA 1 74 LYS QB . . 4.060 3.966 3.789 4.063 0.003 8 0 "[ . 1 . 2]" 1
1445 1 71 ASP HA 1 74 LYS QD . . 4.390 2.522 2.060 3.121 . 0 0 "[ . 1 . 2]" 1
1446 1 71 ASP HA 1 74 LYS QE . . 4.390 3.280 2.022 4.393 0.003 3 0 "[ . 1 . 2]" 1
1447 1 71 ASP HA 1 74 LYS QG . . 4.810 2.106 1.974 2.273 . 0 0 "[ . 1 . 2]" 1
1448 1 71 ASP HA 1 75 ALA H . . 4.200 3.931 3.684 4.143 . 0 0 "[ . 1 . 2]" 1
1449 1 71 ASP HA 1 75 ALA MB . . 4.860 3.961 3.600 4.311 . 0 0 "[ . 1 . 2]" 1
1450 1 71 ASP HB2 1 72 ARG H . . 4.040 3.654 3.082 3.995 . 0 0 "[ . 1 . 2]" 1
1451 1 71 ASP HB3 1 72 ARG H . . 3.870 3.624 3.313 3.877 0.007 13 0 "[ . 1 . 2]" 1
1452 1 71 ASP HB3 1 72 ARG HA . . 4.930 4.271 4.213 4.322 . 0 0 "[ . 1 . 2]" 1
1453 1 71 ASP HB3 1 72 ARG HB2 . . 5.500 5.192 4.711 5.503 0.003 6 0 "[ . 1 . 2]" 1
1454 1 71 ASP HB3 1 72 ARG QG . . 4.930 3.934 3.363 4.741 . 0 0 "[ . 1 . 2]" 1
1455 1 71 ASP HB3 1 75 ALA MB . . 4.930 4.401 3.894 4.924 . 0 0 "[ . 1 . 2]" 1
1456 1 72 ARG H 1 72 ARG HB2 . . 3.000 2.267 2.219 2.335 . 0 0 "[ . 1 . 2]" 1
1457 1 72 ARG H 1 72 ARG HB3 . . 3.600 3.529 3.490 3.591 . 0 0 "[ . 1 . 2]" 1
1458 1 72 ARG H 1 72 ARG QD . . 5.340 4.209 2.472 4.884 . 0 0 "[ . 1 . 2]" 1
1459 1 72 ARG H 1 72 ARG QG . . 3.500 3.174 2.914 3.570 0.070 19 0 "[ . 1 . 2]" 1
1460 1 72 ARG H 1 73 ILE MD . . 5.340 4.564 4.248 4.899 . 0 0 "[ . 1 . 2]" 1
1461 1 72 ARG H 1 73 ILE MG . . 5.500 5.517 5.492 5.560 0.060 10 0 "[ . 1 . 2]" 1
1462 1 72 ARG H 1 75 ALA H . . 5.040 4.471 4.324 4.714 . 0 0 "[ . 1 . 2]" 1
1463 1 72 ARG H 1 75 ALA MB . . 4.880 4.776 4.628 4.884 0.004 15 0 "[ . 1 . 2]" 1
1464 1 72 ARG HA 1 72 ARG HD2 . . 4.100 3.609 3.296 3.874 . 0 0 "[ . 1 . 2]" 1
1465 1 72 ARG HA 1 72 ARG HD3 . . 4.100 2.781 2.371 4.107 0.007 6 0 "[ . 1 . 2]" 1
1466 1 72 ARG HA 1 72 ARG HE . . 5.180 4.880 2.863 5.117 . 0 0 "[ . 1 . 2]" 1
1467 1 72 ARG HA 1 72 ARG QG . . 3.450 2.369 2.146 2.532 . 0 0 "[ . 1 . 2]" 1
1468 1 72 ARG HA 1 75 ALA H . . 3.790 3.648 3.529 3.775 . 0 0 "[ . 1 . 2]" 1
1469 1 72 ARG HA 1 75 ALA MB . . 3.450 3.077 2.956 3.288 . 0 0 "[ . 1 . 2]" 1
1470 1 72 ARG HB3 1 72 ARG HE . . 4.790 4.306 2.430 4.585 . 0 0 "[ . 1 . 2]" 1
1471 1 72 ARG HD2 1 72 ARG QH1 . . 4.390 3.050 1.869 3.411 . 0 0 "[ . 1 . 2]" 1
1472 1 72 ARG HD3 1 72 ARG QH1 . . 4.390 2.112 1.891 3.375 . 0 0 "[ . 1 . 2]" 1
1473 1 72 ARG HE 1 72 ARG QG . . 3.770 2.714 2.198 3.298 . 0 0 "[ . 1 . 2]" 1
1474 1 72 ARG QG 1 73 ILE H . . 4.840 4.412 4.289 4.627 . 0 0 "[ . 1 . 2]" 1
1475 1 73 ILE H 1 73 ILE HB . . 2.820 2.423 2.324 2.488 . 0 0 "[ . 1 . 2]" 1
1476 1 73 ILE H 1 73 ILE MD . . 3.560 3.376 3.162 3.566 0.006 5 0 "[ . 1 . 2]" 1
1477 1 73 ILE H 1 73 ILE HG12 . . 4.100 3.841 3.721 4.049 . 0 0 "[ . 1 . 2]" 1
1478 1 73 ILE H 1 73 ILE HG13 . . 3.660 2.459 2.295 2.716 . 0 0 "[ . 1 . 2]" 1
1479 1 73 ILE H 1 73 ILE MG . . 4.100 3.745 3.696 3.766 . 0 0 "[ . 1 . 2]" 1
1480 1 73 ILE H 1 74 LYS H . . 3.200 2.479 2.363 2.530 . 0 0 "[ . 1 . 2]" 1
1481 1 73 ILE H 1 74 LYS HA . . 5.160 5.131 5.030 5.173 0.013 19 0 "[ . 1 . 2]" 1
1482 1 73 ILE H 1 74 LYS QB . . 4.930 4.610 4.455 4.792 . 0 0 "[ . 1 . 2]" 1
1483 1 73 ILE H 1 74 LYS QG . . 5.010 3.911 3.602 4.108 . 0 0 "[ . 1 . 2]" 1
1484 1 73 ILE H 1 75 ALA H . . 4.590 3.882 3.735 3.987 . 0 0 "[ . 1 . 2]" 1
1485 1 73 ILE H 1 75 ALA MB . . 5.160 4.978 4.824 5.136 . 0 0 "[ . 1 . 2]" 1
1486 1 73 ILE HA 1 73 ILE HG12 . . 3.560 2.692 2.563 2.799 . 0 0 "[ . 1 . 2]" 1
