NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
447079 |
2koj   |
16515 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2koj
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 1277
_Distance_constraint_stats_list.Viol_count 1597
_Distance_constraint_stats_list.Viol_total 1941.403
_Distance_constraint_stats_list.Viol_max 0.522
_Distance_constraint_stats_list.Viol_rms 0.0198
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0038
_Distance_constraint_stats_list.Viol_average_violations_only 0.0608
_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 9 VAL 0.037 0.018 14 0 "[ . 1 . 2]"
1 10 GLY 0.175 0.049 18 0 "[ . 1 . 2]"
1 11 LYS 0.637 0.145 20 0 "[ . 1 . 2]"
1 12 ARG 2.404 0.121 6 0 "[ . 1 . 2]"
1 13 LEU 1.124 0.118 12 0 "[ . 1 . 2]"
1 14 ASN 0.429 0.062 11 0 "[ . 1 . 2]"
1 15 ILE 1.377 0.114 8 0 "[ . 1 . 2]"
1 16 GLN 2.178 0.133 7 0 "[ . 1 . 2]"
1 17 LEU 0.685 0.089 8 0 "[ . 1 . 2]"
1 18 LYS 3.196 0.150 18 0 "[ . 1 . 2]"
1 19 LYS 3.128 0.171 10 0 "[ . 1 . 2]"
1 20 GLY 0.943 0.089 15 0 "[ . 1 . 2]"
1 21 THR 0.341 0.127 20 0 "[ . 1 . 2]"
1 22 GLU 1.322 0.303 9 0 "[ . 1 . 2]"
1 23 GLY 0.016 0.016 6 0 "[ . 1 . 2]"
1 24 LEU 2.701 0.171 10 0 "[ . 1 . 2]"
1 25 GLY 6.988 0.494 13 0 "[ . 1 . 2]"
1 26 PHE 4.993 0.172 19 0 "[ . 1 . 2]"
1 27 SER 0.109 0.059 13 0 "[ . 1 . 2]"
1 28 ILE 10.122 0.175 4 0 "[ . 1 . 2]"
1 29 THR 1.181 0.104 10 0 "[ . 1 . 2]"
1 30 SER 2.799 0.161 19 0 "[ . 1 . 2]"
1 31 ARG 0.728 0.163 9 0 "[ . 1 . 2]"
1 32 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 33 VAL 0.462 0.163 9 0 "[ . 1 . 2]"
1 34 THR 0.267 0.097 10 0 "[ . 1 . 2]"
1 35 ILE 0.267 0.097 10 0 "[ . 1 . 2]"
1 38 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 PRO 0.294 0.070 20 0 "[ . 1 . 2]"
1 41 ILE 8.484 0.184 13 0 "[ . 1 . 2]"
1 42 TYR 3.840 0.136 14 0 "[ . 1 . 2]"
1 43 VAL 0.337 0.040 17 0 "[ . 1 . 2]"
1 44 LYS 2.677 0.126 10 0 "[ . 1 . 2]"
1 45 ASN 0.911 0.113 15 0 "[ . 1 . 2]"
1 46 ILE 5.202 0.176 2 0 "[ . 1 . 2]"
1 47 LEU 1.515 0.522 13 1 "[ . 1 + . 2]"
1 48 PRO 0.001 0.001 1 0 "[ . 1 . 2]"
1 49 ARG 0.526 0.287 9 0 "[ . 1 . 2]"
1 50 GLY 3.308 0.522 13 1 "[ . 1 + . 2]"
1 51 ALA 3.650 0.494 13 0 "[ . 1 . 2]"
1 52 ALA 5.760 0.401 19 0 "[ . 1 . 2]"
1 53 ILE 2.207 0.164 2 0 "[ . 1 . 2]"
1 54 GLN 0.756 0.076 5 0 "[ . 1 . 2]"
1 55 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 GLY 0.761 0.089 8 0 "[ . 1 . 2]"
1 57 ARG 0.531 0.080 14 0 "[ . 1 . 2]"
1 58 LEU 3.351 0.172 19 0 "[ . 1 . 2]"
1 59 LYS 3.479 0.176 2 0 "[ . 1 . 2]"
1 60 ALA 1.175 0.157 10 0 "[ . 1 . 2]"
1 61 GLY 0.008 0.008 10 0 "[ . 1 . 2]"
1 62 ASP 1.176 0.157 10 0 "[ . 1 . 2]"
1 63 ARG 3.729 0.128 12 0 "[ . 1 . 2]"
1 64 LEU 4.031 0.175 4 0 "[ . 1 . 2]"
1 65 ILE 3.965 0.160 15 0 "[ . 1 . 2]"
1 66 GLU 2.570 0.213 10 0 "[ . 1 . 2]"
1 67 VAL 7.677 0.189 4 0 "[ . 1 . 2]"
1 68 ASN 1.399 0.189 4 0 "[ . 1 . 2]"
1 69 GLY 0.134 0.044 17 0 "[ . 1 . 2]"
1 70 VAL 2.151 0.127 11 0 "[ . 1 . 2]"
1 71 ASP 0.260 0.065 20 0 "[ . 1 . 2]"
1 72 LEU 5.783 0.213 10 0 "[ . 1 . 2]"
1 73 ALA 0.043 0.028 14 0 "[ . 1 . 2]"
1 74 GLY 0.275 0.098 15 0 "[ . 1 . 2]"
1 75 LYS 1.993 0.109 15 0 "[ . 1 . 2]"
1 76 SER 2.581 0.118 12 0 "[ . 1 . 2]"
1 77 GLN 2.423 0.255 12 0 "[ . 1 . 2]"
1 78 GLU 3.269 0.255 12 0 "[ . 1 . 2]"
1 79 GLU 2.327 0.118 12 0 "[ . 1 . 2]"
1 80 VAL 4.713 0.184 13 0 "[ . 1 . 2]"
1 81 VAL 2.874 0.219 5 0 "[ . 1 . 2]"
1 82 SER 1.254 0.099 18 0 "[ . 1 . 2]"
