NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
511414 |
2kyl   |
16967 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2kyl
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 1262
_Distance_constraint_stats_list.Viol_count 2125
_Distance_constraint_stats_list.Viol_total 1897.974
_Distance_constraint_stats_list.Viol_max 0.406
_Distance_constraint_stats_list.Viol_rms 0.0468
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0150
_Distance_constraint_stats_list.Viol_average_violations_only 0.0893
_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 4 MET 0.211 0.055 8 0 "[ . 1]"
1 5 ARG 0.874 0.079 6 0 "[ . 1]"
1 6 PRO 1.291 0.078 6 0 "[ . 1]"
1 7 PRO 1.079 0.140 6 0 "[ . 1]"
1 8 ILE 4.358 0.133 8 0 "[ . 1]"
1 9 ILE 7.267 0.327 6 0 "[ . 1]"
1 10 ILE 7.923 0.214 10 0 "[ . 1]"
1 11 HIS 3.199 0.166 2 0 "[ . 1]"
1 12 ARG 4.518 0.243 4 0 "[ . 1]"
1 13 ALA 0.533 0.102 10 0 "[ . 1]"
1 15 LYS 2.129 0.246 3 0 "[ . 1]"
1 16 LYS 2.220 0.296 1 0 "[ . 1]"
1 17 TYR 4.641 0.342 3 0 "[ . 1]"
1 18 GLY 2.549 0.249 7 0 "[ . 1]"
1 19 PHE 6.316 0.341 8 0 "[ . 1]"
1 20 THR 7.681 0.341 8 0 "[ . 1]"
1 21 LEU 1.245 0.140 1 0 "[ . 1]"
1 22 ARG 4.233 0.310 2 0 "[ . 1]"
1 23 ALA 1.728 0.229 5 0 "[ . 1]"
1 24 ILE 0.980 0.070 10 0 "[ . 1]"
1 25 ARG 0.313 0.102 2 0 "[ . 1]"
1 26 VAL 1.979 0.130 9 0 "[ . 1]"
1 27 TYR 3.844 0.247 6 0 "[ . 1]"
1 28 MET 7.621 0.263 4 0 "[ . 1]"
1 30 ASP 0.030 0.023 8 0 "[ . 1]"
1 31 SER 0.455 0.152 2 0 "[ . 1]"
1 32 ASP 2.345 0.237 6 0 "[ . 1]"
1 33 VAL 5.876 0.237 6 0 "[ . 1]"
1 34 TYR 4.894 0.220 8 0 "[ . 1]"
1 35 THR 3.661 0.220 8 0 "[ . 1]"
1 36 VAL 0.464 0.060 2 0 "[ . 1]"
1 37 HIS 1.818 0.177 2 0 "[ . 1]"
1 38 HIS 1.107 0.177 2 0 "[ . 1]"
1 39 MET 1.965 0.113 10 0 "[ . 1]"
1 40 VAL 2.210 0.136 10 0 "[ . 1]"
1 41 TRP 3.106 0.163 5 0 "[ . 1]"
1 42 HIS 2.528 0.267 10 0 "[ . 1]"
1 43 VAL 0.442 0.099 10 0 "[ . 1]"
1 44 GLU 0.642 0.078 3 0 "[ . 1]"
1 45 ASP 0.000 0.000 . 0 "[ . 1]"
1 46 GLY 0.043 0.025 3 0 "[ . 1]"
1 47 GLY 0.511 0.082 10 0 "[ . 1]"
1 48 PRO 1.246 0.079 10 0 "[ . 1]"
1 49 ALA 6.477 0.278 7 0 "[ . 1]"
1 50 SER 1.605 0.202 4 0 "[ . 1]"
1 51 GLU 7.180 0.278 7 0 "[ . 1]"
1 52 ALA 1.375 0.073 10 0 "[ . 1]"
1 53 GLY 3.253 0.115 1 0 "[ . 1]"
1 54 LEU 8.223 0.230 7 0 "[ . 1]"
1 55 ARG 6.148 0.230 7 0 "[ . 1]"
1 56 GLN 6.729 0.267 10 0 "[ . 1]"
1 57 GLY 1.305 0.113 10 0 "[ . 1]"
1 58 ASP 3.382 0.245 5 0 "[ . 1]"
1 59 LEU 6.010 0.245 5 0 "[ . 1]"
1 60 ILE 5.564 0.163 6 0 "[ . 1]"
1 61 THR 0.405 0.097 1 0 "[ . 1]"
1 62 HIS 2.476 0.169 1 0 "[ . 1]"
1 63 VAL 0.353 0.063 10 0 "[ . 1]"
1 64 ASN 1.796 0.186 7 0 "[ . 1]"
1 65 GLY 0.012 0.007 6 0 "[ . 1]"
1 66 GLU 4.059 0.169 1 0 "[ . 1]"
1 67 PRO 1.645 0.117 6 0 "[ . 1]"
1 68 VAL 1.945 0.119 4 0 "[ . 1]"
1 69 HIS 0.377 0.060 8 0 "[ . 1]"
1 70 GLY 0.000 0.000 . 0 "[ . 1]"
1 71 LEU 9.136 0.375 9 0 "[ . 1]"
1 72 VAL 3.867 0.341 2 0 "[ . 1]"
1 73 HIS 0.702 0.056 4 0 "[ . 1]"
1 74 THR 3.995 0.128 6 0 "[ . 1]"
1 75 GLU 14.093 0.375 9 0 "[ . 1]"
1 76 VAL 2.611 0.111 3 0 "[ . 1]"
1 77 VAL 3.537 0.158 2 0 "[ . 1]"
1 78 GLU 13.295 0.406 7 0 "[ . 1]"
1 79 LEU 7.075 0.406 7 0 "[ . 1]"
1 80 ILE 10.271 0.298 10 0 "[ . 1]"
1 81 LEU 5.415 0.250 8 0 "[ . 1]"
1 82 LYS 0.840 0.093 5 0 "[ . 1]"
1 83 SER 1.718 0.186 7 0 "[ . 1]"
1 84 GLY 0.000 0.000 . 0 "[ . 1]"
1 85 ASN 2.067 0.199 4 0 "[ . 1]"
1 86 LYS 12.271 0.383 10 0 "[ . 1]"
1 87 VAL 10.180 0.383 10 0 "[ . 1]"
1 88 ALA 4.888 0.290 8 0 "[ . 1]"
1 89 ILE 6.893 0.297 7 0 "[ . 1]"
1 90 SER 1.476 0.103 9 0 "[ . 1]"
1 91 THR 3.274 0.196 7 0 "[ . 1]"
1 92 THR 1.060 0.099 9 0 "[ . 1]"
1 93 PRO 2.810 0.175 5 0 "[ . 1]"
1 94 LEU 2.797 0.175 5 0 "[ . 1]"
1 95 GLU 3.507 0.274 4 0 "[ . 1]"
1 96 ASN 2.524 0.274 4 0 "[ . 1]"
2 2 PHE 0.000 0.000 . 0 "[ . 1]"
2 9 GLN 0.004 0.004 2 0 "[ . 1]"
2 10 ILE 1.350 0.229 5 0 "[ . 1]"
2 11 THR 1.569 0.208 9 0 "[ . 1]"
2 12 LYS 0.000 0.000 . 0 "[ . 1]"
2 13 VAL 3.322 0.342 3 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 4 MET HA 1 5 ARG H 2.696 . 3.604 3.546 3.523 3.572 . 0 0 "[ . 1]" 1
2 1 4 MET HG3 1 5 ARG QD 1.879 . 2.320 2.324 2.231 2.375 0.055 8 0 "[ . 1]" 1
3 1 5 ARG HA 1 5 ARG HB2 2.273 . 2.919 2.985 2.968 2.998 0.079 6 0 "[ . 1]" 1
4 1 5 ARG HA 1 6 PRO HD2 2.528 . 3.327 2.047 1.911 2.121 . 0 0 "[ . 1]" 1
5 1 5 ARG HA 1 6 PRO HD3 2.511 . 3.299 2.398 2.324 2.529 . 0 0 "[ . 1]" 1
6 1 5 ARG HB2 1 5 ARG QD 2.481 . 3.250 2.287 2.194 2.361 . 0 0 "[ . 1]" 1
7 1 5 ARG HB3 1 5 ARG QD 2.521 . 3.315 3.279 3.203 3.305 . 0 0 "[ . 1]" 1
8 1 5 ARG QD 1 5 ARG QG 2.209 . 2.819 2.086 2.077 2.091 . 0 0 "[ . 1]" 1
9 1 5 ARG QG 1 92 THR HB 2.818 . 3.811 2.866 2.463 3.598 . 0 0 "[ . 1]" 1
10 1 6 PRO HA 1 6 PRO HB2 2.485 . 3.257 2.716 2.701 2.737 . 0 0 "[ . 1]" 1
11 1 6 PRO HA 1 6 PRO HB3 2.535 . 3.338 2.295 2.285 2.302 . 0 0 "[ . 1]" 1
12 1 6 PRO HA 1 6 PRO HG3 2.891 . 3.936 4.004 3.990 4.014 0.078 6 0 "[ . 1]" 1
13 1 6 PRO HB2 1 6 PRO HD2 3.065 . 4.239 4.041 4.032 4.050 . 0 0 "[ . 1]" 1
14 1 6 PRO HB3 1 6 PRO HD2 2.794 . 3.770 3.831 3.825 3.838 0.068 5 0 "[ . 1]" 1
15 1 6 PRO HB3 1 6 PRO HD3 2.378 . 3.085 2.900 2.875 2.923 . 0 0 "[ . 1]" 1
16 1 6 PRO HD2 1 6 PRO HG2 2.479 . 3.247 2.312 2.305 2.323 . 0 0 "[ . 1]" 1
17 1 6 PRO HD2 1 6 PRO HG3 2.256 . 2.892 2.688 2.673 2.701 . 0 0 "[ . 1]" 1
18 1 6 PRO HD3 1 6 PRO HG2 2.336 . 3.018 2.994 2.988 3.003 . 0 0 "[ . 1]" 1
19 1 6 PRO HD3 1 6 PRO HG3 2.401 . 3.121 2.317 2.307 2.329 . 0 0 "[ . 1]" 1
20 1 7 PRO HA 1 7 PRO HB3 2.480 . 3.249 2.269 2.259 2.275 . 0 0 "[ . 1]" 1
21 1 7 PRO HA 1 8 ILE H 2.203 . 2.810 2.202 2.172 2.233 . 0 0 "[ . 1]" 1
22 1 7 PRO HA 1 91 THR H 2.828 . 3.828 3.202 3.071 3.384 . 0 0 "[ . 1]" 1
23 1 7 PRO HB2 1 7 PRO QD 2.858 . 3.879 2.911 2.897 2.935 . 0 0 "[ . 1]" 1
24 1 7 PRO HB2 1 8 ILE H 2.753 . 3.701 3.341 3.259 3.421 . 0 0 "[ . 1]" 1
25 1 7 PRO HB2 1 88 ALA MB 2.355 . 3.048 2.076 1.989 2.223 . 0 0 "[ . 1]" 1
26 1 7 PRO HB3 1 7 PRO QD 2.799 . 3.778 3.526 3.520 3.532 . 0 0 "[ . 1]" 1
27 1 7 PRO HB3 1 7 PRO HG2 2.184 . 2.780 2.688 2.677 2.711 . 0 0 "[ . 1]" 1
28 1 7 PRO HB3 1 8 ILE H 2.571 . 3.397 3.103 3.026 3.230 . 0 0 "[ . 1]" 1
29 1 7 PRO HB3 1 88 ALA HA 2.716 . 3.638 3.649 3.558 3.687 0.049 6 0 "[ . 1]" 1
30 1 7 PRO HB3 1 89 ILE H 3.040 . 4.195 3.391 3.212 3.587 . 0 0 "[ . 1]" 1
31 1 7 PRO QD 1 7 PRO HG2 2.268 . 2.911 2.189 2.187 2.194 . 0 0 "[ . 1]" 1
32 1 7 PRO QD 1 7 PRO HG3 2.407 . 3.131 2.239 2.234 2.241 . 0 0 "[ . 1]" 1
33 1 7 PRO QD 1 8 ILE H 3.474 . 4.982 4.902 4.868 4.933 . 0 0 "[ . 1]" 1
34 1 7 PRO HG2 1 88 ALA MB 2.149 . 2.726 2.815 2.791 2.866 0.140 6 0 "[ . 1]" 1
35 1 8 ILE H 1 8 ILE HA 2.609 . 3.460 2.908 2.897 2.916 . 0 0 "[ . 1]" 1
36 1 8 ILE H 1 8 ILE HB 2.229 . 2.850 2.511 2.467 2.563 . 0 0 "[ . 1]" 1
37 1 8 ILE H 1 8 ILE MD 2.759 . 3.710 3.664 3.521 3.752 0.042 8 0 "[ . 1]" 1
38 1 8 ILE H 1 8 ILE HG12 2.628 . 3.492 2.294 2.163 2.347 . 0 0 "[ . 1]" 1
39 1 8 ILE H 1 9 ILE H 2.909 . 3.967 4.038 4.000 4.072 0.105 2 0 "[ . 1]" 1
40 1 8 ILE H 1 88 ALA MB 3.155 . 4.400 4.302 4.179 4.401 0.001 5 0 "[ . 1]" 1
41 1 8 ILE H 1 89 ILE H 2.822 . 3.818 2.550 2.419 2.726 . 0 0 "[ . 1]" 1
42 1 8 ILE H 1 89 ILE HB 2.954 . 4.045 3.107 3.026 3.263 . 0 0 "[ . 1]" 1
43 1 8 ILE H 1 90 SER HA 2.917 . 3.981 3.425 3.337 3.528 . 0 0 "[ . 1]" 1
44 1 8 ILE HA 1 8 ILE HB 2.310 . 2.977 3.015 3.009 3.018 0.041 8 0 "[ . 1]" 1
45 1 8 ILE HA 1 8 ILE MD 2.036 . 2.554 2.301 2.238 2.344 . 0 0 "[ . 1]" 1
46 1 8 ILE HA 1 8 ILE HG12 2.316 . 2.986 2.921 2.849 3.001 0.015 6 0 "[ . 1]" 1
47 1 8 ILE HA 1 8 ILE HG13 2.762 . 3.715 3.808 3.796 3.825 0.110 6 0 "[ . 1]" 1
48 1 8 ILE HA 1 8 ILE MG 2.243 . 2.872 2.328 2.256 2.418 . 0 0 "[ . 1]" 1
49 1 8 ILE HA 1 9 ILE H 1.883 . 2.326 2.294 2.273 2.317 . 0 0 "[ . 1]" 1
50 1 8 ILE HA 1 89 ILE H 3.480 . 4.994 4.286 4.200 4.396 . 0 0 "[ . 1]" 1
51 1 8 ILE HB 1 8 ILE HG12 2.173 . 2.763 2.569 2.548 2.592 . 0 0 "[ . 1]" 1
52 1 8 ILE HB 1 8 ILE HG13 2.256 . 2.892 2.342 2.327 2.356 . 0 0 "[ . 1]" 1
53 1 8 ILE HB 1 8 ILE MG 1.866 . 2.301 2.113 2.103 2.120 . 0 0 "[ . 1]" 1
54 1 8 ILE HB 1 10 ILE MD 2.500 . 3.281 3.137 2.967 3.201 . 0 0 "[ . 1]" 1
55 1 8 ILE MD 1 8 ILE HG12 1.751 . 2.134 2.115 2.111 2.119 . 0 0 "[ . 1]" 1
56 1 8 ILE MD 1 8 ILE HG13 1.852 . 2.281 2.114 2.112 2.117 . 0 0 "[ . 1]" 1
57 1 8 ILE MD 1 53 GLY H 2.945 . 4.029 4.085 4.072 4.105 0.076 8 0 "[ . 1]" 1
58 1 8 ILE MD 1 53 GLY HA2 2.827 . 3.826 3.725 3.630 3.804 . 0 0 "[ . 1]" 1
59 1 8 ILE MD 1 53 GLY HA3 2.816 . 3.807 2.584 2.493 2.677 . 0 0 "[ . 1]" 1
60 1 8 ILE MD 1 54 LEU H 2.925 . 3.994 3.110 3.043 3.152 . 0 0 "[ . 1]" 1
61 1 8 ILE MD 1 54 LEU HA 2.334 . 3.015 2.595 2.519 2.683 . 0 0 "[ . 1]" 1
62 1 8 ILE MD 1 55 ARG H 2.886 . 3.927 4.038 4.002 4.060 0.133 8 0 "[ . 1]" 1
63 1 8 ILE HG12 1 91 THR H 3.406 . 4.856 3.444 3.314 3.596 . 0 0 "[ . 1]" 1
64 1 8 ILE HG12 1 91 THR MG 2.501 . 3.283 3.168 3.029 3.307 0.024 10 0 "[ . 1]" 1
65 1 8 ILE MG 1 52 ALA HA 2.660 . 3.544 3.600 3.576 3.617 0.073 10 0 "[ . 1]" 1
66 1 8 ILE MG 1 52 ALA MB 1.711 . 2.077 1.861 1.770 1.894 . 0 0 "[ . 1]" 1
67 1 8 ILE MG 1 54 LEU H 2.461 . 3.218 2.258 2.169 2.361 . 0 0 "[ . 1]" 1
68 1 8 ILE MG 1 54 LEU HA 2.688 . 3.591 2.563 2.439 2.801 . 0 0 "[ . 1]" 1
69 1 9 ILE H 1 9 ILE HA 2.761 . 3.714 2.833 2.822 2.843 . 0 0 "[ . 1]" 1
70 1 9 ILE H 1 9 ILE HB 2.159 . 2.742 2.382 2.354 2.431 . 0 0 "[ . 1]" 1
71 1 9 ILE H 1 9 ILE MD 2.527 . 3.325 2.006 1.931 2.091 . 0 0 "[ . 1]" 1
72 1 9 ILE H 1 9 ILE HG12 2.556 . 3.373 3.661 3.618 3.700 0.327 6 0 "[ . 1]" 1
73 1 9 ILE H 1 52 ALA HA 3.406 . 4.856 4.878 4.838 4.902 0.046 6 0 "[ . 1]" 1
74 1 9 ILE H 1 52 ALA MB 2.567 . 3.391 3.361 3.311 3.391 . 10 0 "[ . 1]" 1
75 1 9 ILE HA 1 10 ILE H 2.153 . 2.733 2.180 2.168 2.195 . 0 0 "[ . 1]" 1
76 1 9 ILE HB 1 9 ILE MD 2.204 . 2.811 2.610 2.538 2.667 . 0 0 "[ . 1]" 1
77 1 9 ILE HB 1 9 ILE HG12 2.223 . 2.841 2.339 2.309 2.372 . 0 0 "[ . 1]" 1
78 1 9 ILE HB 1 9 ILE HG13 2.228 . 2.848 2.998 2.988 3.006 0.158 6 0 "[ . 1]" 1
79 1 9 ILE HB 1 9 ILE MG 1.811 . 2.221 2.109 2.096 2.120 . 0 0 "[ . 1]" 1
80 1 9 ILE MD 1 9 ILE HG13 1.849 . 2.276 2.117 2.114 2.121 . 0 0 "[ . 1]" 1
81 1 9 ILE MD 1 88 ALA HA 2.526 . 3.323 2.294 2.129 2.454 . 0 0 "[ . 1]" 1
82 1 9 ILE MD 1 88 ALA MB 1.847 . 2.273 2.305 2.275 2.331 0.058 9 0 "[ . 1]" 1
83 1 9 ILE HG12 1 9 ILE MG 1.851 . 2.279 2.352 2.321 2.394 0.115 1 0 "[ . 1]" 1
84 1 9 ILE HG13 1 9 ILE MG 1.972 . 2.458 2.278 2.213 2.321 . 0 0 "[ . 1]" 1
85 1 9 ILE MG 1 10 ILE H 2.455 . 3.209 3.285 3.267 3.307 0.098 6 0 "[ . 1]" 1
86 1 9 ILE MG 1 11 HIS HD2 3.171 . 4.428 2.831 2.360 3.338 . 0 0 "[ . 1]" 1
87 1 9 ILE MG 1 86 LYS HB2 2.363 . 3.061 2.043 1.963 2.105 . 0 0 "[ . 1]" 1
88 1 9 ILE MG 1 86 LYS HB3 2.750 . 3.695 3.210 3.143 3.269 . 0 0 "[ . 1]" 1
89 1 9 ILE MG 1 86 LYS QE 2.429 . 3.167 3.107 2.927 3.209 0.042 6 0 "[ . 1]" 1
90 1 9 ILE MG 1 87 VAL H 2.768 . 3.725 3.366 3.223 3.465 . 0 0 "[ . 1]" 1
91 1 10 ILE H 1 10 ILE HA 2.795 . 3.772 2.908 2.902 2.918 . 0 0 "[ . 1]" 1
92 1 10 ILE H 1 10 ILE MD 2.857 . 3.877 3.418 3.371 3.444 . 0 0 "[ . 1]" 1
93 1 10 ILE H 1 10 ILE HG13 2.290 . 2.945 2.217 2.180 2.250 . 0 0 "[ . 1]" 1
94 1 10 ILE H 1 17 TYR QD 3.644 . 5.304 5.267 5.166 5.360 0.056 2 0 "[ . 1]" 1
95 1 10 ILE H 1 49 ALA HA 3.537 . 5.100 5.293 5.276 5.314 0.214 10 0 "[ . 1]" 1
96 1 10 ILE H 1 87 VAL MG1 2.682 . 3.581 2.742 2.650 2.789 . 0 0 "[ . 1]" 1
97 1 10 ILE H 1 88 ALA HA 2.831 . 3.833 3.595 3.465 3.754 . 0 0 "[ . 1]" 1
98 1 10 ILE H 1 89 ILE H 3.077 . 4.261 3.930 3.786 4.094 . 0 0 "[ . 1]" 1
99 1 10 ILE HA 1 10 ILE MD 3.060 . 4.230 3.898 3.888 3.914 . 0 0 "[ . 1]" 1
100 1 10 ILE HA 1 10 ILE HG13 2.212 . 2.824 2.913 2.901 2.926 0.102 7 0 "[ . 1]" 1
101 1 10 ILE HA 1 10 ILE MG 2.263 . 2.903 2.286 2.265 2.313 . 0 0 "[ . 1]" 1
102 1 10 ILE HA 1 11 HIS H 2.085 . 2.628 2.126 2.082 2.170 . 0 0 "[ . 1]" 1
103 1 10 ILE HA 1 11 HIS HB2 3.063 . 4.236 4.364 4.321 4.402 0.166 2 0 "[ . 1]" 1
104 1 10 ILE HB 1 10 ILE MG 2.219 . 2.835 2.128 2.124 2.130 . 0 0 "[ . 1]" 1
105 1 10 ILE HB 1 17 TYR QD 2.873 . 3.905 3.168 2.934 3.320 . 0 0 "[ . 1]" 1
106 1 10 ILE HB 1 87 VAL H 2.514 . 3.304 3.382 3.363 3.412 0.108 1 0 "[ . 1]" 1
107 1 10 ILE HB 1 87 VAL MG1 2.026 . 2.539 2.069 2.041 2.116 . 0 0 "[ . 1]" 1
108 1 10 ILE MD 1 10 ILE HG13 1.739 . 2.117 2.119 2.118 2.121 0.004 7 0 "[ . 1]" 1
109 1 10 ILE MD 1 10 ILE MG 1.909 . 2.365 2.048 2.015 2.075 . 0 0 "[ . 1]" 1
110 1 10 ILE MD 1 17 TYR HB2 2.963 . 4.060 3.705 3.472 3.854 . 0 0 "[ . 1]" 1
111 1 10 ILE MD 1 19 PHE QD 2.420 . 3.152 2.756 2.613 2.881 . 0 0 "[ . 1]" 1
112 1 10 ILE MD 1 19 PHE QE 2.352 . 3.044 2.421 2.208 2.545 . 0 0 "[ . 1]" 1
113 1 10 ILE MD 1 49 ALA HA 2.416 . 3.145 2.857 2.785 2.908 . 0 0 "[ . 1]" 1
114 1 10 ILE MD 1 54 LEU H 3.060 . 4.230 4.287 4.266 4.308 0.078 5 0 "[ . 1]" 1
115 1 10 ILE MD 1 54 LEU MD1 2.115 . 2.674 1.957 1.910 2.014 . 0 0 "[ . 1]" 1
116 1 10 ILE HG12 1 10 ILE MG 1.788 . 2.188 2.286 2.274 2.299 0.111 7 0 "[ . 1]" 1
117 1 10 ILE HG12 1 49 ALA HA 2.131 . 2.699 1.837 1.824 1.856 . 0 0 "[ . 1]" 1
