Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
606508 | 2n66 RC | 25753 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2n66
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 938
_Distance_constraint_stats_list.Viol_count 2728
_Distance_constraint_stats_list.Viol_total 3392.759
_Distance_constraint_stats_list.Viol_max 0.300
_Distance_constraint_stats_list.Viol_rms 0.0292
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0090
_Distance_constraint_stats_list.Viol_average_violations_only 0.0622
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 3 LYS 0.634 0.125 6 0 "[ . 1 . 2]"
1 4 CYS 4.052 0.197 18 0 "[ . 1 . 2]"
1 5 LYS 7.500 0.120 18 0 "[ . 1 . 2]"
1 6 LYS 6.678 0.178 19 0 "[ . 1 . 2]"
1 7 VAL 13.815 0.246 18 0 "[ . 1 . 2]"
1 8 TYR 5.762 0.164 13 0 "[ . 1 . 2]"
1 9 GLU 0.190 0.018 4 0 "[ . 1 . 2]"
1 10 ASN 0.154 0.021 18 0 "[ . 1 . 2]"
1 11 TYR 0.934 0.090 8 0 "[ . 1 . 2]"
1 12 PRO 0.315 0.023 15 0 "[ . 1 . 2]"
1 13 VAL 6.777 0.187 17 0 "[ . 1 . 2]"
1 14 SER 2.421 0.147 1 0 "[ . 1 . 2]"
1 15 LYS 3.878 0.113 15 0 "[ . 1 . 2]"
1 16 CYS 1.599 0.101 17 0 "[ . 1 . 2]"
1 17 GLN 4.361 0.125 2 0 "[ . 1 . 2]"
1 18 LEU 5.168 0.125 2 0 "[ . 1 . 2]"
1 19 ALA 7.162 0.227 15 0 "[ . 1 . 2]"
1 20 ASN 3.898 0.227 15 0 "[ . 1 . 2]"
1 21 GLN 9.099 0.179 13 0 "[ . 1 . 2]"
1 22 CYS 7.930 0.227 10 0 "[ . 1 . 2]"
1 23 ASN 12.298 0.227 10 0 "[ . 1 . 2]"
1 24 TYR 9.988 0.192 19 0 "[ . 1 . 2]"
1 25 ASP 7.634 0.208 19 0 "[ . 1 . 2]"
1 26 CYS 14.002 0.183 12 0 "[ . 1 . 2]"
1 27 LYS 8.162 0.188 13 0 "[ . 1 . 2]"
1 28 LEU 6.852 0.188 13 0 "[ . 1 . 2]"
1 29 ASP 2.800 0.064 13 0 "[ . 1 . 2]"
1 30 LYS 4.320 0.100 1 0 "[ . 1 . 2]"
1 31 HIS 1.524 0.091 4 0 "[ . 1 . 2]"
1 32 ALA 4.776 0.121 17 0 "[ . 1 . 2]"
1 33 ARG 8.244 0.229 14 0 "[ . 1 . 2]"
1 34 SER 4.121 0.134 14 0 "[ . 1 . 2]"
1 35 GLY 4.556 0.166 18 0 "[ . 1 . 2]"
1 36 GLU 0.803 0.094 17 0 "[ . 1 . 2]"
1 37 CYS 2.031 0.109 13 0 "[ . 1 . 2]"
1 38 PHE 3.193 0.193 10 0 "[ . 1 . 2]"
1 39 TYR 8.697 0.179 13 0 "[ . 1 . 2]"
1 40 LYS 6.468 0.179 13 0 "[ . 1 . 2]"
1 41 GLU 1.456 0.102 17 0 "[ . 1 . 2]"
1 42 LYS 0.002 0.002 13 0 "[ . 1 . 2]"
1 43 ARG 8.672 0.173 11 0 "[ . 1 . 2]"
1 44 ASN 8.367 0.173 11 0 "[ . 1 . 2]"
1 45 LEU 10.746 0.133 15 0 "[ . 1 . 2]"
1 46 GLN 6.441 0.193 10 0 "[ . 1 . 2]"
1 47 CYS 2.231 0.160 17 0 "[ . 1 . 2]"
1 48 ILE 8.586 0.246 18 0 "[ . 1 . 2]"
1 49 CYS 19.053 0.250 19 0 "[ . 1 . 2]"
1 50 ASP 12.511 0.250 19 0 "[ . 1 . 2]"
1 51 TYR 4.412 0.197 18 0 "[ . 1 . 2]"
1 52 CYS 0.607 0.058 20 0 "[ . 1 . 2]"
1 53 GLU 2.689 0.166 14 0 "[ . 1 . 2]"
1 54 TYR 3.595 0.300 15 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 3 LYS H 1 4 CYS H . . 3.730 2.429 1.892 3.727 . 0 0 "[ . 1 . 2]" 1
2 1 3 LYS HA 1 3 LYS QG . . 3.590 2.626 2.163 3.343 . 0 0 "[ . 1 . 2]" 1
3 1 3 LYS HA 1 4 CYS H . . 3.430 3.233 2.151 3.555 0.125 6 0 "[ . 1 . 2]" 1
4 1 3 LYS QB 1 4 CYS H . . 3.930 3.203 2.097 4.049 0.119 14 0 "[ . 1 . 2]" 1
5 1 3 LYS HB2 1 4 CYS H . . 4.530 3.935 2.510 4.531 0.001 13 0 "[ . 1 . 2]" 1
6 1 3 LYS HB3 1 4 CYS H . . 4.530 3.562 2.248 4.601 0.071 14 0 "[ . 1 . 2]" 1
7 1 3 LYS QG 1 4 CYS H . . 4.150 3.582 2.243 4.136 . 0 0 "[ . 1 . 2]" 1
8 1 4 CYS H 1 4 CYS HA . . 2.760 2.765 2.760 2.793 0.033 9 0 "[ . 1 . 2]" 1
9 1 4 CYS H 1 4 CYS QB . . 3.000 2.352 2.212 2.964 . 0 0 "[ . 1 . 2]" 1
10 1 4 CYS H 1 5 LYS H . . 3.830 2.778 2.615 3.053 . 0 0 "[ . 1 . 2]" 1
11 1 4 CYS HA 1 5 LYS H . . 3.450 3.513 3.492 3.570 0.120 18 0 "[ . 1 . 2]" 1
12 1 4 CYS HA 1 51 TYR QB . . 4.020 3.072 2.307 3.382 . 0 0 "[ . 1 . 2]" 1
13 1 4 CYS QB 1 5 LYS H . . 2.790 2.680 2.196 2.819 0.029 8 0 "[ . 1 . 2]" 1
14 1 4 CYS QB 1 51 TYR H . . 3.620 2.954 2.606 3.817 0.197 18 0 "[ . 1 . 2]" 1
15 1 4 CYS QB 1 52 CYS H . . 4.740 3.545 3.092 4.568 . 0 0 "[ . 1 . 2]" 1
16 1 4 CYS HB2 1 51 TYR H . . 4.210 4.224 4.058 4.283 0.073 12 0 "[ . 1 . 2]" 1
17 1 4 CYS HB2 1 52 CYS H . . 5.420 4.804 4.686 4.921 . 0 0 "[ . 1 . 2]" 1
18 1 4 CYS HB3 1 51 TYR H . . 4.210 3.084 2.638 4.321 0.111 20 0 "[ . 1 . 2]" 1
19 1 4 CYS HB3 1 52 CYS H . . 5.420 3.781 3.134 5.478 0.058 20 0 "[ . 1 . 2]" 1
20 1 5 LYS H 1 5 LYS HB2 . . 3.570 2.366 2.332 2.429 . 0 0 "[ . 1 . 2]" 1
21 1 5 LYS H 1 5 LYS QB . . 3.120 2.335 2.304 2.395 . 0 0 "[ . 1 . 2]" 1
22 1 5 LYS H 1 5 LYS HB3 . . 3.570 3.604 3.588 3.633 0.063 18 0 "[ . 1 . 2]" 1
23 1 5 LYS H 1 5 LYS HD2 . . 5.500 4.746 4.714 4.776 . 0 0 "[ . 1 . 2]" 1
24 1 5 LYS H 1 5 LYS QD . . 4.830 4.436 4.416 4.465 . 0 0 "[ . 1 . 2]" 1
25 1 5 LYS H 1 5 LYS HD3 . . 5.500 5.328 5.265 5.372 . 0 0 "[ . 1 . 2]" 1
26 1 5 LYS H 1 5 LYS QE . . 4.520 4.450 4.368 4.534 0.014 20 0 "[ . 1 . 2]" 1
27 1 5 LYS H 1 5 LYS QG . . 3.520 2.747 2.675 2.809 . 0 0 "[ . 1 . 2]" 1
28 1 5 LYS H 1 6 LYS H . . 4.560 4.561 4.527 4.568 0.008 17 0 "[ . 1 . 2]" 1
29 1 5 LYS HA 1 5 LYS HD2 . . 4.260 4.264 4.227 4.291 0.031 12 0 "[ . 1 . 2]" 1
30 1 5 LYS HA 1 5 LYS QD . . 3.730 3.758 3.730 3.788 0.058 12 0 "[ . 1 . 2]" 1
31 1 5 LYS HA 1 5 LYS HD3 . . 4.260 4.177 4.125 4.214 . 0 0 "[ . 1 . 2]" 1
32 1 5 LYS HA 1 5 LYS QE . . 5.340 4.749 4.725 4.782 . 0 0 "[ . 1 . 2]" 1
33 1 5 LYS HA 1 5 LYS QG . . 2.800 2.278 2.245 2.321 . 0 0 "[ . 1 . 2]" 1
34 1 5 LYS HA 1 6 LYS H . . 2.890 2.214 2.181 2.226 . 0 0 "[ . 1 . 2]" 1
35 1 5 LYS HA 1 48 ILE MG . . 3.520 3.491 3.369 3.569 0.049 17 0 "[ . 1 . 2]" 1
36 1 5 LYS HA 1 51 TYR H . . 3.940 3.230 3.051 3.327 . 0 0 "[ . 1 . 2]" 1
37 1 5 LYS HA 1 51 TYR QB . . 4.510 4.285 4.148 4.448 . 0 0 "[ . 1 . 2]" 1
38 1 5 LYS HA 1 51 TYR QD . . 4.040 3.376 3.105 3.624 . 0 0 "[ . 1 . 2]" 1
39 1 5 LYS QB 1 5 LYS QD . . 3.330 2.061 2.046 2.073 . 0 0 "[ . 1 . 2]" 1
40 1 5 LYS QB 1 5 LYS QE . . 3.110 3.118 3.082 3.197 0.087 18 0 "[ . 1 . 2]" 1
41 1 5 LYS QB 1 6 LYS H . . 3.380 2.910 2.865 3.026 . 0 0 "[ . 1 . 2]" 1
42 1 5 LYS QB 1 48 ILE MG . . 2.850 1.934 1.866 1.988 . 0 0 "[ . 1 . 2]" 1
43 1 5 LYS QB 1 50 ASP HA . . 3.610 3.663 3.634 3.712 0.102 18 0 "[ . 1 . 2]" 1
44 1 5 LYS HB2 1 6 LYS H . . 4.050 4.097 4.060 4.139 0.089 9 0 "[ . 1 . 2]" 1
45 1 5 LYS HB2 1 48 ILE MG . . 3.560 3.139 3.032 3.290 . 0 0 "[ . 1 . 2]" 1
46 1 5 LYS HB3 1 6 LYS H . . 4.050 2.978 2.929 3.111 . 0 0 "[ . 1 . 2]" 1
47 1 5 LYS HB3 1 48 ILE MG . . 3.560 1.952 1.883 2.007 . 0 0 "[ . 1 . 2]" 1
48 1 5 LYS QD 1 6 LYS H . . 5.300 4.565 4.507 4.717 . 0 0 "[ . 1 . 2]" 1
49 1 5 LYS QD 1 48 ILE MG . . 3.370 2.626 2.283 2.701 . 0 0 "[ . 1 . 2]" 1
50 1 5 LYS HD2 1 48 ILE MG . . 3.850 2.738 2.417 2.808 . 0 0 "[ . 1 . 2]" 1
51 1 5 LYS HD3 1 48 ILE MG . . 3.850 3.391 2.805 3.508 . 0 0 "[ . 1 . 2]" 1
52 1 5 LYS QE 1 5 LYS QG . . 2.730 2.091 1.989 2.113 . 0 0 "[ . 1 . 2]" 1
53 1 5 LYS QE 1 38 PHE QE . . 5.340 4.080 3.791 4.593 . 0 0 "[ . 1 . 2]" 1
54 1 5 LYS QE 1 48 ILE MG . . 4.350 4.348 4.083 4.392 0.042 8 0 "[ . 1 . 2]" 1
55 1 5 LYS QE 1 50 ASP HA . . 4.440 4.465 4.442 4.527 0.087 18 0 "[ . 1 . 2]" 1
56 1 5 LYS QG 1 6 LYS H . . 4.260 3.900 3.822 4.051 . 0 0 "[ . 1 . 2]" 1
57 1 5 LYS QG 1 48 ILE MG . . 3.470 3.507 3.289 3.564 0.094 7 0 "[ . 1 . 2]" 1
58 1 5 LYS QG 1 50 ASP HA . . 3.370 1.976 1.945 2.110 . 0 0 "[ . 1 . 2]" 1
59 1 5 LYS QG 1 50 ASP QB . . 3.100 2.995 2.481 3.154 0.054 17 0 "[ . 1 . 2]" 1
60 1 5 LYS QG 1 51 TYR H . . 4.100 3.355 3.238 3.495 . 0 0 "[ . 1 . 2]" 1
61 1 6 LYS H 1 6 LYS HB2 . . 3.700 2.561 2.490 2.743 . 0 0 "[ . 1 . 2]" 1
62 1 6 LYS H 1 6 LYS HB3 . . 3.700 3.484 3.140 3.658 . 0 0 "[ . 1 . 2]" 1
63 1 6 LYS H 1 6 LYS QG . . 4.230 3.904 3.775 4.175 . 0 0 "[ . 1 . 2]" 1
64 1 6 LYS H 1 48 ILE MG . . 3.620 2.671 2.534 2.817 . 0 0 "[ . 1 . 2]" 1
65 1 6 LYS H 1 49 CYS H . . 3.360 2.921 2.781 3.070 . 0 0 "[ . 1 . 2]" 1
66 1 6 LYS H 1 49 CYS HB2 . . 4.070 3.029 2.890 3.127 . 0 0 "[ . 1 . 2]" 1
67 1 6 LYS H 1 49 CYS QB . . 3.420 2.912 2.785 3.005 . 0 0 "[ . 1 . 2]" 1
68 1 6 LYS H 1 49 CYS HB3 . . 4.070 3.781 3.552 3.889 . 0 0 "[ . 1 . 2]" 1
69 1 6 LYS H 1 50 ASP HA . . 3.800 3.796 3.687 3.850 0.050 18 0 "[ . 1 . 2]" 1
70 1 6 LYS H 1 51 TYR QD . . 4.720 3.674 3.441 3.904 . 0 0 "[ . 1 . 2]" 1
71 1 6 LYS H 1 51 TYR QE . . 4.310 3.983 3.536 4.341 0.031 18 0 "[ . 1 . 2]" 1
72 1 6 LYS HA 1 6 LYS QD . . 4.960 3.174 2.246 3.527 . 0 0 "[ . 1 . 2]" 1
73 1 6 LYS HA 1 6 LYS HE2 . . 5.500 4.661 1.999 5.454 . 0 0 "[ . 1 . 2]" 1
74 1 6 LYS HA 1 6 LYS QE . . 4.690 4.107 1.971 4.651 . 0 0 "[ . 1 . 2]" 1
75 1 6 LYS HA 1 6 LYS HE3 . . 5.500 4.710 3.005 5.446 . 0 0 "[ . 1 . 2]" 1
76 1 6 LYS HA 1 6 LYS QG . . 3.310 2.185 2.071 2.440 . 0 0 "[ . 1 . 2]" 1
77 1 6 LYS HA 1 7 VAL H . . 2.540 2.204 2.178 2.269 . 0 0 "[ . 1 . 2]" 1
78 1 6 LYS QB 1 6 LYS QE . . 4.140 3.409 2.606 3.664 . 0 0 "[ . 1 . 2]" 1
79 1 6 LYS QB 1 7 VAL H . . 3.430 3.147 2.973 3.399 . 0 0 "[ . 1 . 2]" 1
80 1 6 LYS QB 1 51 TYR QD . . 4.740 3.315 3.056 3.544 . 0 0 "[ . 1 . 2]" 1
81 1 6 LYS QB 1 51 TYR QE . . 3.390 2.576 2.149 2.980 . 0 0 "[ . 1 . 2]" 1
82 1 6 LYS HB2 1 6 LYS HE2 . . 5.380 4.219 2.819 5.345 . 0 0 "[ . 1 . 2]" 1
83 1 6 LYS HB2 1 6 LYS HE3 . . 5.380 4.444 3.703 4.991 . 0 0 "[ . 1 . 2]" 1
84 1 6 LYS HB2 1 7 VAL H . . 4.160 4.287 4.212 4.338 0.178 19 0 "[ . 1 . 2]" 1
85 1 6 LYS HB2 1 51 TYR QD . . 5.390 3.366 3.112 3.600 . 0 0 "[ . 1 . 2]" 1
86 1 6 LYS HB2 1 51 TYR QE . . 4.090 2.642 2.166 3.104 . 0 0 "[ . 1 . 2]" 1
87 1 6 LYS HB3 1 6 LYS HE2 . . 5.380 4.275 3.436 4.818 . 0 0 "[ . 1 . 2]" 1
88 1 6 LYS HB3 1 6 LYS HE3 . . 5.380 4.593 3.766 5.333 . 0 0 "[ . 1 . 2]" 1
89 1 6 LYS HB3 1 7 VAL H . . 4.160 3.240 3.039 3.553 . 0 0 "[ . 1 . 2]" 1
90 1 6 LYS HB3 1 51 TYR QD . . 5.390 4.977 4.456 5.290 . 0 0 "[ . 1 . 2]" 1