1487 1 73 ILE HA 1 73 ILE HG13 . . 3.560 2.690 2.472 2.829 . 0 0 "[ . 1 . 2]" 1
1488 1 73 ILE HA 1 73 ILE MG . . 3.230 2.490 2.467 2.552 . 0 0 "[ . 1 . 2]" 1
1489 1 73 ILE HA 1 74 LYS HA . . 4.930 4.736 4.693 4.778 . 0 0 "[ . 1 . 2]" 1
1490 1 73 ILE HA 1 75 ALA H . . 4.590 4.398 4.272 4.564 . 0 0 "[ . 1 . 2]" 1
1491 1 73 ILE HA 1 76 ALA H . . 4.090 3.711 3.537 3.911 . 0 0 "[ . 1 . 2]" 1
1492 1 73 ILE HA 1 76 ALA MB . . 3.910 2.552 2.308 2.782 . 0 0 "[ . 1 . 2]" 1
1493 1 73 ILE HA 1 80 LEU MD1 . . 4.390 2.766 1.956 3.197 . 0 0 "[ . 1 . 2]" 1
1494 1 73 ILE HA 1 80 LEU QD . . 3.330 2.653 1.944 3.029 . 0 0 "[ . 1 . 2]" 1
1495 1 73 ILE HA 1 80 LEU MD2 . . 4.390 3.596 2.560 4.142 . 0 0 "[ . 1 . 2]" 1
1496 1 73 ILE HB 1 74 LYS H . . 3.070 2.674 2.487 2.818 . 0 0 "[ . 1 . 2]" 1
1497 1 73 ILE MD 1 73 ILE MG . . 2.950 2.273 2.091 2.452 . 0 0 "[ . 1 . 2]" 1
1498 1 73 ILE MD 1 74 LYS H . . 4.680 4.450 4.259 4.642 . 0 0 "[ . 1 . 2]" 1
1499 1 73 ILE MD 1 80 LEU QD . . 4.200 3.565 3.072 4.050 . 0 0 "[ . 1 . 2]" 1
1500 1 73 ILE HG12 1 80 LEU MD1 . . 4.120 3.100 2.367 3.636 . 0 0 "[ . 1 . 2]" 1
1501 1 73 ILE HG12 1 80 LEU MD2 . . 4.120 2.808 1.992 3.322 . 0 0 "[ . 1 . 2]" 1
1502 1 73 ILE HG13 1 80 LEU MD1 . . 4.930 3.865 2.909 4.263 . 0 0 "[ . 1 . 2]" 1
1503 1 73 ILE HG13 1 80 LEU QD . . 4.000 3.564 2.763 3.947 . 0 0 "[ . 1 . 2]" 1
1504 1 73 ILE HG13 1 80 LEU MD2 . . 4.930 4.222 3.449 4.787 . 0 0 "[ . 1 . 2]" 1
1505 1 73 ILE MG 1 74 LYS H . . 3.740 3.324 3.071 3.506 . 0 0 "[ . 1 . 2]" 1
1506 1 73 ILE MG 1 74 LYS HA . . 4.100 3.268 3.052 3.402 . 0 0 "[ . 1 . 2]" 1
1507 1 73 ILE MG 1 74 LYS QB . . 4.930 3.991 3.690 4.188 . 0 0 "[ . 1 . 2]" 1
1508 1 73 ILE MG 1 75 ALA H . . 5.040 4.885 4.781 5.039 . 0 0 "[ . 1 . 2]" 1
1509 1 73 ILE MG 1 76 ALA H . . 4.860 4.446 4.293 4.597 . 0 0 "[ . 1 . 2]" 1
1510 1 73 ILE MG 1 76 ALA MB . . 4.390 3.487 3.351 3.678 . 0 0 "[ . 1 . 2]" 1
1511 1 73 ILE MG 1 80 LEU MD1 . . 3.840 3.217 2.587 3.746 . 0 0 "[ . 1 . 2]" 1
1512 1 73 ILE MG 1 80 LEU QD . . 3.260 2.418 1.975 2.865 . 0 0 "[ . 1 . 2]" 1
1513 1 73 ILE MG 1 80 LEU MD2 . . 3.840 2.530 1.982 3.221 . 0 0 "[ . 1 . 2]" 1
1514 1 74 LYS H 1 74 LYS QB . . 3.070 2.443 2.348 2.597 . 0 0 "[ . 1 . 2]" 1
1515 1 74 LYS H 1 74 LYS QD . . 4.930 3.879 3.567 4.346 . 0 0 "[ . 1 . 2]" 1
1516 1 74 LYS H 1 74 LYS QG . . 3.590 2.259 1.910 2.421 . 0 0 "[ . 1 . 2]" 1
1517 1 74 LYS H 1 75 ALA H . . 3.170 2.516 2.402 2.634 . 0 0 "[ . 1 . 2]" 1
1518 1 74 LYS H 1 75 ALA MB . . 4.610 4.305 4.217 4.434 . 0 0 "[ . 1 . 2]" 1
1519 1 74 LYS H 1 76 ALA H . . 4.710 3.897 3.712 4.064 . 0 0 "[ . 1 . 2]" 1
1520 1 74 LYS HA 1 74 LYS QD . . 4.670 4.289 3.714 4.459 . 0 0 "[ . 1 . 2]" 1
1521 1 74 LYS HA 1 74 LYS HG2 . . 4.100 3.855 3.722 4.208 0.108 17 0 "[ . 1 . 2]" 1
1522 1 74 LYS HA 1 74 LYS QG . . 3.450 3.339 3.320 3.417 . 0 0 "[ . 1 . 2]" 1
1523 1 74 LYS HA 1 74 LYS HG3 . . 4.100 3.672 3.584 3.766 . 0 0 "[ . 1 . 2]" 1
1524 1 74 LYS HA 1 76 ALA H . . 4.000 3.678 3.511 3.778 . 0 0 "[ . 1 . 2]" 1
1525 1 74 LYS QB 1 74 LYS QE . . 4.100 2.771 2.066 3.675 . 0 0 "[ . 1 . 2]" 1
1526 1 74 LYS QB 1 75 ALA H . . 3.690 3.464 3.396 3.518 . 0 0 "[ . 1 . 2]" 1
1527 1 74 LYS QB 1 75 ALA HA . . 4.930 4.498 4.361 4.566 . 0 0 "[ . 1 . 2]" 1
1528 1 74 LYS QB 1 75 ALA MB . . 4.620 4.328 4.237 4.407 . 0 0 "[ . 1 . 2]" 1
1529 1 74 LYS QB 1 76 ALA H . . 4.710 4.700 4.616 4.754 0.044 8 0 "[ . 1 . 2]" 1