118 1 10 ILE HG13 1 87 VAL MG1 2.922 . 3.989 3.410 3.309 3.468 . 0 0 "[ . 1]" 1
119 1 10 ILE MG 1 11 HIS H 2.259 . 2.897 2.576 2.436 2.732 . 0 0 "[ . 1]" 1
120 1 10 ILE MG 1 17 TYR HB2 2.567 . 3.391 3.206 2.937 3.393 0.002 1 0 "[ . 1]" 1
121 1 10 ILE MG 1 17 TYR HB3 2.863 . 3.888 1.860 1.778 1.916 0.060 8 0 "[ . 1]" 1
122 1 10 ILE MG 1 17 TYR QD 2.165 . 2.751 2.277 2.120 2.512 . 0 0 "[ . 1]" 1
123 1 10 ILE MG 1 48 PRO HA 2.830 . 3.831 3.873 3.849 3.910 0.079 10 0 "[ . 1]" 1
124 1 10 ILE MG 1 48 PRO HB2 2.531 . 3.332 2.184 2.102 2.298 . 0 0 "[ . 1]" 1
125 1 10 ILE MG 1 48 PRO HB3 2.385 . 3.096 2.913 2.857 2.987 . 0 0 "[ . 1]" 1
126 1 10 ILE MG 1 49 ALA H 2.708 . 3.625 2.672 2.622 2.733 . 0 0 "[ . 1]" 1
127 1 10 ILE MG 1 49 ALA HA 2.221 . 2.838 2.123 2.033 2.222 . 0 0 "[ . 1]" 1
128 1 10 ILE MG 1 49 ALA MB 2.268 . 2.911 2.159 2.064 2.262 . 0 0 "[ . 1]" 1
129 1 10 ILE MG 1 87 VAL MG1 2.439 . 3.183 3.179 3.143 3.241 0.058 3 0 "[ . 1]" 1
130 1 11 HIS H 1 11 HIS HA 2.744 . 3.685 2.893 2.866 2.912 . 0 0 "[ . 1]" 1
131 1 11 HIS H 1 11 HIS HB2 2.479 . 3.247 2.287 2.228 2.333 . 0 0 "[ . 1]" 1
132 1 11 HIS H 1 11 HIS HD2 2.905 . 3.960 3.557 3.127 4.026 0.066 6 0 "[ . 1]" 1
133 1 11 HIS H 1 48 PRO HB2 3.272 . 4.610 3.682 3.463 3.913 . 0 0 "[ . 1]" 1
134 1 11 HIS H 1 49 ALA HA 3.436 . 4.911 4.686 4.543 4.881 . 0 0 "[ . 1]" 1
135 1 11 HIS H 1 52 ALA MB 2.577 . 3.407 3.409 3.312 3.460 0.053 4 0 "[ . 1]" 1
136 1 11 HIS HA 1 11 HIS HB2 2.510 . 3.297 3.013 3.004 3.019 . 0 0 "[ . 1]" 1
137 1 11 HIS HA 1 11 HIS HB3 2.542 . 3.349 2.564 2.516 2.631 . 0 0 "[ . 1]" 1
138 1 11 HIS HA 1 12 ARG H 2.133 . 2.702 2.280 2.240 2.322 . 0 0 "[ . 1]" 1
139 1 11 HIS HA 1 86 LYS H 3.281 . 4.626 4.706 4.659 4.766 0.140 3 0 "[ . 1]" 1
140 1 11 HIS HA 1 86 LYS HA 2.793 . 3.768 2.348 2.260 2.448 . 0 0 "[ . 1]" 1
141 1 11 HIS HA 1 86 LYS HB2 2.608 . 3.458 3.328 3.209 3.468 0.010 1 0 "[ . 1]" 1
142 1 11 HIS HA 1 86 LYS HB3 2.766 . 3.722 2.642 2.382 2.997 . 0 0 "[ . 1]" 1
143 1 11 HIS HA 1 87 VAL H 2.977 . 4.085 3.843 3.712 3.985 . 0 0 "[ . 1]" 1
144 1 11 HIS HB2 1 11 HIS HD2 2.822 . 3.818 3.744 3.659 3.906 0.088 6 0 "[ . 1]" 1
145 1 11 HIS HB3 1 11 HIS HD2 2.651 . 3.529 3.574 3.224 3.660 0.131 5 0 "[ . 1]" 1
146 1 11 HIS HB3 1 12 ARG H 2.475 . 3.241 2.812 2.672 2.956 . 0 0 "[ . 1]" 1
147 1 12 ARG H 1 12 ARG HA 2.680 . 3.578 2.828 2.804 2.854 . 0 0 "[ . 1]" 1
148 1 12 ARG H 1 12 ARG HB2 2.745 . 3.687 3.539 3.524 3.556 . 0 0 "[ . 1]" 1
149 1 12 ARG H 1 12 ARG HB3 2.201 . 2.807 2.555 2.487 2.603 . 0 0 "[ . 1]" 1
150 1 12 ARG H 1 12 ARG HD2 3.161 . 4.410 4.631 4.584 4.653 0.243 4 0 "[ . 1]" 1
151 1 12 ARG H 1 12 ARG HG2 2.905 . 3.960 2.034 1.958 2.101 . 0 0 "[ . 1]" 1
152 1 12 ARG H 1 12 ARG HG3 3.063 . 4.236 2.971 2.802 3.085 . 0 0 "[ . 1]" 1
153 1 12 ARG H 1 17 TYR QE 2.988 . 4.104 4.064 3.858 4.138 0.034 1 0 "[ . 1]" 1
154 1 12 ARG H 1 86 LYS HA 2.620 . 3.478 3.209 3.106 3.318 . 0 0 "[ . 1]" 1
155 1 12 ARG H 1 87 VAL MG1 3.544 . 5.114 5.165 5.128 5.192 0.078 9 0 "[ . 1]" 1
156 1 12 ARG HA 1 12 ARG HB2 2.955 . 4.047 2.472 2.442 2.502 . 0 0 "[ . 1]" 1
157 1 12 ARG HA 1 12 ARG HB3 2.950 . 4.038 2.429 2.411 2.461 . 0 0 "[ . 1]" 1
158 1 12 ARG HA 1 17 TYR QD 2.916 . 3.979 2.856 2.540 3.215 . 0 0 "[ . 1]" 1
159 1 12 ARG HB2 1 12 ARG HD2 2.421 . 3.154 2.352 2.286 2.492 . 0 0 "[ . 1]" 1
160 1 12 ARG HB2 1 12 ARG HD3 2.426 . 3.162 2.875 2.806 2.948 . 0 0 "[ . 1]" 1
161 1 12 ARG HB2 1 12 ARG HG2 2.632 . 3.498 2.996 2.991 3.001 . 0 0 "[ . 1]" 1
162 1 12 ARG HB2 1 12 ARG HG3 2.819 . 3.812 2.517 2.487 2.548 . 0 0 "[ . 1]" 1
163 1 12 ARG HB2 1 85 ASN HA 2.842 . 3.852 4.010 3.940 4.051 0.199 4 0 "[ . 1]" 1
164 1 12 ARG HB3 1 12 ARG HD2 2.449 . 3.199 3.146 3.063 3.214 0.015 8 0 "[ . 1]" 1
165 1 12 ARG HB3 1 12 ARG HD3 2.461 . 3.218 2.577 2.466 2.677 . 0 0 "[ . 1]" 1
166 1 12 ARG HB3 1 12 ARG HG2 2.638 . 3.508 2.365 2.339 2.389 . 0 0 "[ . 1]" 1
167 1 12 ARG HB3 1 12 ARG HG3 2.812 . 3.800 3.001 2.992 3.007 . 0 0 "[ . 1]" 1
168 1 12 ARG HB3 1 17 TYR QE 2.782 . 3.750 3.153 2.944 3.444 . 0 0 "[ . 1]" 1
169 1 12 ARG HD2 1 12 ARG HG2 2.558 . 3.376 2.994 2.987 2.999 . 0 0 "[ . 1]" 1
170 1 12 ARG HD2 1 12 ARG HG3 2.515 . 3.305 2.427 2.363 2.474 . 0 0 "[ . 1]" 1
171 1 12 ARG HD3 1 12 ARG HG2 2.576 . 3.406 2.439 2.395 2.500 . 0 0 "[ . 1]" 1
172 1 12 ARG HD3 1 12 ARG HG3 2.558 . 3.376 3.008 3.003 3.014 . 0 0 "[ . 1]" 1
173 1 12 ARG HD3 1 12 ARG HH11 2.984 . 4.097 2.011 1.832 2.184 0.039 6 0 "[ . 1]" 1
174 1 12 ARG HD3 1 12 ARG HH12 3.101 . 4.303 3.549 3.408 3.684 . 0 0 "[ . 1]" 1
175 1 13 ALA HA 1 13 ALA MB 2.169 . 2.757 2.123 2.106 2.129 . 0 0 "[ . 1]" 1
176 1 13 ALA MB 1 17 TYR H 3.276 . 4.618 4.618 4.282 4.720 0.102 10 0 "[ . 1]" 1
177 1 13 ALA MB 1 48 PRO HB3 2.884 . 3.923 3.788 3.593 3.951 0.028 5 0 "[ . 1]" 1
178 1 13 ALA MB 1 48 PRO HD2 3.013 . 4.148 3.519 3.277 3.647 . 0 0 "[ . 1]" 1
179 1 13 ALA MB 1 48 PRO HD3 2.994 . 4.114 3.262 2.858 3.616 . 0 0 "[ . 1]" 1
180 1 13 ALA MB 1 48 PRO HG2 2.418 . 3.149 1.928 1.860 1.988 . 0 0 "[ . 1]" 1
181 1 13 ALA MB 1 48 PRO HG3 2.507 . 3.293 2.503 2.275 3.007 . 0 0 "[ . 1]" 1
182 1 15 LYS HA 1 15 LYS HB2 2.650 . 3.528 2.842 2.288 3.020 . 0 0 "[ . 1]" 1
183 1 15 LYS HA 1 15 LYS HB3 2.153 . 2.733 2.727 2.474 2.979 0.246 3 0 "[ . 1]" 1
184 1 15 LYS HA 1 15 LYS QD 2.828 . 3.828 3.004 1.986 3.943 0.115 3 0 "[ . 1]" 1
185 1 15 LYS HA 1 15 LYS HG2 2.906 . 3.961 2.758 2.169 3.961 . 0 0 "[ . 1]" 1
186 1 15 LYS HA 1 15 LYS HG3 2.879 . 3.915 3.214 2.159 3.736 . 0 0 "[ . 1]" 1
187 1 15 LYS HB2 1 15 LYS HG3 2.246 . 2.877 2.465 2.240 2.992 0.115 1 0 "[ . 1]" 1
188 1 15 LYS HB3 1 15 LYS HG2 2.271 . 2.915 2.702 2.290 2.995 0.080 5 0 "[ . 1]" 1
189 1 15 LYS HB3 1 15 LYS HG3 2.303 . 2.966 2.694 2.459 2.998 0.032 3 0 "[ . 1]" 1
190 1 15 LYS QD 1 15 LYS HG3 1.814 . 2.225 2.276 2.146 2.393 0.168 7 0 "[ . 1]" 1
191 1 15 LYS QE 1 15 LYS HG2 2.555 . 3.371 2.498 2.179 3.302 . 0 0 "[ . 1]" 1
192 1 15 LYS QE 1 15 LYS HG3 2.658 . 3.541 2.821 2.348 3.502 . 0 0 "[ . 1]" 1
193 1 16 LYS H 1 17 TYR H 3.389 . 4.825 4.441 4.387 4.600 . 0 0 "[ . 1]" 1
194 1 16 LYS HA 1 17 TYR H 2.597 . 3.440 2.415 2.280 2.529 . 0 0 "[ . 1]" 1
195 1 16 LYS HA 1 18 GLY H 3.012 . 4.146 3.860 3.580 4.077 . 0 0 "[ . 1]" 1
196 1 16 LYS HB2 1 16 LYS QD 2.348 . 3.037 2.730 2.227 3.333 0.296 1 0 "[ . 1]" 1
197 1 16 LYS HB2 1 16 LYS QE 2.825 . 3.823 3.349 2.393 3.922 0.099 7 0 "[ . 1]" 1
198 1 16 LYS HB2 1 16 LYS QG 2.482 . 3.252 2.260 2.130 2.456 . 0 0 "[ . 1]" 1
199 1 16 LYS HB2 1 17 TYR H 2.869 . 3.898 3.306 2.370 3.873 . 0 0 "[ . 1]" 1
200 1 16 LYS HB2 1 18 GLY H 2.604 . 3.452 2.889 2.076 3.417 . 0 0 "[ . 1]" 1
201 1 16 LYS HB3 1 16 LYS QE 2.591 . 3.430 2.516 1.910 3.576 0.146 5 0 "[ . 1]" 1
202 1 16 LYS HB3 1 17 TYR H 2.955 . 4.047 2.646 2.073 3.855 . 0 0 "[ . 1]" 1
203 1 16 LYS HB3 1 18 GLY H 2.693 . 3.600 2.643 1.999 3.840 0.240 8 0 "[ . 1]" 1
204 1 16 LYS QE 1 16 LYS QG 2.329 . 3.007 2.392 2.191 2.731 . 0 0 "[ . 1]" 1
205 1 16 LYS QE 2 11 THR HA 4.952 . 6.002 6.108 5.988 6.210 0.208 9 0 "[ . 1]" 1
206 1 16 LYS QE 2 12 LYS QB 4.802 . 6.002 2.033 1.870 2.493 . 0 0 "[ . 1]" 1
207 1 16 LYS QE 2 13 VAL HA 4.950 . 6.000 3.992 2.533 5.486 . 0 0 "[ . 1]" 1
208 1 17 TYR H 1 17 TYR HB2 3.006 . 4.135 2.456 2.343 2.600 . 0 0 "[ . 1]" 1
209 1 17 TYR H 1 17 TYR HB3 2.853 . 3.870 3.652 3.579 3.748 . 0 0 "[ . 1]" 1
210 1 17 TYR H 1 17 TYR QD 3.029 . 4.176 2.533 2.267 2.731 . 0 0 "[ . 1]" 1
211 1 17 TYR H 1 18 GLY H 2.560 . 3.379 2.258 1.872 2.601 . 0 0 "[ . 1]" 1
212 1 17 TYR H 1 19 PHE H 2.939 . 4.019 3.278 3.034 3.492 . 0 0 "[ . 1]" 1
213 1 17 TYR H 1 19 PHE QD 3.207 . 4.493 4.350 4.053 4.535 0.042 9 0 "[ . 1]" 1
214 1 17 TYR HA 1 17 TYR HB2 2.695 . 3.603 3.024 3.020 3.028 . 0 0 "[ . 1]" 1
215 1 17 TYR HA 1 17 TYR HB3 2.730 . 3.662 2.506 2.452 2.562 . 0 0 "[ . 1]" 1
216 1 17 TYR HA 1 17 TYR QD 2.478 . 3.246 2.920 2.813 3.030 . 0 0 "[ . 1]" 1
217 1 17 TYR HA 1 48 PRO HB2 2.674 . 3.568 3.494 3.341 3.647 0.079 8 0 "[ . 1]" 1
218 1 17 TYR HB2 1 18 GLY H 3.337 . 4.729 3.455 3.334 3.604 . 0 0 "[ . 1]" 1
219 1 17 TYR HB2 1 19 PHE H 3.276 . 4.618 3.370 3.090 3.632 . 0 0 "[ . 1]" 1
220 1 17 TYR HB2 1 19 PHE QD 2.361 . 3.058 2.615 2.407 2.859 . 0 0 "[ . 1]" 1
221 1 17 TYR HB2 1 19 PHE QE 3.141 . 4.375 2.448 2.175 2.685 . 0 0 "[ . 1]" 1
222 1 17 TYR HB2 1 49 ALA MB 2.919 . 3.984 3.718 3.521 3.859 . 0 0 "[ . 1]" 1
223 1 17 TYR HB2 2 13 VAL MG1 4.831 . 6.001 3.332 2.727 4.313 . 0 0 "[ . 1]" 1
224 1 17 TYR HB2 2 13 VAL MG2 4.962 . 6.002 3.766 1.996 4.161 . 0 0 "[ . 1]" 1
225 1 17 TYR HB3 1 18 GLY H 3.029 . 4.176 4.187 4.126 4.235 0.059 8 0 "[ . 1]" 1
226 1 17 TYR HB3 1 19 PHE QE 3.166 . 4.419 2.991 2.787 3.181 . 0 0 "[ . 1]" 1
227 1 17 TYR HB3 2 13 VAL MG1 4.716 . 5.996 4.783 4.213 5.760 . 0 0 "[ . 1]" 1
228 1 17 TYR HB3 2 13 VAL MG2 4.959 . 5.999 4.968 3.442 5.400 . 0 0 "[ . 1]" 1
229 1 17 TYR QD 1 80 ILE MG 2.264 . 2.905 2.957 2.888 3.021 0.116 3 0 "[ . 1]" 1
230 1 17 TYR QD 1 87 VAL MG1 2.646 . 3.521 2.765 2.613 2.880 . 0 0 "[ . 1]" 1
231 1 17 TYR QD 2 13 VAL H 4.954 . 6.004 4.592 4.445 4.894 . 0 0 "[ . 1]" 1
232 1 17 TYR QD 2 13 VAL HB 4.761 . 6.001 4.219 2.004 4.840 . 0 0 "[ . 1]" 1
233 1 17 TYR QD 2 13 VAL MG1 4.349 . 5.999 2.759 2.323 3.647 . 0 0 "[ . 1]" 1
234 1 17 TYR QD 2 13 VAL MG2 4.834 . 6.004 2.032 1.908 2.279 . 0 0 "[ . 1]" 1
235 1 17 TYR QE 1 80 ILE MG 2.136 . 2.707 2.245 2.092 2.372 . 0 0 "[ . 1]" 1
236 1 17 TYR QE 1 81 LEU MD2 2.063 . 2.595 2.181 1.962 2.417 . 0 0 "[ . 1]" 1
237 1 17 TYR QE 1 81 LEU HG 2.888 . 3.931 3.194 2.740 3.687 . 0 0 "[ . 1]" 1
238 1 17 TYR QE 1 86 LYS H 3.537 . 5.100 4.692 4.483 4.814 . 0 0 "[ . 1]" 1
239 1 17 TYR QE 1 86 LYS HA 2.624 . 3.485 3.424 3.270 3.527 0.042 7 0 "[ . 1]" 1
240 1 17 TYR QE 1 87 VAL H 2.893 . 3.939 4.008 3.979 4.060 0.121 3 0 "[ . 1]" 1
241 1 17 TYR QE 1 87 VAL MG1 2.556 . 3.373 2.688 2.536 2.827 . 0 0 "[ . 1]" 1
242 1 17 TYR QE 2 13 VAL H 4.394 . 6.004 6.221 6.132 6.346 0.342 3 0 "[ . 1]" 1
243 1 17 TYR QE 2 13 VAL HB 4.898 . 5.998 4.744 3.107 5.225 . 0 0 "[ . 1]" 1
244 1 17 TYR QE 2 13 VAL MG1 4.793 . 6.003 4.037 3.754 4.453 . 0 0 "[ . 1]" 1
245 1 17 TYR QE 2 13 VAL MG2 4.963 . 6.003 2.258 1.959 4.026 . 0 0 "[ . 1]" 1
246 1 18 GLY H 1 18 GLY HA2 2.859 . 3.880 2.394 2.368 2.427 . 0 0 "[ . 1]" 1
247 1 18 GLY H 1 18 GLY HA3 2.504 . 3.288 2.923 2.907 2.941 . 0 0 "[ . 1]" 1
248 1 18 GLY H 1 19 PHE H 2.233 . 2.856 2.233 2.095 2.352 . 0 0 "[ . 1]" 1
249 1 18 GLY H 1 44 GLU HG2 3.644 . 5.304 4.853 4.381 5.364 0.060 2 0 "[ . 1]" 1
250 1 18 GLY HA3 1 19 PHE H 2.436 . 3.178 3.371 3.278 3.427 0.249 7 0 "[ . 1]" 1
251 1 19 PHE H 1 19 PHE HA 2.617 . 3.473 2.904 2.885 2.927 . 0 0 "[ . 1]" 1
252 1 19 PHE H 1 19 PHE HB2 3.029 . 4.176 3.961 3.902 3.984 . 0 0 "[ . 1]" 1
253 1 19 PHE H 1 19 PHE HB3 2.810 . 3.797 3.224 3.107 3.265 . 0 0 "[ . 1]" 1
254 1 19 PHE H 1 19 PHE QD 2.758 . 3.709 2.789 2.725 2.923 . 0 0 "[ . 1]" 1
255 1 19 PHE H 1 20 THR HA 3.682 . 5.377 4.916 4.870 4.970 . 0 0 "[ . 1]" 1
256 1 19 PHE H 1 49 ALA MB 2.836 . 3.842 3.746 3.566 3.868 0.026 1 0 "[ . 1]" 1
257 1 19 PHE HA 1 19 PHE HB2 2.493 . 3.270 2.357 2.348 2.379 . 0 0 "[ . 1]" 1
258 1 19 PHE HA 1 19 PHE HB3 2.468 . 3.230 2.482 2.465 2.491 . 0 0 "[ . 1]" 1
259 1 19 PHE HA 1 19 PHE QD 2.846 . 3.859 3.736 3.729 3.745 . 0 0 "[ . 1]" 1
260 1 19 PHE HA 1 20 THR H 2.302 . 2.964 2.294 2.200 2.367 . 0 0 "[ . 1]" 1
261 1 19 PHE HA 1 43 VAL H 3.724 . 5.457 4.780 4.747 4.826 . 0 0 "[ . 1]" 1
262 1 19 PHE HA 1 43 VAL HA 2.669 . 3.560 2.329 2.233 2.425 . 0 0 "[ . 1]" 1
263 1 19 PHE HA 1 44 GLU H 2.753 . 3.700 2.924 2.837 2.994 . 0 0 "[ . 1]" 1
264 1 19 PHE HB2 1 19 PHE QD 2.539 . 3.345 2.326 2.306 2.350 . 0 0 "[ . 1]" 1
265 1 19 PHE HB2 1 20 THR H 2.814 . 3.804 2.196 2.103 2.322 . 0 0 "[ . 1]" 1
266 1 19 PHE HB2 1 40 VAL MG2 2.677 . 3.573 2.071 1.912 2.203 . 0 0 "[ . 1]" 1
267 1 19 PHE HB2 1 44 GLU H 3.299 . 4.659 4.650 4.557 4.718 0.059 8 0 "[ . 1]" 1
268 1 19 PHE HB2 1 49 ALA MB 2.768 . 3.726 3.756 3.677 3.812 0.086 6 0 "[ . 1]" 1
269 1 19 PHE HB2 1 54 LEU MD1 2.892 . 3.937 3.226 3.102 3.312 . 0 0 "[ . 1]" 1
270 1 19 PHE HB3 1 19 PHE QD 2.582 . 3.415 2.463 2.430 2.492 . 0 0 "[ . 1]" 1
271 1 19 PHE HB3 1 20 THR H 2.523 . 3.318 3.601 3.544 3.659 0.341 8 0 "[ . 1]" 1
272 1 19 PHE HB3 1 40 VAL MG2 2.762 . 3.715 3.305 3.141 3.439 . 0 0 "[ . 1]" 1
273 1 19 PHE HB3 1 43 VAL HA 2.817 . 3.809 2.936 2.853 3.014 . 0 0 "[ . 1]" 1
274 1 19 PHE HB3 1 43 VAL MG1 2.639 . 3.509 2.707 2.469 3.041 . 0 0 "[ . 1]" 1
275 1 19 PHE HB3 1 44 GLU H 3.125 . 4.346 4.074 3.963 4.163 . 0 0 "[ . 1]" 1
276 1 19 PHE HB3 1 49 ALA MB 2.397 . 3.115 2.418 2.368 2.458 . 0 0 "[ . 1]" 1
277 1 19 PHE HB3 1 54 LEU MD1 2.772 . 3.732 3.034 2.853 3.147 . 0 0 "[ . 1]" 1
278 1 19 PHE QD 1 20 THR H 3.106 . 4.312 2.923 2.844 3.174 . 0 0 "[ . 1]" 1
279 1 19 PHE QD 1 21 LEU H 3.703 . 5.417 3.870 3.731 3.911 . 0 0 "[ . 1]" 1
280 1 19 PHE QD 1 40 VAL HA 2.968 . 4.069 3.108 3.005 3.211 . 0 0 "[ . 1]" 1
