NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
647270 |
6szc   |
34439 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6szc
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 1556
_Distance_constraint_stats_list.Viol_count 824
_Distance_constraint_stats_list.Viol_total 1215.683
_Distance_constraint_stats_list.Viol_max 0.962
_Distance_constraint_stats_list.Viol_rms 0.0319
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0035
_Distance_constraint_stats_list.Viol_average_violations_only 0.0984
_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 43 GLY 2.004 0.734 7 1 "[ . + 1 .]"
1 44 ASP 5.505 0.922 10 2 "[ . - + .]"
1 45 PRO 1.534 0.156 11 0 "[ . 1 .]"
1 46 LEU 5.186 0.781 7 1 "[ . + 1 .]"
1 47 VAL 4.616 0.922 10 1 "[ . + .]"
1 48 PRO 2.683 0.503 10 1 "[ . + .]"
1 49 ILE 4.025 0.672 10 1 "[ . + .]"
1 50 ASP 0.323 0.076 15 0 "[ . 1 .]"
1 51 GLU 0.953 0.081 13 0 "[ . 1 .]"
1 52 THR 0.542 0.073 7 0 "[ . 1 .]"
1 53 VAL 0.272 0.076 15 0 "[ . 1 .]"
1 54 GLU 0.000 0.000 . 0 "[ . 1 .]"
1 55 PRO 1.416 0.130 9 0 "[ . 1 .]"
1 56 THR 2.226 0.794 15 1 "[ . 1 +]"
1 57 PHE 1.564 0.182 15 0 "[ . 1 .]"
1 58 GLU 0.226 0.087 13 0 "[ . 1 .]"
1 59 ASP 0.000 0.000 . 0 "[ . 1 .]"
1 60 GLY 0.765 0.108 7 0 "[ . 1 .]"
1 61 SER 0.000 0.000 . 0 "[ . 1 .]"
1 62 LYS 2.502 0.182 15 0 "[ . 1 .]"
1 63 GLU 4.127 0.290 10 0 "[ . 1 .]"
1 64 LYS 9.612 0.962 5 4 "[ -* + * 1 .]"
1 65 THR 6.471 0.762 8 4 "[ -* * + 1 .]"
1 66 ILE 7.545 0.827 1 4 "[+*- . *1 .]"
1 67 PRO 0.040 0.022 1 0 "[ . 1 .]"
1 68 GLY 0.000 0.000 . 0 "[ . 1 .]"
1 69 GLN 3.078 0.672 11 1 "[ . 1+ .]"
1 70 GLY 0.263 0.074 8 0 "[ . 1 .]"
1 71 THR 2.326 0.183 4 0 "[ . 1 .]"
1 72 TYR 2.088 0.311 3 0 "[ . 1 .]"
1 73 THR 2.056 0.290 10 0 "[ . 1 .]"
1 74 ILE 5.009 0.794 15 2 "[ .- 1 +]"
1 75 VAL 0.180 0.097 15 0 "[ . 1 .]"
1 76 PRO 0.968 0.085 7 0 "[ . 1 .]"
1 77 ASP 1.482 0.111 4 0 "[ . 1 .]"
1 78 GLY 0.308 0.243 6 0 "[ . 1 .]"
1 79 THR 2.476 0.686 6 1 "[ .+ 1 .]"
1 80 VAL 1.505 0.180 2 0 "[ . 1 .]"
1 81 THR 0.605 0.293 2 0 "[ . 1 .]"
1 82 PHE 7.247 0.542 8 1 "[ . + 1 .]"
1 83 THR 0.077 0.070 13 0 "[ . 1 .]"
1 85 ASP 1.151 0.886 11 1 "[ . 1+ .]"
1 86 LYS 0.576 0.128 11 0 "[ . 1 .]"
1 87 GLN 0.792 0.553 2 1 "[ + . 1 .]"
1 88 PHE 1.746 0.886 11 1 "[ . 1+ .]"
1 89 VAL 0.137 0.137 4 0 "[ . 1 .]"
1 92 PRO 0.085 0.028 11 0 "[ . 1 .]"
1 93 ASP 0.726 0.353 11 0 "[ . 1 .]"
1 94 PRO 0.052 0.034 11 0 "[ . 1 .]"
1 95 VAL 5.363 0.962 5 2 "[ - + 1 .]"
1 96 THR 1.291 0.177 13 0 "[ . 1 .]"
1 97 VAL 2.907 0.235 4 0 "[ . 1 .]"
1 98 LYS 1.986 0.170 12 0 "[ . 1 .]"
1 99 ARG 0.843 0.156 4 0 "[ . 1 .]"
1 100 VAL 1.794 0.566 10 1 "[ . + .]"
1 101 ASP 1.271 0.676 10 1 "[ . + .]"
1 102 LYS 0.234 0.107 11 0 "[ . 1 .]"
1 103 ASN 3.280 0.299 3 0 "[ . 1 .]"
1 104 GLY 0.624 0.076 7 0 "[ . 1 .]"
1 105 THR 1.616 0.357 3 0 "[ . 1 .]"
1 106 PRO 0.633 0.170 12 0 "[ . 1 .]"
1 107 VAL 10.497 0.734 7 3 "[ . +- * .]"
1 108 THR 1.069 0.177 13 0 "[ . 1 .]"
1 109 ALA 0.669 0.074 6 0 "[ . 1 .]"
1 110 THR 0.000 0.000 . 0 "[ . 1 .]"
1 111 TYR 4.499 0.407 7 0 "[ . 1 .]"
1 112 SER 1.106 0.328 11 0 "[ . 1 .]"
1 115 PHE 0.925 0.407 7 0 "[ . 1 .]"
1 116 THR 1.250 0.294 9 0 "[ . 1 .]"
1 117 LYS 3.848 0.589 1 1 "[+ . 1 .]"
1 118 VAL 2.231 0.589 1 1 "[+ . 1 .]"
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 95 VAL MG1 1 95 VAL MG2 1.848 . 2.275 2.083 2.056 2.093 . 0 0 "[ . 1 .]" 1
2 1 64 LYS HG2 1 95 VAL QG 2.287 . 2.941 2.679 1.785 3.903 0.962 5 2 "[ - + 1 .]" 1
3 1 95 VAL QG 1 111 TYR HB2 3.209 . 4.496 2.355 2.027 2.930 . 0 0 "[ . 1 .]" 1
4 1 95 VAL QG 1 111 TYR HB3 3.334 . 4.724 2.855 2.108 3.319 . 0 0 "[ . 1 .]" 1
5 1 49 ILE MD 1 107 VAL HB 2.996 . 4.118 4.005 3.667 4.202 0.084 11 0 "[ . 1 .]" 1
6 1 49 ILE MD 1 49 ILE HG13 2.447 . 3.196 2.120 2.118 2.122 . 0 0 "[ . 1 .]" 1
7 1 49 ILE MD 1 49 ILE HG12 2.447 . 3.196 2.117 2.115 2.120 . 0 0 "[ . 1 .]" 1
8 1 49 ILE HG12 1 49 ILE MG 3.239 . 4.550 3.203 3.195 3.210 . 0 0 "[ . 1 .]" 1
9 1 49 ILE HG13 1 49 ILE MG 2.646 . 3.521 2.336 2.294 2.371 . 0 0 "[ . 1 .]" 1
10 1 49 ILE MG 1 101 ASP HA 3.351 . 4.754 2.717 2.278 3.559 . 0 0 "[ . 1 .]" 1
11 1 49 ILE HB 1 49 ILE MG 2.171 . 2.760 2.124 2.120 2.127 . 0 0 "[ . 1 .]" 1
12 1 49 ILE MD 1 49 ILE MG 2.032 . 2.548 2.023 1.955 2.072 . 0 0 "[ . 1 .]" 1
13 1 66 ILE MD 1 72 TYR QE 4.254 . 6.516 3.917 2.656 5.884 . 0 0 "[ . 1 .]" 1
14 1 66 ILE HB 1 66 ILE MG 2.002 . 2.503 2.127 2.113 2.134 . 0 0 "[ . 1 .]" 1
15 1 66 ILE MD 1 66 ILE MG 2.167 . 2.754 2.152 1.912 2.997 0.243 6 0 "[ . 1 .]" 1
16 1 66 ILE HA 1 66 ILE MG 2.448 . 3.197 2.414 2.357 2.455 . 0 0 "[ . 1 .]" 1
17 1 66 ILE MG 1 67 PRO HD2 2.890 . 3.934 2.399 2.142 2.754 . 0 0 "[ . 1 .]" 1
18 1 74 ILE HA 1 79 THR MG 4.071 . 6.142 4.497 4.007 4.952 . 0 0 "[ . 1 .]" 1
19 1 75 VAL HA 1 79 THR MG 3.634 . 5.285 5.084 4.921 5.382 0.097 15 0 "[ . 1 .]" 1
20 1 79 THR HA 1 79 THR MG 4.214 . 6.434 3.113 2.393 3.216 . 0 0 "[ . 1 .]" 1
21 1 79 THR HB 1 79 THR MG 2.226 . 2.846 2.131 2.128 2.135 . 0 0 "[ . 1 .]" 1
22 1 77 ASP QB 1 79 THR MG 2.000 . 2.500 2.054 1.894 2.266 0.105 8 0 "[ . 1 .]" 1
23 1 100 VAL HA 1 100 VAL MG2 3.038 . 4.191 3.213 3.210 3.215 . 0 0 "[ . 1 .]" 1
24 1 56 THR HG1 1 56 THR MG 3.066 . 4.241 2.295 2.078 2.496 . 0 0 "[ . 1 .]" 1
25 1 55 PRO HA 1 56 THR MG 3.557 . 5.138 4.159 4.032 4.237 . 0 0 "[ . 1 .]" 1
26 1 47 VAL QG 1 48 PRO HD3 4.330 . 6.674 3.861 3.649 4.190 . 0 0 "[ . 1 .]" 1
27 1 56 THR MG 1 62 LYS HD2 3.021 . 4.162 3.551 3.054 3.823 . 0 0 "[ . 1 .]" 1
28 1 108 THR HA 1 108 THR MG 2.555 . 3.371 2.347 2.297 2.384 . 0 0 "[ . 1 .]" 1
29 1 81 THR HA 1 81 THR MG 2.684 . 3.585 3.028 2.145 3.223 . 0 0 "[ . 1 .]" 1
30 1 80 VAL HA 1 81 THR MG 4.225 . 6.456 3.966 3.472 5.417 . 0 0 "[ . 1 .]" 1
31 1 53 VAL QG 1 101 ASP HA 3.109 . 4.317 3.443 3.034 3.812 . 0 0 "[ . 1 .]" 1
32 1 107 VAL HA 1 107 VAL MG1 2.682 . 3.581 2.280 2.142 2.342 . 0 0 "[ . 1 .]" 1
33 1 83 THR HA 1 83 THR MG 2.326 . 3.002 2.324 2.252 2.373 . 0 0 "[ . 1 .]" 1
34 1 56 THR HB 1 56 THR MG 2.026 . 2.539 2.130 2.124 2.133 . 0 0 "[ . 1 .]" 1
35 1 53 VAL HA 1 53 VAL QG 2.586 . 2.923 2.289 2.085 2.325 . 0 0 "[ . 1 .]" 1
36 1 81 THR HB 1 81 THR MG 2.004 . 2.506 2.130 2.125 2.134 . 0 0 "[ . 1 .]" 1
37 1 81 THR MG 1 83 THR HB 3.296 . 4.654 4.097 3.743 4.661 0.007 1 0 "[ . 1 .]" 1
38 1 83 THR HB 1 83 THR MG 1.997 . 2.495 2.137 2.134 2.138 . 0 0 "[ . 1 .]" 1
39 1 50 ASP HB3 1 53 VAL QG 2.516 . 2.974 1.896 1.790 2.154 . 0 0 "[ . 1 .]" 1
40 1 44 ASP HB2 1 47 VAL QG 2.658 . 3.541 3.406 2.777 4.463 0.922 10 1 "[ . + .]" 1
41 1 101 ASP HB2 1 107 VAL MG1 3.690 . 5.392 4.948 4.193 6.068 0.676 10 1 "[ . + .]" 1
42 1 47 VAL HB 1 47 VAL QG 1.813 . 2.224 1.892 1.885 1.898 . 0 0 "[ . 1 .]" 1
43 1 107 VAL HB 1 107 VAL MG1 2.039 . 2.559 2.126 2.122 2.130 . 0 0 "[ . 1 .]" 1
44 1 53 VAL HB 1 53 VAL QG 1.827 . 2.212 1.892 1.881 1.895 . 0 0 "[ . 1 .]" 1
45 1 56 THR MG 1 62 LYS HD3 3.313 . 4.685 2.757 2.305 3.131 . 0 0 "[ . 1 .]" 1
46 1 56 THR MG 1 74 ILE MG 3.722 . 5.454 3.709 3.229 4.552 . 0 0 "[ . 1 .]" 1
47 1 49 ILE MD 1 107 VAL MG1 2.053 . 2.580 2.506 2.064 3.252 0.672 10 1 "[ . + .]" 1
48 1 98 LYS HA 1 108 THR MG 2.357 . 3.051 1.997 1.774 2.198 . 0 0 "[ . 1 .]" 1
49 1 65 THR MG 1 71 THR HA 3.759 . 5.525 3.747 3.323 4.173 . 0 0 "[ . 1 .]" 1
50 1 65 THR HA 1 65 THR MG 2.233 . 2.856 2.348 2.284 2.380 . 0 0 "[ . 1 .]" 1
51 1 96 THR HA 1 96 THR MG 2.458 . 3.213 2.375 2.326 2.447 . 0 0 "[ . 1 .]" 1
52 1 65 THR MG 1 66 ILE HA 3.151 . 4.392 3.512 3.311 3.764 . 0 0 "[ . 1 .]" 1
53 1 107 VAL HA 1 107 VAL MG2 2.581 . 3.414 3.193 3.084 3.218 . 0 0 "[ . 1 .]" 1
54 1 116 THR HB 1 116 THR MG 2.013 . 2.520 2.132 2.122 2.137 . 0 0 "[ . 1 .]" 1
55 1 89 VAL QG 1 117 LYS HA . . 2.766 2.314 1.883 2.742 . 0 0 "[ . 1 .]" 1
56 1 52 THR HA 1 52 THR MG 1.876 . 2.316 2.314 2.266 2.350 0.034 12 0 "[ . 1 .]" 1
57 1 108 THR HB 1 108 THR MG 1.944 . 2.416 2.133 2.127 2.137 . 0 0 "[ . 1 .]" 1
58 1 96 THR HB 1 96 THR MG 1.899 . 2.350 2.138 2.136 2.141 . 0 0 "[ . 1 .]" 1
59 1 65 THR HB 1 65 THR MG 1.841 . 2.265 2.137 2.133 2.141 . 0 0 "[ . 1 .]" 1
60 1 89 VAL HA 1 89 VAL QG 2.367 . 3.068 2.186 2.111 2.417 . 0 0 "[ . 1 .]" 1
61 1 51 GLU HG2 1 52 THR MG 4.269 . 6.547 5.722 5.570 5.896 . 0 0 "[ . 1 .]" 1
62 1 51 GLU HB3 1 52 THR MG 3.911 . 5.823 4.160 3.883 4.379 . 0 0 "[ . 1 .]" 1
63 1 51 GLU HG3 1 52 THR MG 3.636 . 5.288 5.108 4.943 5.310 0.022 9 0 "[ . 1 .]" 1
64 1 106 PRO HB2 1 108 THR MG 2.277 . 2.925 2.210 1.835 2.536 . 0 0 "[ . 1 .]" 1
65 1 100 VAL MG1 1 106 PRO HG3 2.516 . 3.307 2.419 2.051 3.322 0.015 3 0 "[ . 1 .]" 1
66 1 107 VAL HB 1 107 VAL MG2 2.012 . 2.518 2.126 2.116 2.130 . 0 0 "[ . 1 .]" 1
67 1 100 VAL HB 1 100 VAL MG1 1.744 . 2.124 2.126 2.122 2.129 0.005 6 0 "[ . 1 .]" 1
68 1 89 VAL HB 1 89 VAL QG 1.886 . 2.330 1.896 1.885 1.899 . 0 0 "[ . 1 .]" 1
69 1 49 ILE MD 1 107 VAL MG2 2.455 . 3.208 2.043 1.854 2.352 . 0 0 "[ . 1 .]" 1
70 1 96 THR MG 1 108 THR HA 3.771 . 5.548 4.082 3.886 4.306 . 0 0 "[ . 1 .]" 1
71 1 71 THR HA 1 71 THR MG 2.533 . 3.335 2.388 2.339 2.427 . 0 0 "[ . 1 .]" 1
72 1 105 THR MG 1 106 PRO HA 3.577 . 5.176 4.238 4.057 4.578 . 0 0 "[ . 1 .]" 1
73 1 47 VAL QG 1 101 ASP HA 4.178 . 6.360 4.368 4.108 4.821 . 0 0 "[ . 1 .]" 1
74 1 105 THR MG 1 107 VAL HA 3.616 . 5.251 4.019 3.555 4.585 . 0 0 "[ . 1 .]" 1
75 1 105 THR HA 1 105 THR MG 2.186 . 2.783 2.377 2.206 2.463 . 0 0 "[ . 1 .]" 1
76 1 95 VAL HA 1 96 THR MG 4.752 . 7.575 5.466 5.414 5.511 . 0 0 "[ . 1 .]" 1
77 1 46 LEU HA 1 46 LEU QD 2.353 . 3.045 2.776 1.931 3.215 0.170 11 0 "[ . 1 .]" 1
78 1 105 THR HB 1 105 THR MG 2.050 . 2.575 2.135 2.132 2.137 . 0 0 "[ . 1 .]" 1
79 1 105 THR MG 1 106 PRO HD3 3.078 . 4.263 3.248 2.955 3.412 . 0 0 "[ . 1 .]" 1
80 1 96 THR MG 1 108 THR HB 2.036 . 2.554 2.618 2.535 2.731 0.177 13 0 "[ . 1 .]" 1
81 1 43 GLY HA2 1 105 THR MG 4.680 . 7.418 7.293 6.202 7.775 0.357 3 0 "[ . 1 .]" 1
82 1 105 THR MG 1 106 PRO HD2 2.530 . 3.330 2.628 2.317 2.874 . 0 0 "[ . 1 .]" 1
83 1 47 VAL QG 1 48 PRO HD2 3.755 . 5.518 3.311 2.916 3.657 . 0 0 "[ . 1 .]" 1
84 1 71 THR HB 1 71 THR MG 2.116 . 2.675 2.146 2.142 2.151 . 0 0 "[ . 1 .]" 1
85 1 47 VAL QG 1 101 ASP HB3 3.137 . 4.367 3.489 3.113 4.016 . 0 0 "[ . 1 .]" 1
86 1 47 VAL QG 1 101 ASP HB2 2.318 . 2.989 2.418 2.006 2.979 . 0 0 "[ . 1 .]" 1
87 1 63 GLU QG 1 71 THR MG . . 2.643 2.153 1.856 2.826 0.183 4 0 "[ . 1 .]" 1
88 1 105 THR MG 1 106 PRO HG3 4.234 . 6.475 4.847 4.668 4.995 . 0 0 "[ . 1 .]" 1
89 1 47 VAL QG 1 102 LYS HB3 3.682 . 5.377 4.166 3.602 4.637 . 0 0 "[ . 1 .]" 1
90 1 47 VAL QG 1 102 LYS HG3 3.179 . 4.442 3.596 2.626 4.240 . 0 0 "[ . 1 .]" 1
91 1 97 VAL HB 1 109 ALA MB 2.323 . 2.997 2.768 2.335 3.056 0.059 11 0 "[ . 1 .]" 1
92 1 63 GLU HA 1 73 THR MG 3.438 . 4.916 3.460 2.981 4.173 . 0 0 "[ . 1 .]" 1
93 1 109 ALA HA 1 109 ALA MB 2.213 . 2.825 2.137 2.130 2.141 . 0 0 "[ . 1 .]" 1
94 1 73 THR HB 1 73 THR MG 2.140 . 2.713 2.131 2.125 2.135 . 0 0 "[ . 1 .]" 1
95 1 46 LEU QB 1 46 LEU QD 2.171 . 2.760 1.974 1.913 2.063 . 0 0 "[ . 1 .]" 1
96 1 98 LYS HA 1 98 LYS HG2 3.425 . 4.891 2.554 2.431 2.911 . 0 0 "[ . 1 .]" 1
97 1 64 LYS HE3 1 64 LYS HG3 3.049 . 4.211 3.178 2.391 3.782 . 0 0 "[ . 1 .]" 1
98 1 62 LYS HA 1 62 LYS HG3 3.539 . 5.105 3.676 2.626 3.786 . 0 0 "[ . 1 .]" 1
99 1 62 LYS HA 1 62 LYS HG2 3.878 . 5.758 3.102 2.970 3.587 . 0 0 "[ . 1 .]" 1
100 1 102 LYS HB3 1 102 LYS HG2 2.645 . 3.519 2.455 2.422 2.497 . 0 0 "[ . 1 .]" 1
101 1 50 ASP HB2 1 102 LYS HG2 2.723 . 3.650 2.196 1.956 2.849 . 0 0 "[ . 1 .]" 1
102 1 44 ASP HA 1 45 PRO HG3 4.836 . 7.759 4.386 4.319 4.537 . 0 0 "[ . 1 .]" 1
103 1 66 ILE HA 1 67 PRO HG3 4.980 . 8.080 4.209 4.150 4.278 . 0 0 "[ . 1 .]" 1
104 1 66 ILE HA 1 67 PRO HG2 4.949 . 8.011 4.390 4.357 4.451 . 0 0 "[ . 1 .]" 1
105 1 66 ILE HA 1 66 ILE HG12 3.024 . 4.167 2.848 2.524 3.462 . 0 0 "[ . 1 .]" 1
106 1 66 ILE HA 1 66 ILE HG13 3.012 . 4.146 3.043 2.381 3.773 . 0 0 "[ . 1 .]" 1
107 1 55 PRO HG2 1 78 GLY HA2 3.196 . 4.473 3.240 2.564 4.344 . 0 0 "[ . 1 .]" 1
108 1 105 THR HA 1 106 PRO HG2 5.055 . 8.250 4.408 4.383 4.500 . 0 0 "[ . 1 .]" 1
109 1 46 LEU HA 1 46 LEU HG 2.862 . 3.886 3.199 2.425 4.202 0.316 14 0 "[ . 1 .]" 1
110 1 67 PRO HA 1 67 PRO HG2 3.748 . 5.504 3.888 3.844 3.924 . 0 0 "[ . 1 .]" 1
111 1 106 PRO HD3 1 106 PRO HG3 2.393 . 3.109 2.303 2.265 2.314 . 0 0 "[ . 1 .]" 1
112 1 106 PRO HD2 1 106 PRO HG2 2.234 . 2.858 2.310 2.272 2.319 . 0 0 "[ . 1 .]" 1
113 1 48 PRO HD2 1 48 PRO HG2 2.864 . 3.889 2.305 2.290 2.317 . 0 0 "[ . 1 .]" 1
114 1 55 PRO HG2 1 78 GLY HA3 4.885 . 7.868 4.952 4.137 6.085 . 0 0 "[ . 1 .]" 1
115 1 66 ILE MD 1 66 ILE HG13 2.400 . 3.120 2.117 2.114 2.119 . 0 0 "[ . 1 .]" 1
116 1 66 ILE HG13 1 66 ILE MG 2.921 . 3.987 2.929 2.360 3.204 . 0 0 "[ . 1 .]" 1
117 1 66 ILE MD 1 66 ILE HG12 2.326 . 3.002 2.115 2.110 2.119 . 0 0 "[ . 1 .]" 1
118 1 46 LEU QD 1 46 LEU HG 2.089 . 2.635 1.886 1.871 1.894 . 0 0 "[ . 1 .]" 1
119 1 66 ILE HG12 1 66 ILE MG 1.919 . 2.379 2.516 2.120 3.206 0.827 1 4 "[+** . -1 .]" 1
120 1 55 PRO HG2 1 74 ILE MD 2.939 . 4.019 2.225 1.944 2.557 . 0 0 "[ . 1 .]" 1
121 1 55 PRO HG3 1 74 ILE MD 3.650 . 5.315 3.754 3.327 4.081 . 0 0 "[ . 1 .]" 1
122 1 53 VAL HA 1 54 GLU HB2 4.575 . 7.192 4.593 4.522 4.687 . 0 0 "[ . 1 .]" 1
123 1 53 VAL QG 1 54 GLU HB2 4.734 . 7.536 4.723 4.081 4.974 . 0 0 "[ . 1 .]" 1
124 1 58 GLU HB2 1 96 THR HB 2.898 . 3.948 2.320 2.032 3.188 . 0 0 "[ . 1 .]" 1
125 1 58 GLU HB3 1 96 THR HB 2.679 . 3.576 2.413 2.065 3.021 . 0 0 "[ . 1 .]" 1
126 1 58 GLU HA 1 58 GLU HB3 2.913 . 3.974 3.016 2.989 3.025 . 0 0 "[ . 1 .]" 1
127 1 58 GLU HB2 1 96 THR MG 2.551 . 3.365 2.675 2.292 2.936 . 0 0 "[ . 1 .]" 1
128 1 58 GLU HB3 1 96 THR MG 2.940 . 4.020 3.654 2.900 4.107 0.087 13 0 "[ . 1 .]" 1
129 1 62 LYS HD2 1 62 LYS QE 2.251 . 2.885 2.281 2.166 2.383 . 0 0 "[ . 1 .]" 1
130 1 62 LYS HD3 1 62 LYS QE . . 2.908 2.243 2.172 2.421 . 0 0 "[ . 1 .]" 1
131 1 62 LYS HB2 1 62 LYS HD2 3.043 . 4.200 3.662 3.293 3.728 . 0 0 "[ . 1 .]" 1
132 1 62 LYS HB2 1 62 LYS HD3 2.723 . 3.650 3.668 2.571 3.785 0.135 7 0 "[ . 1 .]" 1
133 1 98 LYS QD 1 106 PRO HB3 3.544 . 3.775 2.674 2.162 3.237 . 0 0 "[ . 1 .]" 1
134 1 98 LYS QD 1 106 PRO HD2 4.705 . 7.472 6.012 5.575 6.242 . 0 0 "[ . 1 .]" 1
135 1 98 LYS QD 1 106 PRO HG3 3.806 . 5.617 3.903 3.269 4.302 . 0 0 "[ . 1 .]" 1
136 1 98 LYS QD 1 106 PRO HB2 4.732 . 7.531 3.887 3.165 4.349 . 0 0 "[ . 1 .]" 1
137 1 75 VAL HA 1 75 VAL HB 2.836 . 3.842 2.473 2.387 2.519 . 0 0 "[ . 1 .]" 1
138 1 67 PRO HB3 1 67 PRO HD2 4.040 . 6.081 3.926 3.910 3.955 . 0 0 "[ . 1 .]" 1
139 1 45 PRO HB2 1 46 LEU QD 3.021 . 4.162 3.253 1.870 4.141 0.010 7 0 "[ . 1 .]" 1
140 1 47 VAL QG 1 102 LYS HB2 2.422 . 3.155 2.795 2.259 3.162 0.007 7 0 "[ . 1 .]" 1
141 1 75 VAL HA 1 76 PRO HB3 4.826 . 7.737 5.274 4.843 5.466 . 0 0 "[ . 1 .]" 1
142 1 66 ILE HA 1 67 PRO HB2 5.006 . 8.138 4.947 4.896 5.034 . 0 0 "[ . 1 .]" 1
143 1 85 ASP HA 1 86 LYS HB3 4.497 . 7.025 4.967 4.494 5.737 . 0 0 "[ . 1 .]" 1
144 1 45 PRO HA 1 45 PRO HB3 2.229 . 2.850 2.292 2.253 2.313 . 0 0 "[ . 1 .]" 1
145 1 102 LYS HA 1 102 LYS HB3 2.446 . 3.194 2.507 2.459 2.570 . 0 0 "[ . 1 .]" 1
146 1 86 LYS HA 1 86 LYS HB2 2.392 . 3.107 2.609 2.367 3.020 . 0 0 "[ . 1 .]" 1
147 1 106 PRO HB3 1 106 PRO HD2 4.175 . 6.353 3.900 3.880 3.954 . 0 0 "[ . 1 .]" 1
148 1 106 PRO HB2 1 106 PRO HD2 2.618 . 3.475 3.107 3.006 3.485 0.010 3 0 "[ . 1 .]" 1
149 1 63 GLU HA 1 63 GLU QB . . 3.213 2.285 2.183 2.528 . 0 0 "[ . 1 .]" 1
150 1 106 PRO HA 1 106 PRO HB3 2.446 . 3.194 2.260 2.250 2.266 . 0 0 "[ . 1 .]" 1
151 1 94 PRO HB3 1 112 SER HA 3.093 . 4.289 2.732 1.960 4.070 . 0 0 "[ . 1 .]" 1
152 1 48 PRO HA 1 48 PRO HB3 2.748 . 3.692 2.289 2.265 2.349 . 0 0 "[ . 1 .]" 1
153 1 62 LYS HA 1 62 LYS HB2 2.838 . 3.845 3.012 2.865 3.026 . 0 0 "[ . 1 .]" 1
154 1 106 PRO HB2 1 106 PRO HD3 3.916 . 5.833 3.964 3.924 4.084 . 0 0 "[ . 1 .]" 1
155 1 94 PRO HB3 1 94 PRO HD3 3.474 . 4.982 3.201 2.915 4.047 . 0 0 "[ . 1 .]" 1
156 1 94 PRO HB2 1 94 PRO HD3 3.739 . 5.486 3.901 3.850 3.985 . 0 0 "[ . 1 .]" 1
157 1 69 GLN HG2 1 92 PRO HB2 4.217 . 6.439 5.076 3.170 6.281 . 0 0 "[ . 1 .]" 1
158 1 98 LYS HG2 1 106 PRO HB3 3.321 . 4.699 2.952 2.110 3.943 . 0 0 "[ . 1 .]" 1
159 1 63 GLU QB 1 73 THR MG . . 3.356 2.487 1.882 3.447 0.109 7 0 "[ . 1 .]" 1
160 1 100 VAL MG1 1 106 PRO HB2 3.874 . 5.750 3.920 3.646 4.319 . 0 0 "[ . 1 .]" 1
161 1 62 LYS HB2 1 74 ILE MG 3.194 . 4.469 3.794 3.614 4.001 . 0 0 "[ . 1 .]" 1
162 1 62 LYS HB3 1 74 ILE MG 4.899 . 7.899 2.492 2.287 3.113 . 0 0 "[ . 1 .]" 1
163 1 116 THR HB 1 117 LYS HB3 4.194 . 6.393 5.008 3.872 6.331 . 0 0 "[ . 1 .]" 1
164 1 87 GLN HA 1 87 GLN QG 2.777 . 3.741 2.576 2.398 3.339 . 0 0 "[ . 1 .]" 1
165 1 87 GLN HB3 1 87 GLN QG 2.276 . 2.924 2.338 2.272 2.365 . 0 0 "[ . 1 .]" 1
166 1 107 VAL HA 1 107 VAL HB 2.671 . 3.563 2.532 2.446 2.747 . 0 0 "[ . 1 .]" 1