1 83 LEU 2.482 0.113 10 0 "[ . 1 . 2]"
1 84 LEU 5.185 0.158 11 0 "[ . 1 . 2]"
1 85 ARG 0.362 0.076 7 0 "[ . 1 . 2]"
1 86 SER 1.105 0.190 16 0 "[ . 1 . 2]"
1 87 THR 1.121 0.190 16 0 "[ . 1 . 2]"
1 88 LYS 0.100 0.053 14 0 "[ . 1 . 2]"
1 89 MET 2.270 0.145 7 0 "[ . 1 . 2]"
1 90 GLU 2.268 0.145 7 0 "[ . 1 . 2]"
1 91 GLY 0.134 0.054 3 0 "[ . 1 . 2]"
1 92 THR 3.362 0.150 18 0 "[ . 1 . 2]"
1 93 VAL 2.587 0.097 17 0 "[ . 1 . 2]"
1 94 SER 2.070 0.129 10 0 "[ . 1 . 2]"
1 95 LEU 2.888 0.166 20 0 "[ . 1 . 2]"
1 96 LEU 2.933 0.123 14 0 "[ . 1 . 2]"
1 97 VAL 3.748 0.160 15 0 "[ . 1 . 2]"
1 98 PHE 1.531 0.085 5 0 "[ . 1 . 2]"
1 99 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 GLN 0.164 0.065 4 0 "[ . 1 . 2]"
1 101 GLU 0.044 0.019 7 0 "[ . 1 . 2]"
1 102 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 103 ALA 0.512 0.063 16 0 "[ . 1 . 2]"
1 104 PHE 0.741 0.063 16 0 "[ . 1 . 2]"
1 105 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 106 PRO 1.088 0.206 6 0 "[ . 1 . 2]"
1 107 ARG 1.137 0.206 6 0 "[ . 1 . 2]"
1 108 GLU 0.050 0.050 5 0 "[ . 1 . 2]"
1 110 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 111 ALA 0.000 0.000 . 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 9 VAL HA 1 10 GLY H . . 3.410 2.750 2.100 3.428 0.018 14 0 "[ . 1 . 2]" 1
2 1 9 VAL HB 1 10 GLY H . . 4.530 3.439 1.917 4.465 . 0 0 "[ . 1 . 2]" 1
3 1 9 VAL HB 1 10 GLY QA . . 5.340 4.499 3.855 5.326 . 0 0 "[ . 1 . 2]" 1
4 1 9 VAL QG 1 10 GLY H . . 4.270 2.662 1.695 3.464 . 0 0 "[ . 1 . 2]" 1
5 1 10 GLY H 1 11 LYS H . . 5.230 3.903 2.068 4.482 . 0 0 "[ . 1 . 2]" 1
6 1 10 GLY H 1 98 PHE QE . . 4.970 4.472 3.786 5.019 0.049 18 0 "[ . 1 . 2]" 1
7 1 10 GLY QA 1 98 PHE QD . . 4.500 3.958 3.694 4.323 . 0 0 "[ . 1 . 2]" 1
8 1 10 GLY QA 1 98 PHE QE . . 4.070 2.747 2.465 3.083 . 0 0 "[ . 1 . 2]" 1
9 1 10 GLY QA 1 98 PHE HZ . . 4.250 2.345 2.081 2.964 . 0 0 "[ . 1 . 2]" 1
10 1 10 GLY HA2 1 98 PHE QE . . 4.680 3.654 2.780 4.493 . 0 0 "[ . 1 . 2]" 1
11 1 10 GLY HA2 1 101 GLU H . . 5.500 3.729 2.172 4.885 . 0 0 "[ . 1 . 2]" 1
12 1 10 GLY HA3 1 98 PHE QE . . 4.680 2.980 2.536 4.385 . 0 0 "[ . 1 . 2]" 1
13 1 10 GLY HA3 1 101 GLU H . . 5.500 4.702 2.736 5.519 0.019 7 0 "[ . 1 . 2]" 1
14 1 11 LYS H 1 11 LYS QD . . 4.030 3.462 1.960 4.175 0.145 20 0 "[ . 1 . 2]" 1
15 1 11 LYS H 1 11 LYS QG . . 4.310 2.986 1.946 4.227 . 0 0 "[ . 1 . 2]" 1
16 1 11 LYS H 1 12 ARG H . . 5.310 4.447 4.356 4.519 . 0 0 "[ . 1 . 2]" 1
17 1 11 LYS H 1 98 PHE HA . . 5.380 4.689 4.298 5.354 . 0 0 "[ . 1 . 2]" 1
18 1 11 LYS H 1 98 PHE QE . . 4.950 4.500 3.914 4.984 0.034 10 0 "[ . 1 . 2]" 1
19 1 11 LYS H 1 99 ARG H . . 4.580 3.355 3.044 3.949 . 0 0 "[ . 1 . 2]" 1
20 1 11 LYS H 1 100 GLN HA . . 4.910 3.960 3.031 4.975 0.065 4 0 "[ . 1 . 2]" 1
21 1 11 LYS QB 1 12 ARG H . . 3.990 2.779 2.220 3.683 . 0 0 "[ . 1 . 2]" 1
22 1 11 LYS QG 1 12 ARG H . . 4.730 3.716 2.701 4.273 . 0 0 "[ . 1 . 2]" 1
23 1 12 ARG H 1 12 ARG QB . . 3.560 2.456 2.273 2.566 . 0 0 "[ . 1 . 2]" 1
24 1 12 ARG H 1 12 ARG HD2 . . 5.500 4.471 2.357 5.346 . 0 0 "[ . 1 . 2]" 1
25 1 12 ARG H 1 12 ARG HD3 . . 5.500 4.311 2.287 5.434 . 0 0 "[ . 1 . 2]" 1
26 1 12 ARG H 1 12 ARG HG2 . . 4.960 4.222 4.013 4.416 . 0 0 "[ . 1 . 2]" 1
27 1 12 ARG H 1 12 ARG HG3 . . 5.270 3.291 2.961 3.911 . 0 0 "[ . 1 . 2]" 1
28 1 12 ARG H 1 13 LEU H . . 5.330 4.361 4.253 4.501 . 0 0 "[ . 1 . 2]" 1
29 1 12 ARG HA 1 12 ARG HD2 . . 5.440 4.405 3.234 4.801 . 0 0 "[ . 1 . 2]" 1