281 1 19 PHE QD 1 40 VAL MG2 2.389 . 3.102 2.282 2.147 2.402 . 0 0 "[ . 1]" 1
282 1 19 PHE QD 1 42 HIS H 3.227 . 4.528 4.244 4.092 4.334 . 0 0 "[ . 1]" 1
283 1 19 PHE QD 1 49 ALA H 3.313 . 4.685 4.304 4.216 4.422 . 0 0 "[ . 1]" 1
284 1 19 PHE QD 1 49 ALA MB 2.109 . 2.665 2.102 1.994 2.198 . 0 0 "[ . 1]" 1
285 1 19 PHE QD 1 54 LEU MD1 2.617 . 3.473 2.836 2.780 2.875 . 0 0 "[ . 1]" 1
286 1 19 PHE QE 1 21 LEU HB2 2.974 . 4.080 2.185 2.052 2.220 . 0 0 "[ . 1]" 1
287 1 19 PHE QE 1 21 LEU HB3 2.865 . 3.891 3.916 3.787 3.954 0.063 5 0 "[ . 1]" 1
288 1 19 PHE QE 1 21 LEU MD1 2.479 . 3.247 2.426 2.303 2.645 . 0 0 "[ . 1]" 1
289 1 19 PHE QE 1 21 LEU MD2 2.685 . 3.586 3.235 2.947 3.503 . 0 0 "[ . 1]" 1
290 1 19 PHE QE 1 49 ALA MB 3.053 . 4.218 3.559 3.449 3.744 . 0 0 "[ . 1]" 1
291 1 19 PHE QE 1 54 LEU MD1 2.682 . 3.581 3.120 3.004 3.226 . 0 0 "[ . 1]" 1
292 1 19 PHE QE 1 60 ILE MD 2.289 . 2.944 2.941 2.849 2.980 0.036 3 0 "[ . 1]" 1
293 1 19 PHE QE 1 87 VAL MG1 3.263 . 4.593 3.503 3.340 3.602 . 0 0 "[ . 1]" 1
294 1 19 PHE QE 1 89 ILE MD 2.104 . 2.657 2.701 2.689 2.713 0.056 6 0 "[ . 1]" 1
295 1 19 PHE QE 2 13 VAL MG1 4.466 . 5.996 2.730 2.631 2.961 . 0 0 "[ . 1]" 1
296 1 19 PHE QE 2 13 VAL MG2 4.850 . 6.000 3.921 2.481 4.267 . 0 0 "[ . 1]" 1
297 1 20 THR H 1 20 THR HB 2.485 . 3.257 2.544 2.492 2.635 . 0 0 "[ . 1]" 1
298 1 20 THR H 1 20 THR MG 2.904 . 3.958 3.829 3.799 3.871 . 0 0 "[ . 1]" 1
299 1 20 THR H 1 40 VAL MG2 2.587 . 3.423 2.950 2.846 3.086 . 0 0 "[ . 1]" 1
300 1 20 THR H 1 42 HIS H 2.220 . 2.836 2.783 2.671 2.843 0.007 7 0 "[ . 1]" 1
301 1 20 THR H 1 42 HIS HB3 3.096 . 4.294 3.621 3.501 3.738 . 0 0 "[ . 1]" 1
302 1 20 THR H 1 43 VAL H 3.494 . 5.020 4.920 4.856 5.043 0.023 10 0 "[ . 1]" 1
303 1 20 THR H 1 44 GLU H 3.406 . 4.856 4.888 4.799 4.934 0.078 3 0 "[ . 1]" 1
304 1 20 THR H 1 54 LEU MD1 3.537 . 5.100 4.986 4.857 5.105 0.005 8 0 "[ . 1]" 1
305 1 20 THR HA 1 20 THR MG 2.518 . 3.311 2.441 2.352 2.517 . 0 0 "[ . 1]" 1
306 1 20 THR HA 1 21 LEU H 2.304 . 2.967 2.143 2.133 2.152 . 0 0 "[ . 1]" 1
307 1 20 THR HA 2 12 LYS HA 3.257 . 5.997 2.285 1.951 2.582 . 0 0 "[ . 1]" 1
308 1 20 THR HB 1 20 THR MG 2.290 . 2.946 2.142 2.134 2.145 . 0 0 "[ . 1]" 1
309 1 20 THR HB 1 40 VAL MG2 3.122 . 4.340 4.203 3.981 4.377 0.037 9 0 "[ . 1]" 1
310 1 20 THR HB 1 42 HIS H 2.367 . 3.067 2.381 2.178 2.564 . 0 0 "[ . 1]" 1
311 1 20 THR HB 1 42 HIS HB2 2.682 . 3.581 3.586 3.469 3.626 0.045 9 0 "[ . 1]" 1
312 1 20 THR HB 1 42 HIS HB3 2.665 . 3.553 2.581 2.342 2.877 . 0 0 "[ . 1]" 1
313 1 20 THR HB 2 13 VAL MG1 4.882 . 6.002 6.116 6.023 6.190 0.188 4 0 "[ . 1]" 1
314 1 20 THR MG 1 21 LEU H 2.417 . 3.147 2.862 2.755 2.968 . 0 0 "[ . 1]" 1
315 1 20 THR MG 1 22 ARG HG2 1.945 . 2.418 2.658 2.587 2.728 0.310 2 0 "[ . 1]" 1
316 1 20 THR MG 1 41 TRP H 3.107 . 4.313 3.430 3.162 3.582 . 0 0 "[ . 1]" 1
317 1 20 THR MG 1 41 TRP HB2 2.863 . 3.888 3.507 3.415 3.635 . 0 0 "[ . 1]" 1
318 1 20 THR MG 1 41 TRP HB3 2.385 . 3.096 2.462 2.365 2.558 . 0 0 "[ . 1]" 1
319 1 20 THR MG 1 41 TRP HD1 2.397 . 3.115 3.146 3.104 3.181 0.066 7 0 "[ . 1]" 1
320 1 20 THR MG 1 42 HIS H 2.748 . 3.692 3.715 3.674 3.763 0.071 6 0 "[ . 1]" 1
321 1 20 THR MG 1 42 HIS HB3 2.890 . 3.934 3.776 3.445 3.957 0.023 9 0 "[ . 1]" 1
322 1 20 THR MG 2 11 THR HB 4.890 . 6.000 5.346 5.095 5.500 . 0 0 "[ . 1]" 1
323 1 20 THR MG 2 12 LYS H 4.948 . 5.998 4.115 3.773 4.461 . 0 0 "[ . 1]" 1
324 1 20 THR MG 2 12 LYS HA 4.271 . 6.001 3.238 3.048 3.654 . 0 0 "[ . 1]" 1
325 1 20 THR MG 2 12 LYS QB 4.623 . 6.003 4.310 3.900 4.854 . 0 0 "[ . 1]" 1
326 1 20 THR MG 2 12 LYS QD 4.477 . 5.997 4.402 3.563 5.185 . 0 0 "[ . 1]" 1
327 1 20 THR MG 2 12 LYS QE 4.860 . 6.000 4.149 3.233 5.625 . 0 0 "[ . 1]" 1
328 1 20 THR MG 2 12 LYS QG 4.146 . 5.996 2.781 2.188 3.455 . 0 0 "[ . 1]" 1
329 1 21 LEU H 1 21 LEU HA 2.902 . 3.954 2.919 2.912 2.926 . 0 0 "[ . 1]" 1
330 1 21 LEU H 1 21 LEU HB2 2.623 . 3.483 2.802 2.749 2.848 . 0 0 "[ . 1]" 1
331 1 21 LEU H 1 21 LEU HB3 2.703 . 3.617 2.488 2.425 2.526 . 0 0 "[ . 1]" 1
332 1 21 LEU H 1 41 TRP HB3 3.609 . 5.237 5.326 5.282 5.377 0.140 1 0 "[ . 1]" 1
333 1 21 LEU HA 1 21 LEU HB2 2.423 . 3.157 2.464 2.437 2.487 . 0 0 "[ . 1]" 1
334 1 21 LEU HA 1 21 LEU HB3 2.921 . 3.988 3.021 3.017 3.025 . 0 0 "[ . 1]" 1
335 1 21 LEU HA 1 21 LEU MD1 2.312 . 2.980 2.074 2.035 2.116 . 0 0 "[ . 1]" 1
336 1 21 LEU HA 1 22 ARG H 2.435 . 3.176 2.170 2.140 2.195 . 0 0 "[ . 1]" 1
337 1 21 LEU HA 1 41 TRP H 2.962 . 4.059 3.045 2.889 3.198 . 0 0 "[ . 1]" 1
338 1 21 LEU HA 2 13 VAL MG1 4.718 . 5.998 4.401 4.062 4.606 . 0 0 "[ . 1]" 1
339 1 21 LEU HB2 1 22 ARG H 3.144 . 4.380 4.255 4.184 4.336 . 0 0 "[ . 1]" 1
340 1 21 LEU HB2 2 13 VAL MG1 4.743 . 6.003 2.621 2.237 2.837 . 0 0 "[ . 1]" 1
341 1 21 LEU HB2 2 13 VAL MG2 4.988 . 5.998 4.742 3.903 5.046 . 0 0 "[ . 1]" 1
342 1 21 LEU HB3 1 21 LEU MD2 2.364 . 3.063 2.350 2.279 2.400 . 0 0 "[ . 1]" 1
343 1 21 LEU HB3 2 13 VAL MG1 4.776 . 5.996 3.097 2.546 3.555 . 0 0 "[ . 1]" 1
344 1 21 LEU MD1 1 21 LEU HG 2.340 . 3.024 2.123 2.119 2.128 . 0 0 "[ . 1]" 1
345 1 21 LEU MD1 1 22 ARG H 2.668 . 3.557 2.280 2.084 2.440 . 0 0 "[ . 1]" 1
346 1 21 LEU MD1 1 38 HIS HB2 2.833 . 3.836 3.516 3.397 3.701 . 0 0 "[ . 1]" 1
347 1 21 LEU MD1 1 38 HIS HB3 2.691 . 3.596 2.155 2.044 2.312 . 0 0 "[ . 1]" 1
348 1 21 LEU MD1 2 13 VAL MG2 4.901 . 6.001 5.576 4.954 5.952 . 0 0 "[ . 1]" 1
349 1 21 LEU MD2 1 77 VAL HA 2.773 . 3.734 2.927 2.767 3.046 . 0 0 "[ . 1]" 1
350 1 21 LEU MD2 1 77 VAL MG2 2.118 . 2.679 2.033 1.964 2.166 . 0 0 "[ . 1]" 1
351 1 21 LEU MD2 2 11 THR HB 4.854 . 6.004 4.274 3.535 4.674 . 0 0 "[ . 1]" 1
352 1 21 LEU MD2 2 13 VAL MG2 4.881 . 6.001 4.150 3.647 4.691 . 0 0 "[ . 1]" 1
353 1 22 ARG H 1 22 ARG HB2 2.845 . 3.857 2.579 2.461 2.641 . 0 0 "[ . 1]" 1
354 1 22 ARG H 1 22 ARG HB3 3.099 . 4.300 3.725 3.633 3.773 . 0 0 "[ . 1]" 1
355 1 22 ARG H 1 39 MET H 2.830 . 3.831 3.491 3.315 3.738 . 0 0 "[ . 1]" 1
356 1 22 ARG H 1 40 VAL HA 3.537 . 5.100 3.142 3.033 3.319 . 0 0 "[ . 1]" 1
357 1 22 ARG H 1 41 TRP HB2 3.560 . 5.144 3.747 3.385 4.084 . 0 0 "[ . 1]" 1
358 1 22 ARG H 1 41 TRP HB3 3.626 . 5.270 4.450 4.259 4.790 . 0 0 "[ . 1]" 1
359 1 22 ARG HA 1 22 ARG HB3 2.352 . 3.043 2.559 2.527 2.618 . 0 0 "[ . 1]" 1
360 1 22 ARG HA 1 23 ALA H 2.503 . 3.286 2.118 2.072 2.181 . 0 0 "[ . 1]" 1
361 1 22 ARG HA 1 23 ALA MB 3.122 . 4.340 3.892 3.806 3.950 . 0 0 "[ . 1]" 1
362 1 22 ARG HB2 1 22 ARG HD2 2.841 . 3.850 3.918 3.856 3.977 0.127 4 0 "[ . 1]" 1
363 1 22 ARG HB2 1 41 TRP HB2 3.262 . 4.592 2.086 1.991 2.298 . 0 0 "[ . 1]" 1
364 1 22 ARG HB2 2 10 ILE MG 4.898 . 5.998 5.648 4.615 6.081 0.083 7 0 "[ . 1]" 1
365 1 22 ARG HB3 1 41 TRP HB2 2.543 . 3.352 3.414 3.368 3.480 0.128 1 0 "[ . 1]" 1
366 1 22 ARG HB3 1 41 TRP HE3 3.106 . 4.312 4.253 3.830 4.354 0.042 9 0 "[ . 1]" 1
367 1 22 ARG HB3 2 10 ILE MG 4.850 . 6.000 4.832 4.343 5.056 . 0 0 "[ . 1]" 1
368 1 22 ARG HD2 1 41 TRP HB3 2.941 . 4.022 3.701 3.171 4.032 0.010 2 0 "[ . 1]" 1
369 1 22 ARG HD3 1 41 TRP HB2 2.776 . 3.739 2.564 2.425 2.758 . 0 0 "[ . 1]" 1
370 1 22 ARG HD3 1 41 TRP HB3 2.807 . 3.792 3.311 3.062 3.505 . 0 0 "[ . 1]" 1
371 1 23 ALA H 1 23 ALA MB 2.407 . 3.131 2.244 2.104 2.353 . 0 0 "[ . 1]" 1
372 1 23 ALA H 1 24 ILE H 3.239 . 4.550 4.182 3.984 4.342 . 0 0 "[ . 1]" 1
373 1 23 ALA HA 1 23 ALA MB 3.124 . 4.344 2.122 2.100 2.135 . 0 0 "[ . 1]" 1
374 1 23 ALA HA 1 24 ILE H 2.488 . 3.262 2.185 2.120 2.262 . 0 0 "[ . 1]" 1
375 1 23 ALA MB 1 24 ILE H 2.717 . 3.640 3.460 3.258 3.590 . 0 0 "[ . 1]" 1
376 1 23 ALA MB 1 36 VAL MG2 2.023 . 2.535 2.303 1.979 2.595 0.060 2 0 "[ . 1]" 1
377 1 23 ALA MB 1 38 HIS HE1 2.842 . 3.852 3.363 2.886 3.666 . 0 0 "[ . 1]" 1
378 1 23 ALA MB 1 73 HIS HB2 2.969 . 4.071 2.217 2.169 2.300 . 0 0 "[ . 1]" 1
379 1 23 ALA MB 1 73 HIS HB3 2.659 . 3.543 3.556 3.483 3.594 0.051 4 0 "[ . 1]" 1
380 1 23 ALA MB 2 9 GLN QB 4.225 . 5.995 1.943 1.791 2.222 0.004 2 0 "[ . 1]" 1
381 1 23 ALA MB 2 9 GLN QG 4.878 . 5.998 3.499 2.296 4.057 . 0 0 "[ . 1]" 1
382 1 23 ALA MB 2 10 ILE HB 4.773 . 6.003 6.100 5.997 6.232 0.229 5 0 "[ . 1]" 1
383 1 23 ALA MB 2 11 THR HB 4.942 . 6.002 6.004 5.807 6.088 0.086 9 0 "[ . 1]" 1
384 1 24 ILE H 1 24 ILE HA 2.995 . 4.117 2.905 2.880 2.944 . 0 0 "[ . 1]" 1
385 1 24 ILE H 1 24 ILE HG12 2.805 . 3.789 2.157 2.042 2.262 . 0 0 "[ . 1]" 1
386 1 24 ILE H 1 38 HIS HA 3.337 . 4.729 3.653 3.395 4.026 . 0 0 "[ . 1]" 1
387 1 24 ILE HA 1 24 ILE HB 2.868 . 3.896 2.524 2.484 2.564 . 0 0 "[ . 1]" 1
388 1 24 ILE MD 1 37 HIS HB3 2.772 . 3.732 3.131 3.049 3.223 . 0 0 "[ . 1]" 1
389 1 24 ILE MD 1 39 MET ME 1.837 . 2.259 2.218 2.122 2.288 0.029 10 0 "[ . 1]" 1
390 1 24 ILE MD 2 2 PHE QB 4.981 . 6.001 4.295 3.047 5.299 . 0 0 "[ . 1]" 1
391 1 24 ILE MD 2 2 PHE QE 4.946 . 5.996 3.653 2.216 5.951 . 0 0 "[ . 1]" 1
392 1 24 ILE HG12 1 24 ILE MG 1.856 . 2.287 2.265 2.186 2.293 0.006 9 0 "[ . 1]" 1
393 1 24 ILE HG12 1 37 HIS HB3 2.861 . 3.884 3.912 3.891 3.935 0.051 5 0 "[ . 1]" 1
394 1 24 ILE HG12 1 39 MET H 3.259 . 4.587 3.392 3.091 3.660 . 0 0 "[ . 1]" 1
395 1 24 ILE HG12 1 39 MET ME 2.610 . 3.461 3.511 3.494 3.531 0.070 10 0 "[ . 1]" 1
396 1 24 ILE HG13 1 37 HIS H 2.700 . 3.611 2.589 2.427 2.889 . 0 0 "[ . 1]" 1
397 1 24 ILE HG13 1 37 HIS HB3 2.669 . 3.560 3.531 3.394 3.592 0.032 10 0 "[ . 1]" 1
398 1 24 ILE MG 1 41 TRP HZ3 3.059 . 4.229 3.552 2.815 4.169 . 0 0 "[ . 1]" 1
399 1 24 ILE MG 2 2 PHE QB 5.000 . 6.000 4.719 3.555 5.988 . 0 0 "[ . 1]" 1
400 1 24 ILE MG 2 2 PHE QE 4.942 . 6.002 4.140 1.889 5.329 . 0 0 "[ . 1]" 1
401 1 25 ARG HA 1 26 VAL H 2.337 . 3.020 2.141 2.103 2.242 . 0 0 "[ . 1]" 1
402 1 25 ARG HB2 1 25 ARG QG 2.107 . 2.662 2.351 2.155 2.484 . 0 0 "[ . 1]" 1
403 1 25 ARG HB2 1 26 VAL H 3.193 . 4.467 4.254 3.245 4.554 0.087 2 0 "[ . 1]" 1
404 1 25 ARG HB3 1 25 ARG HD2 2.684 . 3.585 3.033 2.301 3.687 0.102 2 0 "[ . 1]" 1
405 1 26 VAL H 1 26 VAL HA 2.937 . 4.015 2.942 2.897 2.952 . 0 0 "[ . 1]" 1
406 1 26 VAL H 1 26 VAL HB 2.518 . 3.311 2.587 2.466 2.835 . 0 0 "[ . 1]" 1
407 1 26 VAL H 1 26 VAL MG2 2.632 . 3.498 2.602 2.226 2.975 . 0 0 "[ . 1]" 1
408 1 26 VAL H 1 34 TYR HA 3.448 . 4.934 5.025 4.954 5.064 0.130 9 0 "[ . 1]" 1
409 1 26 VAL H 1 34 TYR HB2 3.200 . 4.480 3.820 3.647 3.961 . 0 0 "[ . 1]" 1
410 1 26 VAL H 1 34 TYR QD 3.231 . 4.536 4.292 3.900 4.551 0.015 9 0 "[ . 1]" 1
411 1 26 VAL HA 1 26 VAL HB 2.680 . 3.578 3.027 3.011 3.034 . 0 0 "[ . 1]" 1
412 1 26 VAL HA 1 26 VAL MG2 2.154 . 2.734 2.399 2.323 2.636 . 0 0 "[ . 1]" 1
413 1 26 VAL HA 1 27 TYR H 2.250 . 2.883 2.275 2.147 2.629 . 0 0 "[ . 1]" 1
414 1 26 VAL HB 1 27 TYR H 3.211 . 4.500 4.052 3.037 4.417 . 0 0 "[ . 1]" 1
415 1 26 VAL HB 1 35 THR HB 2.628 . 3.491 2.638 2.138 2.796 . 0 0 "[ . 1]" 1
416 1 26 VAL HB 1 37 HIS HD2 2.797 . 3.775 2.795 2.191 3.378 . 0 0 "[ . 1]" 1
417 1 26 VAL MG1 1 27 TYR H 2.666 . 3.555 2.583 1.743 3.130 0.034 4 0 "[ . 1]" 1
418 1 26 VAL MG1 1 35 THR HB 2.766 . 3.723 3.690 3.225 3.803 0.080 2 0 "[ . 1]" 1
419 1 26 VAL MG2 1 27 TYR H 2.927 . 3.998 4.027 3.847 4.101 0.103 5 0 "[ . 1]" 1
420 1 26 VAL MG2 1 35 THR HB 3.037 . 4.190 4.021 3.097 4.213 0.023 3 0 "[ . 1]" 1
421 1 26 VAL MG2 1 37 HIS HD2 2.529 . 3.328 2.624 2.126 3.315 . 0 0 "[ . 1]" 1
422 1 27 TYR H 1 27 TYR HA 2.989 . 4.105 2.868 2.806 2.941 . 0 0 "[ . 1]" 1
423 1 27 TYR H 1 27 TYR HB2 2.702 . 3.615 2.318 2.203 2.513 . 0 0 "[ . 1]" 1
424 1 27 TYR H 1 27 TYR HB3 2.582 . 3.415 3.531 3.472 3.622 0.207 10 0 "[ . 1]" 1
425 1 27 TYR H 1 27 TYR QD 2.944 . 4.027 2.865 2.201 3.643 . 0 0 "[ . 1]" 1
426 1 27 TYR HA 1 28 MET H 2.297 . 2.957 2.158 2.111 2.200 . 0 0 "[ . 1]" 1
427 1 27 TYR HB2 1 27 TYR QD 2.526 . 3.323 2.430 2.284 2.569 . 0 0 "[ . 1]" 1
428 1 27 TYR HB2 1 28 MET H 2.876 . 3.910 4.110 4.067 4.157 0.247 6 0 "[ . 1]" 1
429 1 27 TYR HB3 1 27 TYR QD 2.634 . 3.502 2.405 2.293 2.630 . 0 0 "[ . 1]" 1
430 1 27 TYR HB3 1 27 TYR QE 3.204 . 4.487 4.417 4.386 4.473 . 0 0 "[ . 1]" 1
431 1 27 TYR HB3 1 28 MET H 2.878 . 3.913 2.949 2.861 3.032 . 0 0 "[ . 1]" 1
432 1 27 TYR QD 1 28 MET H 3.418 . 4.878 3.409 3.037 3.870 . 0 0 "[ . 1]" 1
433 1 27 TYR QD 1 33 VAL H 3.317 . 4.693 4.661 4.492 4.744 0.051 9 0 "[ . 1]" 1
434 1 28 MET H 1 28 MET HB2 2.734 . 3.668 2.227 2.066 2.373 . 0 0 "[ . 1]" 1
435 1 28 MET H 1 28 MET HB3 2.516 . 3.307 3.489 3.367 3.570 0.263 4 0 "[ . 1]" 1
436 1 28 MET H 1 28 MET HG2 2.964 . 4.062 2.773 2.530 3.247 . 0 0 "[ . 1]" 1
437 1 28 MET H 1 28 MET HG3 2.851 . 3.867 3.874 3.744 3.952 0.085 2 0 "[ . 1]" 1
438 1 28 MET H 1 33 VAL MG2 3.268 . 4.603 4.313 3.907 4.564 . 0 0 "[ . 1]" 1
439 1 28 MET H 1 34 TYR HA 2.951 . 4.040 2.633 2.301 2.880 . 0 0 "[ . 1]" 1
440 1 28 MET H 1 35 THR HB 3.734 . 5.477 5.576 5.512 5.637 0.160 6 0 "[ . 1]" 1
441 1 28 MET HA 1 28 MET HB2 2.352 . 3.043 2.995 2.929 3.019 . 0 0 "[ . 1]" 1
442 1 28 MET HA 1 28 MET HG2 2.940 . 4.020 2.834 2.431 3.078 . 0 0 "[ . 1]" 1
443 1 28 MET HA 1 28 MET HG3 2.805 . 3.789 3.672 3.586 3.730 . 0 0 "[ . 1]" 1
444 1 28 MET HB2 1 28 MET HG3 1.864 . 2.298 2.377 2.304 2.403 0.105 4 0 "[ . 1]" 1