167 1 54 GLU HA 1 54 GLU HG2 3.045 . 4.204 3.085 2.928 3.200 . 0 0 "[ . 1 .]" 1
168 1 54 GLU HG3 1 56 THR MG 2.953 . 4.043 2.451 2.302 2.658 . 0 0 "[ . 1 .]" 1
169 1 63 GLU HA 1 63 GLU QG 2.815 . 3.805 2.656 2.174 2.877 . 0 0 "[ . 1 .]" 1
170 1 63 GLU QG 1 73 THR HA 4.258 . 6.524 3.505 2.034 4.200 . 0 0 "[ . 1 .]" 1
171 1 100 VAL HA 1 100 VAL HB 2.344 . 3.031 2.450 2.419 2.469 . 0 0 "[ . 1 .]" 1
172 1 50 ASP HA 1 51 GLU HG3 4.774 . 7.622 3.445 3.328 3.711 . 0 0 "[ . 1 .]" 1
173 1 54 GLU HA 1 54 GLU HG3 2.880 . 3.917 2.629 2.517 2.788 . 0 0 "[ . 1 .]" 1
174 1 53 VAL HA 1 54 GLU HG2 5.041 . 8.217 6.746 6.625 6.807 . 0 0 "[ . 1 .]" 1
175 1 51 GLU HA 1 51 GLU HG3 3.229 . 4.533 3.077 2.967 3.137 . 0 0 "[ . 1 .]" 1
176 1 100 VAL HB 1 104 GLY HA3 4.292 . 6.595 3.785 3.600 4.022 . 0 0 "[ . 1 .]" 1
177 1 49 ILE HB 1 49 ILE HG13 2.753 . 3.701 2.470 2.441 2.499 . 0 0 "[ . 1 .]" 1
178 1 63 GLU QG 1 73 THR MG . . 2.993 2.414 1.664 2.962 0.290 10 0 "[ . 1 .]" 1
179 1 100 VAL HB 1 100 VAL MG2 1.841 . 2.265 2.126 2.124 2.129 . 0 0 "[ . 1 .]" 1
180 1 49 ILE MG 1 51 GLU HG2 3.239 . 4.550 4.552 3.931 4.631 0.081 13 0 "[ . 1 .]" 1
181 1 49 ILE MG 1 51 GLU HG3 3.392 . 4.831 4.782 4.331 4.893 0.062 14 0 "[ . 1 .]" 1
182 1 51 GLU HB2 1 51 GLU HG2 2.761 . 3.714 3.010 3.006 3.013 . 0 0 "[ . 1 .]" 1
183 1 54 GLU HB2 1 54 GLU HG3 2.681 . 3.580 2.412 2.328 2.479 . 0 0 "[ . 1 .]" 1
184 1 49 ILE HB 1 49 ILE HG12 2.849 . 3.863 2.437 2.410 2.468 . 0 0 "[ . 1 .]" 1
185 1 49 ILE HB 1 49 ILE MD 3.795 . 5.596 3.238 3.231 3.245 . 0 0 "[ . 1 .]" 1
186 1 93 ASP HA 1 93 ASP HB2 2.784 . 3.753 2.617 2.418 3.027 . 0 0 "[ . 1 .]" 1
187 1 93 ASP HB3 1 94 PRO HD3 4.099 . 6.199 4.605 3.483 5.132 . 0 0 "[ . 1 .]" 1
188 1 93 ASP HB2 1 94 PRO HD3 4.188 . 6.381 4.693 4.333 4.918 . 0 0 "[ . 1 .]" 1
189 1 93 ASP HB3 1 94 PRO HD2 4.101 . 6.203 3.707 2.131 4.645 . 0 0 "[ . 1 .]" 1
190 1 93 ASP HB2 1 94 PRO HD2 4.198 . 6.401 3.903 3.633 4.315 . 0 0 "[ . 1 .]" 1
191 1 66 ILE HB 1 66 ILE MD 2.589 . 3.427 2.575 2.193 3.240 . 0 0 "[ . 1 .]" 1
192 1 66 ILE MD 1 93 ASP HB3 3.184 . 4.451 2.393 1.806 3.098 0.111 12 0 "[ . 1 .]" 1
193 1 66 ILE MD 1 93 ASP HB2 2.599 . 3.444 2.594 1.898 3.471 0.027 14 0 "[ . 1 .]" 1
194 1 66 ILE HB 1 69 GLN QB 2.045 . 2.568 1.826 1.716 2.286 . 0 0 "[ . 1 .]" 1
195 1 66 ILE HB 1 66 ILE HG13 2.715 . 3.637 2.561 2.402 2.933 . 0 0 "[ . 1 .]" 1
196 1 50 ASP HB2 1 53 VAL QG 3.444 . 4.927 3.018 2.848 3.113 . 0 0 "[ . 1 .]" 1
197 1 50 ASP HB3 1 102 LYS HG2 4.606 . 7.258 3.891 3.661 4.486 . 0 0 "[ . 1 .]" 1
198 1 74 ILE HB 1 74 ILE MD 3.300 . 4.661 3.095 2.379 3.218 . 0 0 "[ . 1 .]" 1
199 1 101 ASP HA 1 101 ASP HB2 2.728 . 3.658 2.438 2.342 2.512 . 0 0 "[ . 1 .]" 1
200 1 101 ASP HA 1 101 ASP HB3 2.751 . 3.697 2.477 2.395 2.598 . 0 0 "[ . 1 .]" 1
201 1 49 ILE HA 1 101 ASP HB2 2.905 . 3.960 2.885 2.468 3.276 . 0 0 "[ . 1 .]" 1
202 1 49 ILE HA 1 101 ASP HB3 2.805 . 3.788 3.182 2.796 3.482 . 0 0 "[ . 1 .]" 1
203 1 70 GLY HA2 1 85 ASP QB 3.817 . 5.638 4.073 3.004 5.206 . 0 0 "[ . 1 .]" 1
204 1 85 ASP QB 1 88 PHE HB2 3.734 . 4.007 2.766 1.867 4.893 0.886 11 1 "[ . 1+ .]" 1
205 1 64 LYS HE2 1 66 ILE MD 2.821 . 3.816 2.380 1.943 3.283 . 0 0 "[ . 1 .]" 1
206 1 64 LYS HE3 1 66 ILE MD 2.916 . 3.979 3.475 2.877 3.995 0.016 11 0 "[ . 1 .]" 1
207 1 49 ILE MD 1 101 ASP HB2 3.945 . 5.890 2.820 2.420 3.213 . 0 0 "[ . 1 .]" 1
208 1 44 ASP HA 1 44 ASP HB3 2.633 . 3.500 2.702 2.329 3.028 . 0 0 "[ . 1 .]" 1
209 1 117 LYS HA 1 117 LYS HE3 4.792 . 7.663 5.250 4.390 6.102 . 0 0 "[ . 1 .]" 1
210 1 62 LYS HB2 1 62 LYS QE 4.521 . 7.076 4.498 4.225 4.544 . 0 0 "[ . 1 .]" 1
211 1 44 ASP HB2 1 47 VAL HB 3.234 . 4.541 2.920 2.250 4.421 . 0 0 "[ . 1 .]" 1
212 1 54 GLU HB2 1 62 LYS QE 4.533 . 7.102 6.726 6.541 6.791 . 0 0 "[ . 1 .]" 1
213 1 62 LYS QE 1 62 LYS HG3 . . 3.259 2.737 2.430 3.014 . 0 0 "[ . 1 .]" 1
214 1 62 LYS QE 1 62 LYS HG2 2.687 . 3.590 2.681 2.448 3.132 . 0 0 "[ . 1 .]" 1
215 1 71 THR MG 1 72 TYR HB3 4.735 . 7.538 5.051 4.883 5.195 . 0 0 "[ . 1 .]" 1
216 1 56 THR MG 1 62 LYS QE . . 2.688 1.953 1.778 2.140 0.066 10 0 "[ . 1 .]" 1
217 1 44 ASP HB3 1 47 VAL QG 4.015 . 4.645 2.941 2.607 3.596 . 0 0 "[ . 1 .]" 1
218 1 100 VAL MG2 1 104 GLY HA3 3.890 . 5.781 4.413 4.288 4.527 . 0 0 "[ . 1 .]" 1
219 1 74 ILE MD 1 78 GLY HA3 4.822 . 7.729 5.504 4.047 6.751 . 0 0 "[ . 1 .]" 1
220 1 55 PRO HG3 1 78 GLY HA2 2.994 . 4.115 2.904 2.070 3.783 . 0 0 "[ . 1 .]" 1
221 1 100 VAL HB 1 104 GLY HA2 2.552 . 3.366 2.247 2.071 2.466 . 0 0 "[ . 1 .]" 1
222 1 56 THR MG 1 60 GLY HA2 3.325 . 4.707 3.774 3.093 4.486 . 0 0 "[ . 1 .]" 1
223 1 56 THR MG 1 60 GLY HA3 4.168 . 6.340 5.054 4.192 5.885 . 0 0 "[ . 1 .]" 1
224 1 43 GLY HA2 1 107 VAL MG2 3.104 . 4.308 3.097 2.423 5.042 0.734 7 1 "[ . + 1 .]" 1
225 1 100 VAL MG2 1 104 GLY HA2 2.370 . 3.072 3.105 2.935 3.148 0.076 7 0 "[ . 1 .]" 1
226 1 43 GLY HA2 1 107 VAL MG1 3.154 . 4.398 2.864 1.982 4.222 . 0 0 "[ . 1 .]" 1
227 1 74 ILE MD 1 78 GLY HA2 3.979 . 5.958 4.060 2.657 5.430 . 0 0 "[ . 1 .]" 1
228 1 56 THR HB 1 60 GLY HA3 3.969 . 5.938 4.848 4.150 5.667 . 0 0 "[ . 1 .]" 1
229 1 56 THR HG1 1 60 GLY HA2 3.668 . 5.350 4.207 3.668 4.815 . 0 0 "[ . 1 .]" 1
230 1 56 THR HG1 1 60 GLY HA3 4.901 . 7.904 5.843 5.252 6.500 . 0 0 "[ . 1 .]" 1
231 1 43 GLY HA2 1 44 ASP HA 4.142 . 6.287 4.503 4.346 4.704 . 0 0 "[ . 1 .]" 1
232 1 54 GLU HG3 1 55 PRO HD2 3.692 . 5.395 3.637 3.194 3.960 . 0 0 "[ . 1 .]" 1
233 1 48 PRO HD3 1 48 PRO HG3 2.545 . 3.355 2.306 2.288 2.322 . 0 0 "[ . 1 .]" 1
234 1 55 PRO HD2 1 55 PRO HG3 2.531 . 3.332 2.947 2.930 2.996 . 0 0 "[ . 1 .]" 1
235 1 48 PRO HD3 1 48 PRO HG2 2.828 . 3.827 2.806 2.688 2.998 . 0 0 "[ . 1 .]" 1
236 1 55 PRO HD2 1 55 PRO HG2 2.796 . 3.774 2.280 2.269 2.322 . 0 0 "[ . 1 .]" 1
237 1 48 PRO HA 1 48 PRO HD3 3.714 . 5.438 3.549 3.323 3.739 . 0 0 "[ . 1 .]" 1
238 1 106 PRO HA 1 106 PRO HD3 4.338 . 6.690 3.912 3.859 3.976 . 0 0 "[ . 1 .]" 1
239 1 106 PRO HA 1 106 PRO HD2 3.982 . 5.964 3.909 3.894 3.926 . 0 0 "[ . 1 .]" 1
240 1 44 ASP HA 1 45 PRO HD2 2.222 . 2.839 2.041 1.841 2.152 . 0 0 "[ . 1 .]" 1
241 1 75 VAL HA 1 76 PRO HD3 2.357 . 3.051 2.034 1.884 2.371 . 0 0 "[ . 1 .]" 1
242 1 75 VAL HB 1 76 PRO HD2 2.025 . 2.537 2.228 2.025 2.395 . 0 0 "[ . 1 .]" 1
243 1 75 VAL HB 1 76 PRO HD3 3.319 . 4.696 2.999 2.537 3.604 . 0 0 "[ . 1 .]" 1
244 1 45 PRO HB3 1 45 PRO HD2 3.623 . 5.264 3.889 3.849 3.957 . 0 0 "[ . 1 .]" 1
245 1 94 PRO HB3 1 94 PRO HD2 3.612 . 5.243 3.891 3.863 3.920 . 0 0 "[ . 1 .]" 1
246 1 106 PRO HD3 1 106 PRO HG2 2.996 . 4.118 2.690 2.673 2.772 . 0 0 "[ . 1 .]" 1
247 1 94 PRO HB2 1 94 PRO HD2 3.939 . 5.878 3.821 2.952 4.056 . 0 0 "[ . 1 .]" 1
248 1 66 ILE HA 1 67 PRO HD2 2.542 . 3.350 2.417 2.335 2.534 . 0 0 "[ . 1 .]" 1
249 1 66 ILE HA 1 67 PRO HD3 2.323 . 2.998 2.011 1.947 2.090 . 0 0 "[ . 1 .]" 1
250 1 65 THR MG 1 67 PRO HD2 4.299 . 6.609 4.748 4.215 4.996 . 0 0 "[ . 1 .]" 1
251 1 66 ILE MG 1 67 PRO HD3 3.432 . 4.904 3.395 3.189 3.620 . 0 0 "[ . 1 .]" 1
252 1 93 ASP HA 1 94 PRO HD3 2.247 . 2.878 2.254 1.912 2.503 . 0 0 "[ . 1 .]" 1
253 1 50 ASP HA 1 102 LYS HA 4.484 . 6.997 4.708 3.946 5.205 . 0 0 "[ . 1 .]" 1
254 1 93 ASP HA 1 94 PRO HD2 2.149 . 2.726 2.235 1.991 2.507 . 0 0 "[ . 1 .]" 1
255 1 59 ASP HA 1 59 ASP HB2 2.584 . 3.419 2.797 2.398 3.027 . 0 0 "[ . 1 .]" 1
256 1 50 ASP HA 1 50 ASP HB3 2.982 . 4.093 3.023 3.018 3.029 . 0 0 "[ . 1 .]" 1
257 1 59 ASP HA 1 59 ASP HB3 2.522 . 3.317 2.638 2.442 3.027 . 0 0 "[ . 1 .]" 1
258 1 93 ASP HA 1 94 PRO HB3 5.289 . 8.785 5.017 4.687 5.464 . 0 0 "[ . 1 .]" 1
259 1 50 ASP HA 1 50 ASP HB2 2.561 . 3.381 2.496 2.447 2.542 . 0 0 "[ . 1 .]" 1
260 1 50 ASP HA 1 102 LYS HG3 3.237 . 4.547 3.429 2.876 4.096 . 0 0 "[ . 1 .]" 1
261 1 50 ASP HA 1 102 LYS HG2 3.154 . 4.398 3.336 2.885 3.783 . 0 0 "[ . 1 .]" 1
262 1 77 ASP HA 1 77 ASP QB 2.265 . 2.906 2.380 2.335 2.420 . 0 0 "[ . 1 .]" 1
263 1 98 LYS HA 1 98 LYS QB 2.757 . 3.707 2.409 2.339 2.484 . 0 0 "[ . 1 .]" 1
264 1 98 LYS HA 1 108 THR HA 3.075 . 4.257 2.956 2.497 3.560 . 0 0 "[ . 1 .]" 1
265 1 85 ASP HA 1 85 ASP QB 2.609 . 3.460 2.373 2.178 2.473 . 0 0 "[ . 1 .]" 1
266 1 87 GLN HA 1 87 GLN HB2 2.480 . 3.249 2.984 2.459 3.027 . 0 0 "[ . 1 .]" 1
267 1 87 GLN HA 1 87 GLN HB3 2.497 . 3.277 2.461 2.412 2.503 . 0 0 "[ . 1 .]" 1
268 1 62 LYS HA 1 74 ILE MG 2.480 . 3.249 2.123 1.982 2.251 . 0 0 "[ . 1 .]" 1
269 1 99 ARG HA 1 99 ARG HG3 3.253 . 4.575 3.747 3.592 3.862 . 0 0 "[ . 1 .]" 1
270 1 63 GLU HA 1 71 THR MG 3.556 . 5.137 3.675 3.424 3.880 . 0 0 "[ . 1 .]" 1
271 1 54 GLU HA 1 55 PRO HD3 2.115 . 2.674 2.036 1.902 2.123 . 0 0 "[ . 1 .]" 1
272 1 54 GLU HA 1 55 PRO HD2 2.405 . 3.128 2.582 2.507 2.640 . 0 0 "[ . 1 .]" 1
273 1 69 GLN HA 1 69 GLN HG3 3.087 . 4.278 2.916 2.475 3.554 . 0 0 "[ . 1 .]" 1
274 1 69 GLN HA 1 69 GLN HG2 3.138 . 4.369 2.900 2.417 3.265 . 0 0 "[ . 1 .]" 1
275 1 69 GLN HA 1 69 GLN QB 3.312 . 3.780 2.360 2.307 2.444 . 0 0 "[ . 1 .]" 1
276 1 49 ILE MD 1 99 ARG HA 5.060 . 8.261 5.617 4.500 6.255 . 0 0 "[ . 1 .]" 1
277 1 72 TYR HA 1 82 PHE HA 3.149 . 4.388 3.179 2.947 3.512 . 0 0 "[ . 1 .]" 1
278 1 117 LYS HA 1 118 VAL HB 4.006 . 6.012 4.964 4.451 6.114 0.102 2 0 "[ . 1 .]" 1
279 1 51 GLU HA 1 51 GLU HG2 2.609 . 3.460 2.579 2.496 2.677 . 0 0 "[ . 1 .]" 1
280 1 51 GLU HA 1 51 GLU HB3 2.446 . 3.194 2.444 2.411 2.473 . 0 0 "[ . 1 .]" 1
281 1 51 GLU HA 1 51 GLU HB2 2.939 . 4.019 3.019 3.014 3.024 . 0 0 "[ . 1 .]" 1
282 1 49 ILE MG 1 51 GLU HA 2.998 . 4.122 3.901 3.688 4.152 0.030 9 0 "[ . 1 .]" 1
283 1 72 TYR HA 1 80 VAL QG 4.326 . 6.666 4.638 3.920 5.600 . 0 0 "[ . 1 .]" 1
284 1 50 ASP HB3 1 102 LYS HA 3.623 . 5.264 3.465 3.235 3.704 . 0 0 "[ . 1 .]" 1
285 1 50 ASP HB2 1 102 LYS HA 2.357 . 3.052 2.349 1.921 2.769 . 0 0 "[ . 1 .]" 1
286 1 102 LYS HA 1 102 LYS HG3 3.672 . 5.357 3.034 2.914 3.160 . 0 0 "[ . 1 .]" 1
287 1 102 LYS HA 1 102 LYS HG2 2.788 . 3.760 2.481 2.361 2.574 . 0 0 "[ . 1 .]" 1
288 1 95 VAL HA 1 95 VAL QG 2.640 . 3.069 2.299 2.211 2.376 . 0 0 "[ . 1 .]" 1
289 1 61 SER HA 1 61 SER QB 2.649 . 3.526 2.258 2.156 2.349 . 0 0 "[ . 1 .]" 1
290 1 100 VAL HA 1 100 VAL MG1 2.774 . 3.736 2.349 2.325 2.383 . 0 0 "[ . 1 .]" 1
291 1 49 ILE HA 1 49 ILE HB 2.967 . 4.067 3.020 3.008 3.024 . 0 0 "[ . 1 .]" 1
292 1 49 ILE HA 1 49 ILE MG 2.628 . 3.492 2.406 2.351 2.494 . 0 0 "[ . 1 .]" 1
293 1 49 ILE HA 1 49 ILE MD 2.530 . 3.330 2.023 1.934 2.141 . 0 0 "[ . 1 .]" 1
294 1 49 ILE HA 1 101 ASP HA 2.729 . 3.660 2.267 1.898 2.981 . 0 0 "[ . 1 .]" 1
295 1 56 THR HA 1 56 THR HG1 5.158 . 8.484 4.068 3.974 4.090 . 0 0 "[ . 1 .]" 1
296 1 47 VAL HA 1 48 PRO HD2 2.017 . 2.525 2.192 1.865 2.463 . 0 0 "[ . 1 .]" 1
297 1 47 VAL HA 1 48 PRO HD3 2.669 . 3.559 2.567 2.236 3.045 . 0 0 "[ . 1 .]" 1
298 1 47 VAL HA 1 48 PRO HB2 4.665 . 7.385 5.054 4.481 5.470 . 0 0 "[ . 1 .]" 1
299 1 47 VAL HA 1 47 VAL HB 2.524 . 3.320 2.991 2.844 3.026 . 0 0 "[ . 1 .]" 1
300 1 47 VAL HA 1 48 PRO HG3 4.142 . 6.287 4.514 4.401 4.654 . 0 0 "[ . 1 .]" 1
301 1 56 THR HA 1 74 ILE HG13 3.315 . 4.689 4.321 3.590 5.483 0.794 15 1 "[ . 1 +]" 1
302 1 56 THR HA 1 56 THR MG 2.260 . 2.899 2.298 2.275 2.354 . 0 0 "[ . 1 .]" 1
303 1 47 VAL HA 1 47 VAL QG 2.183 . 2.779 2.127 2.083 2.146 . 0 0 "[ . 1 .]" 1
304 1 58 GLU HA 1 98 LYS QD 4.012 . 6.024 4.982 3.445 5.573 . 0 0 "[ . 1 .]" 1
305 1 58 GLU HA 1 98 LYS QB 2.638 . 3.508 3.099 2.686 3.288 . 0 0 "[ . 1 .]" 1
306 1 58 GLU HA 1 96 THR MG 3.799 . 5.603 4.584 4.347 4.857 . 0 0 "[ . 1 .]" 1
307 1 73 THR HA 1 73 THR HB 2.438 . 3.181 2.609 2.477 2.849 . 0 0 "[ . 1 .]" 1
308 1 73 THR HA 1 73 THR MG 2.327 . 3.004 2.237 2.138 2.327 . 0 0 "[ . 1 .]" 1
309 1 71 THR MG 1 73 THR HA 3.733 . 5.475 3.581 3.129 3.866 . 0 0 "[ . 1 .]" 1
310 1 73 THR HA 1 74 ILE MG 3.456 . 4.949 3.568 3.304 3.806 . 0 0 "[ . 1 .]" 1
311 1 63 GLU HA 1 73 THR HA 2.757 . 3.707 2.822 2.427 3.294 . 0 0 "[ . 1 .]" 1
312 1 105 THR HA 1 106 PRO HD3 1.917 . 2.376 1.843 1.789 1.880 . 0 0 "[ . 1 .]" 1
313 1 105 THR HA 1 106 PRO HD2 2.718 . 3.642 2.680 2.601 2.787 . 0 0 "[ . 1 .]" 1
314 1 105 THR HA 1 106 PRO HG3 3.943 . 5.886 4.004 3.906 4.064 . 0 0 "[ . 1 .]" 1
315 1 80 VAL HA 1 80 VAL QG 2.978 . 3.942 2.148 2.113 2.472 . 0 0 "[ . 1 .]" 1
316 1 92 PRO HA 1 93 ASP HB2 4.445 . 6.915 4.486 4.349 4.654 . 0 0 "[ . 1 .]" 1
317 1 53 VAL HA 1 54 GLU HB3 4.567 . 7.174 4.954 4.848 5.076 . 0 0 "[ . 1 .]" 1
318 1 53 VAL HA 1 53 VAL HB 2.675 . 3.570 2.487 2.438 2.902 . 0 0 "[ . 1 .]" 1
319 1 97 VAL HA 1 98 LYS QB 4.724 . 7.513 3.887 3.749 4.000 . 0 0 "[ . 1 .]" 1
320 1 92 PRO HA 1 92 PRO HB3 2.328 . 3.005 2.290 2.264 2.331 . 0 0 "[ . 1 .]" 1
321 1 69 GLN QB 1 92 PRO HA 2.628 . 3.491 3.324 2.856 3.513 0.022 4 0 "[ . 1 .]" 1
322 1 66 ILE MD 1 92 PRO HA 3.636 . 5.288 4.622 3.905 5.268 . 0 0 "[ . 1 .]" 1
323 1 65 THR HA 1 71 THR HA 2.739 . 3.677 2.640 2.522 2.813 . 0 0 "[ . 1 .]" 1
324 1 94 PRO HA 1 94 PRO HB3 2.617 . 3.473 2.281 2.245 2.302 . 0 0 "[ . 1 .]" 1
325 1 52 THR HA 1 53 VAL QG 4.642 . 7.335 4.335 4.247 4.853 . 0 0 "[ . 1 .]" 1
326 1 94 PRO HB3 1 112 SER HB3 4.757 . 7.586 3.866 2.315 5.305 . 0 0 "[ . 1 .]" 1
327 1 118 VAL HA 1 118 VAL HB 2.351 . 3.042 2.736 2.410 3.027 . 0 0 "[ . 1 .]" 1
328 1 112 SER HA 1 112 SER HB3 2.909 . 3.967 2.477 2.375 3.028 . 0 0 "[ . 1 .]" 1
329 1 112 SER HA 1 112 SER HB2 2.756 . 3.705 2.844 2.516 3.040 . 0 0 "[ . 1 .]" 1
330 1 67 PRO HA 1 67 PRO HG3 3.151 . 4.392 2.921 2.851 2.979 . 0 0 "[ . 1 .]" 1
331 1 67 PRO HA 1 67 PRO HB3 2.441 . 3.186 2.307 2.300 2.322 . 0 0 "[ . 1 .]" 1
332 1 65 THR MG 1 67 PRO HA 3.283 . 4.630 3.708 3.354 4.056 . 0 0 "[ . 1 .]" 1
333 1 94 PRO HB3 1 112 SER HB2 4.303 . 6.617 4.647 3.442 6.301 . 0 0 "[ . 1 .]" 1
334 1 76 PRO HA 1 76 PRO HD3 2.935 . 4.012 3.677 3.428 3.801 . 0 0 "[ . 1 .]" 1
335 1 55 PRO HD2 1 76 PRO HA 3.511 . 5.052 5.055 4.413 5.137 0.085 7 0 "[ . 1 .]" 1
336 1 76 PRO HA 1 76 PRO HB3 2.372 . 3.075 2.278 2.265 2.289 . 0 0 "[ . 1 .]" 1
337 1 55 PRO HG2 1 76 PRO HA 3.914 . 5.829 4.622 4.080 5.350 . 0 0 "[ . 1 .]" 1
338 1 105 THR HB 1 106 PRO HD2 4.720 . 7.504 4.729 4.188 4.946 . 0 0 "[ . 1 .]" 1
339 1 100 VAL MG1 1 104 GLY HA3 3.960 . 5.920 4.351 4.143 4.529 . 0 0 "[ . 1 .]" 1
340 1 100 VAL MG1 1 104 GLY HA2 2.996 . 4.118 3.492 3.271 3.674 . 0 0 "[ . 1 .]" 1
341 1 102 LYS HB2 1 102 LYS HG3 2.534 . 3.337 2.430 2.392 2.462 . 0 0 "[ . 1 .]" 1
342 1 58 GLU HA 1 58 GLU HB2 2.546 . 3.356 2.494 2.407 2.627 . 0 0 "[ . 1 .]" 1
343 1 76 PRO HD2 1 79 THR MG 3.819 . 5.642 5.615 5.459 5.687 0.045 8 0 "[ . 1 .]" 1
344 1 100 VAL MG1 1 106 PRO HD3 3.673 . 5.360 3.350 3.013 3.840 . 0 0 "[ . 1 .]" 1
345 1 45 PRO HB3 1 46 LEU QD 4.229 . 6.464 4.282 3.329 4.792 . 0 0 "[ . 1 .]" 1
346 1 48 PRO HD3 1 102 LYS HB3 6.575 . 11.978 7.988 7.072 8.834 . 0 0 "[ . 1 .]" 1
347 1 50 ASP HB3 1 102 LYS HB3 6.251 . 11.135 5.583 5.388 5.985 . 0 0 "[ . 1 .]" 1
348 1 105 THR MG 1 106 PRO HB2 3.720 . 5.450 4.609 4.326 5.041 . 0 0 "[ . 1 .]" 1
349 1 50 ASP HA 1 53 VAL QG 5.002 . 8.129 3.863 3.718 4.336 . 0 0 "[ . 1 .]" 1
350 1 71 THR MG 1 72 TYR HB2 4.433 . 6.890 4.431 4.154 4.648 . 0 0 "[ . 1 .]" 1
351 1 56 THR HA 1 56 THR HB 2.430 . 3.168 2.554 2.507 2.609 . 0 0 "[ . 1 .]" 1
352 1 56 THR HA 1 74 ILE MG 2.521 . 3.316 2.791 2.380 3.401 0.085 15 0 "[ . 1 .]" 1
353 1 96 THR MG 1 110 THR HA 3.771 . 5.548 3.065 2.698 3.477 . 0 0 "[ . 1 .]" 1
354 1 96 THR MG 1 98 LYS HA 4.258 . 6.525 4.139 3.660 4.358 . 0 0 "[ . 1 .]" 1
355 1 46 LEU QB 1 47 VAL QG 2.892 . 3.937 2.791 2.410 3.627 . 0 0 "[ . 1 .]" 1
356 1 44 ASP HB2 1 107 VAL MG1 2.873 . 3.905 3.237 2.321 3.578 . 0 0 "[ . 1 .]" 1
357 1 100 VAL HA 1 107 VAL MG1 3.507 . 5.044 4.587 4.074 5.610 0.566 10 1 "[ . + .]" 1
358 1 50 ASP HB3 1 100 VAL MG2 3.288 . 4.640 4.095 3.635 4.460 . 0 0 "[ . 1 .]" 1
359 1 99 ARG HA 1 100 VAL MG2 3.778 . 5.562 3.827 3.738 3.956 . 0 0 "[ . 1 .]" 1
360 1 116 THR HB 1 117 LYS HB2 4.383 . 6.784 5.953 5.182 7.078 0.294 9 0 "[ . 1 .]" 1
361 1 100 VAL MG1 1 106 PRO HB3 2.408 . 3.133 2.651 2.315 3.139 0.006 13 0 "[ . 1 .]" 1
362 1 72 TYR HB3 1 95 VAL QG 4.183 . 6.370 5.269 4.739 5.731 . 0 0 "[ . 1 .]" 1
363 1 46 LEU QD 1 48 PRO HD2 5.501 . 9.283 5.810 4.776 6.685 . 0 0 "[ . 1 .]" 1
364 1 46 LEU QD 1 48 PRO HD3 4.382 . 6.783 5.026 4.104 5.935 . 0 0 "[ . 1 .]" 1
365 1 100 VAL MG1 1 106 PRO HA 3.418 . 4.878 2.473 2.245 2.600 . 0 0 "[ . 1 .]" 1
366 1 98 LYS QD 1 106 PRO HA 4.895 . 7.890 4.031 3.131 5.089 . 0 0 "[ . 1 .]" 1
367 1 62 LYS QE 1 74 ILE MG 4.738 . 7.544 3.552 3.339 4.010 . 0 0 "[ . 1 .]" 1
368 1 56 THR HA 1 62 LYS QE 3.718 . 5.446 3.604 2.620 4.226 . 0 0 "[ . 1 .]" 1
369 1 62 LYS HA 1 62 LYS QE 4.943 . 7.997 3.959 3.747 4.143 . 0 0 "[ . 1 .]" 1
370 1 66 ILE HG13 1 67 PRO HD2 5.209 . 8.600 5.027 4.379 5.625 . 0 0 "[ . 1 .]" 1
371 1 65 THR MG 1 67 PRO HG3 3.153 . 4.395 4.122 3.244 4.404 0.009 7 0 "[ . 1 .]" 1
