NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
624990 |
5z9c   |
36163 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5z9c
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 2435
_Distance_constraint_stats_list.Viol_count 5211
_Distance_constraint_stats_list.Viol_total 13040.193
_Distance_constraint_stats_list.Viol_max 0.992
_Distance_constraint_stats_list.Viol_rms 0.0558
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0134
_Distance_constraint_stats_list.Viol_average_violations_only 0.1251
_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 1 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 2 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 3 LYS 7.742 0.573 19 4 "[ . 1 ** +-]"
1 4 PRO 4.025 0.414 18 0 "[ . 1 . 2]"
1 5 LYS 3.349 0.396 15 0 "[ . 1 . 2]"
1 6 ARG 9.926 0.429 2 0 "[ . 1 . 2]"
1 7 GLN 7.854 0.477 18 0 "[ . 1 . 2]"
1 8 THR 12.444 0.335 15 0 "[ . 1 . 2]"
1 9 ASN 4.955 0.992 5 1 "[ + 1 . 2]"
1 10 GLN 16.869 0.336 14 0 "[ . 1 . 2]"
1 11 LEU 7.437 0.486 8 0 "[ . 1 . 2]"
1 12 GLN 3.835 0.124 5 0 "[ . 1 . 2]"
1 13 TYR 17.319 0.258 3 0 "[ . 1 . 2]"
1 14 LEU 17.090 0.400 14 0 "[ . 1 . 2]"
1 15 LEU 1.446 0.098 19 0 "[ . 1 . 2]"
1 16 ARG 4.620 0.141 11 0 "[ . 1 . 2]"
1 17 VAL 10.779 0.255 9 0 "[ . 1 . 2]"
1 18 VAL 15.900 0.218 1 0 "[ . 1 . 2]"
1 19 LEU 22.078 0.447 17 0 "[ . 1 . 2]"
1 20 LYS 3.164 0.503 14 1 "[ . 1 +. 2]"
1 21 THR 15.130 0.874 3 4 "[ + . ** -. 2]"
1 22 LEU 23.897 0.432 3 0 "[ . 1 . 2]"
1 23 TRP 2.140 0.765 3 1 "[ + . 1 . 2]"
1 24 LYS 10.728 0.874 3 3 "[ + . *- . 2]"
1 25 HIS 12.614 0.460 14 0 "[ . 1 . 2]"
1 26 GLN 13.224 0.791 15 3 "[ . 1 *+* 2]"
1 27 PHE 14.810 0.791 15 3 "[ . 1 *+* 2]"
1 28 ALA 0.092 0.038 17 0 "[ . 1 . 2]"
1 29 TRP 15.774 0.302 7 0 "[ . 1 . 2]"
1 30 PRO 12.203 0.260 18 0 "[ . 1 . 2]"
1 31 PHE 10.935 0.797 17 1 "[ . 1 . + 2]"
1 32 GLN 6.513 0.797 17 1 "[ . 1 . + 2]"
1 33 GLN 11.461 0.906 15 4 "[ - 1* *+ 2]"
1 34 PRO 9.128 0.541 11 2 "[ - 1+ . 2]"
1 35 VAL 3.778 0.198 3 0 "[ . 1 . 2]"
1 36 ASP 1.314 0.144 9 0 "[ . 1 . 2]"
1 37 ALA 4.990 0.325 12 0 "[ . 1 . 2]"
1 38 VAL 3.794 0.228 15 0 "[ . 1 . 2]"
1 39 LYS 10.706 0.868 2 2 "[ + . 1 .- 2]"
1 40 LEU 3.224 0.161 8 0 "[ . 1 . 2]"
1 41 ASN 10.195 0.603 9 1 "[ . +1 . 2]"
1 42 LEU 8.178 0.646 10 1 "[ . + . 2]"
1 43 PRO 4.594 0.646 10 1 "[ . + . 2]"
1 44 ASP 8.253 0.560 2 1 "[ + . 1 . 2]"
1 45 TYR 9.880 0.217 3 0 "[ . 1 . 2]"
1 46 TYR 12.146 0.316 4 0 "[ . 1 . 2]"
1 47 LYS 25.229 0.904 1 6 "[+* . - ** *2]"
1 48 ILE 8.571 0.904 1 4 "[+ . - *. *2]"
1 49 ILE 15.298 0.505 3 1 "[ + . 1 . 2]"
1 50 LYS 6.942 0.744 4 8 "[ * +- ***1 *. * 2]"
1 51 THR 2.296 0.123 1 0 "[ . 1 . 2]"
1 52 PRO 17.465 0.316 4 0 "[ . 1 . 2]"
1 53 MET 0.435 0.122 18 0 "[ . 1 . 2]"
1 54 ASP 0.940 0.106 15 0 "[ . 1 . 2]"
1 55 MET 12.735 0.368 11 0 "[ . 1 . 2]"
1 56 GLY 1.217 0.477 16 0 "[ . 1 . 2]"
1 57 THR 3.167 0.453 9 0 "[ . 1 . 2]"
1 58 ILE 0.027 0.016 16 0 "[ . 1 . 2]"
1 59 LYS 6.192 0.447 17 0 "[ . 1 . 2]"
1 60 LYS 8.531 0.453 9 0 "[ . 1 . 2]"
1 61 ARG 5.504 0.668 1 3 "[+- . 1* . 2]"
1 62 LEU 7.470 0.633 8 3 "[ *. +-1 . 2]"
1 63 GLU 3.173 0.403 20 0 "[ . 1 . 2]"
1 64 ASN 4.843 0.660 9 3 "[ . * +1 - 2]"
1 65 ASN 3.957 0.223 8 0 "[ . 1 . 2]"
1 66 TYR 1.400 0.086 9 0 "[ . 1 . 2]"
1 67 TYR 11.954 0.668 1 3 "[+- . 1* . 2]"
1 68 TRP 2.414 0.234 9 0 "[ . 1 . 2]"
1 69 ASN 4.949 0.477 18 0 "[ . 1 . 2]"
1 70 ALA 7.824 0.508 4 1 "[ +. 1 . 2]"
1 71 GLN 22.257 0.466 10 0 "[ . 1 . 2]"
1 72 GLU 3.855 0.429 20 0 "[ . 1 . 2]"
1 73 CYS 15.391 0.633 8 3 "[ *. +-1 . 2]"
1 74 ILE 22.237 0.420 5 0 "[ . 1 . 2]"
1 75 GLN 7.907 0.324 20 0 "[ . 1 . 2]"
1 76 ASP 5.923 0.169 17 0 "[ . 1 . 2]"
1 77 PHE 28.777 0.441 3 0 "[ . 1 . 2]"
1 78 ASN 2.497 0.172 4 0 "[ . 1 . 2]"
1 79 THR 0.663 0.172 7 0 "[ . 1 . 2]"
1 80 MET 10.587 0.840 11 4 "[ . * 1+ . - *]"
1 81 PHE 9.494 0.294 2 0 "[ . 1 . 2]"
1 82 THR 6.664 0.208 19 0 "[ . 1 . 2]"
1 83 ASN 2.393 0.189 18 0 "[ . 1 . 2]"
1 84 CYS 6.636 0.932 19 1 "[ . 1 . +2]"
1 85 TYR 15.113 0.932 19 1 "[ . 1 . +2]"
1 86 ILE 9.240 0.228 9 0 "[ . 1 . 2]"
1 87 TYR 16.696 0.505 3 1 "[ + . 1 . 2]"
1 88 ASN 2.648 0.132 19 0 "[ . 1 . 2]"
1 89 LYS 1.410 0.232 12 0 "[ . 1 . 2]"
1 90 PRO 4.560 0.232 12 0 "[ . 1 . 2]"
1 91 GLY 1.720 0.151 11 0 "[ . 1 . 2]"
1 92 ASP 3.607 0.146 18 0 "[ . 1 . 2]"
1 93 ASP 15.800 0.964 8 7 "[* ** *+ 1 *. - 2]"
1 94 ILE 19.547 0.964 8 7 "[* ** *+ 1 *. - 2]"
1 95 VAL 7.019 0.171 19 0 "[ . 1 . 2]"
1 96 LEU 13.917 0.426 5 0 "[ . 1 . 2]"
1 97 MET 5.795 0.334 5 0 "[ . 1 . 2]"
1 98 ALA 4.204 0.250 14 0 "[ . 1 . 2]"
1 99 GLU 7.749 0.214 18 0 "[ . 1 . 2]"
1 100 ALA 0.061 0.050 16 0 "[ . 1 . 2]"
1 101 LEU 2.883 0.100 20 0 "[ . 1 . 2]"
1 102 GLU 17.049 0.336 7 0 "[ . 1 . 2]"
1 103 LYS 1.085 0.300 9 0 "[ . 1 . 2]"
1 104 LEU 2.587 0.092 7 0 "[ . 1 . 2]"
1 105 PHE 35.596 0.432 3 0 "[ . 1 . 2]"
1 106 LEU 6.166 0.186 19 0 "[ . 1 . 2]"
1 107 GLN 8.942 0.252 16 0 "[ . 1 . 2]"
1 108 LYS 18.308 0.246 8 0 "[ . 1 . 2]"
1 109 ILE 10.336 0.235 20 0 "[ . 1 . 2]"
1 110 ASN 4.210 0.327 6 0 "[ . 1 . 2]"
1 111 GLU 9.886 0.184 6 0 "[ . 1 . 2]"
1 112 LEU 22.919 0.476 2 0 "[ . 1 . 2]"
1 113 PRO 24.900 0.476 2 0 "[ . 1 . 2]"
1 114 THR 0.084 0.042 18 0 "[ . 1 . 2]"
1 115 GLU 8.341 0.992 5 1 "[ + 1 . 2]"
1 116 GLU 8.344 0.776 16 2 "[ . - 1 .+ 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 87 TYR HB2 1 87 TYR HD1 2.323 . 2.998 2.441 2.414 2.474 . 0 0 "[ . 1 . 2]" 1
2 1 66 TYR HB3 1 66 TYR HD1 2.136 . 2.706 2.338 2.309 2.365 . 0 0 "[ . 1 . 2]" 1
3 1 61 ARG QD 1 66 TYR HD1 2.443 . 3.189 2.412 1.872 2.637 . 0 0 "[ . 1 . 2]" 1
4 1 61 ARG HB3 1 66 TYR HD1 2.599 . 3.443 2.038 1.847 2.155 . 0 0 "[ . 1 . 2]" 1
5 1 77 PHE HB2 1 77 PHE HD1 2.353 . 3.045 2.323 2.301 2.334 . 0 0 "[ . 1 . 2]" 1
6 1 77 PHE HD2 1 80 MET ME 2.282 . 2.933 1.567 1.353 2.127 0.278 16 0 "[ . 1 . 2]" 1
7 1 27 PHE QD 1 97 MET HB3 3.178 . 4.441 2.199 2.019 2.482 . 0 0 "[ . 1 . 2]" 1
8 1 27 PHE HB2 1 27 PHE QD 2.463 . 3.221 2.241 2.216 2.251 . 0 0 "[ . 1 . 2]" 1
9 1 23 TRP QB 1 23 TRP HD1 2.352 . 3.043 2.621 2.590 2.650 . 0 0 "[ . 1 . 2]" 1
10 1 81 PHE HZ 1 102 GLU HA 2.989 . 4.106 3.943 3.762 4.125 0.019 20 0 "[ . 1 . 2]" 1
11 1 23 TRP HZ3 1 55 MET HB3 2.243 . 2.872 2.578 2.293 2.920 0.048 3 0 "[ . 1 . 2]" 1
12 1 19 LEU MD1 1 23 TRP HE3 2.373 . 3.077 1.981 1.862 2.090 . 0 0 "[ . 1 . 2]" 1
13 1 85 TYR HE1 1 98 ALA MB 2.007 . 2.511 2.481 2.447 2.515 0.004 13 0 "[ . 1 . 2]" 1
14 1 46 TYR HE1 1 52 PRO HB2 2.395 . 3.112 2.935 2.846 3.015 . 0 0 "[ . 1 . 2]" 1
15 1 46 TYR HE1 1 52 PRO HG3 2.331 . 3.010 3.001 2.894 3.059 0.049 13 0 "[ . 1 . 2]" 1
16 1 61 ARG QD 1 66 TYR HE1 3.231 . 4.536 3.098 2.390 3.393 . 0 0 "[ . 1 . 2]" 1
17 1 81 PHE HE2 1 105 PHE HD2 2.725 . 3.653 2.414 2.304 2.515 . 0 0 "[ . 1 . 2]" 1
18 1 74 ILE HA 1 77 PHE HD1 2.388 . 3.101 2.311 2.246 2.355 . 0 0 "[ . 1 . 2]" 1
19 1 23 TRP HH2 1 56 GLY HA2 2.931 . 4.005 2.343 2.157 2.953 . 0 0 "[ . 1 . 2]" 1
20 1 23 TRP HH2 1 56 GLY HA3 2.503 . 3.286 3.137 2.914 3.763 0.477 16 0 "[ . 1 . 2]" 1
21 1 23 TRP HZ3 1 56 GLY HA2 3.037 . 4.190 2.088 1.892 2.554 . 0 0 "[ . 1 . 2]" 1
22 1 13 TYR HE1 1 108 LYS HA 2.627 . 3.489 3.155 3.099 3.210 . 0 0 "[ . 1 . 2]" 1
23 1 13 TYR HE1 1 109 ILE HA 2.364 . 3.063 3.104 3.085 3.125 0.062 17 0 "[ . 1 . 2]" 1
24 1 66 TYR HD1 1 67 TYR HA 2.904 . 3.958 3.832 3.545 3.981 0.023 14 0 "[ . 1 . 2]" 1
25 1 61 ARG HA 1 66 TYR HD1 3.081 . 4.267 4.058 3.460 4.327 0.060 14 0 "[ . 1 . 2]" 1
26 1 81 PHE HB3 1 81 PHE HD1 2.836 . 3.841 2.995 2.949 3.040 . 0 0 "[ . 1 . 2]" 1
27 1 58 ILE MG 1 77 PHE HD1 3.411 . 4.866 3.516 3.454 3.566 . 0 0 "[ . 1 . 2]" 1
28 1 30 PRO HD3 1 31 PHE HE1 3.284 . 4.632 3.979 3.918 4.207 . 0 0 "[ . 1 . 2]" 1
29 1 61 ARG HG3 1 66 TYR HD1 3.283 . 4.630 4.275 3.413 4.402 . 0 0 "[ . 1 . 2]" 1
30 1 18 VAL MG1 1 105 PHE HE1 3.073 . 4.253 2.696 2.674 2.713 . 0 0 "[ . 1 . 2]" 1
31 1 61 ARG HB2 1 66 TYR HE1 3.689 . 5.390 5.396 5.241 5.463 0.073 20 0 "[ . 1 . 2]" 1
32 1 23 TRP HE3 1 55 MET HA 3.812 . 5.629 4.269 4.183 4.410 . 0 0 "[ . 1 . 2]" 1
33 1 30 PRO HG2 1 31 PHE HE1 2.879 . 3.915 2.712 2.606 2.830 . 0 0 "[ . 1 . 2]" 1
34 1 30 PRO HG3 1 31 PHE HE1 3.255 . 4.579 3.653 3.585 3.724 . 0 0 "[ . 1 . 2]" 1
35 1 74 ILE MG 1 77 PHE HD1 3.760 . 5.527 4.389 4.336 4.422 . 0 0 "[ . 1 . 2]" 1
36 1 81 PHE HD2 1 102 GLU HB2 3.126 . 4.348 4.406 4.359 4.451 0.103 3 0 "[ . 1 . 2]" 1
37 1 77 PHE HE1 1 105 PHE HE1 3.476 . 4.987 3.844 3.785 3.915 . 0 0 "[ . 1 . 2]" 1
38 1 77 PHE HE2 1 80 MET ME 3.486 . 5.005 2.568 2.393 2.690 . 0 0 "[ . 1 . 2]" 1
39 1 81 PHE HZ 1 105 PHE HD2 3.885 . 5.772 4.559 4.462 4.682 . 0 0 "[ . 1 . 2]" 1
40 1 77 PHE HD1 1 105 PHE HE1 3.325 . 4.707 2.489 2.428 2.530 . 0 0 "[ . 1 . 2]" 1
41 1 74 ILE HA 1 105 PHE HZ 2.989 . 4.106 2.046 1.980 2.106 . 0 0 "[ . 1 . 2]" 1
42 1 31 PHE HZ 1 94 ILE MD 3.384 . 4.815 2.262 2.120 2.357 . 0 0 "[ . 1 . 2]" 1
43 1 13 TYR HD1 1 113 PRO HD3 3.273 . 4.612 4.238 4.148 4.332 . 0 0 "[ . 1 . 2]" 1
44 1 13 TYR HD1 1 14 LEU HG 3.011 . 4.144 3.303 3.132 3.406 . 0 0 "[ . 1 . 2]" 1
45 1 13 TYR HD1 1 14 LEU HB2 3.575 . 5.173 4.458 4.397 4.491 . 0 0 "[ . 1 . 2]" 1
46 1 66 TYR HD1 1 67 TYR HE1 3.499 . 5.029 3.929 3.264 4.156 . 0 0 "[ . 1 . 2]" 1
47 1 85 TYR HD1 1 95 VAL HA 3.460 . 4.957 3.066 2.956 3.424 . 0 0 "[ . 1 . 2]" 1
48 1 84 CYS HB2 1 85 TYR HD1 3.023 . 4.165 4.223 4.075 5.097 0.932 19 1 "[ . 1 . +2]" 1
49 1 82 THR HB 1 85 TYR HD2 3.477 . 4.988 4.388 4.258 4.491 . 0 0 "[ . 1 . 2]" 1
50 1 82 THR HA 1 85 TYR HE2 2.994 . 4.115 3.546 3.384 3.695 . 0 0 "[ . 1 . 2]" 1
51 1 81 PHE HB2 1 85 TYR HE2 2.804 . 3.787 3.023 2.934 3.147 . 0 0 "[ . 1 . 2]" 1
52 1 45 TYR HD2 1 87 TYR HD2 3.455 . 4.947 3.193 3.124 3.323 . 0 0 "[ . 1 . 2]" 1
53 1 23 TRP QB 1 23 TRP HE3 . . 2.937 2.512 2.365 2.570 . 0 0 "[ . 1 . 2]" 1
54 1 23 TRP HZ3 1 59 LYS HB3 3.558 . 5.140 2.970 2.692 3.172 . 0 0 "[ . 1 . 2]" 1
55 1 81 PHE HD2 1 102 GLU HB3 4.131 . 6.264 4.535 4.358 4.633 . 0 0 "[ . 1 . 2]" 1
56 1 74 ILE HA 1 77 PHE HE1 3.276 . 4.617 4.605 4.525 4.655 0.038 8 0 "[ . 1 . 2]" 1
57 1 55 MET HB3 1 77 PHE HE2 3.148 . 4.387 4.156 3.930 4.272 . 0 0 "[ . 1 . 2]" 1
58 1 13 TYR HD1 1 14 LEU HA 3.383 . 4.813 3.183 3.133 3.205 . 0 0 "[ . 1 . 2]" 1
59 1 13 TYR HD2 1 113 PRO HG2 3.057 . 4.225 3.154 2.932 3.351 . 0 0 "[ . 1 . 2]" 1
60 1 13 TYR HD1 1 17 VAL MG2 3.118 . 4.334 4.246 4.225 4.260 . 0 0 "[ . 1 . 2]" 1
61 1 13 TYR HD1 1 112 LEU MD2 2.337 . 3.020 3.111 3.094 3.129 0.109 14 0 "[ . 1 . 2]" 1
62 1 13 TYR HD1 1 112 LEU MD1 2.388 . 3.101 2.129 2.024 2.265 . 0 0 "[ . 1 . 2]" 1
63 1 13 TYR HD1 1 14 LEU MD2 3.074 . 4.255 3.458 3.444 3.504 . 0 0 "[ . 1 . 2]" 1
64 1 13 TYR HE1 1 113 PRO HD2 3.048 . 4.209 4.446 4.423 4.467 0.258 3 0 "[ . 1 . 2]" 1
65 1 49 ILE MD 1 87 TYR HD1 2.967 . 4.068 2.606 2.096 2.699 . 0 0 "[ . 1 . 2]" 1
66 1 45 TYR HD2 1 87 TYR HE2 2.923 . 3.991 3.296 3.138 3.409 . 0 0 "[ . 1 . 2]" 1
67 1 85 TYR HD1 1 98 ALA MB 3.052 . 4.216 3.914 3.870 3.965 . 0 0 "[ . 1 . 2]" 1
68 1 82 THR MG 1 85 TYR HD2 3.186 . 4.455 2.831 2.605 2.968 . 0 0 "[ . 1 . 2]" 1
69 1 66 TYR HD1 1 67 TYR HD1 4.517 . 7.067 3.581 3.026 3.945 . 0 0 "[ . 1 . 2]" 1
70 1 62 LEU HA 1 67 TYR HD2 4.007 . 6.014 1.904 1.837 2.043 0.163 18 0 "[ . 1 . 2]" 1
71 1 66 TYR HE1 1 67 TYR HE1 3.368 . 4.786 4.552 3.427 4.832 0.046 18 0 "[ . 1 . 2]" 1
72 1 66 TYR HE1 1 67 TYR HD1 3.781 . 5.568 4.583 3.614 4.921 . 0 0 "[ . 1 . 2]" 1
73 1 46 TYR HB2 1 46 TYR HD2 2.704 . 3.618 2.824 2.782 2.868 . 0 0 "[ . 1 . 2]" 1
74 1 45 TYR HE1 1 46 TYR HE1 2.960 . 4.055 2.974 2.876 3.105 . 0 0 "[ . 1 . 2]" 1
75 1 45 TYR HD1 1 46 TYR HE1 3.084 . 4.273 1.872 1.824 1.945 0.071 9 0 "[ . 1 . 2]" 1
76 1 35 VAL MG2 1 46 TYR HE1 3.600 . 5.220 2.908 2.670 3.145 . 0 0 "[ . 1 . 2]" 1
77 1 45 TYR HB3 1 45 TYR HD2 2.743 . 3.683 3.713 3.706 3.718 0.035 9 0 "[ . 1 . 2]" 1
78 1 45 TYR HB2 1 45 TYR HD1 2.809 . 3.795 3.549 3.517 3.575 . 0 0 "[ . 1 . 2]" 1
79 1 45 TYR HE2 1 87 TYR HB2 3.402 . 4.849 2.971 2.751 3.202 . 0 0 "[ . 1 . 2]" 1
80 1 45 TYR HE1 1 83 ASN QB 3.866 . 5.734 4.216 4.104 4.333 . 0 0 "[ . 1 . 2]" 1
81 1 45 TYR HA 1 45 TYR HE2 3.451 . 4.939 4.552 4.481 4.608 . 0 0 "[ . 1 . 2]" 1
82 1 45 TYR HE2 1 87 TYR HD2 3.320 . 4.698 2.964 2.771 3.118 . 0 0 "[ . 1 . 2]" 1
83 1 45 TYR HE1 1 46 TYR HD1 4.225 . 6.457 4.422 4.312 4.561 . 0 0 "[ . 1 . 2]" 1
84 1 45 TYR HE2 1 87 TYR HE2 3.787 . 5.579 4.484 4.185 4.692 . 0 0 "[ . 1 . 2]" 1
85 1 35 VAL HB 1 45 TYR HE1 3.158 . 4.405 4.483 4.442 4.524 0.119 18 0 "[ . 1 . 2]" 1
86 1 35 VAL MG2 1 45 TYR HE1 3.470 . 4.975 2.428 2.340 2.519 . 0 0 "[ . 1 . 2]" 1
87 1 45 TYR HD1 1 46 TYR HD1 3.386 . 4.819 2.354 2.172 2.476 . 0 0 "[ . 1 . 2]" 1
88 1 105 PHE HD2 1 106 LEU MD2 2.680 . 3.578 3.173 3.140 3.213 . 0 0 "[ . 1 . 2]" 1
89 1 18 VAL MG1 1 105 PHE HD1 2.778 . 3.742 1.613 1.596 1.634 0.218 1 0 "[ . 1 . 2]" 1
90 1 105 PHE HD1 1 109 ILE MD 3.436 . 4.912 2.570 2.528 2.621 . 0 0 "[ . 1 . 2]" 1
91 1 105 PHE HE1 1 109 ILE QG 2.819 . 3.812 3.075 2.994 3.146 . 0 0 "[ . 1 . 2]" 1
92 1 77 PHE HD1 1 105 PHE HZ 3.009 . 4.140 3.797 3.745 3.870 . 0 0 "[ . 1 . 2]" 1
93 1 105 PHE HZ 1 109 ILE MD 3.222 . 4.520 3.537 3.497 3.574 . 0 0 "[ . 1 . 2]" 1
94 1 55 MET ME 1 77 PHE HE2 3.344 . 4.742 3.563 3.480 3.639 . 0 0 "[ . 1 . 2]" 1
95 1 58 ILE MG 1 77 PHE HE1 2.847 . 3.860 2.858 2.826 2.886 . 0 0 "[ . 1 . 2]" 1
96 1 19 LEU MD1 1 77 PHE HE2 3.306 . 4.672 4.140 4.103 4.183 . 0 0 "[ . 1 . 2]" 1
97 1 18 VAL MG1 1 77 PHE HZ 3.714 . 5.438 3.253 3.217 3.298 . 0 0 "[ . 1 . 2]" 1
98 1 22 LEU MD1 1 77 PHE HZ 3.453 . 4.943 3.209 3.152 3.261 . 0 0 "[ . 1 . 2]" 1
99 1 31 PHE HD1 1 101 LEU MD2 3.398 . 4.841 4.230 4.073 4.285 . 0 0 "[ . 1 . 2]" 1
100 1 30 PRO HG2 1 31 PHE HD1 3.935 . 5.870 2.941 2.880 3.001 . 0 0 "[ . 1 . 2]" 1
101 1 30 PRO HD3 1 31 PHE HD1 3.058 . 4.227 3.575 3.542 3.781 . 0 0 "[ . 1 . 2]" 1
102 1 31 PHE HD2 1 80 MET HG3 3.960 . 5.920 2.780 2.289 4.314 . 0 0 "[ . 1 . 2]" 1
103 1 31 PHE HD1 1 55 MET ME 3.263 . 4.594 2.990 2.883 3.027 . 0 0 "[ . 1 . 2]" 1
104 1 30 PRO HG3 1 31 PHE HD1 3.601 . 5.222 4.194 4.132 4.264 . 0 0 "[ . 1 . 2]" 1
105 1 31 PHE HB3 1 31 PHE HD2 2.759 . 3.711 2.475 2.446 2.552 . 0 0 "[ . 1 . 2]" 1
106 1 31 PHE HZ 1 98 ALA MB 3.091 . 4.286 1.761 1.646 1.880 0.250 14 0 "[ . 1 . 2]" 1
107 1 77 PHE HB2 1 105 PHE HZ 3.800 . 5.605 3.184 3.119 3.256 . 0 0 "[ . 1 . 2]" 1
108 1 27 PHE HB3 1 27 PHE QD 2.764 . 3.719 2.516 2.499 2.571 . 0 0 "[ . 1 . 2]" 1
109 1 27 PHE HA 1 27 PHE HE2 3.365 . 4.780 4.662 4.439 4.730 . 0 0 "[ . 1 . 2]" 1
110 1 68 TRP QB 1 68 TRP HD1 2.389 . 3.102 2.552 2.530 2.564 . 0 0 "[ . 1 . 2]" 1
111 1 27 PHE QD 1 29 TRP HD1 4.280 . 6.570 4.604 4.370 4.849 . 0 0 "[ . 1 . 2]" 1
112 1 29 TRP HH2 1 29 TRP HZ3 2.041 . 2.562 2.438 2.435 2.441 . 0 0 "[ . 1 . 2]" 1
113 1 23 TRP HD1 1 24 LYS HG3 3.007 . 4.137 3.501 3.232 4.902 0.765 3 1 "[ + . 1 . 2]" 1
114 1 25 HIS HE1 1 26 GLN QB 4.028 . 6.057 4.275 3.351 5.102 . 0 0 "[ . 1 . 2]" 1
115 1 25 HIS HE1 1 100 ALA MB 3.424 . 4.889 2.722 2.459 2.939 . 0 0 "[ . 1 . 2]" 1
116 1 25 HIS HE1 1 26 GLN HG3 3.344 . 4.742 4.596 4.174 5.202 0.460 14 0 "[ . 1 . 2]" 1
117 1 25 HIS HE1 1 27 PHE HB2 2.927 . 3.998 4.122 4.085 4.147 0.149 3 0 "[ . 1 . 2]" 1
118 1 25 HIS HE1 1 27 PHE HA 4.158 . 6.319 6.350 6.250 6.403 0.084 16 0 "[ . 1 . 2]" 1
119 1 25 HIS HE1 1 27 PHE QD 2.230 . 2.852 2.172 2.130 2.222 . 0 0 "[ . 1 . 2]" 1
120 1 25 HIS HE1 1 27 PHE HE1 2.637 . 3.506 2.681 2.451 2.785 . 0 0 "[ . 1 . 2]" 1
121 1 62 LEU HB3 1 67 TYR HD2 3.528 . 5.084 3.959 3.874 4.045 . 0 0 "[ . 1 . 2]" 1
122 1 62 LEU HG 1 67 TYR HD2 4.231 . 6.468 2.289 2.178 2.386 . 0 0 "[ . 1 . 2]" 1
123 1 82 THR HA 1 85 TYR HD2 2.396 . 3.113 1.846 1.734 1.947 . 0 0 "[ . 1 . 2]" 1
124 1 74 ILE HA 1 105 PHE HE1 2.673 . 3.566 2.511 2.455 2.568 . 0 0 "[ . 1 . 2]" 1
125 1 77 PHE HA 1 77 PHE HD2 2.245 . 2.875 2.229 2.202 2.254 . 0 0 "[ . 1 . 2]" 1
126 1 87 TYR HA 1 87 TYR HD1 2.108 . 2.664 2.612 2.543 2.661 . 0 0 "[ . 1 . 2]" 1
127 1 13 TYR HA 1 13 TYR HD2 2.362 . 3.060 2.981 2.954 3.012 . 0 0 "[ . 1 . 2]" 1
128 1 81 PHE HA 1 81 PHE HD1 2.099 . 2.650 2.040 1.990 2.096 . 0 0 "[ . 1 . 2]" 1
129 1 66 TYR HA 1 66 TYR HD2 2.208 . 2.817 2.734 2.639 2.821 0.004 20 0 "[ . 1 . 2]" 1
130 1 19 LEU HA 1 77 PHE HE2 2.560 . 3.379 3.370 3.175 3.433 0.054 16 0 "[ . 1 . 2]" 1
131 1 68 TRP HA 1 68 TRP HE3 2.115 . 2.674 2.657 2.478 2.757 0.083 19 0 "[ . 1 . 2]" 1
132 1 100 ALA HA 1 101 LEU H 2.782 . 3.750 3.465 3.448 3.486 . 0 0 "[ . 1 . 2]" 1
133 1 28 ALA HA 1 31 PHE HD1 2.073 . 2.610 2.066 1.995 2.169 . 0 0 "[ . 1 . 2]" 1
134 1 13 TYR HD1 1 112 LEU HA 2.847 . 3.860 3.415 3.379 3.510 . 0 0 "[ . 1 . 2]" 1
135 1 23 TRP HZ3 1 56 GLY HA3 2.785 . 3.754 3.454 3.330 4.068 0.314 16 0 "[ . 1 . 2]" 1
136 1 101 LEU H 1 101 LEU HB2 2.628 . 3.491 2.378 2.359 2.418 . 0 0 "[ . 1 . 2]" 1
137 1 81 PHE HE1 1 101 LEU HB2 2.315 . 2.985 2.739 2.530 2.995 0.010 20 0 "[ . 1 . 2]" 1
138 1 81 PHE HE1 1 101 LEU HB3 2.379 . 3.087 2.637 2.475 2.814 . 0 0 "[ . 1 . 2]" 1
139 1 81 PHE HZ 1 101 LEU HB3 3.165 . 4.417 2.544 2.422 2.676 . 0 0 "[ . 1 . 2]" 1
140 1 19 LEU HB2 1 77 PHE HZ 2.649 . 3.526 3.154 2.958 3.254 . 0 0 "[ . 1 . 2]" 1
141 1 66 TYR HB2 1 66 TYR HD2 2.261 . 2.900 2.553 2.505 2.630 . 0 0 "[ . 1 . 2]" 1
142 1 48 ILE HB 1 87 TYR HD1 2.441 . 3.186 2.111 2.053 2.211 . 0 0 "[ . 1 . 2]" 1
143 1 48 ILE HB 1 87 TYR HE1 2.422 . 3.155 2.428 2.272 2.815 . 0 0 "[ . 1 . 2]" 1
144 1 77 PHE HB3 1 77 PHE HD2 2.362 . 3.059 2.639 2.615 2.679 . 0 0 "[ . 1 . 2]" 1
145 1 105 PHE HB3 1 105 PHE HD2 2.371 . 3.074 2.388 2.377 2.401 . 0 0 "[ . 1 . 2]" 1
146 1 105 PHE HB2 1 105 PHE HD1 2.456 . 3.210 2.477 2.456 2.497 . 0 0 "[ . 1 . 2]" 1
147 1 13 TYR HB3 1 13 TYR HD1 2.395 . 3.112 2.353 2.344 2.364 . 0 0 "[ . 1 . 2]" 1
148 1 13 TYR HB2 1 13 TYR HD2 2.115 . 2.674 2.455 2.447 2.461 . 0 0 "[ . 1 . 2]" 1
149 1 85 TYR HB3 1 85 TYR HD1 2.261 . 2.900 3.060 3.041 3.083 0.183 18 0 "[ . 1 . 2]" 1
150 1 85 TYR HB2 1 85 TYR HD2 2.192 . 2.793 2.348 2.329 2.361 . 0 0 "[ . 1 . 2]" 1
151 1 68 TRP QB 1 68 TRP HE3 2.103 . 2.656 2.678 2.641 2.731 0.075 9 0 "[ . 1 . 2]" 1
152 1 19 LEU HG 1 77 PHE HZ 2.866 . 3.893 4.037 4.004 4.063 0.170 8 0 "[ . 1 . 2]" 1
153 1 46 TYR HD1 1 52 PRO HG3 2.380 . 3.088 2.803 2.727 2.898 . 0 0 "[ . 1 . 2]" 1
154 1 46 TYR HE1 1 52 PRO HG2 2.023 . 2.535 2.436 2.254 2.548 0.013 13 0 "[ . 1 . 2]" 1
155 1 105 PHE HD2 1 106 LEU HG 2.316 . 2.986 1.797 1.731 1.848 . 0 0 "[ . 1 . 2]" 1
156 1 29 TRP HB3 1 29 TRP HD1 2.437 . 3.179 2.623 2.611 2.633 . 0 0 "[ . 1 . 2]" 1
157 1 22 LEU MD2 1 81 PHE HZ 2.428 . 3.165 1.779 1.699 1.825 . 0 0 "[ . 1 . 2]" 1
158 1 62 LEU MD2 1 67 TYR HD2 2.473 . 3.237 1.876 1.772 1.960 . 0 0 "[ . 1 . 2]" 1
159 1 62 LEU MD2 1 67 TYR HE2 2.433 . 3.173 3.059 3.028 3.089 . 0 0 "[ . 1 . 2]" 1
160 1 80 MET ME 1 81 PHE HE1 2.040 . 2.560 2.269 2.136 2.355 . 0 0 "[ . 1 . 2]" 1
161 1 105 PHE HE1 1 109 ILE MD 2.177 . 2.769 2.397 2.366 2.419 . 0 0 "[ . 1 . 2]" 1
162 1 3 LYS HA 1 4 PRO QD 2.169 . 2.535 1.840 1.795 1.890 . 0 0 "[ . 1 . 2]" 1
163 1 22 LEU HA 1 22 LEU HB2 2.395 . 3.112 3.008 3.004 3.013 . 0 0 "[ . 1 . 2]" 1
164 1 104 LEU HA 1 104 LEU HB3 2.279 . 2.928 3.013 3.005 3.020 0.092 7 0 "[ . 1 . 2]" 1
165 1 104 LEU HA 1 104 LEU HB2 2.242 . 2.871 2.452 2.443 2.461 . 0 0 "[ . 1 . 2]" 1
166 1 11 LEU HA 1 14 LEU HB3 2.951 . 4.040 3.375 3.300 3.441 . 0 0 "[ . 1 . 2]" 1
167 1 103 LYS HA 1 106 LEU HB2 2.877 . 3.912 2.650 2.514 2.759 . 0 0 "[ . 1 . 2]" 1
168 1 15 LEU HA 1 19 LEU HB3 2.582 . 3.415 2.703 2.562 2.836 . 0 0 "[ . 1 . 2]" 1
169 1 15 LEU HA 1 19 LEU HB2 2.713 . 3.633 1.877 1.786 1.973 0.007 2 0 "[ . 1 . 2]" 1
170 1 19 LEU HA 1 19 LEU HB2 2.480 . 3.249 2.632 2.613 2.647 . 0 0 "[ . 1 . 2]" 1
171 1 93 ASP HA 1 96 LEU HB3 2.659 . 3.543 3.714 3.686 3.736 0.193 14 0 "[ . 1 . 2]" 1
172 1 96 LEU HA 1 96 LEU HB3 2.229 . 2.850 2.502 2.478 2.522 . 0 0 "[ . 1 . 2]" 1
173 1 66 TYR HA 1 66 TYR HB3 2.350 . 3.040 3.028 3.021 3.032 . 0 0 "[ . 1 . 2]" 1
174 1 107 GLN HA 1 110 ASN QB 2.031 . 2.546 2.564 2.483 2.624 0.078 9 0 "[ . 1 . 2]" 1
175 1 13 TYR HA 1 13 TYR HB2 2.020 . 2.530 2.482 2.476 2.490 . 0 0 "[ . 1 . 2]" 1
176 1 10 GLN HA 1 13 TYR HB2 2.453 . 3.205 3.139 3.039 3.217 0.012 9 0 "[ . 1 . 2]" 1
177 1 46 TYR HA 1 46 TYR HB3 2.071 . 2.607 2.560 2.538 2.573 . 0 0 "[ . 1 . 2]" 1
178 1 5 LYS HA 1 5 LYS HB2 2.502 . 3.285 2.801 2.426 3.025 . 0 0 "[ . 1 . 2]" 1
179 1 5 LYS HA 1 5 LYS HB3 2.389 . 3.102 2.703 2.431 3.029 . 0 0 "[ . 1 . 2]" 1
180 1 49 ILE HA 1 49 ILE HB 2.360 . 3.056 3.017 3.013 3.021 . 0 0 "[ . 1 . 2]" 1
181 1 116 GLU HA 1 116 GLU HB3 1.981 . 2.472 2.456 2.352 2.522 0.050 7 0 "[ . 1 . 2]" 1
182 1 68 TRP HA 1 68 TRP QB 1.959 . 2.439 2.375 2.348 2.431 . 0 0 "[ . 1 . 2]" 1
183 1 115 GLU HA 1 115 GLU HB2 2.190 . 2.790 2.882 2.759 2.997 0.207 2 0 "[ . 1 . 2]" 1
184 1 115 GLU HA 1 115 GLU HB3 2.230 . 2.852 2.707 2.350 2.901 0.049 3 0 "[ . 1 . 2]" 1
185 1 111 GLU HA 1 111 GLU HB3 1.907 . 2.362 2.385 2.372 2.393 0.031 3 0 "[ . 1 . 2]" 1
186 1 20 LYS HA 1 23 TRP QB 2.207 . 2.816 2.175 2.053 2.375 . 0 0 "[ . 1 . 2]" 1
187 1 10 GLN HA 1 10 GLN HB2 2.202 . 2.808 2.999 2.991 3.008 0.200 1 0 "[ . 1 . 2]" 1
188 1 60 LYS HA 1 60 LYS QD 2.019 . 2.528 2.213 2.027 2.588 0.060 9 0 "[ . 1 . 2]" 1
189 1 5 LYS HA 1 5 LYS HD2 3.454 . 4.945 4.238 1.956 4.763 0.007 12 0 "[ . 1 . 2]" 1
190 1 39 LYS HA 1 39 LYS QD 2.056 . 2.584 1.879 1.517 2.521 0.011 19 0 "[ . 1 . 2]" 1
191 1 86 ILE HA 1 86 ILE HG13 2.072 . 2.608 2.421 2.381 2.496 . 0 0 "[ . 1 . 2]" 1
192 1 86 ILE HA 1 86 ILE HG12 2.035 . 2.553 2.613 2.604 2.630 0.077 19 0 "[ . 1 . 2]" 1
193 1 107 GLN HA 1 107 GLN HB2 1.982 . 2.473 2.628 2.594 2.725 0.252 16 0 "[ . 1 . 2]" 1
194 1 26 GLN HA 1 26 GLN QB 1.820 . 2.234 2.167 2.157 2.252 0.018 14 0 "[ . 1 . 2]" 1
195 1 7 GLN HA 1 7 GLN HB3 2.237 . 2.862 2.486 2.360 3.004 0.142 9 0 "[ . 1 . 2]" 1
196 1 71 GLN HA 1 71 GLN HB2 1.863 . 2.297 2.478 2.464 2.498 0.201 10 0 "[ . 1 . 2]" 1
197 1 29 TRP HA 1 29 TRP HB3 1.978 . 2.467 2.464 2.448 2.477 0.010 10 0 "[ . 1 . 2]" 1
198 1 29 TRP HA 1 29 TRP HB2 2.094 . 2.642 2.449 2.437 2.465 . 0 0 "[ . 1 . 2]" 1
199 1 103 LYS HA 1 103 LYS QG 2.621 . 3.382 3.257 3.226 3.268 . 0 0 "[ . 1 . 2]" 1
200 1 47 LYS HA 1 47 LYS HG3 2.142 . 2.716 2.620 2.203 2.996 0.280 18 0 "[ . 1 . 2]" 1
201 1 47 LYS HA 1 47 LYS HG2 2.089 . 2.634 2.667 2.495 2.879 0.245 8 0 "[ . 1 . 2]" 1
202 1 5 LYS HA 1 5 LYS QG 2.406 . 3.130 2.519 2.334 3.014 . 0 0 "[ . 1 . 2]" 1
203 1 22 LEU HA 1 22 LEU MD2 1.980 . 2.470 2.482 2.429 2.513 0.043 15 0 "[ . 1 . 2]" 1
204 1 11 LEU HA 1 62 LEU MD2 2.435 . 3.176 2.637 2.551 2.711 . 0 0 "[ . 1 . 2]" 1
205 1 21 THR HB 1 104 LEU MD2 3.200 . 4.480 3.857 3.827 3.909 . 0 0 "[ . 1 . 2]" 1
206 1 18 VAL MG1 1 19 LEU HA 2.347 . 3.036 3.121 3.094 3.139 0.103 18 0 "[ . 1 . 2]" 1
207 1 76 ASP HA 1 79 THR MG 2.766 . 3.722 3.290 3.235 3.339 . 0 0 "[ . 1 . 2]" 1
208 1 79 THR HB 1 79 THR MG 1.986 . 2.479 2.117 2.110 2.122 . 0 0 "[ . 1 . 2]" 1
209 1 38 VAL QG 1 39 LYS HA 2.083 . 2.625 2.698 2.639 2.749 0.124 2 0 "[ . 1 . 2]" 1
210 1 49 ILE MD 1 83 ASN HA 2.018 . 2.527 2.485 2.442 2.643 0.116 18 0 "[ . 1 . 2]" 1
211 1 21 THR HB 1 108 LYS HE3 2.638 . 3.508 2.750 2.672 2.834 . 0 0 "[ . 1 . 2]" 1
212 1 57 THR HA 1 60 LYS HB2 2.140 . 2.712 2.549 2.022 2.845 0.133 10 0 "[ . 1 . 2]" 1
213 1 82 THR HA 1 82 THR MG 2.112 . 2.669 2.396 2.376 2.422 . 0 0 "[ . 1 . 2]" 1
214 1 74 ILE HA 1 74 ILE MG 2.278 . 2.927 2.537 2.525 2.555 . 0 0 "[ . 1 . 2]" 1
215 1 58 ILE HA 1 58 ILE HG13 2.377 . 3.084 2.516 2.443 2.585 . 0 0 "[ . 1 . 2]" 1
216 1 58 ILE HA 1 58 ILE HG12 2.355 . 3.048 2.556 2.511 2.616 . 0 0 "[ . 1 . 2]" 1
217 1 17 VAL HA 1 20 LYS QB 2.727 . 3.657 3.287 3.002 3.382 . 0 0 "[ . 1 . 2]" 1
218 1 17 VAL HA 1 17 VAL HB 2.140 . 2.713 2.271 2.264 2.278 . 0 0 "[ . 1 . 2]" 1
219 1 77 PHE HA 1 77 PHE HB3 2.369 . 3.071 2.609 2.593 2.637 . 0 0 "[ . 1 . 2]" 1
220 1 77 PHE HA 1 80 MET HB3 2.919 . 3.984 2.939 2.688 3.754 . 0 0 "[ . 1 . 2]" 1
221 1 77 PHE HA 1 77 PHE HB2 2.303 . 2.966 2.992 2.983 2.996 0.030 5 0 "[ . 1 . 2]" 1
222 1 58 ILE MD 1 77 PHE HA 2.096 . 2.645 2.334 2.253 2.428 . 0 0 "[ . 1 . 2]" 1
223 1 4 PRO HA 1 4 PRO HB3 2.487 . 3.260 2.283 2.263 2.303 . 0 0 "[ . 1 . 2]" 1
224 1 52 PRO HA 1 52 PRO HG2 2.695 . 3.603 3.806 3.784 3.836 0.233 3 0 "[ . 1 . 2]" 1
225 1 109 ILE HA 1 112 LEU HB3 2.679 . 3.576 2.875 2.701 2.980 . 0 0 "[ . 1 . 2]" 1
226 1 49 ILE MG 1 52 PRO HA 1.756 . 2.141 2.174 2.126 2.243 0.102 18 0 "[ . 1 . 2]" 1
227 1 48 ILE HA 1 48 ILE HB 2.203 . 2.809 2.977 2.973 2.981 0.172 4 0 "[ . 1 . 2]" 1
228 1 48 ILE HA 1 48 ILE HG12 2.205 . 2.813 2.592 2.555 2.750 . 0 0 "[ . 1 . 2]" 1
229 1 48 ILE HA 1 48 ILE HG13 2.103 . 2.656 2.586 2.423 2.661 0.005 14 0 "[ . 1 . 2]" 1
230 1 87 TYR HA 1 87 TYR HB2 2.133 . 2.702 2.610 2.580 2.626 . 0 0 "[ . 1 . 2]" 1
231 1 114 THR HA 1 114 THR MG 1.870 . 2.307 2.227 2.168 2.272 . 0 0 "[ . 1 . 2]" 1
232 1 13 TYR HA 1 17 VAL MG1 2.122 . 2.685 2.142 2.127 2.156 . 0 0 "[ . 1 . 2]" 1
233 1 81 PHE HA 1 81 PHE HB3 2.579 . 3.411 2.413 2.389 2.426 . 0 0 "[ . 1 . 2]" 1
234 1 29 TRP HA 1 32 GLN HG3 2.487 . 3.260 2.761 2.677 2.847 . 0 0 "[ . 1 . 2]" 1
235 1 66 TYR HA 1 66 TYR HB2 2.160 . 2.743 2.442 2.376 2.480 . 0 0 "[ . 1 . 2]" 1
236 1 22 LEU HA 1 22 LEU HG 2.426 . 3.162 2.493 2.475 2.511 . 0 0 "[ . 1 . 2]" 1
237 1 25 HIS HA 1 25 HIS HB2 1.935 . 2.403 2.685 2.672 2.692 0.289 20 0 "[ . 1 . 2]" 1
238 1 71 GLN HA 1 71 GLN HG3 2.122 . 2.685 2.493 2.428 2.597 . 0 0 "[ . 1 . 2]" 1
239 1 19 LEU HA 1 19 LEU HB3 2.323 . 2.998 3.000 2.996 3.008 0.010 3 0 "[ . 1 . 2]" 1
240 1 19 LEU HA 1 22 LEU HB2 2.226 . 2.845 3.002 2.976 3.044 0.199 3 0 "[ . 1 . 2]" 1
241 1 63 GLU HA 1 63 GLU HB3 2.120 . 2.682 2.666 2.632 2.711 0.029 9 0 "[ . 1 . 2]" 1
242 1 14 LEU HA 1 14 LEU HB2 2.467 . 3.228 2.939 2.935 2.945 . 0 0 "[ . 1 . 2]" 1
243 1 39 LYS HA 1 39 LYS HG3 2.448 . 3.197 2.493 2.232 2.644 . 0 0 "[ . 1 . 2]" 1
244 1 39 LYS HA 1 39 LYS HG2 2.573 . 3.401 3.500 3.469 3.539 0.138 3 0 "[ . 1 . 2]" 1
245 1 19 LEU HA 1 19 LEU MD1 2.151 . 2.729 2.695 2.677 2.716 . 0 0 "[ . 1 . 2]" 1
246 1 19 LEU HA 1 19 LEU MD2 2.643 . 3.516 2.205 2.172 2.260 . 0 0 "[ . 1 . 2]" 1
247 1 14 LEU HA 1 14 LEU MD2 2.157 . 2.739 1.675 1.644 1.760 . 0 0 "[ . 1 . 2]" 1
248 1 62 LEU HA 1 62 LEU HB3 2.767 . 3.724 2.641 2.611 2.665 . 0 0 "[ . 1 . 2]" 1
249 1 62 LEU HA 1 62 LEU HG 2.566 . 3.389 2.700 2.665 2.740 . 0 0 "[ . 1 . 2]" 1
250 1 62 LEU HA 1 62 LEU HB2 2.217 . 2.831 2.959 2.949 2.969 0.138 16 0 "[ . 1 . 2]" 1
251 1 62 LEU HA 1 62 LEU MD2 2.026 . 2.539 2.282 2.218 2.330 . 0 0 "[ . 1 . 2]" 1
252 1 106 LEU HA 1 106 LEU HB2 2.250 . 2.883 2.999 2.996 3.002 0.119 8 0 "[ . 1 . 2]" 1
253 1 67 TYR HA 1 67 TYR HB3 2.018 . 2.527 2.489 2.453 2.515 . 0 0 "[ . 1 . 2]" 1
254 1 70 ALA HA 1 73 CYS HB3 2.118 . 2.679 2.741 2.612 3.187 0.508 4 1 "[ +. 1 . 2]" 1
255 1 70 ALA HA 1 70 ALA MB 1.731 . 2.106 2.102 2.095 2.111 0.005 15 0 "[ . 1 . 2]" 1
256 1 14 LEU MD1 1 70 ALA HA 1.909 . 2.365 2.154 2.066 2.233 . 0 0 "[ . 1 . 2]" 1
257 1 11 LEU MD2 1 70 ALA HA 1.910 . 2.366 1.794 1.748 1.855 . 0 0 "[ . 1 . 2]" 1
258 1 28 ALA HA 1 101 LEU MD1 1.901 . 2.353 2.251 2.204 2.303 . 0 0 "[ . 1 . 2]" 1
259 1 3 LYS HA 1 3 LYS HB3 2.490 . 3.265 2.794 2.475 3.030 . 0 0 "[ . 1 . 2]" 1
260 1 3 LYS HA 1 3 LYS HB2 2.676 . 3.571 2.719 2.429 3.027 . 0 0 "[ . 1 . 2]" 1
261 1 3 LYS HA 1 3 LYS HG2 2.469 . 3.231 3.022 2.450 3.804 0.573 19 4 "[ . 1 ** +-]" 1
262 1 112 LEU HA 1 112 LEU HB3 2.230 . 2.852 2.999 2.997 3.002 0.150 5 0 "[ . 1 . 2]" 1
263 1 112 LEU HA 1 113 PRO HD3 1.925 . 2.388 2.063 2.000 2.121 . 0 0 "[ . 1 . 2]" 1
264 1 112 LEU HA 1 113 PRO HG3 2.971 . 4.074 4.169 4.130 4.202 0.128 16 0 "[ . 1 . 2]" 1
265 1 112 LEU HA 1 112 LEU MD1 2.138 . 2.710 2.048 2.029 2.093 . 0 0 "[ . 1 . 2]" 1
266 1 2 ASN HA 1 2 ASN QB 2.224 . 2.842 2.329 2.175 2.488 . 0 0 "[ . 1 . 2]" 1
267 1 64 ASN HA 1 64 ASN HB2 1.906 . 2.360 2.557 2.413 3.020 0.660 9 3 "[ . * +1 - 2]" 1
268 1 62 LEU HB3 1 62 LEU MD1 2.297 . 2.956 2.438 2.422 2.463 . 0 0 "[ . 1 . 2]" 1
269 1 15 LEU HB2 1 15 LEU MD2 2.428 . 3.165 2.527 2.499 2.550 . 0 0 "[ . 1 . 2]" 1
270 1 101 LEU HB3 1 101 LEU HG 2.436 . 3.177 3.007 3.005 3.008 . 0 0 "[ . 1 . 2]" 1