91 1 6 LYS HB3 1 51 TYR QE . . 4.090 3.789 2.996 4.095 0.005 13 0 "[ . 1 . 2]" 1
92 1 6 LYS QE 1 6 LYS QG . . 3.140 2.085 1.998 2.179 . 0 0 "[ . 1 . 2]" 1
93 1 6 LYS QG 1 7 VAL H . . 3.500 3.558 3.517 3.615 0.115 13 0 "[ . 1 . 2]" 1
94 1 6 LYS QG 1 51 TYR QD . . 4.530 4.566 4.516 4.644 0.114 9 0 "[ . 1 . 2]" 1
95 1 6 LYS QG 1 51 TYR QE . . 4.380 4.171 3.755 4.278 . 0 0 "[ . 1 . 2]" 1
96 1 6 LYS HG2 1 7 VAL H . . 4.280 4.136 3.714 4.326 0.046 13 0 "[ . 1 . 2]" 1
97 1 6 LYS HG2 1 51 TYR QD . . 5.260 5.247 5.129 5.314 0.054 13 0 "[ . 1 . 2]" 1
98 1 6 LYS HG2 1 51 TYR QE . . 5.230 4.705 4.392 5.277 0.047 18 0 "[ . 1 . 2]" 1
99 1 6 LYS HG3 1 7 VAL H . . 4.280 3.966 3.773 4.361 0.081 7 0 "[ . 1 . 2]" 1
100 1 6 LYS HG3 1 51 TYR QD . . 5.260 5.024 4.914 5.192 . 0 0 "[ . 1 . 2]" 1
101 1 6 LYS HG3 1 51 TYR QE . . 5.230 4.772 3.946 5.067 . 0 0 "[ . 1 . 2]" 1
102 1 7 VAL H 1 7 VAL HB . . 3.730 2.704 2.535 2.833 . 0 0 "[ . 1 . 2]" 1
103 1 7 VAL H 1 7 VAL MG1 . . 3.690 2.039 1.912 2.219 . 0 0 "[ . 1 . 2]" 1
104 1 7 VAL H 1 7 VAL QG . . 2.770 2.030 1.907 2.204 . 0 0 "[ . 1 . 2]" 1
105 1 7 VAL H 1 7 VAL MG2 . . 3.690 3.772 3.761 3.790 0.100 7 0 "[ . 1 . 2]" 1
106 1 7 VAL H 1 48 ILE MG . . 3.870 3.321 3.130 3.921 0.051 18 0 "[ . 1 . 2]" 1
107 1 7 VAL HA 1 7 VAL MG1 . . 3.070 3.185 3.182 3.190 0.120 15 0 "[ . 1 . 2]" 1
108 1 7 VAL HA 1 7 VAL MG2 . . 3.070 2.380 2.327 2.406 . 0 0 "[ . 1 . 2]" 1
109 1 7 VAL HA 1 48 ILE HA . . 3.770 2.318 2.234 2.395 . 0 0 "[ . 1 . 2]" 1
110 1 7 VAL HA 1 48 ILE MD . . 3.880 3.446 1.832 3.825 . 0 0 "[ . 1 . 2]" 1
111 1 7 VAL HA 1 48 ILE QG . . 3.350 2.655 2.457 3.596 0.246 18 0 "[ . 1 . 2]" 1
112 1 7 VAL HA 1 48 ILE MG . . 3.870 2.431 2.140 3.095 . 0 0 "[ . 1 . 2]" 1
113 1 7 VAL HA 1 49 CYS H . . 3.430 3.453 3.373 3.543 0.113 20 0 "[ . 1 . 2]" 1
114 1 7 VAL HB 1 8 TYR H . . 3.980 4.078 4.021 4.144 0.164 13 0 "[ . 1 . 2]" 1
115 1 7 VAL HB 1 46 GLN QE . . 4.180 3.583 3.299 3.741 . 0 0 "[ . 1 . 2]" 1
116 1 7 VAL HB 1 48 ILE HA . . 5.130 4.479 4.330 4.628 . 0 0 "[ . 1 . 2]" 1
117 1 7 VAL HB 1 48 ILE MD . . 3.670 3.160 1.982 3.585 . 0 0 "[ . 1 . 2]" 1
118 1 7 VAL HB 1 48 ILE MG . . 4.880 3.435 3.262 4.041 . 0 0 "[ . 1 . 2]" 1
119 1 7 VAL QG 1 8 TYR H . . 3.150 2.314 2.068 2.509 . 0 0 "[ . 1 . 2]" 1
120 1 7 VAL QG 1 8 TYR HA . . 4.200 3.716 3.678 3.776 . 0 0 "[ . 1 . 2]" 1
121 1 7 VAL QG 1 8 TYR QB . . 4.510 3.517 3.435 3.605 . 0 0 "[ . 1 . 2]" 1
122 1 7 VAL QG 1 9 GLU H . . 5.020 4.365 4.310 4.414 . 0 0 "[ . 1 . 2]" 1
123 1 7 VAL QG 1 9 GLU HA . . 3.970 3.970 3.929 3.988 0.018 4 0 "[ . 1 . 2]" 1
124 1 7 VAL QG 1 10 ASN H . . 5.440 5.199 5.126 5.272 . 0 0 "[ . 1 . 2]" 1
125 1 7 VAL QG 1 11 TYR H . . 5.440 5.487 5.438 5.530 0.090 8 0 "[ . 1 . 2]" 1
126 1 7 VAL QG 1 46 GLN QE . . 3.290 1.902 1.744 2.051 . 0 0 "[ . 1 . 2]" 1
127 1 7 VAL QG 1 47 CYS H . . 3.960 3.824 3.724 3.951 . 0 0 "[ . 1 . 2]" 1
128 1 7 VAL QG 1 48 ILE HA . . 4.110 3.652 3.592 3.775 . 0 0 "[ . 1 . 2]" 1
129 1 7 VAL QG 1 48 ILE MD . . 3.410 3.337 2.171 3.498 0.088 12 0 "[ . 1 . 2]" 1
130 1 7 VAL MG1 1 8 TYR H . . 4.200 3.932 3.775 4.041 . 0 0 "[ . 1 . 2]" 1
131 1 7 VAL MG1 1 46 GLN HE21 . . 4.400 4.317 4.047 4.494 0.094 8 0 "[ . 1 . 2]" 1
132 1 7 VAL MG1 1 46 GLN HE22 . . 4.400 4.391 4.247 4.419 0.019 12 0 "[ . 1 . 2]" 1
133 1 7 VAL MG1 1 48 ILE HA . . 5.130 5.093 5.026 5.143 0.013 8 0 "[ . 1 . 2]" 1
134 1 7 VAL MG2 1 8 TYR H . . 4.200 2.331 2.076 2.534 . 0 0 "[ . 1 . 2]" 1
135 1 7 VAL MG2 1 46 GLN HE21 . . 4.400 1.986 1.859 2.149 . 0 0 "[ . 1 . 2]" 1
136 1 7 VAL MG2 1 46 GLN HE22 . . 4.400 2.563 1.964 2.837 . 0 0 "[ . 1 . 2]" 1
137 1 7 VAL MG2 1 48 ILE HA . . 5.130 3.743 3.673 3.883 . 0 0 "[ . 1 . 2]" 1
138 1 8 TYR H 1 8 TYR HB2 . . 3.040 2.181 2.141 2.216 . 0 0 "[ . 1 . 2]" 1
139 1 8 TYR H 1 8 TYR HB3 . . 3.040 3.011 2.943 3.055 0.015 18 0 "[ . 1 . 2]" 1
140 1 8 TYR H 1 8 TYR QD . . 4.360 3.987 3.937 4.033 . 0 0 "[ . 1 . 2]" 1
141 1 8 TYR H 1 47 CYS H . . 4.140 4.134 3.987 4.234 0.094 8 0 "[ . 1 . 2]" 1
142 1 8 TYR H 1 48 ILE HA . . 3.150 2.815 2.710 3.029 . 0 0 "[ . 1 . 2]" 1
143 1 8 TYR H 1 49 CYS H . . 4.090 4.120 4.099 4.150 0.060 13 0 "[ . 1 . 2]" 1
144 1 8 TYR HA 1 8 TYR QD . . 3.360 2.863 2.745 2.994 . 0 0 "[ . 1 . 2]" 1
145 1 8 TYR HA 1 9 GLU H . . 2.510 2.212 2.208 2.218 . 0 0 "[ . 1 . 2]" 1
146 1 8 TYR QB 1 10 ASN H . . 3.730 3.219 3.092 3.353 . 0 0 "[ . 1 . 2]" 1
147 1 8 TYR QB 1 47 CYS QB . . 3.000 2.836 2.759 2.949 . 0 0 "[ . 1 . 2]" 1
148 1 8 TYR HB2 1 9 GLU H . . 5.210 4.305 4.276 4.322 . 0 0 "[ . 1 . 2]" 1
149 1 8 TYR HB2 1 47 CYS HB2 . . 4.150 4.051 3.820 4.161 0.011 8 0 "[ . 1 . 2]" 1
150 1 8 TYR HB2 1 47 CYS HB3 . . 4.150 3.071 2.971 3.256 . 0 0 "[ . 1 . 2]" 1
151 1 8 TYR HB3 1 9 GLU H . . 5.210 3.555 3.516 3.624 . 0 0 "[ . 1 . 2]" 1
152 1 8 TYR HB3 1 47 CYS HB2 . . 4.150 4.164 3.964 4.223 0.073 10 0 "[ . 1 . 2]" 1
153 1 8 TYR HB3 1 47 CYS HB3 . . 4.150 3.861 3.642 4.169 0.019 18 0 "[ . 1 . 2]" 1
154 1 8 TYR QD 1 9 GLU H . . 3.580 2.099 2.002 2.256 . 0 0 "[ . 1 . 2]" 1
155 1 8 TYR QD 1 26 CYS HA . . 3.860 3.932 3.806 3.964 0.104 8 0 "[ . 1 . 2]" 1
156 1 8 TYR QD 1 30 LYS QD . . 4.590 3.748 3.622 3.908 . 0 0 "[ . 1 . 2]" 1
157 1 8 TYR QD 1 30 LYS HE2 . . 4.430 3.783 3.179 4.154 . 0 0 "[ . 1 . 2]" 1
158 1 8 TYR QD 1 30 LYS HE3 . . 4.430 3.038 2.839 4.453 0.023 1 0 "[ . 1 . 2]" 1
159 1 8 TYR QD 1 30 LYS HG2 . . 4.590 4.589 4.478 4.622 0.032 2 0 "[ . 1 . 2]" 1
160 1 8 TYR QD 1 30 LYS HG3 . . 3.820 3.525 3.386 3.562 . 0 0 "[ . 1 . 2]" 1
161 1 8 TYR QD 1 47 CYS QB . . 5.080 3.374 3.223 3.502 . 0 0 "[ . 1 . 2]" 1
162 1 8 TYR QE 1 26 CYS H . . 4.200 4.215 4.086 4.256 0.056 2 0 "[ . 1 . 2]" 1
163 1 8 TYR QE 1 29 ASP HB2 . . 4.460 3.596 3.351 3.761 . 0 0 "[ . 1 . 2]" 1
164 1 8 TYR QE 1 29 ASP QB . . 3.890 3.317 3.140 3.387 . 0 0 "[ . 1 . 2]" 1
165 1 8 TYR QE 1 29 ASP HB3 . . 4.460 3.896 3.790 3.968 . 0 0 "[ . 1 . 2]" 1
166 1 9 GLU H 1 9 GLU HB2 . . 3.650 2.572 2.196 2.735 . 0 0 "[ . 1 . 2]" 1
167 1 9 GLU H 1 9 GLU HB3 . . 3.650 3.589 3.499 3.603 . 0 0 "[ . 1 . 2]" 1
168 1 9 GLU H 1 9 GLU HG2 . . 3.420 2.598 1.998 3.430 0.010 2 0 "[ . 1 . 2]" 1
169 1 9 GLU H 1 9 GLU QG . . 2.940 2.236 1.952 2.943 0.003 2 0 "[ . 1 . 2]" 1
170 1 9 GLU H 1 9 GLU HG3 . . 3.420 2.704 1.974 3.334 . 0 0 "[ . 1 . 2]" 1
171 1 9 GLU HA 1 9 GLU HG2 . . 4.140 2.446 2.068 2.626 . 0 0 "[ . 1 . 2]" 1
172 1 9 GLU HA 1 9 GLU QG . . 3.270 2.399 2.047 2.580 . 0 0 "[ . 1 . 2]" 1
173 1 9 GLU HA 1 9 GLU HG3 . . 4.140 3.522 3.028 3.783 . 0 0 "[ . 1 . 2]" 1
174 1 9 GLU QB 1 9 GLU QG . . 2.360 2.040 2.019 2.086 . 0 0 "[ . 1 . 2]" 1
175 1 9 GLU QB 1 10 ASN HD21 . . 4.450 2.930 2.259 3.572 . 0 0 "[ . 1 . 2]" 1
176 1 9 GLU QB 1 10 ASN HD22 . . 4.460 2.782 2.363 4.102 . 0 0 "[ . 1 . 2]" 1
177 1 9 GLU HB2 1 10 ASN H . . 3.640 2.378 2.262 2.658 . 0 0 "[ . 1 . 2]" 1
178 1 9 GLU HB2 1 10 ASN HD21 . . 5.320 3.829 3.105 4.823 . 0 0 "[ . 1 . 2]" 1
179 1 9 GLU HB3 1 10 ASN H . . 3.640 3.354 2.823 3.583 . 0 0 "[ . 1 . 2]" 1
180 1 9 GLU HB3 1 10 ASN HD21 . . 5.320 3.277 2.305 4.665 . 0 0 "[ . 1 . 2]" 1
181 1 9 GLU QG 1 10 ASN H . . 4.480 3.952 3.758 4.254 . 0 0 "[ . 1 . 2]" 1
182 1 9 GLU QG 1 10 ASN HD21 . . 5.340 4.917 4.360 5.344 0.004 17 0 "[ . 1 . 2]" 1
183 1 9 GLU QG 1 10 ASN HD22 . . 5.340 4.713 4.451 5.352 0.012 2 0 "[ . 1 . 2]" 1
184 1 10 ASN H 1 11 TYR H . . 4.090 3.748 3.613 3.910 . 0 0 "[ . 1 . 2]" 1
185 1 10 ASN HA 1 10 ASN QB . . 2.630 2.188 2.164 2.472 . 0 0 "[ . 1 . 2]" 1
186 1 10 ASN QB 1 10 ASN HD21 . . 3.040 2.243 2.092 2.461 . 0 0 "[ . 1 . 2]" 1
187 1 10 ASN QB 1 11 TYR H . . 4.000 3.446 3.391 3.526 . 0 0 "[ . 1 . 2]" 1
188 1 10 ASN HB2 1 10 ASN HD21 . . 3.530 3.058 2.148 3.475 . 0 0 "[ . 1 . 2]" 1
189 1 10 ASN HB2 1 11 TYR H . . 4.590 3.702 3.586 4.477 . 0 0 "[ . 1 . 2]" 1
190 1 10 ASN HB3 1 10 ASN HD21 . . 3.530 2.649 2.117 3.551 0.021 18 0 "[ . 1 . 2]" 1
191 1 10 ASN HB3 1 11 TYR H . . 4.590 4.173 3.601 4.306 . 0 0 "[ . 1 . 2]" 1
192 1 11 TYR H 1 11 TYR HB2 . . 3.790 2.492 2.474 2.568 . 0 0 "[ . 1 . 2]" 1
193 1 11 TYR H 1 11 TYR HB3 . . 3.790 3.429 3.385 3.443 . 0 0 "[ . 1 . 2]" 1
194 1 11 TYR H 1 11 TYR QD . . 5.140 3.659 3.626 3.730 . 0 0 "[ . 1 . 2]" 1
195 1 11 TYR HA 1 12 PRO HD2 . . 3.540 2.481 2.430 2.501 . 0 0 "[ . 1 . 2]" 1
196 1 11 TYR HA 1 12 PRO HD3 . . 3.540 2.333 2.309 2.343 . 0 0 "[ . 1 . 2]" 1
197 1 11 TYR HA 1 12 PRO QG . . 5.020 4.053 4.020 4.067 . 0 0 "[ . 1 . 2]" 1
198 1 11 TYR QB 1 12 PRO QD . . 4.250 2.315 2.259 2.463 . 0 0 "[ . 1 . 2]" 1
199 1 11 TYR QB 1 12 PRO QG . . 4.150 3.695 3.650 3.817 . 0 0 "[ . 1 . 2]" 1
200 1 11 TYR QB 1 47 CYS QB . . 3.980 2.496 1.994 3.031 . 0 0 "[ . 1 . 2]" 1
201 1 11 TYR HB2 1 12 PRO HD2 . . 5.500 3.688 3.658 3.765 . 0 0 "[ . 1 . 2]" 1
202 1 11 TYR HB2 1 12 PRO HD3 . . 5.500 4.722 4.702 4.766 . 0 0 "[ . 1 . 2]" 1
203 1 11 TYR HB3 1 12 PRO HD2 . . 5.500 2.370 2.307 2.537 . 0 0 "[ . 1 . 2]" 1
204 1 11 TYR HB3 1 12 PRO HD3 . . 5.500 3.745 3.695 3.877 . 0 0 "[ . 1 . 2]" 1
205 1 11 TYR QE 1 25 ASP HB2 . . 4.280 2.997 2.828 3.632 . 0 0 "[ . 1 . 2]" 1
206 1 11 TYR QE 1 25 ASP QB . . 3.630 2.189 1.953 3.214 . 0 0 "[ . 1 . 2]" 1
207 1 11 TYR QE 1 25 ASP HB3 . . 4.280 2.276 1.979 3.604 . 0 0 "[ . 1 . 2]" 1
208 1 12 PRO HA 1 13 VAL H . . 2.400 2.155 2.151 2.175 . 0 0 "[ . 1 . 2]" 1
209 1 12 PRO HA 1 13 VAL MG1 . . 5.460 5.401 3.956 5.483 0.023 15 0 "[ . 1 . 2]" 1
210 1 12 PRO HA 1 13 VAL QG . . 3.940 3.678 3.350 3.772 . 0 0 "[ . 1 . 2]" 1
211 1 12 PRO HA 1 13 VAL MG2 . . 5.460 3.750 3.512 3.844 . 0 0 "[ . 1 . 2]" 1
212 1 12 PRO HA 1 14 SER H . . 3.980 3.684 3.602 3.975 . 0 0 "[ . 1 . 2]" 1
213 1 12 PRO QB 1 13 VAL H . . 3.680 3.338 3.178 3.434 . 0 0 "[ . 1 . 2]" 1