30 1 12 ARG HA 1 12 ARG HD3 . . 5.440 4.359 3.225 4.790 . 0 0 "[ . 1 . 2]" 1
31 1 12 ARG HA 1 13 LEU H . . 3.420 2.093 2.007 2.227 . 0 0 "[ . 1 . 2]" 1
32 1 12 ARG HA 1 98 PHE HA . . 5.500 2.322 2.218 2.520 . 0 0 "[ . 1 . 2]" 1
33 1 12 ARG QB 1 13 LEU H . . 4.240 2.973 2.718 3.155 . 0 0 "[ . 1 . 2]" 1
34 1 12 ARG QB 1 96 LEU QD . . 4.260 1.923 1.784 2.182 . 0 0 "[ . 1 . 2]" 1
35 1 12 ARG QB 1 98 PHE QD . . 4.430 4.009 3.875 4.119 . 0 0 "[ . 1 . 2]" 1
36 1 12 ARG QD 1 65 ILE MD . . 5.340 4.170 3.152 5.382 0.042 5 0 "[ . 1 . 2]" 1
37 1 12 ARG QD 1 65 ILE MG . . 5.340 3.471 2.129 4.968 . 0 0 "[ . 1 . 2]" 1
38 1 12 ARG QD 1 96 LEU QD . . 4.810 2.910 1.875 4.023 . 0 0 "[ . 1 . 2]" 1
39 1 12 ARG HG2 1 13 LEU H . . 5.500 4.312 3.790 5.250 . 0 0 "[ . 1 . 2]" 1
40 1 12 ARG HG2 1 65 ILE HB . . 4.360 4.350 4.153 4.419 0.059 11 0 "[ . 1 . 2]" 1
41 1 12 ARG HG2 1 65 ILE MD . . 5.270 3.987 3.658 4.857 . 0 0 "[ . 1 . 2]" 1
42 1 12 ARG HG2 1 96 LEU QD . . 4.820 2.801 2.068 4.068 . 0 0 "[ . 1 . 2]" 1
43 1 12 ARG HG2 1 98 PHE HA . . 4.760 3.217 2.238 4.644 . 0 0 "[ . 1 . 2]" 1
44 1 12 ARG HG2 1 98 PHE QB . . 4.750 3.087 2.448 4.250 . 0 0 "[ . 1 . 2]" 1
45 1 12 ARG HG2 1 98 PHE QD . . 4.180 2.591 2.250 3.231 . 0 0 "[ . 1 . 2]" 1
46 1 12 ARG HG2 1 98 PHE QE . . 4.580 4.547 4.327 4.665 0.085 5 0 "[ . 1 . 2]" 1
47 1 12 ARG HG3 1 13 LEU H . . 4.720 4.598 4.065 4.838 0.118 12 0 "[ . 1 . 2]" 1
48 1 12 ARG HG3 1 65 ILE MD . . 4.620 4.531 4.004 4.741 0.121 6 0 "[ . 1 . 2]" 1
49 1 12 ARG HG3 1 96 LEU QD . . 4.360 3.736 2.845 4.426 0.066 8 0 "[ . 1 . 2]" 1
50 1 12 ARG HG3 1 98 PHE HA . . 4.520 3.148 2.308 3.881 . 0 0 "[ . 1 . 2]" 1
51 1 12 ARG HG3 1 98 PHE QD . . 4.260 2.001 1.816 2.196 . 0 0 "[ . 1 . 2]" 1
52 1 12 ARG HG3 1 98 PHE QE . . 4.700 3.517 2.961 3.999 . 0 0 "[ . 1 . 2]" 1
53 1 13 LEU H 1 13 LEU HB2 . . 3.880 2.688 2.612 2.815 . 0 0 "[ . 1 . 2]" 1
54 1 13 LEU H 1 13 LEU QD . . 4.130 2.849 2.305 3.570 . 0 0 "[ . 1 . 2]" 1
55 1 13 LEU H 1 14 ASN H . . 5.300 4.376 4.267 4.450 . 0 0 "[ . 1 . 2]" 1
56 1 13 LEU H 1 97 VAL MG2 . . 4.400 2.912 2.668 3.151 . 0 0 "[ . 1 . 2]" 1
57 1 13 LEU HB2 1 14 ASN H . . 3.920 3.905 3.750 3.982 0.062 11 0 "[ . 1 . 2]" 1
58 1 13 LEU HB2 1 14 ASN HA . . 4.930 4.658 4.421 4.909 . 0 0 "[ . 1 . 2]" 1
59 1 13 LEU HB2 1 97 VAL H . . 4.470 3.836 3.570 4.430 . 0 0 "[ . 1 . 2]" 1
60 1 13 LEU HB2 1 97 VAL MG2 . . 3.550 2.553 2.235 3.240 . 0 0 "[ . 1 . 2]" 1
61 1 13 LEU QD 1 98 PHE HA . . 5.180 4.333 3.601 5.210 0.030 19 0 "[ . 1 . 2]" 1
62 1 13 LEU QD 1 99 ARG H . . 5.010 3.559 2.705 4.674 . 0 0 "[ . 1 . 2]" 1
63 1 14 ASN H 1 14 ASN HB2 . . 4.130 3.529 2.813 3.870 . 0 0 "[ . 1 . 2]" 1
64 1 14 ASN H 1 14 ASN HB3 . . 4.130 2.935 2.502 3.290 . 0 0 "[ . 1 . 2]" 1
65 1 14 ASN H 1 15 ILE H . . 5.090 4.312 4.235 4.452 . 0 0 "[ . 1 . 2]" 1
66 1 14 ASN HA 1 15 ILE H . . 3.430 2.092 2.035 2.153 . 0 0 "[ . 1 . 2]" 1
67 1 14 ASN HA 1 15 ILE HB . . 5.230 4.525 4.351 4.707 . 0 0 "[ . 1 . 2]" 1
68 1 14 ASN HA 1 15 ILE MD . . 5.500 3.912 2.677 5.037 . 0 0 "[ . 1 . 2]" 1
69 1 14 ASN HA 1 15 ILE HG13 . . 5.320 4.140 3.240 5.046 . 0 0 "[ . 1 . 2]" 1
70 1 14 ASN HA 1 95 LEU H . . 5.500 4.525 4.338 4.820 . 0 0 "[ . 1 . 2]" 1
71 1 14 ASN HA 1 96 LEU HA . . 5.500 2.163 1.897 2.550 . 0 0 "[ . 1 . 2]" 1
72 1 14 ASN HA 1 96 LEU HB2 . . 5.500 4.014 3.505 4.792 . 0 0 "[ . 1 . 2]" 1
73 1 14 ASN HA 1 96 LEU QD . . 4.420 3.207 2.165 4.099 . 0 0 "[ . 1 . 2]" 1