372 1 55 PRO HG3 1 78 GLY HA3 5.215 . 8.614 4.310 3.432 5.482 . 0 0 "[ . 1 .]" 1
373 1 48 PRO HA 1 49 ILE HG13 6.687 . 12.277 5.475 5.391 5.569 . 0 0 "[ . 1 .]" 1
374 1 86 LYS HA 1 86 LYS HB3 2.561 . 3.381 2.591 2.379 3.020 . 0 0 "[ . 1 .]" 1
375 1 72 TYR QE 1 95 VAL QG 3.714 . 5.438 2.286 2.020 2.793 . 0 0 "[ . 1 .]" 1
376 1 74 ILE HG13 1 74 ILE MG 4.062 . 6.124 2.635 2.480 3.193 . 0 0 "[ . 1 .]" 1
377 1 49 ILE MD 1 101 ASP HA 4.007 . 6.014 2.664 2.160 3.206 . 0 0 "[ . 1 .]" 1
378 1 48 PRO HA 1 49 ILE MD 5.335 . 8.893 4.332 4.049 4.802 . 0 0 "[ . 1 .]" 1
379 1 47 VAL QG 1 102 LYS HA 4.131 . 6.264 4.695 4.266 5.188 . 0 0 "[ . 1 .]" 1
380 1 72 TYR HB2 1 82 PHE HA 3.458 . 4.953 4.530 3.989 5.010 0.057 1 0 "[ . 1 .]" 1
381 1 85 ASP QB 1 88 PHE QD 5.171 . 8.513 3.789 2.545 4.791 . 0 0 "[ . 1 .]" 1
382 1 72 TYR HA 1 73 THR MG 4.836 . 7.759 4.044 3.575 4.732 . 0 0 "[ . 1 .]" 1
383 1 71 THR MG 1 72 TYR HA 3.536 . 5.099 3.574 3.469 3.688 . 0 0 "[ . 1 .]" 1
384 1 56 THR HB 1 74 ILE MG 4.688 . 7.435 4.856 4.448 5.397 . 0 0 "[ . 1 .]" 1
385 1 88 PHE HA 1 89 VAL HA 5.468 . 9.205 4.403 4.341 4.479 . 0 0 "[ . 1 .]" 1
386 1 94 PRO HB2 1 112 SER HB3 5.588 . 9.491 5.320 3.874 6.772 . 0 0 "[ . 1 .]" 1
387 1 94 PRO HB2 1 112 SER HB2 5.271 . 8.744 6.164 5.024 7.708 . 0 0 "[ . 1 .]" 1
388 1 47 VAL HA 1 48 PRO HG2 5.040 . 8.215 4.329 3.968 4.621 . 0 0 "[ . 1 .]" 1
389 1 75 VAL HA 1 76 PRO HA 4.356 . 6.728 4.300 4.254 4.346 . 0 0 "[ . 1 .]" 1
390 1 76 PRO HA 1 76 PRO HD2 3.416 . 4.875 3.964 3.914 4.083 . 0 0 "[ . 1 .]" 1
391 1 94 PRO HB2 1 112 SER HA 3.653 . 5.321 4.141 3.165 5.355 0.034 11 0 "[ . 1 .]" 1
392 1 94 PRO HA 1 112 SER HA 4.504 . 7.040 2.529 1.950 3.298 0.018 5 0 "[ . 1 .]" 1
393 1 85 ASP QB 1 86 LYS HA 5.972 . 10.430 4.786 4.525 5.112 . 0 0 "[ . 1 .]" 1
394 1 58 GLU HA 1 96 THR HB 6.153 . 10.886 4.675 4.438 4.992 . 0 0 "[ . 1 .]" 1
395 1 49 ILE MG 1 50 ASP HB2 4.945 . 8.002 4.563 4.339 4.955 . 0 0 "[ . 1 .]" 1
396 1 50 ASP HB2 1 102 LYS HG3 2.649 . 3.526 2.684 2.044 3.339 . 0 0 "[ . 1 .]" 1
397 1 49 ILE HA 1 50 ASP HB2 5.405 . 9.056 4.426 4.328 4.570 . 0 0 "[ . 1 .]" 1
398 1 49 ILE HA 1 50 ASP HB3 5.353 . 8.935 4.719 4.552 4.839 . 0 0 "[ . 1 .]" 1
399 1 50 ASP HB2 1 101 ASP HA 4.502 . 7.035 3.912 3.584 4.385 . 0 0 "[ . 1 .]" 1
400 1 50 ASP HB3 1 101 ASP HA 4.207 . 6.419 3.903 3.247 4.246 . 0 0 "[ . 1 .]" 1
401 1 101 ASP HB3 1 105 THR HB 3.967 . 5.934 4.072 3.591 4.368 . 0 0 "[ . 1 .]" 1
402 1 72 TYR HB2 1 95 VAL QG 4.985 . 7.042 4.545 4.007 5.033 . 0 0 "[ . 1 .]" 1
403 1 48 PRO HD3 1 102 LYS HG2 7.475 . 14.460 7.801 7.038 8.495 . 0 0 "[ . 1 .]" 1
404 1 67 PRO HB2 1 68 GLY HA3 5.031 . 8.195 4.467 4.419 4.523 . 0 0 "[ . 1 .]" 1
405 1 67 PRO HB3 1 68 GLY HA2 4.486 . 7.001 5.394 5.288 5.463 . 0 0 "[ . 1 .]" 1
406 1 43 GLY HA2 1 49 ILE MD 4.494 . 7.018 3.549 2.600 6.710 . 0 0 "[ . 1 .]" 1
407 1 69 GLN QE 1 70 GLY HA3 5.891 . 10.229 5.652 5.298 6.002 . 0 0 "[ . 1 .]" 1
408 1 70 GLY HA2 1 83 THR MG 5.143 . 8.449 4.340 3.423 5.037 . 0 0 "[ . 1 .]" 1
409 1 70 GLY HA3 1 83 THR MG 4.648 . 7.348 3.944 3.498 4.325 . 0 0 "[ . 1 .]" 1
410 1 43 GLY HA2 1 44 ASP HB3 4.905 . 7.913 5.704 4.369 6.489 . 0 0 "[ . 1 .]" 1
411 1 43 GLY HA3 1 44 ASP HB3 5.386 . 9.012 5.656 4.753 6.626 . 0 0 "[ . 1 .]" 1
412 1 43 GLY HA2 1 44 ASP HB2 5.020 . 8.170 4.891 4.305 6.514 . 0 0 "[ . 1 .]" 1
413 1 43 GLY HA3 1 44 ASP HB2 6.772 . 12.505 5.042 4.142 6.232 . 0 0 "[ . 1 .]" 1
414 1 43 GLY HA3 1 44 ASP HA 4.465 . 6.957 4.510 4.286 4.790 . 0 0 "[ . 1 .]" 1
415 1 57 PHE QE 1 63 GLU QG 5.502 . 9.285 4.569 3.999 5.301 . 0 0 "[ . 1 .]" 1
416 1 63 GLU QG 1 64 LYS HA 4.387 . 6.792 3.723 2.975 5.497 . 0 0 "[ . 1 .]" 1
417 1 63 GLU QG 1 73 THR HB 4.172 . 6.348 4.725 2.762 5.429 . 0 0 "[ . 1 .]" 1
418 1 98 LYS QD 1 98 LYS HG3 2.587 . 3.391 2.322 2.156 2.445 . 0 0 "[ . 1 .]" 1
419 1 98 LYS QD 1 98 LYS HG2 2.585 . 3.420 2.224 2.151 2.446 . 0 0 "[ . 1 .]" 1
420 1 47 VAL QG 1 48 PRO HB2 4.736 . 7.539 4.894 4.287 5.293 . 0 0 "[ . 1 .]" 1
421 1 63 GLU QB 1 71 THR MG 2.525 . 3.322 3.404 3.030 3.492 0.170 8 0 "[ . 1 .]" 1
422 1 63 GLU QG 1 71 THR HA 6.943 . 12.969 4.559 4.027 5.705 . 0 0 "[ . 1 .]" 1
423 1 63 GLU QG 1 71 THR HB 5.121 . 8.399 4.757 4.408 5.246 . 0 0 "[ . 1 .]" 1
424 1 64 LYS HA 1 64 LYS HG2 4.670 . 7.396 3.085 2.198 3.905 . 0 0 "[ . 1 .]" 1
425 1 64 LYS HA 1 64 LYS HG3 3.523 . 5.074 3.299 2.892 3.645 . 0 0 "[ . 1 .]" 1
426 1 64 LYS HE3 1 64 LYS HG2 4.531 . 7.097 3.248 2.400 4.218 . 0 0 "[ . 1 .]" 1
427 1 64 LYS HE2 1 65 THR HA 3.918 . 5.837 5.430 4.547 5.977 0.140 10 0 "[ . 1 .]" 1
428 1 64 LYS HE3 1 65 THR HA 3.579 . 5.180 5.185 4.484 5.942 0.762 8 4 "[ -* * + 1 .]" 1
429 1 79 THR HA 1 79 THR HB 2.895 . 3.943 2.402 2.346 2.449 . 0 0 "[ . 1 .]" 1
430 1 82 PHE QE 1 109 ALA MB 3.592 . 5.205 3.986 3.474 4.422 . 0 0 "[ . 1 .]" 1
431 1 109 ALA MB 1 111 TYR QD 3.152 . 4.394 2.796 2.140 3.495 . 0 0 "[ . 1 .]" 1
432 1 109 ALA MB 1 111 TYR HB2 3.603 . 5.226 4.343 3.783 4.898 . 0 0 "[ . 1 .]" 1
433 1 82 PHE QE 1 107 VAL MG2 4.011 . 6.022 2.789 2.235 3.966 . 0 0 "[ . 1 .]" 1
434 1 82 PHE QD 1 107 VAL MG2 3.388 . 4.823 4.328 3.638 5.365 0.542 8 1 "[ . + 1 .]" 1
435 1 49 ILE MD 1 101 ASP HB3 2.952 . 4.041 2.095 1.887 2.474 . 0 0 "[ . 1 .]" 1
436 1 72 TYR QD 1 95 VAL QG 3.799 . 5.603 3.232 2.720 3.497 . 0 0 "[ . 1 .]" 1
437 1 95 VAL QG 1 110 THR HA 5.198 . 8.576 4.772 4.217 5.710 . 0 0 "[ . 1 .]" 1
438 1 95 VAL QG 1 111 TYR HA 5.022 . 8.175 4.645 4.262 5.168 . 0 0 "[ . 1 .]" 1
439 1 74 ILE MD 1 80 VAL HA 4.653 . 7.359 4.887 3.597 5.301 . 0 0 "[ . 1 .]" 1
440 1 74 ILE MD 1 80 VAL QG 4.794 . 7.667 3.155 1.754 3.969 0.167 6 0 "[ . 1 .]" 1
441 1 71 THR HA 1 72 TYR HB2 4.896 . 7.892 4.921 4.769 5.062 . 0 0 "[ . 1 .]" 1
442 1 64 LYS HG2 1 71 THR HA 5.130 . 8.419 6.432 5.419 7.262 . 0 0 "[ . 1 .]" 1
443 1 71 THR HB 1 83 THR HB 3.678 . 5.369 4.132 3.757 4.624 . 0 0 "[ . 1 .]" 1
444 1 62 LYS HD2 1 74 ILE MG 3.157 . 4.403 2.268 1.907 2.711 0.004 9 0 "[ . 1 .]" 1
445 1 62 LYS HD3 1 74 ILE MG 3.535 . 5.097 2.647 2.271 4.019 . 0 0 "[ . 1 .]" 1
446 1 66 ILE MG 1 69 GLN HA 6.026 . 10.566 4.672 4.310 5.249 . 0 0 "[ . 1 .]" 1
447 1 66 ILE MG 1 69 GLN QB 3.414 . 4.871 2.473 2.057 3.496 . 0 0 "[ . 1 .]" 1
448 1 69 GLN QB 1 69 GLN HG2 3.106 . 4.312 2.385 2.309 2.508 . 0 0 "[ . 1 .]" 1
449 1 75 VAL HA 1 76 PRO HB2 5.145 . 8.454 5.343 5.219 5.589 . 0 0 "[ . 1 .]" 1
450 1 54 GLU HB3 1 62 LYS QE 4.755 . 7.582 7.179 7.042 7.279 . 0 0 "[ . 1 .]" 1
451 1 66 ILE MG 1 93 ASP HB2 3.680 . 5.372 2.794 1.940 3.659 0.048 10 0 "[ . 1 .]" 1
452 1 66 ILE HG12 1 93 ASP HB3 3.765 . 5.537 3.334 2.136 4.943 . 0 0 "[ . 1 .]" 1
453 1 66 ILE HG12 1 93 ASP HB2 3.617 . 5.252 3.559 2.030 5.605 0.353 11 0 "[ . 1 .]" 1
454 1 92 PRO HA 1 93 ASP HB3 5.122 . 8.401 4.951 4.542 5.728 . 0 0 "[ . 1 .]" 1
455 1 48 PRO HA 1 48 PRO HD2 4.707 . 7.476 3.972 3.894 4.075 . 0 0 "[ . 1 .]" 1
456 1 48 PRO HD2 1 102 LYS HG3 4.106 . 6.214 4.936 4.102 5.675 . 0 0 "[ . 1 .]" 1
457 1 48 PRO HD3 1 102 LYS HG3 5.319 . 8.856 6.356 5.680 7.031 . 0 0 "[ . 1 .]" 1
458 1 92 PRO HA 1 92 PRO HD2 3.822 . 5.648 3.969 3.885 4.093 . 0 0 "[ . 1 .]" 1
459 1 46 LEU HA 1 48 PRO HD3 3.525 . 5.078 3.914 3.275 4.634 . 0 0 "[ . 1 .]" 1
460 1 88 PHE QD 1 92 PRO HD2 5.366 . 8.966 5.370 4.418 6.883 . 0 0 "[ . 1 .]" 1
461 1 88 PHE QD 1 92 PRO HD3 5.573 . 9.455 4.140 2.836 5.784 . 0 0 "[ . 1 .]" 1
462 1 51 GLU HB2 1 52 THR MG 2.866 . 3.893 3.232 3.009 3.494 . 0 0 "[ . 1 .]" 1
463 1 51 GLU HG2 1 79 THR MG 4.656 . 7.365 5.258 4.548 6.116 . 0 0 "[ . 1 .]" 1
464 1 80 VAL QG 1 82 PHE QE 4.015 . 6.030 2.025 1.820 2.335 0.180 2 0 "[ . 1 .]" 1
465 1 65 THR MG 1 67 PRO HD3 2.724 . 3.651 3.391 2.711 3.673 0.022 1 0 "[ . 1 .]" 1
466 1 95 VAL QG 1 96 THR MG 4.795 . 6.726 4.390 4.243 4.572 . 0 0 "[ . 1 .]" 1
467 1 80 VAL MG1 1 80 VAL MG2 2.173 . 2.763 2.081 2.068 2.090 . 0 0 "[ . 1 .]" 1
468 1 73 THR MG 1 74 ILE MG 4.535 . 7.105 4.753 4.325 5.093 . 0 0 "[ . 1 .]" 1
469 1 71 THR HB 1 73 THR MG 3.634 . 5.285 3.510 2.755 4.055 . 0 0 "[ . 1 .]" 1
470 1 85 ASP QB 1 88 PHE HA 4.478 . 6.778 4.374 2.334 5.820 . 0 0 "[ . 1 .]" 1
471 1 69 GLN HA 1 85 ASP QB 3.322 . 4.702 2.558 1.900 3.036 0.048 7 0 "[ . 1 .]" 1
472 1 108 THR HA 1 109 ALA MB 4.827 . 7.740 3.996 3.917 4.034 . 0 0 "[ . 1 .]" 1
473 1 57 PHE QE 1 73 THR MG 4.702 . 7.466 4.938 4.522 5.455 . 0 0 "[ . 1 .]" 1
474 1 57 PHE QE 1 73 THR HA 3.765 . 5.537 3.941 3.134 4.506 . 0 0 "[ . 1 .]" 1
475 1 80 VAL QG 1 97 VAL HB 3.994 . 5.988 5.208 4.459 5.808 . 0 0 "[ . 1 .]" 1
476 1 80 VAL QG 1 99 ARG HA 5.393 . 9.029 4.817 4.324 5.816 . 0 0 "[ . 1 .]" 1
477 1 49 ILE MG 1 99 ARG HA 4.005 . 6.010 5.010 4.395 6.128 0.118 3 0 "[ . 1 .]" 1
478 1 49 ILE MD 1 99 ARG HB3 10.295 . 23.542 5.321 4.414 5.794 . 0 0 "[ . 1 .]" 1
479 1 99 ARG HB2 1 99 ARG HG2 2.459 . 3.215 2.994 2.906 3.005 . 0 0 "[ . 1 .]" 1
480 1 49 ILE MD 1 99 ARG HG3 2.721 . 3.646 3.026 2.220 3.707 0.061 3 0 "[ . 1 .]" 1
481 1 49 ILE MG 1 99 ARG HG3 3.081 . 4.267 3.318 2.718 4.245 . 0 0 "[ . 1 .]" 1
482 1 69 GLN HA 1 88 PHE QD 4.198 . 6.401 3.087 2.095 3.965 . 0 0 "[ . 1 .]" 1
483 1 69 GLN HG3 1 88 PHE QD 4.501 . 7.033 3.542 2.399 5.514 . 0 0 "[ . 1 .]" 1
484 1 70 GLY HA3 1 85 ASP QB 3.727 . 5.463 3.686 3.042 4.391 . 0 0 "[ . 1 .]" 1
485 1 69 GLN HG3 1 85 ASP QB 5.351 . 8.931 4.550 2.595 5.773 . 0 0 "[ . 1 .]" 1
486 1 85 ASP QB 1 87 GLN HB3 4.994 . 8.111 6.168 5.179 6.954 . 0 0 "[ . 1 .]" 1
487 1 69 GLN HA 1 88 PHE HB2 3.994 . 5.988 3.439 2.345 6.660 0.672 11 1 "[ . 1+ .]" 1
488 1 74 ILE HA 1 74 ILE HB 2.969 . 4.071 2.389 2.314 2.446 . 0 0 "[ . 1 .]" 1
489 1 74 ILE HA 1 74 ILE MG 3.549 . 5.124 3.203 3.167 3.223 . 0 0 "[ . 1 .]" 1
490 1 74 ILE HA 1 74 ILE MD 5.192 . 8.562 3.391 2.303 3.875 . 0 0 "[ . 1 .]" 1
491 1 74 ILE HA 1 74 ILE HG12 2.904 . 3.958 2.625 2.402 3.916 . 0 0 "[ . 1 .]" 1
492 1 74 ILE HG12 1 74 ILE MG 4.077 . 6.155 3.052 2.203 3.183 . 0 0 "[ . 1 .]" 1
493 1 74 ILE HG12 1 80 VAL QG 2.721 . 3.646 2.330 1.927 3.362 . 0 0 "[ . 1 .]" 1
494 1 74 ILE HB 1 80 VAL QG 3.106 . 4.312 1.978 1.790 3.226 0.110 1 0 "[ . 1 .]" 1
495 1 74 ILE HA 1 80 VAL HA 3.515 . 5.059 2.465 2.145 3.463 . 0 0 "[ . 1 .]" 1
496 1 111 TYR HA 1 112 SER HB2 5.374 . 8.983 4.841 4.168 5.663 . 0 0 "[ . 1 .]" 1
497 1 64 LYS HE2 1 95 VAL QG 6.846 . 12.705 3.805 2.720 4.792 . 0 0 "[ . 1 .]" 1
498 1 64 LYS HE3 1 95 VAL QG 5.614 . 8.986 4.378 3.887 4.724 . 0 0 "[ . 1 .]" 1
499 1 62 LYS HG3 1 74 ILE MG 3.406 . 4.856 3.799 2.259 4.277 . 0 0 "[ . 1 .]" 1
500 1 62 LYS HG2 1 74 ILE MG 4.717 . 7.499 4.041 3.777 4.448 . 0 0 "[ . 1 .]" 1
501 1 74 ILE MD 1 74 ILE HG13 2.933 . 4.009 2.118 2.095 2.121 . 0 0 "[ . 1 .]" 1
502 1 66 ILE MD 1 72 TYR QD 4.778 . 7.632 5.260 3.925 6.846 . 0 0 "[ . 1 .]" 1
503 1 66 ILE HG13 1 72 TYR QD 5.794 . 9.990 6.134 5.471 7.131 . 0 0 "[ . 1 .]" 1
504 1 66 ILE HA 1 72 TYR QD 4.950 . 8.013 8.011 7.773 8.080 0.067 9 0 "[ . 1 .]" 1
505 1 66 ILE HA 1 66 ILE MD 3.730 . 5.469 3.360 2.098 3.925 . 0 0 "[ . 1 .]" 1
506 1 66 ILE HB 1 67 PRO HD2 4.342 . 6.699 4.500 4.379 4.698 . 0 0 "[ . 1 .]" 1
507 1 66 ILE HG12 1 67 PRO HD2 4.387 . 6.793 4.517 4.015 5.323 . 0 0 "[ . 1 .]" 1
508 1 64 LYS HE2 1 66 ILE HG12 3.460 . 4.956 2.939 2.163 3.813 . 0 0 "[ . 1 .]" 1
509 1 64 LYS HE2 1 66 ILE HG13 3.020 . 4.160 2.987 2.187 4.392 0.232 3 0 "[ . 1 .]" 1
510 1 66 ILE MG 1 93 ASP HB3 4.250 . 6.508 3.339 2.016 4.076 . 0 0 "[ . 1 .]" 1
511 1 66 ILE MG 1 67 PRO HG3 5.366 . 8.965 4.783 4.546 5.076 . 0 0 "[ . 1 .]" 1
512 1 66 ILE MG 1 69 GLN HG2 4.329 . 6.671 4.427 4.040 4.983 . 0 0 "[ . 1 .]" 1
513 1 66 ILE HG13 1 67 PRO HD3 5.418 . 9.087 4.978 4.208 5.790 . 0 0 "[ . 1 .]" 1
514 1 44 ASP HB2 1 49 ILE HG12 3.871 . 5.744 4.953 3.839 5.571 . 0 0 "[ . 1 .]" 1
515 1 66 ILE MD 1 95 VAL QG 4.411 . 6.843 3.259 2.107 4.989 . 0 0 "[ . 1 .]" 1
516 1 71 THR MG 1 73 THR MG 1.570 . 1.878 1.877 1.813 1.981 0.103 11 0 "[ . 1 .]" 1
517 1 70 GLY HA3 1 71 THR HB 5.443 . 9.147 5.159 5.003 5.367 . 0 0 "[ . 1 .]" 1
518 1 71 THR HA 1 72 TYR HA 5.004 . 8.134 4.383 4.364 4.404 . 0 0 "[ . 1 .]" 1
519 1 73 THR HB 1 74 ILE MG 5.153 . 8.472 4.884 4.722 5.135 . 0 0 "[ . 1 .]" 1
520 1 57 PHE HA 1 97 VAL HA 3.204 . 4.487 2.287 1.926 2.501 . 0 0 "[ . 1 .]" 1
521 1 57 PHE QE 1 95 VAL HB 4.633 . 7.316 6.660 5.905 7.340 0.024 5 0 "[ . 1 .]" 1
522 1 50 ASP HB3 1 53 VAL HB 3.086 . 4.276 4.082 1.893 4.352 0.076 15 0 "[ . 1 .]" 1
523 1 53 VAL QG 1 102 LYS HG2 5.587 . 9.489 4.455 4.156 4.952 . 0 0 "[ . 1 .]" 1
524 1 52 THR MG 1 53 VAL QG 3.530 . 5.088 4.478 4.345 4.920 . 0 0 "[ . 1 .]" 1
525 1 75 VAL HB 1 76 PRO HB2 6.103 . 10.759 5.049 4.769 5.572 . 0 0 "[ . 1 .]" 1
526 1 72 TYR HB3 1 82 PHE HA 4.190 . 6.384 2.812 2.230 3.306 . 0 0 "[ . 1 .]" 1
527 1 111 TYR QE 1 115 PHE HB2 3.937 . 5.874 5.145 4.256 5.926 0.052 2 0 "[ . 1 .]" 1
528 1 46 LEU HG 1 48 PRO HD2 5.522 . 9.334 7.798 6.865 8.198 . 0 0 "[ . 1 .]" 1
529 1 98 LYS QB 1 98 LYS HE3 3.525 . 5.078 3.311 2.001 3.747 . 0 0 "[ . 1 .]" 1
530 1 48 PRO HA 1 49 ILE HB 5.247 . 8.688 4.618 4.431 4.743 . 0 0 "[ . 1 .]" 1
531 1 49 ILE MG 1 51 GLU HB2 5.268 . 8.737 6.066 5.819 6.210 . 0 0 "[ . 1 .]" 1
532 1 49 ILE MG 1 51 GLU HB3 5.707 . 9.778 5.826 5.472 6.026 . 0 0 "[ . 1 .]" 1
533 1 50 ASP HA 1 51 GLU HB2 5.368 . 8.971 4.606 4.543 4.692 . 0 0 "[ . 1 .]" 1
534 1 99 ARG HA 1 99 ARG HD2 5.182 . 8.539 4.888 4.686 5.523 . 0 0 "[ . 1 .]" 1
535 1 49 ILE MG 1 99 ARG HD3 3.247 . 4.565 3.524 2.614 4.190 . 0 0 "[ . 1 .]" 1
536 1 76 PRO HB2 1 77 ASP QB 5.010 . 8.148 5.110 4.597 5.601 . 0 0 "[ . 1 .]" 1
537 1 49 ILE MG 1 50 ASP HA 4.153 . 6.309 4.059 3.912 4.188 . 0 0 "[ . 1 .]" 1
538 1 94 PRO HA 1 112 SER HB2 4.585 . 7.213 4.927 3.767 5.988 . 0 0 "[ . 1 .]" 1
539 1 66 ILE HG12 1 67 PRO HD3 4.945 . 8.002 4.679 4.236 5.272 . 0 0 "[ . 1 .]" 1
540 1 57 PHE HB2 1 95 VAL QG 4.430 . 6.883 4.192 3.417 4.775 . 0 0 "[ . 1 .]" 1
541 1 57 PHE HB3 1 95 VAL QG 4.342 . 6.699 3.109 2.570 3.548 . 0 0 "[ . 1 .]" 1
542 1 82 PHE HA 1 83 THR MG 5.241 . 8.674 5.537 5.450 5.568 . 0 0 "[ . 1 .]" 1
543 1 55 PRO HA 1 55 PRO HG2 3.965 . 5.930 4.060 4.035 4.116 . 0 0 "[ . 1 .]" 1
544 1 44 ASP HA 1 45 PRO HA 4.934 . 7.977 4.475 4.373 4.587 . 0 0 "[ . 1 .]" 1
545 1 45 PRO HA 1 46 LEU QD 3.617 . 5.252 4.255 3.414 4.763 . 0 0 "[ . 1 .]" 1
546 1 88 PHE HZ 1 92 PRO HA 3.311 . 4.681 4.360 3.432 4.709 0.028 11 0 "[ . 1 .]" 1
547 1 45 PRO HB3 1 46 LEU HG 6.148 . 10.873 6.063 4.720 7.223 . 0 0 "[ . 1 .]" 1
548 1 44 ASP HA 1 47 VAL QG 4.981 . 8.083 4.664 2.930 5.433 . 0 0 "[ . 1 .]" 1
549 1 47 VAL QG 1 105 THR HB 3.804 . 5.612 4.139 3.589 4.672 . 0 0 "[ . 1 .]" 1
550 1 47 VAL QG 1 49 ILE HA 3.952 . 5.904 4.308 4.065 4.949 . 0 0 "[ . 1 .]" 1
551 1 47 VAL QG 1 103 ASN HA 4.432 . 6.887 4.607 3.874 4.977 . 0 0 "[ . 1 .]" 1
552 1 56 THR HA 1 62 LYS HD3 4.239 . 6.486 3.198 2.902 3.907 . 0 0 "[ . 1 .]" 1
553 1 81 THR MG 1 82 PHE HA 4.133 . 6.268 4.302 4.080 4.987 . 0 0 "[ . 1 .]" 1
554 1 58 GLU HA 1 98 LYS HA 5.751 . 9.886 5.921 5.461 6.160 . 0 0 "[ . 1 .]" 1
555 1 56 THR HG1 1 58 GLU HA 5.090 . 8.329 5.198 4.386 6.070 . 0 0 "[ . 1 .]" 1
556 1 57 PHE HB2 1 58 GLU HA 4.887 . 7.872 5.373 5.224 5.494 . 0 0 "[ . 1 .]" 1
557 1 57 PHE HB3 1 58 GLU HA 4.950 . 8.013 5.031 4.894 5.127 . 0 0 "[ . 1 .]" 1
558 1 57 PHE HA 1 58 GLU HA 5.149 . 8.463 4.190 4.104 4.232 . 0 0 "[ . 1 .]" 1
559 1 95 VAL HB 1 95 VAL QG 3.806 . 5.617 1.893 1.890 1.896 0.105 2 0 "[ . 1 .]" 1
560 1 78 GLY HA3 1 79 THR MG 4.932 . 7.972 4.528 4.157 4.678 . 0 0 "[ . 1 .]" 1
561 1 57 PHE HB2 1 97 VAL HA 5.881 . 10.204 4.503 4.209 4.921 . 0 0 "[ . 1 .]" 1
562 1 57 PHE HB3 1 97 VAL HA 4.760 . 7.592 3.146 2.763 3.746 . 0 0 "[ . 1 .]" 1
563 1 92 PRO HA 1 92 PRO HG3 4.053 . 6.107 3.413 2.806 4.050 . 0 0 "[ . 1 .]" 1
564 1 49 ILE MG 1 99 ARG HD2 2.917 . 3.981 2.584 1.913 4.137 0.156 4 0 "[ . 1 .]" 1
565 1 49 ILE MG 1 50 ASP HB3 4.356 . 6.727 3.986 3.798 4.455 . 0 0 "[ . 1 .]" 1
566 1 94 PRO HA 1 95 VAL QG 4.211 . 6.428 3.830 3.660 4.089 . 0 0 "[ . 1 .]" 1
567 1 94 PRO HB2 1 95 VAL QG 5.883 . 10.210 4.959 4.825 5.185 . 0 0 "[ . 1 .]" 1
568 1 53 VAL H 1 53 VAL QG 2.388 . 3.101 1.951 1.852 2.857 . 0 0 "[ . 1 .]" 1
569 1 69 GLN QE 1 69 GLN HG3 3.308 . 4.257 2.686 2.175 3.301 . 0 0 "[ . 1 .]" 1
570 1 66 ILE MD 1 69 GLN QE 4.162 . 4.627 2.821 1.948 4.519 0.049 11 0 "[ . 1 .]" 1
571 1 66 ILE MG 1 69 GLN QE 4.223 . 5.071 3.915 3.352 4.484 . 0 0 "[ . 1 .]" 1
572 1 69 GLN QE 1 92 PRO HA 5.619 . 6.014 4.004 2.522 4.574 . 0 0 "[ . 1 .]" 1
573 1 69 GLN QE 1 69 GLN HG2 3.144 . 4.380 2.478 2.188 2.897 . 0 0 "[ . 1 .]" 1
574 1 44 ASP HB2 1 46 LEU H 4.070 . 6.140 4.684 4.160 5.414 . 0 0 "[ . 1 .]" 1
575 1 44 ASP HB3 1 46 LEU H 3.491 . 5.014 3.655 2.686 5.795 0.781 7 1 "[ . + 1 .]" 1
576 1 45 PRO HB3 1 46 LEU H 4.451 . 6.928 4.092 3.749 4.394 . 0 0 "[ . 1 .]" 1