214 1 12 PRO QB 1 14 SER H . . 3.570 2.888 2.687 3.466 . 0 0 "[ . 1 . 2]" 1
215 1 12 PRO QB 1 15 LYS H . . 4.220 2.493 2.243 2.852 . 0 0 "[ . 1 . 2]" 1
216 1 12 PRO HB2 1 13 VAL H . . 4.350 3.566 3.370 3.683 . 0 0 "[ . 1 . 2]" 1
217 1 12 PRO HB3 1 13 VAL H . . 4.350 4.023 3.892 4.104 . 0 0 "[ . 1 . 2]" 1
218 1 12 PRO QG 1 13 VAL H . . 5.030 4.670 4.594 4.708 . 0 0 "[ . 1 . 2]" 1
219 1 12 PRO QG 1 15 LYS QB . . 3.980 1.976 1.916 2.181 . 0 0 "[ . 1 . 2]" 1
220 1 12 PRO HG2 1 15 LYS H . . 5.100 3.204 3.018 3.662 . 0 0 "[ . 1 . 2]" 1
221 1 12 PRO HG3 1 15 LYS H . . 5.100 4.383 4.302 4.665 . 0 0 "[ . 1 . 2]" 1
222 1 13 VAL H 1 13 VAL HB . . 3.440 2.536 2.438 3.601 0.161 13 0 "[ . 1 . 2]" 1
223 1 13 VAL H 1 13 VAL MG1 . . 3.580 3.695 2.505 3.767 0.187 17 0 "[ . 1 . 2]" 1
224 1 13 VAL H 1 13 VAL QG . . 3.060 2.201 1.840 2.353 . 0 0 "[ . 1 . 2]" 1
225 1 13 VAL H 1 13 VAL MG2 . . 3.580 2.219 1.894 2.377 . 0 0 "[ . 1 . 2]" 1
226 1 13 VAL H 1 14 SER H . . 3.110 2.565 2.558 2.641 . 0 0 "[ . 1 . 2]" 1
227 1 13 VAL HA 1 13 VAL MG1 . . 3.180 2.344 2.263 2.386 . 0 0 "[ . 1 . 2]" 1
228 1 13 VAL HA 1 13 VAL QG . . 2.740 2.092 2.058 2.227 . 0 0 "[ . 1 . 2]" 1
229 1 13 VAL HA 1 13 VAL MG2 . . 3.180 2.379 2.274 3.196 0.016 13 0 "[ . 1 . 2]" 1
230 1 13 VAL HA 1 14 SER H . . 3.400 3.472 3.456 3.547 0.147 1 0 "[ . 1 . 2]" 1
231 1 13 VAL HA 1 16 CYS H . . 3.570 3.266 2.988 3.445 . 0 0 "[ . 1 . 2]" 1
232 1 13 VAL HA 1 16 CYS HB2 . . 4.020 2.222 2.111 2.587 . 0 0 "[ . 1 . 2]" 1
233 1 13 VAL HA 1 16 CYS HB3 . . 4.020 3.309 2.933 3.745 . 0 0 "[ . 1 . 2]" 1
234 1 13 VAL HA 1 45 LEU HB2 . . 5.500 4.489 4.239 4.788 . 0 0 "[ . 1 . 2]" 1
235 1 13 VAL HA 1 45 LEU HB3 . . 5.500 3.045 2.786 3.327 . 0 0 "[ . 1 . 2]" 1
236 1 13 VAL HB 1 14 SER H . . 3.730 2.996 2.541 3.763 0.033 13 0 "[ . 1 . 2]" 1
237 1 13 VAL QG 1 14 SER H . . 3.360 3.325 2.145 3.428 0.068 18 0 "[ . 1 . 2]" 1
238 1 13 VAL QG 1 16 CYS QB . . 4.190 2.942 2.817 3.451 . 0 0 "[ . 1 . 2]" 1
239 1 13 VAL QG 1 44 ASN QB . . 4.100 3.909 3.687 4.033 . 0 0 "[ . 1 . 2]" 1
240 1 13 VAL QG 1 45 LEU H . . 4.330 1.885 1.817 2.145 . 0 0 "[ . 1 . 2]" 1
241 1 13 VAL QG 1 45 LEU QB . . 3.920 1.730 1.691 1.921 . 0 0 "[ . 1 . 2]" 1
242 1 13 VAL QG 1 45 LEU QD . . 3.730 2.422 2.235 3.110 . 0 0 "[ . 1 . 2]" 1
243 1 13 VAL MG1 1 14 SER H . . 4.890 3.687 3.420 4.078 . 0 0 "[ . 1 . 2]" 1
244 1 13 VAL MG1 1 16 CYS HB2 . . 5.500 3.475 3.304 3.780 . 0 0 "[ . 1 . 2]" 1
245 1 13 VAL MG1 1 16 CYS HB3 . . 5.500 3.400 3.213 4.432 . 0 0 "[ . 1 . 2]" 1
246 1 13 VAL MG1 1 44 ASN HA . . 5.500 3.424 3.321 3.486 . 0 0 "[ . 1 . 2]" 1
247 1 13 VAL MG1 1 44 ASN HB2 . . 5.500 5.480 4.658 5.546 0.046 17 0 "[ . 1 . 2]" 1
248 1 13 VAL MG1 1 44 ASN HB3 . . 5.500 5.409 4.076 5.524 0.024 7 0 "[ . 1 . 2]" 1
249 1 13 VAL MG1 1 45 LEU MD1 . . 5.200 2.621 2.324 3.929 . 0 0 "[ . 1 . 2]" 1
250 1 13 VAL MG1 1 45 LEU MD2 . . 5.200 3.141 3.101 3.354 . 0 0 "[ . 1 . 2]" 1
251 1 13 VAL MG2 1 14 SER H . . 4.890 3.893 2.152 4.039 . 0 0 "[ . 1 . 2]" 1
252 1 13 VAL MG2 1 16 CYS HB2 . . 5.500 4.092 3.898 4.807 . 0 0 "[ . 1 . 2]" 1
253 1 13 VAL MG2 1 16 CYS HB3 . . 5.500 4.707 4.466 5.503 0.003 13 0 "[ . 1 . 2]" 1
254 1 13 VAL MG2 1 44 ASN HA . . 5.500 3.334 2.844 3.804 . 0 0 "[ . 1 . 2]" 1
255 1 13 VAL MG2 1 44 ASN HB2 . . 5.500 4.702 4.220 5.579 0.079 13 0 "[ . 1 . 2]" 1
256 1 13 VAL MG2 1 44 ASN HB3 . . 5.500 4.657 4.335 5.578 0.078 13 0 "[ . 1 . 2]" 1
257 1 13 VAL MG2 1 45 LEU MD1 . . 5.200 4.218 4.063 4.847 . 0 0 "[ . 1 . 2]" 1
258 1 13 VAL MG2 1 45 LEU MD2 . . 5.200 3.615 3.401 5.151 . 0 0 "[ . 1 . 2]" 1
259 1 14 SER H 1 14 SER QB . . 2.930 2.331 2.053 2.895 . 0 0 "[ . 1 . 2]" 1
260 1 14 SER H 1 15 LYS H . . 4.030 2.715 2.595 2.856 . 0 0 "[ . 1 . 2]" 1
261 1 14 SER H 1 16 CYS H . . 4.730 3.892 3.691 4.322 . 0 0 "[ . 1 . 2]" 1
262 1 14 SER HA 1 17 GLN HB2 . . 4.940 3.902 3.361 4.068 . 0 0 "[ . 1 . 2]" 1
263 1 14 SER HA 1 17 GLN HB3 . . 5.500 5.410 4.818 5.539 0.039 3 0 "[ . 1 . 2]" 1
264 1 14 SER HA 1 17 GLN QG . . 5.000 3.180 2.732 4.556 . 0 0 "[ . 1 . 2]" 1
265 1 14 SER QB 1 15 LYS H . . 4.110 2.646 2.319 3.280 . 0 0 "[ . 1 . 2]" 1
266 1 15 LYS H 1 15 LYS HB2 . . 3.500 2.315 2.169 2.479 . 0 0 "[ . 1 . 2]" 1
267 1 15 LYS H 1 15 LYS QB . . 2.990 2.286 2.148 2.438 . 0 0 "[ . 1 . 2]" 1
268 1 15 LYS H 1 15 LYS HB3 . . 3.500 3.552 3.472 3.604 0.104 9 0 "[ . 1 . 2]" 1
269 1 15 LYS H 1 15 LYS QD . . 5.340 4.071 3.775 4.506 . 0 0 "[ . 1 . 2]" 1
270 1 15 LYS H 1 15 LYS HG2 . . 3.800 3.487 2.266 3.821 0.021 10 0 "[ . 1 . 2]" 1
271 1 15 LYS H 1 15 LYS QG . . 3.270 2.605 2.247 3.041 . 0 0 "[ . 1 . 2]" 1
272 1 15 LYS H 1 15 LYS HG3 . . 3.800 2.885 2.345 3.732 . 0 0 "[ . 1 . 2]" 1
273 1 15 LYS H 1 16 CYS H . . 3.210 2.500 2.358 2.582 . 0 0 "[ . 1 . 2]" 1
274 1 15 LYS HA 1 15 LYS QB . . 2.610 2.434 2.364 2.495 . 0 0 "[ . 1 . 2]" 1
275 1 15 LYS HA 1 15 LYS HE2 . . 5.500 4.475 2.443 5.269 . 0 0 "[ . 1 . 2]" 1
276 1 15 LYS HA 1 15 LYS HE3 . . 5.500 4.995 3.647 5.504 0.004 5 0 "[ . 1 . 2]" 1
277 1 15 LYS HA 1 15 LYS QG . . 2.970 2.384 2.106 2.981 0.011 18 0 "[ . 1 . 2]" 1
278 1 15 LYS HA 1 17 GLN H . . 3.860 3.722 3.668 3.860 0.000 17 0 "[ . 1 . 2]" 1
279 1 15 LYS HA 1 18 LEU H . . 3.800 3.836 3.803 3.870 0.070 15 0 "[ . 1 . 2]" 1
280 1 15 LYS HA 1 18 LEU QB . . 4.130 4.219 4.205 4.243 0.113 15 0 "[ . 1 . 2]" 1
281 1 15 LYS HA 1 18 LEU MD1 . . 5.500 3.772 3.393 3.960 . 0 0 "[ . 1 . 2]" 1
282 1 15 LYS HA 1 18 LEU QD . . 4.350 3.692 3.350 3.844 . 0 0 "[ . 1 . 2]" 1
283 1 15 LYS HA 1 18 LEU MD2 . . 5.500 5.268 5.067 5.502 0.002 19 0 "[ . 1 . 2]" 1
284 1 15 LYS HA 1 18 LEU HG . . 5.500 3.872 3.650 4.137 . 0 0 "[ . 1 . 2]" 1
285 1 15 LYS HA 1 21 GLN HB2 . . 5.500 4.534 4.133 4.811 . 0 0 "[ . 1 . 2]" 1
286 1 15 LYS HA 1 21 GLN HB3 . . 5.500 4.475 3.946 4.791 . 0 0 "[ . 1 . 2]" 1
287 1 15 LYS HA 1 21 GLN HG2 . . 5.500 5.454 5.335 5.524 0.024 19 0 "[ . 1 . 2]" 1
288 1 15 LYS HA 1 21 GLN HG3 . . 5.500 3.748 3.604 3.912 . 0 0 "[ . 1 . 2]" 1
289 1 15 LYS QB 1 15 LYS QE . . 3.630 3.364 2.802 3.540 . 0 0 "[ . 1 . 2]" 1
290 1 15 LYS QB 1 16 CYS H . . 3.550 2.837 2.606 3.020 . 0 0 "[ . 1 . 2]" 1
291 1 15 LYS HB2 1 15 LYS HE2 . . 4.660 4.454 3.862 4.655 . 0 0 "[ . 1 . 2]" 1
292 1 15 LYS HB2 1 15 LYS HE3 . . 4.660 4.248 2.978 4.639 . 0 0 "[ . 1 . 2]" 1
293 1 15 LYS HB3 1 15 LYS HE2 . . 4.660 4.142 3.912 4.658 . 0 0 "[ . 1 . 2]" 1
294 1 15 LYS HB3 1 15 LYS HE3 . . 4.660 4.424 3.761 4.663 0.003 11 0 "[ . 1 . 2]" 1
295 1 15 LYS QE 1 15 LYS QG . . 3.200 2.090 2.010 2.142 . 0 0 "[ . 1 . 2]" 1
296 1 15 LYS QG 1 16 CYS H . . 4.470 4.293 4.077 4.432 . 0 0 "[ . 1 . 2]" 1
297 1 15 LYS QG 1 21 GLN QB . . 4.410 4.234 3.651 4.423 0.013 10 0 "[ . 1 . 2]" 1
298 1 15 LYS QG 1 21 GLN QG . . 4.760 3.915 3.507 4.766 0.006 18 0 "[ . 1 . 2]" 1
299 1 15 LYS HG2 1 16 CYS H . . 5.170 4.974 4.304 5.221 0.051 2 0 "[ . 1 . 2]" 1
300 1 15 LYS HG3 1 16 CYS H . . 5.170 4.749 4.345 5.161 . 0 0 "[ . 1 . 2]" 1
301 1 16 CYS H 1 16 CYS HB2 . . 3.580 2.078 2.066 2.101 . 0 0 "[ . 1 . 2]" 1
302 1 16 CYS H 1 16 CYS HB3 . . 3.580 3.170 3.106 3.223 . 0 0 "[ . 1 . 2]" 1
303 1 16 CYS H 1 17 GLN H . . 3.510 2.671 2.600 2.723 . 0 0 "[ . 1 . 2]" 1
304 1 16 CYS HA 1 18 LEU H . . 3.680 3.578 3.548 3.654 . 0 0 "[ . 1 . 2]" 1
305 1 16 CYS QB 1 17 GLN H . . 3.270 2.976 2.893 3.012 . 0 0 "[ . 1 . 2]" 1
306 1 16 CYS QB 1 45 LEU QB . . 3.980 3.214 3.090 3.340 . 0 0 "[ . 1 . 2]" 1
307 1 16 CYS QB 1 45 LEU QD . . 3.230 1.944 1.903 2.064 . 0 0 "[ . 1 . 2]" 1
308 1 16 CYS HB2 1 17 GLN H . . 3.750 3.557 3.492 3.604 . 0 0 "[ . 1 . 2]" 1
309 1 16 CYS HB2 1 45 LEU MD1 . . 4.210 4.285 4.233 4.311 0.101 17 0 "[ . 1 . 2]" 1
310 1 16 CYS HB2 1 45 LEU MD2 . . 4.210 3.046 2.936 3.145 . 0 0 "[ . 1 . 2]" 1
311 1 16 CYS HB3 1 17 GLN H . . 3.750 3.194 3.069 3.236 . 0 0 "[ . 1 . 2]" 1
312 1 16 CYS HB3 1 45 LEU MD1 . . 4.210 3.038 2.940 3.181 . 0 0 "[ . 1 . 2]" 1
313 1 16 CYS HB3 1 45 LEU MD2 . . 4.210 1.996 1.948 2.138 . 0 0 "[ . 1 . 2]" 1
314 1 17 GLN H 1 17 GLN HB2 . . 3.220 2.216 2.075 2.255 . 0 0 "[ . 1 . 2]" 1
315 1 17 GLN H 1 17 GLN HB3 . . 3.420 3.507 3.342 3.533 0.113 16 0 "[ . 1 . 2]" 1
316 1 17 GLN H 1 17 GLN QG . . 3.320 2.809 2.710 3.277 . 0 0 "[ . 1 . 2]" 1
317 1 17 GLN H 1 18 LEU H . . 4.070 2.716 2.695 2.763 . 0 0 "[ . 1 . 2]" 1
318 1 17 GLN H 1 18 LEU HG . . 4.310 4.356 4.344 4.388 0.078 15 0 "[ . 1 . 2]" 1
319 1 17 GLN HA 1 17 GLN HB3 . . 2.900 2.674 2.639 2.833 . 0 0 "[ . 1 . 2]" 1
320 1 17 GLN HA 1 17 GLN QG . . 3.000 2.130 2.100 2.215 . 0 0 "[ . 1 . 2]" 1
321 1 17 GLN HA 1 18 LEU H . . 3.460 3.452 3.441 3.473 0.013 2 0 "[ . 1 . 2]" 1
322 1 17 GLN HB2 1 18 LEU H . . 4.620 3.170 3.131 3.352 . 0 0 "[ . 1 . 2]" 1
323 1 17 GLN HB3 1 17 GLN QE . . 3.820 3.200 2.476 3.752 . 0 0 "[ . 1 . 2]" 1
324 1 17 GLN HB3 1 17 GLN QG . . 2.600 2.465 2.302 2.496 . 0 0 "[ . 1 . 2]" 1
325 1 17 GLN HB3 1 18 LEU H . . 4.520 3.640 3.281 3.730 . 0 0 "[ . 1 . 2]" 1
326 1 17 GLN HB3 1 18 LEU MD1 . . 5.090 4.931 4.667 5.098 0.008 7 0 "[ . 1 . 2]" 1
327 1 17 GLN HB3 1 18 LEU QD . . 3.950 3.049 3.014 3.214 . 0 0 "[ . 1 . 2]" 1
328 1 17 GLN HB3 1 18 LEU MD2 . . 5.090 3.080 3.036 3.275 . 0 0 "[ . 1 . 2]" 1
329 1 17 GLN QG 1 18 LEU H . . 4.410 4.467 4.441 4.535 0.125 2 0 "[ . 1 . 2]" 1
330 1 17 GLN QG 1 18 LEU QD . . 4.660 4.661 4.519 4.678 0.018 7 0 "[ . 1 . 2]" 1
331 1 18 LEU H 1 18 LEU MD1 . . 4.680 3.882 3.696 3.953 . 0 0 "[ . 1 . 2]" 1
332 1 18 LEU H 1 18 LEU QD . . 4.080 3.259 3.184 3.305 . 0 0 "[ . 1 . 2]" 1
333 1 18 LEU H 1 18 LEU MD2 . . 4.680 3.504 3.383 3.581 . 0 0 "[ . 1 . 2]" 1