1530 1 74 LYS QE 1 74 LYS QG . . 3.450 2.211 2.058 2.573 . 0 0 "[ . 1 . 2]" 1
1531 1 74 LYS QE 1 75 ALA MB . . 4.930 3.864 2.776 4.909 . 0 0 "[ . 1 . 2]" 1
1532 1 74 LYS QG 1 75 ALA H . . 3.970 2.148 2.012 2.268 . 0 0 "[ . 1 . 2]" 1
1533 1 74 LYS QG 1 75 ALA HA . . 4.790 3.420 3.199 4.411 . 0 0 "[ . 1 . 2]" 1
1534 1 75 ALA H 1 75 ALA MB . . 2.750 2.307 2.237 2.340 . 0 0 "[ . 1 . 2]" 1
1535 1 75 ALA HA 1 76 ALA MB . . 4.930 4.668 4.594 4.729 . 0 0 "[ . 1 . 2]" 1
1536 1 75 ALA MB 1 76 ALA H . . 3.550 3.475 3.319 3.550 . 0 0 "[ . 1 . 2]" 1
1537 1 75 ALA MB 1 76 ALA HA . . 5.330 4.152 4.072 4.224 . 0 0 "[ . 1 . 2]" 1
1538 1 76 ALA H 1 76 ALA MB . . 2.790 2.191 2.036 2.235 . 0 0 "[ . 1 . 2]" 1
1539 1 76 ALA H 1 77 SER H . . 4.710 4.557 4.523 4.602 . 0 0 "[ . 1 . 2]" 1
1540 1 76 ALA H 1 80 LEU QD . . 4.910 4.427 4.083 4.884 . 0 0 "[ . 1 . 2]" 1
1541 1 76 ALA HA 1 77 SER H . . 2.720 2.629 2.566 2.655 . 0 0 "[ . 1 . 2]" 1
1542 1 76 ALA MB 1 77 SER H . . 3.480 1.997 1.896 2.149 . 0 0 "[ . 1 . 2]" 1
1543 1 76 ALA MB 1 80 LEU HA . . 3.840 3.204 2.957 3.398 . 0 0 "[ . 1 . 2]" 1
1544 1 76 ALA MB 1 80 LEU HB2 . . 3.910 2.939 2.518 3.218 . 0 0 "[ . 1 . 2]" 1
1545 1 76 ALA MB 1 80 LEU HB3 . . 4.610 4.371 3.969 4.611 0.001 8 0 "[ . 1 . 2]" 1
1546 1 76 ALA MB 1 80 LEU MD1 . . 4.390 2.126 1.798 2.544 . 0 0 "[ . 1 . 2]" 1
1547 1 76 ALA MB 1 80 LEU QD . . 2.940 2.107 1.791 2.517 . 0 0 "[ . 1 . 2]" 1
1548 1 76 ALA MB 1 80 LEU MD2 . . 4.390 3.541 2.768 4.008 . 0 0 "[ . 1 . 2]" 1
1549 1 76 ALA MB 1 81 CYS H . . 4.770 4.611 4.170 4.785 0.015 18 0 "[ . 1 . 2]" 1
1550 1 77 SER H 1 77 SER QB . . 3.430 2.399 2.252 2.612 . 0 0 "[ . 1 . 2]" 1
1551 1 77 SER H 1 79 GLN H . . 4.090 3.944 3.787 4.099 0.009 9 0 "[ . 1 . 2]" 1
1552 1 77 SER H 1 80 LEU HA . . 4.860 3.835 3.564 4.198 . 0 0 "[ . 1 . 2]" 1
1553 1 77 SER HA 1 78 TYR H . . 2.570 2.563 2.513 2.623 0.053 8 0 "[ . 1 . 2]" 1
1554 1 77 SER HA 1 79 GLN H . . 4.380 4.147 4.080 4.311 . 0 0 "[ . 1 . 2]" 1
1555 1 77 SER QB 1 78 TYR H . . 3.600 2.165 1.965 2.864 . 0 0 "[ . 1 . 2]" 1
1556 1 77 SER QB 1 78 TYR QD . . 4.890 3.504 2.073 4.699 . 0 0 "[ . 1 . 2]" 1
1557 1 77 SER QB 1 79 GLN H . . 4.590 2.610 2.393 2.781 . 0 0 "[ . 1 . 2]" 1
1558 1 78 TYR H 1 78 TYR HB2 . . 3.830 3.350 2.704 3.612 . 0 0 "[ . 1 . 2]" 1
1559 1 78 TYR H 1 78 TYR QB . . 3.290 2.490 2.215 2.751 . 0 0 "[ . 1 . 2]" 1
1560 1 78 TYR H 1 78 TYR HB3 . . 3.830 2.577 2.298 2.856 . 0 0 "[ . 1 . 2]" 1
1561 1 78 TYR H 1 78 TYR QD . . 4.210 2.736 1.952 4.174 . 0 0 "[ . 1 . 2]" 1
1562 1 78 TYR H 1 79 GLN H . . 3.370 2.892 2.806 2.993 . 0 0 "[ . 1 . 2]" 1
1563 1 78 TYR HA 1 78 TYR QD . . 3.710 3.505 2.978 3.731 0.021 16 0 "[ . 1 . 2]" 1
1564 1 78 TYR QB 1 79 GLN H . . 3.630 3.341 2.794 3.608 . 0 0 "[ . 1 . 2]" 1
1565 1 78 TYR QB 1 79 GLN QG . . 4.680 3.762 2.351 4.304 . 0 0 "[ . 1 . 2]" 1
1566 1 78 TYR HB2 1 79 GLN H . . 4.230 3.910 3.439 4.255 0.025 9 0 "[ . 1 . 2]" 1
1567 1 78 TYR HB3 1 79 GLN H . . 4.230 3.833 2.843 4.234 0.004 11 0 "[ . 1 . 2]" 1
1568 1 78 TYR QD 1 79 GLN H . . 4.590 3.070 1.897 3.336 . 0 0 "[ . 1 . 2]" 1
1569 1 78 TYR QD 1 79 GLN HB2 . . 4.390 4.024 2.897 4.374 . 0 0 "[ . 1 . 2]" 1
1570 1 78 TYR QD 1 79 GLN HB3 . . 4.930 2.711 2.014 4.805 . 0 0 "[ . 1 . 2]" 1
1571 1 78 TYR QD 1 79 GLN QG . . 4.030 2.483 2.001 2.962 . 0 0 "[ . 1 . 2]" 1