445 1 28 MET HB3 1 28 MET HG3 1.942 . 2.413 2.445 2.411 2.522 0.109 2 0 "[ . 1]" 1
446 1 28 MET HG2 1 33 VAL MG2 2.670 . 3.561 3.585 3.143 3.690 0.129 7 0 "[ . 1]" 1
447 1 28 MET HG2 1 35 THR HB 3.133 . 4.360 4.240 3.667 4.380 0.020 3 0 "[ . 1]" 1
448 1 28 MET HG2 1 35 THR MG 2.969 . 4.071 3.501 3.147 3.984 . 0 0 "[ . 1]" 1
449 1 28 MET HG3 1 35 THR MG 2.955 . 4.047 4.081 3.666 4.189 0.142 7 0 "[ . 1]" 1
450 1 30 ASP HB2 1 31 SER H 3.189 . 4.460 3.901 3.200 4.483 0.023 8 0 "[ . 1]" 1
451 1 31 SER H 1 31 SER HB3 2.783 . 3.751 3.577 2.906 3.846 0.095 7 0 "[ . 1]" 1
452 1 31 SER HA 1 31 SER HB2 2.693 . 3.599 2.839 2.461 3.031 . 0 0 "[ . 1]" 1
453 1 31 SER HA 1 31 SER HB3 2.728 . 3.658 2.529 2.312 3.027 . 0 0 "[ . 1]" 1
454 1 31 SER HA 1 32 ASP H 2.882 . 3.920 2.955 2.564 3.364 . 0 0 "[ . 1]" 1
455 1 31 SER HB2 1 33 VAL H 2.904 . 3.958 2.881 2.320 3.981 0.023 5 0 "[ . 1]" 1
456 1 31 SER HB3 1 33 VAL MG1 2.788 . 3.760 3.171 1.912 3.912 0.152 2 0 "[ . 1]" 1
457 1 32 ASP H 1 32 ASP HB2 2.966 . 4.066 2.943 2.291 3.665 . 0 0 "[ . 1]" 1
458 1 32 ASP H 1 32 ASP HB3 2.973 . 4.078 2.793 2.459 3.446 . 0 0 "[ . 1]" 1
459 1 32 ASP H 1 33 VAL H 2.839 . 3.847 2.069 1.862 2.301 . 0 0 "[ . 1]" 1
460 1 32 ASP H 1 33 VAL MG1 3.529 . 5.086 3.303 2.960 3.596 . 0 0 "[ . 1]" 1
461 1 32 ASP H 1 33 VAL MG2 3.600 . 5.220 5.339 5.209 5.426 0.206 6 0 "[ . 1]" 1
462 1 32 ASP HB2 1 33 VAL H 2.892 . 3.938 4.046 3.874 4.175 0.237 6 0 "[ . 1]" 1
463 1 33 VAL H 1 33 VAL HA 2.650 . 3.527 2.804 2.753 2.863 . 0 0 "[ . 1]" 1
464 1 33 VAL H 1 33 VAL HB 2.217 . 2.831 2.615 2.508 2.754 . 0 0 "[ . 1]" 1
465 1 33 VAL H 1 33 VAL MG1 2.121 . 2.683 1.924 1.842 2.027 . 0 0 "[ . 1]" 1
466 1 33 VAL HA 1 33 VAL HB 2.430 . 3.168 2.406 2.378 2.426 . 0 0 "[ . 1]" 1
467 1 33 VAL HA 1 33 VAL MG2 1.960 . 2.440 2.392 2.344 2.467 0.027 2 0 "[ . 1]" 1
468 1 33 VAL HA 1 34 TYR H 1.995 . 2.493 2.215 2.166 2.255 . 0 0 "[ . 1]" 1
469 1 33 VAL HA 1 34 TYR QD 2.935 . 4.012 3.515 3.181 3.861 . 0 0 "[ . 1]" 1
470 1 33 VAL HB 1 33 VAL MG1 1.805 . 2.212 2.120 2.109 2.124 . 0 0 "[ . 1]" 1
471 1 33 VAL HB 1 33 VAL MG2 1.775 . 2.169 2.118 2.113 2.124 . 0 0 "[ . 1]" 1
472 1 33 VAL HB 1 34 TYR H 2.757 . 3.707 3.859 3.819 3.899 0.192 4 0 "[ . 1]" 1
473 1 33 VAL MG1 1 34 TYR H 2.724 . 3.652 3.746 3.678 3.860 0.208 7 0 "[ . 1]" 1
474 1 33 VAL MG2 1 34 TYR H 2.267 . 2.909 2.133 2.059 2.191 . 0 0 "[ . 1]" 1
475 1 34 TYR H 1 34 TYR HA 2.804 . 3.787 2.939 2.929 2.947 . 0 0 "[ . 1]" 1
476 1 34 TYR H 1 34 TYR HB3 2.819 . 3.812 3.071 2.818 3.337 . 0 0 "[ . 1]" 1
477 1 34 TYR H 1 34 TYR QD 2.828 . 3.828 2.597 2.199 2.946 . 0 0 "[ . 1]" 1
478 1 34 TYR H 1 34 TYR QE 3.091 . 4.285 4.098 3.838 4.269 . 0 0 "[ . 1]" 1
479 1 34 TYR HA 1 34 TYR HB2 2.697 . 3.606 2.453 2.362 2.500 . 0 0 "[ . 1]" 1
480 1 34 TYR HA 1 34 TYR HB3 2.641 . 3.513 2.437 2.393 2.517 . 0 0 "[ . 1]" 1
481 1 34 TYR HA 1 35 THR H 2.332 . 3.012 2.365 2.306 2.433 . 0 0 "[ . 1]" 1
482 1 34 TYR HB2 1 34 TYR QD 2.594 . 3.435 2.389 2.340 2.447 . 0 0 "[ . 1]" 1
483 1 34 TYR HB2 1 35 THR H 2.467 . 3.228 2.232 2.116 2.327 . 0 0 "[ . 1]" 1
484 1 34 TYR HB3 1 34 TYR QD 2.645 . 3.519 2.420 2.364 2.485 . 0 0 "[ . 1]" 1
485 1 34 TYR HB3 1 35 THR H 2.609 . 3.460 3.595 3.529 3.680 0.220 8 0 "[ . 1]" 1
486 1 34 TYR QD 1 35 THR HA 2.791 . 3.765 3.575 3.382 3.773 0.008 10 0 "[ . 1]" 1
487 1 34 TYR QD 1 36 VAL MG1 2.525 . 3.322 3.274 3.024 3.363 0.041 3 0 "[ . 1]" 1
488 1 35 THR H 1 35 THR HA 2.643 . 3.516 2.938 2.923 2.945 . 0 0 "[ . 1]" 1
489 1 35 THR H 1 35 THR HB 2.604 . 3.452 3.019 2.850 3.164 . 0 0 "[ . 1]" 1
490 1 35 THR HA 1 35 THR MG 2.186 . 2.783 2.192 2.093 2.224 . 0 0 "[ . 1]" 1
491 1 35 THR HA 1 36 VAL H 2.158 . 2.740 2.181 2.149 2.206 . 0 0 "[ . 1]" 1
492 1 35 THR HB 1 35 THR MG 1.946 . 2.419 2.130 2.124 2.138 . 0 0 "[ . 1]" 1
493 1 35 THR HB 1 37 HIS HD2 3.179 . 4.442 3.143 2.785 3.364 . 0 0 "[ . 1]" 1
494 1 35 THR MG 1 36 VAL H 2.531 . 3.332 3.315 3.072 3.370 0.038 4 0 "[ . 1]" 1
495 1 36 VAL H 1 36 VAL HB 2.399 . 3.119 2.898 2.828 3.065 . 0 0 "[ . 1]" 1
496 1 36 VAL H 1 36 VAL MG1 2.259 . 2.897 1.904 1.842 2.000 . 0 0 "[ . 1]" 1
497 1 36 VAL H 1 36 VAL MG2 2.822 . 3.818 3.776 3.752 3.804 . 0 0 "[ . 1]" 1
498 1 36 VAL H 1 37 HIS H 3.200 . 4.480 4.398 4.288 4.500 0.020 1 0 "[ . 1]" 1
499 1 36 VAL HA 1 37 HIS H 2.131 . 2.698 2.114 2.087 2.132 . 0 0 "[ . 1]" 1
500 1 36 VAL HB 1 36 VAL MG1 2.044 . 2.566 2.122 2.117 2.125 . 0 0 "[ . 1]" 1
501 1 36 VAL HB 1 36 VAL MG2 1.938 . 2.407 2.126 2.123 2.129 . 0 0 "[ . 1]" 1
502 1 36 VAL MG2 1 37 HIS H 2.405 . 3.128 2.886 2.563 3.135 0.007 9 0 "[ . 1]" 1
503 1 36 VAL MG2 1 38 HIS HE1 2.913 . 3.974 3.243 2.954 3.630 . 0 0 "[ . 1]" 1
504 1 37 HIS H 1 37 HIS HB2 2.943 . 4.026 2.493 2.330 2.587 . 0 0 "[ . 1]" 1
505 1 37 HIS H 1 37 HIS HB3 2.721 . 3.646 3.677 3.574 3.735 0.089 1 0 "[ . 1]" 1
506 1 37 HIS H 1 38 HIS H 3.529 . 5.086 4.472 4.410 4.512 . 0 0 "[ . 1]" 1
507 1 37 HIS HA 1 38 HIS H 2.498 . 3.278 2.242 2.158 2.293 . 0 0 "[ . 1]" 1
508 1 37 HIS HB2 1 38 HIS H 2.822 . 3.818 3.907 3.842 3.995 0.177 2 0 "[ . 1]" 1
509 1 37 HIS HB2 1 59 LEU QD 2.355 . 3.048 3.023 2.905 3.104 0.056 2 0 "[ . 1]" 1
510 1 37 HIS HB3 1 38 HIS H 2.854 . 3.872 2.754 2.618 2.869 . 0 0 "[ . 1]" 1
511 1 38 HIS H 1 38 HIS HB2 2.851 . 3.867 2.572 2.536 2.618 . 0 0 "[ . 1]" 1
512 1 38 HIS H 1 38 HIS HB3 2.943 . 4.026 3.710 3.689 3.738 . 0 0 "[ . 1]" 1
513 1 38 HIS H 1 38 HIS HD2 3.487 . 5.007 3.253 3.125 3.379 . 0 0 "[ . 1]" 1
514 1 38 HIS HA 1 39 MET H 2.336 . 3.018 2.151 2.125 2.179 . 0 0 "[ . 1]" 1
515 1 38 HIS HB2 1 39 MET H 3.327 . 4.711 4.410 4.373 4.437 . 0 0 "[ . 1]" 1
516 1 38 HIS HB2 1 60 ILE H 3.501 . 5.033 4.078 3.922 4.166 . 0 0 "[ . 1]" 1
517 1 38 HIS HB2 1 60 ILE HB 2.725 . 3.653 2.871 2.762 2.978 . 0 0 "[ . 1]" 1
518 1 38 HIS HB2 1 60 ILE MD 2.982 . 4.093 3.887 3.785 3.994 . 0 0 "[ . 1]" 1
519 1 38 HIS HB3 1 39 MET H 3.080 . 4.266 3.828 3.730 3.919 . 0 0 "[ . 1]" 1
520 1 38 HIS HB3 1 60 ILE HB 2.723 . 3.650 3.479 3.328 3.626 . 0 0 "[ . 1]" 1
521 1 38 HIS HB3 1 60 ILE MD 2.579 . 3.410 3.427 3.375 3.460 0.050 3 0 "[ . 1]" 1
522 1 38 HIS HD2 1 68 VAL HB 3.169 . 4.424 3.294 2.980 3.738 . 0 0 "[ . 1]" 1
523 1 38 HIS HD2 1 68 VAL QG 2.314 . 2.984 2.459 2.244 2.636 . 0 0 "[ . 1]" 1
524 1 38 HIS HD2 1 76 VAL MG1 3.123 . 4.342 2.899 2.718 3.136 . 0 0 "[ . 1]" 1
525 1 38 HIS HE1 1 76 VAL MG1 3.451 . 4.940 3.294 2.960 3.500 . 0 0 "[ . 1]" 1
526 1 39 MET H 1 39 MET HA 2.737 . 3.673 2.943 2.938 2.946 . 0 0 "[ . 1]" 1
527 1 39 MET H 1 39 MET HB3 2.479 . 3.247 2.472 2.429 2.499 . 0 0 "[ . 1]" 1
528 1 39 MET HA 1 39 MET HB3 2.480 . 3.249 3.002 2.985 3.015 . 0 0 "[ . 1]" 1
529 1 39 MET HA 1 39 MET QG 2.449 . 3.199 2.632 2.560 2.711 . 0 0 "[ . 1]" 1
530 1 39 MET HA 1 40 VAL H 2.263 . 2.903 2.152 2.131 2.173 . 0 0 "[ . 1]" 1
531 1 39 MET HA 1 60 ILE H 2.964 . 4.062 2.800 2.647 2.953 . 0 0 "[ . 1]" 1
532 1 39 MET HB2 1 39 MET QG 2.294 . 2.952 2.132 2.129 2.136 . 0 0 "[ . 1]" 1
533 1 39 MET HB3 1 39 MET QG 2.292 . 2.948 2.514 2.504 2.521 . 0 0 "[ . 1]" 1
534 1 39 MET ME 1 41 TRP HE3 2.606 . 3.455 2.529 2.330 2.668 . 0 0 "[ . 1]" 1
535 1 39 MET ME 1 41 TRP HZ3 2.632 . 3.498 2.424 2.204 2.819 . 0 0 "[ . 1]" 1
536 1 39 MET ME 1 57 GLY HA3 2.654 . 3.535 3.622 3.590 3.648 0.113 10 0 "[ . 1]" 1
537 1 39 MET ME 1 94 LEU QD 1.918 . 2.378 2.099 2.024 2.173 . 0 0 "[ . 1]" 1
538 1 39 MET ME 2 2 PHE QE 4.923 . 6.003 3.337 1.995 4.813 . 0 0 "[ . 1]" 1
539 1 39 MET QG 1 40 VAL H 2.236 . 2.861 2.327 2.274 2.388 . 0 0 "[ . 1]" 1
540 1 39 MET QG 1 41 TRP HE3 3.195 . 4.471 4.466 4.367 4.497 0.026 3 0 "[ . 1]" 1
541 1 39 MET QG 1 57 GLY H 2.668 . 3.558 2.572 2.468 2.613 . 0 0 "[ . 1]" 1
542 1 39 MET QG 1 57 GLY HA2 2.885 . 3.925 2.512 2.423 2.564 . 0 0 "[ . 1]" 1
543 1 39 MET QG 1 57 GLY HA3 2.840 . 3.848 3.886 3.823 3.933 0.085 3 0 "[ . 1]" 1
544 1 39 MET QG 1 58 ASP H 2.625 . 3.487 2.980 2.876 3.093 . 0 0 "[ . 1]" 1
545 1 39 MET QG 1 60 ILE H 3.635 . 5.287 4.724 4.643 4.816 . 0 0 "[ . 1]" 1
546 1 40 VAL H 1 40 VAL HA 2.675 . 3.570 2.852 2.844 2.857 . 0 0 "[ . 1]" 1
547 1 40 VAL H 1 40 VAL MG1 2.134 . 2.703 1.749 1.719 1.776 . 0 0 "[ . 1]" 1
548 1 40 VAL H 1 40 VAL MG2 2.723 . 3.650 3.656 3.616 3.673 0.023 7 0 "[ . 1]" 1
549 1 40 VAL H 1 56 GLN HA 3.436 . 4.911 4.413 4.242 4.524 . 0 0 "[ . 1]" 1
550 1 40 VAL H 1 58 ASP H 3.384 . 4.815 3.882 3.795 3.986 . 0 0 "[ . 1]" 1
551 1 40 VAL H 1 60 ILE MD 2.316 . 2.986 3.007 2.971 3.020 0.034 5 0 "[ . 1]" 1
552 1 40 VAL H 1 60 ILE QG 3.424 . 4.889 3.166 2.999 3.261 . 0 0 "[ . 1]" 1
553 1 40 VAL HA 1 40 VAL HB 2.662 . 3.548 2.316 2.296 2.325 . 0 0 "[ . 1]" 1
554 1 40 VAL HA 1 40 VAL MG1 2.538 . 3.343 3.158 3.135 3.169 . 0 0 "[ . 1]" 1
555 1 40 VAL HA 1 40 VAL MG2 2.509 . 3.296 2.667 2.637 2.693 . 0 0 "[ . 1]" 1
556 1 40 VAL HA 1 41 TRP H 2.184 . 2.780 2.137 2.117 2.154 . 0 0 "[ . 1]" 1
557 1 40 VAL HB 1 40 VAL MG1 1.996 . 2.494 2.119 2.114 2.121 . 0 0 "[ . 1]" 1
558 1 40 VAL HB 1 40 VAL MG2 2.017 . 2.525 2.114 2.104 2.126 . 0 0 "[ . 1]" 1
559 1 40 VAL HB 1 42 HIS H 3.584 . 5.189 4.918 4.653 5.045 . 0 0 "[ . 1]" 1
560 1 40 VAL HB 1 54 LEU MD1 3.135 . 4.363 2.679 2.613 2.847 . 0 0 "[ . 1]" 1
561 1 40 VAL MG1 1 54 LEU MD1 2.107 . 2.662 2.683 2.630 2.705 0.043 6 0 "[ . 1]" 1
562 1 40 VAL MG1 1 57 GLY H 2.582 . 3.416 2.600 2.337 2.888 . 0 0 "[ . 1]" 1
563 1 40 VAL MG1 1 58 ASP H 2.861 . 3.885 2.535 2.397 2.670 . 0 0 "[ . 1]" 1
564 1 40 VAL MG1 1 58 ASP HB2 2.499 . 3.279 2.786 2.704 2.904 . 0 0 "[ . 1]" 1
565 1 40 VAL MG2 1 41 TRP H 2.250 . 2.883 2.944 2.910 2.984 0.101 10 0 "[ . 1]" 1
566 1 40 VAL MG2 1 42 HIS H 2.478 . 3.246 2.603 2.424 2.709 . 0 0 "[ . 1]" 1
567 1 40 VAL MG2 1 54 LEU MD1 2.080 . 2.621 2.325 2.135 2.426 . 0 0 "[ . 1]" 1
568 1 40 VAL MG2 1 55 ARG H 3.024 . 4.167 4.263 4.235 4.303 0.136 10 0 "[ . 1]" 1
569 1 40 VAL MG2 1 56 GLN HA 2.135 . 2.705 2.124 1.968 2.208 . 0 0 "[ . 1]" 1
570 1 41 TRP H 1 41 TRP HB2 2.690 . 3.595 2.675 2.594 2.770 . 0 0 "[ . 1]" 1
571 1 41 TRP H 1 41 TRP HB3 2.685 . 3.586 2.442 2.339 2.488 . 0 0 "[ . 1]" 1
572 1 41 TRP H 1 42 HIS H 2.756 . 3.705 2.415 2.353 2.483 . 0 0 "[ . 1]" 1
573 1 41 TRP HA 1 56 GLN HB2 2.758 . 3.709 3.726 3.625 3.872 0.163 5 0 "[ . 1]" 1
574 1 41 TRP HB2 1 41 TRP HD1 3.198 . 4.476 3.736 3.697 3.777 . 0 0 "[ . 1]" 1
575 1 41 TRP HB2 1 42 HIS H 3.122 . 4.340 4.017 3.912 4.125 . 0 0 "[ . 1]" 1
576 1 41 TRP HB3 1 41 TRP HD1 2.823 . 3.819 2.599 2.577 2.629 . 0 0 "[ . 1]" 1
577 1 41 TRP HB3 1 42 HIS H 2.401 . 3.122 2.815 2.656 3.038 . 0 0 "[ . 1]" 1
578 1 42 HIS H 1 42 HIS HA 2.629 . 3.493 2.901 2.874 2.915 . 0 0 "[ . 1]" 1
579 1 42 HIS H 1 42 HIS HB2 2.895 . 3.943 3.284 3.202 3.414 . 0 0 "[ . 1]" 1
580 1 42 HIS H 1 42 HIS HB3 2.946 . 4.031 2.969 2.915 3.045 . 0 0 "[ . 1]" 1
581 1 42 HIS H 1 43 VAL H 3.141 . 4.374 4.307 4.254 4.334 . 0 0 "[ . 1]" 1
582 1 42 HIS H 1 56 GLN HB3 3.337 . 4.729 3.176 3.046 3.422 . 0 0 "[ . 1]" 1
583 1 42 HIS HA 1 42 HIS HB2 2.779 . 3.744 2.522 2.465 2.569 . 0 0 "[ . 1]" 1
584 1 42 HIS HA 1 42 HIS HB3 2.917 . 3.980 3.037 3.031 3.044 . 0 0 "[ . 1]" 1
585 1 42 HIS HA 1 43 VAL H 2.161 . 2.745 2.235 2.190 2.285 . 0 0 "[ . 1]" 1
586 1 42 HIS HA 1 56 GLN HB3 2.812 . 3.800 2.293 2.128 2.712 . 0 0 "[ . 1]" 1
587 1 42 HIS HA 1 56 GLN HG3 2.681 . 3.579 3.780 3.690 3.846 0.267 10 0 "[ . 1]" 1
588 1 42 HIS HB2 1 43 VAL H 2.993 . 4.113 4.030 3.983 4.100 . 0 0 "[ . 1]" 1
589 1 42 HIS HB3 1 43 VAL H 3.053 . 4.218 3.791 3.623 3.896 . 0 0 "[ . 1]" 1
590 1 43 VAL H 1 43 VAL HA 2.723 . 3.650 2.941 2.939 2.946 . 0 0 "[ . 1]" 1
591 1 43 VAL H 1 43 VAL HB 2.406 . 3.130 2.766 2.719 2.823 . 0 0 "[ . 1]" 1
592 1 43 VAL H 1 43 VAL MG2 2.622 . 3.481 2.741 2.593 2.860 . 0 0 "[ . 1]" 1
593 1 43 VAL HA 1 43 VAL MG2 2.502 . 3.285 2.474 2.439 2.518 . 0 0 "[ . 1]" 1
594 1 43 VAL HA 1 44 GLU H 2.115 . 2.674 2.164 2.142 2.182 . 0 0 "[ . 1]" 1
595 1 43 VAL HB 1 43 VAL MG2 1.799 . 2.203 2.127 2.120 2.131 . 0 0 "[ . 1]" 1
596 1 43 VAL MG1 1 44 GLU H 2.643 . 3.516 2.790 2.606 2.996 . 0 0 "[ . 1]" 1
597 1 43 VAL MG1 1 47 GLY H 3.322 . 4.702 3.792 3.645 3.969 . 0 0 "[ . 1]" 1
598 1 43 VAL MG1 1 49 ALA H 2.929 . 4.001 3.973 3.831 4.059 0.058 10 0 "[ . 1]" 1
599 1 43 VAL MG1 1 49 ALA MB 1.912 . 2.369 2.078 1.984 2.153 . 0 0 "[ . 1]" 1
600 1 43 VAL MG1 1 50 SER H 2.425 . 3.160 2.675 2.585 2.744 . 0 0 "[ . 1]" 1
601 1 43 VAL MG1 1 50 SER HA 2.082 . 2.624 2.303 2.171 2.391 . 0 0 "[ . 1]" 1
602 1 43 VAL MG2 1 55 ARG HA 2.487 . 3.260 2.710 2.427 3.056 . 0 0 "[ . 1]" 1
603 1 43 VAL MG2 1 56 GLN H 2.499 . 3.280 2.750 2.166 3.285 0.005 1 0 "[ . 1]" 1
604 1 43 VAL MG2 1 56 GLN HA 2.542 . 3.349 3.231 3.002 3.365 0.016 5 0 "[ . 1]" 1
605 1 43 VAL MG2 1 56 GLN HB3 2.548 . 3.360 2.817 2.045 3.383 0.023 5 0 "[ . 1]" 1
606 1 43 VAL MG2 1 56 GLN HG2 2.737 . 3.673 2.001 1.906 2.189 . 0 0 "[ . 1]" 1
607 1 43 VAL MG2 1 56 GLN HG3 2.498 . 3.278 3.264 3.083 3.377 0.099 10 0 "[ . 1]" 1
608 1 44 GLU H 1 44 GLU HA 2.688 . 3.591 2.760 2.735 2.779 . 0 0 "[ . 1]" 1