577 1 46 LEU H 1 47 VAL HB 4.381 . 6.780 5.031 4.597 5.445 . 0 0 "[ . 1 .]" 1
578 1 46 LEU H 1 46 LEU QB . . 2.655 2.529 2.306 2.850 0.195 11 0 "[ . 1 .]" 1
579 1 46 LEU H 1 46 LEU QD . . 3.257 2.131 1.631 2.910 0.344 14 0 "[ . 1 .]" 1
580 1 44 ASP HA 1 46 LEU H 4.075 . 6.151 3.861 3.300 4.581 . 0 0 "[ . 1 .]" 1
581 1 47 VAL H 1 48 PRO HA 3.457 . 4.950 4.513 4.381 4.708 . 0 0 "[ . 1 .]" 1
582 1 47 VAL H 1 47 VAL HA 2.740 . 3.678 2.936 2.923 2.952 . 0 0 "[ . 1 .]" 1
583 1 47 VAL H 1 48 PRO HD2 3.929 . 5.859 4.372 4.088 4.647 . 0 0 "[ . 1 .]" 1
584 1 47 VAL H 1 48 PRO HD3 3.218 . 4.513 3.483 3.067 4.062 . 0 0 "[ . 1 .]" 1
585 1 44 ASP HB2 1 47 VAL H 3.354 . 4.760 3.518 2.483 4.242 . 0 0 "[ . 1 .]" 1
586 1 44 ASP HB3 1 47 VAL H 3.042 . 4.199 2.693 2.168 4.507 0.308 7 0 "[ . 1 .]" 1
587 1 47 VAL H 1 47 VAL HB 2.437 . 3.180 2.976 2.812 3.361 0.181 7 0 "[ . 1 .]" 1
588 1 47 VAL H 1 48 PRO HB3 3.986 . 5.972 6.058 5.719 6.475 0.503 10 1 "[ . + .]" 1
589 1 46 LEU QB 1 47 VAL H 3.414 . 4.401 3.293 2.586 3.928 . 0 0 "[ . 1 .]" 1
590 1 47 VAL H 1 47 VAL QG . . 3.143 2.532 2.226 2.705 . 0 0 "[ . 1 .]" 1
591 1 44 ASP HA 1 47 VAL H 3.880 . 5.762 4.208 3.751 4.476 . 0 0 "[ . 1 .]" 1
592 1 46 LEU H 1 47 VAL H 2.200 . 2.805 2.409 2.068 2.769 . 0 0 "[ . 1 .]" 1
593 1 48 PRO HA 1 49 ILE H 2.246 . 2.877 2.134 2.106 2.175 . 0 0 "[ . 1 .]" 1
594 1 49 ILE H 1 49 ILE HA 2.786 . 3.756 2.774 2.707 2.822 . 0 0 "[ . 1 .]" 1
595 1 48 PRO HD2 1 49 ILE H 4.811 . 7.705 5.537 5.449 5.679 . 0 0 "[ . 1 .]" 1
596 1 48 PRO HD3 1 49 ILE H 4.788 . 7.654 5.501 5.297 5.723 . 0 0 "[ . 1 .]" 1
597 1 44 ASP HB2 1 49 ILE H 3.854 . 5.711 5.491 3.934 5.809 0.098 3 0 "[ . 1 .]" 1
598 1 48 PRO HB2 1 49 ILE H 3.157 . 4.403 3.851 3.499 4.180 . 0 0 "[ . 1 .]" 1
599 1 48 PRO HB3 1 49 ILE H 3.268 . 4.603 3.703 3.325 4.015 . 0 0 "[ . 1 .]" 1
600 1 49 ILE H 1 49 ILE HB 2.377 . 3.083 2.571 2.442 2.687 . 0 0 "[ . 1 .]" 1
601 1 49 ILE H 1 49 ILE HG13 3.588 . 5.197 3.552 3.473 3.655 . 0 0 "[ . 1 .]" 1
602 1 49 ILE H 1 49 ILE HG12 2.152 . 2.731 2.034 1.901 2.199 . 0 0 "[ . 1 .]" 1
603 1 49 ILE H 1 49 ILE MG 3.500 . 5.031 3.758 3.729 3.769 . 0 0 "[ . 1 .]" 1
604 1 49 ILE H 1 49 ILE MD 3.356 . 4.764 3.036 2.838 3.316 . 0 0 "[ . 1 .]" 1
605 1 47 VAL H 1 49 ILE H 4.160 . 6.323 5.835 5.431 6.291 . 0 0 "[ . 1 .]" 1
606 1 49 ILE H 1 50 ASP H 4.261 . 6.530 4.558 4.442 4.617 . 0 0 "[ . 1 .]" 1
607 1 50 ASP H 1 102 LYS HA 4.471 . 6.970 4.086 3.866 4.582 . 0 0 "[ . 1 .]" 1
608 1 50 ASP H 1 101 ASP HB3 4.242 . 6.491 4.370 3.779 4.675 . 0 0 "[ . 1 .]" 1
609 1 50 ASP H 1 50 ASP HB3 2.735 . 3.670 2.570 2.445 2.671 . 0 0 "[ . 1 .]" 1
610 1 49 ILE HB 1 50 ASP H 3.849 . 5.701 4.104 3.878 4.364 . 0 0 "[ . 1 .]" 1
611 1 50 ASP H 1 50 ASP HB2 2.657 . 3.540 2.541 2.466 2.635 . 0 0 "[ . 1 .]" 1
612 1 50 ASP H 1 102 LYS HG3 3.634 . 5.285 3.409 3.154 3.866 . 0 0 "[ . 1 .]" 1
613 1 50 ASP H 1 53 VAL QG 3.072 . 4.252 3.114 2.918 3.431 . 0 0 "[ . 1 .]" 1
614 1 49 ILE MD 1 50 ASP H 3.983 . 5.966 3.611 3.405 3.737 . 0 0 "[ . 1 .]" 1
615 1 49 ILE HA 1 50 ASP H 2.357 . 3.051 2.164 2.112 2.247 . 0 0 "[ . 1 .]" 1
616 1 50 ASP H 1 101 ASP HB2 3.863 . 5.728 3.774 3.429 4.137 . 0 0 "[ . 1 .]" 1
617 1 49 ILE MG 1 50 ASP H 2.531 . 3.332 2.553 2.262 2.949 . 0 0 "[ . 1 .]" 1
618 1 50 ASP H 1 102 LYS H 3.130 . 4.355 3.242 2.957 3.450 . 0 0 "[ . 1 .]" 1
619 1 50 ASP H 1 101 ASP HA 2.342 . 3.028 2.195 1.875 2.495 . 0 0 "[ . 1 .]" 1
620 1 50 ASP H 1 51 GLU H 4.218 . 6.441 4.570 4.530 4.599 . 0 0 "[ . 1 .]" 1
621 1 50 ASP HA 1 51 GLU H 2.179 . 2.773 2.194 2.147 2.247 . 0 0 "[ . 1 .]" 1
622 1 51 GLU H 1 51 GLU HA 2.698 . 3.608 2.901 2.893 2.923 . 0 0 "[ . 1 .]" 1
623 1 50 ASP HB3 1 51 GLU H 3.726 . 5.462 3.988 3.819 4.132 . 0 0 "[ . 1 .]" 1
624 1 51 GLU H 1 51 GLU HG2 3.660 . 5.334 3.564 3.473 3.688 . 0 0 "[ . 1 .]" 1
625 1 51 GLU H 1 51 GLU HB3 3.582 . 5.186 3.626 3.609 3.663 . 0 0 "[ . 1 .]" 1
626 1 51 GLU H 1 51 GLU HG3 2.655 . 3.536 2.348 2.243 2.505 . 0 0 "[ . 1 .]" 1
627 1 51 GLU H 1 51 GLU HB2 2.533 . 3.335 2.496 2.435 2.562 . 0 0 "[ . 1 .]" 1
628 1 50 ASP HB2 1 51 GLU H 3.915 . 5.831 4.161 4.067 4.274 . 0 0 "[ . 1 .]" 1
629 1 51 GLU H 1 52 THR MG 3.126 . 4.348 3.766 3.634 3.908 . 0 0 "[ . 1 .]" 1
630 1 49 ILE MG 1 51 GLU H 3.532 . 5.092 4.720 4.574 4.888 . 0 0 "[ . 1 .]" 1
631 1 51 GLU H 1 53 VAL H 4.417 . 6.856 4.114 3.833 4.219 . 0 0 "[ . 1 .]" 1
632 1 51 GLU H 1 102 LYS HG2 4.223 . 6.452 5.086 4.593 5.607 . 0 0 "[ . 1 .]" 1
633 1 52 THR H 1 52 THR HA 2.612 . 3.465 2.942 2.930 2.952 . 0 0 "[ . 1 .]" 1
634 1 50 ASP HB3 1 52 THR H 3.105 . 4.310 3.636 3.416 3.761 . 0 0 "[ . 1 .]" 1
635 1 51 GLU HB3 1 52 THR H 4.006 . 6.012 4.300 4.208 4.388 . 0 0 "[ . 1 .]" 1
636 1 51 GLU HB2 1 52 THR H 3.346 . 4.745 3.511 3.356 3.616 . 0 0 "[ . 1 .]" 1
637 1 52 THR H 1 52 THR MG 2.168 . 2.755 2.752 2.593 2.828 0.073 7 0 "[ . 1 .]" 1
638 1 52 THR H 1 53 VAL QG 3.916 . 5.271 3.090 2.935 3.770 . 0 0 "[ . 1 .]" 1
639 1 50 ASP HA 1 52 THR H 3.486 . 5.005 3.825 3.696 3.932 . 0 0 "[ . 1 .]" 1
640 1 51 GLU HA 1 52 THR H 3.024 . 4.167 3.318 3.259 3.361 . 0 0 "[ . 1 .]" 1
641 1 51 GLU HG2 1 52 THR H 4.611 . 7.269 5.214 5.152 5.295 . 0 0 "[ . 1 .]" 1
642 1 51 GLU HG3 1 52 THR H 4.333 . 6.680 4.543 4.411 4.649 . 0 0 "[ . 1 .]" 1
643 1 52 THR H 1 53 VAL H 2.172 . 2.762 2.178 2.034 2.309 . 0 0 "[ . 1 .]" 1
644 1 51 GLU H 1 52 THR H 2.509 . 3.296 2.453 2.370 2.526 . 0 0 "[ . 1 .]" 1
645 1 52 THR HA 1 53 VAL H 3.215 . 4.507 3.269 3.150 3.384 . 0 0 "[ . 1 .]" 1
646 1 53 VAL H 1 53 VAL HA 2.796 . 3.773 2.919 2.895 2.949 . 0 0 "[ . 1 .]" 1
647 1 50 ASP HB3 1 53 VAL H 3.083 . 4.271 3.276 3.068 3.449 . 0 0 "[ . 1 .]" 1
648 1 52 THR MG 1 53 VAL H 3.814 . 5.633 4.230 4.133 4.310 . 0 0 "[ . 1 .]" 1
649 1 54 GLU H 1 54 GLU HA 2.767 . 3.724 2.910 2.852 2.924 . 0 0 "[ . 1 .]" 1
650 1 53 VAL HA 1 54 GLU H 2.223 . 2.841 2.643 2.448 2.706 . 0 0 "[ . 1 .]" 1
651 1 54 GLU H 1 55 PRO HD3 3.890 . 5.782 4.025 3.923 4.145 . 0 0 "[ . 1 .]" 1
652 1 54 GLU H 1 55 PRO HD2 4.214 . 6.434 5.211 5.136 5.297 . 0 0 "[ . 1 .]" 1
653 1 54 GLU H 1 54 GLU HB2 2.640 . 3.511 2.826 2.666 2.916 . 0 0 "[ . 1 .]" 1
654 1 53 VAL QG 1 54 GLU H 2.607 . 3.457 2.742 2.003 3.114 . 0 0 "[ . 1 .]" 1
655 1 53 VAL H 1 54 GLU H 4.257 . 6.522 4.488 4.434 4.563 . 0 0 "[ . 1 .]" 1
656 1 54 GLU H 1 54 GLU HB3 2.516 . 3.307 2.484 2.434 2.528 . 0 0 "[ . 1 .]" 1
657 1 55 PRO HA 1 56 THR H 2.520 . 3.314 2.215 2.185 2.244 . 0 0 "[ . 1 .]" 1
658 1 56 THR H 1 56 THR MG 3.271 . 4.608 3.275 3.178 3.450 . 0 0 "[ . 1 .]" 1
659 1 56 THR HA 1 57 PHE H 2.483 . 3.254 2.432 2.234 2.566 . 0 0 "[ . 1 .]" 1
660 1 56 THR HB 1 57 PHE H 2.202 . 2.808 2.361 2.047 2.847 0.039 6 0 "[ . 1 .]" 1
661 1 57 PHE H 1 57 PHE HB2 2.509 . 3.296 2.530 2.442 2.682 . 0 0 "[ . 1 .]" 1
662 1 57 PHE H 1 57 PHE HB3 3.482 . 4.997 3.662 3.611 3.721 . 0 0 "[ . 1 .]" 1
663 1 56 THR MG 1 57 PHE H 3.376 . 4.801 3.457 3.304 3.741 . 0 0 "[ . 1 .]" 1
664 1 57 PHE H 1 74 ILE MG 3.312 . 4.683 3.937 3.393 4.325 . 0 0 "[ . 1 .]" 1
665 1 56 THR H 1 57 PHE H 4.103 . 6.207 4.377 4.312 4.428 . 0 0 "[ . 1 .]" 1
666 1 57 PHE H 1 57 PHE QD 3.760 . 5.528 2.369 1.976 3.161 0.016 12 0 "[ . 1 .]" 1
667 1 57 PHE H 1 57 PHE HA 2.989 . 4.106 2.908 2.856 2.939 . 0 0 "[ . 1 .]" 1
668 1 56 THR HG1 1 57 PHE H 4.305 . 6.622 4.479 4.026 4.930 . 0 0 "[ . 1 .]" 1
669 1 59 ASP H 1 60 GLY HA2 4.801 . 7.683 4.913 4.735 5.080 . 0 0 "[ . 1 .]" 1
670 1 58 GLU HA 1 59 ASP H 3.507 . 5.044 3.502 3.397 3.556 . 0 0 "[ . 1 .]" 1
671 1 59 ASP H 1 60 GLY HA3 5.040 . 8.215 5.193 5.007 5.334 . 0 0 "[ . 1 .]" 1
672 1 57 PHE HB2 1 59 ASP H 3.696 . 5.404 3.513 3.185 3.827 . 0 0 "[ . 1 .]" 1
673 1 59 ASP H 1 59 ASP HB2 3.076 . 4.259 2.638 2.223 3.688 . 0 0 "[ . 1 .]" 1
674 1 57 PHE HB3 1 59 ASP H 3.100 . 4.301 3.227 2.883 3.553 . 0 0 "[ . 1 .]" 1
675 1 59 ASP H 1 59 ASP HB3 3.101 . 4.303 3.208 2.493 3.666 . 0 0 "[ . 1 .]" 1
676 1 59 ASP H 1 96 THR MG 4.668 . 7.391 5.607 5.138 6.061 . 0 0 "[ . 1 .]" 1
677 1 59 ASP HA 1 60 GLY H 3.222 . 4.520 3.222 3.074 3.369 . 0 0 "[ . 1 .]" 1
678 1 60 GLY H 1 60 GLY HA2 2.458 . 3.213 2.329 2.306 2.346 . 0 0 "[ . 1 .]" 1
679 1 56 THR HB 1 60 GLY H 3.550 . 5.126 3.990 3.635 4.363 . 0 0 "[ . 1 .]" 1
680 1 60 GLY H 1 61 SER QB 4.562 . 7.164 4.696 4.487 5.015 . 0 0 "[ . 1 .]" 1
681 1 60 GLY H 1 60 GLY HA3 2.894 . 3.941 2.899 2.869 2.917 . 0 0 "[ . 1 .]" 1
682 1 59 ASP HB3 1 60 GLY H 4.072 . 6.145 4.127 3.384 4.454 . 0 0 "[ . 1 .]" 1
683 1 60 GLY H 1 98 LYS QB 4.127 . 6.256 5.527 5.214 5.831 . 0 0 "[ . 1 .]" 1
684 1 56 THR MG 1 60 GLY H 3.912 . 5.825 5.135 4.747 5.456 . 0 0 "[ . 1 .]" 1
685 1 58 GLU HA 1 60 GLY H 3.372 . 4.794 3.627 3.377 3.786 . 0 0 "[ . 1 .]" 1
686 1 59 ASP HB2 1 60 GLY H 4.083 . 6.167 3.987 3.470 4.447 . 0 0 "[ . 1 .]" 1
687 1 57 PHE HB3 1 60 GLY H 4.382 . 6.782 4.376 3.953 4.647 . 0 0 "[ . 1 .]" 1
688 1 59 ASP H 1 60 GLY H 2.968 . 4.069 2.621 2.411 2.786 . 0 0 "[ . 1 .]" 1
689 1 56 THR HG1 1 60 GLY H 3.517 . 5.063 5.107 4.974 5.171 0.108 7 0 "[ . 1 .]" 1
690 1 57 PHE H 1 60 GLY H 3.876 . 5.754 4.016 3.758 4.313 . 0 0 "[ . 1 .]" 1
691 1 61 SER H 1 61 SER HA 2.747 . 3.691 2.924 2.869 2.952 . 0 0 "[ . 1 .]" 1
692 1 61 SER H 1 61 SER QB 2.511 . 3.299 2.733 2.492 3.032 . 0 0 "[ . 1 .]" 1
693 1 60 GLY HA3 1 61 SER H 3.134 . 4.362 3.466 3.381 3.514 . 0 0 "[ . 1 .]" 1
694 1 57 PHE HB2 1 61 SER H 2.490 . 3.265 2.122 1.902 2.477 . 0 0 "[ . 1 .]" 1
695 1 57 PHE HB3 1 61 SER H 3.807 . 5.619 3.607 3.272 4.084 . 0 0 "[ . 1 .]" 1
696 1 56 THR MG 1 61 SER H 3.886 . 5.774 4.975 4.526 5.280 . 0 0 "[ . 1 .]" 1
697 1 61 SER H 1 63 GLU H 4.814 . 7.711 5.807 5.393 6.298 . 0 0 "[ . 1 .]" 1
698 1 57 PHE H 1 61 SER H 3.214 . 4.505 3.101 2.768 3.413 . 0 0 "[ . 1 .]" 1
699 1 60 GLY HA2 1 61 SER H 2.605 . 3.453 2.992 2.924 3.106 . 0 0 "[ . 1 .]" 1
700 1 61 SER HA 1 62 LYS H 2.492 . 3.269 2.414 2.286 2.598 . 0 0 "[ . 1 .]" 1
701 1 61 SER QB 1 62 LYS H 2.379 . 3.086 2.460 2.058 2.677 . 0 0 "[ . 1 .]" 1
702 1 62 LYS H 1 62 LYS HB2 3.077 . 4.261 2.591 2.466 2.662 . 0 0 "[ . 1 .]" 1
703 1 62 LYS H 1 63 GLU QB 4.342 . 6.699 4.230 4.090 4.400 . 0 0 "[ . 1 .]" 1
704 1 62 LYS H 1 62 LYS HB3 2.832 . 3.835 3.722 3.340 3.791 . 0 0 "[ . 1 .]" 1
705 1 62 LYS H 1 62 LYS HG3 3.405 . 4.854 4.232 4.003 4.727 . 0 0 "[ . 1 .]" 1
706 1 62 LYS H 1 62 LYS HG2 3.353 . 4.758 3.064 2.768 4.697 . 0 0 "[ . 1 .]" 1
707 1 62 LYS H 1 74 ILE MG 4.391 . 6.801 4.423 4.356 4.542 . 0 0 "[ . 1 .]" 1
708 1 61 SER H 1 62 LYS H 4.503 . 7.037 4.557 4.482 4.619 . 0 0 "[ . 1 .]" 1
709 1 61 SER HA 1 63 GLU H 3.935 . 5.870 4.090 3.835 4.432 . 0 0 "[ . 1 .]" 1
710 1 61 SER QB 1 63 GLU H 2.587 . 3.424 2.871 2.446 3.360 . 0 0 "[ . 1 .]" 1
711 1 63 GLU H 1 63 GLU QB 2.400 . 3.120 2.740 2.463 2.867 . 0 0 "[ . 1 .]" 1
712 1 62 LYS HB3 1 63 GLU H 2.930 . 4.003 3.958 3.501 4.177 0.174 8 0 "[ . 1 .]" 1
713 1 63 GLU H 1 71 THR MG 3.923 . 5.847 5.731 5.492 5.883 0.036 11 0 "[ . 1 .]" 1
714 1 63 GLU H 1 74 ILE MG 3.781 . 5.568 4.343 3.997 4.471 . 0 0 "[ . 1 .]" 1
715 1 63 GLU H 1 63 GLU HA 2.535 . 3.338 2.888 2.847 2.945 . 0 0 "[ . 1 .]" 1
716 1 63 GLU H 1 73 THR HA 4.040 . 6.080 5.227 4.915 5.684 . 0 0 "[ . 1 .]" 1
717 1 63 GLU H 1 64 LYS H 3.518 . 5.065 4.128 3.702 4.392 . 0 0 "[ . 1 .]" 1
718 1 62 LYS H 1 63 GLU H 1.927 . 2.391 1.922 1.798 2.129 . 0 0 "[ . 1 .]" 1
719 1 64 LYS H 1 72 TYR HB3 3.626 . 5.269 5.070 4.859 5.280 0.011 10 0 "[ . 1 .]" 1
720 1 64 LYS H 1 72 TYR HB2 3.483 . 5.000 3.466 3.175 3.751 . 0 0 "[ . 1 .]" 1
721 1 63 GLU QB 1 64 LYS H 4.127 . 5.353 3.538 3.024 3.785 . 0 0 "[ . 1 .]" 1
722 1 64 LYS H 1 73 THR MG 3.900 . 5.801 4.179 3.636 4.830 . 0 0 "[ . 1 .]" 1
723 1 64 LYS H 1 71 THR MG 2.779 . 3.745 3.066 2.527 3.722 . 0 0 "[ . 1 .]" 1
724 1 64 LYS H 1 95 VAL QG 4.730 . 7.526 4.899 4.529 5.183 . 0 0 "[ . 1 .]" 1
725 1 57 PHE QE 1 64 LYS H 4.420 . 6.862 2.587 1.943 4.275 0.035 14 0 "[ . 1 .]" 1
726 1 57 PHE HZ 1 64 LYS H 3.790 . 5.585 3.444 2.987 4.736 . 0 0 "[ . 1 .]" 1
727 1 63 GLU HA 1 64 LYS H 2.415 . 3.144 2.149 2.092 2.197 . 0 0 "[ . 1 .]" 1
728 1 64 LYS H 1 73 THR HA 4.299 . 6.609 4.245 3.753 4.649 . 0 0 "[ . 1 .]" 1
729 1 64 LYS H 1 71 THR HA 4.600 . 7.245 4.136 3.864 4.616 . 0 0 "[ . 1 .]" 1
730 1 64 LYS HA 1 65 THR H 2.238 . 2.864 2.169 2.100 2.207 . 0 0 "[ . 1 .]" 1
731 1 97 VAL HA 1 98 LYS H 2.373 . 3.077 2.299 2.223 2.350 . 0 0 "[ . 1 .]" 1
732 1 65 THR H 1 65 THR HB 2.581 . 3.414 2.648 2.541 2.739 . 0 0 "[ . 1 .]" 1
733 1 58 GLU HA 1 98 LYS H 4.013 . 6.026 4.990 4.136 5.319 . 0 0 "[ . 1 .]" 1
734 1 98 LYS H 1 98 LYS QB 2.561 . 3.381 2.639 2.525 2.732 . 0 0 "[ . 1 .]" 1
735 1 97 VAL MG1 1 98 LYS H 2.277 . 2.925 2.470 2.147 2.885 . 0 0 "[ . 1 .]" 1
736 1 98 LYS H 1 99 ARG H 3.666 . 5.346 4.101 3.877 4.400 . 0 0 "[ . 1 .]" 1
737 1 56 THR H 1 98 LYS H 3.250 . 4.570 4.128 3.679 4.604 0.034 13 0 "[ . 1 .]" 1
738 1 57 PHE HA 1 98 LYS H 2.784 . 3.753 2.155 1.795 2.386 0.020 6 0 "[ . 1 .]" 1
739 1 98 LYS H 1 98 LYS HA 2.847 . 3.860 2.932 2.912 2.956 . 0 0 "[ . 1 .]" 1
740 1 64 LYS HG2 1 65 THR H 4.401 . 6.822 4.672 3.763 5.213 . 0 0 "[ . 1 .]" 1
741 1 65 THR HA 1 66 ILE H 2.228 . 2.849 2.103 2.064 2.139 . 0 0 "[ . 1 .]" 1
742 1 66 ILE H 1 66 ILE HA 2.750 . 3.695 2.940 2.931 2.948 . 0 0 "[ . 1 .]" 1
743 1 66 ILE H 1 67 PRO HD3 3.955 . 5.910 4.353 4.166 4.450 . 0 0 "[ . 1 .]" 1
744 1 66 ILE H 1 66 ILE HB 2.529 . 3.329 2.644 2.522 2.777 . 0 0 "[ . 1 .]" 1
745 1 66 ILE H 1 66 ILE HG13 2.698 . 3.608 3.254 2.672 4.308 0.700 9 2 "[ - . +1 .]" 1
746 1 65 THR MG 1 66 ILE H 2.350 . 3.040 2.817 2.451 3.052 0.012 1 0 "[ . 1 .]" 1
747 1 66 ILE H 1 66 ILE MG 3.454 . 4.945 3.844 3.784 3.897 . 0 0 "[ . 1 .]" 1
748 1 66 ILE H 1 71 THR HA 3.228 . 4.531 3.885 3.613 4.283 . 0 0 "[ . 1 .]" 1
749 1 66 ILE H 1 72 TYR H 4.376 . 6.770 5.516 5.269 5.767 . 0 0 "[ . 1 .]" 1
750 1 67 PRO HB3 1 68 GLY H 5.083 . 8.313 3.909 3.797 3.952 . 0 0 "[ . 1 .]" 1
751 1 69 GLN H 1 69 GLN HA 2.511 . 3.299 2.934 2.870 2.952 . 0 0 "[ . 1 .]" 1
752 1 68 GLY HA3 1 69 GLN H 2.496 . 3.275 3.154 2.996 3.243 . 0 0 "[ . 1 .]" 1
753 1 69 GLN H 1 70 GLY HA2 4.265 . 6.539 4.413 4.251 4.718 . 0 0 "[ . 1 .]" 1
754 1 67 PRO HB3 1 69 GLN H 4.654 . 7.362 5.435 5.330 5.530 . 0 0 "[ . 1 .]" 1
755 1 66 ILE HB 1 69 GLN H 3.188 . 4.458 3.603 3.312 3.774 . 0 0 "[ . 1 .]" 1
756 1 69 GLN H 1 69 GLN HG2 3.658 . 5.330 4.406 3.771 4.547 . 0 0 "[ . 1 .]" 1
757 1 69 GLN H 1 69 GLN QB 2.421 . 3.153 2.328 2.268 2.427 . 0 0 "[ . 1 .]" 1
758 1 66 ILE MG 1 69 GLN H 3.006 . 4.135 3.358 3.162 3.749 . 0 0 "[ . 1 .]" 1
759 1 66 ILE H 1 69 GLN H 3.759 . 5.525 4.176 3.907 4.404 . 0 0 "[ . 1 .]" 1
760 1 68 GLY H 1 69 GLN H 2.706 . 3.621 2.559 2.358 2.890 . 0 0 "[ . 1 .]" 1
761 1 69 GLN H 1 85 ASP H 4.575 . 7.191 5.942 5.180 6.693 . 0 0 "[ . 1 .]" 1
762 1 70 GLY H 1 92 PRO HA 5.157 . 8.482 7.188 6.547 7.487 . 0 0 "[ . 1 .]" 1
763 1 69 GLN HA 1 70 GLY H 3.191 . 4.464 3.490 3.463 3.510 . 0 0 "[ . 1 .]" 1
764 1 70 GLY H 1 70 GLY HA3 2.748 . 3.692 2.951 2.937 2.956 . 0 0 "[ . 1 .]" 1
765 1 70 GLY H 1 70 GLY HA2 2.544 . 3.353 2.489 2.402 2.576 . 0 0 "[ . 1 .]" 1
766 1 66 ILE HB 1 70 GLY H 3.176 . 4.437 3.868 3.472 4.482 0.045 11 0 "[ . 1 .]" 1
767 1 69 GLN HG2 1 70 GLY H 3.800 . 5.605 4.231 3.835 4.971 . 0 0 "[ . 1 .]" 1
768 1 69 GLN QB 1 70 GLY H 2.166 . 2.753 2.735 2.644 2.782 0.029 15 0 "[ . 1 .]" 1
769 1 66 ILE MG 1 70 GLY H 3.715 . 5.440 4.510 4.156 5.065 . 0 0 "[ . 1 .]" 1
770 1 66 ILE H 1 70 GLY H 2.922 . 3.990 3.349 3.157 3.603 . 0 0 "[ . 1 .]" 1
771 1 70 GLY H 1 85 ASP H 3.915 . 5.831 5.085 4.261 5.905 0.074 8 0 "[ . 1 .]" 1
772 1 71 THR HB 1 72 TYR H 3.938 . 5.877 4.044 3.900 4.272 . 0 0 "[ . 1 .]" 1
773 1 72 TYR H 1 72 TYR HB2 3.007 . 4.137 2.846 2.720 2.966 . 0 0 "[ . 1 .]" 1
774 1 64 LYS HB3 1 72 TYR H 3.240 . 4.552 3.779 3.017 4.863 0.311 3 0 "[ . 1 .]" 1
775 1 72 TYR H 1 73 THR MG 3.666 . 5.346 4.074 3.770 4.615 . 0 0 "[ . 1 .]" 1
776 1 71 THR MG 1 72 TYR H 2.424 . 3.158 2.518 2.273 2.932 . 0 0 "[ . 1 .]" 1
777 1 72 TYR H 1 95 VAL QG 4.275 . 6.559 5.131 4.689 5.489 . 0 0 "[ . 1 .]" 1
778 1 72 TYR H 1 72 TYR HB3 3.074 . 4.255 3.712 3.633 3.770 . 0 0 "[ . 1 .]" 1
779 1 63 GLU QB 1 72 TYR H 5.368 . 8.970 5.242 4.948 5.746 . 0 0 "[ . 1 .]" 1
780 1 64 LYS H 1 72 TYR H 2.952 . 4.041 2.829 2.571 3.382 . 0 0 "[ . 1 .]" 1
781 1 71 THR H 1 72 TYR H 4.213 . 6.432 4.210 4.103 4.344 . 0 0 "[ . 1 .]" 1
782 1 57 PHE QE 1 72 TYR H 4.874 . 7.843 3.845 3.282 4.866 . 0 0 "[ . 1 .]" 1
783 1 71 THR HA 1 72 TYR H 2.472 . 3.236 2.130 2.086 2.181 . 0 0 "[ . 1 .]" 1
784 1 72 TYR HA 1 73 THR H 3.336 . 4.727 2.203 2.165 2.242 . 0 0 "[ . 1 .]" 1
785 1 74 ILE H 1 74 ILE HG12 4.083 . 6.166 4.585 4.237 4.820 . 0 0 "[ . 1 .]" 1
786 1 74 ILE H 1 74 ILE MG 3.256 . 4.581 2.156 1.931 2.531 . 0 0 "[ . 1 .]" 1
787 1 73 THR HA 1 74 ILE H 3.500 . 5.031 2.151 2.120 2.269 . 0 0 "[ . 1 .]" 1