1572 1 78 TYR QE 1 79 GLN HB2 . . 4.930 4.495 2.986 4.933 0.003 4 0 "[ . 1 . 2]" 1
1573 1 78 TYR QE 1 79 GLN QG . . 4.810 2.958 2.055 4.472 . 0 0 "[ . 1 . 2]" 1
1574 1 79 GLN H 1 79 GLN HB2 . . 4.090 3.738 2.865 3.880 . 0 0 "[ . 1 . 2]" 1
1575 1 79 GLN H 1 79 GLN HB3 . . 3.890 3.325 3.144 3.905 0.015 14 0 "[ . 1 . 2]" 1
1576 1 79 GLN H 1 79 GLN QG . . 3.510 2.297 1.931 3.015 . 0 0 "[ . 1 . 2]" 1
1577 1 79 GLN HA 1 80 LEU H . . 3.490 2.171 2.141 2.282 . 0 0 "[ . 1 . 2]" 1
1578 1 79 GLN HB2 1 80 LEU H . . 3.790 3.294 3.089 3.795 0.005 14 0 "[ . 1 . 2]" 1
1579 1 79 GLN HB3 1 80 LEU H . . 4.400 4.028 2.760 4.280 . 0 0 "[ . 1 . 2]" 1
1580 1 79 GLN QE 1 79 GLN QG . . 3.100 2.231 2.070 2.687 . 0 0 "[ . 1 . 2]" 1
1581 1 79 GLN QE 1 81 CYS QB . . 5.180 3.937 2.260 5.169 . 0 0 "[ . 1 . 2]" 1
1582 1 80 LEU H 1 80 LEU HB2 . . 3.640 2.832 2.659 2.970 . 0 0 "[ . 1 . 2]" 1
1583 1 80 LEU H 1 80 LEU HB3 . . 3.260 2.449 2.340 2.643 . 0 0 "[ . 1 . 2]" 1
1584 1 80 LEU H 1 80 LEU MD1 . . 4.930 4.245 4.146 4.409 . 0 0 "[ . 1 . 2]" 1
1585 1 80 LEU H 1 80 LEU QD . . 4.220 3.799 3.753 3.848 . 0 0 "[ . 1 . 2]" 1
1586 1 80 LEU H 1 80 LEU MD2 . . 4.930 4.288 4.177 4.430 . 0 0 "[ . 1 . 2]" 1
1587 1 80 LEU H 1 81 CYS H . . 4.860 4.420 4.213 4.568 . 0 0 "[ . 1 . 2]" 1
1588 1 80 LEU HA 1 80 LEU QD . . 3.300 2.196 1.927 2.514 . 0 0 "[ . 1 . 2]" 1
1589 1 80 LEU HA 1 81 CYS H . . 2.780 2.155 2.139 2.217 . 0 0 "[ . 1 . 2]" 1
1590 1 80 LEU HB2 1 81 CYS H . . 4.400 4.238 4.000 4.424 0.024 18 0 "[ . 1 . 2]" 1
1591 1 80 LEU QD 1 81 CYS H . . 3.220 2.643 2.115 3.166 . 0 0 "[ . 1 . 2]" 1
1592 1 80 LEU QD 1 82 LEU H . . 5.110 4.263 3.612 4.707 . 0 0 "[ . 1 . 2]" 1
1593 1 80 LEU QD 1 82 LEU MD1 . . 3.820 1.898 1.679 2.469 . 0 0 "[ . 1 . 2]" 1
1594 1 80 LEU QD 1 82 LEU MD2 . . 3.480 2.336 1.899 2.858 . 0 0 "[ . 1 . 2]" 1
1595 1 80 LEU QD 1 82 LEU HG . . 3.520 2.485 1.990 3.030 . 0 0 "[ . 1 . 2]" 1
1596 1 80 LEU MD1 1 82 LEU HG . . 4.390 2.981 2.015 3.615 . 0 0 "[ . 1 . 2]" 1
1597 1 80 LEU MD2 1 82 LEU HG . . 4.390 2.803 2.258 3.589 . 0 0 "[ . 1 . 2]" 1
1598 1 80 LEU HG 1 81 CYS H . . 4.610 3.219 2.616 3.753 . 0 0 "[ . 1 . 2]" 1
1599 1 80 LEU HG 1 82 LEU HG . . 3.000 2.070 1.998 2.376 . 0 0 "[ . 1 . 2]" 1
1600 1 81 CYS H 1 81 CYS HB2 . . 3.660 2.489 2.270 2.846 . 0 0 "[ . 1 . 2]" 1
1601 1 81 CYS H 1 81 CYS QB . . 3.170 2.372 2.244 2.498 . 0 0 "[ . 1 . 2]" 1
1602 1 81 CYS H 1 81 CYS HB3 . . 3.660 3.265 2.607 3.671 0.011 19 0 "[ . 1 . 2]" 1
1603 1 81 CYS HA 1 82 LEU H . . 2.740 2.164 2.140 2.280 . 0 0 "[ . 1 . 2]" 1
1604 1 81 CYS QB 1 82 LEU H . . 3.930 3.686 3.320 3.941 0.011 8 0 "[ . 1 . 2]" 1
1605 1 81 CYS HB2 1 82 LEU H . . 4.600 4.513 4.402 4.598 . 0 0 "[ . 1 . 2]" 1
1606 1 81 CYS HB3 1 82 LEU H . . 4.600 3.927 3.434 4.334 . 0 0 "[ . 1 . 2]" 1
1607 1 82 LEU H 1 82 LEU HB2 . . 3.890 2.604 2.323 2.760 . 0 0 "[ . 1 . 2]" 1
1608 1 82 LEU H 1 82 LEU QB . . 3.210 2.557 2.295 2.701 . 0 0 "[ . 1 . 2]" 1
1609 1 82 LEU H 1 82 LEU HB3 . . 3.890 3.743 3.585 3.842 . 0 0 "[ . 1 . 2]" 1
1610 1 82 LEU H 1 82 LEU MD1 . . 4.330 3.836 3.629 4.087 . 0 0 "[ . 1 . 2]" 1
1611 1 82 LEU H 1 82 LEU MD2 . . 4.390 3.967 3.491 4.257 . 0 0 "[ . 1 . 2]" 1
1612 1 82 LEU H 1 82 LEU HG . . 3.620 2.953 2.480 3.347 . 0 0 "[ . 1 . 2]" 1
1613 1 82 LEU H 1 83 LYS H . . 4.490 4.311 4.126 4.457 . 0 0 "[ . 1 . 2]" 1
1614 1 82 LEU HA 1 82 LEU MD1 . . 4.610 3.910 3.847 3.955 . 0 0 "[ . 1 . 2]" 1