334 1 18 LEU H 1 18 LEU HG . . 4.410 2.612 2.463 2.656 . 0 0 "[ . 1 . 2]" 1
335 1 18 LEU H 1 19 ALA H . . 5.500 4.335 4.199 4.452 . 0 0 "[ . 1 . 2]" 1
336 1 18 LEU H 1 21 GLN HB2 . . 5.380 3.475 3.429 3.607 . 0 0 "[ . 1 . 2]" 1
337 1 18 LEU H 1 21 GLN QB . . 4.660 3.384 3.343 3.517 . 0 0 "[ . 1 . 2]" 1
338 1 18 LEU H 1 21 GLN HB3 . . 5.380 4.659 4.514 4.872 . 0 0 "[ . 1 . 2]" 1
339 1 18 LEU HA 1 18 LEU MD1 . . 3.910 3.884 3.850 3.926 0.016 17 0 "[ . 1 . 2]" 1
340 1 18 LEU HA 1 18 LEU QD . . 3.400 2.195 2.121 2.315 . 0 0 "[ . 1 . 2]" 1
341 1 18 LEU HA 1 18 LEU MD2 . . 3.910 2.207 2.130 2.331 . 0 0 "[ . 1 . 2]" 1
342 1 18 LEU HA 1 18 LEU HG . . 3.980 3.239 3.174 3.271 . 0 0 "[ . 1 . 2]" 1
343 1 18 LEU HA 1 19 ALA H . . 2.910 2.146 2.139 2.156 . 0 0 "[ . 1 . 2]" 1
344 1 18 LEU QB 1 18 LEU QD . . 2.800 1.910 1.897 1.935 . 0 0 "[ . 1 . 2]" 1
345 1 18 LEU QB 1 19 ALA H . . 3.380 3.317 3.128 3.472 0.092 19 0 "[ . 1 . 2]" 1
346 1 18 LEU QB 1 21 GLN H . . 3.340 2.707 2.665 2.745 . 0 0 "[ . 1 . 2]" 1
347 1 18 LEU HB2 1 18 LEU MD1 . . 3.630 2.353 2.285 2.411 . 0 0 "[ . 1 . 2]" 1
348 1 18 LEU HB2 1 18 LEU MD2 . . 3.630 3.184 3.180 3.191 . 0 0 "[ . 1 . 2]" 1
349 1 18 LEU HB2 1 21 GLN H . . 4.010 2.962 2.892 3.042 . 0 0 "[ . 1 . 2]" 1
350 1 18 LEU HB3 1 18 LEU MD1 . . 3.630 2.302 2.232 2.379 . 0 0 "[ . 1 . 2]" 1
351 1 18 LEU HB3 1 18 LEU MD2 . . 3.630 2.291 2.245 2.343 . 0 0 "[ . 1 . 2]" 1
352 1 18 LEU HB3 1 21 GLN H . . 4.010 3.139 3.058 3.227 . 0 0 "[ . 1 . 2]" 1
353 1 18 LEU QD 1 19 ALA H . . 4.740 3.695 3.527 3.910 . 0 0 "[ . 1 . 2]" 1
354 1 18 LEU QD 1 21 GLN H . . 5.410 4.025 3.960 4.083 . 0 0 "[ . 1 . 2]" 1
355 1 18 LEU QD 1 21 GLN QB . . 3.870 3.419 3.287 3.527 . 0 0 "[ . 1 . 2]" 1
356 1 18 LEU QD 1 21 GLN QG . . 3.150 2.291 2.122 2.459 . 0 0 "[ . 1 . 2]" 1
357 1 18 LEU MD1 1 19 ALA H . . 5.410 5.210 5.003 5.386 . 0 0 "[ . 1 . 2]" 1
358 1 18 LEU MD2 1 19 ALA H . . 5.410 3.780 3.603 4.015 . 0 0 "[ . 1 . 2]" 1
359 1 18 LEU HG 1 19 ALA H . . 5.420 5.251 5.205 5.283 . 0 0 "[ . 1 . 2]" 1
360 1 19 ALA H 1 20 ASN H . . 3.990 2.685 2.641 2.759 . 0 0 "[ . 1 . 2]" 1
361 1 19 ALA HA 1 21 GLN H . . 3.620 3.776 3.753 3.799 0.179 13 0 "[ . 1 . 2]" 1
362 1 19 ALA HA 1 22 CYS QB . . 3.940 3.182 2.880 3.342 . 0 0 "[ . 1 . 2]" 1
363 1 19 ALA MB 1 20 ASN H . . 3.090 2.631 2.396 2.803 . 0 0 "[ . 1 . 2]" 1
364 1 19 ALA MB 1 20 ASN HB2 . . 4.990 5.049 4.834 5.217 0.227 15 0 "[ . 1 . 2]" 1
365 1 19 ALA MB 1 20 ASN HB3 . . 4.990 4.881 4.121 5.161 0.171 1 0 "[ . 1 . 2]" 1
366 1 19 ALA MB 1 20 ASN HD21 . . 4.410 3.857 3.380 4.318 . 0 0 "[ . 1 . 2]" 1
367 1 19 ALA MB 1 20 ASN QD . . 3.770 3.450 3.233 3.726 . 0 0 "[ . 1 . 2]" 1
368 1 19 ALA MB 1 20 ASN HD22 . . 4.410 4.008 3.631 4.429 0.019 15 0 "[ . 1 . 2]" 1
369 1 19 ALA MB 1 21 GLN H . . 4.460 4.249 4.139 4.340 . 0 0 "[ . 1 . 2]" 1
370 1 20 ASN H 1 20 ASN HB2 . . 3.700 2.997 2.785 3.575 . 0 0 "[ . 1 . 2]" 1
371 1 20 ASN H 1 20 ASN QB . . 3.100 2.691 2.642 2.711 . 0 0 "[ . 1 . 2]" 1
372 1 20 ASN H 1 20 ASN HB3 . . 3.700 3.351 2.721 3.564 . 0 0 "[ . 1 . 2]" 1
373 1 20 ASN H 1 21 GLN H . . 4.240 2.617 2.535 2.706 . 0 0 "[ . 1 . 2]" 1
374 1 20 ASN H 1 22 CYS H . . 5.330 4.702 4.496 4.892 . 0 0 "[ . 1 . 2]" 1
375 1 20 ASN HA 1 20 ASN QD . . 4.590 3.126 2.322 3.872 . 0 0 "[ . 1 . 2]" 1
376 1 20 ASN HA 1 20 ASN HD22 . . 5.280 4.357 3.835 4.965 . 0 0 "[ . 1 . 2]" 1
377 1 20 ASN HA 1 21 GLN H . . 3.420 3.430 3.426 3.434 0.014 7 0 "[ . 1 . 2]" 1
378 1 20 ASN HA 1 23 ASN H . . 4.410 3.990 3.844 4.414 0.004 19 0 "[ . 1 . 2]" 1
379 1 20 ASN HA 1 23 ASN HB2 . . 4.560 3.972 3.700 4.538 . 0 0 "[ . 1 . 2]" 1
380 1 20 ASN HA 1 23 ASN QB . . 3.910 3.049 2.884 3.409 . 0 0 "[ . 1 . 2]" 1
381 1 20 ASN HA 1 23 ASN HB3 . . 4.560 3.169 3.004 3.527 . 0 0 "[ . 1 . 2]" 1
382 1 20 ASN HA 1 24 TYR H . . 4.410 3.676 3.587 3.792 . 0 0 "[ . 1 . 2]" 1
383 1 20 ASN QB 1 20 ASN QD . . 2.950 2.284 2.169 2.459 . 0 0 "[ . 1 . 2]" 1
384 1 20 ASN QB 1 21 GLN H . . 3.600 3.188 3.025 3.601 0.001 20 0 "[ . 1 . 2]" 1
385 1 20 ASN HB2 1 21 GLN H . . 4.300 3.317 3.103 3.884 . 0 0 "[ . 1 . 2]" 1
386 1 20 ASN HB3 1 21 GLN H . . 4.300 4.236 4.191 4.263 . 0 0 "[ . 1 . 2]" 1
387 1 21 GLN H 1 21 GLN HB2 . . 3.660 2.172 2.147 2.218 . 0 0 "[ . 1 . 2]" 1
388 1 21 GLN H 1 21 GLN QB . . 3.180 2.151 2.127 2.195 . 0 0 "[ . 1 . 2]" 1
389 1 21 GLN H 1 21 GLN HB3 . . 3.660 3.464 3.448 3.497 . 0 0 "[ . 1 . 2]" 1
390 1 21 GLN H 1 21 GLN HG2 . . 3.730 3.292 3.238 3.369 . 0 0 "[ . 1 . 2]" 1
391 1 21 GLN H 1 21 GLN QG . . 3.240 3.103 3.066 3.169 . 0 0 "[ . 1 . 2]" 1
392 1 21 GLN H 1 21 GLN HG3 . . 3.730 3.798 3.772 3.856 0.126 19 0 "[ . 1 . 2]" 1
393 1 21 GLN H 1 22 CYS H . . 3.130 2.627 2.446 2.749 . 0 0 "[ . 1 . 2]" 1
394 1 21 GLN HA 1 21 GLN HB2 . . 3.010 2.964 2.956 2.977 . 0 0 "[ . 1 . 2]" 1
395 1 21 GLN HA 1 21 GLN QB . . 2.550 2.499 2.486 2.505 . 0 0 "[ . 1 . 2]" 1
396 1 21 GLN HA 1 21 GLN HB3 . . 3.010 2.691 2.664 2.705 . 0 0 "[ . 1 . 2]" 1
397 1 21 GLN HA 1 21 GLN QE . . 3.710 1.928 1.923 1.939 . 0 0 "[ . 1 . 2]" 1
398 1 21 GLN HA 1 21 GLN HG2 . . 3.550 2.309 2.296 2.339 . 0 0 "[ . 1 . 2]" 1
399 1 21 GLN HA 1 21 GLN QG . . 3.040 2.283 2.270 2.310 . 0 0 "[ . 1 . 2]" 1
400 1 21 GLN HA 1 21 GLN HG3 . . 3.550 3.577 3.569 3.592 0.042 17 0 "[ . 1 . 2]" 1
401 1 21 GLN HA 1 24 TYR H . . 3.910 3.764 3.674 3.923 0.013 19 0 "[ . 1 . 2]" 1
402 1 21 GLN HA 1 24 TYR HB2 . . 5.500 3.879 3.785 4.048 . 0 0 "[ . 1 . 2]" 1
403 1 21 GLN HA 1 24 TYR HB3 . . 5.500 2.795 2.703 2.880 . 0 0 "[ . 1 . 2]" 1
404 1 21 GLN HA 1 25 ASP H . . 3.650 3.680 3.594 3.782 0.132 19 0 "[ . 1 . 2]" 1
405 1 21 GLN QB 1 21 GLN QE . . 3.880 2.724 2.611 2.870 . 0 0 "[ . 1 . 2]" 1
406 1 21 GLN QB 1 21 GLN QG . . 2.240 2.018 2.017 2.018 . 0 0 "[ . 1 . 2]" 1
407 1 21 GLN QB 1 22 CYS H . . 2.810 2.370 2.317 2.466 . 0 0 "[ . 1 . 2]" 1
408 1 21 GLN HB2 1 22 CYS H . . 3.440 2.546 2.502 2.606 . 0 0 "[ . 1 . 2]" 1
409 1 21 GLN HB3 1 22 CYS H . . 3.440 2.826 2.703 3.051 . 0 0 "[ . 1 . 2]" 1
410 1 21 GLN QE 1 21 GLN QG . . 2.410 2.410 2.347 2.459 0.049 19 0 "[ . 1 . 2]" 1
411 1 21 GLN QE 1 25 ASP QB . . 3.390 3.411 3.405 3.436 0.046 19 0 "[ . 1 . 2]" 1
412 1 21 GLN HE21 1 24 TYR QD . . 3.870 3.268 3.171 3.330 . 0 0 "[ . 1 . 2]" 1
413 1 21 GLN HE22 1 21 GLN HG2 . . 4.010 3.598 3.563 3.626 . 0 0 "[ . 1 . 2]" 1
414 1 21 GLN HE22 1 21 GLN HG3 . . 4.010 4.098 4.094 4.100 0.090 18 0 "[ . 1 . 2]" 1
415 1 21 GLN HE22 1 24 TYR QD . . 3.870 3.903 3.893 3.922 0.052 19 0 "[ . 1 . 2]" 1
416 1 21 GLN QG 1 22 CYS H . . 4.860 4.194 4.166 4.235 . 0 0 "[ . 1 . 2]" 1
417 1 22 CYS H 1 22 CYS QB . . 2.790 2.134 2.122 2.187 . 0 0 "[ . 1 . 2]" 1
418 1 22 CYS H 1 23 ASN H . . 3.520 2.863 2.816 2.992 . 0 0 "[ . 1 . 2]" 1
419 1 22 CYS HA 1 22 CYS QB . . 2.430 2.474 2.435 2.482 0.052 2 0 "[ . 1 . 2]" 1
420 1 22 CYS HA 1 23 ASN H . . 3.400 3.550 3.543 3.569 0.169 19 0 "[ . 1 . 2]" 1
421 1 22 CYS HA 1 25 ASP HB2 . . 4.770 3.512 3.350 3.687 . 0 0 "[ . 1 . 2]" 1
422 1 22 CYS HA 1 25 ASP QB . . 4.190 3.082 3.001 3.116 . 0 0 "[ . 1 . 2]" 1
423 1 22 CYS HA 1 25 ASP HB3 . . 4.770 3.421 3.207 3.503 . 0 0 "[ . 1 . 2]" 1
424 1 22 CYS HA 1 26 CYS H . . 3.840 3.699 3.584 3.969 0.129 19 0 "[ . 1 . 2]" 1
425 1 22 CYS QB 1 23 ASN H . . 2.900 2.455 2.200 2.520 . 0 0 "[ . 1 . 2]" 1
426 1 22 CYS QB 1 23 ASN QB . . 3.730 3.724 3.635 3.754 0.024 6 0 "[ . 1 . 2]" 1
427 1 22 CYS HB2 1 23 ASN H . . 3.350 3.535 3.483 3.577 0.227 10 0 "[ . 1 . 2]" 1
428 1 22 CYS HB2 1 36 GLU HA . . 5.500 4.469 3.589 5.547 0.047 19 0 "[ . 1 . 2]" 1
429 1 22 CYS HB3 1 23 ASN H . . 3.350 2.505 2.223 2.578 . 0 0 "[ . 1 . 2]" 1
430 1 22 CYS HB3 1 36 GLU HA . . 5.500 3.252 2.347 4.127 . 0 0 "[ . 1 . 2]" 1
431 1 23 ASN H 1 23 ASN HB2 . . 3.310 2.370 2.307 2.438 . 0 0 "[ . 1 . 2]" 1
432 1 23 ASN H 1 23 ASN HB3 . . 3.310 2.712 2.636 2.787 . 0 0 "[ . 1 . 2]" 1
433 1 23 ASN H 1 24 TYR H . . 3.890 2.791 2.736 2.927 . 0 0 "[ . 1 . 2]" 1
434 1 23 ASN H 1 25 ASP H . . 4.020 4.153 4.122 4.228 0.208 19 0 "[ . 1 . 2]" 1
435 1 23 ASN H 1 35 GLY QA . . 4.880 4.425 4.286 4.650 . 0 0 "[ . 1 . 2]" 1
436 1 23 ASN HA 1 23 ASN QB . . 2.640 2.425 2.388 2.451 . 0 0 "[ . 1 . 2]" 1
437 1 23 ASN HA 1 26 CYS H . . 3.780 3.624 3.404 3.707 . 0 0 "[ . 1 . 2]" 1
438 1 23 ASN HA 1 26 CYS HB2 . . 4.060 3.801 2.712 3.958 . 0 0 "[ . 1 . 2]" 1
439 1 23 ASN HA 1 26 CYS QB . . 3.250 2.526 2.397 2.583 . 0 0 "[ . 1 . 2]" 1
440 1 23 ASN HA 1 26 CYS HB3 . . 4.060 2.592 2.432 3.248 . 0 0 "[ . 1 . 2]" 1
441 1 23 ASN HA 1 27 LYS H . . 4.430 3.742 3.676 3.939 . 0 0 "[ . 1 . 2]" 1
442 1 23 ASN HA 1 35 GLY H . . 3.920 3.066 2.890 3.209 . 0 0 "[ . 1 . 2]" 1
443 1 23 ASN HA 1 35 GLY QA . . 4.720 2.495 2.207 2.650 . 0 0 "[ . 1 . 2]" 1
444 1 23 ASN QB 1 23 ASN HD21 . . 2.940 2.199 2.169 2.327 . 0 0 "[ . 1 . 2]" 1
445 1 23 ASN QB 1 23 ASN HD22 . . 3.520 3.286 3.275 3.331 . 0 0 "[ . 1 . 2]" 1
446 1 23 ASN QB 1 35 GLY H . . 3.320 3.378 3.362 3.414 0.094 19 0 "[ . 1 . 2]" 1
447 1 23 ASN HB2 1 23 ASN HD22 . . 4.040 4.043 4.031 4.081 0.041 12 0 "[ . 1 . 2]" 1
448 1 23 ASN HB2 1 24 TYR H . . 3.480 3.555 3.530 3.621 0.141 19 0 "[ . 1 . 2]" 1
449 1 23 ASN HB3 1 23 ASN HD22 . . 4.040 3.477 3.465 3.531 . 0 0 "[ . 1 . 2]" 1
450 1 23 ASN HB3 1 24 TYR H . . 3.480 2.231 2.136 2.318 . 0 0 "[ . 1 . 2]" 1
451 1 23 ASN HD21 1 24 TYR H . . 3.760 3.318 2.945 3.581 . 0 0 "[ . 1 . 2]" 1
452 1 23 ASN HD21 1 34 SER HA . . 4.590 4.383 4.100 4.594 0.004 15 0 "[ . 1 . 2]" 1
453 1 23 ASN HD21 1 34 SER QB . . 5.340 5.076 4.823 5.346 0.006 15 0 "[ . 1 . 2]" 1
454 1 23 ASN HD22 1 34 SER HA . . 4.520 3.117 2.768 3.439 . 0 0 "[ . 1 . 2]" 1