609 1 44 GLU H 1 44 GLU HB2 2.394 . 3.110 2.452 2.293 2.618 . 0 0 "[ . 1]" 1
610 1 44 GLU H 1 44 GLU HG2 2.471 . 3.234 2.065 1.832 2.297 . 0 0 "[ . 1]" 1
611 1 44 GLU H 1 49 ALA MB 3.313 . 4.685 4.199 4.055 4.353 . 0 0 "[ . 1]" 1
612 1 44 GLU HA 1 44 GLU HB3 2.425 . 3.160 2.461 2.380 2.535 . 0 0 "[ . 1]" 1
613 1 44 GLU HA 1 44 GLU HG2 2.471 . 3.235 3.061 2.858 3.187 . 0 0 "[ . 1]" 1
614 1 44 GLU HB2 1 47 GLY H 3.075 . 4.257 3.561 3.347 3.846 . 0 0 "[ . 1]" 1
615 1 44 GLU HB3 1 47 GLY H 3.092 . 4.287 4.071 3.753 4.311 0.024 10 0 "[ . 1]" 1
616 1 45 ASP HA 1 45 ASP QB 2.057 . 2.586 2.468 2.409 2.538 . 0 0 "[ . 1]" 1
617 1 45 ASP QB 1 47 GLY H 3.368 . 4.786 4.679 4.608 4.756 . 0 0 "[ . 1]" 1
618 1 46 GLY H 1 47 GLY H 3.080 . 4.266 2.391 2.253 2.492 . 0 0 "[ . 1]" 1
619 1 46 GLY HA3 1 47 GLY H 2.565 . 3.387 3.372 3.295 3.412 0.025 3 0 "[ . 1]" 1
620 1 47 GLY H 1 47 GLY HA2 2.980 . 4.090 2.882 2.865 2.914 . 0 0 "[ . 1]" 1
621 1 47 GLY H 1 50 SER H 2.882 . 3.920 3.795 3.719 3.850 . 0 0 "[ . 1]" 1
622 1 47 GLY H 1 51 GLU H 3.272 . 4.610 4.653 4.621 4.692 0.082 10 0 "[ . 1]" 1
623 1 48 PRO HA 1 48 PRO HB2 2.331 . 3.010 2.981 2.977 2.995 . 0 0 "[ . 1]" 1
624 1 48 PRO HA 1 48 PRO HB3 2.310 . 2.977 2.327 2.320 2.334 . 0 0 "[ . 1]" 1
625 1 48 PRO HA 1 49 ALA H 2.679 . 3.576 3.512 3.507 3.519 . 0 0 "[ . 1]" 1
626 1 48 PRO HA 1 51 GLU H 2.690 . 3.595 3.490 3.449 3.537 . 0 0 "[ . 1]" 1
627 1 48 PRO HA 1 51 GLU QB 2.144 . 2.719 2.769 2.747 2.786 0.067 8 0 "[ . 1]" 1
628 1 48 PRO HB2 1 48 PRO HD2 2.546 . 3.356 2.690 2.666 2.722 . 0 0 "[ . 1]" 1
629 1 48 PRO HB2 1 49 ALA H 2.444 . 3.190 2.192 2.095 2.251 . 0 0 "[ . 1]" 1
630 1 48 PRO HB2 1 49 ALA MB 2.785 . 3.755 3.614 3.559 3.671 . 0 0 "[ . 1]" 1
631 1 48 PRO HB3 1 48 PRO HG2 2.327 . 3.004 2.601 2.592 2.608 . 0 0 "[ . 1]" 1
632 1 48 PRO HB3 1 49 ALA H 2.737 . 3.673 3.662 3.594 3.703 0.030 10 0 "[ . 1]" 1
633 1 48 PRO HD2 1 48 PRO HG2 2.712 . 3.632 2.347 2.340 2.352 . 0 0 "[ . 1]" 1
634 1 48 PRO HD2 1 48 PRO HG3 2.918 . 3.982 2.986 2.984 2.987 . 0 0 "[ . 1]" 1
635 1 48 PRO HD2 1 49 ALA H 2.827 . 3.826 2.485 2.467 2.516 . 0 0 "[ . 1]" 1
636 1 48 PRO HD3 1 49 ALA H 3.284 . 4.632 3.860 3.846 3.875 . 0 0 "[ . 1]" 1
637 1 48 PRO HG2 1 49 ALA H 2.878 . 3.913 3.824 3.755 3.875 . 0 0 "[ . 1]" 1
638 1 49 ALA H 1 49 ALA HA 2.397 . 3.115 2.803 2.794 2.815 . 0 0 "[ . 1]" 1
639 1 49 ALA H 1 49 ALA MB 2.060 . 2.590 2.260 2.254 2.266 . 0 0 "[ . 1]" 1
640 1 49 ALA H 1 50 SER H 2.548 . 3.359 2.701 2.650 2.745 . 0 0 "[ . 1]" 1
641 1 49 ALA H 1 54 LEU MD1 3.560 . 5.144 5.239 5.217 5.269 0.125 3 0 "[ . 1]" 1
642 1 49 ALA HA 1 49 ALA MB 2.062 . 2.593 2.134 2.130 2.137 . 0 0 "[ . 1]" 1
643 1 49 ALA HA 1 51 GLU H 2.869 . 3.898 4.160 4.139 4.176 0.278 7 0 "[ . 1]" 1
644 1 49 ALA HA 1 52 ALA H 2.611 . 3.463 3.181 3.140 3.248 . 0 0 "[ . 1]" 1
645 1 49 ALA HA 1 52 ALA MB 2.033 . 2.549 2.362 2.294 2.427 . 0 0 "[ . 1]" 1
646 1 49 ALA HA 1 54 LEU MD1 2.895 . 3.943 3.930 3.914 3.949 0.006 3 0 "[ . 1]" 1
647 1 49 ALA MB 1 50 SER H 2.433 . 3.173 2.628 2.590 2.659 . 0 0 "[ . 1]" 1
648 1 49 ALA MB 1 54 LEU H 2.730 . 3.662 3.699 3.682 3.715 0.053 5 0 "[ . 1]" 1
649 1 49 ALA MB 1 54 LEU MD1 1.987 . 2.480 2.195 2.159 2.223 . 0 0 "[ . 1]" 1
650 1 50 SER H 1 50 SER HB2 2.495 . 3.273 2.178 2.066 2.292 . 0 0 "[ . 1]" 1
651 1 50 SER H 1 51 GLU H 2.452 . 3.204 2.501 2.467 2.536 . 0 0 "[ . 1]" 1
652 1 50 SER H 1 52 ALA H 3.178 . 4.441 3.860 3.770 3.933 . 0 0 "[ . 1]" 1
653 1 50 SER H 1 53 GLY H 3.663 . 5.340 4.721 4.659 4.804 . 0 0 "[ . 1]" 1
654 1 50 SER HB2 1 51 GLU H 2.609 . 3.460 3.486 3.300 3.602 0.142 9 0 "[ . 1]" 1
655 1 50 SER HB3 1 51 GLU H 2.056 . 2.585 2.696 2.620 2.787 0.202 4 0 "[ . 1]" 1
656 1 50 SER HB3 1 51 GLU HG2 2.835 . 3.840 3.731 3.368 3.859 0.019 3 0 "[ . 1]" 1
657 1 51 GLU H 1 51 GLU HA 2.213 . 2.825 2.856 2.847 2.879 0.054 6 0 "[ . 1]" 1
658 1 51 GLU H 1 51 GLU QB 1.991 . 2.487 2.472 2.415 2.508 0.021 3 0 "[ . 1]" 1
659 1 51 GLU H 1 51 GLU HG2 2.404 . 3.127 3.174 3.054 3.220 0.093 8 0 "[ . 1]" 1
660 1 51 GLU H 1 51 GLU HG3 2.390 . 3.104 2.289 2.085 2.488 . 0 0 "[ . 1]" 1
661 1 51 GLU H 1 52 ALA H 2.339 . 3.023 2.423 2.347 2.464 . 0 0 "[ . 1]" 1
662 1 51 GLU H 1 52 ALA MB 2.982 . 4.093 4.091 4.036 4.119 0.026 7 0 "[ . 1]" 1
663 1 51 GLU H 1 53 GLY H 3.207 . 4.493 3.848 3.795 3.884 . 0 0 "[ . 1]" 1
664 1 51 GLU HA 1 51 GLU QB 2.168 . 2.755 2.352 2.335 2.372 . 0 0 "[ . 1]" 1
665 1 51 GLU HA 1 51 GLU HG2 2.454 . 3.207 2.493 2.416 2.589 . 0 0 "[ . 1]" 1
666 1 51 GLU HA 1 52 ALA H 2.592 . 3.432 3.449 3.403 3.468 0.036 1 0 "[ . 1]" 1
667 1 51 GLU HA 1 53 GLY H 2.854 . 3.872 3.949 3.913 3.985 0.113 10 0 "[ . 1]" 1
668 1 51 GLU QB 1 52 ALA H 2.258 . 2.895 2.704 2.572 2.931 0.036 6 0 "[ . 1]" 1
669 1 51 GLU QB 1 52 ALA HA 2.917 . 3.980 3.924 3.865 4.005 0.025 6 0 "[ . 1]" 1
670 1 51 GLU QB 1 53 GLY H 3.373 . 4.795 4.551 4.487 4.648 . 0 0 "[ . 1]" 1
671 1 52 ALA H 1 52 ALA HA 2.234 . 2.858 2.849 2.827 2.877 0.019 6 0 "[ . 1]" 1
672 1 52 ALA H 1 52 ALA MB 1.856 . 2.287 2.218 2.202 2.251 . 0 0 "[ . 1]" 1
673 1 52 ALA H 1 53 GLY H 2.375 . 3.080 2.472 2.352 2.541 . 0 0 "[ . 1]" 1
674 1 52 ALA HA 1 52 ALA MB 1.925 . 2.388 2.121 2.117 2.123 . 0 0 "[ . 1]" 1
675 1 52 ALA HA 1 53 GLY H 2.756 . 3.706 3.453 3.437 3.472 . 0 0 "[ . 1]" 1
676 1 52 ALA MB 1 53 GLY H 2.539 . 3.345 2.877 2.819 2.915 . 0 0 "[ . 1]" 1
677 1 53 GLY H 1 53 GLY HA2 2.317 . 2.988 2.418 2.400 2.446 . 0 0 "[ . 1]" 1
678 1 53 GLY H 1 53 GLY HA3 2.208 . 2.818 2.926 2.921 2.933 0.115 1 0 "[ . 1]" 1
679 1 53 GLY H 1 54 LEU H 2.144 . 2.719 2.190 2.147 2.222 . 0 0 "[ . 1]" 1
680 1 53 GLY HA2 1 54 LEU H 2.564 . 3.386 3.237 3.191 3.286 . 0 0 "[ . 1]" 1
681 1 53 GLY HA3 1 54 LEU H 2.489 . 3.264 3.348 3.303 3.376 0.112 9 0 "[ . 1]" 1
682 1 54 LEU H 1 54 LEU HA 2.461 . 3.218 2.844 2.834 2.855 . 0 0 "[ . 1]" 1
683 1 54 LEU H 1 54 LEU HB2 2.181 . 2.776 2.097 2.077 2.121 . 0 0 "[ . 1]" 1
684 1 54 LEU H 1 54 LEU HB3 2.344 . 3.031 3.094 3.070 3.114 0.083 3 0 "[ . 1]" 1
685 1 54 LEU H 1 54 LEU HG 3.235 . 4.544 3.930 3.896 3.995 . 0 0 "[ . 1]" 1
686 1 54 LEU H 1 55 ARG H 3.389 . 4.825 4.528 4.499 4.575 . 0 0 "[ . 1]" 1
687 1 54 LEU HA 1 54 LEU HB2 2.717 . 3.639 2.763 2.749 2.780 . 0 0 "[ . 1]" 1
688 1 54 LEU HA 1 54 LEU HB3 2.665 . 3.553 2.913 2.896 2.922 . 0 0 "[ . 1]" 1
689 1 54 LEU HA 1 54 LEU MD1 2.784 . 3.753 3.741 3.723 3.758 0.005 9 0 "[ . 1]" 1
690 1 54 LEU HA 1 54 LEU MD2 2.056 . 2.584 1.866 1.838 1.904 . 0 0 "[ . 1]" 1
691 1 54 LEU HA 1 55 ARG H 2.002 . 2.503 2.127 2.107 2.177 . 0 0 "[ . 1]" 1
692 1 54 LEU HA 1 91 THR MG 2.379 . 3.086 3.253 3.229 3.282 0.196 7 0 "[ . 1]" 1
693 1 54 LEU HB2 1 54 LEU MD1 2.314 . 2.983 2.560 2.534 2.599 . 0 0 "[ . 1]" 1
694 1 54 LEU HB2 1 55 ARG H 3.018 . 4.157 4.351 4.312 4.387 0.230 7 0 "[ . 1]" 1
695 1 54 LEU HB3 1 54 LEU MD1 2.369 . 3.071 2.226 2.206 2.249 . 0 0 "[ . 1]" 1
696 1 54 LEU HB3 1 55 ARG H 3.129 . 4.353 3.595 3.511 3.656 . 0 0 "[ . 1]" 1
697 1 54 LEU MD1 1 54 LEU MD2 1.841 . 2.265 2.070 2.048 2.076 . 0 0 "[ . 1]" 1
698 1 54 LEU MD1 1 54 LEU HG 2.007 . 2.510 2.122 2.118 2.125 . 0 0 "[ . 1]" 1
699 1 54 LEU MD1 1 55 ARG H 3.118 . 4.333 4.160 4.083 4.224 . 0 0 "[ . 1]" 1
700 1 54 LEU MD1 1 60 ILE MD 2.801 . 3.782 3.058 3.007 3.122 . 0 0 "[ . 1]" 1
701 1 54 LEU MD1 1 60 ILE QG 2.748 . 3.692 3.790 3.771 3.808 0.116 3 0 "[ . 1]" 1
702 1 54 LEU MD1 1 89 ILE MD 2.578 . 3.409 2.499 2.340 2.644 . 0 0 "[ . 1]" 1
703 1 54 LEU MD2 1 55 ARG H 2.291 . 2.947 1.975 1.894 2.049 . 0 0 "[ . 1]" 1
704 1 54 LEU MD2 1 91 THR MG 1.887 . 2.332 1.786 1.752 1.861 . 0 0 "[ . 1]" 1
705 1 55 ARG H 1 55 ARG QB 2.247 . 2.878 2.650 2.590 2.710 . 0 0 "[ . 1]" 1
706 1 55 ARG H 1 55 ARG QD 3.418 . 4.878 3.997 3.736 4.257 . 0 0 "[ . 1]" 1
707 1 55 ARG H 1 55 ARG HG3 2.740 . 3.679 3.822 3.788 3.860 0.181 10 0 "[ . 1]" 1
708 1 55 ARG H 1 58 ASP H 3.537 . 5.100 5.170 5.111 5.211 0.111 2 0 "[ . 1]" 1
709 1 55 ARG H 1 58 ASP HB2 3.567 . 5.158 4.299 4.228 4.381 . 0 0 "[ . 1]" 1
710 1 55 ARG H 1 58 ASP HB3 3.692 . 5.396 5.323 5.251 5.389 . 0 0 "[ . 1]" 1
711 1 55 ARG HA 1 55 ARG QB 2.108 . 2.663 2.309 2.283 2.333 . 0 0 "[ . 1]" 1
712 1 55 ARG HA 1 55 ARG QD 2.347 . 3.035 2.242 2.115 2.333 . 0 0 "[ . 1]" 1
713 1 55 ARG HA 1 56 GLN H 2.021 . 2.532 2.219 2.132 2.496 . 0 0 "[ . 1]" 1
714 1 55 ARG QB 1 55 ARG QD 2.300 . 2.961 2.254 2.185 2.313 . 0 0 "[ . 1]" 1
715 1 55 ARG QD 1 55 ARG HG2 2.174 . 2.765 2.425 2.366 2.491 . 0 0 "[ . 1]" 1
716 1 55 ARG QD 1 55 ARG HG3 2.213 . 2.825 2.266 2.196 2.322 . 0 0 "[ . 1]" 1
717 1 56 GLN H 1 56 GLN HA 2.546 . 3.356 2.860 2.840 2.931 . 0 0 "[ . 1]" 1
718 1 56 GLN H 1 56 GLN HG2 3.007 . 4.137 2.385 1.835 3.077 0.042 10 0 "[ . 1]" 1
719 1 56 GLN H 1 56 GLN HG3 2.907 . 3.963 1.837 1.723 2.442 0.128 1 0 "[ . 1]" 1
720 1 56 GLN H 1 57 GLY H 3.332 . 4.720 4.552 4.498 4.598 . 0 0 "[ . 1]" 1
721 1 56 GLN HA 1 56 GLN HB3 2.321 . 2.994 2.228 2.214 2.303 . 0 0 "[ . 1]" 1
722 1 56 GLN HA 1 56 GLN HG2 2.651 . 3.530 3.471 3.214 3.628 0.098 6 0 "[ . 1]" 1
723 1 56 GLN HA 1 56 GLN HG3 2.605 . 3.453 3.550 3.439 3.643 0.190 10 0 "[ . 1]" 1
724 1 56 GLN HA 1 57 GLY H 2.043 . 2.564 2.163 2.120 2.208 . 0 0 "[ . 1]" 1
725 1 56 GLN HA 1 58 ASP H 3.037 . 4.190 3.293 3.242 3.410 . 0 0 "[ . 1]" 1
726 1 56 GLN HB3 1 56 GLN HG3 2.151 . 2.729 2.936 2.909 2.956 0.227 5 0 "[ . 1]" 1
727 1 57 GLY H 1 57 GLY HA2 2.460 . 3.217 2.373 2.345 2.409 . 0 0 "[ . 1]" 1
728 1 57 GLY H 1 57 GLY HA3 2.373 . 3.077 2.933 2.916 2.947 . 0 0 "[ . 1]" 1
729 1 57 GLY H 1 58 ASP H 2.732 . 3.665 2.306 2.170 2.458 . 0 0 "[ . 1]" 1
730 1 57 GLY HA2 1 58 ASP H 3.107 . 4.313 3.241 3.213 3.274 . 0 0 "[ . 1]" 1
731 1 58 ASP H 1 58 ASP HB2 2.593 . 3.434 2.483 2.448 2.520 . 0 0 "[ . 1]" 1
732 1 58 ASP H 1 58 ASP HB3 2.800 . 3.780 3.650 3.627 3.669 . 0 0 "[ . 1]" 1
733 1 58 ASP HA 1 58 ASP HB3 2.900 . 3.951 2.489 2.471 2.511 . 0 0 "[ . 1]" 1
734 1 58 ASP HA 1 59 LEU H 2.395 . 3.112 2.857 2.795 2.932 . 0 0 "[ . 1]" 1
735 1 58 ASP HB2 1 59 LEU HA 3.031 . 4.180 4.374 4.341 4.425 0.245 5 0 "[ . 1]" 1
736 1 58 ASP HB2 1 60 ILE H 3.400 . 4.845 4.919 4.892 4.951 0.106 7 0 "[ . 1]" 1
737 1 58 ASP HB2 1 91 THR HB 2.885 . 3.925 3.596 3.393 3.930 0.005 10 0 "[ . 1]" 1
738 1 58 ASP HB2 1 91 THR MG 2.712 . 3.632 2.832 2.646 2.991 . 0 0 "[ . 1]" 1
739 1 58 ASP HB2 1 92 THR H 3.313 . 4.685 4.100 3.870 4.489 . 0 0 "[ . 1]" 1
740 1 58 ASP HB3 1 91 THR HB 2.607 . 3.457 2.880 2.627 3.304 . 0 0 "[ . 1]" 1
741 1 58 ASP HB3 1 91 THR MG 2.859 . 3.880 3.158 2.928 3.444 . 0 0 "[ . 1]" 1
742 1 58 ASP HB3 1 92 THR H 3.037 . 4.190 2.756 2.527 3.095 . 0 0 "[ . 1]" 1
743 1 59 LEU H 1 59 LEU HB2 2.501 . 3.283 2.611 2.555 2.648 . 0 0 "[ . 1]" 1
744 1 59 LEU H 1 59 LEU HG 2.801 . 3.782 3.879 3.857 3.900 0.118 1 0 "[ . 1]" 1
745 1 59 LEU H 1 60 ILE H 2.885 . 3.926 3.999 3.984 4.029 0.103 6 0 "[ . 1]" 1
746 1 59 LEU H 1 60 ILE HA 3.122 . 4.340 4.476 4.439 4.503 0.163 6 0 "[ . 1]" 1
747 1 59 LEU H 1 92 THR H 2.751 . 3.697 2.417 2.364 2.551 . 0 0 "[ . 1]" 1
748 1 59 LEU H 1 92 THR MG 3.113 . 4.324 3.446 3.306 3.574 . 0 0 "[ . 1]" 1
749 1 59 LEU HA 1 59 LEU HB2 2.843 . 3.854 2.959 2.955 2.965 . 0 0 "[ . 1]" 1
750 1 59 LEU HA 1 59 LEU QD 2.481 . 3.250 1.925 1.906 1.953 . 0 0 "[ . 1]" 1
751 1 59 LEU HA 1 60 ILE H 2.404 . 3.127 2.139 2.118 2.160 . 0 0 "[ . 1]" 1
752 1 59 LEU HA 1 94 LEU HB2 2.797 . 3.775 3.866 3.842 3.901 0.126 2 0 "[ . 1]" 1
753 1 59 LEU HB2 1 59 LEU QD 1.902 . 2.354 2.299 2.277 2.316 . 0 0 "[ . 1]" 1
754 1 59 LEU HB2 1 92 THR H 3.027 . 4.172 3.593 3.350 3.794 . 0 0 "[ . 1]" 1
755 1 59 LEU HB2 1 92 THR MG 2.221 . 2.837 2.219 2.146 2.336 . 0 0 "[ . 1]" 1
756 1 59 LEU HB3 1 92 THR MG 2.288 . 2.942 2.459 2.345 2.583 . 0 0 "[ . 1]" 1
757 1 59 LEU QD 1 94 LEU HA 2.436 . 3.178 2.138 2.017 2.360 . 0 0 "[ . 1]" 1
758 1 60 ILE H 1 60 ILE HA 2.931 . 4.005 2.877 2.871 2.886 . 0 0 "[ . 1]" 1
759 1 60 ILE H 1 60 ILE HB 2.493 . 3.270 2.465 2.448 2.494 . 0 0 "[ . 1]" 1
760 1 60 ILE H 1 60 ILE MD 2.646 . 3.521 3.440 3.380 3.486 . 0 0 "[ . 1]" 1
761 1 60 ILE H 1 60 ILE QG 2.262 . 2.902 2.391 2.349 2.430 . 0 0 "[ . 1]" 1
762 1 60 ILE HA 1 60 ILE HB 2.420 . 3.152 3.029 3.027 3.033 . 0 0 "[ . 1]" 1
763 1 60 ILE HA 1 60 ILE MG 1.989 . 2.483 2.422 2.387 2.457 . 0 0 "[ . 1]" 1
764 1 60 ILE HA 1 61 THR H 2.254 . 2.889 2.153 2.138 2.170 . 0 0 "[ . 1]" 1
765 1 60 ILE HA 1 62 HIS H 2.916 . 3.979 3.747 3.675 3.819 . 0 0 "[ . 1]" 1
766 1 60 ILE HA 1 91 THR HA 2.693 . 3.599 2.528 2.474 2.592 . 0 0 "[ . 1]" 1
767 1 60 ILE HA 1 91 THR MG 2.390 . 3.104 3.112 3.019 3.142 0.038 3 0 "[ . 1]" 1
768 1 60 ILE HA 1 92 THR MG 2.826 . 3.824 3.880 3.845 3.923 0.099 9 0 "[ . 1]" 1
769 1 60 ILE HB 1 60 ILE MD 1.884 . 2.328 2.315 2.281 2.339 0.011 2 0 "[ . 1]" 1
770 1 60 ILE HB 1 60 ILE MG 1.817 . 2.230 2.126 2.118 2.129 . 0 0 "[ . 1]" 1
771 1 60 ILE QG 1 61 THR H 3.083 . 4.271 4.236 4.202 4.280 0.009 5 0 "[ . 1]" 1
772 1 60 ILE QG 1 91 THR MG 2.417 . 3.147 2.588 2.464 2.807 . 0 0 "[ . 1]" 1