271 1 101 LEU HB2 1 101 LEU MD2 2.650 . 3.528 3.142 3.139 3.146 . 0 0 "[ . 1 . 2]" 1
272 1 101 LEU HB3 1 101 LEU MD2 2.494 . 3.271 2.281 2.274 2.290 . 0 0 "[ . 1 . 2]" 1
273 1 22 LEU HB3 1 22 LEU HG 2.199 . 2.804 2.938 2.934 2.941 0.137 14 0 "[ . 1 . 2]" 1
274 1 22 LEU HB2 1 22 LEU HG 2.541 . 3.348 2.678 2.663 2.689 . 0 0 "[ . 1 . 2]" 1
275 1 104 LEU HB3 1 104 LEU MD1 2.305 . 2.969 2.086 2.076 2.099 . 0 0 "[ . 1 . 2]" 1
276 1 14 LEU HB3 1 14 LEU MD1 2.328 . 3.006 2.321 2.261 2.345 . 0 0 "[ . 1 . 2]" 1
277 1 19 LEU HB2 1 62 LEU MD1 3.466 . 4.967 2.547 2.390 2.656 . 0 0 "[ . 1 . 2]" 1
278 1 106 LEU HB2 1 106 LEU MD1 2.030 . 2.545 2.277 2.265 2.285 . 0 0 "[ . 1 . 2]" 1
279 1 19 LEU HB3 1 19 LEU MD1 2.552 . 3.366 2.303 2.284 2.312 . 0 0 "[ . 1 . 2]" 1
280 1 19 LEU HB2 1 19 LEU MD2 2.505 . 3.290 2.250 2.223 2.265 . 0 0 "[ . 1 . 2]" 1
281 1 11 LEU HB2 1 11 LEU MD2 2.704 . 3.618 3.153 3.133 3.168 . 0 0 "[ . 1 . 2]" 1
282 1 11 LEU HB2 1 11 LEU MD1 2.242 . 2.870 2.198 2.157 2.234 . 0 0 "[ . 1 . 2]" 1
283 1 96 LEU HB3 1 96 LEU HG 2.782 . 3.749 2.984 2.975 2.993 . 0 0 "[ . 1 . 2]" 1
284 1 96 LEU HB2 1 96 LEU HG 2.425 . 3.160 2.318 2.299 2.344 . 0 0 "[ . 1 . 2]" 1
285 1 48 ILE HB 1 48 ILE HG13 2.358 . 3.053 2.566 2.535 2.647 . 0 0 "[ . 1 . 2]" 1
286 1 7 GLN HB3 1 7 GLN QG 2.425 . 2.725 2.310 2.139 2.436 . 0 0 "[ . 1 . 2]" 1
287 1 5 LYS HB2 1 5 LYS QG 2.281 . 2.931 2.321 2.155 2.372 . 0 0 "[ . 1 . 2]" 1
288 1 49 ILE HB 1 49 ILE HG12 2.163 . 2.748 2.564 2.391 2.599 . 0 0 "[ . 1 . 2]" 1
289 1 49 ILE HB 1 49 ILE MG 1.967 . 2.451 2.101 2.098 2.104 . 0 0 "[ . 1 . 2]" 1
290 1 5 LYS HB3 1 5 LYS QG 2.308 . 2.974 2.331 2.165 2.389 . 0 0 "[ . 1 . 2]" 1
291 1 36 ASP QB 1 39 LYS HB2 2.429 . 3.166 1.646 1.566 1.737 0.144 9 0 "[ . 1 . 2]" 1
292 1 60 LYS HB2 1 60 LYS HG3 2.105 . 2.659 2.773 2.445 3.021 0.362 1 0 "[ . 1 . 2]" 1
293 1 25 HIS HB2 1 101 LEU MD2 2.299 . 2.960 2.416 2.358 2.469 . 0 0 "[ . 1 . 2]" 1
294 1 35 VAL HA 1 35 VAL HB 2.131 . 2.699 2.214 2.200 2.229 . 0 0 "[ . 1 . 2]" 1
295 1 35 VAL HB 1 35 VAL MG2 1.829 . 2.247 2.100 2.093 2.107 . 0 0 "[ . 1 . 2]" 1
296 1 115 GLU HB3 1 115 GLU QG 1.811 . 2.221 2.326 2.102 2.405 0.184 15 0 "[ . 1 . 2]" 1
297 1 36 ASP QB 1 39 LYS QD 2.604 . 3.451 2.610 1.926 3.110 . 0 0 "[ . 1 . 2]" 1
298 1 86 ILE HB 1 86 ILE HG12 2.150 . 2.728 2.951 2.947 2.956 0.228 9 0 "[ . 1 . 2]" 1
299 1 62 LEU MD2 1 62 LEU HG 2.190 . 2.789 2.109 2.102 2.128 . 0 0 "[ . 1 . 2]" 1
300 1 50 LYS QD 1 50 LYS HE2 1.999 . 2.499 2.284 2.160 2.361 . 0 0 "[ . 1 . 2]" 1
301 1 19 LEU MD1 1 19 LEU HG 2.450 . 3.200 2.091 2.087 2.095 . 0 0 "[ . 1 . 2]" 1
302 1 7 GLN HB2 1 7 GLN QG 2.175 . 2.658 2.259 2.138 2.401 . 0 0 "[ . 1 . 2]" 1
303 1 15 LEU HB2 1 15 LEU HG 2.327 . 3.004 2.340 2.331 2.351 . 0 0 "[ . 1 . 2]" 1
304 1 62 LEU HB2 1 62 LEU MD1 1.725 . 2.097 2.145 2.128 2.160 0.063 14 0 "[ . 1 . 2]" 1
305 1 96 LEU MD1 1 96 LEU HG 1.795 . 2.198 2.092 2.091 2.094 . 0 0 "[ . 1 . 2]" 1
306 1 89 LYS HE2 1 89 LYS QG 2.571 . 3.398 2.703 2.331 3.310 . 0 0 "[ . 1 . 2]" 1
307 1 62 LEU MD2 1 73 CYS HB3 2.318 . 2.990 3.078 2.947 3.623 0.633 8 3 "[ *. +-1 . 2]" 1
308 1 22 LEU MD2 1 22 LEU HG 1.900 . 2.351 2.142 2.138 2.145 . 0 0 "[ . 1 . 2]" 1
309 1 22 LEU MD2 1 104 LEU HB3 2.428 . 3.165 2.923 2.856 2.950 . 0 0 "[ . 1 . 2]" 1
310 1 22 LEU MD2 1 101 LEU HB3 2.211 . 2.822 1.902 1.885 1.918 . 0 0 "[ . 1 . 2]" 1
311 1 11 LEU MD2 1 62 LEU MD2 2.072 . 2.608 1.912 1.873 1.987 . 0 0 "[ . 1 . 2]" 1
312 1 18 VAL HB 1 18 VAL MG1 1.909 . 2.365 2.105 2.102 2.107 . 0 0 "[ . 1 . 2]" 1
313 1 11 LEU MD2 1 73 CYS HB3 2.194 . 2.796 2.582 2.425 3.282 0.486 8 0 "[ . 1 . 2]" 1
314 1 18 VAL MG1 1 22 LEU MD1 1.897 . 2.347 1.591 1.554 1.612 . 0 0 "[ . 1 . 2]" 1
315 1 96 LEU MD2 1 99 GLU HB2 2.748 . 3.692 3.446 3.390 3.498 . 0 0 "[ . 1 . 2]" 1
316 1 96 LEU HB2 1 96 LEU MD1 2.125 . 2.689 2.527 2.509 2.543 . 0 0 "[ . 1 . 2]" 1
317 1 53 MET HG2 1 79 THR MG 2.132 . 2.700 2.663 2.621 2.682 . 0 0 "[ . 1 . 2]" 1
318 1 82 THR MG 1 86 ILE HG13 2.081 . 2.622 2.136 1.967 2.209 . 0 0 "[ . 1 . 2]" 1
319 1 74 ILE HG12 1 109 ILE MG 2.177 . 2.769 2.586 2.549 2.628 . 0 0 "[ . 1 . 2]" 1
320 1 58 ILE HB 1 58 ILE MG 1.838 . 2.260 2.070 2.064 2.079 . 0 0 "[ . 1 . 2]" 1
321 1 55 MET ME 1 55 MET HG3 1.818 . 2.231 2.276 2.262 2.299 0.068 3 0 "[ . 1 . 2]" 1
322 1 55 MET ME 1 101 LEU MD1 1.965 . 2.448 1.754 1.654 1.820 . 0 0 "[ . 1 . 2]" 1
323 1 14 LEU HG 1 109 ILE MD 2.751 . 3.697 2.808 2.764 2.852 . 0 0 "[ . 1 . 2]" 1
324 1 74 ILE HG12 1 109 ILE MD 1.980 . 2.470 2.617 2.592 2.638 0.168 2 0 "[ . 1 . 2]" 1
325 1 49 ILE MD 1 83 ASN QB 2.508 . 3.294 1.838 1.721 2.680 0.131 16 0 "[ . 1 . 2]" 1
326 1 49 ILE MD 1 86 ILE MG 2.069 . 2.604 1.575 1.496 1.633 0.038 9 0 "[ . 1 . 2]" 1
327 1 7 GLN HA 1 7 GLN HB2 2.400 . 3.120 2.969 2.412 3.025 . 0 0 "[ . 1 . 2]" 1
328 1 10 GLN HB3 1 10 GLN HG3 2.627 . 3.490 2.902 2.818 2.970 . 0 0 "[ . 1 . 2]" 1
329 1 10 GLN HB2 1 10 GLN HG3 2.484 . 3.255 2.683 2.544 2.797 . 0 0 "[ . 1 . 2]" 1
330 1 11 LEU HA 1 11 LEU HB2 2.784 . 3.753 2.995 2.986 3.008 . 0 0 "[ . 1 . 2]" 1
331 1 13 TYR HA 1 13 TYR HB3 2.523 . 3.319 3.025 3.023 3.029 . 0 0 "[ . 1 . 2]" 1
332 1 12 GLN HA 1 15 LEU HB2 3.508 . 5.046 3.773 3.517 4.060 . 0 0 "[ . 1 . 2]" 1
333 1 39 LYS HA 1 39 LYS HB2 2.898 . 3.948 2.810 2.720 2.920 . 0 0 "[ . 1 . 2]" 1
334 1 103 LYS HA 1 106 LEU HB3 3.084 . 4.273 4.125 3.982 4.242 . 0 0 "[ . 1 . 2]" 1
335 1 22 LEU HB2 1 22 LEU MD1 2.237 . 2.862 2.060 2.047 2.078 . 0 0 "[ . 1 . 2]" 1
336 1 16 ARG HA 1 16 ARG QD 2.421 . 3.154 2.282 1.884 3.271 0.117 1 0 "[ . 1 . 2]" 1
337 1 18 VAL HA 1 108 LYS HB2 3.097 . 4.296 3.485 3.398 3.553 . 0 0 "[ . 1 . 2]" 1
338 1 19 LEU HA 1 77 PHE HZ 2.674 . 3.568 2.287 2.155 2.374 . 0 0 "[ . 1 . 2]" 1
339 1 19 LEU HB3 1 77 PHE HZ 3.302 . 4.665 4.380 4.222 4.451 . 0 0 "[ . 1 . 2]" 1
340 1 19 LEU HB2 1 77 PHE HE1 3.298 . 4.658 4.101 3.946 4.172 . 0 0 "[ . 1 . 2]" 1
341 1 19 LEU HB2 1 19 LEU MD1 3.473 . 4.981 3.171 3.163 3.178 . 0 0 "[ . 1 . 2]" 1
342 1 19 LEU HB3 1 19 LEU HG 2.636 . 3.505 2.416 2.400 2.423 . 0 0 "[ . 1 . 2]" 1
343 1 18 VAL HA 1 21 THR HB 2.453 . 3.205 2.530 2.484 2.641 . 0 0 "[ . 1 . 2]" 1
344 1 22 LEU HA 1 104 LEU MD1 2.734 . 3.668 2.207 2.118 2.269 . 0 0 "[ . 1 . 2]" 1
345 1 68 TRP HA 1 68 TRP HD1 3.173 . 4.431 4.370 4.186 4.465 0.034 17 0 "[ . 1 . 2]" 1
346 1 23 TRP HD1 1 24 LYS HA 2.697 . 3.606 3.381 2.979 3.622 0.016 15 0 "[ . 1 . 2]" 1
347 1 25 HIS HB3 1 25 HIS HD2 2.865 . 3.891 3.855 3.838 3.872 . 0 0 "[ . 1 . 2]" 1
348 1 25 HIS HB2 1 25 HIS HD2 2.680 . 3.578 2.764 2.739 2.782 . 0 0 "[ . 1 . 2]" 1
349 1 25 HIS HB3 1 101 LEU MD2 3.053 . 4.218 1.847 1.809 1.894 0.079 20 0 "[ . 1 . 2]" 1
350 1 47 LYS HA 1 47 LYS HB2 2.224 . 2.842 2.903 2.592 2.994 0.152 15 0 "[ . 1 . 2]" 1
351 1 27 PHE HA 1 27 PHE HB2 2.657 . 3.540 3.014 3.011 3.018 . 0 0 "[ . 1 . 2]" 1
352 1 27 PHE HA 1 27 PHE QD 2.232 . 2.855 2.502 2.253 2.593 . 0 0 "[ . 1 . 2]" 1
353 1 27 PHE HA 1 29 TRP HD1 3.142 . 4.376 2.854 2.711 3.057 . 0 0 "[ . 1 . 2]" 1
354 1 28 ALA HA 1 28 ALA MB 1.915 . 2.373 2.109 2.103 2.114 . 0 0 "[ . 1 . 2]" 1
355 1 35 VAL MG2 1 37 ALA HA 2.366 . 3.066 2.486 2.390 2.525 . 0 0 "[ . 1 . 2]" 1
356 1 38 VAL HB 1 38 VAL QG 2.067 . 2.274 1.877 1.868 1.887 . 0 0 "[ . 1 . 2]" 1
357 1 104 LEU HA 1 104 LEU MD2 2.364 . 3.063 2.017 1.998 2.042 . 0 0 "[ . 1 . 2]" 1
358 1 42 LEU HA 1 43 PRO HD2 2.439 . 3.182 2.614 1.900 2.721 . 0 0 "[ . 1 . 2]" 1
359 1 22 LEU MD2 1 105 PHE HB3 2.910 . 3.969 2.441 2.411 2.474 . 0 0 "[ . 1 . 2]" 1
360 1 46 TYR HA 1 49 ILE HB 2.987 . 4.102 3.023 2.891 3.088 . 0 0 "[ . 1 . 2]" 1
361 1 45 TYR HE1 1 49 ILE HB 3.393 . 4.832 4.878 4.797 4.933 0.101 2 0 "[ . 1 . 2]" 1
362 1 49 ILE HA 1 49 ILE MD 2.219 . 2.835 2.120 2.042 2.203 . 0 0 "[ . 1 . 2]" 1
363 1 48 ILE HB 1 49 ILE MD 3.199 . 4.478 3.897 2.956 3.982 . 0 0 "[ . 1 . 2]" 1
364 1 109 ILE HA 1 109 ILE MG 2.060 . 2.591 2.217 2.202 2.230 . 0 0 "[ . 1 . 2]" 1
365 1 46 TYR HD1 1 52 PRO HG2 2.955 . 4.046 2.409 2.230 2.615 . 0 0 "[ . 1 . 2]" 1
366 1 45 TYR HE1 1 52 PRO HG2 3.106 . 4.312 4.443 4.419 4.477 0.165 16 0 "[ . 1 . 2]" 1
367 1 45 TYR HE1 1 52 PRO HG3 3.050 . 4.213 3.669 3.626 3.739 . 0 0 "[ . 1 . 2]" 1
368 1 46 TYR HE1 1 52 PRO HA 3.036 . 4.188 4.459 4.426 4.504 0.316 4 0 "[ . 1 . 2]" 1
369 1 45 TYR HE1 1 52 PRO HA 2.942 . 4.024 3.751 3.639 3.843 . 0 0 "[ . 1 . 2]" 1
370 1 54 ASP HA 1 54 ASP HB2 2.314 . 2.983 2.507 2.462 3.017 0.034 16 0 "[ . 1 . 2]" 1
371 1 54 ASP HA 1 54 ASP HB3 2.139 . 2.711 2.438 2.413 2.482 . 0 0 "[ . 1 . 2]" 1
372 1 54 ASP HA 1 80 MET HG2 2.711 . 3.629 3.459 2.697 3.709 0.080 19 0 "[ . 1 . 2]" 1
373 1 31 PHE HB3 1 55 MET ME 2.267 . 2.909 2.599 2.471 2.711 . 0 0 "[ . 1 . 2]" 1
374 1 57 THR HA 1 57 THR HB 2.774 . 3.736 3.027 3.021 3.034 . 0 0 "[ . 1 . 2]" 1
375 1 55 MET HB3 1 58 ILE HB 3.233 . 4.539 4.331 4.189 4.480 . 0 0 "[ . 1 . 2]" 1
376 1 62 LEU HB3 1 62 LEU MD2 3.321 . 4.700 2.198 2.165 2.229 . 0 0 "[ . 1 . 2]" 1
377 1 66 TYR HA 1 66 TYR HE2 3.380 . 4.808 4.833 4.786 4.894 0.086 9 0 "[ . 1 . 2]" 1
378 1 67 TYR HB3 1 67 TYR HE2 3.430 . 4.900 5.075 5.032 5.104 0.204 2 0 "[ . 1 . 2]" 1
379 1 67 TYR HB2 1 67 TYR HD2 2.891 . 3.935 2.253 2.234 2.272 . 0 0 "[ . 1 . 2]" 1
380 1 67 TYR HB2 1 67 TYR HE2 3.471 . 4.977 4.535 4.518 4.548 . 0 0 "[ . 1 . 2]" 1
381 1 11 LEU HA 1 70 ALA MB 2.905 . 3.960 2.780 2.697 2.913 . 0 0 "[ . 1 . 2]" 1
382 1 74 ILE HA 1 74 ILE MD 3.220 . 4.516 3.779 3.763 3.790 . 0 0 "[ . 1 . 2]" 1
383 1 71 GLN HA 1 74 ILE MD 2.092 . 2.639 1.754 1.655 1.917 . 0 0 "[ . 1 . 2]" 1
384 1 77 PHE HA 1 80 MET HB2 3.461 . 4.959 2.663 2.144 2.861 . 0 0 "[ . 1 . 2]" 1
385 1 77 PHE HA 1 77 PHE HE2 2.935 . 4.012 4.258 4.241 4.276 0.264 12 0 "[ . 1 . 2]" 1
386 1 77 PHE HB2 1 77 PHE HE1 3.298 . 4.658 4.618 4.595 4.628 . 0 0 "[ . 1 . 2]" 1
387 1 80 MET HB2 1 80 MET HG2 2.937 . 4.015 2.964 2.797 2.997 . 0 0 "[ . 1 . 2]" 1
388 1 77 PHE HA 1 80 MET ME 2.481 . 3.251 2.493 2.232 2.830 . 0 0 "[ . 1 . 2]" 1
389 1 80 MET ME 1 81 PHE HZ 2.486 . 3.258 2.799 2.737 2.934 . 0 0 "[ . 1 . 2]" 1
390 1 87 TYR HA 1 87 TYR HE1 2.990 . 4.108 4.422 4.402 4.447 0.339 3 0 "[ . 1 . 2]" 1
391 1 88 ASN HA 1 88 ASN HB3 2.093 . 2.641 2.422 2.325 2.499 . 0 0 "[ . 1 . 2]" 1
392 1 88 ASN HA 1 88 ASN HB2 2.269 . 2.913 2.991 2.984 2.995 0.082 13 0 "[ . 1 . 2]" 1
393 1 91 GLY HA3 1 96 LEU MD2 3.277 . 4.620 3.220 3.149 3.297 . 0 0 "[ . 1 . 2]" 1
394 1 29 TRP HA 1 32 GLN HB2 3.760 . 5.528 3.572 3.205 5.011 . 0 0 "[ . 1 . 2]" 1
395 1 98 ALA MB 1 99 GLU HA 2.928 . 4.000 3.791 3.772 3.833 . 0 0 "[ . 1 . 2]" 1
396 1 81 PHE HZ 1 101 LEU HB2 3.535 . 5.097 3.536 3.405 3.690 . 0 0 "[ . 1 . 2]" 1
397 1 105 PHE HB2 1 105 PHE HE1 3.668 . 5.350 4.676 4.661 4.685 . 0 0 "[ . 1 . 2]" 1
398 1 106 LEU HB2 1 106 LEU HG 2.660 . 3.545 2.578 2.568 2.589 . 0 0 "[ . 1 . 2]" 1
399 1 109 ILE HB 1 109 ILE MG 2.153 . 2.733 2.097 2.096 2.099 . 0 0 "[ . 1 . 2]" 1
400 1 106 LEU MD2 1 109 ILE HB 2.386 . 3.098 3.044 3.025 3.082 . 0 0 "[ . 1 . 2]" 1
401 1 112 LEU HA 1 112 LEU HG 2.778 . 3.743 3.515 3.477 3.563 . 0 0 "[ . 1 . 2]" 1
402 1 13 TYR HE1 1 112 LEU HA 2.914 . 3.975 3.404 3.353 3.455 . 0 0 "[ . 1 . 2]" 1
403 1 22 LEU MD2 1 25 HIS HD2 3.003 . 4.130 4.024 3.987 4.049 . 0 0 "[ . 1 . 2]" 1
404 1 13 TYR HD1 1 109 ILE MG 4.109 . 6.219 4.564 4.530 4.597 . 0 0 "[ . 1 . 2]" 1
405 1 74 ILE HG13 1 109 ILE MD 2.946 . 4.031 3.654 3.560 3.699 . 0 0 "[ . 1 . 2]" 1
406 1 16 ARG HG3 1 17 VAL MG1 3.917 . 5.835 4.222 4.146 4.333 . 0 0 "[ . 1 . 2]" 1
407 1 92 ASP HA 1 96 LEU MD2 3.696 . 5.404 4.682 4.635 4.744 . 0 0 "[ . 1 . 2]" 1
408 1 11 LEU HA 1 11 LEU HB3 2.555 . 3.371 2.586 2.549 2.618 . 0 0 "[ . 1 . 2]" 1
409 1 12 GLN HA 1 12 GLN HB2 2.159 . 2.742 2.820 2.800 2.841 0.099 15 0 "[ . 1 . 2]" 1
410 1 12 GLN HA 1 15 LEU MD1 2.685 . 3.586 3.425 3.194 3.489 . 0 0 "[ . 1 . 2]" 1
411 1 19 LEU HA 1 22 LEU HG 3.472 . 4.979 4.986 4.930 5.021 0.042 3 0 "[ . 1 . 2]" 1
412 1 61 ARG HA 1 66 TYR HB3 2.809 . 3.795 2.377 2.147 2.638 . 0 0 "[ . 1 . 2]" 1
413 1 11 LEU MD1 1 68 TRP HA 3.366 . 4.782 3.339 3.205 3.508 . 0 0 "[ . 1 . 2]" 1
414 1 89 LYS HA 1 89 LYS QD 2.596 . 3.439 2.418 2.043 3.454 0.015 18 0 "[ . 1 . 2]" 1
415 1 93 ASP HA 1 96 LEU HG 2.330 . 3.008 2.888 2.733 2.997 . 0 0 "[ . 1 . 2]" 1
416 1 14 LEU HG 1 109 ILE MG 2.733 . 3.667 3.679 3.646 3.702 0.035 4 0 "[ . 1 . 2]" 1
417 1 109 ILE MG 1 112 LEU MD2 2.150 . 2.728 1.680 1.625 1.727 . 0 0 "[ . 1 . 2]" 1
418 1 109 ILE MG 1 112 LEU HB3 3.135 . 4.363 2.596 2.486 2.689 . 0 0 "[ . 1 . 2]" 1
419 1 22 LEU MD2 1 101 LEU MD1 2.566 . 3.389 2.989 2.958 3.037 . 0 0 "[ . 1 . 2]" 1
420 1 14 LEU MD2 1 109 ILE MD 2.399 . 3.119 1.648 1.629 1.670 0.050 13 0 "[ . 1 . 2]" 1
421 1 91 GLY HA2 1 96 LEU MD2 2.322 . 2.996 1.579 1.497 1.654 0.151 11 0 "[ . 1 . 2]" 1
422 1 74 ILE HA 1 77 PHE HB2 3.460 . 4.957 2.301 2.276 2.333 . 0 0 "[ . 1 . 2]" 1
423 1 82 THR MG 1 86 ILE HA 3.249 . 4.569 4.119 4.022 4.170 . 0 0 "[ . 1 . 2]" 1
424 1 82 THR MG 1 85 TYR HB2 2.958 . 4.051 2.805 2.698 2.883 . 0 0 "[ . 1 . 2]" 1
425 1 11 LEU HA 1 11 LEU MD2 2.565 . 3.387 1.989 1.895 2.123 . 0 0 "[ . 1 . 2]" 1
426 1 35 VAL MG1 1 35 VAL MG2 1.987 . 2.481 2.069 2.061 2.078 . 0 0 "[ . 1 . 2]" 1
427 1 26 GLN HG2 1 27 PHE HZ 2.528 . 3.327 3.390 2.930 3.961 0.634 16 2 "[ . 1 -+ 2]" 1
428 1 26 GLN HG3 1 27 PHE HZ 2.748 . 3.692 3.693 3.278 3.778 0.086 3 0 "[ . 1 . 2]" 1
429 1 29 TRP HA 1 29 TRP HD1 3.285 . 4.634 4.539 4.503 4.561 . 0 0 "[ . 1 . 2]" 1
430 1 29 TRP HA 1 29 TRP HE3 3.025 . 4.169 4.162 4.121 4.198 0.029 18 0 "[ . 1 . 2]" 1
431 1 29 TRP HB2 1 29 TRP HD1 3.093 . 4.289 3.772 3.761 3.783 . 0 0 "[ . 1 . 2]" 1
432 1 6 ARG HD2 1 68 TRP HA 3.310 . 4.680 4.341 3.964 4.914 0.234 9 0 "[ . 1 . 2]" 1
433 1 81 PHE HA 1 81 PHE HB2 2.572 . 3.399 3.023 3.019 3.026 . 0 0 "[ . 1 . 2]" 1
434 1 27 PHE HA 1 27 PHE HB3 2.672 . 3.564 2.454 2.424 2.470 . 0 0 "[ . 1 . 2]" 1
435 1 87 TYR HA 1 87 TYR HB3 2.421 . 3.154 2.976 2.969 2.984 . 0 0 "[ . 1 . 2]" 1
436 1 49 ILE MD 1 87 TYR HB2 2.160 . 2.743 1.117 1.072 1.203 0.505 3 1 "[ + . 1 . 2]" 1
437 1 58 ILE MD 1 80 MET ME 3.040 . 4.195 2.554 2.388 2.799 . 0 0 "[ . 1 . 2]" 1
438 1 19 LEU MD2 1 58 ILE MG 2.360 . 3.056 1.785 1.764 1.835 . 0 0 "[ . 1 . 2]" 1
439 1 58 ILE MG 1 67 TYR HE2 3.120 . 4.337 2.585 2.518 2.682 . 0 0 "[ . 1 . 2]" 1
440 1 48 ILE MD 1 48 ILE HG12 3.029 . 4.176 2.113 2.103 2.117 . 0 0 "[ . 1 . 2]" 1
441 1 22 LEU MD1 1 105 PHE HD1 2.647 . 3.523 2.323 2.267 2.351 . 0 0 "[ . 1 . 2]" 1
442 1 22 LEU MD1 1 77 PHE HE2 2.615 . 3.470 2.354 2.301 2.408 . 0 0 "[ . 1 . 2]" 1
443 1 106 LEU HA 1 109 ILE HB 2.676 . 3.571 2.778 2.715 2.822 . 0 0 "[ . 1 . 2]" 1
444 1 77 PHE HB3 1 80 MET ME 3.038 . 4.192 3.570 3.428 3.940 . 0 0 "[ . 1 . 2]" 1
445 1 55 MET ME 1 80 MET ME 2.472 . 3.236 1.737 1.589 1.900 0.119 11 0 "[ . 1 . 2]" 1
446 1 28 ALA HA 1 101 LEU MD2 2.612 . 3.465 3.057 2.958 3.105 . 0 0 "[ . 1 . 2]" 1
447 1 28 ALA HA 1 31 PHE HE1 3.306 . 4.672 3.866 3.794 4.057 . 0 0 "[ . 1 . 2]" 1
448 1 40 LEU HA 1 40 LEU HB2 2.319 . 2.991 3.020 3.017 3.022 0.031 5 0 "[ . 1 . 2]" 1
449 1 40 LEU HA 1 40 LEU HG 2.459 . 3.215 2.572 2.548 2.611 . 0 0 "[ . 1 . 2]" 1
450 1 101 LEU HA 1 101 LEU HB3 2.605 . 3.453 2.501 2.477 2.510 . 0 0 "[ . 1 . 2]" 1
451 1 11 LEU MD2 1 14 LEU MD1 2.262 . 2.901 2.451 2.393 2.520 . 0 0 "[ . 1 . 2]" 1
452 1 18 VAL MG1 1 108 LYS HG3 3.210 . 4.498 3.175 3.110 3.252 . 0 0 "[ . 1 . 2]" 1
453 1 38 VAL HB 1 39 LYS HA 3.664 . 5.342 4.647 4.352 4.774 . 0 0 "[ . 1 . 2]" 1
454 1 11 LEU HA 1 11 LEU MD1 3.822 . 5.648 3.783 3.762 3.812 . 0 0 "[ . 1 . 2]" 1
455 1 14 LEU HG 1 112 LEU MD1 2.964 . 4.063 3.266 3.127 3.334 . 0 0 "[ . 1 . 2]" 1
456 1 14 LEU HA 1 14 LEU HG 2.541 . 3.348 2.772 2.710 2.806 . 0 0 "[ . 1 . 2]" 1
457 1 101 LEU HA 1 104 LEU MD2 3.713 . 5.436 4.808 4.767 4.873 . 0 0 "[ . 1 . 2]" 1
458 1 15 LEU HA 1 62 LEU MD1 2.495 . 3.273 1.765 1.700 1.834 0.017 3 0 "[ . 1 . 2]" 1
459 1 106 LEU HA 1 109 ILE QG 2.218 . 2.833 1.950 1.910 1.992 . 0 0 "[ . 1 . 2]" 1
460 1 15 LEU HA 1 62 LEU HB2 3.460 . 4.956 4.174 4.075 4.347 . 0 0 "[ . 1 . 2]" 1
461 1 15 LEU HA 1 15 LEU HG 3.456 . 4.949 3.860 3.842 3.876 . 0 0 "[ . 1 . 2]" 1
462 1 15 LEU HA 1 15 LEU HB3 2.931 . 4.005 3.031 3.022 3.038 . 0 0 "[ . 1 . 2]" 1
463 1 19 LEU MD1 1 23 TRP HZ3 2.718 . 3.642 3.039 2.847 3.170 . 0 0 "[ . 1 . 2]" 1
464 1 19 LEU MD2 1 23 TRP HZ3 3.160 . 4.408 3.991 3.914 4.156 . 0 0 "[ . 1 . 2]" 1
465 1 19 LEU MD2 1 77 PHE HZ 3.121 . 4.339 1.512 1.462 1.571 0.441 3 0 "[ . 1 . 2]" 1
466 1 19 LEU MD1 1 77 PHE HZ 2.867 . 3.894 3.605 3.537 3.656 . 0 0 "[ . 1 . 2]" 1
467 1 19 LEU MD2 1 77 PHE HE2 2.878 . 3.913 2.847 2.799 2.906 . 0 0 "[ . 1 . 2]" 1
468 1 19 LEU MD2 1 23 TRP HE3 2.658 . 3.541 3.418 3.378 3.464 . 0 0 "[ . 1 . 2]" 1
469 1 19 LEU MD1 1 58 ILE MG 2.981 . 4.092 3.715 3.691 3.742 . 0 0 "[ . 1 . 2]" 1
470 1 19 LEU MD1 1 59 LYS HB2 3.013 . 4.148 2.441 2.334 2.535 . 0 0 "[ . 1 . 2]" 1
471 1 19 LEU MD2 1 59 LYS HB2 3.438 . 4.915 3.482 3.375 3.550 . 0 0 "[ . 1 . 2]" 1
472 1 19 LEU MD1 1 59 LYS HB3 3.054 . 4.220 1.599 1.441 2.024 0.447 17 0 "[ . 1 . 2]" 1
473 1 19 LEU MD2 1 59 LYS HB3 2.884 . 3.924 2.474 2.326 2.739 . 0 0 "[ . 1 . 2]" 1
474 1 19 LEU MD2 1 19 LEU HG 2.298 . 2.958 2.084 2.077 2.089 . 0 0 "[ . 1 . 2]" 1
475 1 19 LEU MD2 1 55 MET HB3 3.155 . 4.399 3.290 3.172 3.360 . 0 0 "[ . 1 . 2]" 1
476 1 19 LEU MD1 1 55 MET HB3 2.792 . 3.766 2.814 2.671 2.876 . 0 0 "[ . 1 . 2]" 1
477 1 19 LEU HB3 1 19 LEU MD2 2.792 . 3.767 3.153 3.145 3.158 . 0 0 "[ . 1 . 2]" 1
478 1 19 LEU MD2 1 23 TRP HA 3.737 . 5.483 5.370 5.269 5.428 . 0 0 "[ . 1 . 2]" 1
479 1 19 LEU MD1 1 59 LYS HA 2.952 . 4.041 3.226 3.141 3.300 . 0 0 "[ . 1 . 2]" 1
480 1 19 LEU MD2 1 59 LYS HA 2.737 . 3.673 2.163 2.052 2.216 . 0 0 "[ . 1 . 2]" 1
481 1 19 LEU MD1 1 55 MET HA 2.956 . 4.049 3.952 3.906 3.978 . 0 0 "[ . 1 . 2]" 1
482 1 19 LEU MD1 1 20 LYS HA 3.631 . 5.279 3.010 2.829 3.171 . 0 0 "[ . 1 . 2]" 1
483 1 19 LEU MD1 1 56 GLY HA3 4.099 . 6.200 5.770 5.655 6.127 . 0 0 "[ . 1 . 2]" 1
484 1 15 LEU HA 1 19 LEU MD2 3.256 . 4.581 3.335 3.265 3.391 . 0 0 "[ . 1 . 2]" 1
485 1 15 LEU HA 1 19 LEU MD1 4.249 . 6.505 4.150 4.085 4.241 . 0 0 "[ . 1 . 2]" 1
486 1 22 LEU HA 1 22 LEU HB3 2.328 . 3.005 2.554 2.546 2.568 . 0 0 "[ . 1 . 2]" 1
487 1 22 LEU HG 1 101 LEU MD2 3.944 . 5.888 3.808 3.748 3.935 . 0 0 "[ . 1 . 2]" 1
488 1 22 LEU HG 1 101 LEU MD1 4.041 . 6.083 5.432 5.399 5.496 . 0 0 "[ . 1 . 2]" 1
489 1 12 GLN QG 1 15 LEU MD1 3.464 . 4.964 3.636 3.506 3.743 . 0 0 "[ . 1 . 2]" 1
490 1 22 LEU MD1 1 105 PHE HB2 2.702 . 3.615 1.394 1.357 1.424 0.432 3 0 "[ . 1 . 2]" 1
491 1 22 LEU MD1 1 105 PHE HB3 3.392 . 4.831 3.027 3.002 3.055 . 0 0 "[ . 1 . 2]" 1
492 1 22 LEU MD1 1 77 PHE HD2 3.598 . 5.217 2.756 2.613 2.821 . 0 0 "[ . 1 . 2]" 1
493 1 22 LEU MD1 1 105 PHE HA 2.927 . 3.998 2.486 2.441 2.534 . 0 0 "[ . 1 . 2]" 1
494 1 62 LEU HA 1 67 TYR HE2 3.127 . 4.349 3.361 3.167 3.498 . 0 0 "[ . 1 . 2]" 1
495 1 11 LEU MD2 1 62 LEU HA 3.360 . 4.771 3.306 3.187 3.423 . 0 0 "[ . 1 . 2]" 1
496 1 59 LYS HA 1 62 LEU HB3 3.365 . 4.781 3.960 3.815 4.093 . 0 0 "[ . 1 . 2]" 1
497 1 58 ILE MG 1 62 LEU HG 3.625 . 5.268 2.993 2.863 3.126 . 0 0 "[ . 1 . 2]" 1
498 1 58 ILE MG 1 62 LEU MD1 2.446 . 3.194 2.456 2.358 2.538 . 0 0 "[ . 1 . 2]" 1
499 1 3 LYS HD2 1 3 LYS HG2 2.386 . 3.098 2.887 2.449 3.020 . 0 0 "[ . 1 . 2]" 1
500 1 91 GLY HA2 1 96 LEU MD1 3.140 . 4.373 2.993 2.939 3.068 . 0 0 "[ . 1 . 2]" 1
501 1 81 PHE HZ 1 101 LEU MD2 3.365 . 4.781 4.058 3.960 4.184 . 0 0 "[ . 1 . 2]" 1
502 1 81 PHE HE1 1 101 LEU MD2 3.291 . 4.645 3.869 3.787 4.029 . 0 0 "[ . 1 . 2]" 1
503 1 25 HIS HD2 1 101 LEU MD2 3.066 . 4.241 3.058 2.992 3.130 . 0 0 "[ . 1 . 2]" 1
504 1 31 PHE HE1 1 101 LEU MD2 3.676 . 5.365 4.560 4.529 4.589 . 0 0 "[ . 1 . 2]" 1
505 1 27 PHE QD 1 101 LEU MD2 3.928 . 5.857 3.274 3.199 3.402 . 0 0 "[ . 1 . 2]" 1
506 1 22 LEU HA 1 101 LEU MD2 3.067 . 4.243 2.713 2.629 2.812 . 0 0 "[ . 1 . 2]" 1
507 1 101 LEU HA 1 101 LEU MD2 2.485 . 3.257 1.986 1.974 2.020 . 0 0 "[ . 1 . 2]" 1
508 1 27 PHE HB2 1 101 LEU MD2 3.028 . 4.174 2.282 2.181 2.455 . 0 0 "[ . 1 . 2]" 1
509 1 22 LEU HB2 1 101 LEU MD2 3.369 . 4.788 4.357 4.295 4.453 . 0 0 "[ . 1 . 2]" 1
510 1 55 MET ME 1 101 LEU MD2 2.698 . 3.608 2.219 2.162 2.265 . 0 0 "[ . 1 . 2]" 1
511 1 101 LEU MD2 1 101 LEU HG 2.374 . 3.079 2.115 2.113 2.117 . 0 0 "[ . 1 . 2]" 1
512 1 28 ALA MB 1 101 LEU MD2 2.899 . 3.949 2.818 2.752 2.870 . 0 0 "[ . 1 . 2]" 1
513 1 22 LEU MD2 1 101 LEU MD2 2.523 . 3.319 1.925 1.880 2.028 . 0 0 "[ . 1 . 2]" 1
514 1 101 LEU HA 1 104 LEU HB2 3.518 . 5.065 3.117 3.065 3.201 . 0 0 "[ . 1 . 2]" 1
515 1 104 LEU HB3 1 104 LEU HG 2.529 . 3.328 2.638 2.628 2.644 . 0 0 "[ . 1 . 2]" 1
516 1 104 LEU MD2 1 104 LEU HG 2.371 . 3.074 2.131 2.129 2.134 . 0 0 "[ . 1 . 2]" 1
517 1 104 LEU HB3 1 104 LEU MD2 2.638 . 3.508 3.135 3.126 3.148 . 0 0 "[ . 1 . 2]" 1
518 1 104 LEU MD2 1 108 LYS HG3 2.946 . 4.031 3.805 3.783 3.833 . 0 0 "[ . 1 . 2]" 1
519 1 104 LEU HB2 1 104 LEU MD2 2.657 . 3.540 2.647 2.639 2.656 . 0 0 "[ . 1 . 2]" 1
520 1 106 LEU HB3 1 106 LEU MD2 2.458 . 3.213 2.228 2.212 2.242 . 0 0 "[ . 1 . 2]" 1
521 1 106 LEU HA 1 106 LEU HB3 2.872 . 3.903 2.521 2.511 2.534 . 0 0 "[ . 1 . 2]" 1
522 1 105 PHE HD2 1 106 LEU MD1 3.061 . 4.232 3.111 3.053 3.194 . 0 0 "[ . 1 . 2]" 1
523 1 106 LEU HB3 1 106 LEU MD1 2.610 . 3.462 2.509 2.490 2.532 . 0 0 "[ . 1 . 2]" 1
524 1 106 LEU MD1 1 106 LEU HG 2.352 . 3.043 2.115 2.111 2.120 . 0 0 "[ . 1 . 2]" 1
525 1 103 LYS HA 1 106 LEU MD1 2.717 . 3.640 3.368 3.327 3.405 . 0 0 "[ . 1 . 2]" 1
526 1 105 PHE HE2 1 106 LEU MD2 2.779 . 3.744 2.213 2.161 2.250 . 0 0 "[ . 1 . 2]" 1
527 1 106 LEU HA 1 106 LEU MD2 2.302 . 2.964 2.163 2.130 2.207 . 0 0 "[ . 1 . 2]" 1
528 1 106 LEU MD2 1 106 LEU HG 2.413 . 3.141 2.125 2.122 2.128 . 0 0 "[ . 1 . 2]" 1
529 1 112 LEU HB3 1 112 LEU MD2 2.580 . 3.412 2.533 2.514 2.558 . 0 0 "[ . 1 . 2]" 1
530 1 112 LEU HB3 1 112 LEU MD1 2.905 . 3.960 3.129 3.117 3.138 . 0 0 "[ . 1 . 2]" 1
531 1 112 LEU HB2 1 112 LEU MD2 2.290 . 2.945 2.155 2.144 2.171 . 0 0 "[ . 1 . 2]" 1
532 1 112 LEU HB3 1 112 LEU HG 2.777 . 3.741 2.325 2.311 2.336 . 0 0 "[ . 1 . 2]" 1
533 1 10 GLN HG2 1 112 LEU HB3 4.449 . 6.923 4.127 3.931 4.349 . 0 0 "[ . 1 . 2]" 1
534 1 10 GLN HG2 1 112 LEU HB2 4.295 . 6.601 4.677 4.387 4.912 . 0 0 "[ . 1 . 2]" 1
535 1 112 LEU HB2 1 113 PRO HD3 3.279 . 4.623 4.482 4.416 4.557 . 0 0 "[ . 1 . 2]" 1
536 1 112 LEU HB3 1 113 PRO HD3 3.679 . 5.371 4.862 4.815 4.909 . 0 0 "[ . 1 . 2]" 1
537 1 112 LEU HA 1 112 LEU HB2 2.499 . 3.280 2.427 2.412 2.442 . 0 0 "[ . 1 . 2]" 1
538 1 13 TYR HE1 1 112 LEU HB3 3.573 . 5.169 5.115 4.943 5.181 0.012 18 0 "[ . 1 . 2]" 1
539 1 109 ILE HA 1 112 LEU HG 3.193 . 4.468 4.429 4.356 4.484 0.016 18 0 "[ . 1 . 2]" 1
540 1 112 LEU MD2 1 112 LEU HG 2.295 . 2.953 2.099 2.095 2.102 . 0 0 "[ . 1 . 2]" 1
541 1 101 LEU MD1 1 101 LEU HG 3.041 . 4.197 2.116 2.114 2.120 . 0 0 "[ . 1 . 2]" 1
542 1 74 ILE HA 1 109 ILE MD 3.861 . 5.724 4.207 4.154 4.244 . 0 0 "[ . 1 . 2]" 1
543 1 21 THR HA 1 104 LEU MD1 4.200 . 6.406 3.963 3.916 4.015 . 0 0 "[ . 1 . 2]" 1
544 1 82 THR HA 1 85 TYR HB3 2.719 . 3.643 3.809 3.758 3.851 0.208 19 0 "[ . 1 . 2]" 1
545 1 82 THR HA 1 85 TYR HB2 2.317 . 2.988 2.271 2.188 2.353 . 0 0 "[ . 1 . 2]" 1
546 1 53 MET HB3 1 79 THR HB 3.976 . 5.952 3.596 3.340 3.751 . 0 0 "[ . 1 . 2]" 1
547 1 53 MET ME 1 79 THR HB 2.899 . 3.949 3.739 3.675 3.837 . 0 0 "[ . 1 . 2]" 1
548 1 21 THR HB 1 21 THR MG 1.938 . 2.408 2.070 2.066 2.074 . 0 0 "[ . 1 . 2]" 1
549 1 21 THR HB 1 104 LEU MD1 2.663 . 3.549 2.968 2.916 3.030 . 0 0 "[ . 1 . 2]" 1
550 1 82 THR HB 1 86 ILE MD 3.367 . 4.784 3.215 3.109 3.304 . 0 0 "[ . 1 . 2]" 1
551 1 18 VAL MG1 1 21 THR HB 3.177 . 4.439 4.061 4.012 4.148 . 0 0 "[ . 1 . 2]" 1
552 1 21 THR MG 1 25 HIS HD2 2.827 . 3.826 3.183 3.099 3.308 . 0 0 "[ . 1 . 2]" 1
553 1 21 THR MG 1 108 LYS HE3 2.156 . 2.737 1.711 1.668 1.838 . 0 0 "[ . 1 . 2]" 1
554 1 21 THR MG 1 108 LYS HE2 2.244 . 2.873 2.493 2.430 2.581 . 0 0 "[ . 1 . 2]" 1
555 1 21 THR MG 1 104 LEU MD1 1.760 . 2.147 1.520 1.452 1.582 . 0 0 "[ . 1 . 2]" 1
556 1 51 THR HA 1 52 PRO HG3 3.483 . 4.999 4.416 4.291 4.513 . 0 0 "[ . 1 . 2]" 1
557 1 51 THR HA 1 52 PRO HG2 3.256 . 4.581 4.489 4.438 4.538 . 0 0 "[ . 1 . 2]" 1
558 1 31 PHE HA 1 31 PHE HB2 2.563 . 3.384 3.023 3.021 3.027 . 0 0 "[ . 1 . 2]" 1
559 1 51 THR HA 1 52 PRO HD3 2.115 . 2.674 2.271 2.129 2.392 . 0 0 "[ . 1 . 2]" 1
560 1 51 THR HA 1 51 THR HB 1.980 . 2.470 2.378 2.361 2.395 . 0 0 "[ . 1 . 2]" 1
561 1 51 THR HB 1 52 PRO HD2 3.264 . 4.596 4.642 4.574 4.678 0.082 16 0 "[ . 1 . 2]" 1
562 1 51 THR MG 1 53 MET HB3 2.994 . 4.114 4.064 4.013 4.101 . 0 0 "[ . 1 . 2]" 1
563 1 50 LYS HB3 1 51 THR MG 2.824 . 3.821 2.674 2.575 2.835 . 0 0 "[ . 1 . 2]" 1
564 1 50 LYS HB2 1 51 THR MG 3.165 . 4.417 2.802 2.699 2.976 . 0 0 "[ . 1 . 2]" 1
565 1 57 THR HA 1 60 LYS QE 3.418 . 4.879 4.120 2.364 4.761 . 0 0 "[ . 1 . 2]" 1
566 1 78 ASN QB 1 79 THR HA 3.367 . 4.784 4.025 3.919 4.159 . 0 0 "[ . 1 . 2]" 1
567 1 21 THR HB 1 108 LYS HE2 3.258 . 4.585 4.147 4.091 4.201 . 0 0 "[ . 1 . 2]" 1
568 1 79 THR MG 1 80 MET H 3.061 . 4.232 2.971 2.822 3.137 . 0 0 "[ . 1 . 2]" 1
569 1 79 THR MG 1 80 MET HA 2.842 . 3.851 3.084 2.950 3.227 . 0 0 "[ . 1 . 2]" 1
570 1 53 MET HG3 1 79 THR MG 3.729 . 5.467 3.496 3.318 3.557 . 0 0 "[ . 1 . 2]" 1
571 1 82 THR HA 1 82 THR HB 2.268 . 2.911 3.013 3.011 3.017 0.106 1 0 "[ . 1 . 2]" 1
572 1 21 THR HB 1 108 LYS HG3 3.223 . 4.521 3.066 3.011 3.144 . 0 0 "[ . 1 . 2]" 1
573 1 21 THR HB 1 108 LYS HD2 3.089 . 4.282 4.386 4.371 4.406 0.124 19 0 "[ . 1 . 2]" 1
574 1 21 THR HB 1 108 LYS HD3 3.632 . 5.281 5.333 5.309 5.353 0.072 13 0 "[ . 1 . 2]" 1
575 1 82 THR MG 1 85 TYR HB3 3.251 . 4.572 4.037 3.946 4.113 . 0 0 "[ . 1 . 2]" 1
576 1 13 TYR HA 1 17 VAL MG2 3.532 . 5.092 4.624 4.609 4.641 . 0 0 "[ . 1 . 2]" 1
577 1 27 PHE HA 1 97 MET ME 2.373 . 3.077 2.965 1.870 3.087 0.010 11 0 "[ . 1 . 2]" 1
578 1 10 GLN HA 1 112 LEU MD2 2.893 . 3.939 3.595 3.541 3.653 . 0 0 "[ . 1 . 2]" 1
579 1 10 GLN HA 1 112 LEU MD1 3.355 . 4.762 1.699 1.615 1.783 0.333 20 0 "[ . 1 . 2]" 1
580 1 81 PHE HZ 1 105 PHE HB3 3.582 . 5.186 3.023 2.909 3.162 . 0 0 "[ . 1 . 2]" 1
581 1 81 PHE HZ 1 105 PHE HB2 3.407 . 4.858 2.961 2.791 3.059 . 0 0 "[ . 1 . 2]" 1
582 1 81 PHE HE2 1 105 PHE HB3 3.863 . 5.728 2.314 2.222 2.415 . 0 0 "[ . 1 . 2]" 1
583 1 81 PHE HE2 1 105 PHE HB2 3.338 . 4.731 3.175 3.041 3.246 . 0 0 "[ . 1 . 2]" 1
584 1 13 TYR HA 1 16 ARG HB2 3.344 . 4.742 2.664 2.528 2.880 . 0 0 "[ . 1 . 2]" 1
585 1 13 TYR HB3 1 113 PRO HG3 3.268 . 4.603 4.674 4.646 4.722 0.119 6 0 "[ . 1 . 2]" 1
586 1 13 TYR HB3 1 112 LEU MD2 3.193 . 4.468 3.708 3.662 3.753 . 0 0 "[ . 1 . 2]" 1
587 1 66 TYR HB3 1 66 TYR HE1 3.623 . 5.264 4.626 4.609 4.642 . 0 0 "[ . 1 . 2]" 1
588 1 61 ARG HA 1 66 TYR HB2 2.704 . 3.618 3.038 2.781 3.364 . 0 0 "[ . 1 . 2]" 1
589 1 67 TYR HA 1 67 TYR HE1 3.143 . 4.378 4.454 4.412 4.493 0.115 12 0 "[ . 1 . 2]" 1
590 1 67 TYR HA 1 67 TYR HD1 2.857 . 3.877 2.084 2.023 2.140 . 0 0 "[ . 1 . 2]" 1
591 1 67 TYR HA 1 72 GLU HB3 3.441 . 4.921 3.738 3.398 4.126 . 0 0 "[ . 1 . 2]" 1
592 1 11 LEU MD2 1 67 TYR HA 3.871 . 5.744 4.024 3.973 4.055 . 0 0 "[ . 1 . 2]" 1
593 1 23 TRP QB 1 24 LYS HB2 3.768 . 5.543 4.183 4.037 5.054 . 0 0 "[ . 1 . 2]" 1
594 1 23 TRP QB 1 24 LYS HG2 3.884 . 5.770 3.720 3.545 3.933 . 0 0 "[ . 1 . 2]" 1
595 1 23 TRP QB 1 24 LYS HG3 3.820 . 5.644 2.623 2.347 4.144 . 0 0 "[ . 1 . 2]" 1
596 1 19 LEU MD1 1 23 TRP QB 3.313 . 4.685 2.517 2.407 2.615 . 0 0 "[ . 1 . 2]" 1
597 1 19 LEU MD2 1 23 TRP QB 3.424 . 4.890 4.252 4.025 4.356 . 0 0 "[ . 1 . 2]" 1
598 1 29 TRP HA 1 32 GLN HG2 3.048 . 4.209 4.203 2.569 4.357 0.148 12 0 "[ . 1 . 2]" 1
599 1 29 TRP HB3 1 29 TRP HE3 3.043 . 4.201 4.155 4.136 4.171 . 0 0 "[ . 1 . 2]" 1
600 1 29 TRP HB2 1 29 TRP HE3 2.531 . 3.332 2.647 2.618 2.673 . 0 0 "[ . 1 . 2]" 1
601 1 34 PRO HA 1 54 ASP HB2 2.559 . 3.377 3.172 2.058 3.483 0.106 15 0 "[ . 1 . 2]" 1
602 1 36 ASP QB 1 39 LYS HB3 2.814 . 3.080 2.810 2.623 2.960 . 0 0 "[ . 1 . 2]" 1
603 1 34 PRO HA 1 34 PRO HG3 2.814 . 3.804 3.875 3.522 3.950 0.146 5 0 "[ . 1 . 2]" 1
604 1 42 LEU HA 1 43 PRO HD3 2.316 . 2.987 2.067 2.002 2.828 . 0 0 "[ . 1 . 2]" 1