455 1 23 ASN HD22 1 34 SER QB . . 5.070 3.798 3.489 4.170 . 0 0 "[ . 1 . 2]" 1
456 1 24 TYR H 1 24 TYR HB2 . . 3.900 2.469 2.418 2.520 . 0 0 "[ . 1 . 2]" 1
457 1 24 TYR H 1 24 TYR QB . . 3.320 2.251 2.244 2.257 . 0 0 "[ . 1 . 2]" 1
458 1 24 TYR H 1 24 TYR HB3 . . 3.900 2.595 2.547 2.660 . 0 0 "[ . 1 . 2]" 1
459 1 24 TYR H 1 24 TYR QD . . 4.070 4.177 4.159 4.191 0.121 19 0 "[ . 1 . 2]" 1
460 1 24 TYR H 1 25 ASP H . . 3.370 2.851 2.805 2.884 . 0 0 "[ . 1 . 2]" 1
461 1 24 TYR H 1 26 CYS H . . 5.500 4.367 4.169 4.468 . 0 0 "[ . 1 . 2]" 1
462 1 24 TYR HA 1 24 TYR QD . . 3.120 2.417 2.370 2.570 . 0 0 "[ . 1 . 2]" 1
463 1 24 TYR HA 1 25 ASP H . . 3.530 3.551 3.543 3.554 0.024 7 0 "[ . 1 . 2]" 1
464 1 24 TYR HA 1 27 LYS H . . 4.050 3.817 3.570 3.860 . 0 0 "[ . 1 . 2]" 1
465 1 24 TYR HA 1 27 LYS HB2 . . 4.280 4.169 3.865 4.221 . 0 0 "[ . 1 . 2]" 1
466 1 24 TYR HA 1 27 LYS HB3 . . 4.280 3.237 3.051 3.319 . 0 0 "[ . 1 . 2]" 1
467 1 24 TYR HA 1 28 LEU H . . 4.670 4.769 4.727 4.793 0.123 9 0 "[ . 1 . 2]" 1
468 1 24 TYR QB 1 25 ASP H . . 3.350 2.447 2.430 2.496 . 0 0 "[ . 1 . 2]" 1
469 1 24 TYR QB 1 25 ASP QB . . 3.630 3.780 3.768 3.822 0.192 19 0 "[ . 1 . 2]" 1
470 1 24 TYR HB2 1 25 ASP H . . 3.920 3.808 3.791 3.862 . 0 0 "[ . 1 . 2]" 1
471 1 24 TYR HB3 1 25 ASP H . . 3.920 2.477 2.459 2.531 . 0 0 "[ . 1 . 2]" 1
472 1 24 TYR QD 1 25 ASP H . . 3.670 3.684 3.676 3.698 0.028 17 0 "[ . 1 . 2]" 1
473 1 24 TYR QD 1 28 LEU MD1 . . 5.120 4.727 4.488 4.992 . 0 0 "[ . 1 . 2]" 1
474 1 24 TYR QD 1 28 LEU MD2 . . 5.120 3.813 3.557 4.224 . 0 0 "[ . 1 . 2]" 1
475 1 24 TYR QE 1 28 LEU MD1 . . 4.310 3.885 3.621 4.229 . 0 0 "[ . 1 . 2]" 1
476 1 24 TYR QE 1 28 LEU QD . . 3.660 3.064 2.895 3.211 . 0 0 "[ . 1 . 2]" 1
477 1 24 TYR QE 1 28 LEU MD2 . . 4.310 3.226 2.951 3.483 . 0 0 "[ . 1 . 2]" 1
478 1 25 ASP H 1 25 ASP HB2 . . 3.940 2.159 2.129 2.274 . 0 0 "[ . 1 . 2]" 1
479 1 25 ASP H 1 25 ASP QB . . 3.400 2.113 2.092 2.187 . 0 0 "[ . 1 . 2]" 1
480 1 25 ASP H 1 25 ASP HB3 . . 3.940 3.013 2.837 3.070 . 0 0 "[ . 1 . 2]" 1
481 1 25 ASP H 1 26 CYS H . . 3.450 2.696 2.598 2.744 . 0 0 "[ . 1 . 2]" 1
482 1 25 ASP HA 1 28 LEU H . . 5.400 3.438 3.420 3.501 . 0 0 "[ . 1 . 2]" 1
483 1 25 ASP HA 1 28 LEU QB . . 3.090 2.220 2.174 2.467 . 0 0 "[ . 1 . 2]" 1
484 1 25 ASP HA 1 28 LEU QD . . 5.440 2.772 2.572 3.023 . 0 0 "[ . 1 . 2]" 1
485 1 25 ASP HA 1 29 ASP H . . 5.420 3.698 3.428 3.730 . 0 0 "[ . 1 . 2]" 1
486 1 25 ASP QB 1 26 CYS H . . 2.930 2.426 2.318 2.674 . 0 0 "[ . 1 . 2]" 1
487 1 25 ASP HB2 1 26 CYS H . . 3.420 3.338 3.260 3.486 0.066 17 0 "[ . 1 . 2]" 1
488 1 25 ASP HB3 1 26 CYS H . . 3.420 2.494 2.353 2.782 . 0 0 "[ . 1 . 2]" 1
489 1 26 CYS H 1 26 CYS HA . . 2.940 2.780 2.772 2.835 . 0 0 "[ . 1 . 2]" 1
490 1 26 CYS H 1 26 CYS HB2 . . 3.670 2.615 2.096 2.685 . 0 0 "[ . 1 . 2]" 1
491 1 26 CYS H 1 26 CYS QB . . 2.940 2.230 2.067 2.242 . 0 0 "[ . 1 . 2]" 1
492 1 26 CYS H 1 26 CYS HB3 . . 3.670 2.455 2.381 3.145 . 0 0 "[ . 1 . 2]" 1
493 1 26 CYS H 1 27 LYS H . . 3.600 2.784 2.571 2.817 . 0 0 "[ . 1 . 2]" 1
494 1 26 CYS H 1 28 LEU H . . 4.740 3.834 3.767 3.851 . 0 0 "[ . 1 . 2]" 1
495 1 26 CYS HA 1 26 CYS QB . . 2.390 2.314 2.299 2.534 0.144 19 0 "[ . 1 . 2]" 1
496 1 26 CYS HA 1 29 ASP H . . 3.880 3.767 3.743 3.902 0.022 19 0 "[ . 1 . 2]" 1
497 1 26 CYS HA 1 29 ASP QB . . 3.880 3.800 3.535 3.846 . 0 0 "[ . 1 . 2]" 1
498 1 26 CYS HA 1 30 LYS H . . 3.350 3.046 2.990 3.084 . 0 0 "[ . 1 . 2]" 1
499 1 26 CYS HA 1 30 LYS HB2 . . 4.810 3.228 3.187 3.257 . 0 0 "[ . 1 . 2]" 1
500 1 26 CYS HA 1 30 LYS HB3 . . 4.690 4.741 4.718 4.774 0.084 1 0 "[ . 1 . 2]" 1
501 1 26 CYS HA 1 30 LYS HG2 . . 3.920 3.733 3.659 3.771 . 0 0 "[ . 1 . 2]" 1
502 1 26 CYS HA 1 32 ALA MB . . 4.350 4.428 4.400 4.446 0.096 6 0 "[ . 1 . 2]" 1
503 1 26 CYS HA 1 49 CYS HB2 . . 5.500 5.652 5.609 5.675 0.175 7 0 "[ . 1 . 2]" 1
504 1 26 CYS HA 1 49 CYS HB3 . . 5.500 5.342 5.308 5.633 0.133 19 0 "[ . 1 . 2]" 1
505 1 26 CYS QB 1 27 LYS H . . 3.680 2.566 2.527 2.789 . 0 0 "[ . 1 . 2]" 1
506 1 26 CYS QB 1 32 ALA MB . . 4.040 3.798 3.123 3.863 . 0 0 "[ . 1 . 2]" 1
507 1 26 CYS QB 1 35 GLY H . . 4.240 4.254 4.048 4.297 0.057 14 0 "[ . 1 . 2]" 1
508 1 26 CYS QB 1 35 GLY QA . . 2.850 2.345 2.217 2.408 . 0 0 "[ . 1 . 2]" 1
509 1 26 CYS QB 1 49 CYS HA . . 3.220 3.331 3.260 3.364 0.144 18 0 "[ . 1 . 2]" 1
510 1 26 CYS HB2 1 27 LYS H . . 4.240 3.911 3.390 3.954 . 0 0 "[ . 1 . 2]" 1
511 1 26 CYS HB2 1 32 ALA MB . . 4.700 4.511 4.485 4.677 . 0 0 "[ . 1 . 2]" 1
512 1 26 CYS HB2 1 35 GLY HA2 . . 4.200 4.206 4.152 4.231 0.031 9 0 "[ . 1 . 2]" 1
513 1 26 CYS HB2 1 35 GLY HA3 . . 4.200 2.960 2.572 3.024 . 0 0 "[ . 1 . 2]" 1
514 1 26 CYS HB2 1 49 CYS HA . . 3.940 3.562 3.518 4.043 0.103 19 0 "[ . 1 . 2]" 1
515 1 26 CYS HB3 1 27 LYS H . . 4.240 2.606 2.558 2.967 . 0 0 "[ . 1 . 2]" 1
516 1 26 CYS HB3 1 32 ALA MB . . 4.700 4.104 3.172 4.194 . 0 0 "[ . 1 . 2]" 1
517 1 26 CYS HB3 1 35 GLY HA2 . . 4.200 4.008 3.753 4.094 . 0 0 "[ . 1 . 2]" 1
518 1 26 CYS HB3 1 35 GLY HA3 . . 4.200 2.502 2.339 2.586 . 0 0 "[ . 1 . 2]" 1
519 1 26 CYS HB3 1 49 CYS HA . . 3.940 4.051 3.439 4.123 0.183 12 0 "[ . 1 . 2]" 1
520 1 27 LYS H 1 27 LYS HB2 . . 3.310 2.441 2.416 2.503 . 0 0 "[ . 1 . 2]" 1
521 1 27 LYS H 1 27 LYS QB . . 2.880 2.265 2.255 2.288 . 0 0 "[ . 1 . 2]" 1
522 1 27 LYS H 1 27 LYS HB3 . . 3.310 2.684 2.646 2.700 . 0 0 "[ . 1 . 2]" 1
523 1 27 LYS H 1 27 LYS HG2 . . 4.390 4.427 4.384 4.446 0.056 19 0 "[ . 1 . 2]" 1
524 1 27 LYS H 1 27 LYS HG3 . . 4.390 4.480 4.457 4.522 0.132 20 0 "[ . 1 . 2]" 1
525 1 27 LYS H 1 28 LEU H . . 3.800 2.538 2.476 2.547 . 0 0 "[ . 1 . 2]" 1
526 1 27 LYS H 1 29 ASP H . . 4.500 4.554 4.527 4.564 0.064 13 0 "[ . 1 . 2]" 1
527 1 27 LYS HA 1 27 LYS HG2 . . 3.340 2.387 2.246 2.477 . 0 0 "[ . 1 . 2]" 1
528 1 27 LYS HA 1 27 LYS QG . . 2.880 2.304 2.212 2.359 . 0 0 "[ . 1 . 2]" 1
529 1 27 LYS HA 1 27 LYS HG3 . . 3.340 3.050 2.967 3.320 . 0 0 "[ . 1 . 2]" 1
530 1 27 LYS HA 1 32 ALA MB . . 3.510 3.566 3.321 3.597 0.087 2 0 "[ . 1 . 2]" 1
531 1 27 LYS QB 1 27 LYS QE . . 3.290 2.385 1.936 2.953 . 0 0 "[ . 1 . 2]" 1
532 1 27 LYS QB 1 27 LYS QG . . 2.360 2.039 2.023 2.047 . 0 0 "[ . 1 . 2]" 1
533 1 27 LYS QB 1 28 LEU H . . 3.610 3.362 3.339 3.376 . 0 0 "[ . 1 . 2]" 1
534 1 27 LYS HB2 1 28 LEU H . . 4.170 4.219 4.199 4.228 0.058 18 0 "[ . 1 . 2]" 1
535 1 27 LYS HB3 1 28 LEU H . . 4.170 3.531 3.499 3.550 . 0 0 "[ . 1 . 2]" 1
536 1 27 LYS QE 1 27 LYS QG . . 3.340 2.242 1.968 2.588 . 0 0 "[ . 1 . 2]" 1
537 1 27 LYS QE 1 28 LEU H . . 4.840 4.442 4.034 4.927 0.087 13 0 "[ . 1 . 2]" 1
538 1 27 LYS QG 1 28 LEU H . . 4.750 4.473 4.413 4.585 . 0 0 "[ . 1 . 2]" 1
539 1 27 LYS HG2 1 28 LEU H . . 5.500 4.702 4.633 4.837 . 0 0 "[ . 1 . 2]" 1
540 1 27 LYS HG3 1 28 LEU H . . 5.500 5.604 5.549 5.688 0.188 13 0 "[ . 1 . 2]" 1
541 1 28 LEU H 1 28 LEU HB2 . . 3.710 2.912 2.867 3.007 . 0 0 "[ . 1 . 2]" 1
542 1 28 LEU H 1 28 LEU HB3 . . 3.710 2.442 2.416 2.482 . 0 0 "[ . 1 . 2]" 1
543 1 28 LEU H 1 28 LEU MD1 . . 4.450 4.307 4.226 4.418 . 0 0 "[ . 1 . 2]" 1
544 1 28 LEU H 1 28 LEU QD . . 3.890 3.826 3.794 3.866 . 0 0 "[ . 1 . 2]" 1
545 1 28 LEU H 1 28 LEU MD2 . . 4.450 4.284 4.204 4.357 . 0 0 "[ . 1 . 2]" 1
546 1 28 LEU H 1 28 LEU HG . . 5.060 4.385 4.356 4.426 . 0 0 "[ . 1 . 2]" 1
547 1 28 LEU H 1 29 ASP H . . 3.400 2.312 2.290 2.348 . 0 0 "[ . 1 . 2]" 1
548 1 28 LEU H 1 30 LYS H . . 4.580 3.542 3.440 3.568 . 0 0 "[ . 1 . 2]" 1
549 1 28 LEU HA 1 28 LEU QD . . 2.920 2.253 2.024 2.467 . 0 0 "[ . 1 . 2]" 1
550 1 28 LEU HA 1 29 ASP H . . 3.510 3.563 3.561 3.569 0.059 19 0 "[ . 1 . 2]" 1
551 1 28 LEU QB 1 29 ASP H . . 3.180 2.332 2.212 2.351 . 0 0 "[ . 1 . 2]" 1
552 1 28 LEU HB2 1 29 ASP H . . 3.750 3.777 3.705 3.796 0.046 18 0 "[ . 1 . 2]" 1
553 1 28 LEU HB3 1 29 ASP H . . 3.750 2.354 2.229 2.374 . 0 0 "[ . 1 . 2]" 1
554 1 28 LEU QD 1 29 ASP H . . 4.010 3.607 3.325 3.720 . 0 0 "[ . 1 . 2]" 1
555 1 28 LEU MD1 1 29 ASP H . . 4.700 4.404 4.237 4.530 . 0 0 "[ . 1 . 2]" 1
556 1 28 LEU MD2 1 29 ASP H . . 4.700 3.844 3.442 4.103 . 0 0 "[ . 1 . 2]" 1
557 1 28 LEU HG 1 29 ASP H . . 3.580 3.443 3.297 3.582 0.002 12 0 "[ . 1 . 2]" 1
558 1 29 ASP H 1 29 ASP HB2 . . 3.650 2.169 2.149 2.196 . 0 0 "[ . 1 . 2]" 1
559 1 29 ASP H 1 29 ASP HB3 . . 3.650 3.426 3.356 3.492 . 0 0 "[ . 1 . 2]" 1
560 1 29 ASP H 1 30 LYS H . . 3.160 2.446 2.428 2.664 . 0 0 "[ . 1 . 2]" 1
561 1 29 ASP H 1 31 HIS H . . 4.740 3.356 3.335 3.536 . 0 0 "[ . 1 . 2]" 1
562 1 29 ASP HA 1 29 ASP QB . . 2.590 2.514 2.491 2.531 . 0 0 "[ . 1 . 2]" 1
563 1 29 ASP HA 1 31 HIS H . . 4.760 4.214 4.142 4.262 . 0 0 "[ . 1 . 2]" 1
564 1 29 ASP QB 1 30 LYS H . . 3.020 2.567 2.534 2.585 . 0 0 "[ . 1 . 2]" 1
565 1 29 ASP QB 1 30 LYS QE . . 5.180 3.615 3.439 5.213 0.033 1 0 "[ . 1 . 2]" 1
566 1 29 ASP QB 1 30 LYS HG2 . . 4.290 2.812 2.756 2.870 . 0 0 "[ . 1 . 2]" 1
567 1 29 ASP HB2 1 30 LYS H . . 3.780 2.787 2.681 2.894 . 0 0 "[ . 1 . 2]" 1
568 1 29 ASP HB2 1 30 LYS HG2 . . 4.910 3.586 3.442 3.738 . 0 0 "[ . 1 . 2]" 1
569 1 29 ASP HB2 1 30 LYS HG3 . . 4.420 4.275 4.152 4.426 0.006 1 0 "[ . 1 . 2]" 1
570 1 29 ASP HB3 1 30 LYS H . . 3.780 3.015 2.910 3.123 . 0 0 "[ . 1 . 2]" 1
571 1 29 ASP HB3 1 30 LYS HG2 . . 4.910 2.943 2.840 3.052 . 0 0 "[ . 1 . 2]" 1
572 1 29 ASP HB3 1 30 LYS HG3 . . 4.420 4.279 4.124 4.423 0.003 1 0 "[ . 1 . 2]" 1
573 1 30 LYS H 1 30 LYS HB2 . . 3.310 2.624 2.588 2.653 . 0 0 "[ . 1 . 2]" 1
574 1 30 LYS H 1 30 LYS HB3 . . 3.590 3.642 3.638 3.656 0.066 19 0 "[ . 1 . 2]" 1
575 1 30 LYS H 1 30 LYS QD . . 4.530 4.225 4.083 4.273 . 0 0 "[ . 1 . 2]" 1