788 1 77 ASP H 1 77 ASP HA 2.739 . 3.677 2.851 2.825 2.891 . 0 0 "[ . 1 .]" 1
789 1 76 PRO HA 1 77 ASP H 3.244 . 4.560 3.365 3.332 3.404 . 0 0 "[ . 1 .]" 1
790 1 76 PRO HD3 1 77 ASP H 3.785 . 5.576 4.085 3.999 4.221 . 0 0 "[ . 1 .]" 1
791 1 77 ASP H 1 78 GLY HA3 4.714 . 7.492 5.153 5.042 5.202 . 0 0 "[ . 1 .]" 1
792 1 77 ASP H 1 77 ASP QB . . 2.842 2.350 2.226 2.456 . 0 0 "[ . 1 .]" 1
793 1 76 PRO HB3 1 77 ASP H 3.857 . 5.716 4.473 4.407 4.520 . 0 0 "[ . 1 .]" 1
794 1 76 PRO HB2 1 77 ASP H 2.830 . 3.831 3.567 3.361 3.866 0.035 2 0 "[ . 1 .]" 1
795 1 77 ASP H 1 79 THR MG 2.661 . 3.546 3.618 3.573 3.657 0.111 4 0 "[ . 1 .]" 1
796 1 77 ASP H 1 78 GLY H 2.502 . 3.285 2.474 2.345 2.530 . 0 0 "[ . 1 .]" 1
797 1 77 ASP H 1 79 THR H 3.492 . 5.017 3.646 3.516 3.832 . 0 0 "[ . 1 .]" 1
798 1 78 GLY H 1 78 GLY HA2 2.438 . 3.181 2.388 2.347 2.437 . 0 0 "[ . 1 .]" 1
799 1 76 PRO HA 1 78 GLY H 3.255 . 4.579 3.372 3.224 3.616 . 0 0 "[ . 1 .]" 1
800 1 78 GLY H 1 79 THR HA 4.458 . 6.942 4.845 4.747 4.963 . 0 0 "[ . 1 .]" 1
801 1 78 GLY H 1 79 THR HB 4.362 . 6.740 5.111 4.877 5.775 . 0 0 "[ . 1 .]" 1
802 1 55 PRO HD3 1 78 GLY H 4.249 . 6.505 5.976 5.387 6.440 . 0 0 "[ . 1 .]" 1
803 1 55 PRO HD2 1 78 GLY H 4.616 . 7.279 5.968 5.520 6.536 . 0 0 "[ . 1 .]" 1
804 1 78 GLY H 1 78 GLY HA3 2.709 . 3.626 2.938 2.917 2.951 . 0 0 "[ . 1 .]" 1
805 1 77 ASP QB 1 78 GLY H 4.239 . 4.977 3.072 2.927 3.246 . 0 0 "[ . 1 .]" 1
806 1 55 PRO HG2 1 78 GLY H 3.493 . 5.018 4.402 3.928 4.883 . 0 0 "[ . 1 .]" 1
807 1 74 ILE HG12 1 78 GLY H 3.631 . 5.279 4.476 4.081 5.522 0.243 6 0 "[ . 1 .]" 1
808 1 78 GLY H 1 79 THR MG 3.144 . 4.380 3.399 3.167 3.567 . 0 0 "[ . 1 .]" 1
809 1 74 ILE MD 1 78 GLY H 3.668 . 5.349 3.904 2.852 4.851 . 0 0 "[ . 1 .]" 1
810 1 78 GLY H 1 79 THR H 2.577 . 3.407 2.137 2.009 2.264 . 0 0 "[ . 1 .]" 1
811 1 78 GLY HA2 1 79 THR H 3.322 . 4.701 3.097 2.917 3.195 . 0 0 "[ . 1 .]" 1
812 1 79 THR H 1 79 THR HA 2.967 . 4.067 2.934 2.903 2.942 . 0 0 "[ . 1 .]" 1
813 1 79 THR H 1 79 THR HB 2.892 . 3.937 3.207 3.075 3.680 . 0 0 "[ . 1 .]" 1
814 1 55 PRO HD3 1 79 THR H 4.839 . 7.766 6.951 6.275 7.550 . 0 0 "[ . 1 .]" 1
815 1 78 GLY HA3 1 79 THR H 3.453 . 4.944 3.396 3.328 3.512 . 0 0 "[ . 1 .]" 1
816 1 77 ASP QB 1 79 THR H 3.333 . 4.722 3.027 2.846 3.515 . 0 0 "[ . 1 .]" 1
817 1 55 PRO HG3 1 79 THR H 4.221 . 6.449 5.224 4.380 5.814 . 0 0 "[ . 1 .]" 1
818 1 74 ILE HG12 1 79 THR H 3.504 . 5.039 4.227 3.180 5.725 0.686 6 1 "[ .+ 1 .]" 1
819 1 79 THR H 1 79 THR MG 2.166 . 2.752 2.021 1.907 2.305 . 0 0 "[ . 1 .]" 1
820 1 81 THR H 1 81 THR HB 2.897 . 3.946 3.183 2.503 3.459 . 0 0 "[ . 1 .]" 1
821 1 80 VAL HB 1 81 THR H 3.478 . 4.990 3.848 3.667 4.202 . 0 0 "[ . 1 .]" 1
822 1 80 VAL QG 1 81 THR H 2.528 . 3.327 2.378 2.139 2.719 . 0 0 "[ . 1 .]" 1
823 1 81 THR H 1 81 THR MG 2.653 . 3.533 2.517 2.040 3.826 0.293 2 0 "[ . 1 .]" 1
824 1 74 ILE MD 1 81 THR H 4.905 . 7.912 6.320 5.390 6.716 . 0 0 "[ . 1 .]" 1
825 1 74 ILE MG 1 81 THR H 4.625 . 7.299 5.401 4.665 5.924 . 0 0 "[ . 1 .]" 1
826 1 72 TYR HA 1 81 THR H 4.535 . 7.105 4.761 4.466 4.975 . 0 0 "[ . 1 .]" 1
827 1 74 ILE HA 1 81 THR H 3.635 . 5.286 3.837 3.476 4.512 . 0 0 "[ . 1 .]" 1
828 1 80 VAL HA 1 81 THR H 2.316 . 2.987 2.226 2.140 2.284 . 0 0 "[ . 1 .]" 1
829 1 83 THR H 1 83 THR HB 2.724 . 3.651 2.703 2.599 2.780 . 0 0 "[ . 1 .]" 1
830 1 72 TYR HB2 1 83 THR H 3.810 . 5.625 4.927 4.593 5.188 . 0 0 "[ . 1 .]" 1
831 1 83 THR H 1 83 THR MG 2.984 . 4.097 3.877 3.842 3.905 . 0 0 "[ . 1 .]" 1
832 1 71 THR H 1 83 THR H 3.461 . 4.958 4.541 4.230 4.828 . 0 0 "[ . 1 .]" 1
833 1 72 TYR HA 1 83 THR H 3.003 . 4.130 2.608 2.351 2.962 . 0 0 "[ . 1 .]" 1
834 1 82 PHE HA 1 83 THR H 2.429 . 3.166 2.235 2.188 2.290 . 0 0 "[ . 1 .]" 1
835 1 85 ASP HA 1 86 LYS H 3.406 . 4.856 2.209 2.114 2.695 . 0 0 "[ . 1 .]" 1
836 1 85 ASP HA 1 87 GLN H 3.587 . 5.196 3.579 3.045 4.329 . 0 0 "[ . 1 .]" 1
837 1 87 GLN H 1 87 GLN HA 2.687 . 3.589 2.936 2.891 2.952 . 0 0 "[ . 1 .]" 1
838 1 86 LYS HA 1 87 GLN H 3.001 . 4.127 3.337 3.053 3.571 . 0 0 "[ . 1 .]" 1
839 1 87 GLN H 1 88 PHE HB2 3.923 . 5.847 4.341 3.823 5.302 . 0 0 "[ . 1 .]" 1
840 1 87 GLN H 1 88 PHE HB3 4.165 . 6.334 4.457 3.978 4.940 . 0 0 "[ . 1 .]" 1
841 1 85 ASP QB 1 87 GLN H 3.131 . 4.357 3.615 3.202 4.196 . 0 0 "[ . 1 .]" 1
842 1 87 GLN H 1 87 GLN QG 3.005 . 4.133 2.645 1.959 2.934 . 0 0 "[ . 1 .]" 1
843 1 87 GLN H 1 87 GLN HB2 2.369 . 3.071 2.648 2.503 3.624 0.553 2 1 "[ + . 1 .]" 1
844 1 87 GLN H 1 87 GLN HB3 3.373 . 4.795 3.655 2.728 3.770 . 0 0 "[ . 1 .]" 1
845 1 87 GLN H 1 88 PHE H 2.690 . 3.594 2.331 2.049 2.714 . 0 0 "[ . 1 .]" 1
846 1 88 PHE H 1 88 PHE HB2 3.360 . 4.771 2.799 2.576 3.204 . 0 0 "[ . 1 .]" 1
847 1 88 PHE H 1 88 PHE HB3 3.743 . 5.494 2.519 2.036 3.572 . 0 0 "[ . 1 .]" 1
848 1 93 ASP H 1 93 ASP HA 2.831 . 3.833 2.876 2.772 2.949 . 0 0 "[ . 1 .]" 1
849 1 92 PRO HA 1 93 ASP H 2.467 . 3.228 2.225 2.122 2.414 . 0 0 "[ . 1 .]" 1
850 1 93 ASP H 1 94 PRO HD3 4.825 . 7.735 4.814 4.221 5.205 . 0 0 "[ . 1 .]" 1
851 1 93 ASP H 1 94 PRO HD2 4.040 . 6.080 4.875 4.605 5.184 . 0 0 "[ . 1 .]" 1
852 1 93 ASP H 1 93 ASP HB3 2.912 . 3.972 2.819 2.457 3.614 . 0 0 "[ . 1 .]" 1
853 1 93 ASP H 1 93 ASP HB2 2.624 . 3.485 2.594 2.204 3.097 . 0 0 "[ . 1 .]" 1
854 1 92 PRO HB3 1 93 ASP H 3.603 . 5.226 3.464 3.086 3.816 . 0 0 "[ . 1 .]" 1
855 1 66 ILE MD 1 93 ASP H 3.096 . 4.294 3.183 2.309 4.153 . 0 0 "[ . 1 .]" 1
856 1 66 ILE MG 1 93 ASP H 3.157 . 4.403 2.759 2.013 4.012 . 0 0 "[ . 1 .]" 1
857 1 69 GLN QE 1 93 ASP H 3.263 . 4.594 3.042 2.315 3.711 . 0 0 "[ . 1 .]" 1
858 1 95 VAL HA 1 96 THR H 2.153 . 2.733 2.235 2.133 2.384 . 0 0 "[ . 1 .]" 1
859 1 96 THR H 1 96 THR HB 2.481 . 3.250 2.683 2.525 2.919 . 0 0 "[ . 1 .]" 1
860 1 96 THR H 1 96 THR MG 3.469 . 4.973 3.872 3.805 3.971 . 0 0 "[ . 1 .]" 1
861 1 95 VAL QG 1 96 THR H . . 2.991 2.324 1.893 2.806 0.034 3 0 "[ . 1 .]" 1
862 1 96 THR H 1 97 VAL H 4.248 . 6.504 4.271 4.073 4.472 . 0 0 "[ . 1 .]" 1
863 1 96 THR HA 1 97 VAL H 2.728 . 3.658 2.124 2.083 2.167 . 0 0 "[ . 1 .]" 1
864 1 96 THR HB 1 97 VAL H 4.268 . 6.545 4.200 4.056 4.342 . 0 0 "[ . 1 .]" 1
865 1 97 VAL H 1 97 VAL HB 3.016 . 4.153 2.724 2.634 2.824 . 0 0 "[ . 1 .]" 1
866 1 96 THR MG 1 97 VAL H 2.920 . 3.986 2.785 2.564 3.106 . 0 0 "[ . 1 .]" 1
867 1 99 ARG H 1 107 VAL HB 4.164 . 6.331 5.281 5.099 5.546 . 0 0 "[ . 1 .]" 1
868 1 98 LYS QB 1 99 ARG H 4.098 . 6.198 3.817 3.508 3.968 . 0 0 "[ . 1 .]" 1
869 1 49 ILE MG 1 99 ARG H 4.528 . 7.091 5.794 5.323 6.547 . 0 0 "[ . 1 .]" 1
870 1 99 ARG H 1 108 THR HA 3.771 . 5.549 3.884 3.607 4.222 . 0 0 "[ . 1 .]" 1
871 1 98 LYS HA 1 99 ARG H 2.295 . 2.954 2.196 2.151 2.245 . 0 0 "[ . 1 .]" 1
872 1 99 ARG H 1 100 VAL HA 3.968 . 5.936 4.490 4.301 4.655 . 0 0 "[ . 1 .]" 1
873 1 99 ARG H 1 106 PRO HA 3.386 . 4.819 3.594 3.267 3.899 . 0 0 "[ . 1 .]" 1
874 1 99 ARG HA 1 100 VAL H 3.605 . 5.230 2.262 2.175 2.385 . 0 0 "[ . 1 .]" 1
875 1 100 VAL H 1 100 VAL MG2 3.536 . 5.099 2.034 1.977 2.123 . 0 0 "[ . 1 .]" 1
876 1 101 ASP H 1 101 ASP HB3 3.174 . 4.434 2.770 2.548 3.086 . 0 0 "[ . 1 .]" 1
877 1 101 ASP H 1 101 ASP HB2 3.587 . 5.196 3.664 3.636 3.700 . 0 0 "[ . 1 .]" 1
878 1 100 VAL HB 1 101 ASP H 2.865 . 3.891 2.697 2.421 2.934 . 0 0 "[ . 1 .]" 1
879 1 101 ASP H 1 105 THR MG 4.817 . 7.717 4.605 4.321 4.956 . 0 0 "[ . 1 .]" 1
880 1 49 ILE MD 1 101 ASP H 4.172 . 6.347 3.700 3.130 4.387 . 0 0 "[ . 1 .]" 1
881 1 100 VAL HA 1 101 ASP H 2.449 . 3.198 2.257 2.173 2.339 . 0 0 "[ . 1 .]" 1
882 1 101 ASP H 1 107 VAL H 4.436 . 6.895 4.127 3.719 4.385 . 0 0 "[ . 1 .]" 1
883 1 102 LYS H 1 102 LYS HA 2.880 . 3.917 2.804 2.765 2.825 . 0 0 "[ . 1 .]" 1
884 1 49 ILE HA 1 102 LYS H 3.511 . 5.052 3.449 2.933 3.728 . 0 0 "[ . 1 .]" 1
885 1 101 ASP HB3 1 102 LYS H 3.735 . 5.479 3.481 3.403 3.622 . 0 0 "[ . 1 .]" 1
886 1 101 ASP HB2 1 102 LYS H 2.176 . 2.768 1.943 1.837 2.178 . 0 0 "[ . 1 .]" 1
887 1 102 LYS H 1 102 LYS HB3 3.629 . 5.275 3.584 3.568 3.598 . 0 0 "[ . 1 .]" 1
888 1 50 ASP HB2 1 102 LYS H 3.114 . 4.326 3.364 3.039 3.709 . 0 0 "[ . 1 .]" 1
889 1 102 LYS H 1 102 LYS HB2 2.670 . 3.561 2.447 2.352 2.560 . 0 0 "[ . 1 .]" 1
890 1 102 LYS H 1 102 LYS HG3 2.399 . 3.118 2.294 2.035 2.566 . 0 0 "[ . 1 .]" 1
891 1 102 LYS H 1 102 LYS HG2 3.754 . 5.515 3.454 3.237 3.641 . 0 0 "[ . 1 .]" 1
892 1 47 VAL QG 1 102 LYS H 2.595 . 3.437 2.753 2.361 3.361 . 0 0 "[ . 1 .]" 1
893 1 49 ILE MD 1 102 LYS H 5.068 . 8.279 4.147 3.962 4.376 . 0 0 "[ . 1 .]" 1
894 1 56 THR HG1 1 61 SER H 4.322 . 6.657 6.011 5.692 6.283 . 0 0 "[ . 1 .]" 1
895 1 101 ASP HA 1 102 LYS H 2.927 . 3.998 2.747 2.723 2.768 . 0 0 "[ . 1 .]" 1
896 1 102 LYS HA 1 103 ASN H 3.313 . 4.685 3.520 3.445 3.586 . 0 0 "[ . 1 .]" 1
897 1 103 ASN H 1 104 GLY HA3 4.538 . 7.112 5.051 4.916 5.187 . 0 0 "[ . 1 .]" 1
898 1 101 ASP HB2 1 103 ASN H 3.133 . 4.360 3.395 3.100 3.778 . 0 0 "[ . 1 .]" 1
899 1 102 LYS HB3 1 103 ASN H 3.880 . 5.761 3.772 3.596 3.991 . 0 0 "[ . 1 .]" 1
900 1 50 ASP HB2 1 103 ASN H 4.401 . 6.822 5.311 4.986 5.600 . 0 0 "[ . 1 .]" 1
901 1 102 LYS HB2 1 103 ASN H 2.750 . 3.696 2.868 2.599 3.149 . 0 0 "[ . 1 .]" 1
902 1 47 VAL QG 1 103 ASN H 2.235 . 2.859 2.818 2.262 3.011 0.152 4 0 "[ . 1 .]" 1
903 1 103 ASN H 1 103 ASN HD21 4.746 . 7.561 2.947 2.156 3.904 . 0 0 "[ . 1 .]" 1
904 1 103 ASN H 1 103 ASN HD22 3.253 . 4.576 3.923 3.246 4.519 . 0 0 "[ . 1 .]" 1
905 1 103 ASN H 1 103 ASN HA 2.946 . 4.031 2.894 2.857 2.917 . 0 0 "[ . 1 .]" 1
906 1 101 ASP HA 1 103 ASN H 3.867 . 5.736 4.580 4.379 4.739 . 0 0 "[ . 1 .]" 1
907 1 47 VAL QG 1 103 ASN HD21 3.391 . 3.643 2.170 1.731 2.796 0.223 2 0 "[ . 1 .]" 1
908 1 103 ASN HA 1 103 ASN HD21 4.743 . 7.555 4.064 2.357 4.491 . 0 0 "[ . 1 .]" 1
909 1 47 VAL QG 1 103 ASN HD22 2.649 . 3.526 2.433 1.928 3.173 . 0 0 "[ . 1 .]" 1
910 1 104 GLY H 1 104 GLY HA2 2.369 . 3.071 2.409 2.339 2.483 . 0 0 "[ . 1 .]" 1
911 1 102 LYS HA 1 104 GLY H 3.204 . 4.487 4.067 3.697 4.451 . 0 0 "[ . 1 .]" 1
912 1 104 GLY H 1 106 PRO HD2 5.503 . 9.289 7.270 7.068 7.559 . 0 0 "[ . 1 .]" 1
913 1 104 GLY H 1 104 GLY HA3 2.809 . 3.795 2.941 2.909 2.960 . 0 0 "[ . 1 .]" 1
914 1 102 LYS HB3 1 104 GLY H 4.319 . 6.650 5.361 5.153 5.535 . 0 0 "[ . 1 .]" 1
915 1 102 LYS HB2 1 104 GLY H 4.158 . 6.319 4.900 4.708 5.088 . 0 0 "[ . 1 .]" 1
916 1 100 VAL MG2 1 104 GLY H 3.486 . 5.005 4.466 4.249 4.688 . 0 0 "[ . 1 .]" 1
917 1 103 ASN HA 1 104 GLY H 3.002 . 4.129 3.421 3.322 3.484 . 0 0 "[ . 1 .]" 1
918 1 105 THR H 1 105 THR HA 2.748 . 3.692 2.892 2.869 2.915 . 0 0 "[ . 1 .]" 1
919 1 104 GLY HA3 1 105 THR H 3.403 . 4.851 3.391 3.333 3.448 . 0 0 "[ . 1 .]" 1
920 1 101 ASP HB2 1 105 THR H 3.789 . 5.583 4.713 4.474 4.978 . 0 0 "[ . 1 .]" 1
921 1 100 VAL HB 1 105 THR H 3.646 . 5.307 3.809 3.556 3.963 . 0 0 "[ . 1 .]" 1
922 1 105 THR H 1 105 THR MG 3.534 . 5.095 3.773 3.715 3.810 . 0 0 "[ . 1 .]" 1
923 1 105 THR H 1 106 PRO HD2 4.792 . 7.663 5.360 5.305 5.447 . 0 0 "[ . 1 .]" 1
924 1 105 THR H 1 106 PRO HG3 4.546 . 7.129 5.955 5.789 6.262 . 0 0 "[ . 1 .]" 1
925 1 100 VAL H 1 105 THR H 4.559 . 7.157 6.989 6.845 7.162 0.005 12 0 "[ . 1 .]" 1
926 1 103 ASN HD22 1 105 THR H 4.570 . 7.181 5.437 2.555 6.594 . 0 0 "[ . 1 .]" 1
927 1 100 VAL HA 1 105 THR H 4.028 . 6.056 4.438 4.273 4.611 . 0 0 "[ . 1 .]" 1
928 1 103 ASN HA 1 105 THR H 4.122 . 6.246 4.754 4.508 4.978 . 0 0 "[ . 1 .]" 1
929 1 105 THR H 1 106 PRO HD3 3.772 . 5.551 4.369 4.276 4.530 . 0 0 "[ . 1 .]" 1
930 1 107 VAL H 1 107 VAL HA 2.774 . 3.736 2.882 2.873 2.913 . 0 0 "[ . 1 .]" 1
931 1 106 PRO HD2 1 107 VAL H 4.045 . 6.090 5.036 4.855 5.237 . 0 0 "[ . 1 .]" 1
932 1 106 PRO HB3 1 107 VAL H 3.589 . 5.199 4.155 3.874 4.302 . 0 0 "[ . 1 .]" 1
933 1 98 LYS QD 1 107 VAL H 4.381 . 6.780 5.428 4.529 6.457 . 0 0 "[ . 1 .]" 1
934 1 105 THR MG 1 107 VAL H 3.506 . 5.043 4.070 3.613 4.630 . 0 0 "[ . 1 .]" 1
935 1 107 VAL H 1 108 THR MG 3.424 . 4.889 3.980 3.870 4.113 . 0 0 "[ . 1 .]" 1
936 1 107 VAL H 1 107 VAL MG1 2.196 . 2.799 2.588 2.369 3.210 0.411 8 0 "[ . 1 .]" 1
937 1 49 ILE MD 1 107 VAL H 3.360 . 4.771 3.790 3.323 4.277 . 0 0 "[ . 1 .]" 1
938 1 98 LYS HA 1 107 VAL H 3.903 . 5.807 5.135 4.718 5.780 . 0 0 "[ . 1 .]" 1
939 1 106 PRO HA 1 107 VAL H 2.025 . 2.538 2.229 2.146 2.261 . 0 0 "[ . 1 .]" 1
940 1 107 VAL HA 1 108 THR H 2.755 . 3.704 2.093 2.055 2.140 . 0 0 "[ . 1 .]" 1
941 1 107 VAL HB 1 108 THR H 4.268 . 6.545 3.526 3.153 3.721 . 0 0 "[ . 1 .]" 1
942 1 108 THR H 1 108 THR MG 3.354 . 4.760 2.915 2.777 3.056 . 0 0 "[ . 1 .]" 1
943 1 107 VAL MG2 1 108 THR H 4.227 . 6.460 4.179 4.025 4.405 . 0 0 "[ . 1 .]" 1
944 1 107 VAL MG1 1 108 THR H 4.513 . 7.059 3.877 3.471 4.020 . 0 0 "[ . 1 .]" 1
945 1 108 THR HB 1 109 ALA H 2.718 . 3.641 2.493 2.017 2.875 . 0 0 "[ . 1 .]" 1
946 1 97 VAL HB 1 109 ALA H 3.249 . 4.568 2.741 2.134 3.176 . 0 0 "[ . 1 .]" 1
947 1 109 ALA H 1 109 ALA MB 2.744 . 3.685 2.539 2.478 2.697 . 0 0 "[ . 1 .]" 1
948 1 108 THR H 1 109 ALA H 4.538 . 7.112 4.425 4.373 4.452 . 0 0 "[ . 1 .]" 1
949 1 108 THR HA 1 109 ALA H 2.767 . 3.724 2.325 2.183 2.589 . 0 0 "[ . 1 .]" 1
950 1 98 LYS HA 1 109 ALA H 4.246 . 6.500 4.505 4.041 5.072 . 0 0 "[ . 1 .]" 1
951 1 97 VAL H 1 109 ALA H 2.954 . 4.045 2.456 2.168 2.624 . 0 0 "[ . 1 .]" 1
952 1 110 THR H 1 110 THR MG 3.982 . 5.964 3.356 2.646 3.884 . 0 0 "[ . 1 .]" 1
953 1 109 ALA MB 1 110 THR H 4.128 . 6.258 3.096 3.069 3.147 . 0 0 "[ . 1 .]" 1
954 1 109 ALA HA 1 110 THR H 3.435 . 4.910 2.165 2.134 2.204 . 0 0 "[ . 1 .]" 1
955 1 111 TYR HA 1 112 SER H 3.295 . 4.652 2.122 2.049 2.284 . 0 0 "[ . 1 .]" 1
956 1 112 SER H 1 112 SER HB2 3.484 . 5.001 3.181 2.497 3.909 . 0 0 "[ . 1 .]" 1
957 1 116 THR HB 1 117 LYS H 2.652 . 3.531 2.944 1.706 3.629 0.098 2 0 "[ . 1 .]" 1
958 1 117 LYS H 1 117 LYS HA 2.793 . 3.768 2.841 2.268 2.942 . 0 0 "[ . 1 .]" 1
959 1 116 THR MG 1 117 LYS H 4.133 . 6.269 3.286 1.873 3.963 0.124 1 0 "[ . 1 .]" 1
960 1 89 VAL QG 1 117 LYS H 3.679 . 5.371 3.900 3.082 4.421 . 0 0 "[ . 1 .]" 1
961 1 117 LYS HA 1 118 VAL H 2.211 . 2.822 2.467 2.107 2.786 . 0 0 "[ . 1 .]" 1
962 1 118 VAL H 1 118 VAL HB 2.701 . 3.613 3.120 2.563 3.699 0.086 2 0 "[ . 1 .]" 1
963 1 89 VAL QG 1 118 VAL H 3.014 . 4.150 3.209 1.741 4.082 0.137 4 0 "[ . 1 .]" 1
964 1 117 LYS H 1 118 VAL H 4.426 . 6.875 4.098 2.024 4.611 . 0 0 "[ . 1 .]" 1
965 1 64 LYS H 1 65 THR H 3.728 . 5.466 4.017 3.843 4.277 . 0 0 "[ . 1 .]" 1
966 1 99 ARG H 1 100 VAL H 4.296 . 6.603 4.280 4.134 4.391 . 0 0 "[ . 1 .]" 1
967 1 99 ARG H 1 106 PRO HB3 3.831 . 5.665 3.921 3.446 4.514 . 0 0 "[ . 1 .]" 1
968 1 103 ASN HD21 1 105 THR H 5.601 . 9.522 4.532 2.835 5.300 . 0 0 "[ . 1 .]" 1
969 1 44 ASP H 1 47 VAL H 4.486 . 7.002 4.878 4.103 5.648 . 0 0 "[ . 1 .]" 1
970 1 43 GLY HA2 1 44 ASP H 2.783 . 3.751 2.910 2.125 3.550 . 0 0 "[ . 1 .]" 1
971 1 44 ASP H 1 107 VAL MG2 3.888 . 5.777 3.953 3.327 4.637 . 0 0 "[ . 1 .]" 1
972 1 44 ASP H 1 107 VAL MG1 3.733 . 5.475 2.954 1.981 4.161 0.010 2 0 "[ . 1 .]" 1
973 1 63 GLU QG 1 64 LYS H 3.413 . 4.869 2.892 2.379 3.893 . 0 0 "[ . 1 .]" 1
974 1 43 GLY H 1 44 ASP H 2.795 . 3.772 3.455 1.983 3.909 0.137 11 0 "[ . 1 .]" 1
975 1 43 GLY H 1 43 GLY HA2 2.417 . 3.147 2.729 2.324 2.942 . 0 0 "[ . 1 .]" 1
976 1 43 GLY H 1 43 GLY HA3 2.787 . 3.758 2.804 2.436 2.951 . 0 0 "[ . 1 .]" 1
977 1 43 GLY H 1 107 VAL MG2 4.001 . 6.002 4.477 2.675 5.280 . 0 0 "[ . 1 .]" 1
978 1 43 GLY H 1 107 VAL MG1 3.712 . 5.434 3.993 1.984 5.013 0.006 5 0 "[ . 1 .]" 1
979 1 43 GLY H 1 44 ASP HB2 4.856 . 7.804 5.663 4.619 6.961 . 0 0 "[ . 1 .]" 1
980 1 43 GLY H 1 44 ASP HB3 5.553 . 9.408 6.175 4.931 6.809 . 0 0 "[ . 1 .]" 1
981 1 43 GLY H 1 49 ILE MD 4.849 . 7.789 4.898 3.068 7.052 . 0 0 "[ . 1 .]" 1
982 1 44 ASP H 1 44 ASP HB2 2.552 . 3.366 2.690 2.329 3.781 0.415 11 0 "[ . 1 .]" 1
983 1 44 ASP H 1 44 ASP HB3 3.281 . 4.627 3.306 2.725 3.689 . 0 0 "[ . 1 .]" 1
984 1 44 ASP H 1 44 ASP HA 2.929 . 4.002 2.898 2.798 2.942 . 0 0 "[ . 1 .]" 1
985 1 82 PHE QE 1 109 ALA H 4.775 . 7.625 4.341 3.689 5.477 . 0 0 "[ . 1 .]" 1
986 1 65 THR MG 1 69 GLN H 3.370 . 4.790 4.903 4.808 4.996 0.206 2 0 "[ . 1 .]" 1
987 1 107 VAL H 1 107 VAL MG2 2.430 . 3.168 1.895 1.787 2.007 . 0 0 "[ . 1 .]" 1
988 1 69 GLN QB 1 69 GLN QE 4.317 . 6.647 3.288 1.726 3.469 0.261 11 0 "[ . 1 .]" 1
989 1 99 ARG H 1 107 VAL H 2.920 . 3.986 3.555 3.132 4.020 0.034 10 0 "[ . 1 .]" 1
990 1 99 ARG H 1 99 ARG HG2 2.723 . 3.650 2.662 2.268 3.117 . 0 0 "[ . 1 .]" 1
991 1 99 ARG H 1 99 ARG HG3 2.899 . 3.950 3.234 2.663 3.512 . 0 0 "[ . 1 .]" 1
992 1 87 GLN H 1 89 VAL QG 4.372 . 6.761 5.610 4.987 6.627 . 0 0 "[ . 1 .]" 1
993 1 85 ASP H 1 87 GLN H 3.984 . 5.968 5.342 4.865 5.951 . 0 0 "[ . 1 .]" 1
994 1 86 LYS H 1 87 GLN H 3.138 . 4.369 2.586 2.258 3.070 . 0 0 "[ . 1 .]" 1
995 1 85 ASP H 1 88 PHE H 4.927 . 7.961 5.419 4.712 6.321 . 0 0 "[ . 1 .]" 1