605 1 42 LEU MD2 1 43 PRO HD3 2.786 . 3.756 3.726 3.671 4.402 0.646 10 1 "[ . + . 2]" 1
606 1 43 PRO HD3 1 43 PRO HG3 2.628 . 3.491 2.321 2.313 2.353 . 0 0 "[ . 1 . 2]" 1
607 1 34 PRO QD 1 34 PRO HG3 2.486 . 3.259 2.182 2.177 2.215 . 0 0 "[ . 1 . 2]" 1
608 1 52 PRO HA 1 52 PRO HD3 3.170 . 4.426 3.621 3.570 3.713 . 0 0 "[ . 1 . 2]" 1
609 1 52 PRO HA 1 52 PRO HD2 3.118 . 4.333 3.881 3.870 3.889 . 0 0 "[ . 1 . 2]" 1
610 1 109 ILE HA 1 112 LEU MD2 2.759 . 3.711 2.790 2.738 2.854 . 0 0 "[ . 1 . 2]" 1
611 1 33 GLN HG2 1 34 PRO QD 2.747 . 3.690 2.867 2.086 3.521 . 0 0 "[ . 1 . 2]" 1
612 1 49 ILE MG 1 52 PRO HG2 2.955 . 4.047 3.469 3.442 3.519 . 0 0 "[ . 1 . 2]" 1
613 1 49 ILE MG 1 52 PRO HG3 2.737 . 3.673 2.116 2.096 2.137 . 0 0 "[ . 1 . 2]" 1
614 1 52 PRO HD2 1 52 PRO HG3 2.494 . 3.272 3.001 2.997 3.011 . 0 0 "[ . 1 . 2]" 1
615 1 90 PRO HA 1 95 VAL MG2 2.628 . 3.492 1.758 1.678 1.809 0.086 19 0 "[ . 1 . 2]" 1
616 1 90 PRO HA 1 95 VAL MG1 3.225 . 4.525 2.550 2.396 2.725 . 0 0 "[ . 1 . 2]" 1
617 1 90 PRO HA 1 90 PRO HG2 2.681 . 3.580 3.779 3.742 3.808 0.228 12 0 "[ . 1 . 2]" 1
618 1 90 PRO HA 1 90 PRO QD 3.030 . 4.178 3.319 3.261 3.353 . 0 0 "[ . 1 . 2]" 1
619 1 90 PRO HB3 1 90 PRO QD 2.641 . 3.513 3.480 3.469 3.489 . 0 0 "[ . 1 . 2]" 1
620 1 90 PRO HB2 1 90 PRO QD 2.328 . 3.005 2.654 2.629 2.695 . 0 0 "[ . 1 . 2]" 1
621 1 90 PRO HA 1 90 PRO HB2 2.391 . 3.106 2.988 2.979 2.992 . 0 0 "[ . 1 . 2]" 1
622 1 49 ILE MD 1 87 TYR HA 3.665 . 5.344 3.173 2.860 3.251 . 0 0 "[ . 1 . 2]" 1
623 1 84 CYS HA 1 84 CYS HB2 2.498 . 3.278 2.992 2.458 3.024 . 0 0 "[ . 1 . 2]" 1
624 1 113 PRO HA 1 113 PRO HD3 2.574 . 3.402 3.449 3.338 3.480 0.078 6 0 "[ . 1 . 2]" 1
625 1 113 PRO HB2 1 113 PRO HD3 2.882 . 3.920 3.894 3.879 3.904 . 0 0 "[ . 1 . 2]" 1
626 1 113 PRO HA 1 113 PRO HB3 1.959 . 2.439 2.282 2.272 2.295 . 0 0 "[ . 1 . 2]" 1
627 1 60 LYS H 1 60 LYS HB2 2.664 . 3.551 2.374 2.075 2.641 . 0 0 "[ . 1 . 2]" 1
628 1 13 TYR HE1 1 113 PRO HD3 3.243 . 4.557 4.463 4.363 4.580 0.023 16 0 "[ . 1 . 2]" 1
629 1 13 TYR HD1 1 113 PRO HD2 2.846 . 3.858 3.377 3.341 3.445 . 0 0 "[ . 1 . 2]" 1
630 1 113 PRO HA 1 113 PRO HD2 3.771 . 5.549 3.955 3.931 3.970 . 0 0 "[ . 1 . 2]" 1
631 1 10 GLN HA 1 113 PRO HD2 3.173 . 4.432 2.959 2.913 3.002 . 0 0 "[ . 1 . 2]" 1
632 1 13 TYR HB3 1 113 PRO HD3 3.415 . 4.873 4.058 4.006 4.151 . 0 0 "[ . 1 . 2]" 1
633 1 13 TYR HB2 1 113 PRO HD3 3.127 . 4.349 3.583 3.515 3.715 . 0 0 "[ . 1 . 2]" 1
634 1 113 PRO HB3 1 113 PRO HD2 3.281 . 4.627 4.020 4.010 4.034 . 0 0 "[ . 1 . 2]" 1
635 1 113 PRO HB3 1 113 PRO HD3 2.922 . 3.989 3.897 3.867 3.918 . 0 0 "[ . 1 . 2]" 1
636 1 113 PRO HD3 1 113 PRO HG3 2.266 . 2.908 2.237 2.228 2.242 . 0 0 "[ . 1 . 2]" 1
637 1 113 PRO HD2 1 113 PRO HG2 2.169 . 2.757 2.269 2.256 2.276 . 0 0 "[ . 1 . 2]" 1
638 1 113 PRO HD2 1 113 PRO HG3 2.290 . 2.945 2.932 2.918 2.941 . 0 0 "[ . 1 . 2]" 1
639 1 112 LEU HB3 1 113 PRO HD2 3.486 . 5.005 4.309 4.248 4.354 . 0 0 "[ . 1 . 2]" 1
640 1 112 LEU HB2 1 113 PRO HD2 3.131 . 4.356 3.862 3.795 3.895 . 0 0 "[ . 1 . 2]" 1
641 1 112 LEU MD2 1 113 PRO HD2 2.902 . 3.954 3.828 3.815 3.842 . 0 0 "[ . 1 . 2]" 1
642 1 112 LEU MD1 1 113 PRO HD3 2.683 . 3.583 2.755 2.703 2.804 . 0 0 "[ . 1 . 2]" 1
643 1 22 LEU MD2 1 25 HIS HB2 3.138 . 4.369 3.915 3.871 3.990 . 0 0 "[ . 1 . 2]" 1
644 1 4 PRO HA 1 4 PRO HB2 2.588 . 3.425 2.871 2.720 2.982 . 0 0 "[ . 1 . 2]" 1
645 1 34 PRO HA 1 34 PRO QD 2.992 . 4.111 3.505 3.481 3.529 . 0 0 "[ . 1 . 2]" 1
646 1 52 PRO HD2 1 52 PRO HG2 2.544 . 3.353 2.344 2.335 2.362 . 0 0 "[ . 1 . 2]" 1
647 1 11 LEU MD1 1 69 ASN HA 2.832 . 3.834 2.224 2.152 2.306 . 0 0 "[ . 1 . 2]" 1
648 1 11 LEU MD2 1 69 ASN HA 3.363 . 4.776 3.546 3.462 3.606 . 0 0 "[ . 1 . 2]" 1
649 1 7 GLN HB3 1 69 ASN HA 2.677 . 3.573 3.656 2.289 4.050 0.477 18 0 "[ . 1 . 2]" 1
650 1 7 GLN HB2 1 69 ASN HA 2.946 . 4.031 2.152 1.749 3.838 0.112 16 0 "[ . 1 . 2]" 1
651 1 7 GLN QG 1 69 ASN HA 3.580 . 3.941 3.326 2.503 3.898 . 0 0 "[ . 1 . 2]" 1
652 1 69 ASN HA 1 69 ASN QB 2.085 . 2.628 2.339 2.187 2.397 . 0 0 "[ . 1 . 2]" 1
653 1 65 ASN HA 1 65 ASN HB3 1.869 . 2.306 2.398 2.361 2.448 0.142 1 0 "[ . 1 . 2]" 1
654 1 65 ASN HA 1 65 ASN HB2 2.020 . 2.530 2.456 2.389 2.506 . 0 0 "[ . 1 . 2]" 1
655 1 92 ASP HA 1 92 ASP HB2 1.974 . 2.461 2.520 2.500 2.566 0.105 9 0 "[ . 1 . 2]" 1
656 1 92 ASP HA 1 94 ILE MG 3.275 . 4.615 4.529 4.443 4.571 . 0 0 "[ . 1 . 2]" 1
657 1 41 ASN HA 1 42 LEU MD2 3.307 . 4.674 4.386 4.360 4.422 . 0 0 "[ . 1 . 2]" 1
658 1 80 MET HA 1 80 MET HG3 2.829 . 3.830 2.570 2.349 3.289 . 0 0 "[ . 1 . 2]" 1
659 1 10 GLN HG3 1 112 LEU MD2 3.995 . 5.990 4.109 3.960 4.276 . 0 0 "[ . 1 . 2]" 1
660 1 10 GLN HG2 1 112 LEU MD2 3.145 . 4.381 2.811 2.662 3.002 . 0 0 "[ . 1 . 2]" 1
661 1 10 GLN HG2 1 112 LEU MD1 2.964 . 4.062 2.189 1.876 2.477 . 0 0 "[ . 1 . 2]" 1
662 1 55 MET HB3 1 55 MET HG2 2.022 . 2.533 2.298 2.284 2.308 . 0 0 "[ . 1 . 2]" 1
663 1 32 GLN HA 1 55 MET HB3 2.191 . 2.791 2.950 2.844 3.007 0.216 18 0 "[ . 1 . 2]" 1
664 1 23 TRP HE3 1 55 MET HB3 2.499 . 3.280 1.948 1.830 2.108 . 0 0 "[ . 1 . 2]" 1
665 1 10 GLN HG3 1 70 ALA MB 3.382 . 4.812 4.032 3.909 4.144 . 0 0 "[ . 1 . 2]" 1
666 1 10 GLN HG2 1 70 ALA MB 3.005 . 4.134 3.320 3.209 3.441 . 0 0 "[ . 1 . 2]" 1
667 1 10 GLN HB2 1 10 GLN HG2 2.604 . 3.451 2.900 2.813 2.968 . 0 0 "[ . 1 . 2]" 1
668 1 10 GLN HA 1 10 GLN HG2 2.259 . 2.897 2.868 2.588 3.075 0.178 6 0 "[ . 1 . 2]" 1
669 1 55 MET HA 1 55 MET HG3 2.807 . 3.792 2.651 2.599 2.693 . 0 0 "[ . 1 . 2]" 1
670 1 31 PHE HB3 1 55 MET HG2 3.126 . 4.348 4.030 3.946 4.218 . 0 0 "[ . 1 . 2]" 1
671 1 55 MET HA 1 55 MET HG2 2.918 . 3.983 2.802 2.775 2.840 . 0 0 "[ . 1 . 2]" 1
672 1 19 LEU MD2 1 55 MET HG2 2.733 . 3.666 3.279 3.161 3.382 . 0 0 "[ . 1 . 2]" 1
673 1 19 LEU MD1 1 55 MET HG2 3.975 . 5.950 3.542 3.393 3.648 . 0 0 "[ . 1 . 2]" 1
674 1 19 LEU MD1 1 55 MET HG3 3.735 . 5.479 4.874 4.765 4.961 . 0 0 "[ . 1 . 2]" 1
675 1 71 GLN HG3 1 74 ILE MD 3.322 . 4.702 3.115 2.959 3.340 . 0 0 "[ . 1 . 2]" 1
676 1 71 GLN HG2 1 74 ILE MD 3.019 . 4.158 3.964 3.841 4.067 . 0 0 "[ . 1 . 2]" 1
677 1 3 LYS HB2 1 4 PRO QD 3.187 . 4.457 3.957 3.684 4.221 . 0 0 "[ . 1 . 2]" 1
678 1 3 LYS HD2 1 4 PRO QD 3.930 . 5.861 4.399 1.949 5.737 0.050 20 0 "[ . 1 . 2]" 1
679 1 5 LYS HB2 1 5 LYS HE2 3.881 . 5.764 4.316 1.929 4.842 0.069 5 0 "[ . 1 . 2]" 1
680 1 5 LYS HB3 1 5 LYS HE2 3.462 . 4.960 4.248 2.054 4.846 . 0 0 "[ . 1 . 2]" 1
681 1 5 LYS HD2 1 5 LYS HE2 2.265 . 2.906 2.772 2.428 3.016 0.110 9 0 "[ . 1 . 2]" 1
682 1 6 ARG HB2 1 68 TRP HA 3.506 . 5.043 3.811 3.162 4.058 . 0 0 "[ . 1 . 2]" 1
683 1 6 ARG HB3 1 68 TRP HA 3.793 . 5.591 4.603 4.385 4.732 . 0 0 "[ . 1 . 2]" 1
684 1 6 ARG HA 1 6 ARG HB3 2.317 . 2.988 3.006 2.920 3.027 0.039 15 0 "[ . 1 . 2]" 1
685 1 6 ARG HA 1 6 ARG HB2 2.692 . 3.598 2.609 2.516 2.718 . 0 0 "[ . 1 . 2]" 1
686 1 6 ARG HB2 1 6 ARG HD2 2.957 . 4.050 3.598 3.225 3.679 . 0 0 "[ . 1 . 2]" 1
687 1 6 ARG HB2 1 6 ARG HD3 2.913 . 3.973 4.077 3.761 4.213 0.240 10 0 "[ . 1 . 2]" 1
688 1 6 ARG HB3 1 6 ARG HD3 2.946 . 4.031 3.414 2.835 3.630 . 0 0 "[ . 1 . 2]" 1
689 1 6 ARG HB3 1 6 ARG HD2 3.033 . 4.183 2.438 2.220 2.575 . 0 0 "[ . 1 . 2]" 1
690 1 6 ARG HG3 1 11 LEU MD1 2.892 . 3.937 3.815 3.371 3.979 0.042 4 0 "[ . 1 . 2]" 1
691 1 6 ARG HB2 1 6 ARG HG2 2.382 . 3.091 2.644 2.564 2.982 . 0 0 "[ . 1 . 2]" 1
692 1 6 ARG HB2 1 6 ARG HG3 2.709 . 3.626 2.268 2.230 2.310 . 0 0 "[ . 1 . 2]" 1
693 1 6 ARG HD3 1 6 ARG HG3 2.523 . 3.319 2.667 2.420 3.009 . 0 0 "[ . 1 . 2]" 1
694 1 6 ARG HA 1 6 ARG HG2 2.626 . 3.488 2.270 2.166 2.363 . 0 0 "[ . 1 . 2]" 1
695 1 6 ARG HA 1 6 ARG HG3 2.637 . 3.506 3.472 2.588 3.585 0.079 17 0 "[ . 1 . 2]" 1
696 1 6 ARG HG2 1 68 TRP HA 2.747 . 3.690 1.869 1.692 2.722 0.112 20 0 "[ . 1 . 2]" 1
697 1 6 ARG HG3 1 68 TRP HA 2.691 . 3.596 3.098 2.004 3.437 . 0 0 "[ . 1 . 2]" 1
698 1 7 GLN HA 1 7 GLN QG 2.854 . 3.335 2.620 2.220 3.107 . 0 0 "[ . 1 . 2]" 1
699 1 7 GLN HA 1 115 GLU QG 2.841 . 3.850 3.180 2.177 3.758 . 0 0 "[ . 1 . 2]" 1
700 1 9 ASN HA 1 9 ASN HB3 2.110 . 2.666 2.654 2.409 2.984 0.318 14 0 "[ . 1 . 2]" 1
701 1 9 ASN HA 1 12 GLN QG 3.209 . 3.566 3.629 3.561 3.690 0.124 5 0 "[ . 1 . 2]" 1
702 1 8 THR MG 1 9 ASN HA 3.447 . 4.933 3.470 3.337 3.638 . 0 0 "[ . 1 . 2]" 1
703 1 12 GLN HB2 1 16 ARG QD 3.739 . 5.487 5.309 5.059 5.396 . 0 0 "[ . 1 . 2]" 1
704 1 12 GLN HB3 1 16 ARG QD 3.258 . 4.584 4.385 4.040 4.522 . 0 0 "[ . 1 . 2]" 1
705 1 12 GLN HA 1 12 GLN HB3 2.287 . 2.941 2.861 2.803 2.886 . 0 0 "[ . 1 . 2]" 1
706 1 9 ASN HA 1 12 GLN HB2 2.143 . 2.717 1.950 1.850 2.227 . 0 0 "[ . 1 . 2]" 1
707 1 9 ASN HA 1 12 GLN HB3 2.488 . 3.262 3.041 2.907 3.192 . 0 0 "[ . 1 . 2]" 1
708 1 8 THR MG 1 12 GLN QG 3.124 . 3.355 2.493 2.355 2.648 . 0 0 "[ . 1 . 2]" 1
709 1 12 GLN HB3 1 12 GLN QG 2.143 . 2.470 2.324 2.105 2.373 . 0 0 "[ . 1 . 2]" 1
710 1 12 GLN QG 1 16 ARG QD 3.055 . 3.977 2.709 2.581 2.826 . 0 0 "[ . 1 . 2]" 1
711 1 12 GLN HA 1 12 GLN QG 2.319 . 2.743 2.246 2.197 2.655 . 0 0 "[ . 1 . 2]" 1
712 1 16 ARG HB2 1 16 ARG HG2 2.278 . 2.927 2.482 2.423 2.544 . 0 0 "[ . 1 . 2]" 1
713 1 16 ARG QD 1 16 ARG HG2 2.135 . 2.705 2.128 2.096 2.153 . 0 0 "[ . 1 . 2]" 1
714 1 16 ARG HA 1 16 ARG HG2 2.380 . 3.088 3.046 2.953 3.106 0.018 20 0 "[ . 1 . 2]" 1
715 1 15 LEU MD1 1 16 ARG QD 2.786 . 3.756 1.922 1.746 2.193 0.070 6 0 "[ . 1 . 2]" 1
716 1 15 LEU HG 1 16 ARG QD 3.178 . 4.440 4.102 3.922 4.379 . 0 0 "[ . 1 . 2]" 1
717 1 16 ARG QD 1 16 ARG HG3 2.066 . 2.599 2.354 2.117 2.461 . 0 0 "[ . 1 . 2]" 1
718 1 15 LEU MD1 1 16 ARG HB2 3.117 . 4.331 4.027 3.969 4.059 . 0 0 "[ . 1 . 2]" 1
719 1 20 LYS HA 1 20 LYS HG2 3.158 . 4.405 3.027 2.412 3.754 . 0 0 "[ . 1 . 2]" 1
720 1 109 ILE HB 1 110 ASN HA 3.647 . 5.309 4.147 4.070 4.221 . 0 0 "[ . 1 . 2]" 1
721 1 24 LYS HB3 1 24 LYS QE 3.329 . 4.714 3.126 2.473 4.116 . 0 0 "[ . 1 . 2]" 1
722 1 24 LYS HB2 1 24 LYS QE 3.844 . 5.691 2.401 1.761 3.893 0.236 8 0 "[ . 1 . 2]" 1
723 1 23 TRP HD1 1 24 LYS HG2 3.289 . 4.641 3.354 3.012 4.343 . 0 0 "[ . 1 . 2]" 1
724 1 24 LYS HA 1 24 LYS HG2 3.115 . 4.328 2.591 2.431 3.930 . 0 0 "[ . 1 . 2]" 1
725 1 24 LYS HA 1 24 LYS HG3 2.745 . 3.687 3.083 2.990 3.487 . 0 0 "[ . 1 . 2]" 1
726 1 21 THR HA 1 24 LYS HG3 3.778 . 5.562 4.148 2.875 4.388 . 0 0 "[ . 1 . 2]" 1
727 1 24 LYS QE 1 24 LYS HG2 3.066 . 4.241 3.226 2.443 3.442 . 0 0 "[ . 1 . 2]" 1
728 1 24 LYS HB2 1 24 LYS HG3 2.697 . 3.606 2.428 2.350 2.772 . 0 0 "[ . 1 . 2]" 1
729 1 24 LYS HB2 1 24 LYS HG2 2.663 . 3.550 2.984 2.832 2.996 . 0 0 "[ . 1 . 2]" 1
730 1 21 THR HA 1 24 LYS HD2 3.398 . 4.841 4.823 3.498 5.424 0.583 9 2 "[ . +- . 2]" 1
731 1 21 THR HA 1 24 LYS QE 2.784 . 3.753 2.644 2.122 3.797 0.044 20 0 "[ . 1 . 2]" 1
732 1 24 LYS QE 1 24 LYS HG3 2.308 . 2.974 2.426 2.260 2.536 . 0 0 "[ . 1 . 2]" 1
733 1 26 GLN QB 1 27 PHE QD 2.874 . 3.907 3.719 3.162 3.804 . 0 0 "[ . 1 . 2]" 1
734 1 15 LEU MD1 1 16 ARG HG3 2.746 . 3.688 3.655 3.583 3.679 . 0 0 "[ . 1 . 2]" 1
735 1 32 GLN HB3 1 32 GLN HG2 2.971 . 4.075 2.425 2.212 2.490 . 0 0 "[ . 1 . 2]" 1
736 1 75 GLN HB2 1 76 ASP H 2.964 . 4.062 4.193 4.130 4.231 0.169 17 0 "[ . 1 . 2]" 1
737 1 75 GLN HB3 1 76 ASP H 3.060 . 4.230 3.232 3.026 3.880 . 0 0 "[ . 1 . 2]" 1
738 1 39 LYS HB2 1 39 LYS HE3 4.305 . 6.621 4.644 4.504 4.746 . 0 0 "[ . 1 . 2]" 1
739 1 39 LYS HB3 1 39 LYS HE3 3.562 . 5.148 4.818 4.631 5.497 0.349 2 0 "[ . 1 . 2]" 1
740 1 39 LYS HE3 1 39 LYS HG3 2.375 . 3.080 2.602 2.367 3.663 0.583 2 2 "[ + . 1 .- 2]" 1
741 1 39 LYS HE3 1 39 LYS HG2 2.597 . 3.440 3.177 2.812 3.768 0.328 16 0 "[ . 1 . 2]" 1
742 1 39 LYS HA 1 39 LYS HE3 2.693 . 3.600 3.770 3.620 4.468 0.868 2 2 "[ + . 1 .- 2]" 1
743 1 44 ASP HA 1 47 LYS HG2 2.957 . 4.050 4.298 3.946 4.610 0.560 2 1 "[ + . 1 . 2]" 1
744 1 44 ASP HA 1 47 LYS HG3 3.222 . 4.519 3.455 2.658 4.208 . 0 0 "[ . 1 . 2]" 1
745 1 47 LYS QE 1 47 LYS HG2 2.501 . 3.283 2.910 2.391 3.423 0.140 8 0 "[ . 1 . 2]" 1
746 1 47 LYS HA 1 47 LYS QE 2.849 . 3.864 3.948 3.732 4.468 0.604 15 1 "[ . 1 + 2]" 1
747 1 44 ASP HA 1 47 LYS QE 2.862 . 3.886 2.995 1.824 3.799 0.014 2 0 "[ . 1 . 2]" 1
748 1 50 LYS HA 1 50 LYS HB2 2.431 . 3.170 3.014 3.009 3.023 . 0 0 "[ . 1 . 2]" 1
749 1 50 LYS HA 1 50 LYS HB3 2.417 . 3.147 2.521 2.498 2.551 . 0 0 "[ . 1 . 2]" 1
750 1 50 LYS HA 1 50 LYS QG 2.212 . 2.824 2.812 2.759 2.879 0.055 15 0 "[ . 1 . 2]" 1
751 1 50 LYS HA 1 50 LYS QD 2.310 . 2.977 1.896 1.741 2.145 . 0 0 "[ . 1 . 2]" 1
752 1 50 LYS HA 1 50 LYS HE2 2.731 . 3.663 3.965 3.220 4.407 0.744 4 8 "[ * +- ***1 *. * 2]" 1
753 1 56 GLY HA3 1 59 LYS QG 3.581 . 5.184 3.477 3.302 3.700 . 0 0 "[ . 1 . 2]" 1
754 1 59 LYS HA 1 59 LYS QD 3.700 . 4.587 4.000 3.630 4.410 . 0 0 "[ . 1 . 2]" 1
755 1 59 LYS QD 1 59 LYS HE2 2.241 . 2.869 2.296 2.168 2.397 . 0 0 "[ . 1 . 2]" 1
756 1 59 LYS HB2 1 59 LYS QD 3.116 . 4.059 2.655 2.190 2.868 . 0 0 "[ . 1 . 2]" 1
757 1 59 LYS QD 1 59 LYS QG 2.387 . 3.099 2.023 1.989 2.085 . 0 0 "[ . 1 . 2]" 1
758 1 59 LYS HE2 1 59 LYS QG 2.777 . 3.741 2.862 2.268 3.524 . 0 0 "[ . 1 . 2]" 1
759 1 60 LYS HA 1 60 LYS HB2 2.377 . 3.083 2.853 2.488 3.036 . 0 0 "[ . 1 . 2]" 1
760 1 57 THR MG 1 60 LYS HB2 3.033 . 4.183 3.576 3.260 4.037 . 0 0 "[ . 1 . 2]" 1
761 1 60 LYS HA 1 60 LYS HG2 2.912 . 3.972 3.529 3.274 3.780 . 0 0 "[ . 1 . 2]" 1
762 1 60 LYS HA 1 60 LYS HG3 2.800 . 3.780 3.171 2.274 3.810 0.030 11 0 "[ . 1 . 2]" 1
763 1 61 ARG HA 1 61 ARG HG2 2.947 . 4.032 2.690 2.456 3.324 . 0 0 "[ . 1 . 2]" 1
764 1 61 ARG HA 1 64 ASN HB3 2.880 . 3.917 2.872 2.127 4.379 0.462 9 0 "[ . 1 . 2]" 1
765 1 63 GLU HA 1 63 GLU HB2 2.212 . 2.824 2.939 2.919 2.955 0.131 6 0 "[ . 1 . 2]" 1
766 1 63 GLU HB3 1 63 GLU HG2 2.506 . 3.291 2.961 2.526 3.008 . 0 0 "[ . 1 . 2]" 1
767 1 64 ASN HA 1 64 ASN HB3 2.630 . 3.495 2.945 2.490 3.030 . 0 0 "[ . 1 . 2]" 1
768 1 71 GLN HB2 1 71 GLN HG2 2.214 . 2.827 2.988 2.981 2.995 0.168 17 0 "[ . 1 . 2]" 1
769 1 71 GLN HB3 1 71 GLN HG3 2.023 . 2.535 2.994 2.984 3.001 0.466 10 0 "[ . 1 . 2]" 1
770 1 71 GLN HA 1 71 GLN HG2 2.622 . 3.482 2.815 2.735 2.866 . 0 0 "[ . 1 . 2]" 1
771 1 67 TYR HE1 1 72 GLU HB3 2.648 . 3.524 3.447 2.880 3.631 0.107 2 0 "[ . 1 . 2]" 1
772 1 72 GLU HA 1 72 GLU HB3 2.191 . 2.791 2.489 2.411 2.524 . 0 0 "[ . 1 . 2]" 1
773 1 67 TYR HB3 1 72 GLU HB3 3.175 . 4.435 4.177 3.820 4.588 0.153 1 0 "[ . 1 . 2]" 1
774 1 72 GLU HA 1 72 GLU QG 2.210 . 2.820 2.390 2.291 2.500 . 0 0 "[ . 1 . 2]" 1
775 1 14 LEU MD1 1 73 CYS HA 3.670 . 5.353 3.909 3.862 4.026 . 0 0 "[ . 1 . 2]" 1
776 1 73 CYS HA 1 76 ASP HB3 3.314 . 4.687 4.086 3.979 4.191 . 0 0 "[ . 1 . 2]" 1
777 1 73 CYS HA 1 76 ASP HB2 2.969 . 4.071 2.467 2.370 2.577 . 0 0 "[ . 1 . 2]" 1
778 1 67 TYR HD2 1 73 CYS HA 3.182 . 4.448 4.280 4.121 4.410 . 0 0 "[ . 1 . 2]" 1
779 1 73 CYS HA 1 73 CYS HB2 2.431 . 3.170 2.443 2.399 2.609 . 0 0 "[ . 1 . 2]" 1
780 1 14 LEU MD1 1 73 CYS HB2 2.911 . 3.970 2.962 2.429 3.083 . 0 0 "[ . 1 . 2]" 1
781 1 11 LEU MD2 1 73 CYS HB2 2.946 . 4.031 2.397 2.225 2.473 . 0 0 "[ . 1 . 2]" 1
782 1 73 CYS HA 1 73 CYS HB3 2.535 . 3.338 3.026 2.999 3.034 . 0 0 "[ . 1 . 2]" 1
783 1 75 GLN HA 1 75 GLN QG 2.570 . 3.395 3.202 2.872 3.404 0.009 4 0 "[ . 1 . 2]" 1
784 1 75 GLN HA 1 75 GLN HB2 2.399 . 3.119 2.229 2.205 2.313 . 0 0 "[ . 1 . 2]" 1
785 1 75 GLN HB2 1 78 ASN QB 2.999 . 4.123 3.942 3.601 4.054 . 0 0 "[ . 1 . 2]" 1
786 1 72 GLU HA 1 75 GLN QG 2.596 . 3.438 2.880 1.826 3.484 0.046 3 0 "[ . 1 . 2]" 1
787 1 75 GLN HA 1 78 ASN QB 2.354 . 3.046 2.154 1.992 2.310 . 0 0 "[ . 1 . 2]" 1
788 1 74 ILE MG 1 78 ASN QB 2.928 . 3.999 2.883 2.807 3.054 . 0 0 "[ . 1 . 2]" 1
789 1 76 ASP HA 1 79 THR HB 2.544 . 3.353 1.901 1.841 1.957 . 0 0 "[ . 1 . 2]" 1
790 1 76 ASP HA 1 76 ASP HB2 2.504 . 3.288 3.010 2.999 3.016 . 0 0 "[ . 1 . 2]" 1
791 1 76 ASP HA 1 76 ASP HB3 2.651 . 3.530 2.614 2.596 2.634 . 0 0 "[ . 1 . 2]" 1
792 1 78 ASN HA 1 81 PHE HD2 2.325 . 3.001 2.820 2.664 3.011 0.010 13 0 "[ . 1 . 2]" 1
793 1 78 ASN HA 1 81 PHE HE2 3.490 . 5.012 4.433 4.192 4.646 . 0 0 "[ . 1 . 2]" 1
794 1 78 ASN HA 1 78 ASN QB 2.277 . 2.925 2.425 2.377 2.490 . 0 0 "[ . 1 . 2]" 1
795 1 78 ASN QB 1 81 PHE HD2 4.010 . 6.020 4.723 4.584 4.960 . 0 0 "[ . 1 . 2]" 1
796 1 83 ASN HA 1 83 ASN QB 2.672 . 3.538 2.265 2.172 2.319 . 0 0 "[ . 1 . 2]" 1
797 1 83 ASN HA 1 86 ILE HG12 3.219 . 4.514 4.151 4.075 4.241 . 0 0 "[ . 1 . 2]" 1
798 1 31 PHE HE2 1 84 CYS HB3 2.898 . 3.948 3.923 3.799 4.014 0.066 16 0 "[ . 1 . 2]" 1
799 1 31 PHE HE2 1 84 CYS HB2 2.986 . 4.100 3.309 2.594 3.506 . 0 0 "[ . 1 . 2]" 1
800 1 81 PHE HA 1 84 CYS HB3 2.880 . 3.917 4.049 3.217 4.112 0.195 12 0 "[ . 1 . 2]" 1
801 1 81 PHE HA 1 84 CYS HB2 2.690 . 3.595 2.657 2.554 3.585 . 0 0 "[ . 1 . 2]" 1
802 1 84 CYS HA 1 84 CYS HB3 2.600 . 3.445 2.543 2.499 3.028 . 0 0 "[ . 1 . 2]" 1
803 1 84 CYS HB2 1 98 ALA MB 3.860 . 5.722 2.663 2.576 2.877 . 0 0 "[ . 1 . 2]" 1
804 1 89 LYS QG 1 90 PRO QD 3.203 . 4.001 3.566 3.308 3.628 . 0 0 "[ . 1 . 2]" 1
805 1 89 LYS HA 1 89 LYS QG 2.404 . 3.126 2.525 2.301 3.215 0.089 12 0 "[ . 1 . 2]" 1
806 1 89 LYS QD 1 90 PRO QD 2.789 . 3.761 2.437 1.943 3.478 . 0 0 "[ . 1 . 2]" 1
807 1 89 LYS QD 1 89 LYS HE2 2.238 . 2.864 2.293 2.171 2.394 . 0 0 "[ . 1 . 2]" 1
808 1 93 ASP HA 1 93 ASP HB2 2.545 . 3.355 2.830 2.408 3.037 . 0 0 "[ . 1 . 2]" 1
809 1 87 TYR HB3 1 87 TYR HD2 2.497 . 3.276 2.375 2.355 2.384 . 0 0 "[ . 1 . 2]" 1
810 1 45 TYR HE2 1 87 TYR HB3 3.183 . 4.450 2.530 2.300 2.708 . 0 0 "[ . 1 . 2]" 1
811 1 49 ILE MD 1 87 TYR HB3 3.134 . 4.361 2.693 2.627 2.736 . 0 0 "[ . 1 . 2]" 1
812 1 49 ILE HG12 1 87 TYR HB3 3.559 . 5.142 4.587 4.515 4.864 . 0 0 "[ . 1 . 2]" 1
813 1 85 TYR HE1 1 99 GLU HG3 2.364 . 3.062 2.403 2.248 2.495 . 0 0 "[ . 1 . 2]" 1
814 1 85 TYR HE1 1 99 GLU HG2 2.779 . 3.744 2.274 2.176 2.424 . 0 0 "[ . 1 . 2]" 1
815 1 99 GLU HA 1 99 GLU HG2 2.215 . 2.828 2.262 2.226 2.299 . 0 0 "[ . 1 . 2]" 1
816 1 99 GLU HB3 1 99 GLU HG2 2.615 . 3.470 2.723 2.636 2.787 . 0 0 "[ . 1 . 2]" 1
817 1 85 TYR HE1 1 99 GLU HB2 3.285 . 4.634 4.193 4.057 4.300 . 0 0 "[ . 1 . 2]" 1
818 1 85 TYR HE1 1 99 GLU HB3 3.256 . 4.581 4.749 4.706 4.795 0.214 18 0 "[ . 1 . 2]" 1
819 1 96 LEU HA 1 99 GLU HB3 2.768 . 3.726 3.809 3.762 3.851 0.125 10 0 "[ . 1 . 2]" 1
820 1 99 GLU HB2 1 99 GLU HG3 2.640 . 3.511 2.215 2.198 2.253 . 0 0 "[ . 1 . 2]" 1
821 1 99 GLU HB3 1 99 GLU HG3 2.643 . 3.516 2.883 2.838 2.936 . 0 0 "[ . 1 . 2]" 1
822 1 95 VAL HB 1 96 LEU MD2 3.854 . 5.711 4.697 4.589 4.801 . 0 0 "[ . 1 . 2]" 1
823 1 95 VAL MG2 1 96 LEU MD2 2.474 . 3.239 1.994 1.881 2.104 . 0 0 "[ . 1 . 2]" 1
824 1 102 GLU HA 1 102 GLU HB3 2.573 . 3.401 2.763 2.699 2.817 . 0 0 "[ . 1 . 2]" 1
825 1 102 GLU HA 1 102 GLU HB2 2.823 . 3.819 2.928 2.892 2.959 . 0 0 "[ . 1 . 2]" 1
826 1 102 GLU HA 1 102 GLU HG2 2.563 . 3.384 2.249 2.184 2.310 . 0 0 "[ . 1 . 2]" 1
827 1 102 GLU HA 1 105 PHE HB3 2.685 . 3.586 2.620 2.567 2.704 . 0 0 "[ . 1 . 2]" 1
828 1 102 GLU HA 1 105 PHE HA 3.566 . 5.156 5.384 5.331 5.445 0.289 7 0 "[ . 1 . 2]" 1
829 1 81 PHE HE2 1 102 GLU HA 3.097 . 4.296 2.544 2.471 2.638 . 0 0 "[ . 1 . 2]" 1
830 1 102 GLU HA 1 105 PHE HD2 2.964 . 4.062 2.718 2.634 2.818 . 0 0 "[ . 1 . 2]" 1
831 1 81 PHE HD2 1 102 GLU HA 3.403 . 4.851 3.208 3.063 3.322 . 0 0 "[ . 1 . 2]" 1
832 1 99 GLU HA 1 102 GLU HB3 3.084 . 4.273 3.753 3.583 4.004 . 0 0 "[ . 1 . 2]" 1
833 1 102 GLU HB3 1 102 GLU HG2 2.773 . 3.734 2.604 2.556 2.641 . 0 0 "[ . 1 . 2]" 1
834 1 102 GLU HG3 1 106 LEU MD1 2.957 . 4.050 3.948 3.890 4.006 . 0 0 "[ . 1 . 2]" 1
835 1 102 GLU HG2 1 106 LEU MD1 2.903 . 3.956 2.729 2.648 2.861 . 0 0 "[ . 1 . 2]" 1
836 1 102 GLU HA 1 102 GLU HG3 2.414 . 3.142 2.940 2.871 3.008 . 0 0 "[ . 1 . 2]" 1
837 1 107 GLN HB3 1 108 LYS HD3 2.572 . 3.399 2.770 2.702 2.805 . 0 0 "[ . 1 . 2]" 1
838 1 107 GLN HB2 1 108 LYS HD3 3.221 . 4.518 4.492 4.407 4.536 0.018 3 0 "[ . 1 . 2]" 1
839 1 107 GLN HA 1 107 GLN QG 2.503 . 3.286 2.807 2.419 2.980 . 0 0 "[ . 1 . 2]" 1
840 1 104 LEU HA 1 107 GLN QG 2.513 . 3.302 3.266 3.034 3.384 0.082 7 0 "[ . 1 . 2]" 1
841 1 18 VAL MG2 1 108 LYS HA 3.079 . 4.264 3.926 3.915 3.937 . 0 0 "[ . 1 . 2]" 1
842 1 108 LYS HA 1 108 LYS HB3 2.262 . 2.901 2.404 2.398 2.411 . 0 0 "[ . 1 . 2]" 1
843 1 108 LYS HA 1 108 LYS HG2 3.026 . 4.171 3.220 3.193 3.238 . 0 0 "[ . 1 . 2]" 1
844 1 108 LYS HA 1 108 LYS HG3 2.853 . 3.871 3.655 3.646 3.667 . 0 0 "[ . 1 . 2]" 1
845 1 18 VAL HA 1 108 LYS HG3 3.741 . 5.490 1.959 1.918 1.986 0.074 3 0 "[ . 1 . 2]" 1
846 1 108 LYS HB2 1 108 LYS HG2 2.642 . 3.515 2.377 2.369 2.387 . 0 0 "[ . 1 . 2]" 1
847 1 108 LYS HD2 1 108 LYS HG3 2.520 . 3.314 2.414 2.404 2.427 . 0 0 "[ . 1 . 2]" 1
848 1 108 LYS HD3 1 108 LYS HG3 2.609 . 3.460 3.000 2.996 3.003 . 0 0 "[ . 1 . 2]" 1
849 1 104 LEU MD1 1 108 LYS HG3 2.995 . 4.116 3.623 3.571 3.666 . 0 0 "[ . 1 . 2]" 1
850 1 104 LEU MD1 1 108 LYS HG2 2.547 . 3.358 3.242 3.184 3.266 . 0 0 "[ . 1 . 2]" 1
851 1 18 VAL MG2 1 108 LYS HG2 2.938 . 4.017 3.336 3.303 3.372 . 0 0 "[ . 1 . 2]" 1
852 1 108 LYS HA 1 108 LYS HD2 2.256 . 2.892 2.663 2.632 2.687 . 0 0 "[ . 1 . 2]" 1
853 1 108 LYS HD3 1 108 LYS HG2 2.397 . 3.115 2.460 2.447 2.470 . 0 0 "[ . 1 . 2]" 1
854 1 108 LYS HD2 1 108 LYS HG2 2.393 . 3.109 3.012 3.010 3.015 . 0 0 "[ . 1 . 2]" 1
855 1 110 ASN HA 1 110 ASN QB . . 2.169 2.260 2.219 2.496 0.327 6 0 "[ . 1 . 2]" 1
856 1 28 ALA HA 1 31 PHE HB2 3.351 . 4.755 2.795 2.664 2.879 . 0 0 "[ . 1 . 2]" 1
857 1 109 ILE QG 1 110 ASN QB 3.480 . 4.994 4.652 4.587 4.784 . 0 0 "[ . 1 . 2]" 1
858 1 111 GLU HA 1 111 GLU HB2 2.273 . 2.919 3.003 3.000 3.006 0.087 8 0 "[ . 1 . 2]" 1
859 1 111 GLU HA 1 111 GLU HG2 2.276 . 2.923 2.575 2.520 2.637 . 0 0 "[ . 1 . 2]" 1
860 1 10 GLN HG3 1 115 GLU HA 3.461 . 4.958 4.835 4.307 5.071 0.113 20 0 "[ . 1 . 2]" 1
861 1 74 ILE HA 1 74 ILE HG12 2.757 . 3.707 2.545 2.518 2.574 . 0 0 "[ . 1 . 2]" 1
862 1 74 ILE HG12 1 105 PHE HZ 3.308 . 4.676 2.093 1.998 2.176 . 0 0 "[ . 1 . 2]" 1
863 1 74 ILE MD 1 74 ILE HG12 2.875 . 3.908 2.090 2.085 2.093 . 0 0 "[ . 1 . 2]" 1
864 1 116 GLU HA 1 116 GLU HB2 2.405 . 3.128 3.025 3.014 3.030 . 0 0 "[ . 1 . 2]" 1
865 1 116 GLU HA 1 116 GLU HG3 2.027 . 2.540 2.566 2.439 3.096 0.556 16 2 "[ . - 1 .+ 2]" 1
866 1 116 GLU HB3 1 116 GLU HG3 1.811 . 2.221 2.515 2.399 2.997 0.776 16 2 "[ . - 1 .+ 2]" 1
867 1 74 ILE HA 1 74 ILE HG13 3.155 . 4.399 2.886 2.833 2.911 . 0 0 "[ . 1 . 2]" 1
868 1 21 THR HA 1 24 LYS HB2 3.084 . 4.273 3.434 3.085 5.147 0.874 3 1 "[ + . 1 . 2]" 1
869 1 67 TYR HE2 1 73 CYS HA 2.901 . 3.953 3.448 3.131 3.599 . 0 0 "[ . 1 . 2]" 1
870 1 10 GLN HA 1 13 TYR HD1 3.342 . 4.738 4.395 4.323 4.478 . 0 0 "[ . 1 . 2]" 1
871 1 93 ASP HA 1 96 LEU HB2 2.190 . 2.790 2.237 2.185 2.279 . 0 0 "[ . 1 . 2]" 1
872 1 32 GLN HA 1 32 GLN HG2 2.679 . 3.576 2.800 2.631 3.812 0.236 17 0 "[ . 1 . 2]" 1
873 1 32 GLN HA 1 32 GLN HG3 2.649 . 3.526 3.266 3.194 3.578 0.052 17 0 "[ . 1 . 2]" 1
874 1 32 GLN HA 1 32 GLN HB2 2.331 . 3.010 3.003 2.524 3.035 0.025 18 0 "[ . 1 . 2]" 1
875 1 32 GLN HA 1 32 GLN HB3 2.412 . 3.139 2.416 2.346 2.453 . 0 0 "[ . 1 . 2]" 1
876 1 108 LYS HD3 1 108 LYS HE3 2.388 . 3.101 2.960 2.955 2.967 . 0 0 "[ . 1 . 2]" 1
877 1 108 LYS HA 1 108 LYS HE2 2.921 . 3.988 4.148 4.128 4.173 0.185 9 0 "[ . 1 . 2]" 1
878 1 108 LYS HA 1 108 LYS HE3 3.117 . 4.331 4.553 4.532 4.577 0.246 8 0 "[ . 1 . 2]" 1
879 1 109 ILE HB 1 109 ILE QG . . 2.811 2.152 2.149 2.157 . 0 0 "[ . 1 . 2]" 1
880 1 55 MET HG3 1 58 ILE MD 3.108 . 4.315 3.637 3.458 3.867 . 0 0 "[ . 1 . 2]" 1
881 1 13 TYR HA 1 17 VAL HB 3.317 . 4.693 4.712 4.697 4.733 0.040 14 0 "[ . 1 . 2]" 1
882 1 13 TYR HE2 1 17 VAL HB 2.951 . 4.039 4.280 4.262 4.294 0.255 9 0 "[ . 1 . 2]" 1
883 1 13 TYR HD2 1 17 VAL HB 3.451 . 4.940 4.755 4.722 4.784 . 0 0 "[ . 1 . 2]" 1
884 1 103 LYS QB 1 103 LYS QG 1.987 . 2.481 2.048 2.023 2.058 . 0 0 "[ . 1 . 2]" 1
885 1 103 LYS HA 1 103 LYS QB 2.049 . 2.574 2.162 2.150 2.167 . 0 0 "[ . 1 . 2]" 1
886 1 103 LYS QB 1 103 LYS HE2 2.610 . 3.462 2.783 1.738 3.433 0.020 17 0 "[ . 1 . 2]" 1
887 1 67 TYR HD1 1 72 GLU HB3 2.932 . 4.007 2.477 2.287 2.767 . 0 0 "[ . 1 . 2]" 1
888 1 50 LYS QD 1 50 LYS QG 1.925 . 2.388 2.042 1.993 2.088 . 0 0 "[ . 1 . 2]" 1
889 1 22 LEU MD2 1 101 LEU HG 3.234 . 4.541 3.892 3.862 3.952 . 0 0 "[ . 1 . 2]" 1
890 1 18 VAL MG1 1 77 PHE HE2 3.081 . 4.268 3.912 3.783 4.011 . 0 0 "[ . 1 . 2]" 1
891 1 17 VAL HB 1 17 VAL MG2 2.323 . 2.997 2.119 2.117 2.122 . 0 0 "[ . 1 . 2]" 1
892 1 17 VAL MG2 1 108 LYS HD2 2.470 . 3.233 1.940 1.892 1.973 . 0 0 "[ . 1 . 2]" 1
893 1 17 VAL MG2 1 108 LYS HB3 2.661 . 3.546 2.284 2.228 2.325 . 0 0 "[ . 1 . 2]" 1
894 1 17 VAL MG2 1 108 LYS HG3 2.886 . 3.927 2.431 2.387 2.476 . 0 0 "[ . 1 . 2]" 1
895 1 17 VAL MG2 1 108 LYS HB2 2.992 . 4.111 3.569 3.515 3.618 . 0 0 "[ . 1 . 2]" 1
896 1 17 VAL MG2 1 108 LYS HE3 2.659 . 3.543 2.783 2.730 2.842 . 0 0 "[ . 1 . 2]" 1
897 1 17 VAL MG2 1 18 VAL HA 2.315 . 2.985 2.769 2.747 2.794 . 0 0 "[ . 1 . 2]" 1
898 1 17 VAL MG2 1 21 THR HB 2.951 . 4.039 3.237 3.176 3.301 . 0 0 "[ . 1 . 2]" 1
899 1 35 VAL MG2 1 45 TYR HD1 2.863 . 3.887 2.716 2.585 2.806 . 0 0 "[ . 1 . 2]" 1
900 1 27 PHE HB2 1 100 ALA MB 3.085 . 4.275 3.599 3.511 3.666 . 0 0 "[ . 1 . 2]" 1
901 1 100 ALA HA 1 100 ALA MB 2.188 . 2.787 2.116 2.113 2.118 . 0 0 "[ . 1 . 2]" 1
902 1 97 MET HA 1 100 ALA MB 2.244 . 2.873 2.839 2.804 2.877 0.004 7 0 "[ . 1 . 2]" 1
903 1 27 PHE HE1 1 100 ALA MB 2.293 . 2.950 2.615 2.566 2.691 . 0 0 "[ . 1 . 2]" 1
904 1 27 PHE QD 1 100 ALA MB 2.287 . 2.941 2.661 2.535 2.725 . 0 0 "[ . 1 . 2]" 1
905 1 82 THR MG 1 86 ILE H 2.947 . 4.033 3.330 3.008 3.523 . 0 0 "[ . 1 . 2]" 1
906 1 55 MET HB3 1 58 ILE MG 3.335 . 4.725 4.604 4.529 4.644 . 0 0 "[ . 1 . 2]" 1
907 1 58 ILE MG 1 76 ASP HB3 3.503 . 5.037 3.490 3.442 3.551 . 0 0 "[ . 1 . 2]" 1
908 1 58 ILE MG 1 76 ASP HB2 4.143 . 6.288 3.403 3.330 3.498 . 0 0 "[ . 1 . 2]" 1
909 1 86 ILE MG 1 87 TYR HB2 3.099 . 4.300 3.145 3.109 3.191 . 0 0 "[ . 1 . 2]" 1
910 1 53 MET ME 1 58 ILE HA 3.175 . 4.435 3.525 3.214 3.700 . 0 0 "[ . 1 . 2]" 1
911 1 53 MET ME 1 76 ASP HA 2.827 . 3.826 3.124 3.031 3.260 . 0 0 "[ . 1 . 2]" 1
912 1 14 LEU HB2 1 109 ILE MD 3.559 . 5.142 4.724 4.697 4.763 . 0 0 "[ . 1 . 2]" 1
913 1 49 ILE MD 1 86 ILE HG12 3.268 . 4.603 4.405 4.309 4.438 . 0 0 "[ . 1 . 2]" 1
914 1 49 ILE MD 1 86 ILE HG13 3.415 . 4.872 4.538 4.483 4.576 . 0 0 "[ . 1 . 2]" 1
915 1 23 TRP HZ3 1 59 LYS QD 3.607 . 5.233 3.320 2.149 4.292 . 0 0 "[ . 1 . 2]" 1
916 1 102 GLU HA 1 105 PHE H 3.237 . 4.547 3.422 3.374 3.488 . 0 0 "[ . 1 . 2]" 1
917 1 3 LYS HB3 1 3 LYS HG2 2.015 . 2.523 2.535 2.347 3.011 0.488 16 0 "[ . 1 . 2]" 1
918 1 8 THR HA 1 8 THR MG 2.344 . 3.031 2.413 2.350 2.463 . 0 0 "[ . 1 . 2]" 1
919 1 8 THR HA 1 11 LEU HB3 2.440 . 3.184 3.456 3.366 3.519 0.335 15 0 "[ . 1 . 2]" 1
920 1 8 THR HA 1 11 LEU HB2 2.517 . 3.309 2.114 1.850 2.226 . 0 0 "[ . 1 . 2]" 1
921 1 8 THR HA 1 8 THR HB 2.277 . 2.925 3.018 3.011 3.024 0.099 19 0 "[ . 1 . 2]" 1
922 1 7 GLN HA 1 8 THR HA 3.034 . 4.185 4.392 4.350 4.449 0.264 2 0 "[ . 1 . 2]" 1
923 1 7 GLN HA 1 8 THR HB 3.725 . 5.459 4.710 4.598 4.822 . 0 0 "[ . 1 . 2]" 1
924 1 29 TRP HZ3 1 30 PRO HA 3.018 . 4.157 3.252 3.157 3.387 . 0 0 "[ . 1 . 2]" 1
925 1 29 TRP HE3 1 30 PRO HA 2.352 . 3.043 2.781 2.714 2.873 . 0 0 "[ . 1 . 2]" 1
926 1 18 VAL HA 1 22 LEU MD1 2.694 . 3.601 3.395 3.372 3.409 . 0 0 "[ . 1 . 2]" 1
927 1 18 VAL HA 1 108 LYS HG2 2.848 . 3.862 3.431 3.370 3.463 . 0 0 "[ . 1 . 2]" 1
928 1 18 VAL HA 1 108 LYS HB3 2.953 . 4.043 3.490 3.437 3.528 . 0 0 "[ . 1 . 2]" 1
929 1 18 VAL HA 1 18 VAL HB 2.984 . 4.097 3.017 3.016 3.020 . 0 0 "[ . 1 . 2]" 1
930 1 14 LEU HA 1 18 VAL HA 3.218 . 4.512 4.510 4.472 4.530 0.018 12 0 "[ . 1 . 2]" 1
931 1 82 THR HB 1 82 THR MG 2.334 . 3.015 2.120 2.116 2.124 . 0 0 "[ . 1 . 2]" 1
932 1 57 THR HB 1 58 ILE HG13 3.755 . 5.517 3.393 3.331 3.514 . 0 0 "[ . 1 . 2]" 1
933 1 21 THR HA 1 24 LYS HB3 3.682 . 5.377 4.970 4.608 5.232 . 0 0 "[ . 1 . 2]" 1
934 1 74 ILE HA 1 74 ILE HB 2.987 . 4.102 3.009 3.004 3.013 . 0 0 "[ . 1 . 2]" 1
935 1 74 ILE HA 1 77 PHE HB3 2.797 . 3.775 3.880 3.832 3.917 0.142 16 0 "[ . 1 . 2]" 1
936 1 85 TYR HE1 1 95 VAL HA 2.640 . 3.511 2.555 2.497 2.640 . 0 0 "[ . 1 . 2]" 1
937 1 95 VAL HA 1 98 ALA MB 2.217 . 2.831 2.210 2.080 2.268 . 0 0 "[ . 1 . 2]" 1