773 1 60 ILE MG 1 61 THR H 2.401 . 3.122 3.037 2.942 3.122 . 0 0 "[ . 1]" 1
774 1 60 ILE MG 1 62 HIS H 2.201 . 2.807 2.851 2.827 2.876 0.069 9 0 "[ . 1]" 1
775 1 61 THR H 1 61 THR HA 2.828 . 3.828 2.911 2.899 2.923 . 0 0 "[ . 1]" 1
776 1 61 THR H 1 61 THR MG 2.528 . 3.327 1.821 1.769 1.875 . 0 0 "[ . 1]" 1
777 1 61 THR H 1 62 HIS H 2.269 . 2.912 2.301 2.241 2.373 . 0 0 "[ . 1]" 1
778 1 61 THR H 1 91 THR HA 2.724 . 3.652 3.160 3.059 3.258 . 0 0 "[ . 1]" 1
779 1 61 THR HA 1 62 HIS H 2.968 . 4.069 3.523 3.508 3.538 . 0 0 "[ . 1]" 1
780 1 61 THR HB 1 61 THR MG 2.452 . 3.203 2.131 2.128 2.134 . 0 0 "[ . 1]" 1
781 1 61 THR MG 1 62 HIS H 2.729 . 3.660 2.342 2.305 2.421 . 0 0 "[ . 1]" 1
782 1 61 THR MG 1 91 THR HA 2.520 . 3.314 3.348 3.264 3.411 0.097 1 0 "[ . 1]" 1
783 1 62 HIS H 1 62 HIS HA 2.857 . 3.878 2.925 2.918 2.934 . 0 0 "[ . 1]" 1
784 1 62 HIS H 1 62 HIS HB2 2.790 . 3.763 2.936 2.883 3.012 . 0 0 "[ . 1]" 1
785 1 62 HIS H 1 62 HIS HB3 2.941 . 4.022 3.938 3.917 3.967 . 0 0 "[ . 1]" 1
786 1 62 HIS H 1 63 VAL H 3.164 . 4.416 4.343 4.328 4.369 . 0 0 "[ . 1]" 1
787 1 62 HIS H 1 90 SER H 2.634 . 3.501 3.266 3.234 3.295 . 0 0 "[ . 1]" 1
788 1 62 HIS H 1 91 THR HA 3.337 . 4.729 4.784 4.742 4.853 0.124 1 0 "[ . 1]" 1
789 1 62 HIS HA 1 62 HIS HB2 2.938 . 4.017 3.024 3.019 3.028 . 0 0 "[ . 1]" 1
790 1 62 HIS HA 1 62 HIS HB3 2.657 . 3.539 2.433 2.382 2.474 . 0 0 "[ . 1]" 1
791 1 62 HIS HA 1 62 HIS HD2 3.560 . 5.144 3.283 3.145 3.478 . 0 0 "[ . 1]" 1
792 1 62 HIS HA 1 63 VAL H 2.186 . 2.783 2.211 2.180 2.250 . 0 0 "[ . 1]" 1
793 1 62 HIS HA 1 66 GLU H 3.032 . 4.181 4.152 4.067 4.232 0.051 2 0 "[ . 1]" 1
794 1 62 HIS HA 1 67 PRO HA 2.787 . 3.758 3.241 2.858 3.499 . 0 0 "[ . 1]" 1
795 1 62 HIS HA 1 68 VAL H 2.737 . 3.673 2.812 2.666 2.949 . 0 0 "[ . 1]" 1
796 1 62 HIS HA 1 68 VAL QG 2.234 . 2.858 2.404 2.308 2.613 . 0 0 "[ . 1]" 1
797 1 62 HIS HB2 1 63 VAL H 2.831 . 3.833 3.791 3.718 3.847 0.014 1 0 "[ . 1]" 1
798 1 62 HIS HB2 1 65 GLY H 3.609 . 5.237 3.771 3.536 4.028 . 0 0 "[ . 1]" 1
799 1 62 HIS HB2 1 66 GLU H 3.089 . 4.282 4.408 4.382 4.451 0.169 1 0 "[ . 1]" 1
800 1 62 HIS HB2 1 90 SER H 2.984 . 4.097 3.414 3.257 3.554 . 0 0 "[ . 1]" 1
801 1 62 HIS HB2 1 90 SER HB2 2.867 . 3.895 2.240 2.098 2.375 . 0 0 "[ . 1]" 1
802 1 62 HIS HB2 1 90 SER HB3 2.852 . 3.869 3.331 3.230 3.401 . 0 0 "[ . 1]" 1
803 1 62 HIS HB3 1 63 VAL H 2.579 . 3.411 2.756 2.629 2.827 . 0 0 "[ . 1]" 1
804 1 62 HIS HB3 1 65 GLY H 3.412 . 4.867 3.190 3.045 3.349 . 0 0 "[ . 1]" 1
805 1 62 HIS HB3 1 65 GLY HA2 2.904 . 3.958 3.017 2.873 3.129 . 0 0 "[ . 1]" 1
806 1 62 HIS HB3 1 90 SER H 3.272 . 4.610 4.581 4.507 4.647 0.037 2 0 "[ . 1]" 1
807 1 62 HIS HD2 1 66 GLU H 3.529 . 5.086 4.531 4.155 5.018 . 0 0 "[ . 1]" 1
808 1 62 HIS HD2 1 67 PRO QB 3.223 . 4.521 3.111 2.430 3.404 . 0 0 "[ . 1]" 1
809 1 62 HIS HD2 1 67 PRO HD2 3.403 . 4.850 4.480 4.161 4.890 0.040 2 0 "[ . 1]" 1
810 1 62 HIS HD2 1 67 PRO HG3 3.108 . 4.316 3.286 2.751 4.335 0.019 4 0 "[ . 1]" 1
811 1 62 HIS HD2 1 68 VAL H 3.673 . 5.359 3.775 3.541 4.181 . 0 0 "[ . 1]" 1
812 1 63 VAL H 1 63 VAL HA 2.577 . 3.407 2.948 2.945 2.950 . 0 0 "[ . 1]" 1
813 1 63 VAL H 1 63 VAL HB 2.463 . 3.221 2.630 2.607 2.661 . 0 0 "[ . 1]" 1
814 1 63 VAL H 1 63 VAL MG2 2.597 . 3.440 2.921 2.839 2.982 . 0 0 "[ . 1]" 1
815 1 63 VAL H 1 64 ASN H 3.083 . 4.271 4.145 4.113 4.189 . 0 0 "[ . 1]" 1
816 1 63 VAL H 1 66 GLU H 2.483 . 3.254 2.627 2.542 2.704 . 0 0 "[ . 1]" 1
817 1 63 VAL H 1 66 GLU QB 2.751 . 3.697 3.125 2.970 3.273 . 0 0 "[ . 1]" 1
818 1 63 VAL H 1 68 VAL H 3.247 . 4.565 4.090 3.936 4.216 . 0 0 "[ . 1]" 1
819 1 63 VAL H 1 68 VAL QG 2.226 . 2.846 2.439 2.328 2.530 . 0 0 "[ . 1]" 1
820 1 63 VAL HA 1 63 VAL MG1 2.059 . 2.589 2.481 2.450 2.494 . 0 0 "[ . 1]" 1
821 1 63 VAL HA 1 63 VAL MG2 2.060 . 2.590 2.369 2.344 2.385 . 0 0 "[ . 1]" 1
822 1 63 VAL HA 1 64 ASN H 2.423 . 3.157 2.148 2.137 2.161 . 0 0 "[ . 1]" 1
823 1 63 VAL HB 1 63 VAL MG2 1.895 . 2.344 2.131 2.128 2.133 . 0 0 "[ . 1]" 1
824 1 63 VAL HB 1 64 ASN H 3.196 . 4.473 4.363 4.331 4.412 . 0 0 "[ . 1]" 1
825 1 63 VAL HB 1 66 GLU H 3.015 . 4.151 4.183 4.148 4.214 0.063 10 0 "[ . 1]" 1
826 1 63 VAL HB 1 79 LEU HB3 2.579 . 3.410 2.931 2.812 2.994 . 0 0 "[ . 1]" 1
827 1 63 VAL MG1 1 64 ASN H 2.420 . 3.152 2.969 2.916 3.052 . 0 0 "[ . 1]" 1
828 1 63 VAL MG1 1 64 ASN QB 2.666 . 3.554 2.804 2.705 2.892 . 0 0 "[ . 1]" 1
829 1 63 VAL MG1 1 64 ASN QD 2.533 . 3.335 2.483 2.374 2.596 . 0 0 "[ . 1]" 1
830 1 63 VAL MG1 1 79 LEU HB3 2.140 . 2.713 2.095 2.001 2.180 . 0 0 "[ . 1]" 1
831 1 63 VAL MG1 1 80 ILE HA 2.483 . 3.254 2.279 2.102 2.419 . 0 0 "[ . 1]" 1
832 1 64 ASN H 1 64 ASN HA 2.465 . 3.224 2.271 2.267 2.274 . 0 0 "[ . 1]" 1
833 1 64 ASN H 1 64 ASN QB 2.765 . 3.721 3.356 3.310 3.372 . 0 0 "[ . 1]" 1
834 1 64 ASN H 1 64 ASN QD 3.515 . 5.059 4.285 4.178 4.363 . 0 0 "[ . 1]" 1
835 1 64 ASN H 1 65 GLY H 2.966 . 4.066 2.549 2.501 2.582 . 0 0 "[ . 1]" 1
836 1 64 ASN H 1 65 GLY HA3 3.592 . 5.205 5.183 5.153 5.212 0.007 6 0 "[ . 1]" 1
837 1 64 ASN H 1 66 GLU H 3.400 . 4.845 4.047 3.981 4.118 . 0 0 "[ . 1]" 1
838 1 64 ASN H 1 66 GLU HG2 3.609 . 5.237 5.155 5.031 5.314 0.077 5 0 "[ . 1]" 1
839 1 64 ASN H 1 88 ALA H 2.887 . 3.929 3.487 3.383 3.580 . 0 0 "[ . 1]" 1
840 1 64 ASN H 1 88 ALA MB 2.543 . 3.352 3.074 2.907 3.180 . 0 0 "[ . 1]" 1
841 1 64 ASN H 1 90 SER H 3.635 . 5.287 4.090 3.987 4.253 . 0 0 "[ . 1]" 1
842 1 64 ASN HA 1 65 GLY H 3.024 . 4.167 2.972 2.884 3.036 . 0 0 "[ . 1]" 1
843 1 64 ASN HA 1 88 ALA MB 2.294 . 2.952 2.354 2.290 2.422 . 0 0 "[ . 1]" 1
844 1 64 ASN QB 1 64 ASN QD 2.345 . 3.032 2.085 2.063 2.104 . 0 0 "[ . 1]" 1
845 1 64 ASN QB 1 66 GLU H 3.000 . 4.125 3.635 3.502 3.774 . 0 0 "[ . 1]" 1
846 1 64 ASN QB 1 83 SER H 3.663 . 5.340 5.482 5.449 5.526 0.186 7 0 "[ . 1]" 1
847 1 64 ASN QB 1 88 ALA H 3.529 . 5.086 4.230 4.150 4.341 . 0 0 "[ . 1]" 1
848 1 64 ASN QB 1 88 ALA MB 3.031 . 4.180 4.209 4.184 4.239 0.059 3 0 "[ . 1]" 1
849 1 64 ASN QD 1 87 VAL HB 3.424 . 4.889 3.513 3.259 4.008 . 0 0 "[ . 1]" 1
850 1 64 ASN QD 1 87 VAL MG2 2.398 . 3.117 2.270 1.981 2.606 . 0 0 "[ . 1]" 1
851 1 64 ASN QD 1 88 ALA H 3.308 . 4.676 4.248 4.026 4.516 . 0 0 "[ . 1]" 1
852 1 65 GLY H 1 65 GLY HA2 2.923 . 3.991 2.328 2.310 2.348 . 0 0 "[ . 1]" 1
853 1 65 GLY H 1 65 GLY HA3 2.892 . 3.938 2.896 2.871 2.913 . 0 0 "[ . 1]" 1
854 1 65 GLY H 1 66 GLU H 2.518 . 3.311 2.399 2.312 2.489 . 0 0 "[ . 1]" 1
855 1 65 GLY H 1 88 ALA MB 3.529 . 5.086 3.801 3.687 3.998 . 0 0 "[ . 1]" 1
856 1 65 GLY HA2 1 66 GLU H 2.669 . 3.559 3.124 3.051 3.188 . 0 0 "[ . 1]" 1
857 1 65 GLY HA3 1 66 GLU H 2.720 . 3.645 3.416 3.377 3.470 . 0 0 "[ . 1]" 1
858 1 66 GLU H 1 66 GLU HA 2.549 . 3.361 2.940 2.931 2.950 . 0 0 "[ . 1]" 1
859 1 66 GLU H 1 66 GLU QB 2.019 . 2.529 2.606 2.557 2.647 0.118 3 0 "[ . 1]" 1
860 1 66 GLU H 1 66 GLU HG2 2.627 . 3.490 2.375 2.263 2.459 . 0 0 "[ . 1]" 1
861 1 66 GLU H 1 66 GLU HG3 2.677 . 3.573 3.632 3.578 3.690 0.117 1 0 "[ . 1]" 1
862 1 66 GLU HA 1 66 GLU QB 2.461 . 3.218 2.297 2.282 2.313 . 0 0 "[ . 1]" 1
863 1 66 GLU HA 1 67 PRO HD2 2.818 . 3.811 2.620 2.240 2.784 . 0 0 "[ . 1]" 1
864 1 66 GLU QB 1 79 LEU MD2 2.351 . 3.042 1.859 1.800 1.987 . 0 0 "[ . 1]" 1
865 1 66 GLU HG2 1 79 LEU MD2 2.534 . 3.337 3.435 3.394 3.454 0.117 6 0 "[ . 1]" 1
866 1 67 PRO HA 1 68 VAL H 2.191 . 2.791 2.159 2.145 2.182 . 0 0 "[ . 1]" 1
867 1 67 PRO QB 1 67 PRO HG2 1.951 . 2.427 2.190 2.180 2.217 . 0 0 "[ . 1]" 1
868 1 67 PRO QB 1 68 VAL H 2.678 . 3.575 3.561 3.463 3.621 0.046 8 0 "[ . 1]" 1
869 1 67 PRO QB 1 69 HIS H 2.563 . 3.384 3.349 3.244 3.442 0.058 3 0 "[ . 1]" 1
870 1 67 PRO HD2 1 67 PRO HG2 2.579 . 3.410 2.297 2.263 2.314 . 0 0 "[ . 1]" 1
871 1 67 PRO HD2 1 67 PRO HG3 2.238 . 2.864 2.935 2.766 2.981 0.117 6 0 "[ . 1]" 1
872 1 67 PRO HD2 1 68 VAL H 3.592 . 5.205 5.239 5.186 5.288 0.083 9 0 "[ . 1]" 1
873 1 67 PRO HD3 1 67 PRO HG2 2.269 . 2.913 2.730 2.670 2.942 0.029 9 0 "[ . 1]" 1
874 1 68 VAL H 1 68 VAL QG 2.153 . 2.732 1.948 1.922 2.004 . 0 0 "[ . 1]" 1
875 1 68 VAL H 1 69 HIS H 2.526 . 3.324 2.332 2.180 2.425 . 0 0 "[ . 1]" 1
876 1 68 VAL H 1 69 HIS HB2 3.332 . 4.720 4.288 4.007 4.637 . 0 0 "[ . 1]" 1
877 1 68 VAL H 1 69 HIS HB3 3.368 . 4.786 4.787 4.698 4.846 0.060 8 0 "[ . 1]" 1
878 1 68 VAL H 1 76 VAL MG1 3.600 . 5.220 4.770 4.653 4.852 . 0 0 "[ . 1]" 1
879 1 68 VAL HA 1 68 VAL HB 2.264 . 2.905 2.420 2.408 2.430 . 0 0 "[ . 1]" 1
880 1 68 VAL HA 1 68 VAL QG 2.042 . 2.563 2.300 2.273 2.334 . 0 0 "[ . 1]" 1
881 1 68 VAL HA 1 71 LEU HB2 2.851 . 3.867 3.723 3.331 3.986 0.119 4 0 "[ . 1]" 1
882 1 68 VAL HA 1 71 LEU HG 2.414 . 3.143 2.653 2.478 2.942 . 0 0 "[ . 1]" 1
883 1 68 VAL HA 1 76 VAL MG1 2.831 . 3.833 3.139 2.942 3.394 . 0 0 "[ . 1]" 1
884 1 68 VAL HB 1 68 VAL QG 1.907 . 2.361 1.897 1.896 1.899 . 0 0 "[ . 1]" 1
885 1 68 VAL HB 1 71 LEU H 3.592 . 5.205 4.341 4.092 4.572 . 0 0 "[ . 1]" 1
886 1 68 VAL HB 1 71 LEU MD1 2.172 . 2.762 2.691 2.514 2.811 0.049 2 0 "[ . 1]" 1
887 1 68 VAL HB 1 71 LEU HG 2.909 . 3.967 4.024 3.957 4.076 0.109 5 0 "[ . 1]" 1
888 1 68 VAL HB 1 76 VAL MG1 2.273 . 2.919 1.773 1.749 1.793 . 0 0 "[ . 1]" 1
889 1 68 VAL QG 1 69 HIS H 2.484 . 3.255 2.863 2.675 3.089 . 0 0 "[ . 1]" 1
890 1 68 VAL QG 1 76 VAL HA 2.732 . 3.665 3.106 2.899 3.322 . 0 0 "[ . 1]" 1
891 1 68 VAL QG 1 76 VAL MG1 1.940 . 2.411 2.231 2.076 2.387 . 0 0 "[ . 1]" 1
892 1 69 HIS H 1 69 HIS HA 2.474 . 3.239 2.832 2.802 2.864 . 0 0 "[ . 1]" 1
893 1 69 HIS H 1 69 HIS HB2 2.329 . 3.007 2.458 2.332 2.607 . 0 0 "[ . 1]" 1
894 1 69 HIS H 1 69 HIS HB3 2.244 . 2.873 2.614 2.478 2.721 . 0 0 "[ . 1]" 1
895 1 69 HIS HA 1 69 HIS HB2 2.534 . 3.336 2.520 2.427 2.582 . 0 0 "[ . 1]" 1
896 1 69 HIS HA 1 69 HIS HB3 2.592 . 3.432 3.022 3.011 3.029 . 0 0 "[ . 1]" 1
897 1 69 HIS HA 1 70 GLY H 2.740 . 3.679 2.196 2.132 2.261 . 0 0 "[ . 1]" 1
898 1 70 GLY H 1 70 GLY HA3 2.968 . 4.069 2.942 2.930 2.954 . 0 0 "[ . 1]" 1
899 1 70 GLY H 1 71 LEU H 3.182 . 4.447 2.331 2.194 2.521 . 0 0 "[ . 1]" 1
900 1 70 GLY HA2 1 71 LEU H 3.045 . 4.204 3.495 3.482 3.507 . 0 0 "[ . 1]" 1
901 1 70 GLY HA3 1 71 LEU H 3.066 . 4.241 3.024 2.949 3.075 . 0 0 "[ . 1]" 1
902 1 71 LEU H 1 71 LEU HA 2.810 . 3.797 2.856 2.809 2.894 . 0 0 "[ . 1]" 1
903 1 71 LEU H 1 71 LEU HB2 2.583 . 3.417 2.592 2.331 2.852 . 0 0 "[ . 1]" 1
904 1 71 LEU H 1 71 LEU HB3 2.847 . 3.860 3.583 3.539 3.630 . 0 0 "[ . 1]" 1
905 1 71 LEU H 1 71 LEU MD1 2.515 . 3.306 3.546 3.461 3.664 0.358 6 0 "[ . 1]" 1
906 1 71 LEU H 1 71 LEU MD2 2.664 . 3.551 3.244 2.928 3.536 . 0 0 "[ . 1]" 1
907 1 71 LEU H 1 71 LEU HG 2.392 . 3.107 2.196 1.885 2.511 . 0 0 "[ . 1]" 1
908 1 71 LEU H 1 72 VAL H 3.412 . 4.867 4.492 4.390 4.554 . 0 0 "[ . 1]" 1
909 1 71 LEU H 1 76 VAL MG1 3.211 . 4.500 4.016 3.861 4.157 . 0 0 "[ . 1]" 1
910 1 71 LEU HA 1 71 LEU HB3 2.555 . 3.371 2.406 2.292 2.526 . 0 0 "[ . 1]" 1
911 1 71 LEU HA 1 72 VAL H 2.682 . 3.581 2.463 2.315 2.638 . 0 0 "[ . 1]" 1
912 1 71 LEU HB2 1 75 GLU HB2 2.544 . 3.353 2.862 2.297 3.402 0.049 6 0 "[ . 1]" 1
913 1 71 LEU HB2 1 76 VAL MG1 2.583 . 3.417 2.336 2.202 2.481 . 0 0 "[ . 1]" 1
914 1 71 LEU HB3 1 72 VAL H 2.783 . 3.751 2.091 1.866 2.254 . 0 0 "[ . 1]" 1
915 1 71 LEU HB3 1 75 GLU HB2 2.503 . 3.286 1.829 1.741 1.969 . 0 0 "[ . 1]" 1
916 1 71 LEU HB3 1 75 GLU HB3 2.487 . 3.260 2.554 2.348 2.743 . 0 0 "[ . 1]" 1
917 1 71 LEU HB3 1 75 GLU QG 2.753 . 3.701 2.622 2.182 3.116 . 0 0 "[ . 1]" 1
918 1 71 LEU HB3 1 76 VAL MG1 2.711 . 3.630 3.150 2.523 3.649 0.019 3 0 "[ . 1]" 1
919 1 71 LEU MD1 1 75 GLU HB2 1.888 . 2.334 2.516 2.448 2.560 0.226 1 0 "[ . 1]" 1
920 1 71 LEU MD1 1 76 VAL MG1 2.196 . 2.799 2.043 1.978 2.117 . 0 0 "[ . 1]" 1
921 1 71 LEU HG 1 75 GLU HB2 2.953 . 4.043 4.398 4.369 4.418 0.375 9 0 "[ . 1]" 1
922 1 71 LEU HG 1 76 VAL MG1 2.778 . 3.743 3.641 3.435 3.771 0.028 1 0 "[ . 1]" 1
923 1 72 VAL H 1 72 VAL MG2 2.071 . 2.607 1.865 1.814 1.954 . 0 0 "[ . 1]" 1
924 1 72 VAL H 1 75 GLU H 3.235 . 4.543 3.512 3.333 3.627 . 0 0 "[ . 1]" 1
925 1 72 VAL H 1 75 GLU HB2 2.894 . 3.941 2.344 2.074 2.529 . 0 0 "[ . 1]" 1
926 1 72 VAL H 1 75 GLU HB3 2.979 . 4.088 3.743 3.502 3.923 . 0 0 "[ . 1]" 1
927 1 72 VAL H 1 75 GLU QG 3.027 . 4.172 2.439 2.208 2.705 . 0 0 "[ . 1]" 1
928 1 72 VAL HA 1 72 VAL HB 2.872 . 3.903 2.479 2.439 2.505 . 0 0 "[ . 1]" 1
929 1 72 VAL HA 1 72 VAL MG1 2.526 . 3.323 2.356 2.266 2.416 . 0 0 "[ . 1]" 1
930 1 72 VAL HB 1 72 VAL MG1 2.003 . 2.505 2.127 2.123 2.132 . 0 0 "[ . 1]" 1
931 1 72 VAL HB 1 72 VAL MG2 2.015 . 2.523 2.095 2.088 2.105 . 0 0 "[ . 1]" 1
932 1 72 VAL HB 1 73 HIS H 3.200 . 4.480 2.153 1.979 2.245 . 0 0 "[ . 1]" 1
933 1 72 VAL HB 1 74 THR H 3.384 . 4.815 3.023 2.797 3.246 . 0 0 "[ . 1]" 1
934 1 72 VAL HB 1 75 GLU H 3.350 . 4.753 3.837 3.678 3.994 . 0 0 "[ . 1]" 1
935 1 72 VAL MG1 1 75 GLU QG 2.640 . 3.511 3.298 3.072 3.529 0.018 1 0 "[ . 1]" 1
936 1 72 VAL MG2 1 73 HIS H 3.299 . 4.659 3.191 2.916 3.387 . 0 0 "[ . 1]" 1
937 1 72 VAL MG2 1 74 THR H 2.458 . 3.213 2.254 2.068 2.432 . 0 0 "[ . 1]" 1