74 1 14 ASN HA 1 97 VAL H . . 3.890 3.375 3.033 3.813 . 0 0 "[ . 1 . 2]" 1
75 1 14 ASN HA 1 97 VAL MG1 . . 5.110 4.652 4.111 5.092 . 0 0 "[ . 1 . 2]" 1
76 1 14 ASN HA 1 97 VAL MG2 . . 4.770 4.251 3.685 4.653 . 0 0 "[ . 1 . 2]" 1
77 1 14 ASN QB 1 15 ILE H . . 4.380 3.361 2.850 3.867 . 0 0 "[ . 1 . 2]" 1
78 1 14 ASN QB 1 96 LEU HG . . 5.130 3.601 2.097 5.000 . 0 0 "[ . 1 . 2]" 1
79 1 14 ASN HB2 1 15 ILE H . . 4.970 3.598 2.918 4.416 . 0 0 "[ . 1 . 2]" 1
80 1 14 ASN HB3 1 15 ILE H . . 4.970 4.187 3.967 4.318 . 0 0 "[ . 1 . 2]" 1
81 1 15 ILE H 1 15 ILE HB . . 4.050 2.639 2.529 2.723 . 0 0 "[ . 1 . 2]" 1
82 1 15 ILE H 1 15 ILE MD . . 4.760 3.226 2.249 4.042 . 0 0 "[ . 1 . 2]" 1
83 1 15 ILE H 1 15 ILE HG12 . . 5.500 4.129 3.845 4.489 . 0 0 "[ . 1 . 2]" 1
84 1 15 ILE H 1 15 ILE HG13 . . 4.420 3.224 2.630 3.962 . 0 0 "[ . 1 . 2]" 1
85 1 15 ILE H 1 15 ILE MG . . 4.250 3.845 3.800 3.878 . 0 0 "[ . 1 . 2]" 1
86 1 15 ILE H 1 16 GLN H . . 5.500 4.298 4.213 4.380 . 0 0 "[ . 1 . 2]" 1
87 1 15 ILE H 1 94 SER HA . . 5.360 4.341 4.120 4.513 . 0 0 "[ . 1 . 2]" 1
88 1 15 ILE H 1 95 LEU H . . 4.740 3.032 2.878 3.320 . 0 0 "[ . 1 . 2]" 1
89 1 15 ILE H 1 95 LEU HB2 . . 5.020 3.521 3.249 4.015 . 0 0 "[ . 1 . 2]" 1
90 1 15 ILE H 1 95 LEU HB3 . . 5.500 4.625 4.415 4.988 . 0 0 "[ . 1 . 2]" 1
91 1 15 ILE H 1 95 LEU QD . . 5.440 4.558 4.234 4.862 . 0 0 "[ . 1 . 2]" 1
92 1 15 ILE H 1 96 LEU HB2 . . 5.500 5.205 4.702 5.614 0.114 8 0 "[ . 1 . 2]" 1
93 1 15 ILE HA 1 15 ILE MD . . 4.620 3.574 3.158 3.920 . 0 0 "[ . 1 . 2]" 1
94 1 15 ILE HA 1 15 ILE HG12 . . 3.750 3.136 2.567 3.763 0.013 12 0 "[ . 1 . 2]" 1
95 1 15 ILE HA 1 16 GLN H . . 3.560 2.184 2.130 2.252 . 0 0 "[ . 1 . 2]" 1
96 1 15 ILE HB 1 16 GLN H . . 5.130 4.203 4.045 4.300 . 0 0 "[ . 1 . 2]" 1
97 1 15 ILE HB 1 95 LEU H . . 5.030 3.747 3.456 4.065 . 0 0 "[ . 1 . 2]" 1
98 1 15 ILE HB 1 95 LEU HB2 . . 4.340 3.020 2.235 4.118 . 0 0 "[ . 1 . 2]" 1
99 1 15 ILE MD 1 16 GLN H . . 5.290 5.117 4.889 5.323 0.033 19 0 "[ . 1 . 2]" 1
100 1 15 ILE MD 1 57 ARG H . . 5.140 4.540 3.760 5.206 0.066 12 0 "[ . 1 . 2]" 1
101 1 15 ILE MD 1 57 ARG HA . . 5.400 4.502 4.028 5.267 . 0 0 "[ . 1 . 2]" 1
102 1 15 ILE MD 1 57 ARG QB . . 4.490 2.544 1.978 3.559 . 0 0 "[ . 1 . 2]" 1
103 1 15 ILE MD 1 57 ARG QD . . 5.340 4.126 2.636 5.217 . 0 0 "[ . 1 . 2]" 1
104 1 15 ILE MD 1 58 LEU H . . 4.710 3.354 2.462 4.349 . 0 0 "[ . 1 . 2]" 1
105 1 15 ILE MD 1 58 LEU HA . . 4.000 2.951 2.425 3.412 . 0 0 "[ . 1 . 2]" 1
106 1 15 ILE MD 1 58 LEU QD . . 4.480 2.505 2.052 2.964 . 0 0 "[ . 1 . 2]" 1
107 1 15 ILE MD 1 59 LYS H . . 4.950 4.624 4.072 5.016 0.066 17 0 "[ . 1 . 2]" 1
108 1 15 ILE HG12 1 57 ARG QB . . 4.480 2.585 2.068 3.176 . 0 0 "[ . 1 . 2]" 1
109 1 15 ILE HG12 1 57 ARG QD . . 4.960 4.030 1.882 5.000 0.040 9 0 "[ . 1 . 2]" 1
110 1 15 ILE HG12 1 58 LEU H . . 4.720 3.911 2.648 4.771 0.051 19 0 "[ . 1 . 2]" 1
111 1 15 ILE HG13 1 15 ILE MG . . 3.470 2.898 2.493 3.218 . 0 0 "[ . 1 . 2]" 1
112 1 15 ILE HG13 1 16 GLN H . . 5.390 4.820 4.355 5.191 . 0 0 "[ . 1 . 2]" 1
113 1 15 ILE MG 1 16 GLN H . . 4.100 2.770 2.533 2.953 . 0 0 "[ . 1 . 2]" 1
114 1 15 ILE MG 1 16 GLN HA . . 5.080 3.815 3.537 4.039 . 0 0 "[ . 1 . 2]" 1
115 1 15 ILE MG 1 17 LEU H . . 5.130 4.146 3.807 4.395 . 0 0 "[ . 1 . 2]" 1
116 1 15 ILE MG 1 57 ARG H . . 5.500 3.874 3.369 4.382 . 0 0 "[ . 1 . 2]" 1
117 1 15 ILE MG 1 57 ARG HA . . 5.430 5.292 4.875 5.510 0.080 14 0 "[ . 1 . 2]" 1