1615 1 82 LEU HA 1 82 LEU MD2 . . 3.210 2.244 1.977 2.550 . 0 0 "[ . 1 . 2]" 1
1616 1 82 LEU HA 1 83 LYS H . . 2.740 2.157 2.138 2.248 . 0 0 "[ . 1 . 2]" 1
1617 1 82 LEU QB 1 82 LEU MD1 . . 3.090 2.062 1.956 2.099 . 0 0 "[ . 1 . 2]" 1
1618 1 82 LEU QB 1 82 LEU MD2 . . 3.220 2.189 2.031 2.344 . 0 0 "[ . 1 . 2]" 1
1619 1 82 LEU HB2 1 82 LEU MD1 . . 3.560 2.225 2.011 2.357 . 0 0 "[ . 1 . 2]" 1
1620 1 82 LEU HB3 1 82 LEU MD1 . . 3.560 2.473 2.326 2.678 . 0 0 "[ . 1 . 2]" 1
1621 1 82 LEU MD1 1 83 LYS H . . 5.500 5.192 4.833 5.372 . 0 0 "[ . 1 . 2]" 1
1622 1 82 LEU MD2 1 83 LYS H . . 3.850 3.635 3.251 3.846 . 0 0 "[ . 1 . 2]" 1
1623 1 83 LYS H 1 83 LYS QB . . 3.090 2.323 2.279 2.385 . 0 0 "[ . 1 . 2]" 1
1624 1 83 LYS H 1 84 ILE H . . 4.710 4.453 4.269 4.581 . 0 0 "[ . 1 . 2]" 1
1625 1 83 LYS HA 1 83 LYS HD2 . . 4.930 4.419 2.751 4.619 . 0 0 "[ . 1 . 2]" 1
1626 1 83 LYS HA 1 83 LYS QD . . 4.230 3.952 2.604 4.181 . 0 0 "[ . 1 . 2]" 1
1627 1 83 LYS HA 1 83 LYS HD3 . . 4.930 4.484 3.217 4.973 0.043 20 0 "[ . 1 . 2]" 1
1628 1 83 LYS HA 1 83 LYS HG2 . . 4.230 2.995 2.456 3.710 . 0 0 "[ . 1 . 2]" 1
1629 1 83 LYS HA 1 83 LYS QG . . 3.710 2.437 2.235 2.589 . 0 0 "[ . 1 . 2]" 1
1630 1 83 LYS HA 1 83 LYS HG3 . . 4.230 2.639 2.320 2.920 . 0 0 "[ . 1 . 2]" 1
1631 1 83 LYS HA 1 84 ILE H . . 3.420 2.175 2.140 2.259 . 0 0 "[ . 1 . 2]" 1
1632 1 83 LYS HA 1 84 ILE HG12 . . 4.930 4.134 3.745 4.952 0.022 7 0 "[ . 1 . 2]" 1
1633 1 83 LYS HA 1 84 ILE QG . . 4.230 3.639 3.261 3.835 . 0 0 "[ . 1 . 2]" 1
1634 1 83 LYS HA 1 84 ILE HG13 . . 4.930 4.276 3.322 4.792 . 0 0 "[ . 1 . 2]" 1
1635 1 83 LYS HA 1 84 ILE MG . . 4.230 3.913 3.709 4.138 . 0 0 "[ . 1 . 2]" 1
1636 1 83 LYS QB 1 84 ILE H . . 4.930 3.723 3.455 3.944 . 0 0 "[ . 1 . 2]" 1
1637 1 83 LYS QD 1 84 ILE H . . 5.340 4.647 3.317 5.148 . 0 0 "[ . 1 . 2]" 1
1638 1 83 LYS QE 1 83 LYS HG2 . . 3.770 2.555 2.081 3.300 . 0 0 "[ . 1 . 2]" 1
1639 1 83 LYS QE 1 83 LYS QG . . 3.280 2.181 2.058 2.353 . 0 0 "[ . 1 . 2]" 1
1640 1 83 LYS QE 1 83 LYS HG3 . . 3.770 2.644 2.176 3.387 . 0 0 "[ . 1 . 2]" 1
1641 1 83 LYS QE 1 84 ILE H . . 5.500 4.957 4.097 5.503 0.003 8 0 "[ . 1 . 2]" 1
1642 1 83 LYS QE 1 97 SER QB . . 4.610 3.906 2.873 4.618 0.008 18 0 "[ . 1 . 2]" 1
1643 1 83 LYS QG 1 84 ILE H . . 3.640 2.743 2.203 3.207 . 0 0 "[ . 1 . 2]" 1
1644 1 83 LYS QG 1 97 SER QB . . 5.040 4.444 3.854 4.769 . 0 0 "[ . 1 . 2]" 1
1645 1 83 LYS HG2 1 84 ILE H . . 4.390 3.052 2.375 3.959 . 0 0 "[ . 1 . 2]" 1
1646 1 83 LYS HG3 1 84 ILE H . . 4.390 3.372 2.252 4.165 . 0 0 "[ . 1 . 2]" 1
1647 1 84 ILE H 1 84 ILE MD . . 4.200 3.634 2.858 3.874 . 0 0 "[ . 1 . 2]" 1
1648 1 84 ILE H 1 84 ILE QG . . 3.090 2.049 1.873 2.191 . 0 0 "[ . 1 . 2]" 1
1649 1 84 ILE H 1 84 ILE MG . . 3.790 2.927 2.583 3.313 . 0 0 "[ . 1 . 2]" 1
1650 1 84 ILE HA 1 84 ILE MG . . 3.450 2.280 2.130 2.376 . 0 0 "[ . 1 . 2]" 1
1651 1 84 ILE HA 1 85 ASP H . . 3.120 2.314 2.236 2.431 . 0 0 "[ . 1 . 2]" 1
1652 1 84 ILE HA 1 85 ASP HB3 . . 5.240 4.728 4.237 5.066 . 0 0 "[ . 1 . 2]" 1
1653 1 84 ILE HB 1 85 ASP H . . 3.770 2.612 2.306 2.837 . 0 0 "[ . 1 . 2]" 1
1654 1 84 ILE HB 1 85 ASP HB3 . . 5.500 4.833 4.344 5.242 . 0 0 "[ . 1 . 2]" 1
1655 1 84 ILE HB 1 86 ARG H . . 4.980 2.644 2.286 3.079 . 0 0 "[ . 1 . 2]" 1
1656 1 84 ILE MD 1 85 ASP H . . 4.390 4.093 3.533 4.404 0.014 18 0 "[ . 1 . 2]" 1
1657 1 84 ILE MD 1 86 ARG H . . 4.660 2.733 1.708 3.677 . 0 0 "[ . 1 . 2]" 1