938 1 72 VAL MG2 1 75 GLU H 1.979 . 2.469 1.777 1.750 1.839 . 0 0 "[ . 1]" 1
939 1 72 VAL MG2 1 75 GLU HA 2.713 . 3.633 3.479 3.425 3.573 . 0 0 "[ . 1]" 1
940 1 72 VAL MG2 1 75 GLU HB3 2.417 . 3.147 3.445 3.410 3.488 0.341 2 0 "[ . 1]" 1
941 1 72 VAL MG2 1 75 GLU QG 1.923 . 2.385 1.801 1.708 1.899 . 0 0 "[ . 1]" 1
942 1 72 VAL MG2 1 76 VAL H 2.677 . 3.573 3.660 3.644 3.684 0.111 3 0 "[ . 1]" 1
943 1 73 HIS H 1 73 HIS HB3 3.395 . 4.836 2.538 2.503 2.570 . 0 0 "[ . 1]" 1
944 1 73 HIS HB2 1 73 HIS HD2 3.073 . 4.253 3.644 3.597 3.684 . 0 0 "[ . 1]" 1
945 1 73 HIS HB2 1 74 THR H 2.835 . 3.839 3.865 3.846 3.895 0.056 4 0 "[ . 1]" 1
946 1 73 HIS HB3 1 73 HIS HD2 3.600 . 5.220 2.656 2.643 2.666 . 0 0 "[ . 1]" 1
947 1 73 HIS HB3 1 74 THR H 2.900 . 3.951 2.584 2.530 2.639 . 0 0 "[ . 1]" 1
948 1 73 HIS HD2 1 74 THR MG 2.548 . 3.360 3.340 3.172 3.388 0.028 7 0 "[ . 1]" 1
949 1 73 HIS HD2 1 77 VAL MG2 3.263 . 4.593 3.459 3.304 3.700 . 0 0 "[ . 1]" 1
950 1 73 HIS HD2 2 11 THR HA 4.854 . 6.004 5.356 5.153 5.446 . 0 0 "[ . 1]" 1
951 1 73 HIS HD2 2 11 THR HB 4.909 . 5.999 3.482 2.996 4.264 . 0 0 "[ . 1]" 1
952 1 73 HIS HD2 2 11 THR MG 4.863 . 6.003 4.201 3.949 4.515 . 0 0 "[ . 1]" 1
953 1 73 HIS HE1 1 77 VAL MG2 2.682 . 3.581 3.529 3.393 3.610 0.029 4 0 "[ . 1]" 1
954 1 73 HIS HE1 2 11 THR HB 4.808 . 5.998 3.720 3.601 3.907 . 0 0 "[ . 1]" 1
955 1 73 HIS HE1 2 11 THR MG 4.970 . 6.000 5.097 4.921 5.294 . 0 0 "[ . 1]" 1
956 1 74 THR H 1 74 THR HA 2.707 . 3.623 2.847 2.837 2.857 . 0 0 "[ . 1]" 1
957 1 74 THR H 1 74 THR HB 2.848 . 3.862 3.545 3.526 3.575 . 0 0 "[ . 1]" 1
958 1 74 THR H 1 74 THR MG 2.366 . 3.066 2.613 2.506 2.696 . 0 0 "[ . 1]" 1
959 1 74 THR H 1 75 GLU H 2.800 . 3.780 2.668 2.614 2.712 . 0 0 "[ . 1]" 1
960 1 74 THR H 1 75 GLU QG 3.508 . 5.046 4.537 4.375 4.672 . 0 0 "[ . 1]" 1
961 1 74 THR H 1 76 VAL H 3.537 . 5.100 4.396 4.344 4.428 . 0 0 "[ . 1]" 1
962 1 74 THR H 1 77 VAL MG2 3.644 . 5.304 4.390 4.317 4.464 . 0 0 "[ . 1]" 1
963 1 74 THR HA 1 74 THR HB 2.218 . 2.833 2.582 2.542 2.608 . 0 0 "[ . 1]" 1
964 1 74 THR HA 1 74 THR MG 2.102 . 2.654 2.215 2.199 2.246 . 0 0 "[ . 1]" 1
965 1 74 THR HA 1 75 GLU H 2.926 . 3.996 3.552 3.526 3.566 . 0 0 "[ . 1]" 1
966 1 74 THR HA 1 77 VAL H 2.497 . 3.276 3.104 3.068 3.143 . 0 0 "[ . 1]" 1
967 1 74 THR HA 1 77 VAL HB 2.094 . 2.642 1.920 1.898 1.944 . 0 0 "[ . 1]" 1
968 1 74 THR HA 1 77 VAL MG1 2.420 . 3.152 3.257 3.240 3.276 0.124 10 0 "[ . 1]" 1
969 1 74 THR HA 1 77 VAL MG2 2.334 . 3.015 2.764 2.713 2.825 . 0 0 "[ . 1]" 1
970 1 74 THR HA 1 78 GLU H 2.669 . 3.560 3.647 3.621 3.685 0.125 7 0 "[ . 1]" 1
971 1 74 THR HB 1 74 THR MG 1.952 . 2.428 2.133 2.131 2.137 . 0 0 "[ . 1]" 1
972 1 74 THR HB 1 75 GLU H 2.814 . 3.804 3.657 3.553 3.784 . 0 0 "[ . 1]" 1
973 1 74 THR HB 1 77 VAL HB 2.813 . 3.802 3.892 3.849 3.930 0.128 6 0 "[ . 1]" 1
974 1 74 THR MG 1 75 GLU H 3.012 . 4.146 4.222 4.204 4.261 0.115 7 0 "[ . 1]" 1
975 1 74 THR MG 1 77 VAL MG2 2.717 . 3.639 3.495 3.399 3.568 . 0 0 "[ . 1]" 1
976 1 75 GLU H 1 75 GLU HA 2.456 . 3.210 2.782 2.767 2.799 . 0 0 "[ . 1]" 1
977 1 75 GLU H 1 75 GLU HB2 2.601 . 3.447 2.418 2.370 2.450 . 0 0 "[ . 1]" 1
978 1 75 GLU H 1 75 GLU HB3 2.518 . 3.310 3.558 3.549 3.564 0.254 2 0 "[ . 1]" 1
979 1 75 GLU H 1 75 GLU QG 2.322 . 2.996 2.508 2.358 2.659 . 0 0 "[ . 1]" 1
980 1 75 GLU H 1 76 VAL H 2.376 . 3.081 2.683 2.633 2.728 . 0 0 "[ . 1]" 1
981 1 75 GLU H 1 76 VAL MG1 3.083 . 4.271 3.999 3.815 4.145 . 0 0 "[ . 1]" 1
982 1 75 GLU H 1 77 VAL H 3.147 . 4.385 3.929 3.880 3.982 . 0 0 "[ . 1]" 1
983 1 75 GLU H 1 77 VAL MG2 3.682 . 5.377 5.022 4.960 5.102 . 0 0 "[ . 1]" 1
984 1 75 GLU H 1 78 GLU H 3.522 . 5.073 4.730 4.673 4.789 . 0 0 "[ . 1]" 1
985 1 75 GLU HA 1 75 GLU HB2 2.385 . 3.096 3.018 3.007 3.026 . 0 0 "[ . 1]" 1
986 1 75 GLU HA 1 75 GLU HB3 2.655 . 3.536 2.534 2.506 2.568 . 0 0 "[ . 1]" 1
987 1 75 GLU HA 1 75 GLU QG 1.954 . 2.431 2.562 2.517 2.641 0.210 2 0 "[ . 1]" 1
988 1 75 GLU HA 1 76 VAL H 2.610 . 3.462 3.509 3.504 3.516 0.054 8 0 "[ . 1]" 1
989 1 75 GLU HB2 1 76 VAL H 2.400 . 3.120 2.647 2.616 2.675 . 0 0 "[ . 1]" 1
990 1 75 GLU HB2 1 76 VAL MG1 3.011 . 4.145 3.071 2.978 3.204 . 0 0 "[ . 1]" 1
991 1 75 GLU HB3 1 76 VAL H 2.701 . 3.613 3.399 3.311 3.492 . 0 0 "[ . 1]" 1
992 1 75 GLU HB3 1 76 VAL MG1 2.695 . 3.603 3.663 3.604 3.709 0.106 6 0 "[ . 1]" 1
993 1 76 VAL H 1 76 VAL HA 2.274 . 2.921 2.861 2.853 2.871 . 0 0 "[ . 1]" 1
994 1 76 VAL H 1 76 VAL MG1 2.247 . 2.878 2.023 1.865 2.122 . 0 0 "[ . 1]" 1
995 1 76 VAL H 1 76 VAL MG2 2.536 . 3.340 2.273 2.103 2.466 . 0 0 "[ . 1]" 1
996 1 76 VAL H 1 77 VAL H 2.384 . 3.094 2.484 2.434 2.509 . 0 0 "[ . 1]" 1
997 1 76 VAL HA 1 76 VAL HB 2.427 . 3.164 2.378 2.329 2.427 . 0 0 "[ . 1]" 1
998 1 76 VAL HA 1 76 VAL MG1 2.155 . 2.735 2.415 2.374 2.494 . 0 0 "[ . 1]" 1
999 1 76 VAL HA 1 77 VAL H 2.774 . 3.736 3.521 3.509 3.534 . 0 0 "[ . 1]" 1
1000 1 76 VAL HA 1 79 LEU H 2.801 . 3.782 3.362 3.331 3.417 . 0 0 "[ . 1]" 1
1001 1 76 VAL HA 1 79 LEU HB2 2.794 . 3.770 2.080 2.015 2.135 . 0 0 "[ . 1]" 1
1002 1 76 VAL HA 1 79 LEU HB3 2.712 . 3.631 2.984 2.900 3.093 . 0 0 "[ . 1]" 1
1003 1 76 VAL HA 1 79 LEU MD2 2.106 . 2.660 2.716 2.688 2.748 0.088 8 0 "[ . 1]" 1
1004 1 76 VAL HA 1 80 ILE MD 3.020 . 4.160 4.159 4.126 4.183 0.023 4 0 "[ . 1]" 1
1005 1 76 VAL HB 1 76 VAL MG1 2.227 . 2.847 2.126 2.124 2.129 . 0 0 "[ . 1]" 1
1006 1 76 VAL HB 1 76 VAL MG2 2.144 . 2.719 2.130 2.127 2.132 . 0 0 "[ . 1]" 1
1007 1 76 VAL MG1 1 76 VAL MG2 1.912 . 2.369 2.077 2.069 2.083 . 0 0 "[ . 1]" 1
1008 1 76 VAL MG1 1 77 VAL H 2.875 . 3.908 3.747 3.616 3.865 . 0 0 "[ . 1]" 1
1009 1 76 VAL MG1 1 79 LEU H 3.600 . 5.220 5.119 5.077 5.184 . 0 0 "[ . 1]" 1
1010 1 76 VAL MG2 1 77 VAL H 2.601 . 3.447 2.221 2.175 2.273 . 0 0 "[ . 1]" 1
1011 1 76 VAL MG2 1 77 VAL HA 2.827 . 3.826 3.114 3.022 3.220 . 0 0 "[ . 1]" 1
1012 1 77 VAL H 1 77 VAL HA 2.302 . 2.964 2.801 2.789 2.813 . 0 0 "[ . 1]" 1
1013 1 77 VAL H 1 77 VAL HB 2.163 . 2.748 2.307 2.288 2.319 . 0 0 "[ . 1]" 1
1014 1 77 VAL H 1 77 VAL MG2 1.964 . 2.446 2.454 2.399 2.472 0.026 9 0 "[ . 1]" 1
1015 1 77 VAL H 1 78 GLU H 2.456 . 3.210 2.748 2.690 2.806 . 0 0 "[ . 1]" 1
1016 1 77 VAL HA 1 77 VAL HB 2.314 . 2.983 3.007 3.004 3.011 0.028 10 0 "[ . 1]" 1
1017 1 77 VAL HA 1 77 VAL MG1 2.134 . 2.703 2.642 2.627 2.654 . 0 0 "[ . 1]" 1
1018 1 77 VAL HA 1 77 VAL MG2 2.051 . 2.577 2.250 2.239 2.259 . 0 0 "[ . 1]" 1
1019 1 77 VAL HA 1 78 GLU H 2.882 . 3.920 3.541 3.534 3.548 . 0 0 "[ . 1]" 1
1020 1 77 VAL HA 1 80 ILE H 2.927 . 3.998 3.716 3.645 3.752 . 0 0 "[ . 1]" 1
1021 1 77 VAL HA 1 80 ILE HB 2.563 . 3.384 3.103 3.036 3.196 . 0 0 "[ . 1]" 1
1022 1 77 VAL HA 1 80 ILE MD 2.366 . 3.066 1.957 1.915 2.000 . 0 0 "[ . 1]" 1
1023 1 77 VAL HA 1 81 LEU H 2.983 . 4.095 4.206 4.151 4.253 0.158 2 0 "[ . 1]" 1
1024 1 77 VAL HA 2 11 THR MG 4.827 . 5.997 5.069 4.291 5.464 . 0 0 "[ . 1]" 1
1025 1 77 VAL HA 2 13 VAL MG1 4.600 . 6.000 3.749 3.178 4.234 . 0 0 "[ . 1]" 1
1026 1 77 VAL HB 1 77 VAL MG2 1.926 . 2.390 2.127 2.126 2.130 . 0 0 "[ . 1]" 1
1027 1 77 VAL HB 1 78 GLU H 2.250 . 2.883 2.525 2.486 2.551 . 0 0 "[ . 1]" 1
1028 1 77 VAL HB 2 11 THR MG 4.845 . 5.995 4.284 3.841 4.688 . 0 0 "[ . 1]" 1
1029 1 77 VAL MG1 1 77 VAL MG2 1.786 . 2.185 2.079 2.071 2.087 . 0 0 "[ . 1]" 1
1030 1 77 VAL MG1 1 78 GLU H 2.268 . 2.911 2.845 2.780 2.901 . 0 0 "[ . 1]" 1
1031 1 77 VAL MG1 2 11 THR HA 4.949 . 5.999 5.659 5.198 6.048 0.049 1 0 "[ . 1]" 1
1032 1 77 VAL MG1 2 11 THR MG 1.800 . 6.000 2.527 2.022 2.937 . 0 0 "[ . 1]" 1
1033 1 77 VAL MG1 2 13 VAL HB 4.830 . 6.000 3.015 2.329 4.505 . 0 0 "[ . 1]" 1
1034 1 77 VAL MG2 1 80 ILE MD 2.668 . 3.558 3.199 3.152 3.252 . 0 0 "[ . 1]" 1
1035 1 77 VAL MG2 2 11 THR HA 4.929 . 5.999 4.968 4.644 5.253 . 0 0 "[ . 1]" 1
1036 1 77 VAL MG2 2 11 THR HB 4.050 . 6.000 2.494 2.302 2.781 . 0 0 "[ . 1]" 1
1037 1 77 VAL MG2 2 11 THR MG 2.504 . 6.004 2.650 2.209 2.919 . 0 0 "[ . 1]" 1
1038 1 77 VAL MG2 2 13 VAL MG1 4.299 . 5.999 3.402 2.756 3.833 . 0 0 "[ . 1]" 1
1039 1 78 GLU H 1 78 GLU HA 2.170 . 2.759 2.789 2.782 2.797 0.038 5 0 "[ . 1]" 1
1040 1 78 GLU H 1 78 GLU HG2 2.419 . 3.151 3.082 2.997 3.148 . 0 0 "[ . 1]" 1
1041 1 78 GLU H 1 78 GLU HG3 2.492 . 3.268 2.194 2.014 2.382 . 0 0 "[ . 1]" 1
1042 1 78 GLU HA 1 78 GLU HB2 2.051 . 2.577 2.968 2.962 2.975 0.398 3 0 "[ . 1]" 1
1043 1 78 GLU HA 1 78 GLU HB3 2.401 . 3.121 2.447 2.418 2.483 . 0 0 "[ . 1]" 1
1044 1 78 GLU HA 1 78 GLU HG2 2.341 . 3.026 2.330 2.192 2.503 . 0 0 "[ . 1]" 1
1045 1 78 GLU HA 1 78 GLU HG3 2.373 . 3.077 3.185 3.130 3.242 0.165 9 0 "[ . 1]" 1
1046 1 78 GLU HA 1 81 LEU H 2.532 . 3.333 3.441 3.412 3.463 0.130 2 0 "[ . 1]" 1
1047 1 78 GLU HA 1 81 LEU HB2 2.127 . 2.693 2.341 2.311 2.385 . 0 0 "[ . 1]" 1
1048 1 78 GLU HA 1 81 LEU HB3 2.831 . 3.833 3.889 3.853 3.909 0.076 1 0 "[ . 1]" 1
1049 1 78 GLU HA 1 81 LEU MD1 2.906 . 3.961 2.292 2.044 2.694 . 0 0 "[ . 1]" 1
1050 1 78 GLU HB2 1 79 LEU H 2.573 . 3.400 2.253 2.137 2.358 . 0 0 "[ . 1]" 1
1051 1 78 GLU HB3 1 78 GLU HG2 1.925 . 2.388 2.497 2.426 2.546 0.158 8 0 "[ . 1]" 1
1052 1 78 GLU HB3 1 79 LEU H 2.511 . 3.299 3.364 3.329 3.407 0.108 6 0 "[ . 1]" 1
1053 1 78 GLU HG2 1 79 LEU H 3.055 . 4.222 4.598 4.567 4.628 0.406 7 0 "[ . 1]" 1
1054 1 79 LEU H 1 79 LEU HA 2.311 . 2.978 2.725 2.718 2.736 . 0 0 "[ . 1]" 1
1055 1 79 LEU H 1 79 LEU HB2 2.007 . 2.510 2.087 2.081 2.097 . 0 0 "[ . 1]" 1
1056 1 79 LEU H 1 79 LEU HB3 2.487 . 3.260 3.251 3.230 3.266 0.006 3 0 "[ . 1]" 1
1057 1 79 LEU H 1 79 LEU MD1 2.356 . 3.050 3.082 3.054 3.129 0.079 4 0 "[ . 1]" 1
1058 1 79 LEU H 1 81 LEU H 3.259 . 4.587 4.410 4.362 4.463 . 0 0 "[ . 1]" 1
1059 1 79 LEU HA 1 79 LEU HB2 2.573 . 3.400 2.780 2.768 2.788 . 0 0 "[ . 1]" 1
1060 1 79 LEU HA 1 79 LEU HB3 2.477 . 3.244 2.903 2.896 2.915 . 0 0 "[ . 1]" 1
1061 1 79 LEU HA 1 79 LEU MD1 1.922 . 2.384 2.260 2.170 2.356 . 0 0 "[ . 1]" 1
1062 1 79 LEU HA 1 79 LEU MD2 2.893 . 3.939 3.738 3.721 3.752 . 0 0 "[ . 1]" 1
1063 1 79 LEU HB2 1 79 LEU MD1 2.184 . 2.780 2.261 2.213 2.296 . 0 0 "[ . 1]" 1
1064 1 79 LEU HB2 1 79 LEU MD2 2.094 . 2.642 2.434 2.399 2.486 . 0 0 "[ . 1]" 1
1065 1 79 LEU HB2 1 80 ILE H 2.647 . 3.523 3.064 3.030 3.097 . 0 0 "[ . 1]" 1
1066 1 79 LEU HB3 1 79 LEU MD2 2.045 . 2.568 2.200 2.162 2.227 . 0 0 "[ . 1]" 1
1067 1 79 LEU HB3 1 80 ILE H 2.416 . 3.145 2.347 2.323 2.372 . 0 0 "[ . 1]" 1
1068 1 79 LEU MD1 1 79 LEU HG 1.958 . 2.437 2.125 2.120 2.130 . 0 0 "[ . 1]" 1
1069 1 79 LEU MD1 1 82 LYS QE 2.373 . 3.077 2.494 2.277 2.690 . 0 0 "[ . 1]" 1
1070 1 79 LEU MD2 1 79 LEU HG 1.851 . 2.279 2.092 2.085 2.104 . 0 0 "[ . 1]" 1
1071 1 79 LEU MD2 1 80 ILE H 2.964 . 4.062 4.142 4.124 4.165 0.103 10 0 "[ . 1]" 1
1072 1 80 ILE H 1 80 ILE HA 2.408 . 3.133 2.747 2.741 2.752 . 0 0 "[ . 1]" 1
1073 1 80 ILE H 1 80 ILE HB 2.171 . 2.760 2.466 2.445 2.491 . 0 0 "[ . 1]" 1
1074 1 80 ILE H 1 80 ILE MD 2.102 . 2.654 2.909 2.892 2.927 0.273 5 0 "[ . 1]" 1
1075 1 80 ILE H 1 80 ILE HG12 2.429 . 3.167 3.446 3.432 3.465 0.298 10 0 "[ . 1]" 1
1076 1 80 ILE H 1 81 LEU H 2.435 . 3.176 2.904 2.890 2.928 . 0 0 "[ . 1]" 1
1077 1 80 ILE H 1 82 LYS H 3.040 . 4.195 4.263 4.241 4.288 0.093 5 0 "[ . 1]" 1
1078 1 80 ILE HA 1 80 ILE HB 2.382 . 3.091 3.014 3.011 3.017 . 0 0 "[ . 1]" 1
1079 1 80 ILE HA 1 80 ILE HG12 2.222 . 2.839 2.753 2.743 2.763 . 0 0 "[ . 1]" 1
1080 1 80 ILE HA 1 80 ILE HG13 2.745 . 3.687 2.639 2.620 2.660 . 0 0 "[ . 1]" 1
1081 1 80 ILE HA 1 80 ILE MG 2.276 . 2.923 2.420 2.407 2.436 . 0 0 "[ . 1]" 1
1082 1 80 ILE HA 1 81 LEU H 2.864 . 3.890 3.549 3.540 3.558 . 0 0 "[ . 1]" 1
1083 1 80 ILE HA 1 83 SER H 3.061 . 4.232 3.838 3.724 3.928 . 0 0 "[ . 1]" 1
1084 1 80 ILE HA 1 87 VAL MG2 2.420 . 3.152 2.176 2.076 2.300 . 0 0 "[ . 1]" 1
1085 1 80 ILE HA 2 13 VAL MG1 4.943 . 6.003 5.748 5.578 6.017 0.014 8 0 "[ . 1]" 1
1086 1 80 ILE HB 1 80 ILE MG 1.870 . 2.307 2.114 2.110 2.116 . 0 0 "[ . 1]" 1
1087 1 80 ILE HB 1 81 LEU H 2.362 . 3.060 2.186 2.162 2.210 . 0 0 "[ . 1]" 1
1088 1 80 ILE HB 2 13 VAL MG1 4.772 . 6.002 3.722 3.523 3.917 . 0 0 "[ . 1]" 1
1089 1 80 ILE MD 1 80 ILE HG12 1.779 . 2.175 2.110 2.106 2.113 . 0 0 "[ . 1]" 1
1090 1 80 ILE MD 1 81 LEU H 2.891 . 3.936 3.971 3.951 3.985 0.049 10 0 "[ . 1]" 1
1091 1 80 ILE MD 2 13 VAL MG1 4.283 . 6.003 2.270 2.126 2.459 . 0 0 "[ . 1]" 1
1092 1 80 ILE MD 2 13 VAL MG2 4.730 . 6.000 2.816 2.083 3.925 . 0 0 "[ . 1]" 1
1093 1 80 ILE HG12 1 89 ILE MD 2.427 . 3.163 2.583 2.481 2.725 . 0 0 "[ . 1]" 1
1094 1 80 ILE MG 1 81 LEU H 2.176 . 2.768 2.999 2.964 3.018 0.250 8 0 "[ . 1]" 1
1095 1 80 ILE MG 1 83 SER HB3 2.991 . 4.109 4.120 4.091 4.153 0.044 2 0 "[ . 1]" 1
1096 1 80 ILE MG 1 87 VAL MG1 2.326 . 3.002 2.141 2.065 2.249 . 0 0 "[ . 1]" 1
1097 1 80 ILE MG 2 13 VAL H 4.973 . 6.003 5.595 5.485 5.743 . 0 0 "[ . 1]" 1
1098 1 80 ILE MG 2 13 VAL HA 4.941 . 6.001 5.017 4.304 5.327 . 0 0 "[ . 1]" 1
1099 1 80 ILE MG 2 13 VAL HB 4.325 . 5.995 4.094 2.471 4.459 . 0 0 "[ . 1]" 1
1100 1 80 ILE MG 2 13 VAL MG1 3.484 . 6.004 2.680 2.496 3.013 . 0 0 "[ . 1]" 1