118 1 15 ILE MG 1 58 LEU H . . 4.890 3.248 2.938 3.524 . 0 0 "[ . 1 . 2]" 1
119 1 15 ILE MG 1 58 LEU HA . . 5.430 4.381 4.019 4.854 . 0 0 "[ . 1 . 2]" 1
120 1 15 ILE MG 1 58 LEU QB . . 3.750 2.462 2.121 2.946 . 0 0 "[ . 1 . 2]" 1
121 1 15 ILE MG 1 58 LEU QD . . 4.600 3.127 2.786 3.552 . 0 0 "[ . 1 . 2]" 1
122 1 15 ILE MG 1 95 LEU H . . 4.920 4.354 4.089 4.672 . 0 0 "[ . 1 . 2]" 1
123 1 16 GLN H 1 16 GLN QG . . 4.760 2.768 2.555 2.939 . 0 0 "[ . 1 . 2]" 1
124 1 16 GLN H 1 17 LEU H . . 5.260 4.405 4.354 4.453 . 0 0 "[ . 1 . 2]" 1
125 1 16 GLN H 1 17 LEU QD . . 5.300 3.705 3.379 4.197 . 0 0 "[ . 1 . 2]" 1
126 1 16 GLN HA 1 17 LEU H . . 3.550 2.106 2.069 2.153 . 0 0 "[ . 1 . 2]" 1
127 1 16 GLN HA 1 92 THR MG . . 4.570 4.450 4.291 4.577 0.007 20 0 "[ . 1 . 2]" 1
128 1 16 GLN HA 1 93 VAL H . . 4.790 4.023 3.823 4.166 . 0 0 "[ . 1 . 2]" 1
129 1 16 GLN HA 1 94 SER HA . . 5.500 2.221 2.112 2.410 . 0 0 "[ . 1 . 2]" 1
130 1 16 GLN HA 1 95 LEU H . . 4.460 3.270 3.080 3.509 . 0 0 "[ . 1 . 2]" 1
131 1 16 GLN HA 1 95 LEU QD . . 5.440 4.257 3.294 4.942 . 0 0 "[ . 1 . 2]" 1
132 1 16 GLN HB2 1 17 LEU H . . 5.010 4.180 4.076 4.227 . 0 0 "[ . 1 . 2]" 1
133 1 16 GLN HB2 1 92 THR MG . . 4.220 3.684 3.367 4.084 . 0 0 "[ . 1 . 2]" 1
134 1 16 GLN HB3 1 17 LEU H . . 4.630 3.213 3.017 3.306 . 0 0 "[ . 1 . 2]" 1
135 1 16 GLN HB3 1 92 THR MG . . 3.780 2.676 2.526 2.860 . 0 0 "[ . 1 . 2]" 1
136 1 16 GLN HB3 1 94 SER HA . . 5.300 4.128 3.833 4.408 . 0 0 "[ . 1 . 2]" 1
137 1 16 GLN QE 1 92 THR MG . . 4.600 3.170 2.276 4.329 . 0 0 "[ . 1 . 2]" 1
138 1 16 GLN HE21 1 92 THR HB . . 5.500 3.058 2.383 4.401 . 0 0 "[ . 1 . 2]" 1
139 1 16 GLN HE21 1 92 THR MG . . 5.350 3.439 2.320 4.938 . 0 0 "[ . 1 . 2]" 1
140 1 16 GLN HE22 1 92 THR HB . . 5.500 4.172 3.564 5.167 . 0 0 "[ . 1 . 2]" 1
141 1 16 GLN HE22 1 92 THR MG . . 5.350 3.787 3.192 4.789 . 0 0 "[ . 1 . 2]" 1
142 1 16 GLN QG 1 17 LEU H . . 4.520 3.977 3.807 4.125 . 0 0 "[ . 1 . 2]" 1
143 1 16 GLN QG 1 92 THR HB . . 5.340 3.388 3.219 3.706 . 0 0 "[ . 1 . 2]" 1
144 1 16 GLN QG 1 92 THR MG . . 3.970 4.061 4.022 4.103 0.133 7 0 "[ . 1 . 2]" 1
145 1 16 GLN QG 1 93 VAL H . . 5.020 4.827 4.515 5.044 0.024 12 0 "[ . 1 . 2]" 1
146 1 16 GLN QG 1 93 VAL HA . . 5.220 5.068 4.687 5.285 0.065 2 0 "[ . 1 . 2]" 1
147 1 16 GLN QG 1 94 SER HA . . 4.550 2.642 2.232 3.143 . 0 0 "[ . 1 . 2]" 1
148 1 16 GLN QG 1 94 SER QB . . 4.370 2.714 1.978 3.276 . 0 0 "[ . 1 . 2]" 1
149 1 17 LEU H 1 24 LEU QD . . 5.060 4.209 3.841 4.798 . 0 0 "[ . 1 . 2]" 1
150 1 17 LEU H 1 92 THR HA . . 5.270 3.944 3.711 4.137 . 0 0 "[ . 1 . 2]" 1
151 1 17 LEU H 1 92 THR HB . . 5.500 3.809 3.343 4.322 . 0 0 "[ . 1 . 2]" 1
152 1 17 LEU H 1 92 THR MG . . 4.140 3.927 3.714 4.157 0.017 2 0 "[ . 1 . 2]" 1
153 1 17 LEU H 1 93 VAL H . . 4.020 2.593 2.412 2.762 . 0 0 "[ . 1 . 2]" 1
154 1 17 LEU H 1 93 VAL HB . . 4.380 3.499 3.234 3.934 . 0 0 "[ . 1 . 2]" 1
155 1 17 LEU H 1 94 SER HA . . 5.500 3.619 3.412 3.833 . 0 0 "[ . 1 . 2]" 1
156 1 17 LEU H 1 95 LEU QD . . 5.280 3.907 3.103 4.723 . 0 0 "[ . 1 . 2]" 1
157 1 17 LEU HA 1 17 LEU QD . . 3.530 2.259 2.044 3.040 . 0 0 "[ . 1 . 2]" 1
158 1 17 LEU HA 1 51 ALA MB . . 4.820 2.971 2.419 3.520 . 0 0 "[ . 1 . 2]" 1
159 1 17 LEU HB2 1 18 LYS H . . 4.560 4.041 3.983 4.097 . 0 0 "[ . 1 . 2]" 1
160 1 17 LEU HB2 1 93 VAL H . . 4.230 3.650 3.384 3.906 . 0 0 "[ . 1 . 2]" 1