576 1 30 LYS H 1 30 LYS HE2 . . 5.500 4.537 4.404 5.510 0.010 1 0 "[ . 1 . 2]" 1
577 1 30 LYS H 1 30 LYS QE . . 4.630 4.315 4.232 4.730 0.100 1 0 "[ . 1 . 2]" 1
578 1 30 LYS H 1 30 LYS HE3 . . 5.500 5.460 5.150 5.505 0.005 8 0 "[ . 1 . 2]" 1
579 1 30 LYS H 1 30 LYS HG2 . . 3.700 2.459 2.358 2.508 . 0 0 "[ . 1 . 2]" 1
580 1 30 LYS H 1 30 LYS HG3 . . 4.160 2.896 2.818 3.052 . 0 0 "[ . 1 . 2]" 1
581 1 30 LYS H 1 31 HIS H . . 3.100 2.314 2.265 2.331 . 0 0 "[ . 1 . 2]" 1
582 1 30 LYS H 1 32 ALA H . . 4.050 3.937 3.810 3.967 . 0 0 "[ . 1 . 2]" 1
583 1 30 LYS HA 1 30 LYS QD . . 3.170 3.151 2.905 3.198 0.028 13 0 "[ . 1 . 2]" 1
584 1 30 LYS HA 1 30 LYS QE . . 4.320 4.038 3.761 4.361 0.041 1 0 "[ . 1 . 2]" 1
585 1 30 LYS HA 1 30 LYS HG2 . . 2.790 2.645 2.632 2.707 . 0 0 "[ . 1 . 2]" 1
586 1 30 LYS HB2 1 30 LYS QD . . 3.540 3.031 2.979 3.330 . 0 0 "[ . 1 . 2]" 1
587 1 30 LYS HB2 1 30 LYS QE . . 4.810 4.188 3.016 4.262 . 0 0 "[ . 1 . 2]" 1
588 1 30 LYS HB2 1 31 HIS H . . 4.050 3.193 3.146 3.260 . 0 0 "[ . 1 . 2]" 1
589 1 30 LYS HB2 1 32 ALA H . . 4.090 2.608 2.555 2.671 . 0 0 "[ . 1 . 2]" 1
590 1 30 LYS HB2 1 32 ALA MB . . 3.910 2.511 2.463 2.676 . 0 0 "[ . 1 . 2]" 1
591 1 30 LYS HB3 1 30 LYS QD . . 3.500 2.055 1.994 2.170 . 0 0 "[ . 1 . 2]" 1
592 1 30 LYS HB3 1 31 HIS H . . 4.240 4.198 4.171 4.227 . 0 0 "[ . 1 . 2]" 1
593 1 30 LYS HB3 1 32 ALA H . . 3.710 3.684 3.554 3.723 0.013 15 0 "[ . 1 . 2]" 1
594 1 30 LYS HB3 1 32 ALA MB . . 4.110 3.099 3.037 3.155 . 0 0 "[ . 1 . 2]" 1
595 1 30 LYS QD 1 31 HIS H . . 5.340 5.415 5.392 5.431 0.091 4 0 "[ . 1 . 2]" 1
596 1 30 LYS QE 1 30 LYS HG2 . . 3.290 2.130 2.003 3.250 . 0 0 "[ . 1 . 2]" 1
597 1 30 LYS QE 1 30 LYS HG3 . . 3.440 2.688 2.274 2.800 . 0 0 "[ . 1 . 2]" 1
598 1 30 LYS HE2 1 30 LYS HG2 . . 3.920 2.175 2.027 3.624 . 0 0 "[ . 1 . 2]" 1
599 1 30 LYS HE2 1 30 LYS HG3 . . 4.100 2.971 2.522 3.092 . 0 0 "[ . 1 . 2]" 1
600 1 30 LYS HE3 1 30 LYS HG2 . . 3.920 3.209 3.112 3.673 . 0 0 "[ . 1 . 2]" 1
601 1 30 LYS HE3 1 30 LYS HG3 . . 4.100 3.071 2.585 3.225 . 0 0 "[ . 1 . 2]" 1
602 1 30 LYS HG2 1 31 HIS H . . 4.960 4.412 4.345 4.430 . 0 0 "[ . 1 . 2]" 1
603 1 30 LYS HG3 1 31 HIS H . . 4.760 4.668 4.605 4.772 0.012 1 0 "[ . 1 . 2]" 1
604 1 31 HIS H 1 31 HIS HA . . 2.700 2.276 2.274 2.278 . 0 0 "[ . 1 . 2]" 1
605 1 31 HIS H 1 31 HIS HB2 . . 4.190 3.135 2.994 3.628 . 0 0 "[ . 1 . 2]" 1
606 1 31 HIS H 1 31 HIS QB . . 3.540 3.008 2.873 3.372 . 0 0 "[ . 1 . 2]" 1
607 1 31 HIS H 1 31 HIS HB3 . . 4.190 3.907 3.679 4.039 . 0 0 "[ . 1 . 2]" 1
608 1 31 HIS H 1 32 ALA H . . 3.870 2.696 2.633 2.746 . 0 0 "[ . 1 . 2]" 1
609 1 31 HIS HA 1 32 ALA H . . 3.090 2.954 2.925 2.986 . 0 0 "[ . 1 . 2]" 1
610 1 32 ALA H 1 32 ALA MB . . 3.130 2.102 2.066 2.256 . 0 0 "[ . 1 . 2]" 1
611 1 32 ALA H 1 33 ARG H . . 5.500 4.619 4.614 4.625 . 0 0 "[ . 1 . 2]" 1
612 1 32 ALA HA 1 33 ARG H . . 2.780 2.313 2.270 2.323 . 0 0 "[ . 1 . 2]" 1
613 1 32 ALA HA 1 51 TYR QD . . 3.040 3.003 2.806 3.091 0.051 12 0 "[ . 1 . 2]" 1
614 1 32 ALA MB 1 33 ARG H . . 3.750 2.714 2.701 2.752 . 0 0 "[ . 1 . 2]" 1
615 1 32 ALA MB 1 34 SER H . . 3.220 2.657 2.555 2.860 . 0 0 "[ . 1 . 2]" 1
616 1 32 ALA MB 1 49 CYS HA . . 3.900 3.880 3.650 3.932 0.032 12 0 "[ . 1 . 2]" 1
617 1 32 ALA MB 1 49 CYS HB2 . . 3.590 3.667 3.479 3.711 0.121 17 0 "[ . 1 . 2]" 1
618 1 32 ALA MB 1 49 CYS HB3 . . 3.590 2.395 2.273 2.426 . 0 0 "[ . 1 . 2]" 1
619 1 32 ALA MB 1 50 ASP H . . 3.310 2.325 2.260 2.371 . 0 0 "[ . 1 . 2]" 1
620 1 32 ALA MB 1 50 ASP HA . . 5.180 4.167 4.065 4.241 . 0 0 "[ . 1 . 2]" 1
621 1 32 ALA MB 1 51 TYR H . . 5.500 4.338 4.119 4.476 . 0 0 "[ . 1 . 2]" 1
622 1 32 ALA MB 1 51 TYR HA . . 3.620 3.331 3.130 3.459 . 0 0 "[ . 1 . 2]" 1
623 1 32 ALA MB 1 51 TYR QD . . 3.930 3.087 3.018 3.222 . 0 0 "[ . 1 . 2]" 1
624 1 32 ALA MB 1 51 TYR QE . . 3.850 2.777 2.721 2.935 . 0 0 "[ . 1 . 2]" 1
625 1 33 ARG H 1 33 ARG HB2 . . 2.900 2.329 2.261 2.382 . 0 0 "[ . 1 . 2]" 1
626 1 33 ARG H 1 33 ARG HB3 . . 3.800 3.561 3.536 3.575 . 0 0 "[ . 1 . 2]" 1
627 1 33 ARG H 1 33 ARG QD . . 4.320 3.410 2.361 4.500 0.180 14 0 "[ . 1 . 2]" 1
628 1 33 ARG H 1 33 ARG HG2 . . 4.070 3.721 3.219 4.113 0.043 17 0 "[ . 1 . 2]" 1
629 1 33 ARG H 1 33 ARG HG3 . . 4.070 2.869 2.540 3.183 . 0 0 "[ . 1 . 2]" 1
630 1 33 ARG H 1 34 SER H . . 3.440 2.856 2.793 2.960 . 0 0 "[ . 1 . 2]" 1
631 1 33 ARG H 1 51 TYR HA . . 3.560 2.457 2.101 2.647 . 0 0 "[ . 1 . 2]" 1
632 1 33 ARG HA 1 33 ARG HB3 . . 2.750 2.610 2.577 2.660 . 0 0 "[ . 1 . 2]" 1
633 1 33 ARG HA 1 33 ARG HD2 . . 4.180 4.033 3.644 4.409 0.229 14 0 "[ . 1 . 2]" 1
634 1 33 ARG HA 1 33 ARG HD3 . . 4.180 4.198 3.950 4.304 0.124 15 0 "[ . 1 . 2]" 1
635 1 33 ARG HA 1 33 ARG HG2 . . 3.180 2.756 2.134 3.347 0.167 20 0 "[ . 1 . 2]" 1
636 1 33 ARG HA 1 33 ARG QG . . 2.690 2.178 2.112 2.237 . 0 0 "[ . 1 . 2]" 1
637 1 33 ARG HA 1 33 ARG HG3 . . 3.180 2.699 2.172 3.369 0.189 14 0 "[ . 1 . 2]" 1
638 1 33 ARG HA 1 34 SER H . . 3.450 3.541 3.490 3.566 0.116 14 0 "[ . 1 . 2]" 1
639 1 33 ARG HB2 1 33 ARG HD2 . . 3.950 2.834 2.637 3.936 . 0 0 "[ . 1 . 2]" 1
640 1 33 ARG HB2 1 33 ARG QD . . 3.470 2.348 2.006 2.924 . 0 0 "[ . 1 . 2]" 1
641 1 33 ARG HB2 1 33 ARG HD3 . . 3.950 2.888 2.048 3.803 . 0 0 "[ . 1 . 2]" 1
642 1 33 ARG HB2 1 34 SER H . . 3.580 2.691 2.578 2.962 . 0 0 "[ . 1 . 2]" 1
643 1 33 ARG HB2 1 51 TYR HA . . 4.220 2.563 2.194 2.630 . 0 0 "[ . 1 . 2]" 1
644 1 33 ARG HB3 1 33 ARG HD2 . . 3.800 3.106 2.159 3.907 0.107 19 0 "[ . 1 . 2]" 1
645 1 33 ARG HB3 1 33 ARG QD . . 3.290 2.604 2.106 3.115 . 0 0 "[ . 1 . 2]" 1
646 1 33 ARG HB3 1 33 ARG HD3 . . 3.800 3.050 2.319 3.282 . 0 0 "[ . 1 . 2]" 1
647 1 33 ARG HB3 1 34 SER H . . 3.860 3.360 3.035 3.606 . 0 0 "[ . 1 . 2]" 1
648 1 33 ARG HB3 1 51 TYR HA . . 4.340 4.296 3.941 4.367 0.027 17 0 "[ . 1 . 2]" 1
649 1 33 ARG QD 1 34 SER H . . 4.880 4.577 4.220 4.931 0.051 14 0 "[ . 1 . 2]" 1
650 1 33 ARG QD 1 52 CYS HA . . 4.160 3.113 2.243 3.602 . 0 0 "[ . 1 . 2]" 1
651 1 33 ARG HD2 1 52 CYS H . . 5.500 4.383 3.698 5.520 0.020 14 0 "[ . 1 . 2]" 1
652 1 33 ARG HD2 1 52 CYS HA . . 4.850 3.982 2.262 4.885 0.035 10 0 "[ . 1 . 2]" 1
653 1 33 ARG HD3 1 52 CYS H . . 5.500 4.272 2.961 5.542 0.042 13 0 "[ . 1 . 2]" 1
654 1 33 ARG HD3 1 52 CYS HA . . 4.850 3.754 3.169 4.602 . 0 0 "[ . 1 . 2]" 1
655 1 33 ARG QG 1 51 TYR HA . . 3.930 3.415 2.667 4.013 0.083 17 0 "[ . 1 . 2]" 1
656 1 33 ARG HG2 1 34 SER H . . 5.500 5.053 4.783 5.371 . 0 0 "[ . 1 . 2]" 1
657 1 33 ARG HG2 1 51 TYR HA . . 4.480 4.488 4.250 4.574 0.094 17 0 "[ . 1 . 2]" 1
658 1 33 ARG HG3 1 34 SER H . . 5.500 4.718 4.548 4.864 . 0 0 "[ . 1 . 2]" 1
659 1 33 ARG HG3 1 51 TYR HA . . 4.480 3.628 2.695 4.443 . 0 0 "[ . 1 . 2]" 1
660 1 34 SER H 1 34 SER QB . . 3.410 3.268 3.202 3.322 . 0 0 "[ . 1 . 2]" 1
661 1 34 SER H 1 35 GLY H . . 4.530 4.368 4.339 4.378 . 0 0 "[ . 1 . 2]" 1
662 1 34 SER H 1 50 ASP H . . 3.120 3.219 2.984 3.254 0.134 14 0 "[ . 1 . 2]" 1
663 1 34 SER H 1 50 ASP HB2 . . 4.010 3.495 2.360 4.033 0.023 9 0 "[ . 1 . 2]" 1
664 1 34 SER H 1 50 ASP QB . . 3.220 2.489 2.317 2.829 . 0 0 "[ . 1 . 2]" 1
665 1 34 SER H 1 50 ASP HB3 . . 4.010 2.882 2.391 4.010 . 0 0 "[ . 1 . 2]" 1
666 1 34 SER HA 1 34 SER HB2 . . 2.890 2.842 2.794 2.890 . 11 0 "[ . 1 . 2]" 1
667 1 34 SER HA 1 34 SER QB . . 2.520 2.162 2.157 2.170 . 0 0 "[ . 1 . 2]" 1
668 1 34 SER HA 1 34 SER HB3 . . 2.890 2.241 2.238 2.245 . 0 0 "[ . 1 . 2]" 1
669 1 34 SER HA 1 35 GLY H . . 2.810 2.634 2.581 2.707 . 0 0 "[ . 1 . 2]" 1
670 1 34 SER QB 1 35 GLY H . . 2.600 2.165 2.094 2.248 . 0 0 "[ . 1 . 2]" 1
671 1 34 SER HB2 1 35 GLY H . . 3.160 2.255 2.187 2.405 . 0 0 "[ . 1 . 2]" 1
672 1 34 SER HB3 1 35 GLY H . . 3.160 2.824 2.660 2.966 . 0 0 "[ . 1 . 2]" 1
673 1 35 GLY H 1 36 GLU H . . 4.810 4.084 3.838 4.208 . 0 0 "[ . 1 . 2]" 1
674 1 35 GLY QA 1 50 ASP H . . 3.160 3.000 2.923 3.084 . 0 0 "[ . 1 . 2]" 1
675 1 35 GLY HA2 1 49 CYS HA . . 3.510 2.129 1.982 2.243 . 0 0 "[ . 1 . 2]" 1
676 1 35 GLY HA2 1 50 ASP H . . 3.880 3.099 3.004 3.212 . 0 0 "[ . 1 . 2]" 1
677 1 35 GLY HA3 1 49 CYS HA . . 3.510 2.836 2.604 3.005 . 0 0 "[ . 1 . 2]" 1
678 1 35 GLY HA3 1 50 ASP H . . 3.880 4.012 3.981 4.046 0.166 18 0 "[ . 1 . 2]" 1
679 1 36 GLU H 1 36 GLU HB2 . . 3.700 2.625 2.302 3.789 0.089 4 0 "[ . 1 . 2]" 1
680 1 36 GLU H 1 36 GLU QB . . 3.220 2.493 2.273 2.874 . 0 0 "[ . 1 . 2]" 1
681 1 36 GLU H 1 36 GLU HB3 . . 3.700 3.535 2.948 3.677 . 0 0 "[ . 1 . 2]" 1
682 1 36 GLU H 1 36 GLU QG . . 3.870 3.736 2.195 3.907 0.037 10 0 "[ . 1 . 2]" 1
683 1 36 GLU H 1 37 CYS H . . 5.410 4.458 4.428 4.508 . 0 0 "[ . 1 . 2]" 1
684 1 36 GLU H 1 48 ILE H . . 4.840 3.969 3.787 4.383 . 0 0 "[ . 1 . 2]" 1
685 1 36 GLU H 1 48 ILE HB . . 4.800 3.898 3.783 4.202 . 0 0 "[ . 1 . 2]" 1
686 1 36 GLU H 1 49 CYS HA . . 3.740 3.301 3.190 3.519 . 0 0 "[ . 1 . 2]" 1
687 1 36 GLU HA 1 36 GLU QG . . 3.530 2.257 2.099 3.443 . 0 0 "[ . 1 . 2]" 1
688 1 36 GLU HA 1 37 CYS H . . 2.540 2.496 2.469 2.521 . 0 0 "[ . 1 . 2]" 1
689 1 36 GLU QB 1 37 CYS H . . 3.240 2.273 2.227 2.509 . 0 0 "[ . 1 . 2]" 1
690 1 36 GLU QB 1 38 PHE QE . . 4.220 3.121 2.874 4.161 . 0 0 "[ . 1 . 2]" 1
691 1 36 GLU HB2 1 37 CYS H . . 3.760 3.585 2.262 3.854 0.094 17 0 "[ . 1 . 2]" 1
692 1 36 GLU HB2 1 38 PHE QE . . 4.920 3.466 3.129 4.527 . 0 0 "[ . 1 . 2]" 1
693 1 36 GLU HB3 1 37 CYS H . . 3.760 2.438 2.245 3.749 . 0 0 "[ . 1 . 2]" 1
694 1 36 GLU HB3 1 38 PHE QE . . 4.920 3.575 3.340 4.854 . 0 0 "[ . 1 . 2]" 1
695 1 36 GLU QG 1 37 CYS H . . 3.280 3.254 3.126 3.298 0.018 17 0 "[ . 1 . 2]" 1
696 1 36 GLU QG 1 38 PHE QE . . 4.600 4.360 2.094 4.642 0.042 10 0 "[ . 1 . 2]" 1