1101 1 80 ILE MG 2 13 VAL MG2 4.473 . 6.003 2.266 1.972 3.205 . 0 0 "[ . 1]" 1
1102 1 81 LEU H 1 81 LEU HA 2.316 . 2.987 2.761 2.749 2.771 . 0 0 "[ . 1]" 1
1103 1 81 LEU H 1 81 LEU HB2 2.326 . 3.002 2.374 2.240 2.469 . 0 0 "[ . 1]" 1
1104 1 81 LEU H 1 81 LEU MD1 2.798 . 3.777 3.480 3.358 3.539 . 0 0 "[ . 1]" 1
1105 1 81 LEU H 1 81 LEU HG 2.253 . 2.887 2.410 2.202 2.739 . 0 0 "[ . 1]" 1
1106 1 81 LEU H 1 82 LYS H 2.524 . 3.320 2.908 2.893 2.930 . 0 0 "[ . 1]" 1
1107 1 81 LEU H 1 83 SER H 3.251 . 4.572 4.269 4.244 4.323 . 0 0 "[ . 1]" 1
1108 1 81 LEU HA 1 81 LEU HB2 2.850 . 3.865 3.000 2.976 3.014 . 0 0 "[ . 1]" 1
1109 1 81 LEU HA 1 81 LEU HB3 2.169 . 2.757 2.569 2.514 2.651 . 0 0 "[ . 1]" 1
1110 1 81 LEU HA 1 81 LEU MD2 1.933 . 2.400 2.055 1.971 2.141 . 0 0 "[ . 1]" 1
1111 1 81 LEU HA 1 82 LYS H 2.741 . 3.680 3.558 3.554 3.563 . 0 0 "[ . 1]" 1
1112 1 81 LEU HB2 1 81 LEU MD1 1.880 . 2.322 2.266 2.242 2.304 . 0 0 "[ . 1]" 1
1113 1 81 LEU HB2 1 82 LYS H 2.695 . 3.603 2.677 2.594 2.805 . 0 0 "[ . 1]" 1
1114 1 81 LEU HB3 1 82 LYS H 2.854 . 3.872 3.448 3.289 3.531 . 0 0 "[ . 1]" 1
1115 1 81 LEU MD1 2 11 THR MG 4.698 . 5.998 4.422 3.967 4.745 . 0 0 "[ . 1]" 1
1116 1 81 LEU MD2 2 11 THR MG 4.747 . 5.997 5.368 4.502 5.952 . 0 0 "[ . 1]" 1
1117 1 81 LEU MD2 2 13 VAL HA 4.725 . 5.995 3.641 2.962 4.218 . 0 0 "[ . 1]" 1
1118 1 81 LEU MD2 2 13 VAL HB 4.506 . 5.996 4.406 3.619 5.141 . 0 0 "[ . 1]" 1
1119 1 81 LEU MD2 2 13 VAL MG1 4.299 . 5.999 4.550 4.225 4.901 . 0 0 "[ . 1]" 1
1120 1 81 LEU MD2 2 13 VAL MG2 4.970 . 6.000 2.630 2.186 4.359 . 0 0 "[ . 1]" 1
1121 1 82 LYS H 1 82 LYS HA 2.259 . 2.897 2.802 2.783 2.823 . 0 0 "[ . 1]" 1
1122 1 82 LYS H 1 82 LYS QB 1.989 . 2.483 2.427 2.391 2.454 . 0 0 "[ . 1]" 1
1123 1 82 LYS H 1 82 LYS QE 3.400 . 4.845 3.637 3.469 3.800 . 0 0 "[ . 1]" 1
1124 1 82 LYS H 1 82 LYS HG2 2.676 . 3.571 3.133 3.111 3.150 . 0 0 "[ . 1]" 1
1125 1 82 LYS H 1 82 LYS HG3 2.253 . 2.887 2.131 2.045 2.236 . 0 0 "[ . 1]" 1
1126 1 82 LYS H 1 83 SER H 2.340 . 3.025 2.797 2.763 2.827 . 0 0 "[ . 1]" 1
1127 1 82 LYS HA 1 82 LYS QB 1.925 . 2.388 2.344 2.325 2.361 . 0 0 "[ . 1]" 1
1128 1 82 LYS HA 1 82 LYS HG2 2.235 . 2.859 2.347 2.270 2.407 . 0 0 "[ . 1]" 1
1129 1 82 LYS HA 1 83 SER H 2.828 . 3.828 3.368 3.308 3.469 . 0 0 "[ . 1]" 1
1130 1 82 LYS QB 1 82 LYS QE 2.316 . 2.987 2.346 2.115 2.650 . 0 0 "[ . 1]" 1
1131 1 82 LYS QB 1 82 LYS HG2 2.057 . 2.586 2.384 2.366 2.413 . 0 0 "[ . 1]" 1
1132 1 82 LYS QB 1 82 LYS HG3 2.111 . 2.668 2.266 2.233 2.294 . 0 0 "[ . 1]" 1
1133 1 82 LYS QB 1 83 SER H 2.514 . 3.304 3.262 3.001 3.372 0.068 9 0 "[ . 1]" 1
1134 1 82 LYS QE 1 82 LYS HG2 2.589 . 3.427 3.253 3.154 3.300 . 0 0 "[ . 1]" 1
1135 1 82 LYS QE 1 82 LYS HG3 2.601 . 3.447 2.237 2.127 2.366 . 0 0 "[ . 1]" 1
1136 1 83 SER H 1 83 SER HA 2.545 . 3.355 2.745 2.722 2.766 . 0 0 "[ . 1]" 1
1137 1 83 SER H 1 83 SER HB2 2.691 . 3.596 3.578 3.564 3.591 . 0 0 "[ . 1]" 1
1138 1 83 SER H 1 83 SER HB3 2.644 . 3.518 2.509 2.337 2.587 . 0 0 "[ . 1]" 1
1139 1 83 SER H 1 84 GLY H 3.467 . 4.970 3.081 2.966 3.202 . 0 0 "[ . 1]" 1
1140 1 83 SER HB2 1 87 VAL H 3.529 . 5.086 4.319 4.134 4.709 . 0 0 "[ . 1]" 1
1141 1 83 SER HB3 1 87 VAL HB 2.798 . 3.776 2.273 2.168 2.710 . 0 0 "[ . 1]" 1
1142 1 84 GLY H 1 84 GLY HA2 2.927 . 3.998 2.372 2.318 2.410 . 0 0 "[ . 1]" 1
1143 1 84 GLY H 1 84 GLY HA3 2.986 . 4.101 2.927 2.884 2.946 . 0 0 "[ . 1]" 1
1144 1 84 GLY HA3 1 86 LYS H 3.347 . 4.747 4.159 3.999 4.351 . 0 0 "[ . 1]" 1
1145 1 85 ASN HA 1 85 ASN QB 2.374 . 3.078 2.229 2.179 2.286 . 0 0 "[ . 1]" 1
1146 1 85 ASN QB 1 85 ASN HD21 3.560 . 5.144 2.360 2.235 2.651 . 0 0 "[ . 1]" 1
1147 1 85 ASN QB 1 85 ASN HD22 3.592 . 5.205 3.340 3.298 3.439 . 0 0 "[ . 1]" 1
1148 1 85 ASN QB 1 86 LYS H 2.685 . 3.586 2.822 2.502 3.049 . 0 0 "[ . 1]" 1
1149 1 85 ASN HD22 1 86 LYS H 3.567 . 5.158 5.196 5.052 5.266 0.108 5 0 "[ . 1]" 1
1150 1 86 LYS H 1 86 LYS HA 2.507 . 3.293 2.869 2.856 2.881 . 0 0 "[ . 1]" 1
1151 1 86 LYS H 1 86 LYS HB2 3.187 . 4.457 3.891 3.866 3.916 . 0 0 "[ . 1]" 1
1152 1 86 LYS H 1 86 LYS HB3 3.209 . 4.496 3.398 3.288 3.512 . 0 0 "[ . 1]" 1
1153 1 86 LYS H 1 86 LYS QD 2.850 . 3.865 4.038 4.007 4.084 0.219 3 0 "[ . 1]" 1
1154 1 86 LYS H 1 86 LYS HG2 2.581 . 3.414 2.312 2.260 2.408 . 0 0 "[ . 1]" 1
1155 1 86 LYS H 1 86 LYS HG3 2.682 . 3.581 3.512 3.389 3.604 0.023 3 0 "[ . 1]" 1
1156 1 86 LYS H 1 87 VAL H 3.058 . 4.227 4.261 4.240 4.279 0.052 1 0 "[ . 1]" 1
1157 1 86 LYS H 1 87 VAL HB 3.378 . 4.805 4.960 4.943 4.973 0.168 5 0 "[ . 1]" 1
1158 1 86 LYS H 1 87 VAL MG1 3.442 . 4.923 5.016 4.993 5.041 0.118 4 0 "[ . 1]" 1
1159 1 86 LYS HA 1 86 LYS HB2 2.279 . 2.928 2.443 2.412 2.497 . 0 0 "[ . 1]" 1
1160 1 86 LYS HA 1 86 LYS HB3 2.263 . 2.903 2.394 2.342 2.453 . 0 0 "[ . 1]" 1
1161 1 86 LYS HA 1 86 LYS HG3 2.717 . 3.640 3.839 3.796 3.894 0.254 2 0 "[ . 1]" 1
1162 1 86 LYS HA 1 87 VAL H 2.078 . 2.618 2.236 2.172 2.318 . 0 0 "[ . 1]" 1
1163 1 86 LYS HA 1 87 VAL MG1 2.776 . 3.739 3.276 3.253 3.308 . 0 0 "[ . 1]" 1
1164 1 86 LYS HB2 1 86 LYS QE 2.844 . 3.855 3.798 3.638 3.875 0.020 5 0 "[ . 1]" 1
1165 1 86 LYS HB2 1 86 LYS HG2 2.450 . 3.201 2.974 2.956 2.983 . 0 0 "[ . 1]" 1
1166 1 86 LYS HB2 1 86 LYS HG3 2.488 . 3.262 2.277 2.250 2.294 . 0 0 "[ . 1]" 1
1167 1 86 LYS HB2 1 87 VAL H 2.767 . 3.724 2.477 2.376 2.613 . 0 0 "[ . 1]" 1
1168 1 86 LYS HB3 1 86 LYS QE 2.961 . 4.057 3.948 3.928 3.974 . 0 0 "[ . 1]" 1
1169 1 86 LYS HB3 1 86 LYS HG2 2.053 . 2.580 2.589 2.569 2.622 0.042 2 0 "[ . 1]" 1
1170 1 86 LYS HB3 1 86 LYS HG3 2.247 . 2.878 2.948 2.934 2.958 0.080 1 0 "[ . 1]" 1
1171 1 86 LYS HB3 1 87 VAL H 2.543 . 3.351 3.692 3.633 3.734 0.383 10 0 "[ . 1]" 1
1172 1 86 LYS QD 1 86 LYS QE 1.946 . 2.419 2.088 2.086 2.090 . 0 0 "[ . 1]" 1
1173 1 86 LYS QD 1 86 LYS HG3 2.099 . 2.650 2.424 2.395 2.463 . 0 0 "[ . 1]" 1
1174 1 86 LYS QE 1 86 LYS HG2 2.187 . 2.785 2.578 2.492 2.686 . 0 0 "[ . 1]" 1
1175 1 87 VAL H 1 87 VAL HA 2.696 . 3.604 2.940 2.930 2.943 . 0 0 "[ . 1]" 1
1176 1 87 VAL H 1 87 VAL HB 2.783 . 3.751 3.275 3.243 3.338 . 0 0 "[ . 1]" 1
1177 1 87 VAL H 1 87 VAL MG1 2.175 . 2.766 2.111 2.046 2.217 . 0 0 "[ . 1]" 1
1178 1 87 VAL H 1 87 VAL MG2 2.835 . 3.839 3.879 3.869 3.905 0.066 1 0 "[ . 1]" 1
1179 1 87 VAL H 1 88 ALA H 3.147 . 4.385 4.299 4.253 4.355 . 0 0 "[ . 1]" 1
1180 1 87 VAL HA 1 87 VAL MG1 2.909 . 3.967 3.194 3.190 3.197 . 0 0 "[ . 1]" 1
1181 1 87 VAL HA 1 87 VAL MG2 2.322 . 2.996 2.451 2.419 2.473 . 0 0 "[ . 1]" 1
1182 1 87 VAL HA 1 88 ALA H 2.203 . 2.810 2.145 2.126 2.158 . 0 0 "[ . 1]" 1
1183 1 87 VAL HA 1 88 ALA MB 2.904 . 3.958 3.984 3.968 3.993 0.035 7 0 "[ . 1]" 1
1184 1 87 VAL HB 1 87 VAL MG1 2.079 . 2.619 2.124 2.123 2.126 . 0 0 "[ . 1]" 1
1185 1 87 VAL HB 1 87 VAL MG2 2.083 . 2.625 2.131 2.129 2.134 . 0 0 "[ . 1]" 1
1186 1 87 VAL MG1 1 87 VAL MG2 1.798 . 2.202 2.089 2.081 2.097 . 0 0 "[ . 1]" 1
1187 1 87 VAL MG1 1 88 ALA H 2.912 . 3.972 4.031 3.995 4.056 0.084 9 0 "[ . 1]" 1
1188 1 87 VAL MG1 1 89 ILE H 3.575 . 5.173 4.218 4.041 4.422 . 0 0 "[ . 1]" 1
1189 1 87 VAL MG1 1 89 ILE MD 2.080 . 2.621 2.653 2.642 2.662 0.041 2 0 "[ . 1]" 1
1190 1 87 VAL MG1 1 89 ILE HG12 2.349 . 3.039 3.069 3.040 3.094 0.055 7 0 "[ . 1]" 1
1191 1 87 VAL MG1 1 89 ILE HG13 2.614 . 3.468 2.664 2.452 2.786 . 0 0 "[ . 1]" 1
1192 1 87 VAL MG2 1 88 ALA H 2.237 . 2.862 2.602 2.500 2.684 . 0 0 "[ . 1]" 1
1193 1 88 ALA H 1 88 ALA HA 2.887 . 3.929 2.919 2.912 2.923 . 0 0 "[ . 1]" 1
1194 1 88 ALA H 1 88 ALA MB 2.147 . 2.723 2.319 2.305 2.333 . 0 0 "[ . 1]" 1
1195 1 88 ALA H 1 89 ILE H 3.418 . 4.878 4.262 4.185 4.354 . 0 0 "[ . 1]" 1
1196 1 88 ALA HA 1 88 ALA MB 2.148 . 2.725 2.123 2.117 2.127 . 0 0 "[ . 1]" 1
1197 1 88 ALA HA 1 89 ILE H 2.190 . 2.789 2.104 2.089 2.131 . 0 0 "[ . 1]" 1
1198 1 88 ALA MB 1 89 ILE H 2.369 . 3.070 3.304 3.225 3.360 0.290 8 0 "[ . 1]" 1
1199 1 89 ILE H 1 89 ILE HB 2.396 . 3.114 2.662 2.601 2.713 . 0 0 "[ . 1]" 1
1200 1 89 ILE H 1 89 ILE HG12 2.930 . 4.003 3.055 2.947 3.198 . 0 0 "[ . 1]" 1
1201 1 89 ILE H 1 89 ILE HG13 3.004 . 4.132 2.778 2.670 2.904 . 0 0 "[ . 1]" 1
1202 1 89 ILE H 1 90 SER H 3.430 . 4.900 4.245 4.181 4.289 . 0 0 "[ . 1]" 1
1203 1 89 ILE HB 1 89 ILE MD 2.229 . 2.850 2.792 2.710 2.857 0.007 9 0 "[ . 1]" 1
1204 1 89 ILE HB 1 89 ILE HG12 2.328 . 3.005 2.956 2.932 2.983 . 0 0 "[ . 1]" 1
1205 1 89 ILE HB 1 89 ILE HG13 2.368 . 3.069 2.259 2.243 2.286 . 0 0 "[ . 1]" 1
1206 1 89 ILE HB 1 89 ILE MG 1.880 . 2.322 2.108 2.102 2.114 . 0 0 "[ . 1]" 1
1207 1 89 ILE MD 1 89 ILE HG12 2.068 . 2.603 2.120 2.118 2.123 . 0 0 "[ . 1]" 1
1208 1 89 ILE MD 1 89 ILE HG13 2.103 . 2.656 2.113 2.112 2.115 . 0 0 "[ . 1]" 1
1209 1 89 ILE MD 2 13 VAL MG1 4.873 . 6.003 4.021 3.865 4.400 . 0 0 "[ . 1]" 1
1210 1 89 ILE MD 2 13 VAL MG2 4.977 . 5.997 4.618 4.153 4.951 . 0 0 "[ . 1]" 1
1211 1 89 ILE HG13 1 89 ILE MG 2.204 . 2.811 3.073 3.037 3.108 0.297 7 0 "[ . 1]" 1
1212 1 89 ILE MG 1 90 SER H 2.275 . 2.922 3.008 2.990 3.025 0.103 9 0 "[ . 1]" 1
1213 1 90 SER H 1 90 SER HA 2.841 . 3.850 2.875 2.870 2.880 . 0 0 "[ . 1]" 1
1214 1 90 SER H 1 90 SER HB2 2.785 . 3.755 2.616 2.454 2.723 . 0 0 "[ . 1]" 1
1215 1 90 SER H 1 90 SER HB3 2.652 . 3.531 3.587 3.565 3.601 0.070 1 0 "[ . 1]" 1
1216 1 90 SER HA 1 91 THR H 2.100 . 2.651 2.147 2.128 2.155 . 0 0 "[ . 1]" 1
1217 1 91 THR H 1 91 THR HA 2.765 . 3.721 2.925 2.916 2.933 . 0 0 "[ . 1]" 1
1218 1 91 THR H 1 91 THR HB 3.094 . 4.291 3.585 3.525 3.641 . 0 0 "[ . 1]" 1
1219 1 91 THR H 1 91 THR MG 2.586 . 3.422 2.995 2.869 3.208 . 0 0 "[ . 1]" 1
1220 1 91 THR H 1 92 THR MG 3.461 . 4.958 5.004 4.983 5.035 0.077 6 0 "[ . 1]" 1
1221 1 91 THR HA 1 91 THR HB 2.508 . 3.294 2.609 2.565 2.676 . 0 0 "[ . 1]" 1
1222 1 91 THR HA 1 91 THR MG 2.232 . 2.855 2.267 2.209 2.320 . 0 0 "[ . 1]" 1
1223 1 91 THR HA 1 92 THR H 2.210 . 2.821 2.345 2.185 2.440 . 0 0 "[ . 1]" 1
1224 1 91 THR HB 1 91 THR MG 2.158 . 2.740 2.132 2.128 2.135 . 0 0 "[ . 1]" 1
1225 1 91 THR HB 1 92 THR H 2.357 . 3.052 2.450 2.196 2.878 . 0 0 "[ . 1]" 1
1226 1 92 THR H 1 92 THR HB 2.719 . 3.643 3.542 3.426 3.582 . 0 0 "[ . 1]" 1
1227 1 92 THR H 1 92 THR MG 2.430 . 3.168 2.479 2.221 2.620 . 0 0 "[ . 1]" 1
1228 1 92 THR H 1 93 PRO HD3 3.317 . 4.693 4.579 4.488 4.733 0.040 1 0 "[ . 1]" 1
1229 1 92 THR HB 1 92 THR MG 1.935 . 2.403 2.129 2.126 2.132 . 0 0 "[ . 1]" 1
1230 1 93 PRO HA 1 93 PRO HB3 2.745 . 3.687 2.311 2.300 2.322 . 0 0 "[ . 1]" 1
1231 1 93 PRO HA 1 94 LEU H 2.005 . 2.508 2.190 2.164 2.206 . 0 0 "[ . 1]" 1
1232 1 93 PRO HB2 1 93 PRO HD2 2.843 . 3.854 2.998 2.973 3.033 . 0 0 "[ . 1]" 1
1233 1 93 PRO HB2 1 94 LEU H 2.591 . 3.430 3.573 3.537 3.605 0.175 5 0 "[ . 1]" 1
1234 1 93 PRO HB3 1 95 GLU QG 2.066 . 2.600 2.734 2.698 2.772 0.172 8 0 "[ . 1]" 1
1235 1 93 PRO HD2 1 93 PRO QG 2.229 . 2.850 2.229 2.223 2.233 . 0 0 "[ . 1]" 1
1236 1 94 LEU H 1 94 LEU HA 2.540 . 3.347 2.939 2.934 2.944 . 0 0 "[ . 1]" 1
1237 1 94 LEU H 1 94 LEU HB2 2.542 . 3.350 3.154 3.122 3.194 . 0 0 "[ . 1]" 1
1238 1 94 LEU H 1 94 LEU HB3 2.201 . 2.807 2.434 2.392 2.472 . 0 0 "[ . 1]" 1
1239 1 94 LEU HA 1 94 LEU HB2 2.113 . 2.671 2.373 2.345 2.382 . 0 0 "[ . 1]" 1
1240 1 94 LEU HA 1 94 LEU QD 2.066 . 2.600 2.268 2.190 2.382 . 0 0 "[ . 1]" 1
1241 1 94 LEU HA 1 94 LEU HG 2.876 . 3.910 3.295 3.168 3.356 . 0 0 "[ . 1]" 1
1242 1 94 LEU HA 1 95 GLU H 2.290 . 2.945 2.328 2.271 2.446 . 0 0 "[ . 1]" 1
1243 1 94 LEU HB2 1 94 LEU QD 2.022 . 2.533 2.137 2.119 2.152 . 0 0 "[ . 1]" 1
1244 1 94 LEU QD 1 94 LEU HG 2.163 . 2.748 1.892 1.889 1.895 . 0 0 "[ . 1]" 1
1245 1 94 LEU QD 1 96 ASN H 3.259 . 4.587 4.422 4.124 4.614 0.027 3 0 "[ . 1]" 1
1246 1 94 LEU QD 1 96 ASN HB2 2.531 . 3.332 3.200 2.993 3.352 0.020 8 0 "[ . 1]" 1
1247 1 94 LEU MD2 2 2 PHE QE 4.946 . 5.996 3.370 2.191 5.419 . 0 0 "[ . 1]" 1
1248 1 94 LEU HG 1 96 ASN H 3.182 . 4.447 4.470 4.341 4.532 0.085 4 0 "[ . 1]" 1
1249 1 95 GLU H 1 95 GLU HA 2.919 . 3.984 2.921 2.870 2.943 . 0 0 "[ . 1]" 1
1250 1 95 GLU H 1 95 GLU HB2 3.074 . 4.255 2.706 2.523 3.124 . 0 0 "[ . 1]" 1
1251 1 95 GLU H 1 95 GLU QG 2.892 . 3.938 2.281 1.931 2.492 . 0 0 "[ . 1]" 1
1252 1 95 GLU HA 1 95 GLU HB2 2.996 . 4.118 2.988 2.916 3.006 . 0 0 "[ . 1]" 1
1253 1 95 GLU HA 1 95 GLU QG 2.299 . 2.959 2.923 2.823 2.992 0.033 1 0 "[ . 1]" 1
1254 1 95 GLU HA 1 96 ASN H 2.009 . 2.513 2.097 2.075 2.112 . 0 0 "[ . 1]" 1
1255 1 95 GLU HB2 1 96 ASN H 2.841 . 3.850 4.057 3.960 4.124 0.274 4 0 "[ . 1]" 1
1256 1 96 ASN H 1 96 ASN HA 2.649 . 3.526 2.896 2.834 2.939 . 0 0 "[ . 1]" 1
1257 1 96 ASN H 1 96 ASN HB2 3.037 . 4.190 3.243 3.053 3.485 . 0 0 "[ . 1]" 1
1258 1 96 ASN H 1 96 ASN HB3 2.629 . 3.493 2.971 2.749 3.320 . 0 0 "[ . 1]" 1
1259 1 96 ASN HA 1 96 ASN HB2 2.223 . 2.841 2.532 2.434 2.657 . 0 0 "[ . 1]" 1
1260 1 96 ASN HB2 1 96 ASN HD21 3.219 . 4.514 3.424 3.099 3.544 . 0 0 "[ . 1]" 1
1261 1 96 ASN HB3 1 96 ASN HD21 3.141 . 4.374 2.282 2.130 2.835 . 0 0 "[ . 1]" 1
1262 1 96 ASN HB3 1 96 ASN HD22 3.635 . 5.287 3.506 3.441 3.735 . 0 0 "[ . 1]" 1
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