161 1 17 LEU HB2 1 93 VAL HB . . 5.220 3.247 2.614 3.874 . 0 0 "[ . 1 . 2]" 1
162 1 17 LEU HB3 1 18 LYS H . . 4.210 3.064 3.003 3.133 . 0 0 "[ . 1 . 2]" 1
163 1 17 LEU HB3 1 26 PHE QE . . 4.610 4.276 3.316 4.643 0.033 8 0 "[ . 1 . 2]" 1
164 1 17 LEU HB3 1 51 ALA MB . . 3.750 2.073 1.899 2.486 . 0 0 "[ . 1 . 2]" 1
165 1 17 LEU HB3 1 52 ALA HA . . 4.980 4.567 4.309 4.849 . 0 0 "[ . 1 . 2]" 1
166 1 17 LEU HB3 1 93 VAL H . . 4.910 4.759 4.449 4.924 0.014 11 0 "[ . 1 . 2]" 1
167 1 17 LEU HB3 1 93 VAL HB . . 5.500 4.802 4.097 5.334 . 0 0 "[ . 1 . 2]" 1
168 1 17 LEU QD 1 26 PHE HB3 . . 5.420 4.864 4.314 5.430 0.010 15 0 "[ . 1 . 2]" 1
169 1 17 LEU QD 1 26 PHE QD . . 5.140 3.533 2.820 4.284 . 0 0 "[ . 1 . 2]" 1
170 1 17 LEU QD 1 51 ALA HA . . 4.920 3.825 3.482 4.244 . 0 0 "[ . 1 . 2]" 1
171 1 17 LEU QD 1 52 ALA H . . 4.180 2.923 2.447 3.583 . 0 0 "[ . 1 . 2]" 1
172 1 17 LEU QD 1 52 ALA HA . . 3.800 2.007 1.880 2.185 . 0 0 "[ . 1 . 2]" 1
173 1 17 LEU QD 1 52 ALA MB . . 3.330 2.533 2.015 3.020 . 0 0 "[ . 1 . 2]" 1
174 1 17 LEU QD 1 54 GLN H . . 5.000 4.761 4.375 5.060 0.060 18 0 "[ . 1 . 2]" 1
175 1 17 LEU QD 1 55 ASP H . . 4.570 3.813 3.398 4.558 . 0 0 "[ . 1 . 2]" 1
176 1 17 LEU QD 1 55 ASP QB . . 3.800 2.556 2.092 3.393 . 0 0 "[ . 1 . 2]" 1
177 1 17 LEU QD 1 56 GLY H . . 4.960 4.525 4.011 5.049 0.089 8 0 "[ . 1 . 2]" 1
178 1 17 LEU QD 1 58 LEU H . . 5.440 4.285 3.938 4.820 . 0 0 "[ . 1 . 2]" 1
179 1 17 LEU QD 1 58 LEU QD . . 3.940 2.239 1.984 2.737 . 0 0 "[ . 1 . 2]" 1
180 1 17 LEU HG 1 52 ALA H . . 5.500 4.362 3.278 5.523 0.023 19 0 "[ . 1 . 2]" 1
181 1 18 LYS H 1 18 LYS HB2 . . 3.970 3.234 2.813 3.732 . 0 0 "[ . 1 . 2]" 1
182 1 18 LYS H 1 18 LYS HB3 . . 3.950 2.649 2.366 2.986 . 0 0 "[ . 1 . 2]" 1
183 1 18 LYS H 1 18 LYS HG2 . . 5.280 3.432 1.954 4.416 . 0 0 "[ . 1 . 2]" 1
184 1 18 LYS H 1 18 LYS QG . . 4.440 3.196 1.921 4.024 . 0 0 "[ . 1 . 2]" 1
185 1 18 LYS H 1 18 LYS HG3 . . 5.280 3.951 2.833 4.676 . 0 0 "[ . 1 . 2]" 1
186 1 18 LYS H 1 51 ALA MB . . 3.640 2.631 2.154 3.163 . 0 0 "[ . 1 . 2]" 1
187 1 18 LYS HA 1 18 LYS QE . . 4.560 4.401 4.112 4.632 0.072 4 0 "[ . 1 . 2]" 1
188 1 18 LYS HA 1 19 LYS HB2 . . 5.440 4.283 3.999 4.450 . 0 0 "[ . 1 . 2]" 1
189 1 18 LYS HA 1 19 LYS HB3 . . 5.500 5.531 5.232 5.598 0.098 3 0 "[ . 1 . 2]" 1
190 1 18 LYS HA 1 19 LYS HD3 . . 5.500 3.835 3.107 5.170 . 0 0 "[ . 1 . 2]" 1
191 1 18 LYS HA 1 19 LYS QE . . 4.110 2.773 2.177 3.227 . 0 0 "[ . 1 . 2]" 1
192 1 18 LYS HA 1 24 LEU QD . . 4.690 4.481 3.918 4.749 0.059 7 0 "[ . 1 . 2]" 1
193 1 18 LYS HA 1 91 GLY H . . 5.500 5.171 4.633 5.504 0.004 6 0 "[ . 1 . 2]" 1
194 1 18 LYS HA 1 91 GLY HA2 . . 4.760 4.151 3.938 4.444 . 0 0 "[ . 1 . 2]" 1
195 1 18 LYS HA 1 91 GLY HA3 . . 5.500 4.830 4.630 4.927 . 0 0 "[ . 1 . 2]" 1
196 1 18 LYS HA 1 92 THR H . . 5.280 4.500 4.195 4.879 . 0 0 "[ . 1 . 2]" 1
197 1 18 LYS HA 1 92 THR HA . . 4.030 2.399 2.076 2.835 . 0 0 "[ . 1 . 2]" 1
198 1 18 LYS HA 1 92 THR HB . . 5.500 4.721 4.406 5.210 . 0 0 "[ . 1 . 2]" 1
199 1 18 LYS HA 1 92 THR MG . . 4.050 3.104 2.689 3.554 . 0 0 "[ . 1 . 2]" 1
200 1 18 LYS HB2 1 18 LYS QE . . 4.980 2.828 1.918 3.930 . 0 0 "[ . 1 . 2]" 1
201 1 18 LYS HB2 1 19 LYS H . . 5.080 3.575 2.785 4.180 . 0 0 "[ . 1 . 2]" 1
202 1 18 LYS HB2 1 91 GLY HA2 . . 5.390 4.740 3.483 5.371 . 0 0 "[ . 1 . 2]" 1
203 1 18 LYS HB2 1 91 GLY HA3 . . 5.500 5.213 4.190 5.456 . 0 0 "[ . 1 . 2]" 1
204 1 18 LYS HB3 1 19 LYS H . . 5.000 4.002 3.894 4.133 . 0 0 "[ . 1 . 2]" 1