1658 1 84 ILE QG 1 84 ILE MG . . 3.050 2.137 1.965 2.316 . 0 0 "[ . 1 . 2]" 1
1659 1 84 ILE QG 1 85 ASP H . . 4.600 3.998 3.713 4.464 . 0 0 "[ . 1 . 2]" 1
1660 1 84 ILE QG 1 86 ARG H . . 4.570 3.259 2.237 4.142 . 0 0 "[ . 1 . 2]" 1
1661 1 84 ILE HG12 1 84 ILE MG . . 3.560 2.183 2.015 2.376 . 0 0 "[ . 1 . 2]" 1
1662 1 84 ILE HG13 1 84 ILE MG . . 3.560 3.069 2.684 3.202 . 0 0 "[ . 1 . 2]" 1
1663 1 84 ILE MG 1 85 ASP H . . 3.660 3.601 3.492 3.670 0.010 7 0 "[ . 1 . 2]" 1
1664 1 84 ILE MG 1 86 ARG H . . 4.400 4.198 3.962 4.393 . 0 0 "[ . 1 . 2]" 1
1665 1 85 ASP H 1 85 ASP HB2 . . 3.910 2.807 2.415 3.660 . 0 0 "[ . 1 . 2]" 1
1666 1 85 ASP H 1 85 ASP HB3 . . 3.820 2.557 2.223 2.809 . 0 0 "[ . 1 . 2]" 1
1667 1 85 ASP H 1 86 ARG H . . 4.200 2.675 2.229 3.150 . 0 0 "[ . 1 . 2]" 1
1668 1 85 ASP HB2 1 86 ARG H . . 4.600 4.338 3.943 4.590 . 0 0 "[ . 1 . 2]" 1
1669 1 85 ASP HB3 1 86 ARG H . . 4.400 3.670 2.710 4.417 0.017 4 0 "[ . 1 . 2]" 1
1670 1 85 ASP HB3 1 87 ALA H . . 5.290 3.583 2.912 4.732 . 0 0 "[ . 1 . 2]" 1
1671 1 85 ASP HB3 1 87 ALA MB . . 4.610 3.430 2.319 4.629 0.019 4 0 "[ . 1 . 2]" 1
1672 1 86 ARG H 1 86 ARG QB . . 3.180 2.913 2.697 3.124 . 0 0 "[ . 1 . 2]" 1
1673 1 86 ARG H 1 87 ALA H . . 3.850 2.873 2.527 3.121 . 0 0 "[ . 1 . 2]" 1
1674 1 86 ARG H 1 87 ALA MB . . 4.860 4.424 4.069 4.727 . 0 0 "[ . 1 . 2]" 1
1675 1 86 ARG H 1 97 SER QB . . 5.500 5.175 3.874 5.507 0.007 19 0 "[ . 1 . 2]" 1
1676 1 86 ARG HA 1 87 ALA H . . 2.940 2.755 2.630 2.896 . 0 0 "[ . 1 . 2]" 1
1677 1 86 ARG HA 1 87 ALA HA . . 4.890 4.648 4.452 4.817 . 0 0 "[ . 1 . 2]" 1
1678 1 86 ARG HA 1 88 GLU H . . 5.460 5.272 4.363 5.483 0.023 18 0 "[ . 1 . 2]" 1
1679 1 86 ARG QB 1 86 ARG QD . . 3.330 2.226 2.036 2.659 . 0 0 "[ . 1 . 2]" 1
1680 1 86 ARG QB 1 87 ALA H . . 4.230 3.911 3.808 4.045 . 0 0 "[ . 1 . 2]" 1
1681 1 86 ARG QB 1 88 GLU H . . 5.340 4.965 4.428 5.346 0.006 17 0 "[ . 1 . 2]" 1
1682 1 86 ARG HB2 1 87 ALA H . . 4.930 4.498 4.264 4.625 . 0 0 "[ . 1 . 2]" 1
1683 1 86 ARG HB3 1 87 ALA H . . 4.930 4.313 4.114 4.654 . 0 0 "[ . 1 . 2]" 1
1684 1 87 ALA H 1 87 ALA MB . . 3.030 2.174 2.054 2.407 . 0 0 "[ . 1 . 2]" 1
1685 1 87 ALA H 1 90 ARG QD . . 5.340 4.867 3.109 5.352 0.012 20 0 "[ . 1 . 2]" 1
1686 1 87 ALA H 1 90 ARG QG . . 4.510 4.097 3.258 4.526 0.016 19 0 "[ . 1 . 2]" 1
1687 1 87 ALA HA 1 88 GLU H . . 2.890 2.182 2.146 2.373 . 0 0 "[ . 1 . 2]" 1
1688 1 87 ALA HA 1 88 GLU HB3 . . 4.930 4.719 4.541 4.916 . 0 0 "[ . 1 . 2]" 1
1689 1 87 ALA MB 1 88 GLU H . . 3.680 3.436 3.332 3.670 . 0 0 "[ . 1 . 2]" 1
1690 1 87 ALA MB 1 88 GLU HG2 . . 5.500 4.747 4.072 5.218 . 0 0 "[ . 1 . 2]" 1
1691 1 87 ALA MB 1 88 GLU HG3 . . 5.500 5.251 4.876 5.524 0.024 19 0 "[ . 1 . 2]" 1
1692 1 87 ALA MB 1 89 THR H . . 4.330 3.635 3.168 4.290 . 0 0 "[ . 1 . 2]" 1
1693 1 87 ALA MB 1 90 ARG QB . . 4.610 3.058 2.024 3.716 . 0 0 "[ . 1 . 2]" 1
1694 1 87 ALA MB 1 90 ARG QD . . 4.930 3.131 1.994 4.463 . 0 0 "[ . 1 . 2]" 1
1695 1 87 ALA MB 1 90 ARG QG . . 3.980 2.089 1.625 3.759 . 0 0 "[ . 1 . 2]" 1
1696 1 88 GLU H 1 88 GLU HB2 . . 3.770 3.605 3.574 3.653 . 0 0 "[ . 1 . 2]" 1
1697 1 88 GLU H 1 88 GLU HB3 . . 3.140 2.647 2.368 2.978 . 0 0 "[ . 1 . 2]" 1
1698 1 88 GLU H 1 88 GLU HG2 . . 4.660 2.093 1.937 2.501 . 0 0 "[ . 1 . 2]" 1
1699 1 88 GLU H 1 88 GLU QG . . 3.810 2.062 1.912 2.449 . 0 0 "[ . 1 . 2]" 1
1700 1 88 GLU H 1 88 GLU HG3 . . 4.660 3.156 2.705 3.612 . 0 0 "[ . 1 . 2]" 1