996 1 76 PRO HD2 1 77 ASP H 3.045 . 4.204 3.145 3.053 3.281 . 0 0 "[ . 1 .]" 1
997 1 57 PHE H 1 57 PHE QE 4.435 . 6.893 4.370 4.054 4.648 . 0 0 "[ . 1 .]" 1
998 1 57 PHE H 1 57 PHE HZ 4.108 . 6.218 5.994 5.604 6.259 0.041 11 0 "[ . 1 .]" 1
999 1 44 ASP H 1 47 VAL HB 4.888 . 7.874 4.964 4.143 6.602 . 0 0 "[ . 1 .]" 1
1000 1 46 LEU H 1 48 PRO HA 4.233 . 6.473 6.267 5.847 6.582 0.109 7 0 "[ . 1 .]" 1
1001 1 46 LEU H 1 48 PRO HD2 5.086 . 8.319 6.345 5.626 6.921 . 0 0 "[ . 1 .]" 1
1002 1 46 LEU H 1 48 PRO HD3 4.252 . 6.512 5.079 4.597 5.631 . 0 0 "[ . 1 .]" 1
1003 1 56 THR HG1 1 59 ASP H 4.783 . 7.643 7.059 6.437 7.398 . 0 0 "[ . 1 .]" 1
1004 1 81 THR MG 1 83 THR H 3.414 . 4.871 3.906 3.551 4.696 . 0 0 "[ . 1 .]" 1
1005 1 74 ILE MD 1 74 ILE MG 2.189 . 2.788 1.984 1.838 3.192 0.404 6 0 "[ . 1 .]" 1
1006 1 57 PHE QD 1 95 VAL QG 3.863 . 4.988 2.886 2.207 3.366 . 0 0 "[ . 1 .]" 1
1007 1 57 PHE QD 1 74 ILE MG 4.293 . 6.597 3.305 2.855 4.574 . 0 0 "[ . 1 .]" 1
1008 1 57 PHE QE 1 74 ILE MG 3.744 . 5.496 2.320 1.944 3.879 0.048 10 0 "[ . 1 .]" 1
1009 1 57 PHE HZ 1 74 ILE MG 3.716 . 5.442 3.441 2.407 3.895 . 0 0 "[ . 1 .]" 1
1010 1 57 PHE QE 1 95 VAL QG 4.004 . 5.442 3.895 3.381 4.317 . 0 0 "[ . 1 .]" 1
1011 1 57 PHE HZ 1 95 VAL QG 4.423 . 6.850 5.435 4.776 5.732 . 0 0 "[ . 1 .]" 1
1012 1 57 PHE HB2 1 57 PHE QD 3.577 . 5.176 2.598 2.338 2.759 . 0 0 "[ . 1 .]" 1
1013 1 57 PHE QE 1 63 GLU HA 3.880 . 5.762 2.864 2.134 3.696 . 0 0 "[ . 1 .]" 1
1014 1 57 PHE HZ 1 63 GLU HA 3.552 . 5.129 2.944 2.454 4.242 . 0 0 "[ . 1 .]" 1
1015 1 57 PHE HZ 1 73 THR HA 3.665 . 5.344 3.158 2.609 3.601 . 0 0 "[ . 1 .]" 1
1016 1 57 PHE QD 1 73 THR HA 5.414 . 9.078 5.937 5.295 6.502 . 0 0 "[ . 1 .]" 1
1017 1 57 PHE HZ 1 73 THR MG 4.614 . 7.275 4.506 4.155 4.950 . 0 0 "[ . 1 .]" 1
1018 1 57 PHE HZ 1 80 VAL QG 3.170 . 4.426 3.969 3.384 4.415 . 0 0 "[ . 1 .]" 1
1019 1 57 PHE HZ 1 74 ILE HB 3.689 . 5.390 4.570 4.002 4.933 . 0 0 "[ . 1 .]" 1
1020 1 57 PHE QE 1 74 ILE HB 3.784 . 5.574 3.245 2.778 4.269 . 0 0 "[ . 1 .]" 1
1021 1 57 PHE QE 1 80 VAL QG 3.511 . 5.052 3.217 2.529 4.544 . 0 0 "[ . 1 .]" 1
1022 1 57 PHE QD 1 80 VAL QG 4.040 . 6.080 4.460 3.888 5.664 . 0 0 "[ . 1 .]" 1
1023 1 57 PHE QD 1 62 LYS HD3 5.374 . 8.984 4.478 3.422 5.944 . 0 0 "[ . 1 .]" 1
1024 1 57 PHE QE 1 62 LYS HD3 5.180 . 8.534 5.018 4.336 6.380 . 0 0 "[ . 1 .]" 1
1025 1 57 PHE HZ 1 64 LYS HG3 5.393 . 9.029 6.574 5.724 7.150 . 0 0 "[ . 1 .]" 1
1026 1 57 PHE QE 1 64 LYS HG3 4.993 . 8.109 4.559 3.285 5.957 . 0 0 "[ . 1 .]" 1
1027 1 57 PHE QD 1 97 VAL HA 3.951 . 5.903 3.155 2.088 3.811 . 0 0 "[ . 1 .]" 1
1028 1 57 PHE QE 1 97 VAL HA 4.250 . 6.508 4.496 3.915 5.024 . 0 0 "[ . 1 .]" 1
1029 1 82 PHE QE 1 108 THR HA 4.355 . 6.726 3.211 2.572 4.262 . 0 0 "[ . 1 .]" 1
1030 1 72 TYR HA 1 82 PHE QD 4.951 . 8.015 4.199 3.794 4.787 . 0 0 "[ . 1 .]" 1
1031 1 82 PHE HA 1 82 PHE QE 5.091 . 8.331 4.372 4.292 4.524 . 0 0 "[ . 1 .]" 1
1032 1 82 PHE HA 1 82 PHE QD 4.799 . 7.678 2.126 1.992 2.415 . 0 0 "[ . 1 .]" 1
1033 1 82 PHE QE 1 109 ALA HA 4.640 . 7.331 5.426 4.811 6.030 . 0 0 "[ . 1 .]" 1
1034 1 82 PHE QD 1 109 ALA HA 3.971 . 5.942 5.264 4.609 5.850 . 0 0 "[ . 1 .]" 1
1035 1 49 ILE MG 1 82 PHE QE 6.227 . 11.074 5.670 5.232 6.075 . 0 0 "[ . 1 .]" 1
1036 1 49 ILE MG 1 82 PHE QD 5.511 . 9.307 6.816 6.501 7.202 . 0 0 "[ . 1 .]" 1
1037 1 88 PHE HB2 1 88 PHE QE 4.597 . 7.238 4.450 4.405 4.490 . 0 0 "[ . 1 .]" 1
1038 1 69 GLN HA 1 88 PHE QE 4.884 . 7.865 4.178 3.059 4.911 . 0 0 "[ . 1 .]" 1
1039 1 95 VAL QG 1 111 TYR QE 4.225 . 6.456 4.706 4.263 5.524 . 0 0 "[ . 1 .]" 1
1040 1 95 VAL QG 1 111 TYR QD 3.779 . 5.564 3.238 2.650 4.011 . 0 0 "[ . 1 .]" 1
1041 1 57 PHE HB3 1 57 PHE QD 3.538 . 5.103 2.467 2.278 2.750 . 0 0 "[ . 1 .]" 1
1042 1 88 PHE HA 1 88 PHE QE 4.715 . 7.494 4.588 4.364 5.302 . 0 0 "[ . 1 .]" 1
1043 1 88 PHE QE 1 89 VAL HA 4.895 . 7.890 5.461 4.128 5.979 . 0 0 "[ . 1 .]" 1
1044 1 88 PHE HB3 1 88 PHE QE 4.361 . 6.738 4.377 4.361 4.402 . 0 0 "[ . 1 .]" 1
1045 1 88 PHE QD 1 92 PRO HB3 4.898 . 7.897 3.569 2.388 6.956 . 0 0 "[ . 1 .]" 1
1046 1 88 PHE QE 1 92 PRO HB3 4.483 . 6.995 3.657 2.129 5.414 . 0 0 "[ . 1 .]" 1
1047 1 49 ILE MD 1 82 PHE QD 4.696 . 7.453 6.217 5.426 6.779 . 0 0 "[ . 1 .]" 1
1048 1 49 ILE MD 1 82 PHE QE 6.157 . 10.896 5.198 4.192 5.718 . 0 0 "[ . 1 .]" 1
1049 1 82 PHE QD 1 107 VAL MG1 3.656 . 5.327 5.243 4.716 5.435 0.108 15 0 "[ . 1 .]" 1
1050 1 82 PHE QE 1 107 VAL HB 4.806 . 7.693 2.854 2.113 3.566 . 0 0 "[ . 1 .]" 1
1051 1 82 PHE HZ 1 108 THR HA 3.942 . 5.885 3.879 3.135 4.859 . 0 0 "[ . 1 .]" 1
1052 1 82 PHE HA 1 82 PHE HZ 4.554 . 7.146 6.024 5.917 6.162 . 0 0 "[ . 1 .]" 1
1053 1 82 PHE QD 1 107 VAL HA 3.859 . 5.720 5.950 5.890 6.094 0.374 11 0 "[ . 1 .]" 1
1054 1 82 PHE HZ 1 107 VAL HA 5.162 . 8.493 5.706 5.179 6.463 . 0 0 "[ . 1 .]" 1
1055 1 82 PHE QE 1 99 ARG HD3 5.054 . 8.247 3.176 2.497 4.301 . 0 0 "[ . 1 .]" 1
1056 1 82 PHE QD 1 99 ARG HD3 5.003 . 8.132 4.864 4.014 6.058 . 0 0 "[ . 1 .]" 1
1057 1 82 PHE QE 1 97 VAL HB 4.207 . 6.419 3.604 3.243 4.010 . 0 0 "[ . 1 .]" 1
1058 1 82 PHE HZ 1 107 VAL MG2 3.851 . 5.704 2.878 2.125 4.048 . 0 0 "[ . 1 .]" 1
1059 1 82 PHE HZ 1 107 VAL MG1 4.573 . 7.187 5.322 4.618 6.078 . 0 0 "[ . 1 .]" 1
1060 1 111 TYR QD 1 115 PHE HB2 3.700 . 5.411 4.610 3.490 5.818 0.407 7 0 "[ . 1 .]" 1
1061 1 111 TYR QE 1 115 PHE HB3 3.853 . 5.709 4.872 4.106 5.779 0.070 9 0 "[ . 1 .]" 1
1062 1 57 PHE HA 1 57 PHE QD 3.742 . 5.492 2.596 2.076 3.100 . 0 0 "[ . 1 .]" 1
1063 1 57 PHE QE 1 72 TYR HA 5.669 . 9.687 4.647 4.421 4.780 . 0 0 "[ . 1 .]" 1
1064 1 57 PHE HZ 1 80 VAL HA 5.693 . 9.744 6.328 5.362 6.645 . 0 0 "[ . 1 .]" 1
1065 1 57 PHE QE 1 80 VAL HA 6.038 . 10.596 5.762 5.213 6.529 . 0 0 "[ . 1 .]" 1
1066 1 57 PHE HZ 1 72 TYR HB3 3.367 . 4.784 3.123 2.717 3.443 . 0 0 "[ . 1 .]" 1
1067 1 57 PHE QE 1 72 TYR HB3 4.149 . 6.301 3.411 2.490 4.018 . 0 0 "[ . 1 .]" 1
1068 1 57 PHE QD 1 74 ILE MD 5.044 . 8.225 5.321 4.068 6.374 . 0 0 "[ . 1 .]" 1
1069 1 57 PHE QE 1 74 ILE MD 4.549 . 7.135 4.814 3.592 5.884 . 0 0 "[ . 1 .]" 1
1070 1 57 PHE HZ 1 74 ILE MD 4.968 . 8.053 6.218 4.931 6.552 . 0 0 "[ . 1 .]" 1
1071 1 57 PHE HZ 1 74 ILE HA 3.799 . 5.603 5.640 5.521 5.707 0.104 3 0 "[ . 1 .]" 1
1072 1 57 PHE QE 1 74 ILE HA 4.789 . 7.655 4.943 4.596 5.508 . 0 0 "[ . 1 .]" 1
1073 1 82 PHE HZ 1 99 ARG HG2 2.640 . 3.511 2.033 1.850 2.511 . 0 0 "[ . 1 .]" 1
1074 1 82 PHE QE 1 99 ARG HG3 6.126 . 10.817 4.220 4.061 4.366 . 0 0 "[ . 1 .]" 1
1075 1 82 PHE HZ 1 99 ARG HG3 4.917 . 7.939 3.444 2.987 3.797 . 0 0 "[ . 1 .]" 1
1076 1 49 ILE MD 1 82 PHE HZ 5.468 . 9.205 5.391 4.091 5.917 . 0 0 "[ . 1 .]" 1
1077 1 88 PHE QD 1 89 VAL QG 4.260 . 6.528 4.711 3.840 5.018 . 0 0 "[ . 1 .]" 1
1078 1 88 PHE QE 1 89 VAL QG 4.304 . 6.620 5.376 3.849 5.896 . 0 0 "[ . 1 .]" 1
1079 1 88 PHE HZ 1 89 VAL QG 4.918 . 7.941 6.385 4.339 7.047 . 0 0 "[ . 1 .]" 1
1080 1 69 GLN HG2 1 88 PHE QE 4.636 . 7.323 4.988 2.717 5.843 . 0 0 "[ . 1 .]" 1
1081 1 57 PHE QE 1 64 LYS HG2 4.030 . 6.060 4.364 3.522 5.841 . 0 0 "[ . 1 .]" 1
1082 1 57 PHE QD 1 64 LYS HG2 4.403 . 6.826 4.008 3.103 5.143 . 0 0 "[ . 1 .]" 1
1083 1 57 PHE HZ 1 64 LYS HG2 4.456 . 6.938 6.411 5.183 7.105 0.167 5 0 "[ . 1 .]" 1
1084 1 111 TYR QD 1 112 SER H 4.286 . 6.582 3.149 2.760 3.589 . 0 0 "[ . 1 .]" 1
1085 1 111 TYR HA 1 111 TYR QD 3.769 . 5.545 2.707 2.034 2.990 . 0 0 "[ . 1 .]" 1
1086 1 57 PHE HA 1 57 PHE QE 4.133 . 6.269 4.557 4.413 4.654 . 0 0 "[ . 1 .]" 1
1087 1 111 TYR HB2 1 111 TYR QD 3.442 . 4.923 2.349 2.291 2.489 . 0 0 "[ . 1 .]" 1
1088 1 88 PHE HB2 1 88 PHE QD 3.933 . 5.866 2.569 2.415 2.718 . 0 0 "[ . 1 .]" 1
1089 1 70 GLY HA3 1 88 PHE QD 5.217 . 8.619 6.942 5.874 7.486 . 0 0 "[ . 1 .]" 1
1090 1 88 PHE HA 1 88 PHE QD 3.777 . 5.560 2.537 2.098 3.312 . 0 0 "[ . 1 .]" 1
1091 1 82 PHE QD 1 97 VAL HB 3.944 . 5.889 4.224 3.821 4.809 . 0 0 "[ . 1 .]" 1
1092 1 82 PHE HZ 1 97 VAL HB 2.900 . 3.951 3.765 3.077 4.000 0.049 5 0 "[ . 1 .]" 1
1093 1 88 PHE HZ 1 92 PRO HB3 4.501 . 7.033 5.676 2.332 6.946 . 0 0 "[ . 1 .]" 1
1094 1 57 PHE QD 1 63 GLU HA 4.348 . 6.712 4.547 4.284 4.971 . 0 0 "[ . 1 .]" 1
1095 1 111 TYR HB2 1 111 TYR QE 4.576 . 7.194 4.401 4.375 4.439 . 0 0 "[ . 1 .]" 1
1096 1 111 TYR QE 1 112 SER HA 4.600 . 7.245 7.174 6.159 7.573 0.328 11 0 "[ . 1 .]" 1
1097 1 64 LYS HG2 1 72 TYR QD 4.274 . 6.558 4.063 2.687 4.951 . 0 0 "[ . 1 .]" 1
1098 1 72 TYR HB2 1 72 TYR QD 3.876 . 5.754 2.350 2.285 2.473 . 0 0 "[ . 1 .]" 1
1099 1 72 TYR H 1 72 TYR QD 4.478 . 6.985 2.621 2.092 2.955 . 0 0 "[ . 1 .]" 1
1100 1 82 PHE QE 1 107 VAL HA 4.741 . 7.550 4.294 4.045 4.640 . 0 0 "[ . 1 .]" 1
1101 1 69 GLN HG2 1 88 PHE QD 4.337 . 6.688 4.363 2.859 5.216 . 0 0 "[ . 1 .]" 1
1102 1 111 TYR HB3 1 111 TYR QD 3.484 . 5.001 2.475 2.312 2.658 . 0 0 "[ . 1 .]" 1
1103 1 57 PHE HB2 1 57 PHE QE 4.587 . 7.217 4.453 4.398 4.496 . 0 0 "[ . 1 .]" 1
1104 1 72 TYR HB2 1 72 TYR QE 4.693 . 7.446 4.403 4.386 4.433 . 0 0 "[ . 1 .]" 1
1105 1 88 PHE HB3 1 88 PHE QD 3.727 . 5.463 2.291 2.253 2.356 . 0 0 "[ . 1 .]" 1
1106 1 82 PHE QD 1 109 ALA MB 3.343 . 4.740 3.346 2.724 4.002 . 0 0 "[ . 1 .]" 1
1107 1 82 PHE QE 1 107 VAL MG1 4.228 . 6.462 4.276 3.667 4.718 . 0 0 "[ . 1 .]" 1
1108 1 72 TYR QD 1 111 TYR QD 4.292 . 6.595 5.284 3.724 5.823 . 0 0 "[ . 1 .]" 1
1109 1 72 TYR QE 1 111 TYR QD 4.321 . 6.655 3.852 3.286 4.306 . 0 0 "[ . 1 .]" 1
1110 1 88 PHE QD 1 89 VAL HA 4.394 . 6.808 4.579 3.474 4.919 . 0 0 "[ . 1 .]" 1
1111 1 110 THR MG 1 111 TYR QD 4.240 . 6.487 5.593 5.229 6.261 . 0 0 "[ . 1 .]" 1
1112 1 72 TYR QE 1 111 TYR QE 4.584 . 7.211 3.161 2.415 3.827 . 0 0 "[ . 1 .]" 1
1113 1 88 PHE HZ 1 89 VAL HA 4.910 . 7.924 6.682 5.442 7.302 . 0 0 "[ . 1 .]" 1
1114 1 74 ILE MD 1 79 THR MG 2.882 . 3.920 3.109 1.750 3.818 0.094 6 0 "[ . 1 .]" 1
1115 1 49 ILE MG 1 55 PRO QB 3.375 . 4.799 2.804 2.286 3.662 . 0 0 "[ . 1 .]" 1
1116 1 49 ILE MG 1 99 ARG HG2 3.592 . 5.205 3.732 3.490 4.068 . 0 0 "[ . 1 .]" 1
1117 1 49 ILE MG 1 51 GLU HG2 3.030 . 4.178 3.397 2.599 3.893 . 0 0 "[ . 1 .]" 1
1118 1 64 LYS HB3 1 66 ILE MD 3.115 . 4.328 3.115 2.164 3.949 . 0 0 "[ . 1 .]" 1
1119 1 66 ILE HG13 1 66 ILE MG 2.619 . 3.476 2.893 2.352 3.187 . 0 0 "[ . 1 .]" 1
1120 1 77 ASP HA 1 79 THR MG 4.679 . 7.415 4.115 4.036 4.224 . 0 0 "[ . 1 .]" 1
1121 1 55 PRO HD3 1 79 THR MG 4.207 . 6.419 5.957 5.765 6.183 . 0 0 "[ . 1 .]" 1
1122 1 49 ILE HB 1 79 THR MG 4.381 . 6.780 5.580 5.150 5.935 . 0 0 "[ . 1 .]" 1
1123 1 98 LYS QE 1 100 VAL MG2 3.512 . 5.054 4.367 3.691 5.095 0.041 6 0 "[ . 1 .]" 1
1124 1 54 GLU QG 1 56 THR MG 2.974 . 4.079 2.148 2.061 2.398 . 0 0 "[ . 1 .]" 1
1125 1 58 GLU QG 1 108 THR MG 3.960 . 5.920 5.438 4.871 5.976 0.056 13 0 "[ . 1 .]" 1
1126 1 63 GLU QG 1 81 THR MG 5.186 . 8.548 6.337 5.424 7.416 . 0 0 "[ . 1 .]" 1
1127 1 63 GLU HA 1 71 THR MG 3.021 . 4.162 2.902 2.630 3.228 . 0 0 "[ . 1 .]" 1
1128 1 100 VAL HA 1 107 VAL MG2 4.241 . 6.489 3.274 3.099 3.423 . 0 0 "[ . 1 .]" 1
1129 1 100 VAL HA 1 100 VAL MG1 2.287 . 2.941 2.140 2.046 2.188 . 0 0 "[ . 1 .]" 1
1130 1 75 VAL HA 1 75 VAL QG 2.222 . 2.839 2.286 2.243 2.379 . 0 0 "[ . 1 .]" 1
1131 1 117 LYS HA 1 118 VAL QG 3.526 . 5.080 3.595 2.947 4.226 . 0 0 "[ . 1 .]" 1
1132 1 65 THR MG 1 67 PRO HD2 3.683 . 5.378 3.873 3.398 4.019 . 0 0 "[ . 1 .]" 1
1133 1 75 VAL QG 1 76 PRO HD2 2.741 . 3.680 3.121 2.850 3.276 . 0 0 "[ . 1 .]" 1
1134 1 75 VAL HB 1 75 VAL QG 1.708 . 2.073 1.895 1.891 1.897 . 0 0 "[ . 1 .]" 1
1135 1 63 GLU QG 1 71 THR MG 2.981 . 4.092 2.134 1.853 2.689 0.017 9 0 "[ . 1 .]" 1
1136 1 118 VAL HB 1 118 VAL QG 1.643 . 1.980 1.895 1.888 1.902 . 0 0 "[ . 1 .]" 1
1137 1 65 THR MG 1 66 ILE HB 3.353 . 4.758 4.475 4.184 4.695 . 0 0 "[ . 1 .]" 1
1138 1 55 PRO HG3 1 75 VAL MG2 4.022 . 6.044 4.811 4.481 5.181 . 0 0 "[ . 1 .]" 1
1139 1 75 VAL MG2 1 80 VAL HB 3.273 . 4.612 3.855 2.917 4.573 . 0 0 "[ . 1 .]" 1
1140 1 117 LYS QB 1 118 VAL MG1 3.534 . 5.095 3.824 2.880 4.597 . 0 0 "[ . 1 .]" 1
1141 1 116 THR MG 1 117 LYS QD 3.976 . 5.952 5.324 3.616 6.085 0.133 14 0 "[ . 1 .]" 1
1142 1 64 LYS QB 1 65 THR MG 3.865 . 5.732 5.750 5.516 5.885 0.153 15 0 "[ . 1 .]" 1
1143 1 89 VAL QG 1 117 LYS QG 2.865 . 3.890 3.203 2.214 3.506 . 0 0 "[ . 1 .]" 1
1144 1 47 VAL QG 1 103 ASN QB 2.884 . 3.924 3.121 2.313 3.617 . 0 0 "[ . 1 .]" 1
1145 1 47 VAL HB 1 105 THR MG 3.550 . 5.125 4.201 4.047 4.329 . 0 0 "[ . 1 .]" 1
1146 1 58 GLU QB 1 96 THR MG 2.506 . 3.291 2.605 2.242 2.859 . 0 0 "[ . 1 .]" 1
1147 1 97 VAL HB 1 97 VAL QG 1.969 . 2.454 1.897 1.893 1.900 . 0 0 "[ . 1 .]" 1
1148 1 55 PRO QB 1 80 VAL QG 2.265 . 2.906 1.941 1.812 2.370 . 0 0 "[ . 1 .]" 1
1149 1 96 THR MG 1 98 LYS QB 4.427 . 6.876 3.089 2.691 3.540 . 0 0 "[ . 1 .]" 1
1150 1 74 ILE MD 1 80 VAL QG 2.505 . 3.290 2.454 1.687 2.852 0.033 6 0 "[ . 1 .]" 1
1151 1 63 GLU QG 1 73 THR MG 2.780 . 3.746 2.192 1.644 2.856 0.170 12 0 "[ . 1 .]" 1
1152 1 71 THR MG 1 73 THR MG 1.623 . 1.952 1.614 1.588 1.647 . 0 0 "[ . 1 .]" 1
1153 1 45 PRO QG 1 46 LEU QD . . 2.705 2.327 1.892 2.759 0.108 10 0 "[ . 1 .]" 1
1154 1 46 LEU QB 1 46 LEU QD 1.772 . 2.143 1.715 1.695 1.747 . 0 0 "[ . 1 .]" 1
1155 1 117 LYS HE2 1 117 LYS HG2 2.669 . 3.559 2.646 2.157 3.214 . 0 0 "[ . 1 .]" 1
1156 1 98 LYS QE 1 98 LYS HG2 3.323 . 4.703 3.162 2.238 3.519 . 0 0 "[ . 1 .]" 1
1157 1 64 LYS QD 1 64 LYS HG3 2.318 . 2.990 2.327 2.139 2.495 . 0 0 "[ . 1 .]" 1
1158 1 80 VAL HB 1 80 VAL QG 2.072 . 2.609 1.792 1.745 1.809 . 0 0 "[ . 1 .]" 1
1159 1 86 LYS QD 1 86 LYS HG2 2.073 . 2.610 1.849 1.798 1.890 . 0 0 "[ . 1 .]" 1
1160 1 62 LYS HD2 1 62 LYS HG3 2.465 . 3.224 2.146 2.127 2.168 . 0 0 "[ . 1 .]" 1
1161 1 102 LYS HB2 1 102 LYS HG3 2.072 . 2.609 2.162 2.140 2.182 . 0 0 "[ . 1 .]" 1
1162 1 94 PRO QG 1 112 SER HA 4.835 . 7.757 3.977 2.825 5.265 . 0 0 "[ . 1 .]" 1
1163 1 93 ASP HA 1 94 PRO QG 3.972 . 5.944 3.865 3.763 4.022 . 0 0 "[ . 1 .]" 1
1164 1 45 PRO HA 1 45 PRO QG 3.562 . 5.148 3.501 3.441 3.520 . 0 0 "[ . 1 .]" 1
1165 1 94 PRO HD3 1 94 PRO QG 2.347 . 3.035 2.224 2.180 2.254 . 0 0 "[ . 1 .]" 1
1166 1 98 LYS HG2 1 106 PRO HG2 4.365 . 6.746 4.205 3.830 4.557 . 0 0 "[ . 1 .]" 1
1167 1 98 LYS HG2 1 106 PRO HG3 4.380 . 6.778 4.275 3.994 4.678 . 0 0 "[ . 1 .]" 1
1168 1 66 ILE MG 1 67 PRO HG3 4.659 . 7.372 4.667 4.442 4.933 . 0 0 "[ . 1 .]" 1
1169 1 66 ILE MG 1 67 PRO HG2 3.186 . 4.455 4.066 3.838 4.367 . 0 0 "[ . 1 .]" 1
1170 1 76 PRO HD2 1 76 PRO QG 2.574 . 3.402 2.228 2.182 2.250 . 0 0 "[ . 1 .]" 1
1171 1 76 PRO HD3 1 76 PRO QG 2.566 . 3.389 2.199 2.180 2.246 . 0 0 "[ . 1 .]" 1
1172 1 50 ASP HA 1 102 LYS QD 4.195 . 6.395 4.642 4.175 5.285 . 0 0 "[ . 1 .]" 1
1173 1 117 LYS HA 1 117 LYS QD 4.022 . 6.044 4.301 3.751 4.534 . 0 0 "[ . 1 .]" 1
1174 1 102 LYS HA 1 102 LYS QD 4.033 . 6.067 3.970 3.914 4.014 . 0 0 "[ . 1 .]" 1
1175 1 48 PRO HD2 1 102 LYS QD 3.280 . 4.625 3.636 2.756 4.441 . 0 0 "[ . 1 .]" 1
1176 1 102 LYS HD2 1 102 LYS HE2 2.366 . 3.066 2.155 2.038 2.276 . 0 0 "[ . 1 .]" 1
1177 1 75 VAL HB 1 76 PRO QG 4.130 . 6.262 4.046 3.615 4.263 . 0 0 "[ . 1 .]" 1
1178 1 44 ASP HB3 1 45 PRO QG 4.176 . 6.356 4.811 4.162 5.394 . 0 0 "[ . 1 .]" 1
1179 1 102 LYS QD 1 102 LYS HG2 2.522 . 3.317 2.361 2.325 2.385 . 0 0 "[ . 1 .]" 1
1180 1 47 VAL QG 1 102 LYS QD 3.843 . 5.689 3.473 2.270 4.164 . 0 0 "[ . 1 .]" 1
1181 1 54 GLU HB2 1 54 GLU QG 2.600 . 3.445 2.318 2.252 2.369 . 0 0 "[ . 1 .]" 1
1182 1 98 LYS QD 1 98 LYS QE 2.835 . 3.574 2.029 2.000 2.095 . 0 0 "[ . 1 .]" 1
1183 1 55 PRO QB 1 80 VAL QG 2.530 . 3.330 1.960 1.828 2.397 . 0 0 "[ . 1 .]" 1
1184 1 55 PRO QB 1 74 ILE MD 3.709 . 5.428 3.073 1.903 3.403 0.087 15 0 "[ . 1 .]" 1
1185 1 45 PRO HB2 1 46 LEU HG 3.085 . 4.275 3.611 3.118 3.989 . 0 0 "[ . 1 .]" 1
1186 1 86 LYS HB2 1 86 LYS QG 2.380 . 3.088 2.327 2.145 2.502 . 0 0 "[ . 1 .]" 1
1187 1 86 LYS HB3 1 86 LYS QG 2.375 . 3.080 2.315 2.133 2.431 . 0 0 "[ . 1 .]" 1
1188 1 98 LYS HG2 1 106 PRO HB2 3.616 . 5.250 3.446 2.655 4.000 . 0 0 "[ . 1 .]" 1
1189 1 98 LYS HG3 1 106 PRO HB3 3.029 . 4.176 2.798 2.258 3.346 . 0 0 "[ . 1 .]" 1
1190 1 94 PRO HB3 1 94 PRO QG 2.166 . 2.752 2.008 1.972 2.023 . 0 0 "[ . 1 .]" 1
1191 1 94 PRO HB3 1 94 PRO HD2 3.614 . 5.247 3.622 3.232 3.857 . 0 0 "[ . 1 .]" 1
1192 1 102 LYS HB3 1 102 LYS QE 4.651 . 7.355 4.052 3.900 4.201 . 0 0 "[ . 1 .]" 1
1193 1 102 LYS HB2 1 102 LYS QE 5.245 . 8.684 4.013 3.928 4.089 . 0 0 "[ . 1 .]" 1
1194 1 117 LYS QB 1 117 LYS QG 2.347 . 3.035 2.067 2.004 2.087 . 0 0 "[ . 1 .]" 1
1195 1 48 PRO HB2 1 102 LYS QD 4.155 . 6.313 4.082 2.701 5.222 . 0 0 "[ . 1 .]" 1
1196 1 86 LYS QD 1 87 GLN QG 4.473 . 5.176 3.992 2.619 5.036 . 0 0 "[ . 1 .]" 1
1197 1 86 LYS QG 1 87 GLN QG 3.984 . 4.919 3.290 1.940 4.695 0.060 7 0 "[ . 1 .]" 1
1198 1 50 ASP HA 1 51 GLU HG2 4.969 . 8.055 4.102 3.713 4.498 . 0 0 "[ . 1 .]" 1