938 1 95 VAL HA 1 95 VAL MG2 2.290 . 2.946 2.853 2.841 2.896 . 0 0 "[ . 1 . 2]" 1
939 1 94 ILE HG13 1 95 VAL HA 3.383 . 4.813 3.487 3.410 3.564 . 0 0 "[ . 1 . 2]" 1
940 1 57 THR HA 1 60 LYS HG3 3.132 . 4.358 3.653 2.381 4.811 0.453 9 0 "[ . 1 . 2]" 1
941 1 57 THR HA 1 60 LYS QD 2.928 . 4.000 3.711 2.302 4.031 0.031 13 0 "[ . 1 . 2]" 1
942 1 57 THR HA 1 57 THR MG 2.434 . 3.174 2.440 2.409 2.460 . 0 0 "[ . 1 . 2]" 1
943 1 38 VAL HA 1 38 VAL QG 2.463 . 3.221 2.362 2.109 2.400 . 0 0 "[ . 1 . 2]" 1
944 1 38 VAL HA 1 38 VAL HB 2.158 . 2.740 2.369 2.319 2.968 0.228 15 0 "[ . 1 . 2]" 1
945 1 38 VAL HA 1 41 ASN HA 2.487 . 3.260 3.365 3.287 3.422 0.162 17 0 "[ . 1 . 2]" 1
946 1 43 PRO HA 1 43 PRO HB2 2.577 . 3.407 2.924 2.707 2.949 . 0 0 "[ . 1 . 2]" 1
947 1 30 PRO HB3 1 30 PRO HG3 2.078 . 2.618 2.262 2.257 2.270 . 0 0 "[ . 1 . 2]" 1
948 1 30 PRO HB3 1 30 PRO HG2 2.787 . 3.758 2.948 2.938 2.958 . 0 0 "[ . 1 . 2]" 1
949 1 45 TYR HA 1 45 TYR HB3 2.383 . 3.093 3.001 2.996 3.008 . 0 0 "[ . 1 . 2]" 1
950 1 45 TYR HA 1 45 TYR HB2 2.352 . 3.044 2.660 2.641 2.679 . 0 0 "[ . 1 . 2]" 1
951 1 45 TYR HA 1 48 ILE MG 3.050 . 4.213 4.088 4.077 4.103 . 0 0 "[ . 1 . 2]" 1
952 1 45 TYR HA 1 45 TYR HD2 2.518 . 3.311 2.543 2.439 2.630 . 0 0 "[ . 1 . 2]" 1
953 1 45 TYR HA 1 87 TYR HE1 2.023 . 2.535 2.075 1.936 2.169 . 0 0 "[ . 1 . 2]" 1
954 1 45 TYR HA 1 87 TYR HD1 2.655 . 3.536 2.588 2.383 2.674 . 0 0 "[ . 1 . 2]" 1
955 1 35 VAL HB 1 35 VAL MG1 1.932 . 2.399 2.099 2.094 2.104 . 0 0 "[ . 1 . 2]" 1
956 1 34 PRO HA 1 35 VAL MG1 3.385 . 4.817 3.198 3.159 3.251 . 0 0 "[ . 1 . 2]" 1
957 1 35 VAL MG1 1 45 TYR HD1 3.229 . 4.532 4.056 3.961 4.126 . 0 0 "[ . 1 . 2]" 1
958 1 35 VAL MG1 1 45 TYR HE1 2.508 . 3.294 2.423 2.348 2.500 . 0 0 "[ . 1 . 2]" 1
959 1 35 VAL MG2 1 42 LEU MD1 2.255 . 2.891 1.882 1.850 1.949 . 0 0 "[ . 1 . 2]" 1
960 1 35 VAL MG2 1 42 LEU HB2 3.303 . 4.667 3.938 3.863 4.038 . 0 0 "[ . 1 . 2]" 1
961 1 35 VAL MG2 1 40 LEU MD2 3.381 . 4.809 3.945 3.827 4.010 . 0 0 "[ . 1 . 2]" 1
962 1 34 PRO HA 1 54 ASP HB3 2.823 . 3.819 2.224 2.036 3.009 . 0 0 "[ . 1 . 2]" 1
963 1 34 PRO HA 1 34 PRO HB3 2.375 . 3.080 2.280 2.235 2.307 . 0 0 "[ . 1 . 2]" 1
964 1 3 LYS HA 1 4 PRO HG2 2.972 . 4.076 4.270 4.028 4.490 0.414 18 0 "[ . 1 . 2]" 1
965 1 4 PRO QD 1 4 PRO HG2 2.442 . 2.994 2.207 2.185 2.244 . 0 0 "[ . 1 . 2]" 1
966 1 109 ILE HA 1 109 ILE QG 2.471 . 3.234 3.159 3.151 3.162 . 0 0 "[ . 1 . 2]" 1
967 1 13 TYR HA 1 16 ARG HG3 3.210 . 4.498 3.742 3.625 3.918 . 0 0 "[ . 1 . 2]" 1
968 1 18 VAL MG1 1 105 PHE HA 2.691 . 3.597 2.283 2.253 2.312 . 0 0 "[ . 1 . 2]" 1
969 1 22 LEU HG 1 105 PHE HA 3.218 . 4.513 3.189 3.121 3.226 . 0 0 "[ . 1 . 2]" 1
970 1 105 PHE HA 1 105 PHE HB2 2.390 . 3.104 2.273 2.269 2.279 . 0 0 "[ . 1 . 2]" 1
971 1 105 PHE HA 1 105 PHE HB3 2.417 . 3.147 2.963 2.959 2.970 . 0 0 "[ . 1 . 2]" 1
972 1 105 PHE HA 1 105 PHE HD1 2.285 . 2.938 2.930 2.886 2.952 0.014 7 0 "[ . 1 . 2]" 1
973 1 105 PHE H 1 105 PHE HA 2.853 . 3.870 2.803 2.795 2.811 . 0 0 "[ . 1 . 2]" 1
974 1 105 PHE HA 1 106 LEU H 2.526 . 3.324 3.503 3.495 3.510 0.186 19 0 "[ . 1 . 2]" 1
975 1 73 CYS HA 1 77 PHE HD1 3.036 . 4.188 4.376 4.286 4.403 0.215 13 0 "[ . 1 . 2]" 1
976 1 19 LEU MD1 1 23 TRP HA 3.197 . 4.475 4.129 4.091 4.179 . 0 0 "[ . 1 . 2]" 1
977 1 23 TRP HA 1 23 TRP QB 2.272 . 2.702 2.413 2.344 2.425 . 0 0 "[ . 1 . 2]" 1
978 1 23 TRP HA 1 23 TRP HD1 3.127 . 4.349 4.045 3.985 4.114 . 0 0 "[ . 1 . 2]" 1
979 1 23 TRP HA 1 23 TRP HE3 2.497 . 3.277 3.200 3.037 3.312 0.035 7 0 "[ . 1 . 2]" 1
980 1 94 ILE HA 1 94 ILE MD 2.441 . 3.186 2.078 1.943 2.225 . 0 0 "[ . 1 . 2]" 1
981 1 94 ILE HA 1 94 ILE HG13 2.719 . 3.643 3.127 3.064 3.222 . 0 0 "[ . 1 . 2]" 1
982 1 31 PHE HE1 1 94 ILE HA 3.120 . 4.337 4.544 4.512 4.585 0.248 19 0 "[ . 1 . 2]" 1
983 1 94 ILE HG12 1 94 ILE MG 2.763 . 3.717 2.271 2.201 2.363 . 0 0 "[ . 1 . 2]" 1
984 1 94 ILE MG 1 95 VAL MG1 2.239 . 2.866 2.555 2.392 2.582 . 0 0 "[ . 1 . 2]" 1
985 1 94 ILE HB 1 94 ILE MG 2.188 . 2.787 2.092 2.075 2.120 . 0 0 "[ . 1 . 2]" 1
986 1 88 ASN HB2 1 94 ILE MG 2.289 . 2.944 2.415 2.216 2.656 . 0 0 "[ . 1 . 2]" 1
987 1 92 ASP HB3 1 94 ILE MG 1.986 . 2.479 2.468 2.419 2.492 0.013 18 0 "[ . 1 . 2]" 1
988 1 94 ILE HA 1 94 ILE MG 2.579 . 3.411 3.205 3.189 3.222 . 0 0 "[ . 1 . 2]" 1
989 1 94 ILE MD 1 94 ILE HG13 2.402 . 3.123 2.112 2.108 2.115 . 0 0 "[ . 1 . 2]" 1
990 1 30 PRO HG2 1 94 ILE MD 2.607 . 3.456 2.019 1.970 2.064 . 0 0 "[ . 1 . 2]" 1
991 1 94 ILE HB 1 94 ILE MD 2.049 . 2.574 2.420 2.405 2.443 . 0 0 "[ . 1 . 2]" 1
992 1 30 PRO HB2 1 94 ILE MD 2.430 . 3.168 2.590 2.515 2.702 . 0 0 "[ . 1 . 2]" 1
993 1 30 PRO HD3 1 94 ILE MD 3.105 . 4.311 3.786 3.740 3.850 . 0 0 "[ . 1 . 2]" 1
994 1 94 ILE MD 1 97 MET HB3 3.719 . 5.448 3.701 3.374 3.874 . 0 0 "[ . 1 . 2]" 1
995 1 94 ILE MD 1 97 MET HB2 3.004 . 4.132 2.563 2.381 2.624 . 0 0 "[ . 1 . 2]" 1
996 1 30 PRO HD2 1 94 ILE MD 3.037 . 4.190 3.691 3.653 3.730 . 0 0 "[ . 1 . 2]" 1
997 1 29 TRP HH2 1 94 ILE MD 2.897 . 3.946 4.012 3.983 4.040 0.094 14 0 "[ . 1 . 2]" 1
998 1 31 PHE HD1 1 94 ILE MD 3.461 . 4.959 4.002 3.957 4.082 . 0 0 "[ . 1 . 2]" 1
999 1 94 ILE HA 1 97 MET HB2 2.301 . 2.963 2.398 2.210 2.557 . 0 0 "[ . 1 . 2]" 1
1000 1 59 LYS HA 1 59 LYS HB2 2.910 . 3.968 2.407 2.344 2.477 . 0 0 "[ . 1 . 2]" 1
1001 1 59 LYS HA 1 59 LYS QG 2.789 . 3.761 3.431 3.316 3.518 . 0 0 "[ . 1 . 2]" 1
1002 1 15 LEU MD2 1 59 LYS HA 3.011 . 4.144 2.970 2.839 3.142 . 0 0 "[ . 1 . 2]" 1
1003 1 10 GLN HA 1 10 GLN HG3 2.245 . 2.875 2.444 2.223 2.637 . 0 0 "[ . 1 . 2]" 1
1004 1 10 GLN HA 1 13 TYR HB3 2.499 . 3.280 2.558 2.466 2.636 . 0 0 "[ . 1 . 2]" 1
1005 1 10 GLN HA 1 10 GLN HB3 2.270 . 2.914 2.536 2.503 2.576 . 0 0 "[ . 1 . 2]" 1
1006 1 10 GLN HA 1 113 PRO HB2 2.486 . 3.259 3.279 3.124 3.318 0.059 6 0 "[ . 1 . 2]" 1
1007 1 10 GLN HA 1 112 LEU HA 4.275 . 6.559 4.565 4.506 4.631 . 0 0 "[ . 1 . 2]" 1
1008 1 10 GLN HA 1 113 PRO HD3 3.117 . 4.331 4.638 4.591 4.667 0.336 14 0 "[ . 1 . 2]" 1
1009 1 80 MET HA 1 80 MET ME 3.089 . 4.282 4.222 4.149 4.270 . 0 0 "[ . 1 . 2]" 1
1010 1 80 MET HA 1 80 MET HB2 2.179 . 2.773 2.593 2.500 2.857 0.084 18 0 "[ . 1 . 2]" 1
1011 1 80 MET HA 1 80 MET HB3 2.335 . 3.016 2.958 2.786 3.007 . 0 0 "[ . 1 . 2]" 1
1012 1 80 MET HA 1 80 MET HG2 2.697 . 3.607 2.836 2.051 3.059 . 0 0 "[ . 1 . 2]" 1
1013 1 80 MET HA 1 83 ASN QB 3.065 . 4.240 3.798 3.448 4.165 . 0 0 "[ . 1 . 2]" 1
1014 1 61 ARG HA 1 61 ARG HG3 2.789 . 3.762 3.621 3.167 4.017 0.255 16 0 "[ . 1 . 2]" 1
1015 1 61 ARG HA 1 61 ARG QD 2.915 . 3.978 3.715 2.747 3.915 . 0 0 "[ . 1 . 2]" 1
1016 1 46 TYR HA 1 46 TYR HB2 2.185 . 2.782 2.981 2.977 2.988 0.206 1 0 "[ . 1 . 2]" 1
1017 1 46 TYR HA 1 46 TYR HE1 3.033 . 4.183 4.228 4.189 4.256 0.073 9 0 "[ . 1 . 2]" 1
1018 1 46 TYR HA 1 46 TYR HD1 2.149 . 2.726 1.926 1.883 1.981 . 0 0 "[ . 1 . 2]" 1
1019 1 55 MET HA 1 55 MET HB3 2.299 . 2.960 2.578 2.545 2.596 . 0 0 "[ . 1 . 2]" 1
1020 1 55 MET HA 1 58 ILE HB 2.269 . 2.912 2.087 2.020 2.246 . 0 0 "[ . 1 . 2]" 1
1021 1 97 MET HA 1 97 MET HB3 2.415 . 3.144 2.455 2.416 2.492 . 0 0 "[ . 1 . 2]" 1
1022 1 97 MET HA 1 97 MET HB2 2.503 . 3.286 3.034 3.029 3.038 . 0 0 "[ . 1 . 2]" 1
1023 1 27 PHE QD 1 97 MET HA 2.319 . 2.991 2.726 2.549 2.938 . 0 0 "[ . 1 . 2]" 1
1024 1 27 PHE HE2 1 97 MET HA 2.942 . 4.024 3.620 3.461 3.864 . 0 0 "[ . 1 . 2]" 1
1025 1 31 PHE HE1 1 97 MET HB2 2.930 . 4.003 3.087 2.943 3.205 . 0 0 "[ . 1 . 2]" 1
1026 1 97 MET HA 1 97 MET HG3 2.355 . 3.048 3.133 2.806 3.382 0.334 5 0 "[ . 1 . 2]" 1
1027 1 97 MET HA 1 97 MET HG2 2.781 . 3.747 2.585 2.502 2.800 . 0 0 "[ . 1 . 2]" 1
1028 1 97 MET HB2 1 97 MET HG3 2.994 . 4.114 2.443 2.326 2.600 . 0 0 "[ . 1 . 2]" 1
1029 1 97 MET ME 1 97 MET HG3 2.792 . 3.766 2.914 2.590 3.325 . 0 0 "[ . 1 . 2]" 1
1030 1 27 PHE QD 1 97 MET HG3 3.312 . 4.683 3.099 2.788 3.337 . 0 0 "[ . 1 . 2]" 1
1031 1 30 PRO HD2 1 97 MET ME 2.369 . 3.071 3.164 3.039 3.261 0.190 16 0 "[ . 1 . 2]" 1
1032 1 94 ILE HA 1 97 MET ME 2.407 . 3.131 1.841 1.610 3.139 0.073 20 0 "[ . 1 . 2]" 1
1033 1 31 PHE HE1 1 97 MET ME 2.523 . 3.319 2.586 2.478 2.720 . 0 0 "[ . 1 . 2]" 1
1034 1 31 PHE HD1 1 97 MET ME 3.311 . 4.681 3.932 3.782 4.028 . 0 0 "[ . 1 . 2]" 1
1035 1 27 PHE QD 1 97 MET ME 2.417 . 3.147 3.114 2.182 3.216 0.069 10 0 "[ . 1 . 2]" 1
1036 1 29 TRP HD1 1 97 MET ME 3.017 . 4.155 3.496 2.800 3.693 . 0 0 "[ . 1 . 2]" 1
1037 1 97 MET ME 1 97 MET HG2 2.518 . 3.311 3.099 2.519 3.306 . 0 0 "[ . 1 . 2]" 1
1038 1 97 MET HB2 1 97 MET ME 2.385 . 3.096 1.983 1.848 2.464 . 0 0 "[ . 1 . 2]" 1
1039 1 30 PRO HG2 1 97 MET ME 2.512 . 3.301 2.792 2.579 2.949 . 0 0 "[ . 1 . 2]" 1
1040 1 16 ARG HA 1 16 ARG HB2 2.234 . 2.858 2.996 2.991 2.999 0.141 11 0 "[ . 1 . 2]" 1
1041 1 63 GLU HA 1 63 GLU HG2 2.084 . 2.627 2.559 2.187 2.743 0.116 8 0 "[ . 1 . 2]" 1
1042 1 23 TRP HZ3 1 32 GLN HA 2.793 . 3.768 3.371 3.003 3.652 . 0 0 "[ . 1 . 2]" 1
1043 1 23 TRP HH2 1 32 GLN HA 3.180 . 4.444 3.906 3.475 4.477 0.033 3 0 "[ . 1 . 2]" 1
1044 1 15 LEU HA 1 15 LEU MD2 2.477 . 3.244 2.023 1.976 2.111 . 0 0 "[ . 1 . 2]" 1
1045 1 15 LEU MD2 1 63 GLU HA 2.872 . 3.903 3.758 3.658 3.834 . 0 0 "[ . 1 . 2]" 1
1046 1 15 LEU MD2 1 62 LEU HB3 2.827 . 3.826 2.492 2.330 2.625 . 0 0 "[ . 1 . 2]" 1
1047 1 15 LEU MD2 1 63 GLU HB2 2.536 . 3.340 3.281 3.215 3.398 0.058 3 0 "[ . 1 . 2]" 1
1048 1 96 LEU HA 1 96 LEU MD2 2.047 . 2.571 1.895 1.867 1.936 . 0 0 "[ . 1 . 2]" 1
1049 1 96 LEU HA 1 96 LEU HG 2.613 . 3.467 3.310 3.270 3.354 . 0 0 "[ . 1 . 2]" 1
1050 1 96 LEU HA 1 96 LEU HB2 2.305 . 2.969 3.017 3.013 3.024 0.055 19 0 "[ . 1 . 2]" 1
1051 1 96 LEU HA 1 99 GLU HB2 2.343 . 3.029 2.285 2.217 2.344 . 0 0 "[ . 1 . 2]" 1
1052 1 96 LEU HA 1 99 GLU HG3 3.330 . 4.716 2.696 2.601 2.825 . 0 0 "[ . 1 . 2]" 1
1053 1 31 PHE HA 1 31 PHE HB3 2.322 . 2.996 2.430 2.420 2.444 . 0 0 "[ . 1 . 2]" 1
1054 1 31 PHE HA 1 31 PHE HD2 2.542 . 3.350 2.944 2.795 2.992 . 0 0 "[ . 1 . 2]" 1
1055 1 49 ILE HA 1 49 ILE HG12 2.411 . 3.138 2.878 2.839 3.181 0.043 18 0 "[ . 1 . 2]" 1
1056 1 48 ILE MG 1 49 ILE HA 2.715 . 3.637 2.959 2.875 3.025 . 0 0 "[ . 1 . 2]" 1
1057 1 106 LEU HA 1 106 LEU HG 3.610 . 5.239 2.765 2.745 2.783 . 0 0 "[ . 1 . 2]" 1
1058 1 101 LEU HA 1 101 LEU HG 2.771 . 3.731 2.954 2.926 3.021 . 0 0 "[ . 1 . 2]" 1
1059 1 22 LEU MD2 1 101 LEU HA 2.559 . 3.378 2.665 2.615 2.703 . 0 0 "[ . 1 . 2]" 1
1060 1 101 LEU HA 1 101 LEU MD1 3.361 . 4.773 3.864 3.858 3.879 . 0 0 "[ . 1 . 2]" 1
1061 1 104 LEU HA 1 107 GLN HB2 2.368 . 3.069 2.136 1.989 2.244 . 0 0 "[ . 1 . 2]" 1
1062 1 104 LEU HA 1 107 GLN HB3 2.516 . 3.307 2.944 2.863 3.123 . 0 0 "[ . 1 . 2]" 1
1063 1 78 ASN HA 1 81 PHE HB2 2.597 . 3.440 3.176 3.059 3.291 . 0 0 "[ . 1 . 2]" 1
1064 1 85 TYR HA 1 85 TYR HB3 2.315 . 2.985 2.438 2.411 2.452 . 0 0 "[ . 1 . 2]" 1
1065 1 85 TYR HA 1 85 TYR HB2 2.230 . 2.851 3.008 3.005 3.011 0.160 7 0 "[ . 1 . 2]" 1
1066 1 85 TYR HA 1 95 VAL MG1 2.949 . 4.036 3.225 3.081 3.315 . 0 0 "[ . 1 . 2]" 1
1067 1 85 TYR HA 1 85 TYR HD1 2.173 . 2.763 2.119 2.083 2.202 . 0 0 "[ . 1 . 2]" 1
1068 1 9 ASN HB2 1 115 GLU HA 3.497 . 5.025 4.540 3.167 5.187 0.162 6 0 "[ . 1 . 2]" 1
1069 1 98 ALA HA 1 101 LEU HB3 2.810 . 3.797 3.864 3.835 3.897 0.100 20 0 "[ . 1 . 2]" 1
1070 1 98 ALA HA 1 101 LEU HB2 2.647 . 3.523 2.269 2.241 2.299 . 0 0 "[ . 1 . 2]" 1
1071 1 81 PHE HE1 1 98 ALA HA 3.091 . 4.285 3.397 3.219 3.709 . 0 0 "[ . 1 . 2]" 1
1072 1 81 PHE HD1 1 98 ALA HA 2.629 . 3.493 2.818 2.662 2.967 . 0 0 "[ . 1 . 2]" 1
1073 1 31 PHE HE1 1 98 ALA HA 2.836 . 3.841 3.482 3.130 3.625 . 0 0 "[ . 1 . 2]" 1
1074 1 31 PHE HZ 1 98 ALA HA 2.996 . 4.118 2.930 2.822 3.273 . 0 0 "[ . 1 . 2]" 1
1075 1 31 PHE HD1 1 98 ALA HA 3.570 . 5.163 5.115 4.691 5.189 0.026 1 0 "[ . 1 . 2]" 1
1076 1 98 ALA HA 1 101 LEU H 3.076 . 4.259 3.244 3.183 3.295 . 0 0 "[ . 1 . 2]" 1
1077 1 24 LYS HA 1 24 LYS HB2 2.497 . 3.277 2.985 2.487 3.017 . 0 0 "[ . 1 . 2]" 1
1078 1 24 LYS HA 1 24 LYS HB3 2.494 . 3.271 2.508 2.400 2.560 . 0 0 "[ . 1 . 2]" 1
1079 1 28 ALA HA 1 30 PRO HD2 3.230 . 4.534 3.104 3.050 3.153 . 0 0 "[ . 1 . 2]" 1
1080 1 100 ALA HA 1 103 LYS HD2 2.565 . 3.387 2.953 2.414 3.437 0.050 16 0 "[ . 1 . 2]" 1
1081 1 40 LEU MD1 1 40 LEU HG 2.237 . 2.863 2.111 2.108 2.113 . 0 0 "[ . 1 . 2]" 1
1082 1 35 VAL HA 1 40 LEU MD1 2.657 . 3.539 2.543 2.452 2.657 . 0 0 "[ . 1 . 2]" 1
1083 1 40 LEU HB2 1 40 LEU MD1 1.821 . 2.236 2.143 2.130 2.156 . 0 0 "[ . 1 . 2]" 1
1084 1 40 LEU MD1 1 42 LEU HG 2.813 . 3.802 3.298 3.235 3.356 . 0 0 "[ . 1 . 2]" 1
1085 1 35 VAL MG1 1 40 LEU MD1 2.809 . 3.795 3.191 3.142 3.252 . 0 0 "[ . 1 . 2]" 1
1086 1 40 LEU MD1 1 42 LEU MD1 2.313 . 2.982 1.652 1.610 1.681 0.034 18 0 "[ . 1 . 2]" 1
1087 1 35 VAL MG2 1 40 LEU MD1 2.085 . 2.628 2.173 2.047 2.308 . 0 0 "[ . 1 . 2]" 1
1088 1 40 LEU MD2 1 40 LEU HG 2.378 . 3.085 2.126 2.122 2.128 . 0 0 "[ . 1 . 2]" 1
1089 1 40 LEU MD1 1 40 LEU MD2 2.495 . 3.273 2.088 2.083 2.097 . 0 0 "[ . 1 . 2]" 1
1090 1 40 LEU MD2 1 42 LEU MD1 3.376 . 4.800 3.080 2.985 3.180 . 0 0 "[ . 1 . 2]" 1
1091 1 40 LEU HB2 1 40 LEU MD2 3.104 . 4.309 2.854 2.807 2.897 . 0 0 "[ . 1 . 2]" 1
1092 1 40 LEU HB2 1 40 LEU HG 2.743 . 3.683 2.873 2.851 2.893 . 0 0 "[ . 1 . 2]" 1
1093 1 37 ALA HA 1 42 LEU MD1 2.528 . 3.327 1.480 1.404 1.558 0.325 12 0 "[ . 1 . 2]" 1
1094 1 37 ALA HA 1 40 LEU MD1 3.130 . 4.354 3.037 2.884 3.158 . 0 0 "[ . 1 . 2]" 1
1095 1 37 ALA HA 1 37 ALA MB 2.230 . 2.852 2.111 2.105 2.116 . 0 0 "[ . 1 . 2]" 1
1096 1 41 ASN HA 1 41 ASN HB2 1.938 . 2.407 2.474 2.421 3.010 0.603 9 1 "[ . +1 . 2]" 1
1097 1 89 LYS HA 1 90 PRO QD 2.336 . 2.552 1.803 1.750 1.901 . 0 0 "[ . 1 . 2]" 1
1098 1 89 LYS HA 1 89 LYS HB3 2.220 . 2.836 2.568 2.448 2.725 . 0 0 "[ . 1 . 2]" 1
1099 1 33 GLN HA 1 34 PRO QD 2.127 . 2.527 1.915 1.680 1.999 . 0 0 "[ . 1 . 2]" 1
1100 1 53 MET HA 1 53 MET HG2 3.348 . 4.749 3.813 3.797 3.840 . 0 0 "[ . 1 . 2]" 1
1101 1 53 MET HA 1 53 MET HB3 2.411 . 3.138 3.014 3.010 3.018 . 0 0 "[ . 1 . 2]" 1
1102 1 53 MET HA 1 53 MET HG3 2.903 . 3.957 3.279 3.226 3.300 . 0 0 "[ . 1 . 2]" 1
1103 1 112 LEU HA 1 112 LEU MD2 2.862 . 3.886 3.568 3.548 3.598 . 0 0 "[ . 1 . 2]" 1
1104 1 112 LEU HA 1 113 PRO HD2 2.122 . 2.685 1.974 1.903 1.998 . 0 0 "[ . 1 . 2]" 1
1105 1 44 ASP HA 1 47 LYS HD2 2.588 . 3.425 2.721 1.665 3.278 0.086 11 0 "[ . 1 . 2]" 1
1106 1 44 ASP HA 1 47 LYS HB2 2.393 . 3.109 2.431 2.019 2.712 . 0 0 "[ . 1 . 2]" 1
1107 1 44 ASP QB 1 47 LYS HB2 3.165 . 3.816 2.693 2.361 3.272 . 0 0 "[ . 1 . 2]" 1
1108 1 44 ASP QB 1 47 LYS HD2 2.802 . 3.746 3.135 2.045 4.107 0.361 18 0 "[ . 1 . 2]" 1
1109 1 44 ASP HA 1 44 ASP QB 2.271 . 2.900 2.200 2.153 2.240 . 0 0 "[ . 1 . 2]" 1
1110 1 88 ASN HA 1 94 ILE MG 3.376 . 4.801 4.296 4.259 4.375 . 0 0 "[ . 1 . 2]" 1
1111 1 36 ASP HA 1 36 ASP QB 2.104 . 2.658 2.453 2.411 2.492 . 0 0 "[ . 1 . 2]" 1
1112 1 42 LEU HA 1 42 LEU HG 2.965 . 4.064 3.284 3.264 3.310 . 0 0 "[ . 1 . 2]" 1
1113 1 42 LEU HA 1 42 LEU HB3 2.987 . 4.102 2.351 2.338 2.357 . 0 0 "[ . 1 . 2]" 1
1114 1 42 LEU HA 1 43 PRO HG3 3.018 . 4.157 4.216 4.179 4.469 0.312 10 0 "[ . 1 . 2]" 1
1115 1 42 LEU HA 1 42 LEU HB2 2.956 . 4.048 3.004 2.998 3.007 . 0 0 "[ . 1 . 2]" 1
1116 1 42 LEU HB3 1 42 LEU MD1 2.782 . 3.750 2.451 2.429 2.468 . 0 0 "[ . 1 . 2]" 1
1117 1 42 LEU MD1 1 42 LEU MD2 2.608 . 3.459 2.068 2.061 2.075 . 0 0 "[ . 1 . 2]" 1
1118 1 42 LEU MD1 1 42 LEU HG 2.908 . 3.965 2.116 2.114 2.118 . 0 0 "[ . 1 . 2]" 1
1119 1 37 ALA MB 1 42 LEU MD1 2.775 . 3.738 2.525 2.442 2.614 . 0 0 "[ . 1 . 2]" 1
1120 1 42 LEU HA 1 42 LEU MD1 3.452 . 4.941 3.956 3.946 3.973 . 0 0 "[ . 1 . 2]" 1
1121 1 42 LEU MD1 1 87 TYR HE2 3.301 . 4.663 4.417 4.399 4.443 . 0 0 "[ . 1 . 2]" 1
1122 1 42 LEU HB2 1 42 LEU MD1 2.687 . 3.590 2.254 2.236 2.267 . 0 0 "[ . 1 . 2]" 1
1123 1 42 LEU HA 1 42 LEU MD2 2.147 . 2.723 2.265 2.236 2.291 . 0 0 "[ . 1 . 2]" 1
1124 1 37 ALA HA 1 42 LEU MD2 3.469 . 4.973 4.040 4.005 4.071 . 0 0 "[ . 1 . 2]" 1
1125 1 42 LEU MD2 1 42 LEU HG 2.132 . 2.700 2.112 2.110 2.115 . 0 0 "[ . 1 . 2]" 1
1126 1 42 LEU HB2 1 42 LEU MD2 3.010 . 4.143 3.173 3.167 3.177 . 0 0 "[ . 1 . 2]" 1
1127 1 42 LEU HB3 1 42 LEU MD2 3.105 . 4.310 2.304 2.287 2.322 . 0 0 "[ . 1 . 2]" 1
1128 1 40 LEU HB2 1 42 LEU MD2 2.518 . 3.311 2.112 2.052 2.187 . 0 0 "[ . 1 . 2]" 1
1129 1 51 THR HA 1 52 PRO HD2 1.949 . 2.424 2.377 2.343 2.429 0.005 2 0 "[ . 1 . 2]" 1
1130 1 51 THR MG 1 52 PRO HD3 3.358 . 4.767 4.467 4.430 4.489 . 0 0 "[ . 1 . 2]" 1
1131 1 52 PRO HB2 1 52 PRO HD3 2.861 . 3.884 3.815 3.796 3.828 . 0 0 "[ . 1 . 2]" 1
1132 1 52 PRO HD3 1 52 PRO HG3 2.317 . 2.988 2.329 2.320 2.345 . 0 0 "[ . 1 . 2]" 1
1133 1 43 PRO HD2 1 43 PRO HG3 2.217 . 2.831 2.960 2.638 2.979 0.148 5 0 "[ . 1 . 2]" 1
1134 1 52 PRO HD3 1 52 PRO HG2 2.246 . 2.877 2.687 2.663 2.703 . 0 0 "[ . 1 . 2]" 1
1135 1 90 PRO QD 1 90 PRO HG2 2.631 . 3.496 2.184 2.175 2.187 . 0 0 "[ . 1 . 2]" 1
1136 1 90 PRO QD 1 90 PRO HG3 2.479 . 3.247 2.269 2.249 2.277 . 0 0 "[ . 1 . 2]" 1
1137 1 29 TRP HE3 1 30 PRO HD3 3.464 . 4.964 3.778 3.715 3.844 . 0 0 "[ . 1 . 2]" 1
1138 1 29 TRP HD1 1 30 PRO HD3 3.153 . 4.396 3.099 3.055 3.139 . 0 0 "[ . 1 . 2]" 1
1139 1 29 TRP HB3 1 30 PRO HD2 3.223 . 4.521 4.752 4.720 4.781 0.260 18 0 "[ . 1 . 2]" 1
1140 1 30 PRO HD2 1 31 PHE HD1 2.874 . 3.907 1.871 1.835 2.093 0.006 12 0 "[ . 1 . 2]" 1
1141 1 6 ARG HA 1 6 ARG HD2 3.092 . 4.287 3.621 3.158 4.233 . 0 0 "[ . 1 . 2]" 1
1142 1 6 ARG HA 1 6 ARG HD3 2.958 . 4.052 3.905 3.011 4.481 0.429 2 0 "[ . 1 . 2]" 1
1143 1 6 ARG HD3 1 68 TRP HA 3.935 . 5.871 3.700 3.385 4.405 . 0 0 "[ . 1 . 2]" 1
1144 1 6 ARG HB2 1 65 ASN HB2 3.349 . 4.751 4.513 4.290 4.831 0.080 2 0 "[ . 1 . 2]" 1
1145 1 6 ARG HB3 1 65 ASN HB2 3.164 . 4.415 4.513 4.387 4.638 0.223 8 0 "[ . 1 . 2]" 1
1146 1 6 ARG HD3 1 6 ARG HG2 2.453 . 3.205 2.340 2.251 2.434 . 0 0 "[ . 1 . 2]" 1
1147 1 6 ARG HD2 1 6 ARG HG3 2.639 . 3.509 2.864 2.445 3.004 . 0 0 "[ . 1 . 2]" 1
1148 1 6 ARG HD2 1 6 ARG HG2 2.550 . 3.363 2.663 2.412 3.007 . 0 0 "[ . 1 . 2]" 1
1149 1 61 ARG HB3 1 61 ARG QD 2.794 . 3.770 2.415 2.188 2.583 . 0 0 "[ . 1 . 2]" 1
1150 1 61 ARG QD 1 61 ARG HG3 3.034 . 3.651 2.297 2.250 2.481 . 0 0 "[ . 1 . 2]" 1
1151 1 61 ARG QD 1 61 ARG HG2 3.761 . 5.529 2.206 2.157 2.392 . 0 0 "[ . 1 . 2]" 1
1152 1 19 LEU HA 1 22 LEU HB3 3.732 . 5.473 4.557 4.512 4.588 . 0 0 "[ . 1 . 2]" 1
1153 1 101 LEU HA 1 104 LEU HB3 2.822 . 3.818 2.136 2.084 2.190 . 0 0 "[ . 1 . 2]" 1
1154 1 3 LYS HA 1 3 LYS HD2 4.368 . 6.753 4.036 2.169 4.859 . 0 0 "[ . 1 . 2]" 1
1155 1 11 LEU MD2 1 14 LEU HB2 2.902 . 3.955 3.219 3.113 3.308 . 0 0 "[ . 1 . 2]" 1
1156 1 11 LEU HA 1 14 LEU HB2 2.854 . 3.872 2.091 2.032 2.157 . 0 0 "[ . 1 . 2]" 1
1157 1 104 LEU MD2 1 108 LYS HE3 2.455 . 3.208 2.707 2.652 2.772 . 0 0 "[ . 1 . 2]" 1
1158 1 104 LEU MD2 1 108 LYS HE2 2.400 . 3.120 1.825 1.761 1.883 . 0 0 "[ . 1 . 2]" 1
1159 1 108 LYS HE2 1 108 LYS HG2 2.563 . 3.384 2.453 2.383 2.507 . 0 0 "[ . 1 . 2]" 1
1160 1 108 LYS HE3 1 108 LYS HG2 2.634 . 3.501 2.920 2.860 2.968 . 0 0 "[ . 1 . 2]" 1
1161 1 108 LYS HD2 1 108 LYS HE2 2.456 . 3.210 2.984 2.982 2.987 . 0 0 "[ . 1 . 2]" 1
1162 1 108 LYS HD3 1 108 LYS HE2 2.318 . 2.990 2.384 2.350 2.413 . 0 0 "[ . 1 . 2]" 1
1163 1 108 LYS HE2 1 108 LYS HG3 2.912 . 3.972 3.115 3.057 3.157 . 0 0 "[ . 1 . 2]" 1
1164 1 108 LYS HD2 1 108 LYS HE3 2.238 . 2.864 2.410 2.376 2.445 . 0 0 "[ . 1 . 2]" 1
1165 1 108 LYS HE3 1 108 LYS HG3 2.397 . 3.115 2.466 2.404 2.523 . 0 0 "[ . 1 . 2]" 1
1166 1 93 ASP HB3 1 96 LEU MD1 3.357 . 4.766 4.757 4.525 5.192 0.426 5 0 "[ . 1 . 2]" 1
1167 1 93 ASP HA 1 93 ASP HB3 2.038 . 2.557 2.700 2.450 3.033 0.476 5 0 "[ . 1 . 2]" 1
1168 1 31 PHE HB2 1 55 MET ME 2.864 . 3.889 2.324 2.253 2.413 . 0 0 "[ . 1 . 2]" 1
1169 1 31 PHE HB2 1 31 PHE HD1 2.630 . 3.494 2.387 2.339 2.413 . 0 0 "[ . 1 . 2]" 1
1170 1 11 LEU MD1 1 67 TYR HB2 2.783 . 3.751 2.595 2.476 2.817 . 0 0 "[ . 1 . 2]" 1
1171 1 11 LEU MD2 1 67 TYR HB2 3.347 . 4.747 2.009 1.893 2.082 0.054 15 0 "[ . 1 . 2]" 1
1172 1 11 LEU MD2 1 67 TYR HB3 3.005 . 4.133 1.951 1.878 1.999 . 0 0 "[ . 1 . 2]" 1
1173 1 67 TYR HA 1 67 TYR HB2 2.408 . 3.133 3.010 3.006 3.013 . 0 0 "[ . 1 . 2]" 1
1174 1 45 TYR HA 1 48 ILE HB 2.891 . 3.935 3.102 3.074 3.153 . 0 0 "[ . 1 . 2]" 1
1175 1 1 PRO HD2 1 2 ASN QB 2.793 . 3.768 3.563 3.223 3.751 . 0 0 "[ . 1 . 2]" 1
1176 1 42 LEU HB2 1 45 TYR HB2 3.210 . 4.498 2.006 1.931 2.131 . 0 0 "[ . 1 . 2]" 1
1177 1 42 LEU HB3 1 45 TYR HB2 3.114 . 4.326 1.875 1.685 2.085 0.217 3 0 "[ . 1 . 2]" 1
1178 1 42 LEU HB2 1 45 TYR HB3 3.288 . 4.639 3.159 3.073 3.223 . 0 0 "[ . 1 . 2]" 1
1179 1 86 ILE HA 1 86 ILE HB 2.188 . 2.786 2.952 2.946 2.963 0.177 18 0 "[ . 1 . 2]" 1
1180 1 83 ASN HA 1 86 ILE HB 2.389 . 3.103 1.860 1.804 1.974 . 0 0 "[ . 1 . 2]" 1
1181 1 86 ILE HB 1 86 ILE HG13 2.832 . 3.835 2.563 2.555 2.574 . 0 0 "[ . 1 . 2]" 1
1182 1 86 ILE HB 1 86 ILE MG 1.887 . 2.332 2.087 2.079 2.093 . 0 0 "[ . 1 . 2]" 1
1183 1 49 ILE MD 1 86 ILE HB 2.396 . 3.114 2.376 2.327 2.406 . 0 0 "[ . 1 . 2]" 1
1184 1 71 GLN HA 1 74 ILE HB 2.043 . 2.565 2.077 2.009 2.174 . 0 0 "[ . 1 . 2]" 1
1185 1 27 PHE HB3 1 100 ALA MB 3.080 . 4.266 3.942 3.781 4.037 . 0 0 "[ . 1 . 2]" 1
1186 1 27 PHE HB3 1 101 LEU MD2 3.728 . 5.465 3.611 3.491 3.771 . 0 0 "[ . 1 . 2]" 1
1187 1 81 PHE HB2 1 81 PHE HD2 2.861 . 3.884 2.360 2.338 2.377 . 0 0 "[ . 1 . 2]" 1
1188 1 63 GLU HB2 1 63 GLU HG2 2.352 . 3.044 2.516 2.379 2.964 . 0 0 "[ . 1 . 2]" 1
1189 1 63 GLU HB2 1 63 GLU HG3 2.225 . 2.844 2.361 2.272 2.449 . 0 0 "[ . 1 . 2]" 1
1190 1 15 LEU MD2 1 63 GLU HG2 2.440 . 3.184 1.952 1.694 2.937 0.002 8 0 "[ . 1 . 2]" 1
1191 1 15 LEU MD2 1 63 GLU HG3 2.408 . 3.133 2.569 1.684 2.740 . 0 0 "[ . 1 . 2]" 1
1192 1 95 VAL MG2 1 99 GLU HG2 3.047 . 4.208 2.765 2.688 2.833 . 0 0 "[ . 1 . 2]" 1
1193 1 46 TYR HB2 1 46 TYR HD1 2.520 . 3.314 3.366 3.337 3.395 0.081 14 0 "[ . 1 . 2]" 1
1194 1 46 TYR HB3 1 46 TYR HD2 2.550 . 3.363 2.684 2.642 2.739 . 0 0 "[ . 1 . 2]" 1
1195 1 115 GLU HA 1 115 GLU QG 1.939 . 2.409 2.282 2.057 2.588 0.179 16 0 "[ . 1 . 2]" 1
1196 1 9 ASN QD 1 115 GLU QG 3.160 . 4.408 3.367 2.105 4.226 . 0 0 "[ . 1 . 2]" 1
1197 1 102 GLU HG3 1 105 PHE HD2 3.310 . 4.680 4.803 4.715 5.016 0.336 7 0 "[ . 1 . 2]" 1
1198 1 81 PHE HE2 1 102 GLU HG3 4.314 . 6.640 3.969 3.829 4.131 . 0 0 "[ . 1 . 2]" 1
1199 1 81 PHE HD2 1 102 GLU HG3 3.812 . 5.629 2.415 2.324 2.478 . 0 0 "[ . 1 . 2]" 1
1200 1 81 PHE HA 1 102 GLU HG3 3.891 . 5.783 4.788 4.590 4.873 . 0 0 "[ . 1 . 2]" 1
1201 1 81 PHE HA 1 102 GLU HG2 3.881 . 5.763 6.011 5.968 6.057 0.294 2 0 "[ . 1 . 2]" 1
1202 1 10 GLN HG3 1 112 LEU HG 2.882 . 3.920 3.420 3.159 3.727 . 0 0 "[ . 1 . 2]" 1
1203 1 10 GLN HG2 1 112 LEU HG 2.450 . 3.200 1.849 1.670 2.086 0.030 9 0 "[ . 1 . 2]" 1
1204 1 12 GLN QG 1 16 ARG HG3 3.246 . 4.050 2.844 2.774 2.934 . 0 0 "[ . 1 . 2]" 1
1205 1 75 GLN QG 1 76 ASP HA 2.491 . 3.267 3.190 2.835 3.312 0.045 16 0 "[ . 1 . 2]" 1
1206 1 104 LEU MD2 1 107 GLN QG 3.185 . 4.453 3.006 2.842 3.101 . 0 0 "[ . 1 . 2]" 1
1207 1 55 MET HG2 1 77 PHE HE2 3.036 . 4.188 2.381 2.236 2.502 . 0 0 "[ . 1 . 2]" 1
1208 1 55 MET HG3 1 77 PHE HE2 2.985 . 4.099 3.177 3.078 3.266 . 0 0 "[ . 1 . 2]" 1
1209 1 71 GLN HG2 1 74 ILE MG 3.441 . 4.921 4.005 3.861 4.138 . 0 0 "[ . 1 . 2]" 1
1210 1 33 GLN HA 1 33 GLN HG2 2.402 . 3.123 3.263 3.018 3.483 0.360 17 0 "[ . 1 . 2]" 1
1211 1 33 GLN HG3 1 34 PRO QD 2.701 . 3.468 2.493 1.804 3.440 . 0 0 "[ . 1 . 2]" 1
1212 1 50 LYS HB2 1 50 LYS QG 2.158 . 2.740 2.162 2.156 2.168 . 0 0 "[ . 1 . 2]" 1
1213 1 49 ILE MG 1 52 PRO HB3 2.550 . 3.363 3.179 3.149 3.212 . 0 0 "[ . 1 . 2]" 1
1214 1 49 ILE MG 1 52 PRO HB2 3.177 . 4.439 3.956 3.934 4.011 . 0 0 "[ . 1 . 2]" 1
1215 1 52 PRO HB3 1 52 PRO HD3 2.947 . 4.033 4.076 4.066 4.089 0.056 2 0 "[ . 1 . 2]" 1
1216 1 52 PRO HB3 1 52 PRO HD2 2.943 . 4.026 3.856 3.812 3.884 . 0 0 "[ . 1 . 2]" 1
1217 1 52 PRO HB2 1 52 PRO HD2 2.580 . 3.412 2.847 2.774 2.894 . 0 0 "[ . 1 . 2]" 1
1218 1 52 PRO HA 1 52 PRO HB3 2.037 . 2.556 2.275 2.267 2.282 . 0 0 "[ . 1 . 2]" 1
1219 1 45 TYR HD1 1 52 PRO HB3 3.311 . 4.681 3.237 3.195 3.280 . 0 0 "[ . 1 . 2]" 1
1220 1 45 TYR HD1 1 52 PRO HB2 3.143 . 4.378 4.471 4.430 4.519 0.141 15 0 "[ . 1 . 2]" 1
1221 1 45 TYR HE1 1 52 PRO HB3 2.641 . 3.513 2.507 2.446 2.543 . 0 0 "[ . 1 . 2]" 1
1222 1 45 TYR HE1 1 52 PRO HB2 3.031 . 4.180 4.214 4.154 4.253 0.073 1 0 "[ . 1 . 2]" 1
1223 1 46 TYR HE1 1 52 PRO HB3 2.406 . 3.130 2.294 2.242 2.385 . 0 0 "[ . 1 . 2]" 1
1224 1 34 PRO HB3 1 34 PRO QD 3.254 . 4.578 3.263 3.206 3.495 . 0 0 "[ . 1 . 2]" 1
1225 1 34 PRO HA 1 34 PRO HB2 2.009 . 2.514 2.738 2.706 2.819 0.305 18 0 "[ . 1 . 2]" 1
1226 1 47 LYS HB2 1 47 LYS QE 2.692 . 3.598 2.645 1.737 3.564 0.049 10 0 "[ . 1 . 2]" 1
1227 1 26 GLN HG3 1 27 PHE HA 3.483 . 4.999 3.517 3.217 5.660 0.661 15 2 "[ . 1 +- 2]" 1
1228 1 26 GLN HA 1 27 PHE QD 3.736 . 5.481 5.234 5.112 5.275 . 0 0 "[ . 1 . 2]" 1
1229 1 26 GLN HA 1 29 TRP HD1 3.339 . 4.733 4.813 4.750 4.879 0.146 1 0 "[ . 1 . 2]" 1
1230 1 26 GLN HG3 1 27 PHE QD 2.327 . 3.004 2.986 2.865 3.795 0.791 15 2 "[ . 1 +- 2]" 1
1231 1 26 GLN HG3 1 27 PHE HE1 2.517 . 3.309 3.408 2.797 4.018 0.709 14 1 "[ . 1 +. 2]" 1
1232 1 26 GLN HG2 1 27 PHE HE1 2.946 . 4.031 3.223 2.645 3.438 . 0 0 "[ . 1 . 2]" 1
1233 1 20 LYS QB 1 20 LYS HG2 2.518 . 3.311 2.305 2.133 2.393 . 0 0 "[ . 1 . 2]" 1
1234 1 89 LYS HA 1 89 LYS HB2 2.909 . 3.966 2.967 2.244 3.020 . 0 0 "[ . 1 . 2]" 1
1235 1 89 LYS HB3 1 90 PRO QD 2.688 . 3.591 2.710 2.448 3.823 0.232 12 0 "[ . 1 . 2]" 1
1236 1 113 PRO HB2 1 113 PRO HD2 2.425 . 3.160 3.232 3.202 3.267 0.107 19 0 "[ . 1 . 2]" 1
1237 1 34 PRO HB2 1 34 PRO QD 2.601 . 3.447 3.465 3.193 3.511 0.064 5 0 "[ . 1 . 2]" 1
1238 1 53 MET HA 1 53 MET HB2 2.842 . 3.852 2.341 2.331 2.357 . 0 0 "[ . 1 . 2]" 1
1239 1 89 LYS HB3 1 89 LYS QG 2.156 . 2.737 2.414 2.119 2.509 . 0 0 "[ . 1 . 2]" 1
1240 1 30 PRO HB3 1 30 PRO HD2 3.293 . 4.648 3.919 3.907 3.932 . 0 0 "[ . 1 . 2]" 1
1241 1 95 VAL HB 1 95 VAL MG2 1.997 . 2.496 2.112 2.103 2.115 . 0 0 "[ . 1 . 2]" 1
1242 1 95 VAL HA 1 95 VAL HB 2.603 . 3.450 2.212 2.191 2.219 . 0 0 "[ . 1 . 2]" 1
1243 1 53 MET HG2 1 80 MET HB2 2.720 . 3.645 3.109 2.828 3.767 0.122 18 0 "[ . 1 . 2]" 1
1244 1 14 LEU MD2 1 18 VAL HB 2.328 . 3.005 2.310 2.258 2.351 . 0 0 "[ . 1 . 2]" 1
1245 1 14 LEU HA 1 18 VAL HB 2.003 . 2.504 1.921 1.883 1.948 . 0 0 "[ . 1 . 2]" 1
1246 1 96 LEU MD2 1 99 GLU HB3 3.703 . 5.417 4.306 4.249 4.376 . 0 0 "[ . 1 . 2]" 1
1247 1 13 TYR HE1 1 111 GLU HB2 3.016 . 4.153 4.083 3.945 4.177 0.024 9 0 "[ . 1 . 2]" 1
1248 1 33 GLN HA 1 33 GLN HB3 2.193 . 2.794 2.788 2.547 2.905 0.111 20 0 "[ . 1 . 2]" 1
1249 1 33 GLN HA 1 33 GLN HB2 2.183 . 2.779 2.371 2.201 2.983 0.204 14 0 "[ . 1 . 2]" 1
1250 1 33 GLN HB2 1 34 PRO QD 2.399 . 2.990 2.836 2.450 3.531 0.541 11 2 "[ - 1+ . 2]" 1
1251 1 102 GLU HB3 1 102 GLU HG3 2.347 . 3.035 2.958 2.947 2.969 . 0 0 "[ . 1 . 2]" 1
1252 1 107 GLN HB3 1 108 LYS HE2 3.166 . 4.419 2.607 2.518 2.721 . 0 0 "[ . 1 . 2]" 1
1253 1 107 GLN HB3 1 108 LYS HE3 3.208 . 4.495 4.217 4.153 4.335 . 0 0 "[ . 1 . 2]" 1
1254 1 107 GLN HB2 1 108 LYS HE3 3.744 . 5.496 5.668 5.571 5.717 0.221 19 0 "[ . 1 . 2]" 1
1255 1 107 GLN HB2 1 108 LYS HE2 3.020 . 4.160 3.978 3.900 4.059 . 0 0 "[ . 1 . 2]" 1
1256 1 83 ASN HA 1 86 ILE HG13 2.861 . 3.884 3.557 3.462 3.671 . 0 0 "[ . 1 . 2]" 1
1257 1 94 ILE MD 1 94 ILE HG12 2.834 . 3.838 2.126 2.122 2.131 . 0 0 "[ . 1 . 2]" 1
1258 1 94 ILE HB 1 94 ILE HG13 2.613 . 3.467 3.043 3.034 3.049 . 0 0 "[ . 1 . 2]" 1
1259 1 94 ILE HB 1 94 ILE HG12 2.995 . 4.116 2.508 2.483 2.532 . 0 0 "[ . 1 . 2]" 1
1260 1 94 ILE HA 1 94 ILE HG12 3.206 . 4.491 3.775 3.715 3.830 . 0 0 "[ . 1 . 2]" 1
1261 1 31 PHE HZ 1 94 ILE HG13 2.698 . 3.608 3.109 2.922 3.214 . 0 0 "[ . 1 . 2]" 1
1262 1 31 PHE HE2 1 94 ILE HG13 2.968 . 4.069 4.217 4.155 4.281 0.212 17 0 "[ . 1 . 2]" 1
1263 1 61 ARG HB3 1 61 ARG HG3 2.322 . 2.996 2.950 2.538 3.009 0.013 2 0 "[ . 1 . 2]" 1
1264 1 14 LEU HG 1 112 LEU MD2 2.671 . 3.562 2.293 2.199 2.369 . 0 0 "[ . 1 . 2]" 1
1265 1 104 LEU MD2 1 107 GLN HB2 2.494 . 3.271 3.042 2.861 3.134 . 0 0 "[ . 1 . 2]" 1
1266 1 104 LEU MD2 1 107 GLN HB3 2.121 . 2.683 2.624 2.525 2.721 0.038 16 0 "[ . 1 . 2]" 1
1267 1 26 GLN QB 1 27 PHE HE1 2.997 . 4.120 3.996 3.446 4.049 . 0 0 "[ . 1 . 2]" 1