1701 1 88 GLU H 1 89 THR H . . 3.710 2.602 2.190 2.980 . 0 0 "[ . 1 . 2]" 1
1702 1 88 GLU H 1 90 ARG QG . . 5.300 4.661 3.924 5.304 0.004 5 0 "[ . 1 . 2]" 1
1703 1 88 GLU HA 1 88 GLU QG . . 3.730 3.336 3.328 3.340 . 0 0 "[ . 1 . 2]" 1
1704 1 88 GLU HB2 1 89 THR H . . 4.220 3.656 3.345 3.894 . 0 0 "[ . 1 . 2]" 1
1705 1 88 GLU HB2 1 90 ARG H . . 5.500 5.307 4.897 5.503 0.003 5 0 "[ . 1 . 2]" 1
1706 1 88 GLU HB3 1 89 THR H . . 4.630 3.916 3.748 4.014 . 0 0 "[ . 1 . 2]" 1
1707 1 88 GLU HB3 1 90 ARG H . . 5.500 5.499 5.407 5.555 0.055 7 0 "[ . 1 . 2]" 1
1708 1 88 GLU QG 1 89 THR H . . 4.500 1.985 1.793 2.219 . 0 0 "[ . 1 . 2]" 1
1709 1 88 GLU QG 1 89 THR HA . . 5.020 3.695 2.960 4.000 . 0 0 "[ . 1 . 2]" 1
1710 1 88 GLU QG 1 89 THR HB . . 4.590 3.517 2.660 4.425 . 0 0 "[ . 1 . 2]" 1
1711 1 88 GLU QG 1 89 THR MG . . 4.300 3.752 2.154 4.288 . 0 0 "[ . 1 . 2]" 1
1712 1 88 GLU HG2 1 89 THR H . . 5.160 2.576 1.952 2.860 . 0 0 "[ . 1 . 2]" 1
1713 1 88 GLU HG2 1 90 ARG H . . 5.500 4.465 3.619 5.165 . 0 0 "[ . 1 . 2]" 1
1714 1 88 GLU HG3 1 89 THR H . . 5.160 2.114 1.889 2.529 . 0 0 "[ . 1 . 2]" 1
1715 1 88 GLU HG3 1 90 ARG H . . 5.500 4.189 3.483 5.026 . 0 0 "[ . 1 . 2]" 1
1716 1 89 THR H 1 89 THR HB . . 3.480 2.919 2.622 3.527 0.047 16 0 "[ . 1 . 2]" 1
1717 1 89 THR H 1 89 THR MG . . 3.920 3.587 2.151 3.954 0.034 13 0 "[ . 1 . 2]" 1
1718 1 89 THR H 1 90 ARG H . . 3.510 2.227 1.780 3.190 . 0 0 "[ . 1 . 2]" 1
1719 1 89 THR H 1 90 ARG QB . . 5.040 4.666 4.004 5.007 . 0 0 "[ . 1 . 2]" 1
1720 1 89 THR H 1 90 ARG QG . . 4.600 4.285 3.753 4.618 0.018 18 0 "[ . 1 . 2]" 1
1721 1 89 THR HA 1 89 THR MG . . 3.310 2.321 1.993 3.201 . 0 0 "[ . 1 . 2]" 1
1722 1 89 THR HB 1 90 ARG H . . 4.190 3.606 2.924 4.225 0.035 2 0 "[ . 1 . 2]" 1
1723 1 89 THR HB 1 91 LEU H . . 4.920 3.847 2.798 4.968 0.048 20 0 "[ . 1 . 2]" 1
1724 1 89 THR MG 1 90 ARG H . . 4.350 3.942 2.251 4.424 0.074 11 0 "[ . 1 . 2]" 1
1725 1 89 THR MG 1 91 LEU H . . 4.710 3.777 1.999 4.729 0.019 20 0 "[ . 1 . 2]" 1
1726 1 90 ARG H 1 90 ARG QB . . 3.310 2.926 2.196 3.353 0.043 5 0 "[ . 1 . 2]" 1
1727 1 90 ARG H 1 90 ARG QD . . 5.310 4.181 1.939 5.018 . 0 0 "[ . 1 . 2]" 1
1728 1 90 ARG H 1 90 ARG QG . . 3.470 2.660 2.017 3.339 . 0 0 "[ . 1 . 2]" 1
1729 1 90 ARG HA 1 90 ARG QD . . 4.560 3.682 2.006 4.351 . 0 0 "[ . 1 . 2]" 1
1730 1 90 ARG HA 1 90 ARG QG . . 3.390 2.553 2.233 3.340 . 0 0 "[ . 1 . 2]" 1
1731 1 90 ARG HA 1 91 LEU H . . 3.430 2.696 2.182 3.465 0.035 20 0 "[ . 1 . 2]" 1
1732 1 90 ARG QB 1 90 ARG QD . . 3.490 2.292 2.013 2.647 . 0 0 "[ . 1 . 2]" 1
1733 1 90 ARG QB 1 91 LEU H . . 4.270 3.795 2.884 4.029 . 0 0 "[ . 1 . 2]" 1
1734 1 91 LEU H 1 91 LEU HB2 . . 4.130 2.833 2.183 3.644 . 0 0 "[ . 1 . 2]" 1
1735 1 91 LEU H 1 91 LEU QB . . 3.610 2.385 2.134 2.730 . 0 0 "[ . 1 . 2]" 1
1736 1 91 LEU H 1 91 LEU HB3 . . 4.130 2.839 2.191 3.754 . 0 0 "[ . 1 . 2]" 1
1737 1 91 LEU H 1 91 LEU MD1 . . 5.380 4.170 3.895 4.583 . 0 0 "[ . 1 . 2]" 1
1738 1 91 LEU H 1 91 LEU QD . . 4.160 3.374 1.848 3.983 . 0 0 "[ . 1 . 2]" 1
1739 1 91 LEU H 1 91 LEU MD2 . . 5.380 3.777 1.851 4.470 . 0 0 "[ . 1 . 2]" 1
1740 1 91 LEU HA 1 91 LEU MD1 . . 4.390 3.054 2.115 4.018 . 0 0 "[ . 1 . 2]" 1
1741 1 91 LEU HA 1 91 LEU QD . . 3.360 2.536 1.930 3.406 0.046 7 0 "[ . 1 . 2]" 1
1742 1 91 LEU HA 1 91 LEU MD2 . . 4.390 3.294 1.956 4.062 . 0 0 "[ . 1 . 2]" 1