1199 1 58 GLU QG 1 96 THR HB 3.794 . 5.593 3.458 2.372 3.896 . 0 0 "[ . 1 .]" 1
1200 1 58 GLU HA 1 58 GLU QG 2.781 . 3.748 2.483 2.372 2.804 . 0 0 "[ . 1 .]" 1
1201 1 58 GLU QG 1 98 LYS QB 4.010 . 6.020 3.854 2.870 4.194 . 0 0 "[ . 1 .]" 1
1202 1 58 GLU QG 1 98 LYS QB 3.939 . 5.878 3.978 2.873 4.450 . 0 0 "[ . 1 .]" 1
1203 1 58 GLU QG 1 96 THR MG 2.959 . 4.054 3.649 2.776 4.071 0.017 15 0 "[ . 1 .]" 1
1204 1 103 ASN QB 1 105 THR HB 4.030 . 6.060 4.084 3.383 5.344 . 0 0 "[ . 1 .]" 1
1205 1 50 ASP HB2 1 102 LYS HB2 3.817 . 5.638 3.763 3.531 4.076 . 0 0 "[ . 1 .]" 1
1206 1 50 ASP HB3 1 55 PRO HB2 5.601 . 9.523 5.109 4.877 5.450 . 0 0 "[ . 1 .]" 1
1207 1 97 VAL QG 1 111 TYR HB2 3.086 . 4.276 4.388 4.203 4.511 0.235 4 0 "[ . 1 .]" 1
1208 1 56 THR HG1 1 98 LYS HE2 4.022 . 6.044 3.500 2.747 4.651 . 0 0 "[ . 1 .]" 1
1209 1 82 PHE QB 1 109 ALA HA 4.068 . 6.137 5.992 5.287 6.211 0.074 6 0 "[ . 1 .]" 1
1210 1 50 ASP HA 1 102 LYS QE 2.748 . 3.692 3.141 2.722 3.743 0.051 15 0 "[ . 1 .]" 1
1211 1 98 LYS QE 1 106 PRO HD2 4.917 . 7.939 7.573 6.649 7.978 0.039 15 0 "[ . 1 .]" 1
1212 1 48 PRO HG3 1 102 LYS QE 2.972 . 4.076 3.811 3.375 4.115 0.039 11 0 "[ . 1 .]" 1
1213 1 54 GLU HB2 1 98 LYS HE2 4.281 . 6.572 5.246 4.668 5.602 . 0 0 "[ . 1 .]" 1
1214 1 85 ASP QB 1 86 LYS QB 4.990 . 8.102 5.339 4.994 5.585 . 0 0 "[ . 1 .]" 1
1215 1 48 PRO HG2 1 102 LYS HE2 3.184 . 4.451 3.186 2.021 3.814 . 0 0 "[ . 1 .]" 1
1216 1 102 LYS QD 1 102 LYS QE 2.217 . 2.831 2.052 2.007 2.090 . 0 0 "[ . 1 .]" 1
1217 1 102 LYS QE 1 102 LYS HG3 2.692 . 3.598 2.450 2.359 2.526 . 0 0 "[ . 1 .]" 1
1218 1 64 LYS QD 1 64 LYS HE2 2.087 . 2.631 2.330 2.170 2.474 . 0 0 "[ . 1 .]" 1
1219 1 64 LYS QD 1 64 LYS HE3 2.199 . 2.804 2.306 2.154 2.409 . 0 0 "[ . 1 .]" 1
1220 1 102 LYS QE 1 102 LYS HG2 2.650 . 3.528 2.582 2.315 2.852 . 0 0 "[ . 1 .]" 1
1221 1 98 LYS QB 1 98 LYS HE3 2.668 . 3.558 2.804 1.984 3.169 . 0 0 "[ . 1 .]" 1
1222 1 98 LYS QE 1 98 LYS HG3 3.407 . 4.858 2.910 2.330 3.349 . 0 0 "[ . 1 .]" 1
1223 1 47 VAL QG 1 101 ASP HB3 3.154 . 4.397 3.237 2.763 3.558 . 0 0 "[ . 1 .]" 1
1224 1 47 VAL QG 1 102 LYS QE 4.090 . 6.181 4.531 3.481 5.204 . 0 0 "[ . 1 .]" 1
1225 1 49 ILE MD 1 82 PHE QB 5.153 . 8.473 7.078 6.455 7.846 . 0 0 "[ . 1 .]" 1
1226 1 48 PRO HB2 1 102 LYS QE 3.363 . 4.776 2.893 2.053 3.647 . 0 0 "[ . 1 .]" 1
1227 1 102 LYS HA 1 102 LYS QE 4.908 . 7.919 4.716 4.452 4.915 . 0 0 "[ . 1 .]" 1
1228 1 44 ASP HB2 1 45 PRO QD 4.714 . 7.492 4.056 3.646 4.404 . 0 0 "[ . 1 .]" 1
1229 1 44 ASP HB3 1 45 PRO QD 2.848 . 3.862 3.548 2.986 4.018 0.156 11 0 "[ . 1 .]" 1
1230 1 117 LYS HB2 1 117 LYS QE 2.756 . 3.705 2.568 1.909 3.844 0.139 10 0 "[ . 1 .]" 1
1231 1 117 LYS HD2 1 117 LYS HE2 1.936 . 2.404 2.182 2.020 2.281 . 0 0 "[ . 1 .]" 1
1232 1 44 ASP HB2 1 47 VAL QG 3.620 . 5.258 3.254 2.753 3.470 . 0 0 "[ . 1 .]" 1
1233 1 44 ASP HB2 1 47 VAL QG 2.646 . 3.521 2.883 2.314 3.127 . 0 0 "[ . 1 .]" 1
1234 1 99 ARG QB 1 99 ARG HD2 3.021 . 4.162 2.506 2.281 3.280 . 0 0 "[ . 1 .]" 1
1235 1 49 ILE HB 1 78 GLY HA3 4.667 . 7.390 4.252 3.427 5.342 . 0 0 "[ . 1 .]" 1
1236 1 55 PRO QB 1 78 GLY HA3 4.314 . 6.640 4.630 4.033 5.645 . 0 0 "[ . 1 .]" 1
1237 1 78 GLY HA3 1 79 THR MG 3.797 . 5.600 4.212 3.800 4.385 . 0 0 "[ . 1 .]" 1
1238 1 55 PRO HB2 1 78 GLY HA2 3.037 . 4.190 3.196 2.553 4.255 0.065 2 0 "[ . 1 .]" 1
1239 1 78 GLY HA2 1 79 THR MG 3.641 . 5.298 3.846 3.337 4.142 . 0 0 "[ . 1 .]" 1
1240 1 94 PRO HD2 1 94 PRO QG 2.125 . 2.690 2.193 2.178 2.239 . 0 0 "[ . 1 .]" 1
1241 1 45 PRO HB2 1 48 PRO HD3 3.918 . 5.837 5.847 5.514 5.969 0.132 7 0 "[ . 1 .]" 1
1242 1 48 PRO HD3 1 102 LYS QD 4.474 . 6.976 5.201 4.440 5.924 . 0 0 "[ . 1 .]" 1
1243 1 44 ASP HA 1 45 PRO HD3 2.381 . 3.090 2.258 2.080 2.544 . 0 0 "[ . 1 .]" 1
1244 1 75 VAL QG 1 76 PRO HD3 2.686 . 3.588 3.274 3.062 3.619 0.031 14 0 "[ . 1 .]" 1
1245 1 45 PRO HB3 1 45 PRO HD3 3.556 . 5.137 2.917 2.801 3.028 . 0 0 "[ . 1 .]" 1
1246 1 45 PRO HD2 1 45 PRO QG 2.268 . 2.911 2.179 2.174 2.187 . 0 0 "[ . 1 .]" 1
1247 1 96 THR MG 1 109 ALA HA 4.182 . 6.368 4.068 3.601 4.549 . 0 0 "[ . 1 .]" 1
1248 1 66 ILE HG12 1 67 PRO HD3 4.967 . 8.051 4.414 4.104 4.814 . 0 0 "[ . 1 .]" 1
1249 1 48 PRO HB2 1 50 ASP HA 5.207 . 8.596 4.334 4.167 4.515 . 0 0 "[ . 1 .]" 1
1250 1 58 GLU QG 1 59 ASP HA 4.375 . 6.767 4.003 3.317 5.150 . 0 0 "[ . 1 .]" 1
1251 1 50 ASP HA 1 102 LYS HB2 4.028 . 6.056 4.450 4.024 5.037 . 0 0 "[ . 1 .]" 1
1252 1 51 GLU HG2 1 77 ASP HA 4.523 . 7.080 5.171 4.939 5.548 . 0 0 "[ . 1 .]" 1
1253 1 98 LYS HA 1 98 LYS QB 2.596 . 3.438 2.196 2.146 2.302 . 0 0 "[ . 1 .]" 1
1254 1 85 ASP HA 1 86 LYS QB 5.000 . 8.125 4.380 3.892 4.604 . 0 0 "[ . 1 .]" 1
1255 1 46 LEU HA 1 46 LEU QB 2.228 . 2.849 2.181 2.073 2.404 . 0 0 "[ . 1 .]" 1
1256 1 63 GLU HA 1 63 GLU QB 2.741 . 3.680 2.130 2.055 2.150 . 0 0 "[ . 1 .]" 1
1257 1 62 LYS HB3 1 63 GLU HA 4.091 . 6.183 3.896 3.741 4.066 . 0 0 "[ . 1 .]" 1
1258 1 63 GLU HA 1 64 LYS HG2 3.847 . 5.697 5.086 4.263 5.601 . 0 0 "[ . 1 .]" 1
1259 1 54 GLU HA 1 55 PRO QB 3.958 . 5.916 4.083 4.037 4.131 . 0 0 "[ . 1 .]" 1
1260 1 99 ARG HA 1 99 ARG QB 3.054 . 4.220 2.184 2.175 2.194 . 0 0 "[ . 1 .]" 1
1261 1 117 LYS HA 1 117 LYS QB 2.125 . 2.689 2.181 2.149 2.290 . 0 0 "[ . 1 .]" 1
1262 1 117 LYS HA 1 117 LYS QG 2.563 . 3.384 3.304 2.595 3.415 0.031 15 0 "[ . 1 .]" 1
1263 1 65 THR MG 1 66 ILE HA 3.787 . 5.580 2.937 2.082 3.321 . 0 0 "[ . 1 .]" 1
1264 1 47 VAL QG 1 102 LYS HA 4.302 . 6.615 3.414 3.196 3.863 . 0 0 "[ . 1 .]" 1
1265 1 86 LYS HA 1 86 LYS QB 2.373 . 3.077 2.270 2.167 2.392 . 0 0 "[ . 1 .]" 1
1266 1 48 PRO HG2 1 49 ILE HA 4.411 . 6.843 4.357 4.231 4.521 . 0 0 "[ . 1 .]" 1
1267 1 86 LYS HA 1 86 LYS QD 4.496 . 7.023 3.901 2.058 4.549 . 0 0 "[ . 1 .]" 1
1268 1 86 LYS HA 1 86 LYS QG 3.013 . 4.147 2.948 2.398 3.484 . 0 0 "[ . 1 .]" 1
1269 1 58 GLU HA 1 60 GLY HA2 4.171 . 6.346 4.172 3.994 4.316 . 0 0 "[ . 1 .]" 1
1270 1 47 VAL HA 1 102 LYS HB2 3.961 . 5.922 4.261 3.393 4.939 . 0 0 "[ . 1 .]" 1
1271 1 56 THR HA 1 62 LYS HG3 4.436 . 6.896 5.076 3.646 5.532 . 0 0 "[ . 1 .]" 1
1272 1 56 THR HA 1 80 VAL QG 3.601 . 5.222 4.291 3.888 4.731 . 0 0 "[ . 1 .]" 1
1273 1 58 GLU HA 1 98 LYS QE 3.585 . 5.192 4.285 2.838 5.075 . 0 0 "[ . 1 .]" 1
1274 1 58 GLU HA 1 58 GLU QB 2.409 . 3.135 2.380 2.317 2.466 . 0 0 "[ . 1 .]" 1
1275 1 63 GLU QB 1 73 THR HA 3.961 . 5.922 2.643 2.029 2.971 . 0 0 "[ . 1 .]" 1
1276 1 96 THR MG 1 97 VAL HA 3.777 . 5.560 3.380 3.323 3.452 . 0 0 "[ . 1 .]" 1
1277 1 53 VAL HA 1 54 GLU QG 4.625 . 7.299 5.899 5.838 5.939 . 0 0 "[ . 1 .]" 1
1278 1 58 GLU HB2 1 97 VAL HA 3.710 . 5.431 2.970 2.937 2.992 . 0 0 "[ . 1 .]" 1
1279 1 96 THR MG 1 97 VAL HA 3.928 . 5.857 3.829 3.641 3.981 . 0 0 "[ . 1 .]" 1
1280 1 97 VAL HA 1 97 VAL QG 2.327 . 3.004 2.129 2.113 2.149 . 0 0 "[ . 1 .]" 1
1281 1 55 PRO HA 1 55 PRO QB 2.403 . 3.125 1.866 1.643 2.056 0.038 5 0 "[ . 1 .]" 1
1282 1 94 PRO QG 1 112 SER HB3 6.051 . 10.628 5.074 3.633 6.731 . 0 0 "[ . 1 .]" 1
1283 1 94 PRO QG 1 112 SER HB2 5.812 . 10.034 5.791 4.331 7.667 . 0 0 "[ . 1 .]" 1
1284 1 117 LYS QB 1 118 VAL HA 4.544 . 7.125 4.531 3.870 5.491 . 0 0 "[ . 1 .]" 1
1285 1 117 LYS QG 1 118 VAL HA 3.812 . 5.628 4.551 3.609 5.769 0.141 5 0 "[ . 1 .]" 1
1286 1 118 VAL HA 1 118 VAL QG 2.274 . 2.920 2.204 2.129 2.341 . 0 0 "[ . 1 .]" 1
1287 1 79 THR HA 1 79 THR MG 2.663 . 3.550 2.806 2.349 2.926 . 0 0 "[ . 1 .]" 1
1288 1 75 VAL HB 1 76 PRO HA 4.578 . 7.198 4.566 4.489 4.639 . 0 0 "[ . 1 .]" 1
1289 1 76 PRO HA 1 76 PRO QG 3.415 . 4.873 3.083 2.851 3.492 . 0 0 "[ . 1 .]" 1
1290 1 75 VAL QG 1 76 PRO HA 3.464 . 4.964 4.366 4.226 4.489 . 0 0 "[ . 1 .]" 1
1291 1 58 GLU QB 1 96 THR HB 2.669 . 3.559 2.048 1.845 2.252 . 0 0 "[ . 1 .]" 1
1292 1 96 THR MG 1 108 THR HB 2.071 . 2.607 2.043 2.027 2.063 . 0 0 "[ . 1 .]" 1
1293 1 76 PRO HB2 1 76 PRO QG 2.213 . 2.825 2.229 2.181 2.257 . 0 0 "[ . 1 .]" 1
1294 1 89 VAL QG 1 117 LYS QB 1.903 . 2.356 1.847 1.737 2.043 . 0 0 "[ . 1 .]" 1
1295 1 45 PRO HB2 1 46 LEU QD 2.337 . 3.019 2.228 1.838 2.716 . 0 0 "[ . 1 .]" 1
1296 1 70 GLY HA2 1 83 THR MG 3.248 . 4.566 4.020 3.303 4.636 0.070 13 0 "[ . 1 .]" 1
1297 1 103 ASN QB 1 105 THR MG 4.970 . 8.057 4.845 3.948 5.899 . 0 0 "[ . 1 .]" 1
1298 1 44 ASP HA 1 105 THR MG 4.060 . 6.121 5.983 5.028 6.179 0.058 6 0 "[ . 1 .]" 1
1299 1 52 THR HB 1 53 VAL QG 4.921 . 7.948 3.325 2.969 3.581 . 0 0 "[ . 1 .]" 1
1300 1 75 VAL QG 1 76 PRO QG 3.711 . 5.432 4.208 4.000 4.333 . 0 0 "[ . 1 .]" 1
1301 1 89 VAL QG 1 117 LYS QE 3.090 . 4.284 3.011 1.995 4.150 . 0 0 "[ . 1 .]" 1
1302 1 100 VAL MG2 1 106 PRO HB3 3.891 . 5.784 4.974 4.655 5.422 . 0 0 "[ . 1 .]" 1
1303 1 117 LYS HA 1 117 LYS QE 6.054 . 10.635 4.476 4.118 5.442 . 0 0 "[ . 1 .]" 1
1304 1 89 VAL HB 1 117 LYS HA 4.085 . 6.171 3.904 2.105 4.344 . 0 0 "[ . 1 .]" 1
1305 1 102 LYS HB3 1 102 LYS QD 2.481 . 3.250 2.363 2.299 2.416 . 0 0 "[ . 1 .]" 1
1306 1 98 LYS QE 1 100 VAL MG1 2.735 . 3.670 3.263 2.875 3.738 0.068 6 0 "[ . 1 .]" 1
1307 1 58 GLU QG 1 98 LYS QD 4.725 . 6.682 5.396 4.123 6.075 . 0 0 "[ . 1 .]" 1
1308 1 98 LYS QE 1 106 PRO HB2 4.727 . 7.520 5.528 4.862 6.192 . 0 0 "[ . 1 .]" 1
1309 1 98 LYS QE 1 106 PRO HB3 3.667 . 5.347 4.240 3.557 4.720 . 0 0 "[ . 1 .]" 1
1310 1 56 THR HB 1 62 LYS QE 4.124 . 6.250 3.547 3.364 3.793 . 0 0 "[ . 1 .]" 1
1311 1 55 PRO QB 1 55 PRO HD2 3.939 . 5.879 3.288 3.033 3.344 . 0 0 "[ . 1 .]" 1
1312 1 54 GLU HA 1 55 PRO QB 4.606 . 7.258 3.959 3.921 4.002 . 0 0 "[ . 1 .]" 1
1313 1 86 LYS HB2 1 86 LYS QD 2.775 . 3.738 2.676 2.251 3.542 . 0 0 "[ . 1 .]" 1
1314 1 86 LYS HB3 1 86 LYS QD 2.435 . 3.176 2.651 2.243 3.304 0.128 11 0 "[ . 1 .]" 1
1315 1 57 PHE QE 1 95 VAL QG 3.365 . 4.780 3.066 2.577 3.652 . 0 0 "[ . 1 .]" 1
1316 1 55 PRO HG2 1 74 ILE MD 3.588 . 5.197 1.977 1.849 2.163 0.130 9 0 "[ . 1 .]" 1
1317 1 74 ILE MG 1 75 VAL QG 4.167 . 6.337 2.974 2.754 3.656 . 0 0 "[ . 1 .]" 1
1318 1 49 ILE MD 1 99 ARG QB 4.914 . 7.932 4.060 3.123 4.662 . 0 0 "[ . 1 .]" 1
1319 1 49 ILE MG 1 50 ASP HA 3.632 . 5.281 3.896 3.715 4.067 . 0 0 "[ . 1 .]" 1
1320 1 72 TYR HA 1 72 TYR QD 4.284 . 6.578 2.915 2.630 3.189 . 0 0 "[ . 1 .]" 1
1321 1 72 TYR QD 1 82 PHE HA 4.444 . 6.912 1.959 1.814 2.275 0.162 6 0 "[ . 1 .]" 1
1322 1 49 ILE HB 1 55 PRO QB 5.162 . 8.493 4.954 4.177 6.169 . 0 0 "[ . 1 .]" 1
1323 1 49 ILE HA 1 99 ARG HB3 4.693 . 7.446 4.937 4.661 5.214 . 0 0 "[ . 1 .]" 1
1324 1 55 PRO HB3 1 78 GLY HA2 4.148 . 6.299 3.781 3.412 4.439 . 0 0 "[ . 1 .]" 1
1325 1 48 PRO HG2 1 102 LYS QE 3.929 . 5.859 3.533 2.026 4.711 . 0 0 "[ . 1 .]" 1
1326 1 48 PRO HG3 1 102 LYS QE 3.901 . 5.804 4.802 3.695 5.911 0.107 11 0 "[ . 1 .]" 1
1327 1 75 VAL HA 1 76 PRO QG 4.948 . 8.008 3.786 3.660 4.013 . 0 0 "[ . 1 .]" 1
1328 1 61 SER QB 1 62 LYS HB3 4.669 . 7.394 3.897 3.228 4.870 . 0 0 "[ . 1 .]" 1
1329 1 61 SER QB 1 62 LYS HB3 5.046 . 8.228 3.790 3.176 4.658 . 0 0 "[ . 1 .]" 1
1330 1 94 PRO HB2 1 94 PRO QG 2.303 . 2.966 2.194 2.178 2.246 . 0 0 "[ . 1 .]" 1
1331 1 58 GLU HA 1 59 ASP HA 5.236 . 8.663 4.420 4.221 4.555 . 0 0 "[ . 1 .]" 1
1332 1 50 ASP HB2 1 102 LYS QE 5.123 . 8.404 3.829 3.487 4.528 . 0 0 "[ . 1 .]" 1
1333 1 101 ASP HA 1 102 LYS QE 5.005 . 8.136 5.926 5.725 6.248 . 0 0 "[ . 1 .]" 1
1334 1 86 LYS QE 1 86 LYS HG3 2.355 . 3.049 2.466 2.315 3.101 0.052 9 0 "[ . 1 .]" 1
1335 1 86 LYS QB 1 86 LYS HE3 3.044 . 4.203 3.083 1.894 4.120 . 0 0 "[ . 1 .]" 1
1336 1 86 LYS QD 1 86 LYS HE2 2.039 . 2.559 2.126 2.114 2.131 . 0 0 "[ . 1 .]" 1
1337 1 117 LYS QE 1 117 LYS QG 2.228 . 2.849 2.466 2.123 2.904 0.055 5 0 "[ . 1 .]" 1
1338 1 67 PRO HG3 1 68 GLY HA3 5.609 . 9.541 4.963 4.494 5.247 . 0 0 "[ . 1 .]" 1
1339 1 66 ILE HB 1 68 GLY HA2 4.802 . 7.684 5.234 5.131 5.312 . 0 0 "[ . 1 .]" 1
1340 1 63 GLU QG 1 64 LYS HA 4.326 . 6.665 3.576 2.927 5.161 . 0 0 "[ . 1 .]" 1
1341 1 61 SER QB 1 63 GLU QG 5.249 . 8.692 4.366 2.757 4.928 . 0 0 "[ . 1 .]" 1
1342 1 62 LYS HB3 1 63 GLU QG 5.038 . 8.210 4.261 3.991 4.549 . 0 0 "[ . 1 .]" 1
1343 1 57 PHE QD 1 64 LYS HE2 5.617 . 9.561 6.415 5.488 7.122 . 0 0 "[ . 1 .]" 1
1344 1 57 PHE QD 1 64 LYS HE3 5.664 . 9.675 6.334 5.216 7.180 . 0 0 "[ . 1 .]" 1
1345 1 64 LYS QB 1 64 LYS HG3 3.371 . 4.791 2.267 2.129 2.456 . 0 0 "[ . 1 .]" 1
1346 1 64 LYS HA 1 64 LYS QB 3.806 . 5.616 2.433 2.311 2.527 . 0 0 "[ . 1 .]" 1
1347 1 64 LYS QD 1 65 THR HA 5.461 . 9.189 5.215 3.393 6.492 . 0 0 "[ . 1 .]" 1
1348 1 54 GLU QG 1 62 LYS QE 3.599 . 5.218 4.316 4.184 4.396 . 0 0 "[ . 1 .]" 1
1349 1 66 ILE HG13 1 93 ASP HB2 4.770 . 7.614 3.911 2.356 5.190 . 0 0 "[ . 1 .]" 1
1350 1 93 ASP HB3 1 94 PRO QG 5.602 . 9.524 5.057 3.361 5.953 . 0 0 "[ . 1 .]" 1
1351 1 55 PRO HG3 1 77 ASP QB 4.180 . 6.364 4.614 4.325 4.797 . 0 0 "[ . 1 .]" 1
1352 1 66 ILE HG12 1 93 ASP HA 4.848 . 7.786 4.882 4.139 5.418 . 0 0 "[ . 1 .]" 1
1353 1 66 ILE HG13 1 93 ASP HB3 5.594 . 9.506 3.715 1.974 5.628 . 0 0 "[ . 1 .]" 1
1354 1 72 TYR QD 1 97 VAL MG2 3.831 . 5.665 2.633 2.434 2.898 . 0 0 "[ . 1 .]" 1
1355 1 57 PHE QE 1 97 VAL QG 3.055 . 4.222 2.487 1.957 2.822 . 0 0 "[ . 1 .]" 1
1356 1 51 GLU HG3 1 79 THR MG 6.572 . 11.970 5.793 5.416 6.116 . 0 0 "[ . 1 .]" 1
1357 1 98 LYS QE 1 108 THR MG 5.083 . 8.313 4.637 4.249 4.987 . 0 0 "[ . 1 .]" 1
1358 1 74 ILE MG 1 80 VAL QG 6.275 . 11.197 3.042 2.781 3.930 . 0 0 "[ . 1 .]" 1
1359 1 65 THR HB 1 73 THR MG 4.545 . 7.127 5.432 4.115 5.831 . 0 0 "[ . 1 .]" 1
1360 1 46 LEU HA 1 47 VAL QG 3.282 . 4.629 3.654 3.348 3.962 . 0 0 "[ . 1 .]" 1
1361 1 97 VAL QG 1 111 TYR HB3 4.058 . 6.117 5.708 5.398 5.882 . 0 0 "[ . 1 .]" 1
1362 1 117 LYS QB 1 117 LYS HE2 3.393 . 4.832 2.273 1.907 3.608 0.047 9 0 "[ . 1 .]" 1
1363 1 78 GLY HA2 1 80 VAL QG 5.378 . 8.993 3.857 3.360 4.127 . 0 0 "[ . 1 .]" 1
1364 1 98 LYS HG3 1 99 ARG HA 5.543 . 9.384 4.737 4.369 5.065 . 0 0 "[ . 1 .]" 1
1365 1 49 ILE MG 1 99 ARG QB 4.268 . 6.545 3.102 2.520 4.169 . 0 0 "[ . 1 .]" 1
1366 1 99 ARG QB 1 99 ARG HG3 2.658 . 3.541 2.349 2.254 2.508 . 0 0 "[ . 1 .]" 1
1367 1 117 LYS QE 1 118 VAL MG1 3.745 . 5.498 4.964 3.844 6.087 0.589 1 1 "[+ . 1 .]" 1
1368 1 85 ASP QB 1 86 LYS QG 8.664 . 10.714 5.562 4.539 6.529 . 0 0 "[ . 1 .]" 1
1369 1 69 GLN HG2 1 85 ASP QB 5.823 . 10.061 4.204 2.327 4.865 . 0 0 "[ . 1 .]" 1
1370 1 66 ILE HB 1 85 ASP QB 6.888 . 12.819 5.580 4.918 6.216 . 0 0 "[ . 1 .]" 1
1371 1 100 VAL MG2 1 101 ASP HB2 3.694 . 5.399 4.666 4.106 5.265 . 0 0 "[ . 1 .]" 1
1372 1 74 ILE HA 1 75 VAL QG 3.746 . 5.500 2.453 2.027 3.196 . 0 0 "[ . 1 .]" 1
1373 1 98 LYS QB 1 98 LYS HE3 2.543 . 3.351 3.023 1.993 3.421 0.070 13 0 "[ . 1 .]" 1
1374 1 64 LYS QD 1 95 VAL QG 3.578 . 3.643 2.661 2.107 3.586 . 0 0 "[ . 1 .]" 1
1375 1 64 LYS QD 1 66 ILE MD 3.280 . 4.625 3.379 2.169 4.475 . 0 0 "[ . 1 .]" 1
1376 1 94 PRO HD3 1 95 VAL QG 5.431 . 9.118 4.145 4.054 4.299 . 0 0 "[ . 1 .]" 1
1377 1 64 LYS QB 1 95 VAL QG 3.052 . 4.217 2.586 2.284 2.880 . 0 0 "[ . 1 .]" 1
1378 1 66 ILE HG13 1 95 VAL QG 4.355 . 6.726 4.352 3.691 5.225 . 0 0 "[ . 1 .]" 1
1379 1 62 LYS HG3 1 74 ILE MG 3.821 . 5.646 2.912 2.077 3.090 . 0 0 "[ . 1 .]" 1
1380 1 57 PHE HA 1 95 VAL QG 5.506 . 9.296 4.533 4.154 4.814 . 0 0 "[ . 1 .]" 1
1381 1 66 ILE MD 1 67 PRO HD2 5.609 . 9.541 4.385 3.232 5.089 . 0 0 "[ . 1 .]" 1
1382 1 57 PHE HZ 1 83 THR MG 5.090 . 8.329 7.428 7.243 7.581 . 0 0 "[ . 1 .]" 1
1383 1 73 THR HA 1 74 ILE HB 3.662 . 5.338 4.015 3.666 4.404 . 0 0 "[ . 1 .]" 1
1384 1 73 THR HA 1 75 VAL QG 4.522 . 7.078 3.991 3.643 4.685 . 0 0 "[ . 1 .]" 1
1385 1 55 PRO QB 1 99 ARG HD2 3.447 . 4.932 3.289 2.524 3.890 . 0 0 "[ . 1 .]" 1
1386 1 55 PRO QB 1 78 GLY HA3 6.010 . 10.525 5.604 4.988 6.686 . 0 0 "[ . 1 .]" 1
1387 1 52 THR HB 1 53 VAL HB 4.438 . 6.900 5.594 4.829 5.983 . 0 0 "[ . 1 .]" 1
1388 1 74 ILE HA 1 75 VAL QG 4.017 . 6.034 3.358 3.284 3.406 . 0 0 "[ . 1 .]" 1
1389 1 51 GLU HB3 1 77 ASP HA 5.817 . 10.046 3.867 3.226 4.581 . 0 0 "[ . 1 .]" 1
1390 1 99 ARG QB 1 99 ARG HD3 3.699 . 5.409 2.514 2.325 3.293 . 0 0 "[ . 1 .]" 1
1391 1 58 GLU QG 1 59 ASP HB3 5.133 . 8.427 5.729 4.813 6.729 . 0 0 "[ . 1 .]" 1
1392 1 58 GLU QG 1 59 ASP HB2 5.352 . 8.933 5.462 4.456 6.285 . 0 0 "[ . 1 .]" 1
1393 1 49 ILE HB 1 50 ASP HA 4.316 . 6.645 4.308 4.261 4.376 . 0 0 "[ . 1 .]" 1
1394 1 57 PHE HB2 1 97 VAL QG 5.407 . 9.062 4.364 3.923 4.768 . 0 0 "[ . 1 .]" 1
1395 1 57 PHE HB3 1 97 VAL QG 4.170 . 6.344 3.528 3.172 4.078 . 0 0 "[ . 1 .]" 1
1396 1 56 THR HB 1 57 PHE HB2 4.777 . 7.629 4.089 3.880 4.280 . 0 0 "[ . 1 .]" 1
1397 1 56 THR HB 1 57 PHE HB3 5.294 . 8.797 5.157 4.960 5.351 . 0 0 "[ . 1 .]" 1
1398 1 56 THR HA 1 57 PHE HB3 6.447 . 11.642 3.477 2.739 4.399 . 0 0 "[ . 1 .]" 1
1399 1 56 THR HA 1 57 PHE HB2 5.446 . 9.153 2.454 1.877 3.398 . 0 0 "[ . 1 .]" 1
1400 1 98 LYS QE 1 106 PRO HG2 5.762 . 9.912 6.113 4.896 6.737 . 0 0 "[ . 1 .]" 1
1401 1 98 LYS QE 1 106 PRO HG3 4.722 . 7.509 5.313 4.269 5.825 . 0 0 "[ . 1 .]" 1