1268 1 75 GLN HA 1 75 GLN HB3 2.526 . 3.324 2.824 2.523 2.924 . 0 0 "[ . 1 . 2]" 1
1269 1 72 GLU HA 1 75 GLN HB3 3.100 . 4.301 2.341 1.995 3.351 . 0 0 "[ . 1 . 2]" 1
1270 1 72 GLU HA 1 75 GLN HB2 3.148 . 4.387 3.778 3.403 4.423 0.036 20 0 "[ . 1 . 2]" 1
1271 1 11 LEU MD1 1 11 LEU HG 2.491 . 3.267 2.117 2.114 2.121 . 0 0 "[ . 1 . 2]" 1
1272 1 11 LEU HA 1 11 LEU HG 2.851 . 3.867 2.733 2.665 2.798 . 0 0 "[ . 1 . 2]" 1
1273 1 13 TYR HB2 1 113 PRO HG3 3.020 . 4.160 3.445 3.358 3.548 . 0 0 "[ . 1 . 2]" 1
1274 1 13 TYR HB3 1 113 PRO HG2 3.432 . 4.904 3.290 3.263 3.341 . 0 0 "[ . 1 . 2]" 1
1275 1 13 TYR HB2 1 113 PRO HG2 2.900 . 3.951 2.135 2.020 2.264 . 0 0 "[ . 1 . 2]" 1
1276 1 113 PRO HD3 1 113 PRO HG2 2.179 . 2.773 2.757 2.747 2.772 . 0 0 "[ . 1 . 2]" 1
1277 1 10 GLN HA 1 113 PRO HG2 2.633 . 3.499 3.155 2.993 3.354 . 0 0 "[ . 1 . 2]" 1
1278 1 13 TYR HE2 1 113 PRO HG3 3.288 . 4.639 4.336 4.138 4.607 . 0 0 "[ . 1 . 2]" 1
1279 1 13 TYR HE2 1 113 PRO HG2 3.629 . 5.275 5.036 4.839 5.222 . 0 0 "[ . 1 . 2]" 1
1280 1 13 TYR HD2 1 113 PRO HG3 3.075 . 4.257 3.130 2.987 3.341 . 0 0 "[ . 1 . 2]" 1
1281 1 113 PRO HB3 1 113 PRO HG3 2.281 . 2.931 2.285 2.278 2.292 . 0 0 "[ . 1 . 2]" 1
1282 1 33 GLN HA 1 34 PRO HG3 3.058 . 4.227 4.169 3.847 4.253 0.026 3 0 "[ . 1 . 2]" 1
1283 1 71 GLN HA 1 71 GLN HB3 2.410 . 3.136 3.000 2.996 3.005 . 0 0 "[ . 1 . 2]" 1
1284 1 71 GLN HB2 1 71 GLN HG3 2.383 . 3.093 2.358 2.316 2.387 . 0 0 "[ . 1 . 2]" 1
1285 1 71 GLN HB2 1 74 ILE MD 3.151 . 4.392 3.224 3.169 3.350 . 0 0 "[ . 1 . 2]" 1
1286 1 108 LYS HA 1 108 LYS HD3 2.480 . 3.249 1.858 1.821 1.900 . 0 0 "[ . 1 . 2]" 1
1287 1 108 LYS HB2 1 108 LYS HD2 2.878 . 3.914 3.738 3.723 3.756 . 0 0 "[ . 1 . 2]" 1
1288 1 17 VAL MG2 1 108 LYS HD3 2.934 . 4.010 3.315 3.274 3.346 . 0 0 "[ . 1 . 2]" 1
1289 1 27 PHE HB2 1 101 LEU MD1 3.057 . 4.225 2.513 2.441 2.667 . 0 0 "[ . 1 . 2]" 1
1290 1 98 ALA HA 1 101 LEU MD1 3.996 . 5.992 2.147 1.936 2.225 0.064 19 0 "[ . 1 . 2]" 1
1291 1 101 LEU HB2 1 101 LEU MD1 2.320 . 2.993 2.160 2.149 2.173 . 0 0 "[ . 1 . 2]" 1
1292 1 28 ALA MB 1 101 LEU MD1 2.723 . 3.650 3.200 3.164 3.234 . 0 0 "[ . 1 . 2]" 1
1293 1 101 LEU HB3 1 101 LEU MD1 2.391 . 3.106 2.474 2.462 2.481 . 0 0 "[ . 1 . 2]" 1
1294 1 80 MET ME 1 101 LEU MD1 3.567 . 5.157 3.392 3.190 3.535 . 0 0 "[ . 1 . 2]" 1
1295 1 101 LEU MD1 1 101 LEU MD2 2.250 . 2.883 2.009 2.003 2.016 . 0 0 "[ . 1 . 2]" 1
1296 1 81 PHE HZ 1 101 LEU MD1 3.401 . 4.847 3.878 3.776 4.014 . 0 0 "[ . 1 . 2]" 1
1297 1 81 PHE HE1 1 101 LEU MD1 3.014 . 4.150 2.424 2.296 2.611 . 0 0 "[ . 1 . 2]" 1
1298 1 81 PHE HD1 1 101 LEU MD1 3.556 . 5.136 3.429 3.305 3.597 . 0 0 "[ . 1 . 2]" 1
1299 1 31 PHE HE1 1 101 LEU MD1 2.449 . 3.199 2.218 2.197 2.228 . 0 0 "[ . 1 . 2]" 1
1300 1 31 PHE HD1 1 101 LEU MD1 2.397 . 3.115 2.448 2.274 2.502 . 0 0 "[ . 1 . 2]" 1
1301 1 30 PRO HD2 1 30 PRO HG2 2.467 . 3.228 2.226 2.220 2.232 . 0 0 "[ . 1 . 2]" 1
1302 1 11 LEU HA 1 14 LEU MD1 2.212 . 2.824 2.786 2.764 2.809 . 0 0 "[ . 1 . 2]" 1
1303 1 14 LEU MD1 1 73 CYS HB3 1.960 . 2.440 1.701 1.537 1.758 . 0 0 "[ . 1 . 2]" 1
1304 1 14 LEU MD1 1 74 ILE HG13 2.851 . 3.867 1.581 1.435 1.819 0.400 14 0 "[ . 1 . 2]" 1
1305 1 14 LEU HB2 1 14 LEU MD1 2.211 . 2.822 2.277 2.237 2.305 . 0 0 "[ . 1 . 2]" 1
1306 1 14 LEU MD1 1 70 ALA MB 2.358 . 3.053 2.047 1.770 2.189 . 0 0 "[ . 1 . 2]" 1
1307 1 14 LEU MD1 1 62 LEU MD2 2.830 . 3.831 3.018 2.874 3.091 . 0 0 "[ . 1 . 2]" 1
1308 1 14 LEU MD1 1 77 PHE HE1 3.195 . 4.471 3.274 3.103 3.706 . 0 0 "[ . 1 . 2]" 1
1309 1 92 ASP HA 1 95 VAL MG1 3.265 . 4.597 3.406 3.384 3.430 . 0 0 "[ . 1 . 2]" 1
1310 1 84 CYS HB3 1 95 VAL MG1 3.276 . 4.618 3.918 3.822 4.115 . 0 0 "[ . 1 . 2]" 1
1311 1 92 ASP HB3 1 95 VAL MG1 2.361 . 3.058 1.816 1.760 1.872 . 0 0 "[ . 1 . 2]" 1
1312 1 88 ASN HB2 1 95 VAL MG1 2.377 . 3.084 2.134 1.856 2.327 . 0 0 "[ . 1 . 2]" 1
1313 1 95 VAL HB 1 95 VAL MG1 2.133 . 2.702 2.092 2.085 2.098 . 0 0 "[ . 1 . 2]" 1
1314 1 85 TYR HD1 1 95 VAL MG1 2.553 . 3.368 3.061 2.876 3.115 . 0 0 "[ . 1 . 2]" 1
1315 1 109 ILE QG 1 109 ILE MG 2.065 . 2.598 2.322 2.314 2.327 . 0 0 "[ . 1 . 2]" 1
1316 1 15 LEU MD1 1 16 ARG HA 2.352 . 3.044 2.324 2.254 2.392 . 0 0 "[ . 1 . 2]" 1
1317 1 19 LEU HA 1 22 LEU MD1 2.922 . 3.989 2.818 2.767 2.884 . 0 0 "[ . 1 . 2]" 1
1318 1 104 LEU HA 1 104 LEU MD1 3.000 . 4.125 3.438 3.404 3.453 . 0 0 "[ . 1 . 2]" 1
1319 1 30 PRO HD3 1 30 PRO HG3 2.829 . 3.829 2.225 2.220 2.232 . 0 0 "[ . 1 . 2]" 1
1320 1 30 PRO HD2 1 30 PRO HG3 2.662 . 3.548 2.819 2.804 2.829 . 0 0 "[ . 1 . 2]" 1
1321 1 30 PRO HG3 1 31 PHE HZ 3.671 . 5.355 4.765 4.700 4.887 . 0 0 "[ . 1 . 2]" 1
1322 1 84 CYS HB2 1 95 VAL HA 3.444 . 4.927 3.464 3.347 3.868 . 0 0 "[ . 1 . 2]" 1
1323 1 81 PHE HD1 1 84 CYS HB2 3.669 . 5.352 4.302 4.185 4.841 . 0 0 "[ . 1 . 2]" 1
1324 1 70 ALA HA 1 73 CYS HB2 2.569 . 3.394 3.526 2.927 3.668 0.274 20 0 "[ . 1 . 2]" 1
1325 1 13 TYR HE1 1 112 LEU MD1 2.792 . 3.766 3.503 3.392 3.604 . 0 0 "[ . 1 . 2]" 1
1326 1 13 TYR HE1 1 112 LEU MD2 3.237 . 4.547 4.168 4.138 4.218 . 0 0 "[ . 1 . 2]" 1
1327 1 109 ILE HA 1 112 LEU MD1 2.757 . 3.707 3.580 3.523 3.629 . 0 0 "[ . 1 . 2]" 1
1328 1 13 TYR HB2 1 112 LEU MD1 3.525 . 5.078 3.049 2.963 3.111 . 0 0 "[ . 1 . 2]" 1
1329 1 13 TYR HB3 1 112 LEU MD1 3.201 . 4.482 2.171 2.116 2.247 . 0 0 "[ . 1 . 2]" 1
1330 1 10 GLN HG3 1 112 LEU MD1 3.112 . 4.323 2.704 2.548 2.820 . 0 0 "[ . 1 . 2]" 1
1331 1 112 LEU MD1 1 113 PRO HD2 2.548 . 3.359 1.359 1.261 1.488 0.476 2 0 "[ . 1 . 2]" 1
1332 1 10 GLN HB3 1 112 LEU MD2 2.430 . 3.168 2.278 2.196 2.402 . 0 0 "[ . 1 . 2]" 1
1333 1 10 GLN HB3 1 112 LEU MD1 2.656 . 3.538 1.993 1.933 2.045 . 0 0 "[ . 1 . 2]" 1
1334 1 112 LEU HB2 1 112 LEU MD1 2.186 . 2.784 2.556 2.530 2.585 . 0 0 "[ . 1 . 2]" 1
1335 1 109 ILE MD 1 112 LEU MD2 2.504 . 3.288 2.687 2.653 2.732 . 0 0 "[ . 1 . 2]" 1
1336 1 15 LEU MD1 1 15 LEU HG 2.096 . 2.645 2.107 2.102 2.113 . 0 0 "[ . 1 . 2]" 1
1337 1 11 LEU MD1 1 70 ALA HA 3.178 . 4.441 3.608 3.532 3.680 . 0 0 "[ . 1 . 2]" 1
1338 1 8 THR HA 1 11 LEU MD1 2.749 . 3.694 2.578 2.158 2.799 . 0 0 "[ . 1 . 2]" 1
1339 1 11 LEU MD1 1 62 LEU HA 3.476 . 4.986 4.392 4.272 4.665 . 0 0 "[ . 1 . 2]" 1
1340 1 11 LEU MD1 1 67 TYR HA 3.538 . 5.103 4.191 4.059 4.374 . 0 0 "[ . 1 . 2]" 1
1341 1 11 LEU MD1 1 67 TYR HB3 2.706 . 3.621 2.743 2.562 2.946 . 0 0 "[ . 1 . 2]" 1
1342 1 6 ARG HD2 1 11 LEU MD1 2.447 . 3.195 2.579 2.066 3.326 0.131 1 0 "[ . 1 . 2]" 1
1343 1 6 ARG HD3 1 11 LEU MD1 2.755 . 3.703 1.979 1.823 2.943 . 0 0 "[ . 1 . 2]" 1
1344 1 11 LEU MD1 1 73 CYS HB3 3.847 . 5.697 5.095 4.954 5.803 0.106 8 0 "[ . 1 . 2]" 1
1345 1 11 LEU HB3 1 11 LEU MD1 2.220 . 2.836 2.440 2.381 2.514 . 0 0 "[ . 1 . 2]" 1
1346 1 6 ARG HG2 1 11 LEU MD1 3.124 . 4.344 2.953 2.241 3.182 . 0 0 "[ . 1 . 2]" 1
1347 1 11 LEU MD1 1 62 LEU MD2 3.003 . 4.130 3.587 3.516 3.697 . 0 0 "[ . 1 . 2]" 1
1348 1 93 ASP HA 1 96 LEU MD1 2.090 . 2.636 2.515 2.402 2.607 . 0 0 "[ . 1 . 2]" 1
1349 1 103 LYS HE2 1 103 LYS QG 2.408 . 2.616 2.534 2.161 2.916 0.300 9 0 "[ . 1 . 2]" 1
1350 1 60 LYS QE 1 60 LYS HG2 2.179 . 2.772 2.601 2.167 3.177 0.405 10 0 "[ . 1 . 2]" 1
1351 1 49 ILE MD 1 49 ILE HG12 2.254 . 2.889 2.099 2.080 2.103 . 0 0 "[ . 1 . 2]" 1
1352 1 49 ILE MD 1 49 ILE HG13 2.463 . 3.222 2.100 2.087 2.104 . 0 0 "[ . 1 . 2]" 1
1353 1 49 ILE HB 1 49 ILE HG13 2.693 . 3.599 2.359 2.338 2.507 . 0 0 "[ . 1 . 2]" 1
1354 1 49 ILE HA 1 49 ILE HG13 3.997 . 5.994 3.753 3.664 3.772 . 0 0 "[ . 1 . 2]" 1
1355 1 22 LEU HB3 1 22 LEU MD2 2.620 . 3.478 2.161 2.152 2.172 . 0 0 "[ . 1 . 2]" 1
1356 1 22 LEU MD2 1 101 LEU HB2 2.827 . 3.826 3.274 3.253 3.292 . 0 0 "[ . 1 . 2]" 1
1357 1 5 LYS HE2 1 5 LYS QG 2.331 . 3.010 2.635 2.325 3.406 0.396 15 0 "[ . 1 . 2]" 1
1358 1 14 LEU MD2 1 18 VAL HA 3.357 . 4.766 4.289 4.246 4.334 . 0 0 "[ . 1 . 2]" 1
1359 1 13 TYR HE1 1 14 LEU MD2 3.189 . 4.460 4.209 4.195 4.234 . 0 0 "[ . 1 . 2]" 1
1360 1 14 LEU MD2 1 105 PHE HE1 2.740 . 3.678 1.716 1.663 1.821 0.139 16 0 "[ . 1 . 2]" 1
1361 1 14 LEU MD2 1 77 PHE HD1 3.320 . 4.698 2.581 2.497 2.659 . 0 0 "[ . 1 . 2]" 1
1362 1 14 LEU HB3 1 14 LEU MD2 2.383 . 3.093 2.389 2.324 2.418 . 0 0 "[ . 1 . 2]" 1
1363 1 14 LEU MD2 1 14 LEU HG 2.254 . 2.889 2.109 2.105 2.113 . 0 0 "[ . 1 . 2]" 1
1364 1 104 LEU MD2 1 108 LYS HD3 2.806 . 3.790 3.710 3.681 3.733 . 0 0 "[ . 1 . 2]" 1
1365 1 11 LEU HB3 1 11 LEU MD2 2.117 . 2.677 2.269 2.193 2.331 . 0 0 "[ . 1 . 2]" 1
1366 1 11 LEU MD2 1 11 LEU HG 2.399 . 3.119 2.116 2.109 2.121 . 0 0 "[ . 1 . 2]" 1
1367 1 42 LEU MD2 1 43 PRO HD2 3.495 . 5.022 4.355 3.657 4.473 . 0 0 "[ . 1 . 2]" 1
1368 1 53 MET HA 1 79 THR MG 3.053 . 4.218 4.047 3.997 4.094 . 0 0 "[ . 1 . 2]" 1
1369 1 8 THR MG 1 12 GLN HB2 2.304 . 2.967 3.014 2.886 3.085 0.118 2 0 "[ . 1 . 2]" 1
1370 1 8 THR HB 1 8 THR MG 2.083 . 2.625 2.134 2.133 2.137 . 0 0 "[ . 1 . 2]" 1
1371 1 105 PHE HZ 1 106 LEU MD2 2.825 . 3.823 3.539 3.516 3.562 . 0 0 "[ . 1 . 2]" 1
1372 1 85 TYR HE1 1 95 VAL MG2 2.213 . 2.825 1.902 1.867 2.022 . 0 0 "[ . 1 . 2]" 1
1373 1 85 TYR HD1 1 95 VAL MG2 2.360 . 3.056 2.486 2.413 2.586 . 0 0 "[ . 1 . 2]" 1
1374 1 95 VAL MG2 1 96 LEU HA 2.737 . 3.674 2.925 2.901 2.962 . 0 0 "[ . 1 . 2]" 1
1375 1 95 VAL MG2 1 99 GLU HG3 2.432 . 3.171 1.725 1.658 1.767 0.035 19 0 "[ . 1 . 2]" 1
1376 1 95 VAL MG2 1 99 GLU HB3 3.194 . 4.469 4.286 4.258 4.306 . 0 0 "[ . 1 . 2]" 1
1377 1 13 TYR HE1 1 18 VAL MG2 3.101 . 4.303 2.488 2.441 2.525 . 0 0 "[ . 1 . 2]" 1
1378 1 18 VAL MG2 1 105 PHE HD1 2.902 . 3.955 3.284 3.256 3.313 . 0 0 "[ . 1 . 2]" 1
1379 1 13 TYR HD1 1 18 VAL MG2 2.767 . 3.724 2.438 2.394 2.467 . 0 0 "[ . 1 . 2]" 1
1380 1 18 VAL MG2 1 105 PHE HA 2.594 . 3.435 3.593 3.576 3.614 0.179 8 0 "[ . 1 . 2]" 1
1381 1 14 LEU HA 1 18 VAL MG2 2.501 . 3.283 1.659 1.633 1.694 0.086 6 0 "[ . 1 . 2]" 1
1382 1 18 VAL HA 1 18 VAL MG2 2.293 . 2.950 2.461 2.452 2.467 . 0 0 "[ . 1 . 2]" 1
1383 1 18 VAL HB 1 18 VAL MG2 2.454 . 3.207 2.104 2.102 2.106 . 0 0 "[ . 1 . 2]" 1
1384 1 18 VAL MG2 1 108 LYS HB3 2.635 . 3.503 2.026 2.009 2.042 . 0 0 "[ . 1 . 2]" 1
1385 1 18 VAL MG2 1 108 LYS HG3 2.854 . 3.872 2.639 2.599 2.704 . 0 0 "[ . 1 . 2]" 1
1386 1 18 VAL MG2 1 108 LYS HB2 2.264 . 2.905 1.621 1.590 1.643 0.033 2 0 "[ . 1 . 2]" 1
1387 1 18 VAL MG2 1 108 LYS HD2 3.705 . 5.420 3.806 3.763 3.873 . 0 0 "[ . 1 . 2]" 1
1388 1 14 LEU MD2 1 18 VAL MG2 2.142 . 2.716 1.439 1.416 1.474 0.152 20 0 "[ . 1 . 2]" 1
1389 1 18 VAL MG2 1 109 ILE MD 2.369 . 3.070 1.896 1.877 1.922 . 0 0 "[ . 1 . 2]" 1
1390 1 17 VAL MG2 1 18 VAL MG2 3.650 . 5.315 2.309 2.272 2.370 . 0 0 "[ . 1 . 2]" 1
1391 1 21 THR MG 1 22 LEU HG 2.562 . 3.382 3.420 3.400 3.447 0.065 19 0 "[ . 1 . 2]" 1
1392 1 18 VAL HA 1 21 THR MG 2.824 . 3.821 3.704 3.679 3.738 . 0 0 "[ . 1 . 2]" 1
1393 1 21 THR MG 1 22 LEU HA 3.253 . 4.576 3.576 3.518 3.616 . 0 0 "[ . 1 . 2]" 1
1394 1 53 MET HA 1 57 THR MG 3.298 . 4.658 3.856 3.700 3.944 . 0 0 "[ . 1 . 2]" 1
1395 1 57 THR MG 1 58 ILE HA 2.712 . 3.632 3.439 3.329 3.516 . 0 0 "[ . 1 . 2]" 1
1396 1 57 THR HB 1 57 THR MG 2.216 . 2.830 2.123 2.115 2.129 . 0 0 "[ . 1 . 2]" 1
1397 1 57 THR MG 1 61 ARG QD 2.496 . 3.275 2.884 2.721 3.081 . 0 0 "[ . 1 . 2]" 1
1398 1 53 MET ME 1 57 THR MG 2.632 . 3.498 1.948 1.909 1.993 . 0 0 "[ . 1 . 2]" 1
1399 1 57 THR MG 1 61 ARG HG3 2.344 . 3.031 2.931 2.751 3.405 0.374 16 0 "[ . 1 . 2]" 1
1400 1 57 THR MG 1 61 ARG HG2 3.322 . 4.702 3.470 2.912 3.888 . 0 0 "[ . 1 . 2]" 1
1401 1 17 VAL MG1 1 108 LYS HE3 4.093 . 6.187 5.363 5.330 5.414 . 0 0 "[ . 1 . 2]" 1
1402 1 13 TYR HD1 1 17 VAL MG1 2.452 . 3.204 3.196 3.182 3.212 0.008 14 0 "[ . 1 . 2]" 1
1403 1 17 VAL MG1 1 108 LYS HB3 2.596 . 3.438 3.432 3.393 3.461 0.023 16 0 "[ . 1 . 2]" 1
1404 1 23 TRP HA 1 28 ALA MB 2.107 . 2.662 2.558 2.476 2.628 . 0 0 "[ . 1 . 2]" 1
1405 1 25 HIS HB2 1 28 ALA MB 2.527 . 3.325 2.587 2.428 2.733 . 0 0 "[ . 1 . 2]" 1
1406 1 25 HIS HB3 1 28 ALA MB 3.049 . 4.211 2.321 2.206 2.490 . 0 0 "[ . 1 . 2]" 1
1407 1 28 ALA MB 1 55 MET HG2 3.073 . 4.253 4.248 4.217 4.291 0.038 17 0 "[ . 1 . 2]" 1
1408 1 28 ALA MB 1 55 MET HG3 3.210 . 4.498 4.450 4.423 4.467 . 0 0 "[ . 1 . 2]" 1
1409 1 28 ALA MB 1 32 GLN HG2 2.512 . 3.301 2.408 2.238 2.563 . 0 0 "[ . 1 . 2]" 1
1410 1 22 LEU MD2 1 28 ALA MB 3.391 . 4.828 4.042 3.997 4.120 . 0 0 "[ . 1 . 2]" 1
1411 1 24 LYS H 1 28 ALA MB 2.979 . 4.088 3.633 3.571 3.689 . 0 0 "[ . 1 . 2]" 1
1412 1 28 ALA MB 1 29 TRP H 3.444 . 4.927 3.286 3.266 3.306 . 0 0 "[ . 1 . 2]" 1
1413 1 38 VAL QG 1 39 LYS HB2 3.435 . 4.910 3.167 2.857 4.167 . 0 0 "[ . 1 . 2]" 1
1414 1 38 VAL QG 1 39 LYS HG3 3.242 . 4.556 4.191 3.663 4.373 . 0 0 "[ . 1 . 2]" 1
1415 1 35 VAL MG2 1 37 ALA MB 2.748 . 3.692 2.774 2.686 2.821 . 0 0 "[ . 1 . 2]" 1
1416 1 37 ALA MB 1 45 TYR HB3 2.581 . 3.413 2.082 1.944 2.305 . 0 0 "[ . 1 . 2]" 1
1417 1 37 ALA MB 1 45 TYR HB2 2.216 . 2.830 2.554 2.375 2.836 0.006 3 0 "[ . 1 . 2]" 1
1418 1 37 ALA MB 1 45 TYR HD1 3.043 . 4.200 2.716 2.606 2.974 . 0 0 "[ . 1 . 2]" 1
1419 1 37 ALA MB 1 45 TYR HE1 3.868 . 5.739 4.509 4.398 4.705 . 0 0 "[ . 1 . 2]" 1
1420 1 37 ALA MB 1 46 TYR HE1 2.693 . 3.599 3.408 3.294 3.463 . 0 0 "[ . 1 . 2]" 1
1421 1 37 ALA MB 1 46 TYR HD1 2.715 . 3.637 3.502 3.448 3.549 . 0 0 "[ . 1 . 2]" 1
1422 1 94 ILE HB 1 97 MET ME 3.368 . 4.786 3.099 2.948 4.241 . 0 0 "[ . 1 . 2]" 1
1423 1 94 ILE HA 1 94 ILE HB 2.107 . 2.662 2.357 2.323 2.386 . 0 0 "[ . 1 . 2]" 1
1424 1 29 TRP HZ2 1 94 ILE HB 2.774 . 3.736 3.948 3.835 4.038 0.302 7 0 "[ . 1 . 2]" 1
1425 1 94 ILE HG13 1 98 ALA MB 3.099 . 4.300 3.297 3.200 3.384 . 0 0 "[ . 1 . 2]" 1
1426 1 95 VAL MG2 1 98 ALA MB 2.861 . 3.885 3.611 3.589 3.644 . 0 0 "[ . 1 . 2]" 1
1427 1 84 CYS HB3 1 98 ALA MB 2.742 . 3.682 2.881 2.701 2.936 . 0 0 "[ . 1 . 2]" 1
1428 1 98 ALA MB 1 99 GLU HG3 2.985 . 4.099 3.849 3.652 3.974 . 0 0 "[ . 1 . 2]" 1
1429 1 98 ALA HA 1 98 ALA MB 2.217 . 2.832 2.125 2.123 2.128 . 0 0 "[ . 1 . 2]" 1
1430 1 81 PHE HA 1 98 ALA MB 2.532 . 3.333 2.006 1.962 2.047 . 0 0 "[ . 1 . 2]" 1
1431 1 109 ILE MG 1 112 LEU HB2 3.566 . 5.155 2.389 2.322 2.461 . 0 0 "[ . 1 . 2]" 1
1432 1 55 MET HA 1 58 ILE MG 2.494 . 3.272 3.141 3.120 3.175 . 0 0 "[ . 1 . 2]" 1
1433 1 19 LEU HG 1 58 ILE MG 3.275 . 4.616 3.873 3.832 3.958 . 0 0 "[ . 1 . 2]" 1
1434 1 58 ILE MG 1 77 PHE HZ 2.666 . 3.554 2.319 2.280 2.356 . 0 0 "[ . 1 . 2]" 1
1435 1 30 PRO HG3 1 97 MET ME 2.115 . 2.674 1.790 1.449 2.204 0.107 7 0 "[ . 1 . 2]" 1
1436 1 49 ILE HA 1 86 ILE MG 3.115 . 4.328 1.921 1.854 2.003 0.048 19 0 "[ . 1 . 2]" 1
1437 1 86 ILE MG 1 87 TYR HB3 3.277 . 4.619 4.446 4.420 4.473 . 0 0 "[ . 1 . 2]" 1
1438 1 48 ILE HB 1 86 ILE MG 2.969 . 4.071 3.767 3.731 3.819 . 0 0 "[ . 1 . 2]" 1
1439 1 50 LYS QG 1 86 ILE MG 3.158 . 4.405 2.817 2.679 2.965 . 0 0 "[ . 1 . 2]" 1
1440 1 49 ILE MG 1 86 ILE MG 3.138 . 4.369 3.010 2.953 3.081 . 0 0 "[ . 1 . 2]" 1
1441 1 48 ILE HB 1 48 ILE MG 2.302 . 2.965 2.071 2.069 2.075 . 0 0 "[ . 1 . 2]" 1
1442 1 48 ILE MG 1 86 ILE HB 3.293 . 4.648 3.955 3.911 4.012 . 0 0 "[ . 1 . 2]" 1
1443 1 48 ILE MG 1 49 ILE MD 2.357 . 3.051 2.656 1.604 2.743 0.059 18 0 "[ . 1 . 2]" 1
1444 1 48 ILE MG 1 87 TYR HB2 2.732 . 3.665 3.180 3.156 3.215 . 0 0 "[ . 1 . 2]" 1
1445 1 48 ILE MG 1 87 TYR HB3 3.296 . 4.654 4.344 4.298 4.390 . 0 0 "[ . 1 . 2]" 1
1446 1 48 ILE MG 1 87 TYR HA 2.409 . 3.134 2.301 2.205 2.409 . 0 0 "[ . 1 . 2]" 1
1447 1 48 ILE MG 1 87 TYR HD1 2.513 . 3.303 2.117 2.019 2.336 . 0 0 "[ . 1 . 2]" 1
1448 1 49 ILE MG 1 83 ASN QB 2.670 . 3.561 1.768 1.617 1.876 0.189 18 0 "[ . 1 . 2]" 1
1449 1 49 ILE MG 1 52 PRO HD3 2.658 . 3.541 2.049 1.967 2.177 . 0 0 "[ . 1 . 2]" 1
1450 1 49 ILE MG 1 52 PRO HD2 3.221 . 4.518 3.404 3.359 3.493 . 0 0 "[ . 1 . 2]" 1
1451 1 49 ILE MG 1 83 ASN HA 2.799 . 3.779 2.685 2.631 2.736 . 0 0 "[ . 1 . 2]" 1
1452 1 45 TYR HD1 1 49 ILE MG 3.379 . 4.807 4.252 4.180 4.318 . 0 0 "[ . 1 . 2]" 1
1453 1 46 TYR HA 1 49 ILE MG 3.699 . 5.409 4.349 4.197 4.432 . 0 0 "[ . 1 . 2]" 1
1454 1 46 TYR HE1 1 49 ILE MG 3.324 . 4.705 4.406 4.341 4.440 . 0 0 "[ . 1 . 2]" 1
1455 1 49 ILE MG 1 87 TYR HD1 3.675 . 5.363 4.824 4.787 4.896 . 0 0 "[ . 1 . 2]" 1
1456 1 46 TYR HD1 1 49 ILE MG 3.624 . 5.265 4.254 4.205 4.322 . 0 0 "[ . 1 . 2]" 1
1457 1 49 ILE MD 1 49 ILE MG 2.563 . 3.384 1.947 1.911 2.019 . 0 0 "[ . 1 . 2]" 1
1458 1 80 MET HB3 1 80 MET ME 2.376 . 3.081 1.846 1.798 1.944 . 0 0 "[ . 1 . 2]" 1
1459 1 80 MET ME 1 80 MET HG2 1.982 . 2.473 2.617 2.410 3.313 0.840 11 4 "[ . * 1+ . - *]" 1
1460 1 31 PHE HB3 1 80 MET ME 2.730 . 3.662 2.752 2.436 2.973 . 0 0 "[ . 1 . 2]" 1
1461 1 22 LEU HB3 1 55 MET ME 2.387 . 3.099 1.348 1.307 1.392 0.368 11 0 "[ . 1 . 2]" 1
1462 1 74 ILE MG 1 105 PHE HD2 3.915 . 5.831 4.537 4.497 4.567 . 0 0 "[ . 1 . 2]" 1
1463 1 74 ILE MG 1 105 PHE HZ 2.359 . 3.055 1.279 1.243 1.301 0.420 5 0 "[ . 1 . 2]" 1
1464 1 74 ILE MG 1 105 PHE HE2 2.851 . 3.867 2.517 2.472 2.565 . 0 0 "[ . 1 . 2]" 1
1465 1 74 ILE MG 1 75 GLN HA 3.174 . 4.433 3.161 3.049 3.223 . 0 0 "[ . 1 . 2]" 1
1466 1 71 GLN HG3 1 74 ILE MG 4.216 . 6.438 3.563 3.367 3.664 . 0 0 "[ . 1 . 2]" 1
1467 1 74 ILE HB 1 74 ILE MG 2.363 . 3.061 2.112 2.109 2.120 . 0 0 "[ . 1 . 2]" 1
1468 1 74 ILE HG13 1 74 ILE MG 3.573 . 5.169 3.217 3.212 3.225 . 0 0 "[ . 1 . 2]" 1
1469 1 53 MET ME 1 57 THR HB 3.278 . 4.621 3.256 3.124 3.344 . 0 0 "[ . 1 . 2]" 1
1470 1 53 MET ME 1 76 ASP HB2 2.988 . 4.104 3.473 3.365 3.535 . 0 0 "[ . 1 . 2]" 1
1471 1 53 MET ME 1 53 MET HG2 2.600 . 3.445 2.238 2.124 2.290 . 0 0 "[ . 1 . 2]" 1
1472 1 53 MET ME 1 76 ASP HB3 2.532 . 3.333 2.085 2.030 2.148 . 0 0 "[ . 1 . 2]" 1
1473 1 53 MET HB2 1 53 MET ME 2.430 . 3.168 2.285 2.213 2.417 . 0 0 "[ . 1 . 2]" 1
1474 1 53 MET ME 1 58 ILE MD 3.239 . 4.550 3.122 3.021 3.222 . 0 0 "[ . 1 . 2]" 1
1475 1 30 PRO HG3 1 94 ILE MD 2.654 . 3.534 2.015 1.969 2.093 . 0 0 "[ . 1 . 2]" 1
1476 1 30 PRO HA 1 30 PRO HG3 2.797 . 3.775 3.945 3.921 3.970 0.195 14 0 "[ . 1 . 2]" 1
1477 1 30 PRO HA 1 30 PRO HB3 2.293 . 2.950 2.290 2.280 2.302 . 0 0 "[ . 1 . 2]" 1
1478 1 30 PRO HA 1 30 PRO HB2 2.141 . 2.714 2.678 2.666 2.692 . 0 0 "[ . 1 . 2]" 1
1479 1 30 PRO HA 1 30 PRO HD3 3.365 . 4.781 3.907 3.890 3.917 . 0 0 "[ . 1 . 2]" 1
1480 1 30 PRO HA 1 30 PRO HD2 3.543 . 5.112 4.002 3.990 4.010 . 0 0 "[ . 1 . 2]" 1
1481 1 74 ILE MD 1 109 ILE MG 2.402 . 3.123 1.714 1.688 1.734 . 0 0 "[ . 1 . 2]" 1
1482 1 74 ILE MD 1 74 ILE HG13 2.427 . 3.163 2.095 2.091 2.097 . 0 0 "[ . 1 . 2]" 1
1483 1 74 ILE HB 1 74 ILE MD 2.145 . 2.720 2.363 2.338 2.381 . 0 0 "[ . 1 . 2]" 1
1484 1 74 ILE MD 1 105 PHE HZ 2.488 . 3.262 3.253 3.231 3.290 0.028 16 0 "[ . 1 . 2]" 1
1485 1 83 ASN HA 1 86 ILE MD 2.359 . 3.055 1.937 1.861 2.027 . 0 0 "[ . 1 . 2]" 1
1486 1 86 ILE MD 1 86 ILE HG13 2.190 . 2.790 2.118 2.115 2.119 . 0 0 "[ . 1 . 2]" 1
1487 1 82 THR MG 1 86 ILE MD 2.079 . 2.619 2.240 2.179 2.305 . 0 0 "[ . 1 . 2]" 1
1488 1 13 TYR HE1 1 109 ILE MD 2.977 . 4.085 2.618 2.597 2.661 . 0 0 "[ . 1 . 2]" 1
1489 1 77 PHE HD1 1 109 ILE MD 3.452 . 4.941 4.369 4.319 4.398 . 0 0 "[ . 1 . 2]" 1
1490 1 48 ILE MD 1 87 TYR HE1 2.009 . 2.513 1.890 1.783 2.172 . 0 0 "[ . 1 . 2]" 1
1491 1 48 ILE MD 1 87 TYR HD1 2.616 . 3.471 2.864 2.731 2.945 . 0 0 "[ . 1 . 2]" 1
1492 1 48 ILE MD 1 87 TYR HA 3.325 . 4.707 3.117 2.997 3.309 . 0 0 "[ . 1 . 2]" 1
1493 1 44 ASP HA 1 48 ILE MD 3.234 . 4.541 4.147 3.894 4.265 . 0 0 "[ . 1 . 2]" 1
1494 1 45 TYR HA 1 48 ILE MD 2.821 . 3.815 3.689 3.606 3.756 . 0 0 "[ . 1 . 2]" 1
1495 1 44 ASP QB 1 48 ILE MD 2.332 . 3.011 1.708 1.611 1.808 0.111 15 0 "[ . 1 . 2]" 1
1496 1 47 LYS HB2 1 48 ILE MD 3.013 . 4.148 4.162 3.912 5.052 0.904 1 4 "[+ . - *. *2]" 1
1497 1 48 ILE HB 1 48 ILE MD 2.457 . 3.211 2.340 2.273 2.357 . 0 0 "[ . 1 . 2]" 1
1498 1 48 ILE MD 1 48 ILE HG13 2.159 . 2.742 2.112 2.102 2.115 . 0 0 "[ . 1 . 2]" 1
1499 1 58 ILE MD 1 77 PHE HD2 2.776 . 3.739 2.882 2.793 2.967 . 0 0 "[ . 1 . 2]" 1
1500 1 58 ILE MD 1 77 PHE HZ 3.016 . 4.153 4.122 4.092 4.169 0.016 16 0 "[ . 1 . 2]" 1
1501 1 58 ILE MD 1 77 PHE HE2 2.697 . 3.606 3.228 3.171 3.284 . 0 0 "[ . 1 . 2]" 1
1502 1 55 MET HA 1 58 ILE MD 2.771 . 3.731 2.598 2.372 2.834 . 0 0 "[ . 1 . 2]" 1
1503 1 58 ILE MD 1 76 ASP HB2 2.857 . 3.877 3.438 3.257 3.558 . 0 0 "[ . 1 . 2]" 1
1504 1 53 MET HG2 1 58 ILE MD 3.203 . 4.486 2.263 2.206 2.426 . 0 0 "[ . 1 . 2]" 1
1505 1 58 ILE MD 1 76 ASP HB3 2.774 . 3.736 2.425 2.227 2.565 . 0 0 "[ . 1 . 2]" 1
1506 1 53 MET HB3 1 58 ILE MD 3.855 . 5.713 3.963 3.932 4.005 . 0 0 "[ . 1 . 2]" 1
1507 1 53 MET HG3 1 58 ILE MD 3.065 . 4.240 2.135 2.069 2.234 . 0 0 "[ . 1 . 2]" 1
1508 1 58 ILE HB 1 58 ILE MD 2.627 . 3.490 2.297 2.268 2.324 . 0 0 "[ . 1 . 2]" 1
1509 1 58 ILE MD 1 58 ILE HG12 2.296 . 2.955 2.095 2.092 2.100 . 0 0 "[ . 1 . 2]" 1
1510 1 31 PHE HZ 1 94 ILE HA 3.890 . 5.781 4.372 4.321 4.517 . 0 0 "[ . 1 . 2]" 1
1511 1 85 TYR HE1 1 99 GLU HA 2.885 . 3.926 3.938 3.879 3.969 0.043 3 0 "[ . 1 . 2]" 1
1512 1 99 GLU HA 1 99 GLU HB3 2.444 . 3.191 2.542 2.511 2.574 . 0 0 "[ . 1 . 2]" 1
1513 1 12 GLN HA 1 15 LEU HB3 2.553 . 3.368 2.509 2.246 2.687 . 0 0 "[ . 1 . 2]" 1
1514 1 107 GLN HA 1 107 GLN HB3 2.414 . 3.143 3.005 2.947 3.023 . 0 0 "[ . 1 . 2]" 1
1515 1 9 ASN HB3 1 115 GLU HA 2.989 . 4.106 3.899 2.493 5.098 0.992 5 1 "[ + 1 . 2]" 1
1516 1 6 ARG HA 1 68 TRP QB 3.500 . 5.031 3.402 3.053 4.454 . 0 0 "[ . 1 . 2]" 1
1517 1 6 ARG HA 1 68 TRP HA 2.637 . 3.506 2.820 2.445 3.368 . 0 0 "[ . 1 . 2]" 1
1518 1 6 ARG HA 1 68 TRP HE3 2.851 . 3.867 2.764 2.143 3.911 0.044 1 0 "[ . 1 . 2]" 1
1519 1 6 ARG HA 1 68 TRP HZ3 4.510 . 7.053 4.512 3.671 5.635 . 0 0 "[ . 1 . 2]" 1
1520 1 6 ARG HA 1 68 TRP HD1 4.562 . 7.163 6.421 4.507 6.935 . 0 0 "[ . 1 . 2]" 1
1521 1 69 ASN QB 1 72 GLU QG 2.737 . 3.673 3.009 2.420 3.614 . 0 0 "[ . 1 . 2]" 1
1522 1 39 LYS HB3 1 39 LYS HG2 2.499 . 3.279 2.437 2.302 2.536 . 0 0 "[ . 1 . 2]" 1
1523 1 30 PRO HB2 1 30 PRO HG3 2.792 . 3.766 2.728 2.712 2.743 . 0 0 "[ . 1 . 2]" 1
1524 1 13 TYR HE2 1 111 GLU HB3 3.638 . 5.292 4.483 4.337 4.617 . 0 0 "[ . 1 . 2]" 1
1525 1 70 ALA MB 1 112 LEU MD2 2.456 . 3.210 1.953 1.875 2.033 . 0 0 "[ . 1 . 2]" 1
1526 1 14 LEU HB2 1 70 ALA MB 2.332 . 3.012 3.127 3.082 3.186 0.174 18 0 "[ . 1 . 2]" 1
1527 1 10 GLN HB2 1 70 ALA MB 2.338 . 3.022 2.287 2.120 2.449 . 0 0 "[ . 1 . 2]" 1
1528 1 14 LEU HG 1 70 ALA MB 2.582 . 3.416 2.868 2.779 2.985 . 0 0 "[ . 1 . 2]" 1
1529 1 10 GLN HB3 1 70 ALA MB 2.302 . 2.965 1.789 1.712 1.862 . 0 0 "[ . 1 . 2]" 1
1530 1 50 LYS H 1 50 LYS QD 2.841 . 3.850 3.333 3.140 3.471 . 0 0 "[ . 1 . 2]" 1
1531 1 50 LYS H 1 51 THR H 2.411 . 3.137 2.915 2.842 2.987 . 0 0 "[ . 1 . 2]" 1
1532 1 50 LYS H 1 50 LYS HA 2.513 . 3.302 2.708 2.686 2.728 . 0 0 "[ . 1 . 2]" 1
1533 1 49 ILE HA 1 50 LYS H 2.139 . 2.711 2.015 1.997 2.026 . 0 0 "[ . 1 . 2]" 1
1534 1 50 LYS H 1 50 LYS HB2 2.308 . 2.974 2.447 2.355 2.513 . 0 0 "[ . 1 . 2]" 1
1535 1 50 LYS H 1 50 LYS QG 2.643 . 3.516 1.995 1.893 2.111 . 0 0 "[ . 1 . 2]" 1
1536 1 92 ASP HA 1 93 ASP H 2.265 . 2.906 2.295 2.264 2.315 . 0 0 "[ . 1 . 2]" 1
1537 1 93 ASP H 1 93 ASP HA 2.424 . 3.158 2.744 2.726 2.765 . 0 0 "[ . 1 . 2]" 1
1538 1 93 ASP H 1 93 ASP HB3 2.758 . 3.709 3.268 2.509 3.634 . 0 0 "[ . 1 . 2]" 1
1539 1 25 HIS H 1 28 ALA H 3.103 . 4.307 3.827 3.612 3.940 . 0 0 "[ . 1 . 2]" 1
1540 1 24 LYS H 1 25 HIS H 1.965 . 2.447 2.324 2.219 2.447 0.000 16 0 "[ . 1 . 2]" 1
1541 1 74 ILE H 1 76 ASP H 2.725 . 3.653 3.796 3.770 3.815 0.162 4 0 "[ . 1 . 2]" 1
1542 1 75 GLN H 1 76 ASP H 2.278 . 2.927 2.795 2.719 2.850 . 0 0 "[ . 1 . 2]" 1
1543 1 76 ASP H 1 77 PHE H 2.236 . 2.861 2.425 2.323 2.472 . 0 0 "[ . 1 . 2]" 1
1544 1 76 ASP H 1 77 PHE HD1 3.296 . 4.654 4.663 4.617 4.698 0.044 7 0 "[ . 1 . 2]" 1
1545 1 76 ASP H 1 76 ASP HA 2.292 . 2.949 2.903 2.893 2.915 . 0 0 "[ . 1 . 2]" 1
1546 1 73 CYS HA 1 76 ASP H 2.579 . 3.410 3.261 3.156 3.426 0.016 20 0 "[ . 1 . 2]" 1
1547 1 76 ASP H 1 76 ASP HB2 2.185 . 2.782 2.322 2.297 2.345 . 0 0 "[ . 1 . 2]" 1
1548 1 74 ILE HA 1 76 ASP H 3.589 . 5.199 4.086 4.051 4.116 . 0 0 "[ . 1 . 2]" 1
1549 1 5 LYS H 1 5 LYS HA 2.508 . 3.294 2.897 2.825 2.954 . 0 0 "[ . 1 . 2]" 1
1550 1 61 ARG H 1 62 LEU H 2.519 . 3.312 2.585 2.493 2.705 . 0 0 "[ . 1 . 2]" 1
1551 1 62 LEU H 1 62 LEU HA 2.525 . 3.322 2.836 2.793 2.866 . 0 0 "[ . 1 . 2]" 1
1552 1 59 LYS HA 1 62 LEU H 2.794 . 3.769 3.631 3.424 3.803 0.034 20 0 "[ . 1 . 2]" 1
1553 1 62 LEU H 1 62 LEU HG 2.377 . 3.083 2.919 2.682 3.021 . 0 0 "[ . 1 . 2]" 1
1554 1 61 ARG HA 1 62 LEU H 3.697 . 5.405 3.463 3.419 3.519 . 0 0 "[ . 1 . 2]" 1
1555 1 62 LEU H 1 62 LEU HB2 2.371 . 3.074 2.190 2.160 2.237 . 0 0 "[ . 1 . 2]" 1
1556 1 61 ARG HB2 1 62 LEU H 2.814 . 3.804 3.045 2.665 3.235 . 0 0 "[ . 1 . 2]" 1
1557 1 79 THR HA 1 80 MET H 3.228 . 4.531 3.531 3.481 3.556 . 0 0 "[ . 1 . 2]" 1
1558 1 80 MET H 1 80 MET HA 2.480 . 3.249 2.761 2.731 2.789 . 0 0 "[ . 1 . 2]" 1
1559 1 80 MET H 1 80 MET HB3 2.312 . 2.980 2.789 2.611 3.242 0.262 7 0 "[ . 1 . 2]" 1
1560 1 80 MET H 1 80 MET HB2 2.199 . 2.804 2.180 1.876 2.324 . 0 0 "[ . 1 . 2]" 1
1561 1 80 MET H 1 80 MET HG2 3.184 . 4.451 4.325 3.586 4.515 0.064 13 0 "[ . 1 . 2]" 1
1562 1 58 ILE HB 1 59 LYS H 2.822 . 3.818 2.750 2.656 2.861 . 0 0 "[ . 1 . 2]" 1
1563 1 59 LYS H 1 59 LYS QD 2.725 . 3.653 3.640 3.564 3.695 0.042 19 0 "[ . 1 . 2]" 1
1564 1 59 LYS H 1 59 LYS QG 3.179 . 4.442 2.268 2.059 2.497 . 0 0 "[ . 1 . 2]" 1
1565 1 53 MET HA 1 54 ASP H 2.159 . 2.741 2.174 2.157 2.201 . 0 0 "[ . 1 . 2]" 1
1566 1 54 ASP H 1 54 ASP HB2 3.714 . 5.438 3.743 2.724 3.809 . 0 0 "[ . 1 . 2]" 1
1567 1 54 ASP H 1 57 THR HB 2.434 . 3.174 2.387 2.277 2.605 . 0 0 "[ . 1 . 2]" 1
1568 1 53 MET HG2 1 54 ASP H 3.204 . 4.487 4.044 3.993 4.365 . 0 0 "[ . 1 . 2]" 1
1569 1 54 ASP H 1 54 ASP HB3 3.528 . 5.084 3.238 3.160 3.825 . 0 0 "[ . 1 . 2]" 1
1570 1 53 MET HG3 1 54 ASP H 2.441 . 3.186 2.883 2.833 3.105 . 0 0 "[ . 1 . 2]" 1
1571 1 53 MET HB2 1 54 ASP H 3.144 . 4.379 3.848 3.806 4.046 . 0 0 "[ . 1 . 2]" 1
1572 1 86 ILE HB 1 87 TYR H 2.221 . 2.837 2.514 2.402 2.558 . 0 0 "[ . 1 . 2]" 1
1573 1 86 ILE H 1 87 TYR H 2.316 . 2.986 2.716 2.572 2.896 . 0 0 "[ . 1 . 2]" 1
1574 1 87 TYR H 1 88 ASN H 2.297 . 2.956 2.525 2.404 2.666 . 0 0 "[ . 1 . 2]" 1
1575 1 87 TYR H 1 87 TYR HA 2.220 . 2.836 2.878 2.867 2.889 0.053 19 0 "[ . 1 . 2]" 1
1576 1 87 TYR H 1 87 TYR HB3 2.549 . 3.361 2.770 2.709 2.809 . 0 0 "[ . 1 . 2]" 1
1577 1 86 ILE HG13 1 87 TYR H 3.266 . 4.600 4.536 4.460 4.561 . 0 0 "[ . 1 . 2]" 1
1578 1 86 ILE MG 1 87 TYR H 2.216 . 2.830 2.726 2.704 2.752 . 0 0 "[ . 1 . 2]" 1
1579 1 49 ILE MD 1 87 TYR H 2.409 . 3.134 2.335 2.284 2.361 . 0 0 "[ . 1 . 2]" 1
1580 1 12 GLN HE22 1 12 GLN QG 3.232 . 4.538 3.269 3.204 3.470 . 0 0 "[ . 1 . 2]" 1
1581 1 12 GLN HE21 1 12 GLN QG 2.559 . 2.816 2.248 2.150 2.752 . 0 0 "[ . 1 . 2]" 1
1582 1 69 ASN HA 1 70 ALA H 3.645 . 5.306 2.318 2.191 2.423 . 0 0 "[ . 1 . 2]" 1
1583 1 74 ILE HA 1 78 ASN H 3.135 . 4.364 3.799 3.681 3.897 . 0 0 "[ . 1 . 2]" 1
1584 1 23 TRP H 1 25 HIS H 3.560 . 5.144 4.287 4.208 4.435 . 0 0 "[ . 1 . 2]" 1
1585 1 77 PHE HA 1 78 ASN H 3.685 . 5.383 3.523 3.504 3.538 . 0 0 "[ . 1 . 2]" 1
1586 1 109 ILE H 1 111 GLU H 3.740 . 5.488 3.661 3.628 3.704 . 0 0 "[ . 1 . 2]" 1
1587 1 87 TYR H 1 87 TYR HB2 2.896 . 3.944 2.318 2.274 2.369 . 0 0 "[ . 1 . 2]" 1
1588 1 58 ILE MG 1 59 LYS H 3.606 . 5.231 3.175 3.054 3.287 . 0 0 "[ . 1 . 2]" 1
1589 1 13 TYR HA 1 17 VAL H 2.934 . 4.010 2.847 2.825 2.873 . 0 0 "[ . 1 . 2]" 1
1590 1 16 ARG HA 1 17 VAL H 2.965 . 4.064 3.544 3.525 3.560 . 0 0 "[ . 1 . 2]" 1
1591 1 86 ILE HG12 1 87 TYR H 3.524 . 5.076 4.916 4.865 4.951 . 0 0 "[ . 1 . 2]" 1
1592 1 76 ASP HA 1 80 MET H 3.463 . 4.962 3.757 3.686 3.914 . 0 0 "[ . 1 . 2]" 1
1593 1 78 ASN QB 1 80 MET H 3.407 . 4.858 4.622 4.536 4.662 . 0 0 "[ . 1 . 2]" 1
1594 1 76 ASP H 1 77 PHE HB2 3.481 . 4.995 4.264 4.224 4.295 . 0 0 "[ . 1 . 2]" 1
1595 1 16 ARG HB2 1 17 VAL H 2.488 . 3.262 1.976 1.913 2.055 . 0 0 "[ . 1 . 2]" 1
1596 1 23 TRP HA 1 25 HIS H 3.450 . 4.938 3.954 3.867 4.048 . 0 0 "[ . 1 . 2]" 1
1597 1 24 LYS HG2 1 25 HIS H 3.494 . 5.020 5.119 4.465 5.186 0.166 11 0 "[ . 1 . 2]" 1
1598 1 93 ASP H 1 93 ASP HB2 2.954 . 4.044 2.509 2.398 2.668 . 0 0 "[ . 1 . 2]" 1
1599 1 55 MET HG2 1 58 ILE H 4.699 . 7.459 6.170 6.106 6.285 . 0 0 "[ . 1 . 2]" 1