697 1 36 GLU HG2 1 37 CYS H . . 3.950 3.818 3.275 3.959 0.009 4 0 "[ . 1 . 2]" 1
698 1 36 GLU HG3 1 37 CYS H . . 3.950 3.565 3.274 4.021 0.071 8 0 "[ . 1 . 2]" 1
699 1 37 CYS H 1 37 CYS HB2 . . 3.660 2.418 2.383 2.437 . 0 0 "[ . 1 . 2]" 1
700 1 37 CYS H 1 37 CYS HB3 . . 3.660 3.637 3.603 3.654 . 0 0 "[ . 1 . 2]" 1
701 1 37 CYS HA 1 37 CYS QB . . 2.600 2.442 2.427 2.464 . 0 0 "[ . 1 . 2]" 1
702 1 37 CYS HA 1 45 LEU MD1 . . 5.500 5.490 5.301 5.543 0.043 12 0 "[ . 1 . 2]" 1
703 1 37 CYS HA 1 45 LEU MD2 . . 5.500 3.391 3.205 3.429 . 0 0 "[ . 1 . 2]" 1
704 1 37 CYS HA 1 46 GLN H . . 5.500 5.021 4.921 5.100 . 0 0 "[ . 1 . 2]" 1
705 1 37 CYS HA 1 47 CYS HA . . 4.930 2.068 1.991 2.228 . 0 0 "[ . 1 . 2]" 1
706 1 37 CYS HA 1 48 ILE H . . 3.490 2.637 2.558 2.826 . 0 0 "[ . 1 . 2]" 1
707 1 37 CYS HA 1 48 ILE HB . . 5.500 4.688 4.396 4.935 . 0 0 "[ . 1 . 2]" 1
708 1 37 CYS QB 1 38 PHE H . . 3.200 2.962 2.911 3.140 . 0 0 "[ . 1 . 2]" 1
709 1 37 CYS QB 1 45 LEU QB . . 4.760 4.574 4.527 4.594 . 0 0 "[ . 1 . 2]" 1
710 1 37 CYS QB 1 45 LEU QD . . 2.900 1.854 1.832 1.880 . 0 0 "[ . 1 . 2]" 1
711 1 37 CYS QB 1 46 GLN H . . 5.340 4.307 4.246 4.455 . 0 0 "[ . 1 . 2]" 1
712 1 37 CYS HB2 1 45 LEU MD1 . . 4.140 4.219 4.201 4.249 0.109 13 0 "[ . 1 . 2]" 1
713 1 37 CYS HB2 1 45 LEU MD2 . . 4.140 3.259 3.246 3.325 . 0 0 "[ . 1 . 2]" 1
714 1 37 CYS HB2 1 47 CYS HA . . 5.500 4.730 4.528 4.939 . 0 0 "[ . 1 . 2]" 1
715 1 37 CYS HB3 1 45 LEU MD1 . . 4.140 3.340 3.224 3.392 . 0 0 "[ . 1 . 2]" 1
716 1 37 CYS HB3 1 45 LEU MD2 . . 4.140 1.877 1.853 1.907 . 0 0 "[ . 1 . 2]" 1
717 1 37 CYS HB3 1 47 CYS HA . . 5.500 3.887 3.800 4.147 . 0 0 "[ . 1 . 2]" 1
718 1 38 PHE H 1 38 PHE HB2 . . 3.900 2.396 2.323 2.565 . 0 0 "[ . 1 . 2]" 1
719 1 38 PHE H 1 38 PHE QB . . 3.260 2.362 2.290 2.523 . 0 0 "[ . 1 . 2]" 1
720 1 38 PHE H 1 38 PHE HB3 . . 3.900 3.577 3.467 3.736 . 0 0 "[ . 1 . 2]" 1
721 1 38 PHE H 1 38 PHE QD . . 3.970 3.010 2.855 3.713 . 0 0 "[ . 1 . 2]" 1
722 1 38 PHE H 1 39 TYR H . . 5.500 4.512 4.474 4.530 . 0 0 "[ . 1 . 2]" 1
723 1 38 PHE H 1 45 LEU MD1 . . 5.500 5.019 4.921 5.064 . 0 0 "[ . 1 . 2]" 1
724 1 38 PHE H 1 45 LEU QD . . 3.970 2.694 2.634 2.727 . 0 0 "[ . 1 . 2]" 1
725 1 38 PHE H 1 45 LEU MD2 . . 5.500 2.704 2.644 2.738 . 0 0 "[ . 1 . 2]" 1
726 1 38 PHE H 1 46 GLN H . . 3.210 3.348 3.318 3.403 0.193 10 0 "[ . 1 . 2]" 1
727 1 38 PHE H 1 47 CYS HA . . 5.500 2.937 2.866 3.114 . 0 0 "[ . 1 . 2]" 1
728 1 38 PHE H 1 48 ILE H . . 4.870 3.447 2.916 3.715 . 0 0 "[ . 1 . 2]" 1
729 1 38 PHE HA 1 39 TYR H . . 2.800 2.377 2.346 2.474 . 0 0 "[ . 1 . 2]" 1
730 1 38 PHE QB 1 39 TYR H . . 3.470 2.531 2.248 2.682 . 0 0 "[ . 1 . 2]" 1
731 1 38 PHE QB 1 48 ILE MD . . 3.480 2.719 2.497 3.291 . 0 0 "[ . 1 . 2]" 1
732 1 38 PHE HB2 1 39 TYR H . . 4.070 3.910 3.556 4.037 . 0 0 "[ . 1 . 2]" 1
733 1 38 PHE HB2 1 48 ILE MD . . 4.170 2.830 2.589 3.433 . 0 0 "[ . 1 . 2]" 1
734 1 38 PHE HB3 1 39 TYR H . . 4.070 2.563 2.272 2.722 . 0 0 "[ . 1 . 2]" 1
735 1 38 PHE HB3 1 48 ILE MD . . 4.170 3.521 3.272 4.286 0.116 10 0 "[ . 1 . 2]" 1
736 1 38 PHE QD 1 39 TYR H . . 4.690 3.759 3.545 3.840 . 0 0 "[ . 1 . 2]" 1
737 1 38 PHE QD 1 48 ILE H . . 4.790 3.606 3.407 4.321 . 0 0 "[ . 1 . 2]" 1
738 1 38 PHE QD 1 48 ILE HB . . 3.610 3.271 3.022 3.433 . 0 0 "[ . 1 . 2]" 1
739 1 38 PHE QD 1 48 ILE MD . . 3.690 2.822 1.894 3.702 0.012 17 0 "[ . 1 . 2]" 1
740 1 38 PHE QD 1 48 ILE QG . . 4.570 2.898 2.599 3.039 . 0 0 "[ . 1 . 2]" 1
741 1 38 PHE QD 1 48 ILE MG . . 4.530 4.346 3.966 4.530 0.000 12 0 "[ . 1 . 2]" 1
742 1 38 PHE QE 1 48 ILE HB . . 4.070 3.343 2.956 3.839 . 0 0 "[ . 1 . 2]" 1
743 1 38 PHE QE 1 48 ILE MG . . 4.560 3.966 3.288 4.164 . 0 0 "[ . 1 . 2]" 1
744 1 39 TYR H 1 39 TYR HB2 . . 3.400 2.284 2.259 2.288 . 0 0 "[ . 1 . 2]" 1
745 1 39 TYR H 1 39 TYR HB3 . . 3.400 3.310 3.277 3.328 . 0 0 "[ . 1 . 2]" 1
746 1 39 TYR H 1 39 TYR QD . . 4.000 4.017 3.982 4.040 0.040 13 0 "[ . 1 . 2]" 1
747 1 39 TYR H 1 40 LYS H . . 3.880 4.010 4.007 4.019 0.139 10 0 "[ . 1 . 2]" 1
748 1 39 TYR HA 1 40 LYS H . . 2.780 2.234 2.232 2.236 . 0 0 "[ . 1 . 2]" 1
749 1 39 TYR HB2 1 40 LYS H . . 4.480 4.656 4.654 4.659 0.179 13 0 "[ . 1 . 2]" 1
750 1 39 TYR HB3 1 40 LYS H . . 4.480 4.100 4.091 4.114 . 0 0 "[ . 1 . 2]" 1
751 1 39 TYR QD 1 40 LYS H . . 4.260 3.418 3.386 3.435 . 0 0 "[ . 1 . 2]" 1
752 1 39 TYR QD 1 44 ASN H . . 5.500 5.562 5.545 5.596 0.096 13 0 "[ . 1 . 2]" 1
753 1 39 TYR QD 1 45 LEU QB . . 4.550 3.921 3.898 3.967 . 0 0 "[ . 1 . 2]" 1
754 1 39 TYR QD 1 45 LEU MD1 . . 4.680 3.331 3.228 3.452 . 0 0 "[ . 1 . 2]" 1
755 1 39 TYR QD 1 45 LEU QD . . 4.100 3.256 3.163 3.363 . 0 0 "[ . 1 . 2]" 1
756 1 39 TYR QD 1 45 LEU MD2 . . 4.680 4.587 4.503 4.685 0.005 10 0 "[ . 1 . 2]" 1
757 1 39 TYR QD 1 45 LEU HG . . 5.500 3.292 3.193 3.351 . 0 0 "[ . 1 . 2]" 1
758 1 39 TYR QE 1 45 LEU HB2 . . 5.210 3.636 3.619 3.676 . 0 0 "[ . 1 . 2]" 1
759 1 39 TYR QE 1 45 LEU QB . . 4.360 3.574 3.560 3.610 . 0 0 "[ . 1 . 2]" 1
760 1 39 TYR QE 1 45 LEU HB3 . . 5.210 5.259 5.251 5.277 0.067 10 0 "[ . 1 . 2]" 1
761 1 39 TYR QE 1 45 LEU MD1 . . 5.190 2.794 2.591 2.929 . 0 0 "[ . 1 . 2]" 1
762 1 39 TYR QE 1 45 LEU QD . . 4.230 2.779 2.581 2.911 . 0 0 "[ . 1 . 2]" 1
763 1 39 TYR QE 1 45 LEU MD2 . . 5.190 4.933 4.842 5.072 . 0 0 "[ . 1 . 2]" 1
764 1 39 TYR QE 1 45 LEU HG . . 5.360 4.018 3.895 4.113 . 0 0 "[ . 1 . 2]" 1
765 1 40 LYS H 1 40 LYS HB2 . . 3.490 2.243 2.198 2.277 . 0 0 "[ . 1 . 2]" 1
766 1 40 LYS H 1 40 LYS QB . . 2.860 2.201 2.167 2.233 . 0 0 "[ . 1 . 2]" 1
767 1 40 LYS H 1 40 LYS HB3 . . 3.490 3.207 3.113 3.482 . 0 0 "[ . 1 . 2]" 1
768 1 40 LYS H 1 40 LYS QG . . 3.780 3.733 3.512 3.799 0.019 13 0 "[ . 1 . 2]" 1
769 1 40 LYS H 1 41 GLU H . . 4.510 4.526 4.512 4.530 0.020 8 0 "[ . 1 . 2]" 1
770 1 40 LYS HA 1 40 LYS QD . . 4.550 3.304 3.009 3.978 . 0 0 "[ . 1 . 2]" 1
771 1 40 LYS HA 1 41 GLU H . . 3.220 2.525 2.520 2.536 . 0 0 "[ . 1 . 2]" 1
772 1 40 LYS QB 1 41 GLU H . . 3.750 2.507 2.195 2.610 . 0 0 "[ . 1 . 2]" 1
773 1 40 LYS QG 1 41 GLU H . . 4.630 2.909 2.322 3.326 . 0 0 "[ . 1 . 2]" 1
774 1 41 GLU H 1 41 GLU QB . . 3.250 3.152 2.847 3.352 0.102 17 0 "[ . 1 . 2]" 1
775 1 41 GLU H 1 41 GLU HG2 . . 4.710 3.328 2.641 4.420 . 0 0 "[ . 1 . 2]" 1
776 1 41 GLU H 1 41 GLU QG . . 3.970 3.086 2.531 3.757 . 0 0 "[ . 1 . 2]" 1
777 1 41 GLU H 1 41 GLU HG3 . . 4.710 4.074 3.203 4.297 . 0 0 "[ . 1 . 2]" 1
778 1 41 GLU H 1 42 LYS H . . 4.660 4.643 4.637 4.645 . 0 0 "[ . 1 . 2]" 1
779 1 41 GLU HA 1 41 GLU QG . . 3.360 2.647 2.064 3.125 . 0 0 "[ . 1 . 2]" 1
780 1 41 GLU HA 1 42 LYS H . . 2.980 2.791 2.785 2.803 . 0 0 "[ . 1 . 2]" 1
781 1 41 GLU QB 1 42 LYS H . . 3.290 1.996 1.880 2.181 . 0 0 "[ . 1 . 2]" 1
782 1 41 GLU HB2 1 42 LYS H . . 3.980 3.015 2.623 3.535 . 0 0 "[ . 1 . 2]" 1
783 1 41 GLU HB3 1 42 LYS H . . 3.980 2.029 1.920 2.202 . 0 0 "[ . 1 . 2]" 1
784 1 41 GLU QG 1 42 LYS H . . 3.990 3.234 1.972 3.952 . 0 0 "[ . 1 . 2]" 1
785 1 41 GLU QG 1 44 ASN QD . . 4.380 3.481 2.255 4.253 . 0 0 "[ . 1 . 2]" 1
786 1 42 LYS H 1 42 LYS QB . . 3.410 2.102 2.076 2.180 . 0 0 "[ . 1 . 2]" 1
787 1 42 LYS H 1 42 LYS QG . . 3.720 3.448 2.925 3.722 0.002 13 0 "[ . 1 . 2]" 1
788 1 42 LYS H 1 43 ARG H . . 3.050 2.499 2.488 2.558 . 0 0 "[ . 1 . 2]" 1
789 1 42 LYS HA 1 42 LYS QD . . 5.030 3.329 2.004 4.002 . 0 0 "[ . 1 . 2]" 1
790 1 42 LYS HA 1 42 LYS QG . . 3.050 2.184 2.012 2.639 . 0 0 "[ . 1 . 2]" 1
791 1 42 LYS QB 1 43 ARG H . . 3.320 2.586 2.507 2.620 . 0 0 "[ . 1 . 2]" 1
792 1 43 ARG H 1 43 ARG HB2 . . 3.130 2.655 2.647 2.676 . 0 0 "[ . 1 . 2]" 1
793 1 43 ARG H 1 43 ARG HB3 . . 3.670 3.784 3.780 3.797 0.127 10 0 "[ . 1 . 2]" 1
794 1 43 ARG H 1 43 ARG QG . . 3.620 2.953 2.895 3.009 . 0 0 "[ . 1 . 2]" 1
795 1 43 ARG H 1 44 ASN H . . 2.890 1.865 1.848 1.875 . 0 0 "[ . 1 . 2]" 1
796 1 43 ARG HA 1 43 ARG HB3 . . 2.920 2.470 2.470 2.472 . 0 0 "[ . 1 . 2]" 1
797 1 43 ARG HA 1 43 ARG QD . . 3.720 3.304 2.354 3.723 0.003 1 0 "[ . 1 . 2]" 1
798 1 43 ARG HA 1 43 ARG HG2 . . 3.890 2.540 2.409 2.781 . 0 0 "[ . 1 . 2]" 1
799 1 43 ARG HA 1 43 ARG QG . . 3.170 2.485 2.360 2.716 . 0 0 "[ . 1 . 2]" 1
800 1 43 ARG HA 1 43 ARG HG3 . . 3.890 3.527 3.378 3.797 . 0 0 "[ . 1 . 2]" 1
801 1 43 ARG HB2 1 43 ARG QG . . 2.580 2.199 2.146 2.230 . 0 0 "[ . 1 . 2]" 1
802 1 43 ARG HB2 1 44 ASN H . . 3.500 2.774 2.756 2.780 . 0 0 "[ . 1 . 2]" 1
803 1 43 ARG HB3 1 44 ASN H . . 3.630 3.798 3.784 3.803 0.173 11 0 "[ . 1 . 2]" 1
804 1 43 ARG QG 1 44 ASN H . . 3.910 4.061 4.055 4.065 0.155 18 0 "[ . 1 . 2]" 1
805 1 44 ASN H 1 44 ASN HB2 . . 3.200 2.290 2.124 2.331 . 0 0 "[ . 1 . 2]" 1
806 1 44 ASN H 1 44 ASN HB3 . . 3.200 2.818 2.765 3.070 . 0 0 "[ . 1 . 2]" 1
807 1 44 ASN HA 1 45 LEU H . . 3.160 2.403 2.387 2.449 . 0 0 "[ . 1 . 2]" 1
808 1 44 ASN QB 1 44 ASN QD . . 3.020 2.144 2.065 2.397 . 0 0 "[ . 1 . 2]" 1
809 1 44 ASN QB 1 45 LEU H . . 3.580 3.196 2.923 3.244 . 0 0 "[ . 1 . 2]" 1
810 1 44 ASN HB2 1 45 LEU H . . 4.130 3.919 3.892 3.967 . 0 0 "[ . 1 . 2]" 1
811 1 44 ASN HB3 1 45 LEU H . . 4.130 3.391 3.011 3.462 . 0 0 "[ . 1 . 2]" 1
812 1 45 LEU H 1 45 LEU HB2 . . 3.150 2.874 2.826 2.897 . 0 0 "[ . 1 . 2]" 1
813 1 45 LEU H 1 45 LEU HB3 . . 3.150 2.981 2.936 3.003 . 0 0 "[ . 1 . 2]" 1
814 1 45 LEU H 1 45 LEU MD1 . . 4.420 4.522 4.494 4.553 0.133 15 0 "[ . 1 . 2]" 1
815 1 45 LEU H 1 45 LEU QD . . 3.870 3.940 3.911 3.954 0.084 13 0 "[ . 1 . 2]" 1
816 1 45 LEU H 1 45 LEU MD2 . . 4.420 4.336 4.302 4.371 . 0 0 "[ . 1 . 2]" 1
817 1 45 LEU H 1 45 LEU HG . . 4.870 4.618 4.601 4.629 . 0 0 "[ . 1 . 2]" 1
818 1 45 LEU H 1 46 GLN H . . 5.500 4.440 4.435 4.459 . 0 0 "[ . 1 . 2]" 1