1402 1 66 ILE HG12 1 67 PRO HG3 6.357 . 11.408 6.030 5.802 6.291 . 0 0 "[ . 1 .]" 1
1403 1 45 PRO HA 1 46 LEU QB 4.596 . 7.237 5.003 4.709 5.259 . 0 0 "[ . 1 .]" 1
1404 1 45 PRO HA 1 46 LEU QB 4.532 . 7.099 5.252 4.976 5.494 . 0 0 "[ . 1 .]" 1
1405 1 45 PRO HB3 1 46 LEU QB 5.695 . 9.750 5.204 4.495 5.742 . 0 0 "[ . 1 .]" 1
1406 1 45 PRO HD3 1 46 LEU QB 4.816 . 7.716 5.193 4.404 6.068 . 0 0 "[ . 1 .]" 1
1407 1 45 PRO HD2 1 46 LEU QB 4.842 . 7.772 3.944 3.099 5.448 . 0 0 "[ . 1 .]" 1
1408 1 44 ASP HB2 1 107 VAL HB 3.635 . 5.287 5.199 4.514 5.380 0.093 8 0 "[ . 1 .]" 1
1409 1 100 VAL HA 1 107 VAL HB 5.111 . 8.377 5.381 5.169 5.467 . 0 0 "[ . 1 .]" 1
1410 1 45 PRO QD 1 46 LEU HG 4.996 . 8.116 4.792 3.126 6.611 . 0 0 "[ . 1 .]" 1
1411 1 45 PRO QD 1 46 LEU QD 4.696 . 7.453 2.901 2.225 4.122 . 0 0 "[ . 1 .]" 1
1412 1 55 PRO HB3 1 56 THR HA 4.694 . 7.448 3.973 2.693 4.374 . 0 0 "[ . 1 .]" 1
1413 1 57 PHE HA 1 97 VAL QG 4.177 . 6.358 3.065 2.411 3.455 . 0 0 "[ . 1 .]" 1
1414 1 53 VAL QG 1 102 LYS HA 4.136 . 6.275 3.453 3.249 3.955 . 0 0 "[ . 1 .]" 1
1415 1 47 VAL QG 1 102 LYS HA 4.624 . 7.297 4.629 4.236 5.074 . 0 0 "[ . 1 .]" 1
1416 1 44 ASP HB2 1 49 ILE MG 4.011 . 6.022 5.960 5.539 6.174 0.152 13 0 "[ . 1 .]" 1
1417 1 49 ILE MG 1 50 ASP HB2 3.867 . 5.737 3.799 3.475 4.196 . 0 0 "[ . 1 .]" 1
1418 1 45 PRO HA 1 46 LEU H 2.583 . 3.417 2.742 2.656 2.808 . 0 0 "[ . 1 .]" 1
1419 1 45 PRO QD 1 46 LEU H 3.154 . 4.398 2.710 2.385 3.405 . 0 0 "[ . 1 .]" 1
1420 1 45 PRO HB2 1 46 LEU H 2.570 . 3.396 2.331 1.798 2.893 . 0 0 "[ . 1 .]" 1
1421 1 45 PRO HA 1 47 VAL H 2.839 . 3.847 3.212 3.000 3.372 . 0 0 "[ . 1 .]" 1
1422 1 45 PRO QD 1 47 VAL H 4.165 . 6.333 4.047 3.487 4.418 . 0 0 "[ . 1 .]" 1
1423 1 45 PRO HB3 1 47 VAL H 4.579 . 7.200 5.292 5.062 5.645 . 0 0 "[ . 1 .]" 1
1424 1 45 PRO HB2 1 47 VAL H 3.927 . 5.855 4.235 3.725 4.723 . 0 0 "[ . 1 .]" 1
1425 1 49 ILE H 1 101 ASP HB3 4.100 . 6.202 4.783 4.454 5.042 . 0 0 "[ . 1 .]" 1
1426 1 48 PRO HG2 1 49 ILE H 4.446 . 6.916 5.200 4.886 5.392 . 0 0 "[ . 1 .]" 1
1427 1 49 ILE H 1 99 ARG HB3 4.863 . 7.819 5.782 5.315 6.112 . 0 0 "[ . 1 .]" 1
1428 1 47 VAL QG 1 49 ILE H 4.405 . 6.830 4.576 4.428 4.741 . 0 0 "[ . 1 .]" 1
1429 1 50 ASP H 1 55 PRO HB2 4.699 . 7.459 4.654 4.474 4.832 . 0 0 "[ . 1 .]" 1
1430 1 49 ILE HG12 1 50 ASP H 4.402 . 6.824 3.939 3.676 4.182 . 0 0 "[ . 1 .]" 1
1431 1 51 GLU H 1 102 LYS QE 3.690 . 5.392 4.522 4.066 5.267 . 0 0 "[ . 1 .]" 1
1432 1 51 GLU H 1 55 PRO HG2 4.617 . 7.282 5.834 5.361 6.391 . 0 0 "[ . 1 .]" 1
1433 1 50 ASP HB2 1 52 THR H 3.990 . 5.980 4.288 3.304 4.431 . 0 0 "[ . 1 .]" 1
1434 1 54 GLU H 1 54 GLU QG 3.501 . 5.033 3.995 3.978 4.011 . 0 0 "[ . 1 .]" 1
1435 1 55 PRO HB3 1 56 THR H 3.150 . 4.390 2.910 1.890 3.422 0.020 5 0 "[ . 1 .]" 1
1436 1 57 PHE H 1 61 SER HA 4.300 . 6.611 4.346 4.240 4.451 . 0 0 "[ . 1 .]" 1
1437 1 57 PHE H 1 62 LYS HB3 3.703 . 5.417 3.829 3.433 4.325 . 0 0 "[ . 1 .]" 1
1438 1 57 PHE H 1 62 LYS HG3 4.176 . 6.355 4.751 4.371 5.183 . 0 0 "[ . 1 .]" 1
1439 1 57 PHE H 1 62 LYS HG2 3.966 . 5.932 5.116 4.841 6.114 0.182 15 0 "[ . 1 .]" 1
1440 1 58 GLU QG 1 59 ASP H 4.006 . 6.012 3.939 3.441 4.448 . 0 0 "[ . 1 .]" 1
1441 1 58 GLU QB 1 59 ASP H 3.214 . 4.505 2.737 2.507 3.086 . 0 0 "[ . 1 .]" 1
1442 1 59 ASP H 1 60 GLY H 2.820 . 3.814 2.546 2.350 2.711 . 0 0 "[ . 1 .]" 1
1443 1 58 GLU QB 1 60 GLY H 4.154 . 6.311 4.492 4.328 4.635 . 0 0 "[ . 1 .]" 1
1444 1 62 LYS HG3 1 63 GLU H 3.941 . 5.883 4.746 4.474 5.174 . 0 0 "[ . 1 .]" 1
1445 1 62 LYS HG2 1 63 GLU H 3.875 . 5.752 4.452 4.097 5.563 . 0 0 "[ . 1 .]" 1
1446 1 64 LYS H 1 64 LYS QB 3.023 . 4.166 2.510 2.350 2.681 . 0 0 "[ . 1 .]" 1
1447 1 58 GLU HB2 1 98 LYS H 3.550 . 5.125 3.712 3.576 3.874 . 0 0 "[ . 1 .]" 1
1448 1 98 LYS H 1 99 ARG HG2 3.323 . 4.703 4.605 3.896 4.772 0.069 7 0 "[ . 1 .]" 1
1449 1 96 THR MG 1 98 LYS H 3.747 . 5.502 4.204 3.797 4.363 . 0 0 "[ . 1 .]" 1
1450 1 65 THR HB 1 66 ILE H 3.647 . 5.310 4.012 3.876 4.123 . 0 0 "[ . 1 .]" 1
1451 1 66 ILE H 1 70 GLY HA2 4.372 . 6.762 4.690 4.381 5.063 . 0 0 "[ . 1 .]" 1
1452 1 66 ILE H 1 66 ILE HG12 3.208 . 4.495 3.052 2.511 3.450 . 0 0 "[ . 1 .]" 1
1453 1 67 PRO HA 1 68 GLY H 3.063 . 4.236 2.006 1.984 2.019 . 0 0 "[ . 1 .]" 1
1454 1 66 ILE HB 1 68 GLY H 5.577 . 9.465 4.102 4.065 4.139 . 0 0 "[ . 1 .]" 1
1455 1 67 PRO HA 1 69 GLN H 2.865 . 3.891 3.142 3.065 3.268 . 0 0 "[ . 1 .]" 1
1456 1 69 GLN H 1 69 GLN QE 4.307 . 6.625 4.490 3.927 4.983 . 0 0 "[ . 1 .]" 1
1457 1 66 ILE HG13 1 69 GLN H 4.859 . 7.811 5.520 5.360 5.809 . 0 0 "[ . 1 .]" 1
1458 1 66 ILE HG13 1 70 GLY H 4.664 . 7.383 5.644 5.256 6.208 . 0 0 "[ . 1 .]" 1
1459 1 66 ILE MD 1 70 GLY H 3.649 . 5.313 4.853 4.375 5.235 . 0 0 "[ . 1 .]" 1
1460 1 67 PRO HA 1 70 GLY H 4.313 . 6.638 3.992 3.875 4.084 . 0 0 "[ . 1 .]" 1
1461 1 65 THR HB 1 72 TYR H 5.053 . 8.244 5.375 5.045 5.527 . 0 0 "[ . 1 .]" 1
1462 1 64 LYS HA 1 72 TYR H 3.684 . 5.380 3.962 3.839 4.116 . 0 0 "[ . 1 .]" 1
1463 1 64 LYS HG2 1 72 TYR H 4.397 . 6.814 5.269 4.696 5.662 . 0 0 "[ . 1 .]" 1
1464 1 65 THR H 1 72 TYR H 4.290 . 6.591 4.776 4.666 4.890 . 0 0 "[ . 1 .]" 1
1465 1 76 PRO QG 1 77 ASP H 3.528 . 5.084 3.983 3.188 4.292 . 0 0 "[ . 1 .]" 1
1466 1 51 GLU HG2 1 78 GLY H 4.748 . 7.566 4.855 4.582 5.152 . 0 0 "[ . 1 .]" 1
1467 1 55 PRO HG3 1 78 GLY H 3.675 . 5.363 4.346 3.962 4.731 . 0 0 "[ . 1 .]" 1
1468 1 55 PRO QB 1 79 THR H 4.157 . 6.317 4.582 4.066 5.188 . 0 0 "[ . 1 .]" 1
1469 1 75 VAL MG2 1 81 THR H 3.296 . 4.654 2.373 2.138 2.715 . 0 0 "[ . 1 .]" 1
1470 1 73 THR H 1 81 THR H 3.449 . 4.936 3.033 2.751 3.272 . 0 0 "[ . 1 .]" 1
1471 1 73 THR MG 1 81 THR H 4.332 . 6.678 4.848 4.672 5.172 . 0 0 "[ . 1 .]" 1
1472 1 70 GLY HA2 1 83 THR H 3.849 . 5.701 5.415 5.114 5.583 . 0 0 "[ . 1 .]" 1
1473 1 73 THR H 1 83 THR H 3.967 . 5.934 3.739 3.605 3.891 . 0 0 "[ . 1 .]" 1
1474 1 86 LYS H 1 86 LYS QB 3.675 . 5.363 2.502 2.229 2.742 . 0 0 "[ . 1 .]" 1
1475 1 86 LYS QB 1 87 GLN H 3.020 . 4.160 3.418 2.425 4.014 . 0 0 "[ . 1 .]" 1
1476 1 86 LYS QD 1 87 GLN H 3.665 . 5.344 4.641 2.980 5.415 0.071 8 0 "[ . 1 .]" 1
1477 1 86 LYS QG 1 87 GLN H 3.186 . 4.454 3.669 2.600 4.342 . 0 0 "[ . 1 .]" 1
1478 1 93 ASP H 1 94 PRO QG 5.200 . 8.580 6.034 5.550 6.205 . 0 0 "[ . 1 .]" 1
1479 1 58 GLU QG 1 96 THR H 4.846 . 7.782 5.140 4.490 5.604 . 0 0 "[ . 1 .]" 1
1480 1 58 GLU HB3 1 96 THR H 4.028 . 6.056 3.277 2.869 3.630 . 0 0 "[ . 1 .]" 1
1481 1 64 LYS QD 1 96 THR H 4.445 . 6.915 6.185 5.295 6.933 0.018 12 0 "[ . 1 .]" 1
1482 1 97 VAL H 1 97 VAL QG 2.746 . 3.689 2.006 1.934 2.286 . 0 0 "[ . 1 .]" 1
1483 1 98 LYS QE 1 99 ARG H 4.882 . 7.861 4.382 3.769 5.367 . 0 0 "[ . 1 .]" 1
1484 1 99 ARG H 1 99 ARG QB 3.526 . 5.080 3.213 3.043 3.360 . 0 0 "[ . 1 .]" 1
1485 1 98 LYS QB 1 99 ARG H 2.847 . 3.860 3.069 2.128 3.590 . 0 0 "[ . 1 .]" 1
1486 1 98 LYS HG3 1 99 ARG H 3.145 . 4.381 3.091 2.618 3.411 . 0 0 "[ . 1 .]" 1
1487 1 99 ARG QB 1 100 VAL H 4.442 . 6.908 2.889 2.527 3.074 . 0 0 "[ . 1 .]" 1
1488 1 101 ASP H 1 104 GLY HA2 3.695 . 5.402 3.276 3.154 3.384 . 0 0 "[ . 1 .]" 1
1489 1 49 ILE HA 1 101 ASP H 4.875 . 7.846 4.682 4.359 5.097 . 0 0 "[ . 1 .]" 1
1490 1 55 PRO HB2 1 101 ASP H 5.022 . 8.174 6.207 6.068 6.321 . 0 0 "[ . 1 .]" 1
1491 1 100 VAL MG1 1 101 ASP H 3.622 . 5.262 3.523 3.284 3.667 . 0 0 "[ . 1 .]" 1
1492 1 58 GLU QB 1 61 SER H 4.604 . 7.253 5.681 5.352 5.987 . 0 0 "[ . 1 .]" 1
1493 1 61 SER H 1 62 LYS HB3 4.370 . 6.758 5.609 5.336 5.937 . 0 0 "[ . 1 .]" 1
1494 1 47 VAL QG 1 102 LYS H 4.070 . 6.141 2.751 2.361 3.355 . 0 0 "[ . 1 .]" 1
1495 1 103 ASN H 1 104 GLY HA2 4.057 . 6.114 4.286 4.131 4.498 . 0 0 "[ . 1 .]" 1
1496 1 103 ASN H 1 103 ASN QB 2.450 . 3.200 2.435 2.229 2.755 . 0 0 "[ . 1 .]" 1
1497 1 102 LYS HG2 1 103 ASN H 4.633 . 7.316 4.852 4.786 4.950 . 0 0 "[ . 1 .]" 1
1498 1 103 ASN QB 1 103 ASN HD21 3.591 . 5.203 2.218 2.150 2.786 . 0 0 "[ . 1 .]" 1
1499 1 103 ASN QB 1 103 ASN HD22 2.436 . 3.178 3.264 3.204 3.477 0.299 3 0 "[ . 1 .]" 1
1500 1 103 ASN QB 1 104 GLY H 3.143 . 4.378 3.139 2.737 3.736 . 0 0 "[ . 1 .]" 1
1501 1 50 ASP HB2 1 104 GLY H 3.710 . 5.431 3.736 3.563 3.898 . 0 0 "[ . 1 .]" 1
1502 1 102 LYS HG2 1 104 GLY H 4.610 . 7.267 5.148 5.062 5.227 . 0 0 "[ . 1 .]" 1
1503 1 104 GLY HA2 1 105 THR H 2.432 . 3.171 2.429 2.341 2.646 . 0 0 "[ . 1 .]" 1
1504 1 103 ASN QB 1 105 THR H 2.972 . 4.076 3.206 2.653 4.195 0.119 12 0 "[ . 1 .]" 1
1505 1 106 PRO HD3 1 107 VAL H 4.239 . 6.485 5.263 5.206 5.354 . 0 0 "[ . 1 .]" 1
1506 1 98 LYS QE 1 107 VAL H 4.495 . 7.021 6.662 6.237 7.040 0.019 12 0 "[ . 1 .]" 1
1507 1 101 ASP H 1 107 VAL H 3.803 . 5.611 3.773 3.521 3.897 . 0 0 "[ . 1 .]" 1
1508 1 96 THR MG 1 109 ALA H 3.190 . 4.462 3.003 2.752 3.185 . 0 0 "[ . 1 .]" 1
1509 1 72 TYR QD 1 109 ALA H 4.448 . 6.921 4.993 4.505 5.778 . 0 0 "[ . 1 .]" 1
1510 1 117 LYS H 1 117 LYS QB 3.107 . 4.314 2.981 2.473 3.476 . 0 0 "[ . 1 .]" 1
1511 1 117 LYS H 1 117 LYS QG 3.092 . 4.287 2.345 1.792 3.335 0.105 9 0 "[ . 1 .]" 1
1512 1 117 LYS QB 1 118 VAL H 2.843 . 3.853 2.770 1.798 3.984 0.131 2 0 "[ . 1 .]" 1
1513 1 117 LYS QG 1 118 VAL H 3.256 . 4.581 3.709 2.678 4.426 . 0 0 "[ . 1 .]" 1
1514 1 118 VAL H 1 118 VAL QG 2.522 . 3.317 2.383 1.781 3.117 . 0 0 "[ . 1 .]" 1
1515 1 43 GLY HA3 1 44 ASP H 3.047 . 4.208 2.694 2.108 3.453 . 0 0 "[ . 1 .]" 1
1516 1 89 VAL HB 1 118 VAL H 4.319 . 6.651 4.467 3.445 5.611 . 0 0 "[ . 1 .]" 1
1517 1 98 LYS QB 1 107 VAL H 4.630 . 7.309 5.115 4.411 5.677 . 0 0 "[ . 1 .]" 1
1518 1 66 ILE HG12 1 69 GLN QE 3.582 . 5.186 3.162 1.726 3.421 0.252 11 0 "[ . 1 .]" 1
1519 1 69 GLN H 1 85 ASP H 4.832 . 7.751 4.806 4.073 5.537 . 0 0 "[ . 1 .]" 1
1520 1 58 GLU QG 1 60 GLY H 4.306 . 6.624 4.857 4.537 5.438 . 0 0 "[ . 1 .]" 1
1521 1 60 GLY H 1 98 LYS QB 4.469 . 6.966 5.461 5.163 5.751 . 0 0 "[ . 1 .]" 1
1522 1 57 PHE QE 1 97 VAL QG 2.532 . 3.333 2.303 1.862 2.560 . 0 0 "[ . 1 .]" 1
1523 1 57 PHE HZ 1 97 VAL QG 3.518 . 5.065 3.366 3.132 3.750 . 0 0 "[ . 1 .]" 1
1524 1 57 PHE QD 1 97 VAL QG 3.427 . 4.895 2.447 1.908 2.780 0.051 5 0 "[ . 1 .]" 1
1525 1 57 PHE QD 1 73 THR MG 5.302 . 8.815 5.917 5.295 6.267 . 0 0 "[ . 1 .]" 1
1526 1 57 PHE QE 1 73 THR MG 4.688 . 7.435 4.599 4.390 4.859 . 0 0 "[ . 1 .]" 1
1527 1 57 PHE QD 1 64 LYS QD 4.567 . 7.175 4.511 3.764 5.529 . 0 0 "[ . 1 .]" 1
1528 1 57 PHE QD 1 64 LYS QB 4.527 . 7.089 2.863 2.224 4.645 . 0 0 "[ . 1 .]" 1
1529 1 57 PHE QE 1 64 LYS QB 4.417 . 6.855 2.500 2.026 4.647 . 0 0 "[ . 1 .]" 1
1530 1 57 PHE QE 1 64 LYS QD 4.518 . 7.069 4.960 4.501 6.376 . 0 0 "[ . 1 .]" 1
1531 1 82 PHE QE 1 97 VAL QG 3.704 . 5.419 2.307 1.970 2.544 0.019 11 0 "[ . 1 .]" 1
1532 1 49 ILE HG12 1 82 PHE QE 5.954 . 10.385 5.086 4.761 5.391 . 0 0 "[ . 1 .]" 1
1533 1 80 VAL HB 1 82 PHE QD 4.179 . 6.362 3.773 3.150 4.012 . 0 0 "[ . 1 .]" 1
1534 1 82 PHE QB 1 82 PHE QD 3.426 . 4.893 2.336 2.289 2.371 . 0 0 "[ . 1 .]" 1
1535 1 82 PHE QE 1 99 ARG QB 5.945 . 10.362 4.018 3.522 4.845 . 0 0 "[ . 1 .]" 1
1536 1 82 PHE HZ 1 99 ARG QB 4.430 . 6.883 3.617 2.707 4.304 . 0 0 "[ . 1 .]" 1
1537 1 72 TYR QD 1 111 TYR QE 5.297 . 8.805 4.782 3.150 5.425 . 0 0 "[ . 1 .]" 1
1538 1 72 TYR HB2 1 111 TYR QE 3.807 . 5.619 5.015 4.237 5.741 0.122 2 0 "[ . 1 .]" 1
1539 1 66 ILE MD 1 72 TYR QD 4.768 . 7.609 4.091 3.649 4.466 . 0 0 "[ . 1 .]" 1
1540 1 57 PHE QD 1 72 TYR HA 4.546 . 7.130 6.076 5.597 6.365 . 0 0 "[ . 1 .]" 1
1541 1 82 PHE QE 1 99 ARG HG2 4.102 . 6.205 3.025 2.665 3.545 . 0 0 "[ . 1 .]" 1
1542 1 57 PHE HZ 1 64 LYS QD 5.166 . 8.502 6.782 6.395 7.614 . 0 0 "[ . 1 .]" 1
1543 1 97 VAL QG 1 111 TYR QD 2.857 . 3.877 3.672 2.694 3.854 . 0 0 "[ . 1 .]" 1
1544 1 97 VAL QG 1 111 TYR QE 3.272 . 4.610 4.539 2.856 4.738 0.128 5 0 "[ . 1 .]" 1
1545 1 82 PHE QB 1 82 PHE QE 3.715 . 5.440 3.984 3.972 4.000 . 0 0 "[ . 1 .]" 1
1546 1 57 PHE QE 1 64 LYS HG2 3.517 . 5.063 3.121 2.495 4.395 . 0 0 "[ . 1 .]" 1
1547 1 57 PHE QE 1 62 LYS HG3 4.043 . 6.086 5.302 4.958 5.862 . 0 0 "[ . 1 .]" 1
1548 1 82 PHE QD 1 99 ARG QB 5.359 . 8.949 5.914 5.290 6.750 . 0 0 "[ . 1 .]" 1
1549 1 82 PHE QD 1 97 VAL QG 3.531 . 5.090 2.956 2.803 3.117 . 0 0 "[ . 1 .]" 1
1550 1 57 PHE QD 1 64 LYS HG2 3.948 . 5.897 3.565 2.992 4.390 . 0 0 "[ . 1 .]" 1
1551 1 82 PHE HZ 1 97 VAL QG 2.620 . 3.478 2.762 2.325 3.114 . 0 0 "[ . 1 .]" 1
1552 1 57 PHE HZ 1 74 ILE HB 3.732 . 5.473 3.716 3.299 4.017 . 0 0 "[ . 1 .]" 1
1553 1 66 ILE MD 1 72 TYR QE 3.902 . 5.805 3.720 2.650 5.008 . 0 0 "[ . 1 .]" 1
1554 1 88 PHE QD 1 89 VAL QG 4.411 . 6.843 3.307 2.126 4.304 . 0 0 "[ . 1 .]" 1
1555 1 57 PHE QD 1 64 LYS H 4.704 . 7.470 4.119 3.836 4.385 . 0 0 "[ . 1 .]" 1
1556 1 109 ALA HA 1 111 TYR QE 4.468 . 6.963 5.243 4.378 6.232 . 0 0 "[ . 1 .]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 29
_Distance_constraint_stats_list.Viol_count 143
_Distance_constraint_stats_list.Viol_total 159.758
_Distance_constraint_stats_list.Viol_max 0.262
_Distance_constraint_stats_list.Viol_rms 0.0464
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0245
_Distance_constraint_stats_list.Viol_average_violations_only 0.0745
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 44 ASP 0.643 0.262 7 0 "[ . 1 .]"
1 47 VAL 0.643 0.262 7 0 "[ . 1 .]"
1 50 ASP 1.115 0.118 12 0 "[ . 1 .]"
1 53 VAL 1.115 0.118 12 0 "[ . 1 .]"
1 54 GLU 2.679 0.249 5 0 "[ . 1 .]"
1 56 THR 1.094 0.145 6 0 "[ . 1 .]"
1 57 PHE 1.523 0.173 8 0 "[ . 1 .]"
1 61 SER 1.523 0.173 8 0 "[ . 1 .]"
1 62 LYS 0.051 0.051 4 0 "[ . 1 .]"
1 64 LYS 0.111 0.046 9 0 "[ . 1 .]"
1 66 ILE 0.022 0.022 11 0 "[ . 1 .]"
1 69 GLN 0.616 0.125 11 0 "[ . 1 .]"
1 70 GLY 0.022 0.022 11 0 "[ . 1 .]"
1 71 THR 1.908 0.172 15 0 "[ . 1 .]"
1 72 TYR 0.111 0.046 9 0 "[ . 1 .]"
1 73 THR 0.043 0.023 6 0 "[ . 1 .]"
1 74 ILE 0.051 0.051 4 0 "[ . 1 .]"
1 75 VAL 0.660 0.094 14 0 "[ . 1 .]"
1 78 GLY 0.000 0.000 . 0 "[ . 1 .]"
1 79 THR 0.660 0.094 14 0 "[ . 1 .]"
1 81 THR 0.043 0.023 6 0 "[ . 1 .]"
1 83 THR 1.908 0.172 15 0 "[ . 1 .]"
1 85 ASP 0.293 0.099 8 0 "[ . 1 .]"
1 93 ASP 0.322 0.125 11 0 "[ . 1 .]"
1 95 VAL 0.031 0.031 4 0 "[ . 1 .]"
1 97 VAL 0.072 0.046 8 0 "[ . 1 .]"
1 98 LYS 0.604 0.145 6 0 "[ . 1 .]"
1 99 ARG 0.237 0.053 5 0 "[ . 1 .]"
1 100 VAL 2.189 0.249 5 0 "[ . 1 .]"
1 101 ASP 0.337 0.127 14 0 "[ . 1 .]"
1 105 THR 0.337 0.127 14 0 "[ . 1 .]"
1 107 VAL 0.237 0.053 5 0 "[ . 1 .]"
1 109 ALA 0.072 0.046 8 0 "[ . 1 .]"
1 111 TYR 0.031 0.031 4 0 "[ . 1 .]"
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 56 THR H 1 98 LYS O 2.200 . 2.700 2.234 1.704 2.706 0.026 8 0 "[ . 1 .]" 2
2 1 56 THR O 1 98 LYS H 2.200 . 2.700 2.269 1.777 2.845 0.145 6 0 "[ . 1 .]" 2
3 1 57 PHE H 1 61 SER O 2.200 . 2.700 2.108 1.938 2.228 . 0 0 "[ . 1 .]" 2
4 1 57 PHE O 1 61 SER H 2.200 . 2.700 2.802 2.728 2.873 0.173 8 0 "[ . 1 .]" 2
5 1 64 LYS H 1 72 TYR O 2.200 . 2.700 2.441 2.041 2.746 0.046 9 0 "[ . 1 .]" 2
6 1 66 ILE H 1 70 GLY O 2.200 . 2.700 2.304 2.021 2.722 0.022 11 0 "[ . 1 .]" 2
7 1 66 ILE O 1 69 GLN H 2.200 . 2.700 1.782 1.736 1.905 . 0 0 "[ . 1 .]" 2
8 1 66 ILE O 1 70 GLY H 2.200 . 2.700 2.296 2.075 2.634 . 0 0 "[ . 1 .]" 2
9 1 71 THR H 1 83 THR O 2.200 . 2.700 2.612 2.165 2.774 0.074 8 0 "[ . 1 .]" 2
10 1 64 LYS O 1 72 TYR H 2.200 . 2.700 2.512 2.188 2.725 0.025 1 0 "[ . 1 .]" 2
11 1 73 THR H 1 81 THR O 2.200 . 2.700 2.364 2.067 2.723 0.023 6 0 "[ . 1 .]" 2
12 1 62 LYS O 1 74 ILE H 2.200 . 2.700 2.182 1.857 2.751 0.051 4 0 "[ . 1 .]" 2
13 1 75 VAL O 1 78 GLY H 2.200 . 2.700 1.997 1.825 2.137 . 0 0 "[ . 1 .]" 2
14 1 75 VAL O 1 79 THR H 2.200 . 2.700 2.732 2.515 2.794 0.094 14 0 "[ . 1 .]" 2
15 1 73 THR O 1 81 THR H 2.200 . 2.700 2.090 1.745 2.703 0.003 5 0 "[ . 1 .]" 2
16 1 71 THR O 1 83 THR H 2.200 . 2.700 2.810 2.746 2.872 0.172 15 0 "[ . 1 .]" 2
17 1 95 VAL H 1 111 TYR O 2.200 . 2.700 2.253 1.936 2.731 0.031 4 0 "[ . 1 .]" 2
18 1 97 VAL H 1 109 ALA O 2.200 . 2.700 2.212 1.790 2.746 0.046 8 0 "[ . 1 .]" 2
19 1 99 ARG H 1 107 VAL O 2.200 . 2.700 2.610 2.344 2.753 0.053 5 0 "[ . 1 .]" 2
20 1 101 ASP H 1 105 THR O 2.200 . 2.700 2.177 2.038 2.369 . 0 0 "[ . 1 .]" 2
21 1 101 ASP OD1 1 105 THR H 2.200 . 2.700 2.127 1.697 2.827 0.127 14 0 "[ . 1 .]" 2
22 1 99 ARG O 1 107 VAL H 2.200 . 2.700 2.053 1.803 2.262 . 0 0 "[ . 1 .]" 2
23 1 69 GLN O 1 85 ASP H 2.200 . 2.700 2.173 1.689 2.799 0.099 8 0 "[ . 1 .]" 2
24 1 50 ASP O 1 53 VAL H 2.200 . 2.700 2.774 2.734 2.818 0.118 12 0 "[ . 1 .]" 2
25 1 44 ASP O 1 47 VAL H 2.200 . 2.700 2.594 2.048 2.962 0.262 7 0 "[ . 1 .]" 2
26 1 69 GLN QE 1 93 ASP O 2.200 . 2.700 2.703 2.602 2.825 0.125 11 0 "[ . 1 .]" 2
27 1 69 GLN QE 1 72 TYR OH 2.200 . 2.700 2.291 1.762 2.699 . 0 0 "[ . 1 .]" 2
28 1 54 GLU O 1 100 VAL H 2.200 . 2.700 2.846 2.765 2.949 0.249 5 0 "[ . 1 .]" 2
29 1 54 GLU OE1 1 56 THR HG1 2.200 . 2.700 2.676 2.093 2.788 0.088 7 0 "[ . 1 .]" 2
stop_
save_
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