1600 1 55 MET HG3 1 58 ILE H 4.001 . 6.002 5.832 5.758 5.938 . 0 0 "[ . 1 . 2]" 1
1601 1 53 MET ME 1 58 ILE H 3.767 . 5.541 4.087 3.927 4.200 . 0 0 "[ . 1 . 2]" 1
1602 1 55 MET HA 1 58 ILE H 3.173 . 4.431 3.384 3.320 3.508 . 0 0 "[ . 1 . 2]" 1
1603 1 72 GLU HA 1 76 ASP H 4.273 . 6.556 4.180 4.068 4.283 . 0 0 "[ . 1 . 2]" 1
1604 1 74 ILE MG 1 76 ASP H 3.368 . 4.786 4.552 4.518 4.576 . 0 0 "[ . 1 . 2]" 1
1605 1 58 ILE HG12 1 76 ASP H 3.582 . 5.186 4.745 4.618 4.837 . 0 0 "[ . 1 . 2]" 1
1606 1 98 ALA H 1 99 GLU H 2.689 . 3.593 2.661 2.623 2.709 . 0 0 "[ . 1 . 2]" 1
1607 1 31 PHE HE1 1 98 ALA H 3.156 . 4.401 3.796 3.520 3.852 . 0 0 "[ . 1 . 2]" 1
1608 1 85 TYR HE1 1 98 ALA H 3.484 . 5.001 4.405 4.337 4.461 . 0 0 "[ . 1 . 2]" 1
1609 1 98 ALA H 1 98 ALA HA 2.804 . 3.787 2.798 2.786 2.808 . 0 0 "[ . 1 . 2]" 1
1610 1 97 MET HG2 1 98 ALA H 3.473 . 4.981 4.826 4.693 4.923 . 0 0 "[ . 1 . 2]" 1
1611 1 97 MET HB2 1 98 ALA H 2.738 . 3.675 2.412 2.231 2.533 . 0 0 "[ . 1 . 2]" 1
1612 1 97 MET HB3 1 98 ALA H 2.757 . 3.707 3.552 3.385 3.656 . 0 0 "[ . 1 . 2]" 1
1613 1 98 ALA H 1 98 ALA MB 2.138 . 2.709 2.214 2.201 2.232 . 0 0 "[ . 1 . 2]" 1
1614 1 94 ILE MD 1 98 ALA H 4.008 . 6.016 3.486 3.430 3.551 . 0 0 "[ . 1 . 2]" 1
1615 1 97 MET HA 1 98 ALA H 2.715 . 3.636 3.542 3.534 3.558 . 0 0 "[ . 1 . 2]" 1
1616 1 75 GLN QG 1 79 THR H 3.687 . 5.386 4.297 3.881 4.720 . 0 0 "[ . 1 . 2]" 1
1617 1 79 THR H 1 80 MET HB3 3.676 . 5.365 5.247 5.085 5.537 0.172 7 0 "[ . 1 . 2]" 1
1618 1 112 LEU H 1 112 LEU MD1 3.098 . 4.298 4.018 3.995 4.047 . 0 0 "[ . 1 . 2]" 1
1619 1 109 ILE HB 1 112 LEU H 3.726 . 5.461 4.685 4.608 4.752 . 0 0 "[ . 1 . 2]" 1
1620 1 112 LEU H 1 112 LEU HB2 2.594 . 3.435 2.478 2.435 2.543 . 0 0 "[ . 1 . 2]" 1
1621 1 112 LEU H 1 112 LEU HB3 2.389 . 3.102 2.492 2.441 2.536 . 0 0 "[ . 1 . 2]" 1
1622 1 111 GLU HB3 1 112 LEU H 3.070 . 4.248 4.391 4.359 4.432 0.184 6 0 "[ . 1 . 2]" 1
1623 1 111 GLU HG2 1 112 LEU H 3.491 . 5.015 5.051 5.019 5.087 0.072 20 0 "[ . 1 . 2]" 1
1624 1 112 LEU H 1 113 PRO HD2 3.338 . 4.731 4.714 4.643 4.743 0.012 14 0 "[ . 1 . 2]" 1
1625 1 112 LEU H 1 113 PRO HD3 3.437 . 4.914 4.395 4.299 4.469 . 0 0 "[ . 1 . 2]" 1
1626 1 112 LEU H 1 112 LEU HA 2.692 . 3.598 2.775 2.757 2.804 . 0 0 "[ . 1 . 2]" 1
1627 1 110 ASN HA 1 112 LEU H 3.590 . 5.201 3.951 3.908 3.994 . 0 0 "[ . 1 . 2]" 1
1628 1 111 GLU HA 1 112 LEU H 3.007 . 4.137 3.145 3.087 3.207 . 0 0 "[ . 1 . 2]" 1
1629 1 109 ILE HA 1 112 LEU H 3.009 . 4.141 2.675 2.557 2.749 . 0 0 "[ . 1 . 2]" 1
1630 1 13 TYR HE1 1 112 LEU H 3.328 . 4.713 4.185 4.045 4.335 . 0 0 "[ . 1 . 2]" 1
1631 1 110 ASN H 1 112 LEU H 3.463 . 4.962 3.855 3.788 3.947 . 0 0 "[ . 1 . 2]" 1
1632 1 62 LEU H 1 67 TYR HE2 4.163 . 6.329 2.821 2.636 3.073 . 0 0 "[ . 1 . 2]" 1
1633 1 60 LYS H 1 62 LEU H 3.255 . 4.579 3.968 3.859 4.075 . 0 0 "[ . 1 . 2]" 1
1634 1 104 LEU MD1 1 105 PHE H 3.202 . 4.484 2.913 2.866 2.980 . 0 0 "[ . 1 . 2]" 1
1635 1 105 PHE H 1 106 LEU HB2 3.454 . 4.945 4.739 4.710 4.760 . 0 0 "[ . 1 . 2]" 1
1636 1 104 LEU HB2 1 105 PHE H 2.812 . 3.801 3.767 3.740 3.797 . 0 0 "[ . 1 . 2]" 1
1637 1 104 LEU HB3 1 105 PHE H 2.586 . 3.422 2.376 2.330 2.430 . 0 0 "[ . 1 . 2]" 1
1638 1 105 PHE H 1 106 LEU HG 3.490 . 5.012 4.781 4.744 4.834 . 0 0 "[ . 1 . 2]" 1
1639 1 105 PHE H 1 105 PHE HB2 2.600 . 3.445 2.975 2.948 2.993 . 0 0 "[ . 1 . 2]" 1
1640 1 105 PHE H 1 105 PHE HB3 2.698 . 3.608 2.160 2.145 2.184 . 0 0 "[ . 1 . 2]" 1
1641 1 104 LEU HA 1 105 PHE H 3.123 . 4.342 3.572 3.556 3.583 . 0 0 "[ . 1 . 2]" 1
1642 1 105 PHE H 1 105 PHE HD2 3.375 . 4.799 4.108 4.083 4.132 . 0 0 "[ . 1 . 2]" 1
1643 1 104 LEU H 1 105 PHE H 2.637 . 3.506 2.519 2.462 2.561 . 0 0 "[ . 1 . 2]" 1
1644 1 73 CYS HA 1 74 ILE H 3.766 . 5.539 3.460 3.445 3.469 . 0 0 "[ . 1 . 2]" 1
1645 1 74 ILE H 1 74 ILE HA 2.661 . 3.546 2.813 2.791 2.825 . 0 0 "[ . 1 . 2]" 1
1646 1 73 CYS HB3 1 74 ILE H 3.039 . 4.194 2.646 2.271 2.765 . 0 0 "[ . 1 . 2]" 1
1647 1 74 ILE H 1 75 GLN HB3 3.669 . 5.352 4.284 4.148 4.805 . 0 0 "[ . 1 . 2]" 1
1648 1 74 ILE H 1 74 ILE HB 2.724 . 3.652 2.342 2.313 2.383 . 0 0 "[ . 1 . 2]" 1
1649 1 73 CYS HB2 1 74 ILE H 3.286 . 4.636 3.868 3.474 3.973 . 0 0 "[ . 1 . 2]" 1
1650 1 14 LEU MD1 1 74 ILE H 2.749 . 3.693 2.508 2.424 2.608 . 0 0 "[ . 1 . 2]" 1
1651 1 74 ILE H 1 74 ILE HG13 2.801 . 3.781 2.181 2.074 2.256 . 0 0 "[ . 1 . 2]" 1
1652 1 73 CYS H 1 74 ILE H 2.916 . 3.979 2.512 2.447 2.600 . 0 0 "[ . 1 . 2]" 1
1653 1 74 ILE H 1 75 GLN H 2.594 . 3.435 2.683 2.645 2.725 . 0 0 "[ . 1 . 2]" 1
1654 1 79 THR HB 1 80 MET H 3.072 . 4.252 2.543 2.431 2.755 . 0 0 "[ . 1 . 2]" 1
1655 1 77 PHE HA 1 80 MET H 3.344 . 4.741 3.271 3.198 3.327 . 0 0 "[ . 1 . 2]" 1
1656 1 80 MET H 1 80 MET HG3 3.682 . 5.377 4.064 3.304 4.303 . 0 0 "[ . 1 . 2]" 1
1657 1 77 PHE HD2 1 80 MET H 3.777 . 5.560 5.251 5.168 5.325 . 0 0 "[ . 1 . 2]" 1
1658 1 13 TYR HD1 1 18 VAL H 3.388 . 4.823 4.085 4.038 4.130 . 0 0 "[ . 1 . 2]" 1
1659 1 13 TYR HA 1 18 VAL H 4.008 . 6.016 4.234 4.203 4.261 . 0 0 "[ . 1 . 2]" 1
1660 1 17 VAL HA 1 18 VAL H 3.262 . 4.592 3.599 3.591 3.605 . 0 0 "[ . 1 . 2]" 1
1661 1 14 LEU HA 1 18 VAL H 2.843 . 3.853 3.210 3.156 3.243 . 0 0 "[ . 1 . 2]" 1
1662 1 18 VAL H 1 18 VAL HB 3.035 . 4.186 2.650 2.643 2.666 . 0 0 "[ . 1 . 2]" 1
1663 1 18 VAL H 1 108 LYS HG3 3.185 . 4.453 3.753 3.710 3.779 . 0 0 "[ . 1 . 2]" 1
1664 1 17 VAL HB 1 18 VAL H 2.795 . 3.772 3.889 3.874 3.899 0.127 8 0 "[ . 1 . 2]" 1
1665 1 18 VAL H 1 18 VAL MG2 2.492 . 3.268 1.869 1.859 1.879 . 0 0 "[ . 1 . 2]" 1
1666 1 17 VAL MG1 1 18 VAL H 3.024 . 4.167 2.044 2.017 2.083 . 0 0 "[ . 1 . 2]" 1
1667 1 17 VAL MG2 1 18 VAL H 2.970 . 4.073 2.230 2.200 2.256 . 0 0 "[ . 1 . 2]" 1
1668 1 27 PHE QD 1 101 LEU H 3.567 . 5.157 4.478 4.323 4.560 . 0 0 "[ . 1 . 2]" 1
1669 1 101 LEU H 1 102 GLU H 2.727 . 3.657 2.445 2.414 2.489 . 0 0 "[ . 1 . 2]" 1
1670 1 101 LEU H 1 101 LEU HA 2.708 . 3.625 2.875 2.865 2.883 . 0 0 "[ . 1 . 2]" 1
1671 1 101 LEU H 1 102 GLU HA 3.955 . 5.910 5.056 5.034 5.084 . 0 0 "[ . 1 . 2]" 1
1672 1 100 ALA MB 1 101 LEU H 2.306 . 2.971 2.823 2.780 2.849 . 0 0 "[ . 1 . 2]" 1
1673 1 101 LEU H 1 101 LEU HG 2.321 . 2.994 2.468 2.397 2.507 . 0 0 "[ . 1 . 2]" 1
1674 1 101 LEU H 1 101 LEU HB3 2.649 . 3.526 3.558 3.551 3.566 0.040 13 0 "[ . 1 . 2]" 1
1675 1 22 LEU MD2 1 101 LEU H 3.481 . 4.996 4.531 4.502 4.557 . 0 0 "[ . 1 . 2]" 1
1676 1 101 LEU H 1 101 LEU MD2 3.415 . 4.873 3.622 3.551 3.654 . 0 0 "[ . 1 . 2]" 1
1677 1 93 ASP H 1 96 LEU H 4.481 . 6.991 4.598 4.529 4.620 . 0 0 "[ . 1 . 2]" 1
1678 1 59 LYS H 1 59 LYS HB2 3.097 . 4.296 3.627 3.586 3.665 . 0 0 "[ . 1 . 2]" 1
1679 1 59 LYS H 1 59 LYS HB3 3.049 . 4.211 2.555 2.366 2.698 . 0 0 "[ . 1 . 2]" 1
1680 1 59 LYS H 1 62 LEU MD1 3.787 . 5.580 4.215 4.092 4.447 . 0 0 "[ . 1 . 2]" 1
1681 1 76 ASP HB3 1 77 PHE H 3.244 . 4.559 3.442 3.354 3.574 . 0 0 "[ . 1 . 2]" 1
1682 1 76 ASP HB2 1 77 PHE H 2.769 . 3.727 2.735 2.667 2.860 . 0 0 "[ . 1 . 2]" 1
1683 1 77 PHE H 1 77 PHE HB3 2.625 . 3.486 3.518 3.504 3.526 0.040 4 0 "[ . 1 . 2]" 1
1684 1 77 PHE H 1 77 PHE HA 2.753 . 3.700 2.827 2.811 2.872 . 0 0 "[ . 1 . 2]" 1
1685 1 74 ILE HA 1 77 PHE H 3.258 . 4.585 3.253 3.202 3.288 . 0 0 "[ . 1 . 2]" 1
1686 1 75 GLN HA 1 77 PHE H 3.881 . 5.764 4.459 4.076 4.611 . 0 0 "[ . 1 . 2]" 1
1687 1 76 ASP HA 1 77 PHE H 3.812 . 5.628 3.507 3.464 3.532 . 0 0 "[ . 1 . 2]" 1
1688 1 77 PHE H 1 77 PHE HD1 2.927 . 3.998 3.099 3.040 3.242 . 0 0 "[ . 1 . 2]" 1
1689 1 77 PHE H 1 77 PHE HE1 3.573 . 5.169 5.046 4.962 5.233 0.064 20 0 "[ . 1 . 2]" 1
1690 1 77 PHE H 1 77 PHE HB2 3.031 . 4.179 2.233 2.196 2.253 . 0 0 "[ . 1 . 2]" 1
1691 1 74 ILE MG 1 77 PHE H 3.997 . 5.994 4.442 4.295 4.527 . 0 0 "[ . 1 . 2]" 1
1692 1 58 ILE MD 1 77 PHE H 3.312 . 4.683 3.352 3.249 3.532 . 0 0 "[ . 1 . 2]" 1
1693 1 18 VAL HA 1 19 LEU H 3.692 . 5.396 3.549 3.532 3.563 . 0 0 "[ . 1 . 2]" 1
1694 1 14 LEU HA 1 19 LEU H 3.385 . 4.817 3.469 3.397 3.531 . 0 0 "[ . 1 . 2]" 1
1695 1 19 LEU H 1 19 LEU HA 2.763 . 3.717 2.735 2.728 2.741 . 0 0 "[ . 1 . 2]" 1
1696 1 15 LEU HA 1 19 LEU H 3.711 . 5.433 3.297 3.168 3.439 . 0 0 "[ . 1 . 2]" 1
1697 1 19 LEU H 1 20 LYS H 3.037 . 4.190 2.990 2.915 3.037 . 0 0 "[ . 1 . 2]" 1
1698 1 19 LEU H 1 77 PHE HZ 3.859 . 5.721 3.736 3.579 3.815 . 0 0 "[ . 1 . 2]" 1
1699 1 18 VAL H 1 19 LEU H 3.049 . 4.211 3.115 3.077 3.145 . 0 0 "[ . 1 . 2]" 1
1700 1 18 VAL HB 1 19 LEU H 2.726 . 3.655 1.995 1.957 2.037 . 0 0 "[ . 1 . 2]" 1
1701 1 19 LEU H 1 19 LEU HB3 2.744 . 3.685 2.849 2.790 2.891 . 0 0 "[ . 1 . 2]" 1
1702 1 19 LEU H 1 19 LEU HB2 2.549 . 3.361 2.116 2.095 2.136 . 0 0 "[ . 1 . 2]" 1
1703 1 19 LEU H 1 20 LYS QB 3.634 . 5.284 4.794 4.574 4.976 . 0 0 "[ . 1 . 2]" 1
1704 1 19 LEU H 1 19 LEU MD2 3.406 . 4.856 3.541 3.499 3.571 . 0 0 "[ . 1 . 2]" 1
1705 1 18 VAL MG1 1 19 LEU H 2.706 . 3.621 2.912 2.872 2.961 . 0 0 "[ . 1 . 2]" 1
1706 1 54 ASP H 1 58 ILE HG13 3.900 . 5.801 3.793 3.669 3.998 . 0 0 "[ . 1 . 2]" 1
1707 1 48 ILE H 1 48 ILE MD 2.669 . 3.560 3.303 3.071 3.388 . 0 0 "[ . 1 . 2]" 1
1708 1 48 ILE H 1 48 ILE HG13 2.572 . 3.399 2.474 2.333 2.621 . 0 0 "[ . 1 . 2]" 1
1709 1 47 LYS HG2 1 48 ILE H 3.527 . 5.082 4.569 3.776 4.922 . 0 0 "[ . 1 . 2]" 1
1710 1 48 ILE H 1 48 ILE HB 2.638 . 3.508 2.203 2.177 2.241 . 0 0 "[ . 1 . 2]" 1
1711 1 47 LYS HB2 1 48 ILE H 2.781 . 3.748 2.420 1.917 3.247 . 0 0 "[ . 1 . 2]" 1
1712 1 48 ILE H 1 48 ILE HA 2.990 . 4.108 2.822 2.779 2.858 . 0 0 "[ . 1 . 2]" 1
1713 1 47 LYS HA 1 48 ILE H 3.378 . 4.804 3.498 3.488 3.513 . 0 0 "[ . 1 . 2]" 1
1714 1 46 TYR HA 1 48 ILE H 3.825 . 5.653 4.657 4.397 4.905 . 0 0 "[ . 1 . 2]" 1
1715 1 14 LEU MD1 1 73 CYS H 3.263 . 4.594 3.355 3.303 3.412 . 0 0 "[ . 1 . 2]" 1
1716 1 62 LEU MD2 1 73 CYS H 4.116 . 6.234 4.452 4.374 4.648 . 0 0 "[ . 1 . 2]" 1
1717 1 73 CYS H 1 73 CYS HB3 2.496 . 3.275 2.455 2.377 2.721 . 0 0 "[ . 1 . 2]" 1
1718 1 72 GLU HB3 1 73 CYS H 2.595 . 3.437 3.509 3.422 3.747 0.310 1 0 "[ . 1 . 2]" 1
1719 1 70 ALA HA 1 73 CYS H 3.372 . 4.793 3.236 3.170 3.315 . 0 0 "[ . 1 . 2]" 1
1720 1 71 GLN HA 1 73 CYS H 3.635 . 5.286 4.444 4.283 4.509 . 0 0 "[ . 1 . 2]" 1
1721 1 72 GLU HA 1 73 CYS H 3.803 . 5.611 3.529 3.499 3.543 . 0 0 "[ . 1 . 2]" 1
1722 1 73 CYS H 1 75 GLN H 3.379 . 4.806 4.127 4.033 4.230 . 0 0 "[ . 1 . 2]" 1
1723 1 49 ILE HG13 1 87 TYR H 3.488 . 5.009 5.009 4.769 5.066 0.057 19 0 "[ . 1 . 2]" 1
1724 1 83 ASN HA 1 87 TYR H 3.915 . 5.831 3.695 3.625 3.810 . 0 0 "[ . 1 . 2]" 1
1725 1 15 LEU H 1 15 LEU HA 2.848 . 3.862 2.923 2.915 2.929 . 0 0 "[ . 1 . 2]" 1
1726 1 12 GLN HA 1 15 LEU H 3.326 . 4.708 3.445 3.272 3.537 . 0 0 "[ . 1 . 2]" 1
1727 1 74 ILE MD 1 75 GLN H 3.243 . 4.557 4.151 4.100 4.202 . 0 0 "[ . 1 . 2]" 1
1728 1 74 ILE MG 1 75 GLN H 2.773 . 3.734 2.910 2.851 2.966 . 0 0 "[ . 1 . 2]" 1
1729 1 74 ILE HB 1 75 GLN H 2.626 . 3.488 2.166 2.110 2.223 . 0 0 "[ . 1 . 2]" 1
1730 1 75 GLN H 1 75 GLN HB3 2.010 . 2.515 2.005 1.934 2.244 . 0 0 "[ . 1 . 2]" 1
1731 1 75 GLN H 1 75 GLN QG 2.777 . 3.741 3.440 2.516 3.650 . 0 0 "[ . 1 . 2]" 1
1732 1 75 GLN H 1 78 ASN QB 3.892 . 5.786 4.208 4.084 4.346 . 0 0 "[ . 1 . 2]" 1
1733 1 74 ILE HA 1 75 GLN H 3.146 . 4.383 3.515 3.504 3.534 . 0 0 "[ . 1 . 2]" 1
1734 1 72 GLU HA 1 75 GLN H 3.250 . 4.571 3.346 3.218 3.481 . 0 0 "[ . 1 . 2]" 1
1735 1 75 GLN H 1 75 GLN HA 2.699 . 3.610 2.751 2.734 2.790 . 0 0 "[ . 1 . 2]" 1
1736 1 77 PHE HB2 1 78 ASN H 3.149 . 4.389 2.588 2.519 2.660 . 0 0 "[ . 1 . 2]" 1
1737 1 78 ASN H 1 78 ASN QB 2.199 . 2.803 2.179 2.140 2.196 . 0 0 "[ . 1 . 2]" 1
1738 1 75 GLN HA 1 78 ASN H 2.912 . 3.972 3.278 3.066 3.406 . 0 0 "[ . 1 . 2]" 1
1739 1 77 PHE H 1 78 ASN H 2.440 . 3.184 2.585 2.457 2.636 . 0 0 "[ . 1 . 2]" 1
1740 1 78 ASN H 1 79 THR H 2.713 . 3.633 2.698 2.530 2.819 . 0 0 "[ . 1 . 2]" 1
1741 1 109 ILE QG 1 111 GLU H 3.409 . 4.862 4.846 4.831 4.860 . 0 0 "[ . 1 . 2]" 1
1742 1 111 GLU H 1 112 LEU HB2 3.406 . 4.856 4.053 3.966 4.108 . 0 0 "[ . 1 . 2]" 1
1743 1 109 ILE HB 1 111 GLU H 3.260 . 4.589 4.659 4.635 4.679 0.090 20 0 "[ . 1 . 2]" 1
1744 1 111 GLU H 1 111 GLU HB2 2.663 . 3.549 2.651 2.614 2.699 . 0 0 "[ . 1 . 2]" 1
1745 1 111 GLU H 1 111 GLU HG2 2.678 . 3.574 3.613 3.574 3.645 0.071 1 0 "[ . 1 . 2]" 1
1746 1 111 GLU H 1 111 GLU HB3 2.746 . 3.689 3.739 3.718 3.762 0.073 6 0 "[ . 1 . 2]" 1
1747 1 110 ASN QB 1 111 GLU H 2.740 . 3.678 3.016 2.954 3.072 . 0 0 "[ . 1 . 2]" 1
1748 1 109 ILE HA 1 111 GLU H 3.581 . 5.184 3.380 3.302 3.456 . 0 0 "[ . 1 . 2]" 1
1749 1 111 GLU H 1 111 GLU HA 2.936 . 4.013 2.956 2.951 2.958 . 0 0 "[ . 1 . 2]" 1
1750 1 110 ASN HA 1 111 GLU H 3.364 . 4.778 3.417 3.390 3.431 . 0 0 "[ . 1 . 2]" 1
1751 1 16 ARG H 1 17 VAL H 2.664 . 3.551 2.852 2.806 2.883 . 0 0 "[ . 1 . 2]" 1
1752 1 17 VAL H 1 18 VAL H 2.376 . 3.082 2.700 2.654 2.738 . 0 0 "[ . 1 . 2]" 1
1753 1 17 VAL H 1 17 VAL HA 2.880 . 3.917 2.891 2.883 2.901 . 0 0 "[ . 1 . 2]" 1
1754 1 13 TYR HB2 1 17 VAL H 4.035 . 6.070 5.224 5.204 5.257 . 0 0 "[ . 1 . 2]" 1
1755 1 13 TYR HB3 1 17 VAL H 3.854 . 5.711 5.327 5.278 5.364 . 0 0 "[ . 1 . 2]" 1
1756 1 17 VAL H 1 17 VAL HB 2.588 . 3.425 3.219 3.191 3.256 . 0 0 "[ . 1 . 2]" 1
1757 1 17 VAL H 1 17 VAL MG2 2.901 . 3.953 3.558 3.544 3.571 . 0 0 "[ . 1 . 2]" 1
1758 1 17 VAL H 1 17 VAL MG1 2.540 . 3.347 1.575 1.543 1.616 0.190 7 0 "[ . 1 . 2]" 1
1759 1 16 ARG HG2 1 17 VAL H 3.130 . 4.355 3.865 3.816 3.890 . 0 0 "[ . 1 . 2]" 1
1760 1 15 LEU MD1 1 16 ARG H 3.304 . 4.668 2.610 2.554 2.664 . 0 0 "[ . 1 . 2]" 1
1761 1 16 ARG H 1 17 VAL MG1 3.620 . 5.258 3.741 3.701 3.789 . 0 0 "[ . 1 . 2]" 1
1762 1 16 ARG H 1 17 VAL MG2 4.301 . 6.613 5.780 5.721 5.811 . 0 0 "[ . 1 . 2]" 1
1763 1 15 LEU HG 1 16 ARG H 3.140 . 4.373 4.432 4.404 4.471 0.098 19 0 "[ . 1 . 2]" 1
1764 1 16 ARG H 1 16 ARG HG2 2.687 . 3.590 1.877 1.806 1.951 . 0 0 "[ . 1 . 2]" 1
1765 1 16 ARG H 1 16 ARG HB2 2.215 . 2.828 2.572 2.509 2.679 . 0 0 "[ . 1 . 2]" 1
1766 1 15 LEU HB2 1 16 ARG H 2.836 . 3.841 3.773 3.738 3.830 . 0 0 "[ . 1 . 2]" 1
1767 1 16 ARG H 1 16 ARG QD 3.682 . 5.377 3.288 3.081 3.640 . 0 0 "[ . 1 . 2]" 1
1768 1 12 GLN HA 1 16 ARG H 3.474 . 4.982 3.577 3.475 3.646 . 0 0 "[ . 1 . 2]" 1
1769 1 13 TYR HA 1 16 ARG H 4.300 . 6.611 3.485 3.440 3.524 . 0 0 "[ . 1 . 2]" 1
1770 1 15 LEU HA 1 16 ARG H 3.495 . 5.022 3.543 3.528 3.559 . 0 0 "[ . 1 . 2]" 1
1771 1 15 LEU H 1 16 ARG H 2.845 . 3.857 2.416 2.366 2.471 . 0 0 "[ . 1 . 2]" 1
1772 1 19 LEU MD1 1 20 LYS H 3.787 . 5.580 3.273 3.070 3.388 . 0 0 "[ . 1 . 2]" 1
1773 1 19 LEU MD2 1 20 LYS H 3.736 . 5.481 4.547 4.474 4.573 . 0 0 "[ . 1 . 2]" 1
1774 1 20 LYS H 1 20 LYS HG2 3.694 . 5.400 3.931 2.364 4.602 . 0 0 "[ . 1 . 2]" 1
1775 1 20 LYS H 1 20 LYS QB 2.980 . 4.090 2.272 2.186 2.383 . 0 0 "[ . 1 . 2]" 1
1776 1 19 LEU HB2 1 20 LYS H 3.104 . 4.309 3.411 3.372 3.445 . 0 0 "[ . 1 . 2]" 1
1777 1 19 LEU HB3 1 20 LYS H 3.277 . 4.620 2.209 2.061 2.292 . 0 0 "[ . 1 . 2]" 1
1778 1 19 LEU HA 1 20 LYS H 4.022 . 6.044 3.573 3.548 3.591 . 0 0 "[ . 1 . 2]" 1
1779 1 20 LYS H 1 22 LEU H 4.289 . 6.588 4.275 4.168 4.456 . 0 0 "[ . 1 . 2]" 1
1780 1 55 MET HB3 1 56 GLY H 3.037 . 4.190 3.635 3.556 3.770 . 0 0 "[ . 1 . 2]" 1
1781 1 56 GLY H 1 56 GLY HA2 2.969 . 4.071 2.836 2.789 2.865 . 0 0 "[ . 1 . 2]" 1
1782 1 56 GLY H 1 56 GLY HA3 2.847 . 3.860 2.299 2.293 2.310 . 0 0 "[ . 1 . 2]" 1
1783 1 55 MET HA 1 56 GLY H 3.295 . 4.652 3.516 3.496 3.530 . 0 0 "[ . 1 . 2]" 1
1784 1 32 GLN HA 1 56 GLY H 3.283 . 4.630 3.421 3.223 3.584 . 0 0 "[ . 1 . 2]" 1
1785 1 56 GLY H 1 58 ILE H 3.388 . 4.823 3.805 3.671 3.963 . 0 0 "[ . 1 . 2]" 1
1786 1 54 ASP H 1 56 GLY H 4.266 . 6.541 4.618 4.487 4.712 . 0 0 "[ . 1 . 2]" 1
1787 1 23 TRP HH2 1 56 GLY H 5.877 . 10.194 4.114 3.874 4.816 . 0 0 "[ . 1 . 2]" 1
1788 1 110 ASN QB 1 110 ASN HD22 3.077 . 4.260 3.283 3.201 3.309 . 0 0 "[ . 1 . 2]" 1
1789 1 107 GLN HA 1 110 ASN HD22 3.835 . 5.673 5.157 4.186 5.909 0.236 10 0 "[ . 1 . 2]" 1
1790 1 107 GLN HA 1 110 ASN HD21 4.202 . 6.410 4.177 2.507 5.468 . 0 0 "[ . 1 . 2]" 1
1791 1 110 ASN QB 1 110 ASN HD21 2.991 . 4.110 2.193 2.103 2.245 . 0 0 "[ . 1 . 2]" 1
1792 1 75 GLN HE21 1 75 GLN QG 2.676 . 3.571 2.327 2.098 2.804 . 0 0 "[ . 1 . 2]" 1
1793 1 75 GLN HE22 1 75 GLN QG 3.183 . 4.450 3.299 3.191 3.489 . 0 0 "[ . 1 . 2]" 1
1794 1 21 THR H 1 22 LEU HB2 4.357 . 6.729 4.526 4.446 4.671 . 0 0 "[ . 1 . 2]" 1
1795 1 21 THR H 1 22 LEU HG 3.457 . 4.951 5.067 5.043 5.130 0.179 6 0 "[ . 1 . 2]" 1
1796 1 20 LYS QB 1 21 THR H 2.811 . 3.629 2.648 2.438 2.794 . 0 0 "[ . 1 . 2]" 1
1797 1 20 LYS HG2 1 21 THR H 3.283 . 4.630 4.542 3.825 5.133 0.503 14 1 "[ . 1 +. 2]" 1
1798 1 21 THR H 1 22 LEU MD1 3.452 . 4.941 4.623 4.589 4.708 . 0 0 "[ . 1 . 2]" 1
1799 1 17 VAL MG2 1 21 THR H 3.710 . 5.430 4.077 4.001 4.129 . 0 0 "[ . 1 . 2]" 1
1800 1 18 VAL MG1 1 21 THR H 3.841 . 5.685 4.676 4.638 4.741 . 0 0 "[ . 1 . 2]" 1
1801 1 18 VAL HA 1 21 THR H 3.448 . 4.934 3.690 3.619 3.737 . 0 0 "[ . 1 . 2]" 1
1802 1 21 THR H 1 21 THR HA 2.533 . 3.335 2.822 2.790 2.847 . 0 0 "[ . 1 . 2]" 1
1803 1 21 THR H 1 21 THR HB 2.587 . 3.424 2.406 2.365 2.444 . 0 0 "[ . 1 . 2]" 1
1804 1 20 LYS H 1 21 THR H 3.161 . 4.410 2.618 2.538 2.714 . 0 0 "[ . 1 . 2]" 1
1805 1 21 THR H 1 23 TRP H 3.576 . 5.174 3.981 3.883 4.128 . 0 0 "[ . 1 . 2]" 1
1806 1 33 GLN QE 1 33 GLN HG3 3.662 . 3.963 3.193 2.840 3.310 . 0 0 "[ . 1 . 2]" 1
1807 1 30 PRO HA 1 33 GLN QE 3.272 . 4.610 3.530 2.470 4.423 . 0 0 "[ . 1 . 2]" 1
1808 1 24 LYS H 1 24 LYS QE 3.617 . 5.252 3.743 3.412 4.707 . 0 0 "[ . 1 . 2]" 1
1809 1 29 TRP HE1 1 97 MET ME 2.434 . 3.175 2.089 1.515 2.325 0.178 7 0 "[ . 1 . 2]" 1
1810 1 29 TRP HE1 1 30 PRO HD3 3.439 . 4.917 3.358 3.318 3.380 . 0 0 "[ . 1 . 2]" 1
1811 1 27 PHE HA 1 29 TRP HE1 3.117 . 4.332 3.603 3.398 3.736 . 0 0 "[ . 1 . 2]" 1
1812 1 116 GLU H 1 116 GLU HB2 2.493 . 3.270 2.539 2.390 2.754 . 0 0 "[ . 1 . 2]" 1
1813 1 116 GLU H 1 116 GLU HB3 2.704 . 3.618 3.588 3.560 3.627 0.009 20 0 "[ . 1 . 2]" 1
1814 1 116 GLU H 1 116 GLU HG3 2.540 . 3.347 3.140 2.124 3.533 0.186 14 0 "[ . 1 . 2]" 1
1815 1 116 GLU H 1 116 GLU HA 2.207 . 2.816 2.810 2.756 2.873 0.057 16 0 "[ . 1 . 2]" 1
1816 1 115 GLU HA 1 116 GLU H 2.220 . 2.836 2.189 2.058 2.325 . 0 0 "[ . 1 . 2]" 1
1817 1 26 GLN H 1 26 GLN QB 2.675 . 3.569 2.055 1.928 2.938 . 0 0 "[ . 1 . 2]" 1
1818 1 25 HIS HA 1 26 GLN H 2.382 . 3.092 2.225 2.169 2.293 . 0 0 "[ . 1 . 2]" 1
1819 1 37 ALA H 1 38 VAL H 2.688 . 3.591 2.643 2.580 2.745 . 0 0 "[ . 1 . 2]" 1
1820 1 36 ASP HA 1 37 ALA H 2.651 . 3.530 2.159 2.142 2.180 . 0 0 "[ . 1 . 2]" 1
1821 1 37 ALA H 1 37 ALA MB 2.472 . 3.236 2.168 2.153 2.180 . 0 0 "[ . 1 . 2]" 1
1822 1 35 VAL H 1 35 VAL MG2 3.272 . 4.610 3.254 3.049 3.427 . 0 0 "[ . 1 . 2]" 1
1823 1 35 VAL H 1 35 VAL MG1 2.605 . 3.453 1.648 1.559 1.726 0.198 3 0 "[ . 1 . 2]" 1
1824 1 35 VAL H 1 35 VAL HB 2.585 . 3.420 3.349 3.273 3.447 0.027 13 0 "[ . 1 . 2]" 1
1825 1 34 PRO HB2 1 35 VAL H 3.211 . 4.500 3.555 3.342 3.821 . 0 0 "[ . 1 . 2]" 1
1826 1 34 PRO HA 1 35 VAL H 2.315 . 2.985 2.087 2.066 2.121 . 0 0 "[ . 1 . 2]" 1
1827 1 57 THR H 1 59 LYS QG 3.188 . 4.459 4.335 4.242 4.461 0.002 20 0 "[ . 1 . 2]" 1
1828 1 57 THR H 1 58 ILE HG13 4.179 . 6.362 4.636 4.413 4.892 . 0 0 "[ . 1 . 2]" 1
1829 1 34 PRO HG3 1 57 THR H 4.662 . 7.379 4.831 3.806 5.586 . 0 0 "[ . 1 . 2]" 1
1830 1 54 ASP HB3 1 57 THR H 5.644 . 9.626 4.371 4.337 4.512 . 0 0 "[ . 1 . 2]" 1
1831 1 57 THR H 1 57 THR HB 3.092 . 4.287 2.435 2.380 2.516 . 0 0 "[ . 1 . 2]" 1
1832 1 57 THR H 1 58 ILE H 2.906 . 3.962 2.664 2.508 2.808 . 0 0 "[ . 1 . 2]" 1
1833 1 56 GLY H 1 57 THR H 3.019 . 4.158 2.764 2.601 2.914 . 0 0 "[ . 1 . 2]" 1
1834 1 115 GLU H 1 115 GLU HA 2.722 . 3.648 2.790 2.721 2.932 . 0 0 "[ . 1 . 2]" 1
1835 1 114 THR HA 1 115 GLU H 2.501 . 3.283 2.283 2.138 2.492 . 0 0 "[ . 1 . 2]" 1
1836 1 115 GLU H 1 115 GLU QG 2.584 . 3.418 3.066 2.206 3.423 0.005 15 0 "[ . 1 . 2]" 1
1837 1 115 GLU H 1 115 GLU HB2 2.809 . 3.795 2.209 1.966 2.743 . 0 0 "[ . 1 . 2]" 1
1838 1 115 GLU H 1 115 GLU HB3 2.576 . 3.405 3.382 3.130 3.577 0.172 2 0 "[ . 1 . 2]" 1
1839 1 10 GLN HE22 1 115 GLU H 3.402 . 4.848 3.037 2.344 3.912 . 0 0 "[ . 1 . 2]" 1
1840 1 24 LYS HB3 1 25 HIS H 3.190 . 4.462 4.213 4.026 4.418 . 0 0 "[ . 1 . 2]" 1
1841 1 25 HIS H 1 25 HIS HB3 2.612 . 3.465 2.968 2.919 3.015 . 0 0 "[ . 1 . 2]" 1
1842 1 25 HIS H 1 25 HIS HB2 2.605 . 3.453 2.109 2.057 2.204 . 0 0 "[ . 1 . 2]" 1
1843 1 24 LYS HA 1 25 HIS H 2.792 . 3.767 3.165 3.004 3.282 . 0 0 "[ . 1 . 2]" 1
1844 1 95 VAL H 1 96 LEU HB2 3.212 . 4.502 4.547 4.501 4.570 0.068 2 0 "[ . 1 . 2]" 1
1845 1 95 VAL H 1 96 LEU HG 3.148 . 4.387 4.218 4.026 4.349 . 0 0 "[ . 1 . 2]" 1
1846 1 95 VAL H 1 95 VAL MG1 2.445 . 3.192 1.828 1.810 1.842 . 0 0 "[ . 1 . 2]" 1
1847 1 94 ILE MG 1 95 VAL H 2.483 . 3.253 1.948 1.871 2.021 . 0 0 "[ . 1 . 2]" 1
1848 1 92 ASP HB3 1 95 VAL H 2.578 . 3.409 2.596 2.538 2.642 . 0 0 "[ . 1 . 2]" 1
1849 1 95 VAL H 1 95 VAL HA 2.578 . 3.409 2.850 2.841 2.875 . 0 0 "[ . 1 . 2]" 1
1850 1 95 VAL H 1 96 LEU H 2.417 . 3.147 2.531 2.424 2.576 . 0 0 "[ . 1 . 2]" 1
1851 1 45 TYR H 1 45 TYR HB2 2.970 . 4.073 2.273 2.250 2.315 . 0 0 "[ . 1 . 2]" 1
1852 1 45 TYR H 1 45 TYR HB3 3.536 . 5.099 2.915 2.882 2.976 . 0 0 "[ . 1 . 2]" 1
1853 1 39 LYS H 1 39 LYS HG3 3.233 . 4.539 4.417 4.048 4.550 0.011 19 0 "[ . 1 . 2]" 1
1854 1 39 LYS H 1 39 LYS HG2 3.517 . 5.063 4.378 4.134 4.565 . 0 0 "[ . 1 . 2]" 1
1855 1 38 VAL QG 1 39 LYS H 3.223 . 4.115 2.440 2.330 2.879 . 0 0 "[ . 1 . 2]" 1
1856 1 39 LYS H 1 39 LYS HB3 2.578 . 3.409 3.194 3.034 3.427 0.018 15 0 "[ . 1 . 2]" 1
1857 1 39 LYS H 1 39 LYS HA 2.758 . 3.709 2.860 2.784 2.883 . 0 0 "[ . 1 . 2]" 1
1858 1 39 LYS H 1 39 LYS HB2 2.525 . 3.322 2.127 2.071 2.193 . 0 0 "[ . 1 . 2]" 1
1859 1 5 LYS HA 1 6 ARG H 2.820 . 3.814 2.169 2.098 2.336 . 0 0 "[ . 1 . 2]" 1
1860 1 6 ARG H 1 6 ARG HB3 3.387 . 4.821 2.782 2.571 3.199 . 0 0 "[ . 1 . 2]" 1
1861 1 92 ASP H 1 94 ILE MG 3.324 . 4.705 4.578 4.553 4.604 . 0 0 "[ . 1 . 2]" 1
1862 1 92 ASP H 1 96 LEU MD2 3.583 . 5.188 3.649 3.580 3.766 . 0 0 "[ . 1 . 2]" 1
1863 1 92 ASP H 1 95 VAL MG1 2.607 . 3.456 1.754 1.723 1.818 0.035 4 0 "[ . 1 . 2]" 1
1864 1 89 LYS HB3 1 92 ASP H 3.935 . 5.870 5.423 5.189 5.806 . 0 0 "[ . 1 . 2]" 1
1865 1 92 ASP H 1 95 VAL HB 2.997 . 4.120 4.229 4.195 4.266 0.146 18 0 "[ . 1 . 2]" 1
1866 1 91 GLY HA2 1 92 ASP H 2.978 . 4.087 3.326 3.288 3.377 . 0 0 "[ . 1 . 2]" 1
1867 1 92 ASP H 1 92 ASP HA 2.460 . 3.216 2.877 2.868 2.887 . 0 0 "[ . 1 . 2]" 1
1868 1 92 ASP H 1 95 VAL H 3.277 . 4.620 3.868 3.814 3.932 . 0 0 "[ . 1 . 2]" 1
1869 1 91 GLY H 1 92 ASP H 2.448 . 3.197 2.056 2.014 2.118 . 0 0 "[ . 1 . 2]" 1
1870 1 92 ASP H 1 93 ASP H 3.693 . 5.398 4.585 4.565 4.605 . 0 0 "[ . 1 . 2]" 1
1871 1 102 GLU H 1 102 GLU HB3 2.447 . 3.195 3.376 3.308 3.446 0.251 20 0 "[ . 1 . 2]" 1
1872 1 101 LEU HB3 1 102 GLU H 3.058 . 4.227 3.827 3.781 3.863 . 0 0 "[ . 1 . 2]" 1
1873 1 102 GLU H 1 102 GLU HB2 2.215 . 2.828 2.097 2.069 2.155 . 0 0 "[ . 1 . 2]" 1
1874 1 101 LEU HB2 1 102 GLU H 2.713 . 3.633 2.908 2.823 2.955 . 0 0 "[ . 1 . 2]" 1
1875 1 102 GLU H 1 102 GLU HA 2.686 . 3.588 2.813 2.801 2.823 . 0 0 "[ . 1 . 2]" 1
1876 1 101 LEU HA 1 102 GLU H 3.057 . 4.225 3.518 3.500 3.537 . 0 0 "[ . 1 . 2]" 1
1877 1 99 GLU HA 1 102 GLU H 3.118 . 4.333 3.124 2.961 3.221 . 0 0 "[ . 1 . 2]" 1
1878 1 81 PHE HZ 1 102 GLU H 3.712 . 5.434 4.796 4.685 4.990 . 0 0 "[ . 1 . 2]" 1
1879 1 81 PHE HE2 1 102 GLU H 3.435 . 4.910 4.657 4.550 4.830 . 0 0 "[ . 1 . 2]" 1
1880 1 102 GLU H 1 104 LEU H 3.622 . 5.262 3.711 3.663 3.757 . 0 0 "[ . 1 . 2]" 1
1881 1 100 ALA H 1 102 GLU H 3.529 . 5.086 3.827 3.759 3.903 . 0 0 "[ . 1 . 2]" 1
1882 1 102 GLU H 1 103 LYS H 2.650 . 3.528 2.755 2.715 2.794 . 0 0 "[ . 1 . 2]" 1
1883 1 67 TYR HB2 1 68 TRP H 3.100 . 4.301 4.245 4.177 4.294 . 0 0 "[ . 1 . 2]" 1
1884 1 68 TRP H 1 68 TRP QB 2.345 . 3.033 2.400 2.268 2.486 . 0 0 "[ . 1 . 2]" 1
1885 1 68 TRP H 1 72 GLU HB3 4.050 . 6.101 4.366 3.974 4.820 . 0 0 "[ . 1 . 2]" 1
1886 1 67 TYR HA 1 68 TRP H 2.478 . 3.245 2.186 2.154 2.206 . 0 0 "[ . 1 . 2]" 1
1887 1 68 TRP H 1 68 TRP HD1 4.257 . 6.522 3.244 2.854 4.905 . 0 0 "[ . 1 . 2]" 1
1888 1 68 TRP H 1 69 ASN H 2.860 . 3.882 2.213 2.121 2.364 . 0 0 "[ . 1 . 2]" 1
1889 1 58 ILE H 1 58 ILE MD 2.974 . 4.080 3.231 3.148 3.319 . 0 0 "[ . 1 . 2]" 1
1890 1 58 ILE H 1 58 ILE HG12 3.033 . 4.183 3.792 3.681 3.909 . 0 0 "[ . 1 . 2]" 1
1891 1 58 ILE H 1 59 LYS QG 3.070 . 4.248 4.162 3.978 4.259 0.011 20 0 "[ . 1 . 2]" 1
1892 1 58 ILE H 1 58 ILE HB 2.716 . 3.638 2.207 2.179 2.245 . 0 0 "[ . 1 . 2]" 1
1893 1 58 ILE H 1 58 ILE HG13 2.759 . 3.710 2.432 2.293 2.578 . 0 0 "[ . 1 . 2]" 1
1894 1 58 ILE H 1 58 ILE HA 2.709 . 3.626 2.812 2.801 2.829 . 0 0 "[ . 1 . 2]" 1
1895 1 57 THR HB 1 58 ILE H 2.919 . 3.984 2.720 2.609 2.814 . 0 0 "[ . 1 . 2]" 1
1896 1 58 ILE H 1 59 LYS H 3.261 . 4.590 2.740 2.646 2.787 . 0 0 "[ . 1 . 2]" 1
1897 1 58 ILE MD 1 76 ASP H 4.032 . 6.064 4.718 4.555 4.802 . 0 0 "[ . 1 . 2]" 1
1898 1 99 GLU H 1 100 ALA H 2.436 . 3.178 2.735 2.679 2.793 . 0 0 "[ . 1 . 2]" 1
1899 1 100 ALA H 1 101 LEU H 2.377 . 3.083 2.426 2.364 2.474 . 0 0 "[ . 1 . 2]" 1
1900 1 99 GLU HA 1 100 ALA H 2.976 . 4.083 3.558 3.537 3.577 . 0 0 "[ . 1 . 2]" 1
1901 1 100 ALA H 1 100 ALA HA 2.686 . 3.588 2.859 2.840 2.875 . 0 0 "[ . 1 . 2]" 1
1902 1 97 MET HA 1 100 ALA H 2.616 . 3.472 3.309 3.203 3.414 . 0 0 "[ . 1 . 2]" 1
1903 1 99 GLU HG3 1 100 ALA H 3.592 . 5.205 4.671 4.530 4.798 . 0 0 "[ . 1 . 2]" 1
1904 1 99 GLU HB2 1 100 ALA H 2.442 . 3.188 2.837 2.737 2.927 . 0 0 "[ . 1 . 2]" 1
1905 1 100 ALA H 1 100 ALA MB 1.841 . 2.265 2.250 2.240 2.269 0.004 8 0 "[ . 1 . 2]" 1
1906 1 96 LEU H 1 98 ALA H 3.213 . 4.504 4.147 4.110 4.208 . 0 0 "[ . 1 . 2]" 1
1907 1 94 ILE HG13 1 98 ALA H 3.094 . 4.290 4.042 3.912 4.096 . 0 0 "[ . 1 . 2]" 1
1908 1 27 PHE H 1 27 PHE HB3 4.144 . 6.291 3.631 3.599 3.651 . 0 0 "[ . 1 . 2]" 1
1909 1 27 PHE H 1 27 PHE HB2 3.948 . 5.896 2.446 2.397 2.474 . 0 0 "[ . 1 . 2]" 1
1910 1 26 GLN HG3 1 27 PHE H 3.433 . 4.906 3.023 2.766 4.302 . 0 0 "[ . 1 . 2]" 1
1911 1 26 GLN HG2 1 27 PHE H 3.006 . 4.135 4.129 2.726 4.619 0.484 14 0 "[ . 1 . 2]" 1
1912 1 14 LEU H 1 112 LEU MD2 2.933 . 4.008 3.859 3.843 3.876 . 0 0 "[ . 1 . 2]" 1
1913 1 14 LEU H 1 14 LEU MD2 2.759 . 3.711 3.646 3.631 3.675 . 0 0 "[ . 1 . 2]" 1
1914 1 14 LEU H 1 14 LEU HB2 2.694 . 3.601 2.125 2.113 2.137 . 0 0 "[ . 1 . 2]" 1
1915 1 14 LEU H 1 70 ALA MB 3.693 . 5.398 3.883 3.794 3.987 . 0 0 "[ . 1 . 2]" 1
1916 1 14 LEU H 1 14 LEU HG 2.508 . 3.294 2.906 2.795 2.958 . 0 0 "[ . 1 . 2]" 1
1917 1 14 LEU H 1 14 LEU HB3 2.912 . 3.972 3.448 3.440 3.456 . 0 0 "[ . 1 . 2]" 1
1918 1 13 TYR HB2 1 14 LEU H 2.637 . 3.506 3.611 3.588 3.636 0.130 6 0 "[ . 1 . 2]" 1
1919 1 14 LEU H 1 14 LEU HA 2.713 . 3.633 2.728 2.716 2.737 . 0 0 "[ . 1 . 2]" 1
1920 1 11 LEU HA 1 14 LEU H 3.125 . 4.345 3.377 3.313 3.467 . 0 0 "[ . 1 . 2]" 1
1921 1 13 TYR HA 1 14 LEU H 3.348 . 4.749 3.554 3.547 3.560 . 0 0 "[ . 1 . 2]" 1
1922 1 13 TYR HD1 1 14 LEU H 3.309 . 4.677 2.948 2.882 2.995 . 0 0 "[ . 1 . 2]" 1
1923 1 14 LEU H 1 15 LEU H 2.293 . 2.951 2.901 2.874 2.928 . 0 0 "[ . 1 . 2]" 1
1924 1 5 LYS H 1 5 LYS HB3 2.690 . 3.595 3.213 2.436 3.886 0.291 5 0 "[ . 1 . 2]" 1
1925 1 5 LYS H 1 5 LYS QG 3.712 . 5.434 3.166 2.134 4.067 . 0 0 "[ . 1 . 2]" 1
1926 1 47 LYS HB2 1 49 ILE H 4.022 . 6.045 4.817 4.499 5.411 . 0 0 "[ . 1 . 2]" 1
1927 1 48 ILE HB 1 49 ILE H 2.378 . 3.085 2.493 2.376 2.590 . 0 0 "[ . 1 . 2]" 1
1928 1 49 ILE H 1 49 ILE HB 2.505 . 3.289 2.538 2.511 2.562 . 0 0 "[ . 1 . 2]" 1
1929 1 48 ILE MG 1 49 ILE H 3.371 . 4.791 2.989 2.843 3.095 . 0 0 "[ . 1 . 2]" 1
1930 1 49 ILE H 1 49 ILE HG12 2.741 . 3.680 2.088 1.966 2.164 . 0 0 "[ . 1 . 2]" 1
1931 1 49 ILE H 1 49 ILE MD 3.058 . 4.227 3.476 2.958 3.541 . 0 0 "[ . 1 . 2]" 1
1932 1 45 TYR HA 1 49 ILE H 4.577 . 7.196 3.440 3.331 3.569 . 0 0 "[ . 1 . 2]" 1
1933 1 49 ILE H 1 49 ILE HA 2.679 . 3.576 2.827 2.794 2.841 . 0 0 "[ . 1 . 2]" 1
1934 1 47 LYS HA 1 49 ILE H 3.753 . 5.513 4.830 4.726 5.025 . 0 0 "[ . 1 . 2]" 1
1935 1 46 TYR HA 1 49 ILE H 2.961 . 4.057 3.752 3.651 3.899 . 0 0 "[ . 1 . 2]" 1
1936 1 48 ILE H 1 49 ILE H 2.539 . 3.345 2.595 2.470 2.733 . 0 0 "[ . 1 . 2]" 1
1937 1 78 ASN QB 1 79 THR H 2.830 . 3.831 2.296 2.090 2.607 . 0 0 "[ . 1 . 2]" 1