205 1 18 LYS HB3 1 19 LYS QE . . 5.330 5.101 4.665 5.428 0.098 18 0 "[ . 1 . 2]" 1
206 1 18 LYS HB3 1 92 THR HA . . 5.030 4.281 3.072 5.048 0.018 2 0 "[ . 1 . 2]" 1
207 1 18 LYS QE 1 18 LYS QG . . 3.260 2.391 2.094 2.830 . 0 0 "[ . 1 . 2]" 1
208 1 18 LYS QG 1 19 LYS H . . 4.040 3.065 2.377 3.866 . 0 0 "[ . 1 . 2]" 1
209 1 18 LYS QG 1 20 GLY QA . . 4.230 4.204 3.820 4.319 0.089 15 0 "[ . 1 . 2]" 1
210 1 18 LYS HG2 1 19 LYS H . . 4.810 3.695 2.741 4.873 0.063 1 0 "[ . 1 . 2]" 1
211 1 18 LYS HG2 1 92 THR HA . . 5.500 5.251 4.922 5.500 0.000 5 0 "[ . 1 . 2]" 1
212 1 18 LYS HG3 1 19 LYS H . . 4.810 3.319 2.600 4.056 . 0 0 "[ . 1 . 2]" 1
213 1 18 LYS HG3 1 92 THR HA . . 5.500 4.693 3.931 5.650 0.150 18 0 "[ . 1 . 2]" 1
214 1 19 LYS H 1 19 LYS HB2 . . 4.000 2.269 2.028 2.415 . 0 0 "[ . 1 . 2]" 1
215 1 19 LYS H 1 19 LYS HB3 . . 3.930 3.508 3.110 3.626 . 0 0 "[ . 1 . 2]" 1
216 1 19 LYS H 1 19 LYS HD3 . . 5.430 3.007 2.387 4.135 . 0 0 "[ . 1 . 2]" 1
217 1 19 LYS H 1 19 LYS HG3 . . 5.500 4.162 3.891 4.534 . 0 0 "[ . 1 . 2]" 1
218 1 19 LYS H 1 20 GLY H . . 5.010 4.407 4.325 4.485 . 0 0 "[ . 1 . 2]" 1
219 1 19 LYS H 1 24 LEU QD . . 4.680 4.348 3.875 4.666 . 0 0 "[ . 1 . 2]" 1
220 1 19 LYS H 1 91 GLY H . . 5.500 4.833 3.862 5.528 0.028 3 0 "[ . 1 . 2]" 1
221 1 19 LYS H 1 91 GLY HA2 . . 5.500 3.712 3.284 4.019 . 0 0 "[ . 1 . 2]" 1
222 1 19 LYS H 1 92 THR HA . . 4.550 4.061 3.522 4.473 . 0 0 "[ . 1 . 2]" 1
223 1 19 LYS H 1 92 THR MG . . 5.100 4.734 4.229 5.096 . 0 0 "[ . 1 . 2]" 1
224 1 19 LYS H 1 93 VAL H . . 5.180 5.091 4.834 5.270 0.090 10 0 "[ . 1 . 2]" 1
225 1 19 LYS H 1 93 VAL QG . . 5.160 4.601 3.911 4.975 . 0 0 "[ . 1 . 2]" 1
226 1 19 LYS HA 1 19 LYS HD3 . . 4.130 2.422 1.969 2.763 . 0 0 "[ . 1 . 2]" 1
227 1 19 LYS HA 1 20 GLY H . . 3.390 2.010 1.936 2.060 . 0 0 "[ . 1 . 2]" 1
228 1 19 LYS HA 1 24 LEU QD . . 4.050 3.433 3.123 3.699 . 0 0 "[ . 1 . 2]" 1
229 1 19 LYS HA 1 51 ALA MB . . 4.450 3.360 2.661 3.861 . 0 0 "[ . 1 . 2]" 1
230 1 19 LYS HB2 1 20 GLY H . . 5.030 4.329 4.065 4.477 . 0 0 "[ . 1 . 2]" 1
231 1 19 LYS HB3 1 19 LYS HD3 . . 4.160 3.745 3.682 3.812 . 0 0 "[ . 1 . 2]" 1
232 1 19 LYS HB3 1 20 GLY H . . 5.230 3.385 2.906 3.819 . 0 0 "[ . 1 . 2]" 1
233 1 19 LYS HB3 1 23 GLY QA . . 5.340 2.854 2.147 4.591 . 0 0 "[ . 1 . 2]" 1
234 1 19 LYS HD3 1 20 GLY H . . 4.650 4.313 3.389 4.720 0.070 3 0 "[ . 1 . 2]" 1
235 1 19 LYS HD3 1 23 GLY QA . . 4.710 3.986 3.008 4.626 . 0 0 "[ . 1 . 2]" 1
236 1 19 LYS HD3 1 24 LEU HA . . 4.090 3.536 2.768 4.066 . 0 0 "[ . 1 . 2]" 1
237 1 19 LYS HD3 1 24 LEU MD1 . . 4.400 2.778 1.928 4.412 0.012 18 0 "[ . 1 . 2]" 1
238 1 19 LYS HD3 1 24 LEU QD . . 3.590 2.189 1.926 2.455 . 0 0 "[ . 1 . 2]" 1
239 1 19 LYS HD3 1 24 LEU MD2 . . 4.400 2.857 2.077 4.383 . 0 0 "[ . 1 . 2]" 1
240 1 19 LYS QE 1 24 LEU QD . . 3.100 2.869 1.929 3.271 0.171 10 0 "[ . 1 . 2]" 1
241 1 19 LYS QE 1 91 GLY H . . 5.340 3.494 2.743 4.159 . 0 0 "[ . 1 . 2]" 1
242 1 19 LYS QE 1 91 GLY HA2 . . 5.060 3.687 2.525 4.288 . 0 0 "[ . 1 . 2]" 1
243 1 19 LYS HG3 1 20 GLY H . . 4.850 3.862 3.406 4.061 . 0 0 "[ . 1 . 2]" 1
244 1 19 LYS HG3 1 23 GLY H . . 5.500 4.472 3.731 4.893 . 0 0 "[ . 1 . 2]" 1
245 1 19 LYS HG3 1 23 GLY QA . . 5.070 2.281 1.884 2.594 . 0 0 "[ . 1 . 2]" 1
246 1 19 LYS HG3 1 51 ALA MB . . 5.430 5.028 4.132 5.453 0.023 3 0 "[ . 1 . 2]" 1
247 1 20 GLY H 1 22 GLU H . . 5.500 4.008 3.686 4.313 . 0 0 "[ . 1 . 2]" 1