1743 1 91 LEU QB 1 91 LEU QD . . 2.840 1.879 1.765 2.047 . 0 0 "[ . 1 . 2]" 1
1744 1 91 LEU QB 1 92 TRP H . . 3.610 2.713 1.920 3.595 . 0 0 "[ . 1 . 2]" 1
1745 1 91 LEU QD 1 92 TRP H . . 4.370 3.170 2.293 4.186 . 0 0 "[ . 1 . 2]" 1
1746 1 91 LEU MD1 1 92 TRP H . . 5.500 4.125 2.512 5.165 . 0 0 "[ . 1 . 2]" 1
1747 1 91 LEU MD2 1 92 TRP H . . 5.500 3.551 2.302 4.727 . 0 0 "[ . 1 . 2]" 1
1748 1 92 TRP H 1 92 TRP HB2 . . 3.880 2.867 2.190 3.882 0.002 17 0 "[ . 1 . 2]" 1
1749 1 92 TRP H 1 92 TRP QB . . 3.350 2.583 2.133 3.183 . 0 0 "[ . 1 . 2]" 1
1750 1 92 TRP H 1 92 TRP HB3 . . 3.880 3.063 2.470 3.827 . 0 0 "[ . 1 . 2]" 1
1751 1 92 TRP H 1 92 TRP HD1 . . 5.180 4.904 3.337 5.184 0.004 2 0 "[ . 1 . 2]" 1
1752 1 92 TRP H 1 92 TRP HE3 . . 5.300 4.793 3.420 5.302 0.002 2 0 "[ . 1 . 2]" 1
1753 1 92 TRP H 1 93 SER H . . 4.370 3.872 2.512 4.396 0.026 10 0 "[ . 1 . 2]" 1
1754 1 92 TRP HA 1 92 TRP HD1 . . 4.390 3.367 2.718 4.319 . 0 0 "[ . 1 . 2]" 1
1755 1 92 TRP HA 1 92 TRP HE3 . . 4.670 4.168 2.822 4.670 . 0 0 "[ . 1 . 2]" 1
1756 1 92 TRP HA 1 93 SER H . . 3.010 2.392 2.140 3.056 0.046 7 0 "[ . 1 . 2]" 1
1757 1 92 TRP HB2 1 93 SER H . . 5.320 4.212 1.942 4.668 . 0 0 "[ . 1 . 2]" 1
1758 1 92 TRP HB3 1 93 SER H . . 5.320 4.056 3.290 4.396 . 0 0 "[ . 1 . 2]" 1
1759 1 92 TRP HD1 1 93 SER H . . 5.040 3.566 2.627 5.073 0.033 7 0 "[ . 1 . 2]" 1
1760 1 92 TRP HD1 1 94 PRO HA . . 5.500 4.887 2.899 5.517 0.017 20 0 "[ . 1 . 2]" 1
1761 1 92 TRP HD1 1 94 PRO QD . . 4.810 3.729 1.956 4.791 . 0 0 "[ . 1 . 2]" 1
1762 1 93 SER H 1 93 SER QB . . 3.660 2.747 2.174 3.251 . 0 0 "[ . 1 . 2]" 1
1763 1 93 SER H 1 94 PRO HA . . 5.500 4.984 4.494 5.541 0.041 17 0 "[ . 1 . 2]" 1
1764 1 93 SER H 1 94 PRO QD . . 4.910 3.816 2.483 4.350 . 0 0 "[ . 1 . 2]" 1
1765 1 93 SER HA 1 94 PRO HD2 . . 3.450 2.145 1.915 2.395 . 0 0 "[ . 1 . 2]" 1
1766 1 93 SER HA 1 94 PRO HD3 . . 3.450 2.489 2.250 3.218 . 0 0 "[ . 1 . 2]" 1
1767 1 94 PRO QD 1 95 GLN H . . 4.940 3.633 2.616 4.925 . 0 0 "[ . 1 . 2]" 1
1768 1 94 PRO QG 1 95 GLN H . . 4.140 3.011 1.883 4.086 . 0 0 "[ . 1 . 2]" 1
1769 1 95 GLN H 1 95 GLN QG . . 4.930 2.927 1.862 4.361 . 0 0 "[ . 1 . 2]" 1
1770 1 95 GLN H 1 96 VAL QG . . 5.440 4.238 2.823 5.459 0.019 19 0 "[ . 1 . 2]" 1
1771 1 95 GLN HA 1 96 VAL H . . 3.130 2.464 2.139 3.061 . 0 0 "[ . 1 . 2]" 1
1772 1 95 GLN QB 1 96 VAL H . . 4.000 3.383 2.038 4.024 0.024 5 0 "[ . 1 . 2]" 1
1773 1 95 GLN HB2 1 96 VAL H . . 4.860 3.958 2.051 4.620 . 0 0 "[ . 1 . 2]" 1
1774 1 95 GLN HB3 1 96 VAL H . . 4.860 3.925 2.636 4.652 . 0 0 "[ . 1 . 2]" 1
1775 1 95 GLN QG 1 96 VAL H . . 5.290 3.817 2.379 4.555 . 0 0 "[ . 1 . 2]" 1
1776 1 96 VAL H 1 96 VAL MG1 . . 4.360 2.917 1.920 3.976 . 0 0 "[ . 1 . 2]" 1
1777 1 96 VAL H 1 96 VAL QG . . 3.680 2.303 1.841 3.078 . 0 0 "[ . 1 . 2]" 1
1778 1 96 VAL H 1 96 VAL MG2 . . 4.360 3.003 1.895 4.040 . 0 0 "[ . 1 . 2]" 1
1779 1 96 VAL H 1 97 SER H . . 4.680 3.972 1.809 4.548 . 0 0 "[ . 1 . 2]" 1
1780 1 96 VAL HA 1 97 SER H . . 3.350 2.408 2.140 3.439 0.089 19 0 "[ . 1 . 2]" 1
1781 1 96 VAL HB 1 97 SER H . . 4.490 3.726 2.040 4.487 . 0 0 "[ . 1 . 2]" 1
1782 1 96 VAL QG 1 97 SER H . . 4.730 2.796 1.970 3.736 . 0 0 "[ . 1 . 2]" 1
1783 1 96 VAL MG1 1 97 SER H . . 5.400 3.544 2.113 4.297 . 0 0 "[ . 1 . 2]" 1
1784 1 96 VAL MG2 1 97 SER H . . 5.400 3.356 1.977 4.289 . 0 0 "[ . 1 . 2]" 1
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