1938 1 79 THR H 1 79 THR MG 3.261 . 4.590 3.705 3.654 3.735 . 0 0 "[ . 1 . 2]" 1
1939 1 79 THR H 1 79 THR HB 2.897 . 3.946 2.347 2.245 2.411 . 0 0 "[ . 1 . 2]" 1
1940 1 79 THR H 1 79 THR HA 2.583 . 3.417 2.757 2.720 2.822 . 0 0 "[ . 1 . 2]" 1
1941 1 76 ASP HA 1 79 THR H 3.354 . 4.760 3.075 2.965 3.179 . 0 0 "[ . 1 . 2]" 1
1942 1 79 THR H 1 80 MET H 2.846 . 3.859 2.816 2.519 2.981 . 0 0 "[ . 1 . 2]" 1
1943 1 22 LEU H 1 22 LEU MD1 2.434 . 3.175 2.970 2.934 3.000 . 0 0 "[ . 1 . 2]" 1
1944 1 21 THR MG 1 22 LEU H 2.912 . 3.972 3.230 3.122 3.305 . 0 0 "[ . 1 . 2]" 1
1945 1 22 LEU H 1 22 LEU HB3 2.661 . 3.546 3.531 3.525 3.545 . 0 0 "[ . 1 . 2]" 1
1946 1 22 LEU H 1 22 LEU HG 2.550 . 3.363 2.682 2.630 2.726 . 0 0 "[ . 1 . 2]" 1
1947 1 22 LEU H 1 22 LEU HB2 2.609 . 3.460 2.291 2.280 2.313 . 0 0 "[ . 1 . 2]" 1
1948 1 18 VAL HA 1 22 LEU H 3.139 . 4.371 3.700 3.646 3.762 . 0 0 "[ . 1 . 2]" 1
1949 1 22 LEU H 1 22 LEU HA 2.458 . 3.213 2.830 2.811 2.846 . 0 0 "[ . 1 . 2]" 1
1950 1 21 THR HB 1 22 LEU H 2.470 . 3.233 2.561 2.489 2.618 . 0 0 "[ . 1 . 2]" 1
1951 1 22 LEU H 1 23 TRP QB 3.764 . 5.535 4.219 4.060 4.266 . 0 0 "[ . 1 . 2]" 1
1952 1 22 LEU H 1 23 TRP HA 3.915 . 5.831 5.206 5.161 5.241 . 0 0 "[ . 1 . 2]" 1
1953 1 21 THR H 1 22 LEU H 2.650 . 3.528 2.620 2.581 2.715 . 0 0 "[ . 1 . 2]" 1
1954 1 12 GLN HB3 1 13 TYR H 3.239 . 4.551 2.309 2.122 2.550 . 0 0 "[ . 1 . 2]" 1
1955 1 12 GLN HB2 1 13 TYR H 2.751 . 3.697 2.857 2.802 2.947 . 0 0 "[ . 1 . 2]" 1
1956 1 12 GLN QG 1 13 TYR H 3.293 . 4.648 4.076 3.974 4.196 . 0 0 "[ . 1 . 2]" 1
1957 1 13 TYR H 1 13 TYR HB2 2.359 . 3.055 2.344 2.321 2.389 . 0 0 "[ . 1 . 2]" 1
1958 1 10 GLN HA 1 13 TYR H 3.343 . 4.740 3.364 3.225 3.402 . 0 0 "[ . 1 . 2]" 1
1959 1 13 TYR H 1 13 TYR HA 2.799 . 3.778 2.759 2.751 2.768 . 0 0 "[ . 1 . 2]" 1
1960 1 13 TYR H 1 14 LEU H 2.289 . 2.944 2.997 2.976 3.021 0.077 4 0 "[ . 1 . 2]" 1
1961 1 9 ASN HA 1 13 TYR H 4.057 . 6.114 3.735 3.607 3.845 . 0 0 "[ . 1 . 2]" 1
1962 1 109 ILE QG 1 110 ASN H 3.423 . 3.672 3.278 3.240 3.332 . 0 0 "[ . 1 . 2]" 1
1963 1 109 ILE HB 1 110 ASN H 2.865 . 3.891 2.859 2.802 2.923 . 0 0 "[ . 1 . 2]" 1
1964 1 110 ASN H 1 111 GLU HB2 3.568 . 5.159 4.959 4.885 5.027 . 0 0 "[ . 1 . 2]" 1
1965 1 110 ASN H 1 111 GLU HG3 3.021 . 4.162 4.203 4.089 4.250 0.088 18 0 "[ . 1 . 2]" 1
1966 1 110 ASN H 1 110 ASN QB 1.870 . 2.307 2.078 2.013 2.123 . 0 0 "[ . 1 . 2]" 1
1967 1 106 LEU HA 1 110 ASN H 3.475 . 4.984 3.608 3.560 3.662 . 0 0 "[ . 1 . 2]" 1
1968 1 108 LYS HA 1 110 ASN H 3.224 . 4.523 4.284 4.196 4.367 . 0 0 "[ . 1 . 2]" 1
1969 1 110 ASN H 1 111 GLU HA 3.691 . 5.394 5.220 5.180 5.265 . 0 0 "[ . 1 . 2]" 1
1970 1 110 ASN H 1 110 ASN HA 2.313 . 2.982 2.791 2.778 2.802 . 0 0 "[ . 1 . 2]" 1
1971 1 110 ASN H 1 111 GLU H 2.340 . 3.025 2.535 2.481 2.592 . 0 0 "[ . 1 . 2]" 1
1972 1 108 LYS H 1 110 ASN H 3.575 . 5.173 3.952 3.909 3.983 . 0 0 "[ . 1 . 2]" 1
1973 1 109 ILE H 1 110 ASN H 2.379 . 3.087 2.383 2.359 2.419 . 0 0 "[ . 1 . 2]" 1
1974 1 70 ALA H 1 70 ALA MB 3.168 . 4.423 2.044 1.982 2.092 . 0 0 "[ . 1 . 2]" 1
1975 1 81 PHE HZ 1 105 PHE H 3.383 . 4.814 4.245 4.133 4.394 . 0 0 "[ . 1 . 2]" 1
1976 1 102 GLU HA 1 104 LEU H 3.282 . 4.628 3.977 3.930 4.028 . 0 0 "[ . 1 . 2]" 1
1977 1 103 LYS HE2 1 104 LEU H 4.276 . 6.561 5.347 4.778 5.797 . 0 0 "[ . 1 . 2]" 1
1978 1 104 LEU H 1 105 PHE HB3 4.608 . 7.262 4.283 4.208 4.338 . 0 0 "[ . 1 . 2]" 1
1979 1 101 LEU HA 1 104 LEU H 2.760 . 3.712 3.200 3.155 3.236 . 0 0 "[ . 1 . 2]" 1
1980 1 103 LYS HA 1 104 LEU H 3.376 . 4.801 3.430 3.401 3.451 . 0 0 "[ . 1 . 2]" 1
1981 1 104 LEU H 1 104 LEU HA 2.364 . 3.063 2.890 2.878 2.897 . 0 0 "[ . 1 . 2]" 1
1982 1 103 LYS H 1 104 LEU H 2.555 . 3.371 2.637 2.603 2.665 . 0 0 "[ . 1 . 2]" 1
1983 1 104 LEU H 1 107 GLN H 4.218 . 6.442 4.087 4.008 4.156 . 0 0 "[ . 1 . 2]" 1
1984 1 104 LEU H 1 104 LEU HB3 1.930 . 2.396 2.417 2.406 2.432 0.036 4 0 "[ . 1 . 2]" 1
1985 1 104 LEU H 1 104 LEU HB2 2.286 . 2.939 2.630 2.605 2.649 . 0 0 "[ . 1 . 2]" 1
1986 1 103 LYS QG 1 104 LEU H 2.855 . 3.874 2.499 2.426 2.638 . 0 0 "[ . 1 . 2]" 1
1987 1 101 LEU MD2 1 104 LEU H 4.124 . 6.250 4.764 4.713 4.816 . 0 0 "[ . 1 . 2]" 1
1988 1 58 ILE MD 1 80 MET H 4.442 . 6.908 3.364 3.230 3.451 . 0 0 "[ . 1 . 2]" 1
1989 1 94 ILE MG 1 96 LEU H 3.295 . 4.652 4.127 4.103 4.179 . 0 0 "[ . 1 . 2]" 1
1990 1 96 LEU H 1 96 LEU MD2 2.432 . 3.171 2.691 2.618 2.752 . 0 0 "[ . 1 . 2]" 1
1991 1 95 VAL MG1 1 96 LEU H 2.846 . 3.859 2.540 2.496 2.766 . 0 0 "[ . 1 . 2]" 1
1992 1 95 VAL MG2 1 96 LEU H 2.824 . 3.821 2.485 2.421 2.531 . 0 0 "[ . 1 . 2]" 1
1993 1 96 LEU H 1 96 LEU HB3 2.795 . 3.771 3.563 3.554 3.571 . 0 0 "[ . 1 . 2]" 1
1994 1 96 LEU H 1 96 LEU HG 2.351 . 3.042 2.266 2.182 2.331 . 0 0 "[ . 1 . 2]" 1
1995 1 96 LEU H 1 96 LEU HB2 2.299 . 2.959 2.467 2.437 2.518 . 0 0 "[ . 1 . 2]" 1
1996 1 95 VAL HB 1 96 LEU H 2.895 . 3.942 4.092 4.078 4.113 0.171 19 0 "[ . 1 . 2]" 1
1997 1 92 ASP HB3 1 96 LEU H 4.122 . 6.246 4.193 4.145 4.230 . 0 0 "[ . 1 . 2]" 1
1998 1 95 VAL HA 1 96 LEU H 3.253 . 4.575 3.499 3.478 3.510 . 0 0 "[ . 1 . 2]" 1
1999 1 96 LEU H 1 96 LEU HA 2.563 . 3.384 2.788 2.780 2.800 . 0 0 "[ . 1 . 2]" 1
2000 1 93 ASP HA 1 96 LEU H 3.405 . 4.854 3.502 3.322 3.591 . 0 0 "[ . 1 . 2]" 1
2001 1 96 LEU H 1 97 MET H 2.467 . 3.228 2.698 2.608 2.753 . 0 0 "[ . 1 . 2]" 1
2002 1 58 ILE MD 1 59 LYS H 3.755 . 5.517 4.576 4.507 4.662 . 0 0 "[ . 1 . 2]" 1
2003 1 75 GLN HB3 1 77 PHE H 3.580 . 5.182 5.308 5.228 5.506 0.324 20 0 "[ . 1 . 2]" 1
2004 1 88 ASN H 1 89 LYS H 3.743 . 5.494 4.344 4.299 4.415 . 0 0 "[ . 1 . 2]" 1
2005 1 88 ASN HB3 1 89 LYS H 2.591 . 3.430 3.481 3.369 3.562 0.132 19 0 "[ . 1 . 2]" 1
2006 1 89 LYS H 1 89 LYS HB3 2.699 . 3.610 3.477 2.112 3.579 . 0 0 "[ . 1 . 2]" 1
2007 1 89 LYS H 1 89 LYS HB2 2.688 . 3.591 2.401 2.260 3.422 . 0 0 "[ . 1 . 2]" 1
2008 1 89 LYS H 1 89 LYS QG 2.367 . 3.068 2.476 2.282 2.978 . 0 0 "[ . 1 . 2]" 1
2009 1 89 LYS H 1 94 ILE MG 4.600 . 7.245 5.482 5.389 5.630 . 0 0 "[ . 1 . 2]" 1
2010 1 60 LYS H 1 61 ARG H 3.069 . 4.247 2.864 2.777 2.961 . 0 0 "[ . 1 . 2]" 1
2011 1 60 LYS HB2 1 61 ARG H 2.848 . 3.862 2.654 2.039 3.511 . 0 0 "[ . 1 . 2]" 1
2012 1 61 ARG H 1 61 ARG QD 3.740 . 5.488 3.876 3.081 4.029 . 0 0 "[ . 1 . 2]" 1
2013 1 61 ARG H 1 61 ARG HG3 3.479 . 4.992 2.290 2.060 3.397 . 0 0 "[ . 1 . 2]" 1
2014 1 61 ARG H 1 61 ARG HB3 3.228 . 4.531 3.576 3.549 3.608 . 0 0 "[ . 1 . 2]" 1
2015 1 35 VAL H 1 54 ASP H 4.370 . 6.757 6.374 5.569 6.550 . 0 0 "[ . 1 . 2]" 1
2016 1 19 LEU H 1 22 LEU HB3 4.593 . 7.230 6.660 6.615 6.682 . 0 0 "[ . 1 . 2]" 1
2017 1 17 VAL H 1 19 LEU H 3.395 . 4.835 4.462 4.369 4.541 . 0 0 "[ . 1 . 2]" 1
2018 1 15 LEU MD2 1 63 GLU H 3.000 . 4.125 3.020 2.738 3.123 . 0 0 "[ . 1 . 2]" 1
2019 1 62 LEU HB2 1 63 GLU H 3.012 . 4.146 2.428 2.286 2.506 . 0 0 "[ . 1 . 2]" 1
2020 1 63 GLU H 1 63 GLU HB2 2.641 . 3.513 2.145 2.086 2.185 . 0 0 "[ . 1 . 2]" 1
2021 1 63 GLU H 1 63 GLU HB3 2.631 . 3.497 3.468 3.418 3.504 0.007 8 0 "[ . 1 . 2]" 1
2022 1 62 LEU HB3 1 63 GLU H 2.869 . 3.898 2.864 2.692 2.969 . 0 0 "[ . 1 . 2]" 1
2023 1 63 GLU H 1 63 GLU HG2 2.609 . 3.460 3.059 2.851 3.863 0.403 20 0 "[ . 1 . 2]" 1
2024 1 60 LYS HA 1 63 GLU H 3.200 . 4.480 4.074 3.893 4.233 . 0 0 "[ . 1 . 2]" 1
2025 1 63 GLU H 1 64 ASN H 3.014 . 4.149 2.544 2.435 2.661 . 0 0 "[ . 1 . 2]" 1
2026 1 62 LEU H 1 63 GLU H 3.037 . 4.190 2.775 2.654 2.897 . 0 0 "[ . 1 . 2]" 1
2027 1 63 GLU H 1 63 GLU HA 2.782 . 3.750 2.841 2.797 2.862 . 0 0 "[ . 1 . 2]" 1
2028 1 49 ILE MG 1 83 ASN H 5.701 . 9.764 4.350 4.294 4.408 . 0 0 "[ . 1 . 2]" 1
2029 1 49 ILE MD 1 83 ASN H 3.699 . 5.409 4.554 4.492 5.019 . 0 0 "[ . 1 . 2]" 1
2030 1 83 ASN H 1 86 ILE MD 3.309 . 4.677 3.154 3.056 3.252 . 0 0 "[ . 1 . 2]" 1
2031 1 79 THR MG 1 83 ASN H 3.063 . 4.236 3.660 3.577 3.745 . 0 0 "[ . 1 . 2]" 1
2032 1 82 THR MG 1 83 ASN H 3.003 . 4.130 3.673 3.614 3.737 . 0 0 "[ . 1 . 2]" 1
2033 1 83 ASN H 1 83 ASN QB 2.981 . 3.746 2.670 2.530 2.788 . 0 0 "[ . 1 . 2]" 1
2034 1 80 MET HA 1 83 ASN H 4.665 . 7.385 3.834 3.727 4.044 . 0 0 "[ . 1 . 2]" 1
2035 1 82 THR HA 1 83 ASN H 2.786 . 3.756 3.629 3.619 3.647 . 0 0 "[ . 1 . 2]" 1
2036 1 83 ASN H 1 83 ASN HA 2.376 . 3.082 2.829 2.814 2.851 . 0 0 "[ . 1 . 2]" 1
2037 1 83 ASN H 1 84 CYS H 2.686 . 3.588 2.677 2.570 2.758 . 0 0 "[ . 1 . 2]" 1
2038 1 83 ASN H 1 85 TYR H 3.472 . 4.978 3.883 3.837 4.021 . 0 0 "[ . 1 . 2]" 1
2039 1 81 PHE H 1 83 ASN H 3.790 . 5.586 4.389 4.321 4.466 . 0 0 "[ . 1 . 2]" 1
2040 1 82 THR H 1 83 ASN H 3.109 . 4.317 2.690 2.631 2.752 . 0 0 "[ . 1 . 2]" 1
2041 1 54 ASP HA 1 55 MET H 2.981 . 4.092 2.264 2.223 2.467 . 0 0 "[ . 1 . 2]" 1
2042 1 55 MET H 1 55 MET HG2 3.012 . 4.146 3.838 3.787 3.902 . 0 0 "[ . 1 . 2]" 1
2043 1 54 ASP HB2 1 55 MET H 3.424 . 4.889 2.877 2.780 3.561 . 0 0 "[ . 1 . 2]" 1
2044 1 55 MET H 1 55 MET HB3 2.629 . 3.493 3.555 3.542 3.578 0.085 16 0 "[ . 1 . 2]" 1
2045 1 54 ASP H 1 55 MET H 3.730 . 5.469 4.397 4.381 4.439 . 0 0 "[ . 1 . 2]" 1
2046 1 55 MET H 1 56 GLY H 3.221 . 4.518 2.847 2.812 2.893 . 0 0 "[ . 1 . 2]" 1
2047 1 55 MET H 1 55 MET ME 3.069 . 4.247 4.048 3.940 4.085 . 0 0 "[ . 1 . 2]" 1
2048 1 96 LEU HB3 1 97 MET H 2.856 . 3.876 3.614 3.538 3.812 . 0 0 "[ . 1 . 2]" 1
2049 1 97 MET H 1 97 MET HG3 2.345 . 3.032 2.161 2.075 2.237 . 0 0 "[ . 1 . 2]" 1
2050 1 94 ILE MG 1 97 MET H 3.758 . 5.523 4.821 4.787 4.868 . 0 0 "[ . 1 . 2]" 1
2051 1 94 ILE MD 1 97 MET H 4.747 . 7.564 4.256 4.196 4.400 . 0 0 "[ . 1 . 2]" 1
2052 1 96 LEU HB2 1 97 MET H 2.245 . 2.875 2.582 2.505 2.760 . 0 0 "[ . 1 . 2]" 1
2053 1 97 MET H 1 97 MET HB3 2.826 . 3.824 3.564 3.525 3.585 . 0 0 "[ . 1 . 2]" 1
2054 1 97 MET H 1 97 MET HB2 2.571 . 3.397 2.491 2.410 2.574 . 0 0 "[ . 1 . 2]" 1
2055 1 97 MET H 1 97 MET HG2 2.624 . 3.485 3.294 3.007 3.557 0.072 17 0 "[ . 1 . 2]" 1
2056 1 94 ILE HA 1 97 MET H 3.606 . 5.231 3.212 3.132 3.274 . 0 0 "[ . 1 . 2]" 1
2057 1 97 MET H 1 97 MET HA 2.876 . 3.910 2.838 2.803 2.857 . 0 0 "[ . 1 . 2]" 1
2058 1 96 LEU HA 1 97 MET H 3.493 . 5.018 3.493 3.458 3.510 . 0 0 "[ . 1 . 2]" 1
2059 1 93 ASP HA 1 97 MET H 3.459 . 4.955 3.904 3.809 3.988 . 0 0 "[ . 1 . 2]" 1
2060 1 95 VAL H 1 97 MET H 3.726 . 5.461 3.909 3.673 3.991 . 0 0 "[ . 1 . 2]" 1
2061 1 31 PHE HZ 1 97 MET H 3.699 . 5.409 5.222 5.105 5.365 . 0 0 "[ . 1 . 2]" 1
2062 1 27 PHE QD 1 97 MET H 4.075 . 6.151 4.380 4.261 4.534 . 0 0 "[ . 1 . 2]" 1
2063 1 97 MET H 1 98 ALA H 2.510 . 3.297 2.587 2.511 2.728 . 0 0 "[ . 1 . 2]" 1
2064 1 18 VAL MG2 1 109 ILE H 3.070 . 4.248 3.534 3.464 3.604 . 0 0 "[ . 1 . 2]" 1
2065 1 109 ILE H 1 109 ILE QG 2.691 . 3.596 1.575 1.551 1.630 0.235 20 0 "[ . 1 . 2]" 1
2066 1 108 LYS HG2 1 109 ILE H 3.545 . 5.116 3.959 3.935 3.985 . 0 0 "[ . 1 . 2]" 1
2067 1 109 ILE H 1 109 ILE HB 2.678 . 3.575 2.884 2.869 2.907 . 0 0 "[ . 1 . 2]" 1
2068 1 108 LYS HB2 1 109 ILE H 3.035 . 4.187 2.546 2.519 2.580 . 0 0 "[ . 1 . 2]" 1
2069 1 107 GLN HB2 1 109 ILE H 4.596 . 7.236 5.490 5.284 5.584 . 0 0 "[ . 1 . 2]" 1
2070 1 107 GLN HB3 1 109 ILE H 4.684 . 7.427 4.697 4.613 4.796 . 0 0 "[ . 1 . 2]" 1
2071 1 109 ILE H 1 110 ASN QB 3.310 . 4.680 3.945 3.899 3.990 . 0 0 "[ . 1 . 2]" 1
2072 1 106 LEU HA 1 109 ILE H 3.152 . 4.394 2.924 2.890 2.961 . 0 0 "[ . 1 . 2]" 1
2073 1 105 PHE HA 1 109 ILE H 4.134 . 6.271 4.562 4.496 4.594 . 0 0 "[ . 1 . 2]" 1
2074 1 109 ILE H 1 109 ILE HA 2.567 . 3.391 2.861 2.853 2.870 . 0 0 "[ . 1 . 2]" 1
2075 1 108 LYS HA 1 109 ILE H 3.253 . 4.576 3.529 3.525 3.536 . 0 0 "[ . 1 . 2]" 1
2076 1 108 LYS H 1 109 ILE H 2.548 . 3.359 2.649 2.628 2.675 . 0 0 "[ . 1 . 2]" 1
2077 1 71 GLN H 1 71 GLN HG2 3.017 . 4.155 4.466 4.443 4.491 0.336 17 0 "[ . 1 . 2]" 1
2078 1 71 GLN H 1 71 GLN HB2 3.077 . 4.261 2.302 2.264 2.344 . 0 0 "[ . 1 . 2]" 1
2079 1 71 GLN H 1 71 GLN HB3 2.622 . 3.482 2.711 2.661 2.761 . 0 0 "[ . 1 . 2]" 1
2080 1 71 GLN H 1 74 ILE HB 3.394 . 4.834 4.593 4.521 4.703 . 0 0 "[ . 1 . 2]" 1
2081 1 70 ALA MB 1 71 GLN H 3.229 . 4.532 2.682 2.616 2.757 . 0 0 "[ . 1 . 2]" 1
2082 1 71 GLN H 1 74 ILE MD 3.520 . 5.069 3.185 3.089 3.286 . 0 0 "[ . 1 . 2]" 1
2083 1 48 ILE H 1 49 ILE MD 4.176 . 6.356 5.253 4.493 5.398 . 0 0 "[ . 1 . 2]" 1
2084 1 48 ILE H 1 49 ILE HG13 4.215 . 6.435 5.476 5.333 5.704 . 0 0 "[ . 1 . 2]" 1
2085 1 45 TYR HA 1 48 ILE H 4.140 . 6.282 3.678 3.567 3.791 . 0 0 "[ . 1 . 2]" 1
2086 1 11 LEU H 1 12 GLN H 2.993 . 4.113 2.666 2.617 2.761 . 0 0 "[ . 1 . 2]" 1
2087 1 12 GLN H 1 13 TYR H 2.722 . 3.648 2.959 2.901 3.011 . 0 0 "[ . 1 . 2]" 1
2088 1 9 ASN HA 1 12 GLN H 3.576 . 5.175 3.230 3.096 3.327 . 0 0 "[ . 1 . 2]" 1
2089 1 12 GLN H 1 12 GLN HA 2.566 . 3.389 2.750 2.738 2.764 . 0 0 "[ . 1 . 2]" 1
2090 1 12 GLN H 1 12 GLN QG 2.749 . 3.694 3.368 3.260 3.628 . 0 0 "[ . 1 . 2]" 1
2091 1 12 GLN H 1 12 GLN HB2 2.867 . 3.894 2.069 2.006 2.107 . 0 0 "[ . 1 . 2]" 1
2092 1 12 GLN H 1 12 GLN HB3 2.964 . 4.062 3.271 3.230 3.302 . 0 0 "[ . 1 . 2]" 1
2093 1 11 LEU HB2 1 12 GLN H 3.304 . 4.668 2.590 2.492 2.651 . 0 0 "[ . 1 . 2]" 1
2094 1 11 LEU HB3 1 12 GLN H 2.829 . 3.829 3.350 3.256 3.495 . 0 0 "[ . 1 . 2]" 1
2095 1 11 LEU MD1 1 12 GLN H 3.633 . 5.283 4.395 4.281 4.462 . 0 0 "[ . 1 . 2]" 1
2096 1 88 ASN HA 1 89 LYS H 2.299 . 2.960 2.101 2.073 2.149 . 0 0 "[ . 1 . 2]" 1
2097 1 73 CYS H 1 74 ILE HG13 3.004 . 4.132 4.200 4.163 4.225 0.093 5 0 "[ . 1 . 2]" 1
2098 1 73 CYS H 1 73 CYS HB2 2.601 . 3.447 2.605 2.292 2.722 . 0 0 "[ . 1 . 2]" 1
2099 1 11 LEU MD2 1 73 CYS H 3.055 . 4.221 2.943 2.863 3.138 . 0 0 "[ . 1 . 2]" 1
2100 1 72 GLU QG 1 73 CYS H 4.153 . 6.308 4.015 3.901 4.079 . 0 0 "[ . 1 . 2]" 1
2101 1 72 GLU H 1 72 GLU HA 2.563 . 3.384 2.841 2.817 2.856 . 0 0 "[ . 1 . 2]" 1
2102 1 71 GLN HA 1 72 GLU H 3.076 . 4.258 3.532 3.497 3.564 . 0 0 "[ . 1 . 2]" 1
2103 1 72 GLU H 1 72 GLU QG 2.492 . 3.268 2.256 2.124 2.407 . 0 0 "[ . 1 . 2]" 1
2104 1 71 GLN HB2 1 72 GLU H 3.596 . 5.212 3.943 3.905 4.002 . 0 0 "[ . 1 . 2]" 1
2105 1 72 GLU H 1 73 CYS H 2.438 . 3.181 2.598 2.522 2.659 . 0 0 "[ . 1 . 2]" 1
2106 1 71 GLN H 1 72 GLU H 2.777 . 3.741 2.864 2.791 2.974 . 0 0 "[ . 1 . 2]" 1
2107 1 102 GLU HB3 1 103 LYS H 3.232 . 4.537 2.720 2.572 2.908 . 0 0 "[ . 1 . 2]" 1
2108 1 103 LYS H 1 103 LYS QG 2.660 . 3.544 2.010 1.894 2.170 . 0 0 "[ . 1 . 2]" 1
2109 1 103 LYS H 1 103 LYS QB 2.302 . 2.964 2.533 2.428 2.730 . 0 0 "[ . 1 . 2]" 1
2110 1 103 LYS H 1 103 LYS HA 2.839 . 3.846 2.790 2.776 2.801 . 0 0 "[ . 1 . 2]" 1
2111 1 100 ALA HA 1 103 LYS H 3.053 . 4.218 3.556 3.467 3.634 . 0 0 "[ . 1 . 2]" 1
2112 1 38 VAL H 1 38 VAL HA 2.472 . 3.236 2.897 2.868 2.915 . 0 0 "[ . 1 . 2]" 1
2113 1 37 ALA HA 1 38 VAL H 3.347 . 4.747 3.430 3.381 3.536 . 0 0 "[ . 1 . 2]" 1
2114 1 38 VAL H 1 38 VAL QG 2.150 . 2.728 2.049 1.955 2.583 . 0 0 "[ . 1 . 2]" 1
2115 1 15 LEU H 1 15 LEU HB3 2.541 . 3.348 2.247 2.216 2.271 . 0 0 "[ . 1 . 2]" 1
2116 1 85 TYR H 1 85 TYR HB3 2.828 . 3.828 3.626 3.588 3.638 . 0 0 "[ . 1 . 2]" 1
2117 1 85 TYR H 1 85 TYR HB2 2.497 . 3.277 2.508 2.484 2.558 . 0 0 "[ . 1 . 2]" 1
2118 1 84 CYS HB2 1 85 TYR H 2.606 . 3.455 3.026 2.905 3.892 0.437 19 0 "[ . 1 . 2]" 1
2119 1 85 TYR H 1 86 ILE MD 3.216 . 4.509 4.358 4.332 4.396 . 0 0 "[ . 1 . 2]" 1
2120 1 85 TYR H 1 95 VAL MG1 4.060 . 6.120 5.037 4.734 5.176 . 0 0 "[ . 1 . 2]" 1
2121 1 82 THR MG 1 85 TYR H 3.631 . 5.279 3.838 3.777 3.904 . 0 0 "[ . 1 . 2]" 1
2122 1 85 TYR H 1 98 ALA MB 3.774 . 5.555 4.658 4.560 4.702 . 0 0 "[ . 1 . 2]" 1
2123 1 85 TYR H 1 86 ILE HG13 4.879 . 7.855 4.396 4.319 4.522 . 0 0 "[ . 1 . 2]" 1
2124 1 82 THR HA 1 85 TYR H 2.591 . 3.430 2.741 2.660 2.865 . 0 0 "[ . 1 . 2]" 1
2125 1 84 CYS HA 1 85 TYR H 3.073 . 4.253 3.488 3.472 3.535 . 0 0 "[ . 1 . 2]" 1
2126 1 85 TYR H 1 85 TYR HA 2.868 . 3.896 2.910 2.872 2.918 . 0 0 "[ . 1 . 2]" 1
2127 1 84 CYS H 1 85 TYR H 2.133 . 2.702 2.635 2.507 2.699 . 0 0 "[ . 1 . 2]" 1
2128 1 85 TYR H 1 86 ILE H 2.498 . 3.278 2.182 2.136 2.309 . 0 0 "[ . 1 . 2]" 1
2129 1 85 TYR H 1 86 ILE HB 4.306 . 6.624 3.925 3.886 4.072 . 0 0 "[ . 1 . 2]" 1
2130 1 106 LEU HB2 1 107 GLN H 2.559 . 3.377 3.032 2.968 3.070 . 0 0 "[ . 1 . 2]" 1
2131 1 107 GLN H 1 108 LYS HD3 3.573 . 5.169 5.088 5.001 5.176 0.007 16 0 "[ . 1 . 2]" 1
2132 1 107 GLN H 1 107 GLN HB3 2.409 . 3.134 2.826 2.750 3.079 . 0 0 "[ . 1 . 2]" 1
2133 1 107 GLN H 1 107 GLN HB2 2.144 . 2.719 2.215 2.044 2.293 . 0 0 "[ . 1 . 2]" 1
2134 1 106 LEU HA 1 107 GLN H 3.026 . 4.170 3.464 3.447 3.477 . 0 0 "[ . 1 . 2]" 1
2135 1 105 PHE HA 1 107 GLN H 2.980 . 4.090 4.108 4.088 4.137 0.047 8 0 "[ . 1 . 2]" 1
2136 1 107 GLN H 1 107 GLN HA 2.393 . 3.109 2.787 2.772 2.799 . 0 0 "[ . 1 . 2]" 1
2137 1 104 LEU HA 1 107 GLN H 2.718 . 3.642 3.293 3.261 3.320 . 0 0 "[ . 1 . 2]" 1
2138 1 107 GLN H 1 108 LYS H 2.196 . 2.799 2.715 2.684 2.757 . 0 0 "[ . 1 . 2]" 1
2139 1 107 GLN H 1 109 ILE H 3.160 . 4.408 4.057 4.022 4.097 . 0 0 "[ . 1 . 2]" 1
2140 1 106 LEU H 1 107 GLN H 2.528 . 3.327 2.579 2.547 2.591 . 0 0 "[ . 1 . 2]" 1
2141 1 102 GLU HB3 1 106 LEU H 3.288 . 4.639 4.630 4.533 4.692 0.053 2 0 "[ . 1 . 2]" 1
2142 1 106 LEU H 1 106 LEU HB2 2.717 . 3.640 2.354 2.333 2.373 . 0 0 "[ . 1 . 2]" 1
2143 1 106 LEU H 1 106 LEU HG 2.514 . 3.304 2.425 2.404 2.472 . 0 0 "[ . 1 . 2]" 1
2144 1 105 PHE HB2 1 106 LEU H 2.972 . 4.076 3.932 3.899 3.952 . 0 0 "[ . 1 . 2]" 1
2145 1 105 PHE HB3 1 106 LEU H 2.900 . 3.951 2.684 2.633 2.708 . 0 0 "[ . 1 . 2]" 1
2146 1 106 LEU H 1 106 LEU HA 2.737 . 3.673 2.823 2.817 2.831 . 0 0 "[ . 1 . 2]" 1
2147 1 105 PHE HD2 1 106 LEU H 2.847 . 3.860 2.693 2.630 2.744 . 0 0 "[ . 1 . 2]" 1
2148 1 106 LEU H 1 108 LYS H 3.453 . 4.944 4.286 4.238 4.354 . 0 0 "[ . 1 . 2]" 1
2149 1 47 LYS H 1 48 ILE MD 4.654 . 7.361 4.725 4.431 4.881 . 0 0 "[ . 1 . 2]" 1
2150 1 47 LYS H 1 47 LYS HG2 2.932 . 4.007 4.137 3.712 4.605 0.598 2 2 "[ + . - . 2]" 1
2151 1 47 LYS H 1 48 ILE HB 2.925 . 3.994 4.051 4.028 4.087 0.093 14 0 "[ . 1 . 2]" 1
2152 1 47 LYS H 1 47 LYS HB2 2.494 . 3.272 2.338 2.196 2.443 . 0 0 "[ . 1 . 2]" 1
2153 1 46 TYR HB2 1 47 LYS H 4.171 . 6.346 3.677 3.630 3.718 . 0 0 "[ . 1 . 2]" 1
2154 1 44 ASP QB 1 47 LYS H 4.187 . 6.379 4.024 3.902 4.183 . 0 0 "[ . 1 . 2]" 1
2155 1 46 TYR HA 1 47 LYS H 3.590 . 5.201 3.173 3.151 3.191 . 0 0 "[ . 1 . 2]" 1
2156 1 44 ASP HA 1 47 LYS H 3.402 . 4.848 3.388 3.187 3.507 . 0 0 "[ . 1 . 2]" 1
2157 1 47 LYS H 1 49 ILE H 2.730 . 3.662 3.475 3.404 3.572 . 0 0 "[ . 1 . 2]" 1
2158 1 84 CYS H 1 84 CYS HA 2.689 . 3.593 2.816 2.806 2.853 . 0 0 "[ . 1 . 2]" 1
2159 1 81 PHE HA 1 84 CYS H 3.203 . 4.485 3.615 3.556 3.679 . 0 0 "[ . 1 . 2]" 1
2160 1 32 GLN H 1 32 GLN HA 3.000 . 4.125 2.768 2.749 2.789 . 0 0 "[ . 1 . 2]" 1
2161 1 84 CYS H 1 84 CYS HB2 2.317 . 2.988 2.383 2.317 2.648 . 0 0 "[ . 1 . 2]" 1
2162 1 31 PHE HB2 1 32 GLN H 2.811 . 3.799 2.665 2.390 2.810 . 0 0 "[ . 1 . 2]" 1
2163 1 32 GLN H 1 32 GLN HG3 2.521 . 3.315 1.989 1.873 2.499 . 0 0 "[ . 1 . 2]" 1
2164 1 32 GLN H 1 32 GLN HB2 2.494 . 3.272 2.804 2.688 3.616 0.344 17 0 "[ . 1 . 2]" 1
2165 1 32 GLN H 1 32 GLN HG2 3.273 . 4.612 3.059 2.302 3.208 . 0 0 "[ . 1 . 2]" 1
2166 1 31 PHE HA 1 32 GLN H 3.206 . 4.490 3.559 3.540 3.592 . 0 0 "[ . 1 . 2]" 1
2167 1 31 PHE H 1 32 GLN H 2.530 . 3.330 2.083 2.035 2.128 . 0 0 "[ . 1 . 2]" 1
2168 1 49 ILE MD 1 86 ILE H 3.674 . 5.362 3.806 3.698 4.031 . 0 0 "[ . 1 . 2]" 1
2169 1 86 ILE H 1 86 ILE HG13 2.318 . 2.990 2.682 2.434 2.818 . 0 0 "[ . 1 . 2]" 1
2170 1 86 ILE H 1 86 ILE HB 2.170 . 2.759 2.141 2.115 2.232 . 0 0 "[ . 1 . 2]" 1
2171 1 85 TYR HB2 1 86 ILE H 3.126 . 4.348 2.717 2.484 2.909 . 0 0 "[ . 1 . 2]" 1
2172 1 85 TYR HB3 1 86 ILE H 3.099 . 4.299 3.805 3.598 3.944 . 0 0 "[ . 1 . 2]" 1
2173 1 82 THR HA 1 86 ILE H 3.252 . 4.574 3.718 3.483 3.853 . 0 0 "[ . 1 . 2]" 1
2174 1 86 ILE H 1 86 ILE HA 2.478 . 3.245 2.794 2.734 2.837 . 0 0 "[ . 1 . 2]" 1
2175 1 83 ASN HA 1 86 ILE H 3.545 . 5.116 3.076 2.961 3.158 . 0 0 "[ . 1 . 2]" 1
2176 1 85 TYR HA 1 86 ILE H 4.340 . 6.694 3.433 3.390 3.479 . 0 0 "[ . 1 . 2]" 1
2177 1 84 CYS H 1 86 ILE H 3.025 . 4.169 3.943 3.834 4.095 . 0 0 "[ . 1 . 2]" 1
2178 1 73 CYS HA 1 75 GLN H 4.186 . 6.376 4.629 4.535 4.772 . 0 0 "[ . 1 . 2]" 1
2179 1 28 ALA H 1 101 LEU MD1 3.274 . 4.614 3.511 3.437 3.658 . 0 0 "[ . 1 . 2]" 1
2180 1 28 ALA H 1 101 LEU MD2 3.054 . 4.220 3.053 3.011 3.128 . 0 0 "[ . 1 . 2]" 1
2181 1 25 HIS HB3 1 28 ALA H 3.468 . 4.971 2.164 2.088 2.227 . 0 0 "[ . 1 . 2]" 1
2182 1 27 PHE HB2 1 28 ALA H 3.031 . 4.179 3.494 3.432 3.552 . 0 0 "[ . 1 . 2]" 1
2183 1 28 ALA H 1 30 PRO HD2 4.105 . 6.212 4.499 4.453 4.546 . 0 0 "[ . 1 . 2]" 1
2184 1 27 PHE HB3 1 28 ALA H 3.443 . 4.925 4.264 4.225 4.309 . 0 0 "[ . 1 . 2]" 1
2185 1 25 HIS HB2 1 28 ALA H 2.990 . 4.107 3.625 3.549 3.704 . 0 0 "[ . 1 . 2]" 1
2186 1 26 GLN HA 1 28 ALA H 3.949 . 5.898 4.153 4.090 4.332 . 0 0 "[ . 1 . 2]" 1
2187 1 28 ALA H 1 28 ALA HA 2.788 . 3.760 2.860 2.851 2.875 . 0 0 "[ . 1 . 2]" 1
2188 1 27 PHE HA 1 28 ALA H 2.887 . 3.929 3.319 3.303 3.338 . 0 0 "[ . 1 . 2]" 1
2189 1 28 ALA H 1 29 TRP H 2.508 . 3.294 2.687 2.617 2.737 . 0 0 "[ . 1 . 2]" 1
2190 1 27 PHE H 1 28 ALA H 2.475 . 3.241 2.312 2.165 2.369 . 0 0 "[ . 1 . 2]" 1
2191 1 80 MET HB3 1 81 PHE H 3.226 . 4.527 2.268 2.186 2.498 . 0 0 "[ . 1 . 2]" 1
2192 1 81 PHE H 1 81 PHE HB2 2.259 . 2.897 2.569 2.543 2.614 . 0 0 "[ . 1 . 2]" 1
2193 1 80 MET HB2 1 81 PHE H 3.022 . 4.164 3.371 2.633 3.594 . 0 0 "[ . 1 . 2]" 1
2194 1 80 MET ME 1 81 PHE H 3.160 . 4.408 3.441 3.307 3.744 . 0 0 "[ . 1 . 2]" 1
2195 1 81 PHE H 1 81 PHE HA 2.660 . 3.544 2.836 2.822 2.845 . 0 0 "[ . 1 . 2]" 1
2196 1 81 PHE H 1 82 THR HB 3.718 . 5.446 5.015 4.968 5.073 . 0 0 "[ . 1 . 2]" 1
2197 1 81 PHE H 1 81 PHE HE1 4.714 . 7.492 4.668 4.448 4.763 . 0 0 "[ . 1 . 2]" 1
2198 1 81 PHE H 1 81 PHE HD1 2.698 . 3.608 3.256 3.035 3.371 . 0 0 "[ . 1 . 2]" 1
2199 1 80 MET H 1 81 PHE H 2.754 . 3.702 2.876 2.768 2.962 . 0 0 "[ . 1 . 2]" 1
2200 1 81 PHE H 1 82 THR H 2.708 . 3.625 2.601 2.568 2.648 . 0 0 "[ . 1 . 2]" 1
2201 1 59 LYS H 1 60 LYS H 3.090 . 4.284 2.475 2.341 2.584 . 0 0 "[ . 1 . 2]" 1
2202 1 60 LYS H 1 60 LYS HA 2.812 . 3.801 2.795 2.754 2.815 . 0 0 "[ . 1 . 2]" 1
2203 1 59 LYS HA 1 60 LYS H 3.089 . 4.282 3.450 3.379 3.500 . 0 0 "[ . 1 . 2]" 1
2204 1 59 LYS HB2 1 60 LYS H 2.978 . 4.086 4.009 3.917 4.082 . 0 0 "[ . 1 . 2]" 1
2205 1 60 LYS H 1 60 LYS QD 3.048 . 4.209 3.156 2.378 3.906 . 0 0 "[ . 1 . 2]" 1
2206 1 60 LYS H 1 60 LYS HG3 3.273 . 4.612 4.100 3.731 4.486 . 0 0 "[ . 1 . 2]" 1
2207 1 59 LYS QG 1 60 LYS H 3.321 . 4.514 2.469 2.136 2.739 . 0 0 "[ . 1 . 2]" 1
2208 1 59 LYS QD 1 60 LYS H 4.157 . 6.317 3.170 2.414 4.294 . 0 0 "[ . 1 . 2]" 1
2209 1 19 LEU MD1 1 23 TRP H 3.832 . 5.668 3.625 3.551 3.693 . 0 0 "[ . 1 . 2]" 1
2210 1 22 LEU MD1 1 23 TRP H 3.002 . 4.129 3.959 3.896 3.983 . 0 0 "[ . 1 . 2]" 1
2211 1 22 LEU HB3 1 23 TRP H 2.717 . 3.640 3.145 3.047 3.215 . 0 0 "[ . 1 . 2]" 1
2212 1 22 LEU HB2 1 23 TRP H 2.903 . 3.956 2.324 2.218 2.377 . 0 0 "[ . 1 . 2]" 1
2213 1 23 TRP H 1 23 TRP QB 2.624 . 3.485 2.169 2.137 2.192 . 0 0 "[ . 1 . 2]" 1
2214 1 23 TRP H 1 23 TRP HA 2.818 . 3.810 2.688 2.659 2.706 . 0 0 "[ . 1 . 2]" 1
2215 1 20 LYS HA 1 23 TRP H 3.136 . 4.366 3.449 3.324 3.676 . 0 0 "[ . 1 . 2]" 1
2216 1 22 LEU HA 1 23 TRP H 3.348 . 4.749 3.523 3.464 3.535 . 0 0 "[ . 1 . 2]" 1
2217 1 19 LEU HA 1 23 TRP H 3.584 . 5.189 3.736 3.705 3.772 . 0 0 "[ . 1 . 2]" 1
2218 1 23 TRP H 1 24 LYS H 2.716 . 3.638 2.913 2.861 3.014 . 0 0 "[ . 1 . 2]" 1
2219 1 23 TRP H 1 23 TRP HE3 3.416 . 4.875 4.033 3.947 4.201 . 0 0 "[ . 1 . 2]" 1
2220 1 22 LEU H 1 23 TRP H 2.583 . 3.417 2.625 2.582 2.664 . 0 0 "[ . 1 . 2]" 1
2221 1 95 VAL MG2 1 99 GLU H 3.309 . 4.678 3.537 3.480 3.588 . 0 0 "[ . 1 . 2]" 1
2222 1 96 LEU MD2 1 99 GLU H 3.355 . 4.762 4.539 4.490 4.592 . 0 0 "[ . 1 . 2]" 1
2223 1 98 ALA MB 1 99 GLU H 2.579 . 3.410 2.526 2.463 2.613 . 0 0 "[ . 1 . 2]" 1
2224 1 99 GLU H 1 99 GLU HB3 2.779 . 3.745 3.531 3.514 3.555 . 0 0 "[ . 1 . 2]" 1
2225 1 99 GLU H 1 99 GLU HG2 2.205 . 2.813 2.931 2.884 2.984 0.171 18 0 "[ . 1 . 2]" 1
2226 1 99 GLU H 1 99 GLU HG3 2.542 . 3.350 2.707 2.437 2.889 . 0 0 "[ . 1 . 2]" 1
2227 1 98 ALA HA 1 99 GLU H 3.595 . 5.211 3.516 3.505 3.529 . 0 0 "[ . 1 . 2]" 1
2228 1 95 VAL HA 1 99 GLU H 3.729 . 5.467 3.664 3.484 3.736 . 0 0 "[ . 1 . 2]" 1
2229 1 99 GLU H 1 99 GLU HA 2.405 . 3.128 2.777 2.754 2.795 . 0 0 "[ . 1 . 2]" 1
2230 1 85 TYR HE1 1 99 GLU H 3.262 . 4.592 3.155 3.047 3.239 . 0 0 "[ . 1 . 2]" 1
2231 1 66 TYR H 1 66 TYR HA 2.945 . 4.029 2.880 2.827 2.913 . 0 0 "[ . 1 . 2]" 1
2232 1 61 ARG HA 1 66 TYR H 3.433 . 4.906 3.152 2.881 3.463 . 0 0 "[ . 1 . 2]" 1
2233 1 66 TYR H 1 66 TYR HB2 2.713 . 3.633 2.720 2.589 2.830 . 0 0 "[ . 1 . 2]" 1
2234 1 61 ARG HB3 1 66 TYR H 4.231 . 6.469 3.811 3.508 4.211 . 0 0 "[ . 1 . 2]" 1
2235 1 65 ASN HA 1 66 TYR H 2.979 . 4.088 2.819 2.720 2.948 . 0 0 "[ . 1 . 2]" 1
2236 1 66 TYR H 1 67 TYR H 2.561 . 3.381 2.411 2.275 2.640 . 0 0 "[ . 1 . 2]" 1
2237 1 78 ASN H 1 80 MET H 3.247 . 4.565 4.041 3.931 4.124 . 0 0 "[ . 1 . 2]" 1
2238 1 76 ASP H 1 78 ASN H 3.150 . 4.391 3.757 3.681 3.822 . 0 0 "[ . 1 . 2]" 1
2239 1 78 ASN H 1 105 PHE HZ 4.073 . 6.146 4.368 4.270 4.427 . 0 0 "[ . 1 . 2]" 1
2240 1 78 ASN H 1 105 PHE HE2 3.354 . 4.760 4.323 4.204 4.439 . 0 0 "[ . 1 . 2]" 1
2241 1 76 ASP HA 1 78 ASN H 3.281 . 4.626 4.335 4.265 4.441 . 0 0 "[ . 1 . 2]" 1
2242 1 94 ILE H 1 95 VAL H 2.581 . 3.414 2.826 2.772 2.909 . 0 0 "[ . 1 . 2]" 1
2243 1 94 ILE H 1 96 LEU H 3.591 . 5.203 4.115 4.053 4.190 . 0 0 "[ . 1 . 2]" 1
2244 1 92 ASP HA 1 94 ILE H 3.332 . 4.720 4.495 4.430 4.623 . 0 0 "[ . 1 . 2]" 1
2245 1 93 ASP HA 1 94 ILE H 3.224 . 4.523 3.579 3.570 3.597 . 0 0 "[ . 1 . 2]" 1
2246 1 94 ILE H 1 94 ILE HA 2.694 . 3.601 2.825 2.798 2.845 . 0 0 "[ . 1 . 2]" 1
2247 1 92 ASP HB3 1 94 ILE H 2.733 . 3.667 3.574 3.501 3.672 0.005 19 0 "[ . 1 . 2]" 1
2248 1 93 ASP HB2 1 94 ILE H 2.272 . 2.917 2.982 2.402 3.881 0.964 8 7 "[* ** *+ 1 *. - 2]" 1
2249 1 94 ILE H 1 94 ILE HB 2.149 . 2.726 2.699 2.632 2.736 0.010 6 0 "[ . 1 . 2]" 1
2250 1 94 ILE H 1 94 ILE MG 2.094 . 2.642 2.040 1.980 2.095 . 0 0 "[ . 1 . 2]" 1
2251 1 40 LEU HB2 1 41 ASN H 2.822 . 3.817 3.618 3.494 3.768 . 0 0 "[ . 1 . 2]" 1
2252 1 41 ASN H 1 42 LEU HG 3.294 . 4.650 3.221 3.150 3.337 . 0 0 "[ . 1 . 2]" 1
2253 1 41 ASN H 1 42 LEU MD2 3.259 . 4.586 4.101 4.039 4.152 . 0 0 "[ . 1 . 2]" 1
2254 1 41 ASN H 1 41 ASN HB3 2.552 . 3.366 3.547 3.490 3.881 0.515 9 1 "[ . +1 . 2]" 1
2255 1 41 ASN H 1 41 ASN HB2 2.576 . 3.406 3.124 3.058 3.487 0.081 9 0 "[ . 1 . 2]" 1
2256 1 37 ALA HA 1 41 ASN H 3.559 . 5.142 4.695 4.509 4.945 . 0 0 "[ . 1 . 2]" 1
2257 1 38 VAL HA 1 41 ASN H 2.901 . 3.953 3.729 3.675 3.801 . 0 0 "[ . 1 . 2]" 1
2258 1 39 LYS HA 1 41 ASN H 3.182 . 4.447 3.614 3.457 3.715 . 0 0 "[ . 1 . 2]" 1
2259 1 41 ASN H 1 41 ASN HA 2.214 . 2.827 2.241 2.206 2.254 . 0 0 "[ . 1 . 2]" 1
2260 1 40 LEU H 1 41 ASN H 2.117 . 2.677 2.624 2.552 2.693 0.016 8 0 "[ . 1 . 2]" 1
2261 1 41 ASN H 1 42 LEU H 2.315 . 2.985 2.979 2.897 3.030 0.045 1 0 "[ . 1 . 2]" 1
2262 1 29 TRP H 1 29 TRP HB3 2.371 . 3.074 2.560 2.533 2.575 . 0 0 "[ . 1 . 2]" 1
2263 1 29 TRP H 1 30 PRO HD2 2.937 . 4.016 2.865 2.841 2.894 . 0 0 "[ . 1 . 2]" 1
2264 1 29 TRP H 1 30 PRO HD3 2.410 . 3.136 2.623 2.591 2.671 . 0 0 "[ . 1 . 2]" 1
2265 1 29 TRP H 1 30 PRO HG2 3.397 . 4.840 4.948 4.933 4.971 0.131 15 0 "[ . 1 . 2]" 1
2266 1 29 TRP H 1 29 TRP HA 2.378 . 3.085 2.773 2.761 2.782 . 0 0 "[ . 1 . 2]" 1
2267 1 27 PHE HA 1 29 TRP H 3.339 . 4.733 3.425 3.360 3.531 . 0 0 "[ . 1 . 2]" 1
2268 1 29 TRP H 1 29 TRP HE1 3.322 . 4.702 4.619 4.531 4.676 . 0 0 "[ . 1 . 2]" 1
2269 1 111 GLU H 1 112 LEU HA 4.192 . 6.389 4.349 4.313 4.378 . 0 0 "[ . 1 . 2]" 1
2270 1 74 ILE MG 1 78 ASN H 2.750 . 3.695 3.530 3.403 3.572 . 0 0 "[ . 1 . 2]" 1
2271 1 75 GLN HB3 1 78 ASN H 3.639 . 5.295 5.419 5.351 5.467 0.172 4 0 "[ . 1 . 2]" 1
2272 1 65 ASN H 1 65 ASN HB3 3.129 . 4.353 3.003 2.917 3.067 . 0 0 "[ . 1 . 2]" 1
2273 1 65 ASN H 1 65 ASN HB2 2.976 . 4.083 3.982 3.944 4.016 . 0 0 "[ . 1 . 2]" 1
2274 1 63 GLU HA 1 65 ASN H 4.367 . 6.751 3.420 3.298 3.589 . 0 0 "[ . 1 . 2]" 1
2275 1 65 ASN H 1 65 ASN HA 2.857 . 3.878 2.258 2.243 2.268 . 0 0 "[ . 1 . 2]" 1
2276 1 64 ASN HA 1 65 ASN H 3.308 . 4.676 3.078 2.990 3.176 . 0 0 "[ . 1 . 2]" 1