819 1 45 LEU HA 1 45 LEU MD1 . . 3.440 3.536 3.504 3.566 0.126 10 0 "[ . 1 . 2]" 1
820 1 45 LEU HA 1 45 LEU QD . . 2.900 2.957 2.949 2.963 0.063 16 0 "[ . 1 . 2]" 1
821 1 45 LEU HA 1 45 LEU MD2 . . 3.440 3.172 3.149 3.195 . 0 0 "[ . 1 . 2]" 1
822 1 45 LEU HA 1 45 LEU HG . . 3.880 2.264 2.247 2.281 . 0 0 "[ . 1 . 2]" 1
823 1 45 LEU HA 1 46 GLN H . . 2.940 2.333 2.329 2.343 . 0 0 "[ . 1 . 2]" 1
824 1 45 LEU QB 1 45 LEU QD . . 2.540 1.804 1.778 1.848 . 0 0 "[ . 1 . 2]" 1
825 1 45 LEU QB 1 46 GLN H . . 4.040 3.237 3.208 3.254 . 0 0 "[ . 1 . 2]" 1
826 1 45 LEU HB2 1 45 LEU MD1 . . 3.620 2.066 1.997 2.183 . 0 0 "[ . 1 . 2]" 1
827 1 45 LEU HB2 1 45 LEU MD2 . . 3.620 3.115 3.107 3.122 . 0 0 "[ . 1 . 2]" 1
828 1 45 LEU HB2 1 46 GLN H . . 4.590 4.071 4.063 4.080 . 0 0 "[ . 1 . 2]" 1
829 1 45 LEU HB3 1 45 LEU MD1 . . 3.620 2.649 2.604 2.672 . 0 0 "[ . 1 . 2]" 1
830 1 45 LEU HB3 1 45 LEU MD2 . . 3.620 2.089 2.075 2.107 . 0 0 "[ . 1 . 2]" 1
831 1 45 LEU HB3 1 46 GLN H . . 4.590 3.398 3.359 3.424 . 0 0 "[ . 1 . 2]" 1
832 1 45 LEU QD 1 46 GLN H . . 3.390 2.156 2.111 2.186 . 0 0 "[ . 1 . 2]" 1
833 1 45 LEU MD1 1 46 GLN H . . 4.130 4.060 4.042 4.083 . 0 0 "[ . 1 . 2]" 1
834 1 45 LEU MD2 1 46 GLN H . . 4.130 2.164 2.118 2.195 . 0 0 "[ . 1 . 2]" 1
835 1 45 LEU HG 1 46 GLN H . . 5.350 2.619 2.590 2.647 . 0 0 "[ . 1 . 2]" 1
836 1 46 GLN H 1 46 GLN HB2 . . 3.930 2.552 2.492 2.613 . 0 0 "[ . 1 . 2]" 1
837 1 46 GLN H 1 46 GLN HB3 . . 3.930 3.537 3.454 3.584 . 0 0 "[ . 1 . 2]" 1
838 1 46 GLN H 1 46 GLN QG . . 3.690 3.726 3.679 3.773 0.083 19 0 "[ . 1 . 2]" 1
839 1 46 GLN H 1 47 CYS H . . 5.500 4.452 4.428 4.468 . 0 0 "[ . 1 . 2]" 1
840 1 46 GLN HA 1 46 GLN QG . . 3.570 2.283 2.237 2.517 . 0 0 "[ . 1 . 2]" 1
841 1 46 GLN HA 1 47 CYS H . . 2.830 2.395 2.340 2.454 . 0 0 "[ . 1 . 2]" 1
842 1 46 GLN QB 1 47 CYS H . . 3.490 2.585 2.498 2.724 . 0 0 "[ . 1 . 2]" 1
843 1 46 GLN QB 1 48 ILE MD . . 3.870 3.805 3.198 3.917 0.047 2 0 "[ . 1 . 2]" 1
844 1 46 GLN QB 1 48 ILE QG . . 3.710 3.206 3.033 3.278 . 0 0 "[ . 1 . 2]" 1
845 1 46 GLN HB2 1 48 ILE MD . . 4.670 4.681 4.302 4.789 0.119 19 0 "[ . 1 . 2]" 1
846 1 46 GLN HB2 1 48 ILE HG12 . . 5.290 5.066 4.240 5.304 0.014 19 0 "[ . 1 . 2]" 1
847 1 46 GLN HB2 1 48 ILE HG13 . . 5.290 4.825 4.696 5.334 0.044 18 0 "[ . 1 . 2]" 1
848 1 46 GLN HB3 1 48 ILE MD . . 4.670 4.034 3.298 4.196 . 0 0 "[ . 1 . 2]" 1
849 1 46 GLN HB3 1 48 ILE HG12 . . 5.290 3.707 3.178 3.793 . 0 0 "[ . 1 . 2]" 1
850 1 46 GLN HB3 1 48 ILE HG13 . . 5.290 3.784 3.429 4.696 . 0 0 "[ . 1 . 2]" 1
851 1 46 GLN QE 1 46 GLN QG . . 2.980 2.407 2.254 2.573 . 0 0 "[ . 1 . 2]" 1
852 1 46 GLN QE 1 48 ILE MD . . 4.500 3.733 2.567 4.170 . 0 0 "[ . 1 . 2]" 1
853 1 46 GLN HE21 1 48 ILE MD . . 5.210 3.957 2.628 4.510 . 0 0 "[ . 1 . 2]" 1
854 1 46 GLN HE22 1 48 ILE MD . . 5.210 4.622 3.595 5.299 0.089 8 0 "[ . 1 . 2]" 1
855 1 46 GLN QG 1 47 CYS H . . 3.600 3.118 2.920 3.680 0.080 12 0 "[ . 1 . 2]" 1
856 1 46 GLN HG2 1 47 CYS H . . 4.100 3.251 2.985 4.113 0.013 12 0 "[ . 1 . 2]" 1
857 1 46 GLN HG3 1 47 CYS H . . 4.100 4.137 4.117 4.180 0.080 19 0 "[ . 1 . 2]" 1
858 1 47 CYS H 1 47 CYS HB2 . . 3.780 2.509 2.403 2.626 . 0 0 "[ . 1 . 2]" 1
859 1 47 CYS H 1 47 CYS QB . . 3.220 2.440 2.351 2.541 . 0 0 "[ . 1 . 2]" 1
860 1 47 CYS H 1 47 CYS HB3 . . 3.780 3.339 3.305 3.456 . 0 0 "[ . 1 . 2]" 1
861 1 47 CYS H 1 48 ILE H . . 4.700 4.200 3.971 4.298 . 0 0 "[ . 1 . 2]" 1
862 1 47 CYS HA 1 48 ILE H . . 2.690 2.147 2.139 2.209 . 0 0 "[ . 1 . 2]" 1
863 1 47 CYS QB 1 48 ILE H . . 3.660 3.620 3.508 3.820 0.160 17 0 "[ . 1 . 2]" 1
864 1 48 ILE H 1 48 ILE HB . . 3.470 2.670 2.479 2.754 . 0 0 "[ . 1 . 2]" 1
865 1 48 ILE H 1 48 ILE MD . . 4.130 3.989 3.716 4.107 . 0 0 "[ . 1 . 2]" 1
866 1 48 ILE H 1 48 ILE HG12 . . 3.430 3.358 2.356 3.495 0.065 4 0 "[ . 1 . 2]" 1
867 1 48 ILE H 1 48 ILE HG13 . . 3.430 2.651 2.449 3.602 0.172 17 0 "[ . 1 . 2]" 1
868 1 48 ILE H 1 48 ILE MG . . 3.820 3.856 3.773 3.894 0.074 19 0 "[ . 1 . 2]" 1
869 1 48 ILE HA 1 48 ILE MD . . 3.690 3.619 2.267 3.798 0.108 13 0 "[ . 1 . 2]" 1
870 1 48 ILE HA 1 48 ILE HG12 . . 3.820 2.564 2.503 2.844 . 0 0 "[ . 1 . 2]" 1
871 1 48 ILE HA 1 48 ILE QG . . 3.320 2.487 2.433 2.763 . 0 0 "[ . 1 . 2]" 1
872 1 48 ILE HA 1 48 ILE HG13 . . 3.820 3.348 3.272 3.757 . 0 0 "[ . 1 . 2]" 1
873 1 48 ILE HA 1 48 ILE MG . . 2.940 2.338 2.322 2.350 . 0 0 "[ . 1 . 2]" 1
874 1 48 ILE HA 1 49 CYS H . . 3.120 2.226 2.201 2.242 . 0 0 "[ . 1 . 2]" 1
875 1 48 ILE HB 1 48 ILE MD . . 3.530 2.570 2.440 3.201 . 0 0 "[ . 1 . 2]" 1
876 1 48 ILE HB 1 49 CYS H . . 4.530 3.848 3.770 4.015 . 0 0 "[ . 1 . 2]" 1
877 1 48 ILE MD 1 49 CYS H . . 5.500 4.624 3.374 4.796 . 0 0 "[ . 1 . 2]" 1
878 1 48 ILE QG 1 48 ILE MG . . 2.800 2.397 2.383 2.430 . 0 0 "[ . 1 . 2]" 1
879 1 48 ILE HG12 1 48 ILE MG . . 3.470 2.550 2.460 3.185 . 0 0 "[ . 1 . 2]" 1
880 1 48 ILE HG12 1 49 CYS H . . 5.500 4.456 4.376 4.852 . 0 0 "[ . 1 . 2]" 1
881 1 48 ILE HG13 1 48 ILE MG . . 3.470 3.119 2.461 3.196 . 0 0 "[ . 1 . 2]" 1
882 1 48 ILE HG13 1 49 CYS H . . 5.500 5.153 5.126 5.274 . 0 0 "[ . 1 . 2]" 1
883 1 48 ILE MG 1 49 CYS H . . 3.780 2.195 2.125 2.262 . 0 0 "[ . 1 . 2]" 1
884 1 48 ILE MG 1 49 CYS HA . . 5.290 3.903 3.837 3.961 . 0 0 "[ . 1 . 2]" 1
885 1 49 CYS H 1 49 CYS HB2 . . 3.370 2.245 2.184 2.255 . 0 0 "[ . 1 . 2]" 1
886 1 49 CYS H 1 49 CYS HB3 . . 3.370 3.517 3.431 3.528 0.158 10 0 "[ . 1 . 2]" 1
887 1 49 CYS H 1 50 ASP H . . 4.860 4.506 4.493 4.514 . 0 0 "[ . 1 . 2]" 1
888 1 49 CYS HA 1 50 ASP H . . 2.500 2.572 2.562 2.592 0.092 20 0 "[ . 1 . 2]" 1
889 1 49 CYS QB 1 50 ASP H . . 2.960 2.089 2.043 2.147 . 0 0 "[ . 1 . 2]" 1
890 1 49 CYS QB 1 51 TYR QD . . 5.180 3.751 3.553 3.850 . 0 0 "[ . 1 . 2]" 1
891 1 49 CYS QB 1 51 TYR QE . . 3.210 2.957 2.586 3.245 0.035 13 0 "[ . 1 . 2]" 1
892 1 49 CYS HB2 1 50 ASP H . . 3.410 3.580 3.537 3.660 0.250 19 0 "[ . 1 . 2]" 1
893 1 49 CYS HB2 1 51 TYR QE . . 3.700 3.368 3.072 3.731 0.031 16 0 "[ . 1 . 2]" 1
894 1 49 CYS HB3 1 50 ASP H . . 3.410 2.103 2.056 2.162 . 0 0 "[ . 1 . 2]" 1
895 1 49 CYS HB3 1 51 TYR QE . . 3.700 3.278 2.782 3.569 . 0 0 "[ . 1 . 2]" 1
896 1 50 ASP H 1 50 ASP HB2 . . 3.800 2.940 2.745 3.157 . 0 0 "[ . 1 . 2]" 1
897 1 50 ASP H 1 50 ASP QB . . 3.300 2.698 2.677 2.727 . 0 0 "[ . 1 . 2]" 1
898 1 50 ASP H 1 50 ASP HB3 . . 3.800 3.312 2.975 3.842 0.042 17 0 "[ . 1 . 2]" 1
899 1 50 ASP H 1 51 TYR H . . 4.620 4.293 4.219 4.340 . 0 0 "[ . 1 . 2]" 1
900 1 50 ASP HA 1 51 TYR H . . 2.580 2.185 2.157 2.208 . 0 0 "[ . 1 . 2]" 1
901 1 50 ASP HA 1 51 TYR QD . . 3.820 3.822 3.611 3.896 0.076 18 0 "[ . 1 . 2]" 1
902 1 50 ASP QB 1 51 TYR H . . 4.080 3.390 2.926 3.662 . 0 0 "[ . 1 . 2]" 1
903 1 51 TYR H 1 51 TYR QB . . 3.230 2.542 2.429 2.609 . 0 0 "[ . 1 . 2]" 1
904 1 51 TYR H 1 51 TYR QD . . 4.090 3.265 2.955 3.385 . 0 0 "[ . 1 . 2]" 1
905 1 51 TYR HA 1 51 TYR QB . . 2.640 2.428 2.400 2.452 . 0 0 "[ . 1 . 2]" 1
906 1 51 TYR HA 1 51 TYR QD . . 3.320 2.796 2.743 2.930 . 0 0 "[ . 1 . 2]" 1
907 1 51 TYR QB 1 52 CYS H . . 4.190 3.742 3.602 3.842 . 0 0 "[ . 1 . 2]" 1
908 1 51 TYR QD 1 52 CYS H . . 5.500 4.949 4.894 4.990 . 0 0 "[ . 1 . 2]" 1
909 1 52 CYS H 1 52 CYS QB . . 3.570 2.887 2.721 3.211 . 0 0 "[ . 1 . 2]" 1
910 1 52 CYS H 1 53 GLU H . . 4.550 4.361 4.327 4.379 . 0 0 "[ . 1 . 2]" 1
911 1 52 CYS HA 1 52 CYS QB . . 2.640 2.362 2.171 2.476 . 0 0 "[ . 1 . 2]" 1
912 1 52 CYS HA 1 53 GLU H . . 2.850 2.581 2.287 2.720 . 0 0 "[ . 1 . 2]" 1
913 1 52 CYS QB 1 53 GLU H . . 3.520 2.141 1.962 2.728 . 0 0 "[ . 1 . 2]" 1
914 1 52 CYS HB2 1 53 GLU H . . 4.050 3.088 2.023 4.034 . 0 0 "[ . 1 . 2]" 1
915 1 52 CYS HB3 1 53 GLU H . . 4.050 2.673 1.973 3.959 . 0 0 "[ . 1 . 2]" 1
916 1 53 GLU H 1 53 GLU HB2 . . 4.140 3.372 2.863 4.052 . 0 0 "[ . 1 . 2]" 1
917 1 53 GLU H 1 53 GLU QB . . 3.570 3.054 2.791 3.359 . 0 0 "[ . 1 . 2]" 1
918 1 53 GLU H 1 53 GLU HB3 . . 4.140 3.789 3.558 3.941 . 0 0 "[ . 1 . 2]" 1
919 1 53 GLU H 1 53 GLU HG2 . . 4.370 3.445 2.539 4.387 0.017 20 0 "[ . 1 . 2]" 1
920 1 53 GLU H 1 53 GLU QG . . 3.670 2.845 2.512 3.365 . 0 0 "[ . 1 . 2]" 1
921 1 53 GLU H 1 53 GLU HG3 . . 4.370 3.511 3.050 4.186 . 0 0 "[ . 1 . 2]" 1
922 1 53 GLU H 1 54 TYR H . . 4.170 4.266 4.162 4.336 0.166 14 0 "[ . 1 . 2]" 1
923 1 53 GLU HA 1 53 GLU HG2 . . 4.190 3.086 2.544 3.678 . 0 0 "[ . 1 . 2]" 1
924 1 53 GLU HA 1 53 GLU HG3 . . 4.190 3.511 2.595 4.127 . 0 0 "[ . 1 . 2]" 1
925 1 53 GLU HA 1 54 TYR H . . 2.660 2.516 2.206 2.724 0.064 14 0 "[ . 1 . 2]" 1
926 1 53 GLU QB 1 53 GLU QG . . 2.320 2.060 2.016 2.087 . 0 0 "[ . 1 . 2]" 1
927 1 53 GLU QB 1 54 TYR H . . 3.400 2.316 1.913 2.914 . 0 0 "[ . 1 . 2]" 1
928 1 53 GLU HB2 1 54 TYR H . . 4.010 2.899 2.755 2.992 . 0 0 "[ . 1 . 2]" 1
929 1 53 GLU HB3 1 54 TYR H . . 4.010 2.782 1.941 4.018 0.008 8 0 "[ . 1 . 2]" 1
930 1 53 GLU QG 1 54 TYR H . . 4.070 3.941 3.845 4.071 0.001 12 0 "[ . 1 . 2]" 1
931 1 53 GLU HG2 1 54 TYR H . . 4.670 4.346 4.104 4.675 0.005 1 0 "[ . 1 . 2]" 1
932 1 53 GLU HG3 1 54 TYR H . . 4.670 4.559 4.254 4.664 . 0 0 "[ . 1 . 2]" 1
933 1 54 TYR H 1 54 TYR HA . . 2.930 2.692 2.274 2.948 0.018 20 0 "[ . 1 . 2]" 1
934 1 54 TYR H 1 54 TYR HB2 . . 3.630 2.862 2.079 3.743 0.113 16 0 "[ . 1 . 2]" 1
935 1 54 TYR H 1 54 TYR QB . . 3.140 2.583 2.056 3.143 0.003 20 0 "[ . 1 . 2]" 1
936 1 54 TYR H 1 54 TYR HB3 . . 3.630 3.258 2.158 3.622 . 0 0 "[ . 1 . 2]" 1
937 1 54 TYR H 1 54 TYR QD . . 4.650 3.831 2.396 4.473 . 0 0 "[ . 1 . 2]" 1
938 1 54 TYR HA 1 54 TYR QD . . 3.300 2.825 2.278 3.600 0.300 15 0 "[ . 1 . 2]" 1
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