2277 1 65 ASN H 1 66 TYR H 3.419 . 4.880 2.943 2.855 3.018 . 0 0 "[ . 1 . 2]" 1
2278 1 64 ASN H 1 65 ASN H 3.530 . 5.087 2.514 2.304 2.643 . 0 0 "[ . 1 . 2]" 1
2279 1 107 GLN HB2 1 108 LYS H 2.832 . 3.835 3.322 3.076 3.430 . 0 0 "[ . 1 . 2]" 1
2280 1 107 GLN HB3 1 108 LYS H 3.535 . 5.097 2.186 2.070 2.352 . 0 0 "[ . 1 . 2]" 1
2281 1 108 LYS H 1 108 LYS HD2 3.189 . 4.461 4.022 3.981 4.063 . 0 0 "[ . 1 . 2]" 1
2282 1 108 LYS H 1 108 LYS HD3 3.050 . 4.213 2.774 2.713 2.837 . 0 0 "[ . 1 . 2]" 1
2283 1 108 LYS H 1 108 LYS HG3 2.502 . 3.284 3.428 3.413 3.436 0.152 1 0 "[ . 1 . 2]" 1
2284 1 108 LYS H 1 108 LYS HG2 3.064 . 4.238 1.878 1.858 1.888 0.032 2 0 "[ . 1 . 2]" 1
2285 1 104 LEU MD2 1 108 LYS H 3.236 . 4.545 3.738 3.654 3.791 . 0 0 "[ . 1 . 2]" 1
2286 1 18 VAL MG2 1 108 LYS H 3.000 . 4.125 3.902 3.877 3.924 . 0 0 "[ . 1 . 2]" 1
2287 1 108 LYS H 1 108 LYS HE3 4.187 . 6.378 4.529 4.493 4.602 . 0 0 "[ . 1 . 2]" 1
2288 1 105 PHE HA 1 108 LYS H 4.804 . 7.689 3.525 3.499 3.559 . 0 0 "[ . 1 . 2]" 1
2289 1 108 LYS H 1 108 LYS HA 2.873 . 3.905 2.781 2.772 2.787 . 0 0 "[ . 1 . 2]" 1
2290 1 107 GLN HA 1 108 LYS H 2.716 . 3.638 3.506 3.498 3.513 . 0 0 "[ . 1 . 2]" 1
2291 1 108 LYS H 1 111 GLU H 3.426 . 4.893 4.857 4.830 4.898 0.005 2 0 "[ . 1 . 2]" 1
2292 1 63 GLU HB3 1 64 ASN H 3.201 . 4.482 3.749 3.380 3.968 . 0 0 "[ . 1 . 2]" 1
2293 1 64 ASN H 1 64 ASN HB2 2.906 . 3.962 2.686 2.407 2.854 . 0 0 "[ . 1 . 2]" 1
2294 1 64 ASN H 1 64 ASN HB3 3.073 . 4.254 2.719 2.372 3.691 . 0 0 "[ . 1 . 2]" 1
2295 1 63 GLU HA 1 64 ASN H 3.360 . 4.772 3.418 3.321 3.510 . 0 0 "[ . 1 . 2]" 1
2296 1 40 LEU H 1 40 LEU HA 2.387 . 3.099 2.863 2.847 2.881 . 0 0 "[ . 1 . 2]" 1
2297 1 39 LYS HA 1 40 LEU H 2.892 . 3.937 3.567 3.546 3.588 . 0 0 "[ . 1 . 2]" 1
2298 1 37 ALA HA 1 40 LEU H 3.175 . 4.435 3.720 3.617 3.850 . 0 0 "[ . 1 . 2]" 1
2299 1 40 LEU H 1 40 LEU HG 1.982 . 2.473 2.599 2.543 2.634 0.161 8 0 "[ . 1 . 2]" 1
2300 1 40 LEU H 1 40 LEU HB2 2.074 . 2.612 2.571 2.544 2.598 . 0 0 "[ . 1 . 2]" 1
2301 1 40 LEU H 1 40 LEU MD1 2.703 . 3.617 2.112 1.960 2.259 . 0 0 "[ . 1 . 2]" 1
2302 1 67 TYR H 1 67 TYR HA 2.896 . 3.944 2.813 2.783 2.836 . 0 0 "[ . 1 . 2]" 1
2303 1 66 TYR HA 1 67 TYR H 3.281 . 4.627 3.528 3.504 3.548 . 0 0 "[ . 1 . 2]" 1
2304 1 61 ARG HA 1 67 TYR H 4.319 . 6.651 3.985 3.748 4.164 . 0 0 "[ . 1 . 2]" 1
2305 1 67 TYR H 1 67 TYR HD2 2.976 . 4.083 3.468 3.338 3.639 . 0 0 "[ . 1 . 2]" 1
2306 1 67 TYR H 1 68 TRP H 3.274 . 4.614 4.537 4.502 4.571 . 0 0 "[ . 1 . 2]" 1
2307 1 67 TYR H 1 67 TYR HB3 2.664 . 3.551 3.576 3.566 3.583 0.032 18 0 "[ . 1 . 2]" 1
2308 1 67 TYR H 1 67 TYR HB2 2.266 . 2.908 2.447 2.393 2.531 . 0 0 "[ . 1 . 2]" 1
2309 1 61 ARG HB2 1 67 TYR H 2.732 . 3.665 3.811 3.667 4.333 0.668 1 3 "[+- . 1* . 2]" 1
2310 1 61 ARG HG3 1 67 TYR H 3.938 . 5.876 5.840 5.421 5.973 0.097 17 0 "[ . 1 . 2]" 1
2311 1 62 LEU MD2 1 67 TYR H 5.627 . 9.585 4.755 4.703 4.846 . 0 0 "[ . 1 . 2]" 1
2312 1 114 THR H 1 114 THR MG 2.528 . 3.327 3.097 2.614 3.228 . 0 0 "[ . 1 . 2]" 1
2313 1 113 PRO HB2 1 114 THR H 2.598 . 3.442 3.208 2.893 3.484 0.042 18 0 "[ . 1 . 2]" 1
2314 1 113 PRO HB3 1 114 THR H 2.749 . 3.693 2.787 2.515 3.044 . 0 0 "[ . 1 . 2]" 1
2315 1 114 THR H 1 114 THR HA 2.524 . 3.320 2.936 2.920 2.950 . 0 0 "[ . 1 . 2]" 1
2316 1 113 PRO HA 1 114 THR H 2.421 . 3.154 2.336 2.214 2.501 . 0 0 "[ . 1 . 2]" 1
2317 1 114 THR H 1 115 GLU H 3.253 . 4.575 4.410 4.211 4.560 . 0 0 "[ . 1 . 2]" 1
2318 1 49 ILE MD 1 88 ASN H 4.145 . 6.293 3.903 3.836 3.954 . 0 0 "[ . 1 . 2]" 1
2319 1 87 TYR HB3 1 88 ASN H 2.873 . 3.905 2.267 2.028 2.616 . 0 0 "[ . 1 . 2]" 1
2320 1 87 TYR HB2 1 88 ASN H 3.374 . 4.797 3.411 3.320 3.563 . 0 0 "[ . 1 . 2]" 1
2321 1 88 ASN H 1 88 ASN HB2 2.868 . 3.896 2.492 2.353 2.723 . 0 0 "[ . 1 . 2]" 1
2322 1 88 ASN H 1 88 ASN HA 2.967 . 4.067 2.908 2.890 2.932 . 0 0 "[ . 1 . 2]" 1
2323 1 84 CYS HA 1 88 ASN H 3.090 . 4.283 3.452 3.326 3.542 . 0 0 "[ . 1 . 2]" 1
2324 1 87 TYR HA 1 88 ASN H 3.072 . 4.252 3.557 3.540 3.570 . 0 0 "[ . 1 . 2]" 1
2325 1 87 TYR HD2 1 88 ASN H 3.168 . 4.422 3.907 3.587 4.319 . 0 0 "[ . 1 . 2]" 1
2326 1 86 ILE H 1 88 ASN H 3.129 . 4.353 4.124 3.815 4.366 0.013 16 0 "[ . 1 . 2]" 1
2327 1 69 ASN QB 1 69 ASN HD21 3.157 . 4.403 2.166 2.113 2.244 . 0 0 "[ . 1 . 2]" 1
2328 1 69 ASN HD21 1 72 GLU QG 3.331 . 4.718 3.909 2.912 4.614 . 0 0 "[ . 1 . 2]" 1
2329 1 69 ASN HD22 1 72 GLU QG 4.029 . 6.058 5.149 2.470 5.845 . 0 0 "[ . 1 . 2]" 1
2330 1 9 ASN QD 1 113 PRO HB3 4.174 . 6.350 3.327 2.138 5.410 . 0 0 "[ . 1 . 2]" 1
2331 1 9 ASN QD 1 113 PRO HB2 4.087 . 6.175 3.106 2.480 4.543 . 0 0 "[ . 1 . 2]" 1
2332 1 9 ASN HB2 1 9 ASN QD 3.719 . 5.448 2.610 2.177 3.306 . 0 0 "[ . 1 . 2]" 1
2333 1 9 ASN HB3 1 9 ASN QD 3.208 . 4.495 2.512 2.184 2.833 . 0 0 "[ . 1 . 2]" 1
2334 1 82 THR H 1 82 THR HB 2.386 . 3.098 2.603 2.555 2.630 . 0 0 "[ . 1 . 2]" 1
2335 1 82 THR H 1 82 THR HA 2.458 . 3.213 2.863 2.848 2.872 . 0 0 "[ . 1 . 2]" 1
2336 1 81 PHE HB2 1 82 THR H 2.398 . 3.117 2.805 2.730 2.848 . 0 0 "[ . 1 . 2]" 1
2337 1 82 THR H 1 84 CYS H 2.855 . 3.874 3.939 3.887 3.973 0.099 19 0 "[ . 1 . 2]" 1
2338 1 80 MET H 1 82 THR H 3.767 . 5.541 3.922 3.802 4.029 . 0 0 "[ . 1 . 2]" 1
2339 1 33 GLN H 1 54 ASP HB2 3.710 . 5.431 4.057 3.630 5.213 . 0 0 "[ . 1 . 2]" 1
2340 1 33 GLN H 1 33 GLN HG2 2.754 . 3.702 3.701 2.876 4.608 0.906 15 4 "[ - 1* *+ 2]" 1
2341 1 33 GLN H 1 33 GLN HB2 2.779 . 3.745 3.399 2.416 3.744 . 0 0 "[ . 1 . 2]" 1
2342 1 33 GLN H 1 33 GLN HB3 2.613 . 3.466 2.713 2.372 3.696 0.230 15 0 "[ . 1 . 2]" 1
2343 1 33 GLN H 1 34 PRO QD 3.727 . 5.283 4.311 4.206 4.345 . 0 0 "[ . 1 . 2]" 1
2344 1 32 GLN HA 1 33 GLN H 3.148 . 4.387 3.500 3.438 3.539 . 0 0 "[ . 1 . 2]" 1
2345 1 33 GLN H 1 34 PRO HA 3.731 . 5.471 5.058 4.928 5.221 . 0 0 "[ . 1 . 2]" 1
2346 1 33 GLN H 1 33 GLN HA 2.560 . 3.379 2.932 2.923 2.940 . 0 0 "[ . 1 . 2]" 1
2347 1 32 GLN H 1 33 GLN H 2.659 . 3.543 2.767 2.647 2.906 . 0 0 "[ . 1 . 2]" 1
2348 1 33 GLN H 1 33 GLN QE 3.035 . 4.186 3.017 2.521 3.881 . 0 0 "[ . 1 . 2]" 1
2349 1 33 GLN H 1 56 GLY H 4.553 . 7.144 4.764 4.429 5.122 . 0 0 "[ . 1 . 2]" 1
2350 1 31 PHE H 1 33 GLN H 4.707 . 7.476 3.603 3.053 3.961 . 0 0 "[ . 1 . 2]" 1
2351 1 31 PHE H 1 31 PHE HD1 2.567 . 3.391 2.674 2.523 2.895 . 0 0 "[ . 1 . 2]" 1
2352 1 31 PHE H 1 31 PHE HE1 3.770 . 5.547 4.711 4.567 4.889 . 0 0 "[ . 1 . 2]" 1
2353 1 28 ALA HA 1 31 PHE H 3.440 . 4.920 3.660 3.575 3.737 . 0 0 "[ . 1 . 2]" 1
2354 1 30 PRO HA 1 31 PHE H 3.159 . 4.407 3.278 3.217 3.322 . 0 0 "[ . 1 . 2]" 1
2355 1 31 PHE H 1 31 PHE HB3 3.690 . 5.392 3.708 3.669 3.766 . 0 0 "[ . 1 . 2]" 1
2356 1 30 PRO HD2 1 31 PHE H 3.261 . 4.591 2.301 2.171 2.526 . 0 0 "[ . 1 . 2]" 1
2357 1 31 PHE H 1 31 PHE HB2 2.568 . 3.392 2.598 2.556 2.673 . 0 0 "[ . 1 . 2]" 1
2358 1 31 PHE H 1 32 GLN HG3 3.082 . 4.270 3.460 3.353 3.598 . 0 0 "[ . 1 . 2]" 1
2359 1 31 PHE H 1 32 GLN HB2 3.310 . 4.679 4.410 4.156 5.476 0.797 17 1 "[ . 1 . + 2]" 1
2360 1 30 PRO HD3 1 31 PHE H 3.437 . 4.913 3.564 3.487 3.708 . 0 0 "[ . 1 . 2]" 1
2361 1 28 ALA MB 1 31 PHE H 3.712 . 5.434 4.136 4.082 4.186 . 0 0 "[ . 1 . 2]" 1
2362 1 31 PHE H 1 101 LEU MD1 3.728 . 5.465 4.578 4.503 4.690 . 0 0 "[ . 1 . 2]" 1
2363 1 30 PRO HB3 1 31 PHE H 3.815 . 5.634 4.387 4.333 4.490 . 0 0 "[ . 1 . 2]" 1
2364 1 51 THR H 1 51 THR MG 3.035 . 4.186 2.481 2.421 2.526 . 0 0 "[ . 1 . 2]" 1
2365 1 49 ILE MG 1 51 THR H 2.741 . 3.680 2.174 2.149 2.200 . 0 0 "[ . 1 . 2]" 1
2366 1 49 ILE MD 1 51 THR H 3.488 . 5.009 4.525 4.392 4.573 . 0 0 "[ . 1 . 2]" 1
2367 1 50 LYS HB2 1 51 THR H 2.721 . 3.646 2.241 2.151 2.366 . 0 0 "[ . 1 . 2]" 1
2368 1 50 LYS HB3 1 51 THR H 2.990 . 4.108 3.246 3.179 3.309 . 0 0 "[ . 1 . 2]" 1
2369 1 50 LYS QG 1 51 THR H 4.175 . 6.354 3.868 3.792 3.964 . 0 0 "[ . 1 . 2]" 1
2370 1 51 THR H 1 52 PRO HD3 3.557 . 5.138 3.149 2.977 3.333 . 0 0 "[ . 1 . 2]" 1
2371 1 51 THR H 1 52 PRO HD2 4.280 . 6.570 4.393 4.241 4.577 . 0 0 "[ . 1 . 2]" 1
2372 1 49 ILE HA 1 51 THR H 2.890 . 3.934 4.001 3.915 4.057 0.123 1 0 "[ . 1 . 2]" 1
2373 1 11 LEU MD1 1 69 ASN H 3.547 . 5.119 2.796 2.538 3.140 . 0 0 "[ . 1 . 2]" 1
2374 1 69 ASN H 1 72 GLU HB3 3.206 . 4.491 4.497 4.063 4.920 0.429 20 0 "[ . 1 . 2]" 1
2375 1 69 ASN H 1 72 GLU QG 4.639 . 7.329 3.352 2.951 3.596 . 0 0 "[ . 1 . 2]" 1
2376 1 67 TYR HB3 1 69 ASN H 2.774 . 3.736 2.985 2.672 3.311 . 0 0 "[ . 1 . 2]" 1
2377 1 69 ASN H 1 69 ASN QB 2.905 . 3.960 2.810 2.676 3.235 . 0 0 "[ . 1 . 2]" 1
2378 1 41 ASN HB2 1 41 ASN HD22 2.710 . 3.628 3.728 3.476 4.064 0.436 9 0 "[ . 1 . 2]" 1
2379 1 41 ASN HB3 1 41 ASN HD22 3.026 . 4.171 3.733 3.471 4.080 . 0 0 "[ . 1 . 2]" 1
2380 1 41 ASN HB2 1 41 ASN HD21 2.880 . 3.917 2.793 2.231 3.498 . 0 0 "[ . 1 . 2]" 1
2381 1 41 ASN HB3 1 41 ASN HD21 3.476 . 4.987 2.764 2.184 3.507 . 0 0 "[ . 1 . 2]" 1
2382 1 33 GLN QE 1 33 GLN HG2 2.518 . 3.311 2.667 2.173 3.293 . 0 0 "[ . 1 . 2]" 1
2383 1 107 GLN HE21 1 107 GLN QG 3.615 . 4.508 2.260 2.148 2.774 . 0 0 "[ . 1 . 2]" 1
2384 1 107 GLN HB3 1 107 GLN HE21 3.428 . 4.897 3.942 2.930 4.507 . 0 0 "[ . 1 . 2]" 1
2385 1 26 GLN HE21 1 26 GLN HG3 3.333 . 4.722 3.053 2.250 3.523 . 0 0 "[ . 1 . 2]" 1
2386 1 26 GLN HE22 1 26 GLN HG2 3.575 . 5.172 3.762 3.478 4.080 . 0 0 "[ . 1 . 2]" 1
2387 1 75 GLN HA 1 78 ASN HD21 3.253 . 4.576 3.624 2.505 4.360 . 0 0 "[ . 1 . 2]" 1
2388 1 78 ASN QB 1 78 ASN HD21 2.397 . 3.115 2.144 2.097 2.197 . 0 0 "[ . 1 . 2]" 1
2389 1 74 ILE MG 1 78 ASN HD21 2.769 . 3.728 3.495 2.179 3.615 . 0 0 "[ . 1 . 2]" 1
2390 1 78 ASN QB 1 78 ASN HD22 3.034 . 4.184 3.214 3.200 3.258 . 0 0 "[ . 1 . 2]" 1
2391 1 75 GLN HA 1 78 ASN HD22 3.711 . 5.433 4.963 4.126 5.244 . 0 0 "[ . 1 . 2]" 1
2392 1 91 GLY H 1 96 LEU MD2 3.337 . 4.729 2.746 2.632 2.851 . 0 0 "[ . 1 . 2]" 1
2393 1 91 GLY H 1 95 VAL MG2 2.687 . 3.590 1.796 1.707 1.878 0.077 19 0 "[ . 1 . 2]" 1
2394 1 91 GLY H 1 96 LEU HG 4.103 . 6.208 3.776 3.722 3.840 . 0 0 "[ . 1 . 2]" 1
2395 1 90 PRO HB2 1 91 GLY H 3.144 . 4.380 4.218 4.179 4.234 . 0 0 "[ . 1 . 2]" 1
2396 1 90 PRO HG2 1 91 GLY H 4.068 . 6.137 5.715 5.683 5.734 . 0 0 "[ . 1 . 2]" 1
2397 1 90 PRO HB3 1 91 GLY H 2.890 . 3.934 3.806 3.729 3.843 . 0 0 "[ . 1 . 2]" 1
2398 1 91 GLY H 1 91 GLY HA2 2.255 . 2.891 2.480 2.473 2.488 . 0 0 "[ . 1 . 2]" 1
2399 1 90 PRO HA 1 91 GLY H 2.028 . 2.542 2.149 2.133 2.160 . 0 0 "[ . 1 . 2]" 1
2400 1 23 TRP HA 1 24 LYS H 3.233 . 4.540 3.470 3.447 3.509 . 0 0 "[ . 1 . 2]" 1
2401 1 23 TRP QB 1 24 LYS H 3.308 . 4.676 2.646 2.559 2.785 . 0 0 "[ . 1 . 2]" 1
2402 1 24 LYS H 1 24 LYS HB3 3.209 . 4.496 3.575 2.907 3.650 . 0 0 "[ . 1 . 2]" 1
2403 1 24 LYS H 1 24 LYS HB2 2.893 . 3.939 2.437 2.307 3.651 . 0 0 "[ . 1 . 2]" 1
2404 1 24 LYS H 1 24 LYS HG2 2.993 . 4.113 3.728 2.620 3.946 . 0 0 "[ . 1 . 2]" 1
2405 1 24 LYS H 1 24 LYS HG3 2.827 . 3.826 2.640 2.022 2.904 . 0 0 "[ . 1 . 2]" 1
2406 1 21 THR HA 1 24 LYS H 3.194 . 4.470 3.854 3.664 4.017 . 0 0 "[ . 1 . 2]" 1
2407 1 24 LYS H 1 24 LYS HA 2.910 . 3.969 2.929 2.916 2.942 . 0 0 "[ . 1 . 2]" 1
2408 1 41 ASN HA 1 42 LEU H 2.236 . 2.861 2.332 2.241 2.395 . 0 0 "[ . 1 . 2]" 1
2409 1 37 ALA HA 1 42 LEU H 2.962 . 4.059 3.699 3.529 3.791 . 0 0 "[ . 1 . 2]" 1
2410 1 41 ASN HB3 1 42 LEU H 3.377 . 4.803 4.428 4.237 4.471 . 0 0 "[ . 1 . 2]" 1
2411 1 42 LEU H 1 42 LEU HB3 2.883 . 3.922 3.763 3.729 3.789 . 0 0 "[ . 1 . 2]" 1
2412 1 42 LEU H 1 42 LEU HG 2.596 . 3.438 2.435 2.323 2.521 . 0 0 "[ . 1 . 2]" 1
2413 1 42 LEU H 1 42 LEU MD2 3.245 . 4.561 3.413 3.336 3.478 . 0 0 "[ . 1 . 2]" 1
2414 1 42 LEU H 1 42 LEU MD1 3.682 . 5.376 3.763 3.679 3.817 . 0 0 "[ . 1 . 2]" 1
2415 1 42 LEU H 1 42 LEU HB2 2.478 . 3.246 2.780 2.747 2.816 . 0 0 "[ . 1 . 2]" 1
2416 1 52 PRO HA 1 53 MET H 2.736 . 3.672 2.168 2.127 2.198 . 0 0 "[ . 1 . 2]" 1
2417 1 53 MET H 1 53 MET HB3 3.133 . 4.360 2.614 2.550 2.685 . 0 0 "[ . 1 . 2]" 1
2418 1 53 MET H 1 53 MET HB2 3.157 . 4.402 3.367 3.307 3.446 . 0 0 "[ . 1 . 2]" 1
2419 1 49 ILE MG 1 53 MET H 3.803 . 5.611 3.782 3.703 3.892 . 0 0 "[ . 1 . 2]" 1
2420 1 40 LEU H 1 42 LEU H 3.472 . 4.979 4.413 4.226 4.574 . 0 0 "[ . 1 . 2]" 1
2421 1 42 LEU H 1 43 PRO HD2 4.075 . 6.151 4.822 4.236 4.932 . 0 0 "[ . 1 . 2]" 1
2422 1 41 ASN HB2 1 42 LEU H 3.723 . 5.455 4.549 4.404 4.581 . 0 0 "[ . 1 . 2]" 1
2423 1 10 GLN HE21 1 115 GLU H 3.247 . 4.565 3.295 2.407 4.371 . 0 0 "[ . 1 . 2]" 1
2424 1 6 ARG H 1 6 ARG HB2 3.428 . 4.897 2.521 2.211 3.254 . 0 0 "[ . 1 . 2]" 1
2425 1 11 LEU H 1 11 LEU HB2 3.469 . 4.973 2.214 2.160 2.305 . 0 0 "[ . 1 . 2]" 1
2426 1 11 LEU H 1 11 LEU HB3 3.087 . 4.278 3.479 3.455 3.522 . 0 0 "[ . 1 . 2]" 1
2427 1 10 GLN HB3 1 11 LEU H 4.671 . 7.398 3.322 3.217 3.425 . 0 0 "[ . 1 . 2]" 1
2428 1 46 TYR H 1 46 TYR HB3 2.816 . 3.807 3.570 3.563 3.586 . 0 0 "[ . 1 . 2]" 1
2429 1 46 TYR H 1 46 TYR HB2 2.799 . 3.779 2.296 2.281 2.329 . 0 0 "[ . 1 . 2]" 1
2430 1 45 TYR HB2 1 46 TYR H 3.743 . 5.494 3.410 3.337 3.490 . 0 0 "[ . 1 . 2]" 1
2431 1 45 TYR HB3 1 46 TYR H 3.361 . 4.773 2.291 2.176 2.416 . 0 0 "[ . 1 . 2]" 1
2432 1 37 ALA MB 1 46 TYR H 4.173 . 6.349 3.265 3.100 3.437 . 0 0 "[ . 1 . 2]" 1
2433 1 46 TYR H 1 47 LYS HB2 4.899 . 7.899 4.465 4.135 4.748 . 0 0 "[ . 1 . 2]" 1
2434 1 46 TYR H 1 46 TYR HD1 2.574 . 3.402 2.826 2.717 2.908 . 0 0 "[ . 1 . 2]" 1
2435 1 45 TYR H 1 46 TYR H 3.454 . 4.946 2.766 2.705 2.832 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 132
_Distance_constraint_stats_list.Viol_count 376
_Distance_constraint_stats_list.Viol_total 442.112
_Distance_constraint_stats_list.Viol_max 0.524
_Distance_constraint_stats_list.Viol_rms 0.0263
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0084
_Distance_constraint_stats_list.Viol_average_violations_only 0.0588
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 8 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 GLN 0.260 0.050 14 0 "[ . 1 . 2]"
1 11 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 TYR 1.473 0.088 16 0 "[ . 1 . 2]"
1 14 LEU 1.427 0.090 13 0 "[ . 1 . 2]"
1 15 LEU 0.115 0.048 3 0 "[ . 1 . 2]"
1 16 ARG 1.470 0.104 20 0 "[ . 1 . 2]"
1 17 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 18 VAL 1.427 0.090 13 0 "[ . 1 . 2]"
1 19 LEU 0.115 0.048 3 0 "[ . 1 . 2]"
1 20 LYS 2.074 0.104 20 0 "[ . 1 . 2]"
1 21 THR 0.161 0.034 6 0 "[ . 1 . 2]"
1 22 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 TRP 2.362 0.524 15 1 "[ . 1 + 2]"
1 24 LYS 0.604 0.094 15 0 "[ . 1 . 2]"
1 25 HIS 0.161 0.034 6 0 "[ . 1 . 2]"
1 28 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 GLN 2.362 0.524 15 1 "[ . 1 + 2]"
1 35 VAL 0.098 0.030 17 0 "[ . 1 . 2]"
1 36 ASP 0.009 0.009 16 0 "[ . 1 . 2]"
1 40 LEU 0.009 0.009 16 0 "[ . 1 . 2]"
1 44 ASP 2.021 0.180 14 0 "[ . 1 . 2]"
1 45 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 TYR 0.098 0.030 17 0 "[ . 1 . 2]"
1 48 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 49 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 51 THR 0.468 0.112 18 0 "[ . 1 . 2]"
1 55 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 GLY 0.085 0.045 16 0 "[ . 1 . 2]"
1 57 THR 0.052 0.034 20 0 "[ . 1 . 2]"
1 58 ILE 0.029 0.016 19 0 "[ . 1 . 2]"
1 59 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 LYS 0.149 0.064 16 0 "[ . 1 . 2]"
1 61 ARG 1.595 0.222 3 0 "[ . 1 . 2]"
1 62 LEU 0.029 0.016 19 0 "[ . 1 . 2]"
1 63 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 ASN 0.064 0.064 16 0 "[ . 1 . 2]"
1 65 ASN 0.363 0.043 18 0 "[ . 1 . 2]"
1 67 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 71 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 ASP 1.180 0.222 3 0 "[ . 1 . 2]"
1 77 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 79 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 MET 2.779 0.115 1 0 "[ . 1 . 2]"
1 81 PHE 0.392 0.044 15 0 "[ . 1 . 2]"
1 82 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 ASN 0.468 0.112 18 0 "[ . 1 . 2]"
1 84 CYS 4.057 0.115 1 0 "[ . 1 . 2]"
1 85 TYR 0.392 0.044 15 0 "[ . 1 . 2]"
1 86 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 TYR 2.021 0.180 14 0 "[ . 1 . 2]"
1 88 ASN 1.279 0.092 9 0 "[ . 1 . 2]"
1 89 LYS 0.054 0.028 4 0 "[ . 1 . 2]"
1 92 ASP 0.054 0.028 4 0 "[ . 1 . 2]"
1 93 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 95 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 LEU 0.024 0.020 19 0 "[ . 1 . 2]"
1 97 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 98 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 GLU 0.159 0.032 20 0 "[ . 1 . 2]"
1 100 ALA 1.035 0.073 2 0 "[ . 1 . 2]"
1 101 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 103 LYS 1.448 0.097 18 0 "[ . 1 . 2]"
1 104 LEU 1.235 0.073 2 0 "[ . 1 . 2]"
1 105 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 106 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 107 GLN 3.943 0.102 12 0 "[ . 1 . 2]"
1 108 LYS 1.696 0.088 16 0 "[ . 1 . 2]"
1 109 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 110 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 111 GLU 2.654 0.102 12 0 "[ . 1 . 2]"
1 112 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 113 PRO 0.260 0.050 14 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 8 THR O 1 12 GLN H 1.800 . 2.300 1.602 1.520 1.781 . 0 0 "[ . 1 . 2]" 2
2 1 8 THR O 1 12 GLN N 2.800 2.300 3.300 2.478 2.431 2.570 . 0 0 "[ . 1 . 2]" 2
3 1 9 ASN O 1 13 TYR H 1.800 . 2.300 1.841 1.729 1.980 . 0 0 "[ . 1 . 2]" 2
4 1 9 ASN O 1 13 TYR N 2.800 2.300 3.300 2.814 2.709 2.960 . 0 0 "[ . 1 . 2]" 2
5 1 10 GLN O 1 14 LEU H 1.800 . 2.300 1.659 1.631 1.699 . 0 0 "[ . 1 . 2]" 2
6 1 10 GLN O 1 14 LEU N 2.800 2.300 3.300 2.639 2.608 2.681 . 0 0 "[ . 1 . 2]" 2
7 1 11 LEU O 1 15 LEU H 1.800 . 2.300 2.029 1.928 2.116 . 0 0 "[ . 1 . 2]" 2
8 1 11 LEU O 1 15 LEU N 2.800 2.300 3.300 2.782 2.715 2.860 . 0 0 "[ . 1 . 2]" 2
9 1 12 GLN O 1 16 ARG H 1.800 . 2.300 1.497 1.473 1.514 . 0 0 "[ . 1 . 2]" 2
10 1 12 GLN O 1 16 ARG N 2.800 2.300 3.300 2.478 2.450 2.495 . 0 0 "[ . 1 . 2]" 2
11 1 13 TYR O 1 17 VAL H 1.800 . 2.300 2.089 2.018 2.147 . 0 0 "[ . 1 . 2]" 2
12 1 13 TYR O 1 17 VAL N 2.800 2.300 3.300 2.853 2.807 2.893 . 0 0 "[ . 1 . 2]" 2
13 1 14 LEU O 1 18 VAL N 3.000 2.500 3.800 3.871 3.841 3.890 0.090 13 0 "[ . 1 . 2]" 2
14 1 15 LEU O 1 19 LEU N 3.000 2.500 3.800 3.766 3.632 3.848 0.048 3 0 "[ . 1 . 2]" 2
15 1 16 ARG O 1 20 LYS N 3.000 2.500 3.800 3.874 3.841 3.904 0.104 20 0 "[ . 1 . 2]" 2
16 1 17 VAL O 1 21 THR H 1.800 . 2.300 1.675 1.635 1.730 . 0 0 "[ . 1 . 2]" 2
17 1 17 VAL O 1 21 THR N 2.800 2.300 3.300 2.569 2.519 2.612 . 0 0 "[ . 1 . 2]" 2
18 1 18 VAL O 1 22 LEU H 1.800 . 2.300 1.681 1.671 1.698 . 0 0 "[ . 1 . 2]" 2
19 1 18 VAL O 1 22 LEU N 2.800 2.300 3.300 2.662 2.653 2.681 . 0 0 "[ . 1 . 2]" 2
20 1 19 LEU O 1 23 TRP H 1.800 . 2.300 1.686 1.655 1.761 . 0 0 "[ . 1 . 2]" 2
21 1 19 LEU O 1 23 TRP N 2.800 2.300 3.300 2.628 2.596 2.689 . 0 0 "[ . 1 . 2]" 2
22 1 20 LYS O 1 24 LYS H 1.800 . 2.300 2.313 2.167 2.394 0.094 15 0 "[ . 1 . 2]" 2
23 1 20 LYS O 1 24 LYS N 2.800 2.300 3.300 3.021 2.876 3.142 . 0 0 "[ . 1 . 2]" 2
24 1 21 THR O 1 25 HIS N 3.000 3.000 3.700 3.673 3.536 3.734 0.034 6 0 "[ . 1 . 2]" 2
25 1 28 ALA O 1 32 GLN H 1.800 . 2.300 1.687 1.611 1.744 . 0 0 "[ . 1 . 2]" 2
26 1 28 ALA O 1 32 GLN N 2.800 2.300 3.300 2.652 2.589 2.700 . 0 0 "[ . 1 . 2]" 2
27 1 36 ASP O 1 40 LEU H 1.800 . 2.300 2.204 2.040 2.309 0.009 16 0 "[ . 1 . 2]" 2
28 1 36 ASP O 1 40 LEU N 2.800 2.300 3.300 3.145 2.995 3.231 . 0 0 "[ . 1 . 2]" 2
29 1 44 ASP O 1 48 ILE H 1.800 . 2.300 1.693 1.594 1.841 . 0 0 "[ . 1 . 2]" 2
30 1 44 ASP O 1 48 ILE N 2.800 2.300 3.300 2.669 2.575 2.784 . 0 0 "[ . 1 . 2]" 2
31 1 45 TYR O 1 49 ILE H 1.800 . 2.300 1.830 1.769 1.895 . 0 0 "[ . 1 . 2]" 2
32 1 45 TYR O 1 49 ILE N 2.800 2.300 3.300 2.748 2.701 2.807 . 0 0 "[ . 1 . 2]" 2
33 1 55 MET O 1 59 LYS H 1.800 . 2.300 1.716 1.638 1.785 . 0 0 "[ . 1 . 2]" 2
34 1 55 MET O 1 59 LYS N 2.800 2.300 3.300 2.631 2.589 2.672 . 0 0 "[ . 1 . 2]" 2
35 1 56 GLY O 1 60 LYS H 1.800 . 2.300 2.164 1.925 2.345 0.045 16 0 "[ . 1 . 2]" 2
36 1 56 GLY O 1 60 LYS N 2.800 2.300 3.300 2.977 2.841 3.130 . 0 0 "[ . 1 . 2]" 2
37 1 57 THR O 1 61 ARG H 1.800 . 2.300 2.193 1.995 2.334 0.034 20 0 "[ . 1 . 2]" 2
38 1 57 THR O 1 61 ARG N 2.800 2.300 3.300 3.135 2.951 3.290 . 0 0 "[ . 1 . 2]" 2
39 1 58 ILE O 1 62 LEU H 1.800 . 2.300 2.208 2.024 2.316 0.016 19 0 "[ . 1 . 2]" 2
40 1 58 ILE O 1 62 LEU N 2.800 2.300 3.300 3.108 2.965 3.200 . 0 0 "[ . 1 . 2]" 2
41 1 59 LYS O 1 63 GLU H 1.800 . 2.300 2.119 1.927 2.286 . 0 0 "[ . 1 . 2]" 2
42 1 59 LYS O 1 63 GLU N 2.800 2.300 3.300 3.089 2.902 3.267 . 0 0 "[ . 1 . 2]" 2
43 1 60 LYS O 1 64 ASN H 1.800 . 2.300 1.992 1.805 2.364 0.064 16 0 "[ . 1 . 2]" 2
44 1 60 LYS O 1 64 ASN N 2.800 2.300 3.300 2.811 2.690 3.000 . 0 0 "[ . 1 . 2]" 2
45 1 61 ARG O 1 65 ASN N 2.900 2.400 3.400 3.380 3.144 3.443 0.043 18 0 "[ . 1 . 2]" 2
46 1 69 ASN O 1 73 CYS N 3.200 3.200 3.900 3.624 3.466 3.834 . 0 0 "[ . 1 . 2]" 2
47 1 70 ALA O 1 74 ILE H 1.800 . 2.300 1.738 1.680 1.849 . 0 0 "[ . 1 . 2]" 2
48 1 70 ALA O 1 74 ILE N 2.800 2.300 3.300 2.683 2.627 2.801 . 0 0 "[ . 1 . 2]" 2
49 1 71 GLN O 1 75 GLN H 1.800 . 2.300 1.741 1.667 1.822 . 0 0 "[ . 1 . 2]" 2
50 1 71 GLN O 1 75 GLN N 2.800 2.300 3.300 2.691 2.609 2.780 . 0 0 "[ . 1 . 2]" 2
51 1 72 GLU O 1 76 ASP H 1.800 . 2.300 2.063 1.968 2.185 . 0 0 "[ . 1 . 2]" 2
52 1 72 GLU O 1 76 ASP N 2.800 2.300 3.300 2.850 2.749 3.006 . 0 0 "[ . 1 . 2]" 2
53 1 73 CYS O 1 77 PHE H 1.800 . 2.300 1.894 1.759 2.096 . 0 0 "[ . 1 . 2]" 2
54 1 73 CYS O 1 77 PHE N 2.800 2.300 3.300 2.804 2.701 2.899 . 0 0 "[ . 1 . 2]" 2
55 1 74 ILE O 1 78 ASN H 1.800 . 2.300 1.559 1.495 1.612 . 0 0 "[ . 1 . 2]" 2
56 1 74 ILE O 1 78 ASN N 2.800 2.300 3.300 2.523 2.463 2.578 . 0 0 "[ . 1 . 2]" 2
57 1 75 GLN O 1 79 THR H 1.800 . 2.300 1.717 1.634 1.877 . 0 0 "[ . 1 . 2]" 2
58 1 75 GLN O 1 79 THR N 2.800 2.300 3.300 2.618 2.568 2.663 . 0 0 "[ . 1 . 2]" 2
59 1 76 ASP O 1 80 MET H 1.800 . 2.300 1.775 1.702 1.939 . 0 0 "[ . 1 . 2]" 2
60 1 76 ASP O 1 80 MET N 2.800 2.300 3.300 2.674 2.620 2.763 . 0 0 "[ . 1 . 2]" 2
61 1 77 PHE O 1 81 PHE H 1.800 . 2.300 2.027 1.909 2.193 . 0 0 "[ . 1 . 2]" 2
62 1 77 PHE O 1 81 PHE N 2.800 2.300 3.300 3.003 2.890 3.164 . 0 0 "[ . 1 . 2]" 2
63 1 78 ASN O 1 82 THR H 1.800 . 2.300 1.824 1.750 1.968 . 0 0 "[ . 1 . 2]" 2
64 1 78 ASN O 1 82 THR N 2.800 2.300 3.300 2.687 2.631 2.822 . 0 0 "[ . 1 . 2]" 2
65 1 79 THR O 1 83 ASN H 1.800 . 2.300 1.673 1.630 1.731 . 0 0 "[ . 1 . 2]" 2
66 1 79 THR O 1 83 ASN N 2.800 2.300 3.300 2.653 2.611 2.705 . 0 0 "[ . 1 . 2]" 2
67 1 80 MET O 1 84 CYS H 1.800 . 2.300 2.396 2.378 2.415 0.115 1 0 "[ . 1 . 2]" 2
68 1 80 MET O 1 84 CYS N 2.800 2.300 3.300 3.342 3.281 3.363 0.063 12 0 "[ . 1 . 2]" 2
69 1 81 PHE O 1 85 TYR H 1.800 . 2.300 2.319 2.296 2.344 0.044 15 0 "[ . 1 . 2]" 2
70 1 81 PHE O 1 85 TYR N 2.800 2.300 3.300 2.963 2.900 3.110 . 0 0 "[ . 1 . 2]" 2
71 1 82 THR O 1 86 ILE H 1.800 . 2.300 1.651 1.524 1.779 . 0 0 "[ . 1 . 2]" 2
72 1 82 THR O 1 86 ILE N 2.800 2.300 3.300 2.506 2.486 2.525 . 0 0 "[ . 1 . 2]" 2
73 1 83 ASN O 1 87 TYR H 1.800 . 2.300 1.871 1.771 2.228 . 0 0 "[ . 1 . 2]" 2
74 1 83 ASN O 1 87 TYR N 2.800 2.300 3.300 2.848 2.752 3.188 . 0 0 "[ . 1 . 2]" 2
75 1 84 CYS O 1 88 ASN H 1.800 . 2.300 2.343 1.877 2.392 0.092 9 0 "[ . 1 . 2]" 2
76 1 84 CYS O 1 88 ASN N 2.800 2.300 3.300 3.091 2.624 3.138 . 0 0 "[ . 1 . 2]" 2
77 1 92 ASP O 1 96 LEU H 1.800 . 2.300 1.655 1.626 1.688 . 0 0 "[ . 1 . 2]" 2
78 1 92 ASP O 1 96 LEU N 2.800 2.300 3.300 2.636 2.605 2.669 . 0 0 "[ . 1 . 2]" 2
79 1 93 ASP O 1 97 MET H 1.800 . 2.300 1.715 1.630 1.799 . 0 0 "[ . 1 . 2]" 2
80 1 93 ASP O 1 97 MET N 2.800 2.300 3.300 2.598 2.546 2.650 . 0 0 "[ . 1 . 2]" 2
81 1 94 ILE O 1 98 ALA H 1.800 . 2.300 1.739 1.719 1.783 . 0 0 "[ . 1 . 2]" 2
82 1 94 ILE O 1 98 ALA N 2.800 2.300 3.300 2.692 2.671 2.739 . 0 0 "[ . 1 . 2]" 2
83 1 95 VAL O 1 99 GLU H 1.800 . 2.300 1.562 1.520 1.598 . 0 0 "[ . 1 . 2]" 2
84 1 95 VAL O 1 99 GLU N 2.800 2.300 3.300 2.480 2.448 2.497 . 0 0 "[ . 1 . 2]" 2
85 1 96 LEU O 1 100 ALA H 1.800 . 2.300 2.199 2.096 2.320 0.020 19 0 "[ . 1 . 2]" 2
86 1 96 LEU O 1 100 ALA N 2.800 2.300 3.300 3.039 2.930 3.191 . 0 0 "[ . 1 . 2]" 2
87 1 97 MET O 1 101 LEU H 1.800 . 2.300 2.062 1.981 2.138 . 0 0 "[ . 1 . 2]" 2
88 1 97 MET O 1 101 LEU N 2.800 2.300 3.300 2.907 2.840 2.965 . 0 0 "[ . 1 . 2]" 2
89 1 98 ALA O 1 102 GLU H 1.800 . 2.300 1.789 1.760 1.828 . 0 0 "[ . 1 . 2]" 2
90 1 98 ALA O 1 102 GLU N 2.800 2.300 3.300 2.579 2.552 2.618 . 0 0 "[ . 1 . 2]" 2
91 1 99 GLU O 1 103 LYS H 1.800 . 2.300 2.242 2.057 2.332 0.032 20 0 "[ . 1 . 2]" 2
92 1 99 GLU O 1 103 LYS N 2.800 2.300 3.300 3.220 3.039 3.310 0.010 10 0 "[ . 1 . 2]" 2
93 1 100 ALA O 1 104 LEU H 2.000 . 2.500 2.551 2.533 2.573 0.073 2 0 "[ . 1 . 2]" 2
94 1 100 ALA O 1 104 LEU N 3.000 2.500 3.500 3.257 3.225 3.302 . 0 0 "[ . 1 . 2]" 2
95 1 101 LEU O 1 105 PHE H 1.800 . 2.300 1.595 1.582 1.611 . 0 0 "[ . 1 . 2]" 2
96 1 101 LEU O 1 105 PHE N 2.800 2.300 3.300 2.562 2.549 2.577 . 0 0 "[ . 1 . 2]" 2
97 1 102 GLU O 1 106 LEU H 1.800 . 2.300 1.636 1.604 1.667 . 0 0 "[ . 1 . 2]" 2
98 1 102 GLU O 1 106 LEU N 2.800 2.300 3.300 2.568 2.535 2.589 . 0 0 "[ . 1 . 2]" 2
99 1 103 LYS O 1 107 GLN H 1.800 . 2.300 2.364 2.313 2.397 0.097 18 0 "[ . 1 . 2]" 2
100 1 103 LYS O 1 107 GLN N 2.800 2.300 3.300 2.963 2.918 3.013 . 0 0 "[ . 1 . 2]" 2
101 1 104 LEU O 1 108 LYS H 1.800 . 2.300 2.308 2.260 2.337 0.037 2 0 "[ . 1 . 2]" 2
102 1 104 LEU O 1 108 LYS N 2.800 2.300 3.300 3.218 3.184 3.260 . 0 0 "[ . 1 . 2]" 2
103 1 105 PHE O 1 109 ILE H 1.800 . 2.300 2.186 2.123 2.213 . 0 0 "[ . 1 . 2]" 2
104 1 105 PHE O 1 109 ILE N 2.800 2.300 3.300 3.101 3.046 3.125 . 0 0 "[ . 1 . 2]" 2
105 1 106 LEU O 1 110 ASN H 1.800 . 2.300 1.953 1.826 2.069 . 0 0 "[ . 1 . 2]" 2
106 1 106 LEU O 1 110 ASN N 2.800 2.300 3.300 2.792 2.684 2.896 . 0 0 "[ . 1 . 2]" 2
107 1 107 GLN O 1 111 GLU H 2.000 . 2.700 2.771 2.729 2.802 0.102 12 0 "[ . 1 . 2]" 2
108 1 107 GLN O 1 111 GLU N 2.800 2.300 3.300 3.362 3.320 3.394 0.094 12 0 "[ . 1 . 2]" 2
109 1 108 LYS O 1 112 LEU N 3.000 2.500 3.500 2.796 2.739 2.856 . 0 0 "[ . 1 . 2]" 2
110 1 25 HIS O 1 28 ALA H 1.800 . 2.300 2.169 2.014 2.252 . 0 0 "[ . 1 . 2]" 2
111 1 25 HIS O 1 28 ALA N 2.800 2.300 3.300 3.096 2.957 3.197 . 0 0 "[ . 1 . 2]" 2
112 1 89 LYS O 1 92 ASP H 1.800 . 2.300 2.196 2.003 2.328 0.028 4 0 "[ . 1 . 2]" 2
113 1 89 LYS O 1 92 ASP N 2.800 2.300 3.300 2.897 2.825 2.993 . 0 0 "[ . 1 . 2]" 2
114 1 35 VAL O 1 46 TYR HH 1.800 . 2.300 2.130 1.902 2.330 0.030 17 0 "[ . 1 . 2]" 2
115 1 35 VAL O 1 46 TYR OH 2.800 2.300 3.300 3.006 2.784 3.231 . 0 0 "[ . 1 . 2]" 2
116 1 44 ASP OD1 1 87 TYR HH 2.000 . 2.500 2.601 2.519 2.680 0.180 14 0 "[ . 1 . 2]" 2
117 1 44 ASP OD1 1 87 TYR OH 2.800 2.300 3.300 3.059 2.852 3.245 . 0 0 "[ . 1 . 2]" 2
118 1 85 TYR HH 1 102 GLU OE2 1.800 . 2.300 1.649 1.614 1.733 . 0 0 "[ . 1 . 2]" 2
119 1 85 TYR OH 1 102 GLU OE2 2.800 2.300 3.300 2.611 2.584 2.691 . 0 0 "[ . 1 . 2]" 2
120 1 13 TYR HH 1 108 LYS O 1.800 . 2.300 2.374 2.359 2.388 0.088 16 0 "[ . 1 . 2]" 2
121 1 13 TYR OH 1 108 LYS O 2.800 2.300 3.300 2.671 2.645 2.704 . 0 0 "[ . 1 . 2]" 2
122 1 23 TRP O 1 32 GLN HE21 1.800 . 2.300 2.398 1.900 2.824 0.524 15 1 "[ . 1 + 2]" 2
123 1 23 TRP O 1 32 GLN NE2 2.800 2.300 3.300 2.690 2.589 2.760 . 0 0 "[ . 1 . 2]" 2
124 1 67 TYR HH 1 76 ASP OD2 1.800 . 2.300 1.648 1.603 1.774 . 0 0 "[ . 1 . 2]" 2
125 1 67 TYR OH 1 76 ASP OD2 2.800 2.300 3.300 2.575 2.528 2.703 . 0 0 "[ . 1 . 2]" 2
126 1 61 ARG NH1 1 76 ASP OD2 2.800 2.300 3.300 3.212 2.638 3.522 0.222 3 0 "[ . 1 . 2]" 2
127 1 10 GLN HE21 1 113 PRO O 1.800 . 2.300 2.251 2.003 2.350 0.050 14 0 "[ . 1 . 2]" 2
128 1 10 GLN NE2 1 113 PRO O 2.800 2.300 3.300 3.030 2.869 3.133 . 0 0 "[ . 1 . 2]" 2
129 1 51 THR O 1 83 ASN QD 2.000 . 2.700 2.465 2.015 2.812 0.112 18 0 "[ . 1 . 2]" 2
130 1 51 THR O 1 83 ASN ND2 3.000 2.500 3.700 3.133 2.748 3.598 . 0 0 "[ . 1 . 2]" 2
131 1 31 PHE O 1 55 MET H 1.800 . 2.300 2.027 1.868 2.240 . 0 0 "[ . 1 . 2]" 2
132 1 31 PHE O 1 55 MET N 2.800 2.300 3.300 2.543 2.497 2.594 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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