248 1 20 GLY H 1 24 LEU HA . . 4.670 4.478 4.112 4.729 0.059 17 0 "[ . 1 . 2]" 1
249 1 20 GLY H 1 24 LEU QD . . 4.800 4.592 4.283 4.810 0.010 9 0 "[ . 1 . 2]" 1
250 1 20 GLY H 1 51 ALA MB . . 4.690 3.360 2.894 3.880 . 0 0 "[ . 1 . 2]" 1
251 1 20 GLY QA 1 21 THR MG . . 5.340 4.362 3.450 5.044 . 0 0 "[ . 1 . 2]" 1
252 1 21 THR HA 1 21 THR MG . . 3.300 2.386 2.224 3.244 . 0 0 "[ . 1 . 2]" 1
253 1 21 THR HA 1 22 GLU QG . . 5.340 5.059 4.794 5.467 0.127 20 0 "[ . 1 . 2]" 1
254 1 22 GLU H 1 22 GLU HG2 . . 5.280 2.760 2.162 4.135 . 0 0 "[ . 1 . 2]" 1
255 1 22 GLU H 1 22 GLU HG3 . . 5.280 3.727 2.788 3.972 . 0 0 "[ . 1 . 2]" 1
256 1 22 GLU H 1 23 GLY H . . 5.050 2.394 2.208 2.515 . 0 0 "[ . 1 . 2]" 1
257 1 22 GLU H 1 50 GLY HA2 . . 4.710 3.432 2.858 3.777 . 0 0 "[ . 1 . 2]" 1
258 1 22 GLU HA 1 22 GLU QG . . 3.520 2.903 2.395 3.162 . 0 0 "[ . 1 . 2]" 1
259 1 22 GLU QB 1 50 GLY H . . 4.820 4.037 3.306 4.852 0.032 9 0 "[ . 1 . 2]" 1
260 1 22 GLU QB 1 50 GLY HA2 . . 3.730 2.281 1.865 2.920 . 0 0 "[ . 1 . 2]" 1
261 1 22 GLU QB 1 50 GLY HA3 . . 4.250 2.673 2.493 2.889 . 0 0 "[ . 1 . 2]" 1
262 1 22 GLU QB 1 51 ALA H . . 4.510 3.885 3.454 4.523 0.013 14 0 "[ . 1 . 2]" 1
263 1 22 GLU HB2 1 23 GLY H . . 5.390 3.626 3.213 3.784 . 0 0 "[ . 1 . 2]" 1
264 1 22 GLU HB2 1 50 GLY HA2 . . 4.300 2.298 1.872 2.953 . 0 0 "[ . 1 . 2]" 1
265 1 22 GLU HB2 1 50 GLY HA3 . . 4.920 2.737 2.545 2.946 . 0 0 "[ . 1 . 2]" 1
266 1 22 GLU HB3 1 23 GLY H . . 5.390 4.329 4.198 4.401 . 0 0 "[ . 1 . 2]" 1
267 1 22 GLU HB3 1 50 GLY HA2 . . 4.300 3.885 3.466 4.603 0.303 9 0 "[ . 1 . 2]" 1
268 1 22 GLU HB3 1 50 GLY HA3 . . 4.920 3.762 3.306 4.288 . 0 0 "[ . 1 . 2]" 1
269 1 22 GLU QG 1 23 GLY H . . 5.340 4.438 4.022 4.774 . 0 0 "[ . 1 . 2]" 1
270 1 22 GLU QG 1 50 GLY HA2 . . 3.950 3.282 2.512 4.091 0.141 9 0 "[ . 1 . 2]" 1
271 1 23 GLY QA 1 24 LEU QD . . 5.280 3.194 2.821 4.054 . 0 0 "[ . 1 . 2]" 1
272 1 23 GLY QA 1 87 THR MG . . 4.510 3.547 2.337 4.526 0.016 6 0 "[ . 1 . 2]" 1
273 1 24 LEU HA 1 24 LEU MD1 . . 4.710 2.507 1.985 3.870 . 0 0 "[ . 1 . 2]" 1
274 1 24 LEU HA 1 24 LEU QD . . 3.300 2.019 1.944 2.280 . 0 0 "[ . 1 . 2]" 1
275 1 24 LEU HA 1 24 LEU MD2 . . 4.710 2.737 1.964 3.846 . 0 0 "[ . 1 . 2]" 1
276 1 24 LEU HA 1 26 PHE QD . . 4.140 4.056 3.845 4.222 0.082 14 0 "[ . 1 . 2]" 1
277 1 24 LEU HA 1 26 PHE QE . . 4.620 3.856 3.612 4.217 . 0 0 "[ . 1 . 2]" 1
278 1 24 LEU HA 1 51 ALA MB . . 3.680 2.588 2.095 2.896 . 0 0 "[ . 1 . 2]" 1
279 1 24 LEU HA 1 52 ALA H . . 5.500 3.891 3.373 4.297 . 0 0 "[ . 1 . 2]" 1
280 1 24 LEU QB 1 25 GLY HA3 . . 5.340 4.294 4.219 4.417 . 0 0 "[ . 1 . 2]" 1
281 1 24 LEU QB 1 26 PHE H . . 4.210 2.745 2.561 2.995 . 0 0 "[ . 1 . 2]" 1
282 1 24 LEU QB 1 26 PHE QD . . 3.760 2.281 2.142 2.519 . 0 0 "[ . 1 . 2]" 1
283 1 24 LEU QB 1 26 PHE QE . . 3.360 1.942 1.870 2.072 . 0 0 "[ . 1 . 2]" 1
284 1 24 LEU HB2 1 26 PHE H . . 4.870 2.960 2.712 3.329 . 0 0 "[ . 1 . 2]" 1
285 1 24 LEU HB2 1 26 PHE QD . . 4.560 3.471 3.124 3.705 . 0 0 "[ . 1 . 2]" 1
286 1 24 LEU HB2 1 26 PHE QE . . 3.980 3.503 3.069 3.671 . 0 0 "[ . 1 . 2]" 1
287 1 24 LEU HB3 1 26 PHE H . . 4.870 3.270 3.005 3.808 . 0 0 "[ . 1 . 2]" 1
288 1 24 LEU HB3 1 26 PHE QD . . 4.560 2.316 2.165 2.563 . 0 0 "[ . 1 . 2]" 1
289 1 24 LEU HB3 1 26 PHE QE . . 3.980 1.952 1.882 2.084 . 0 0 "[ . 1 . 2]" 1
290 1 24 LEU QD 1 26 PHE QD . . 4.330 3.718 3.371 4.021 . 0 0 "[ . 1 . 2]" 1
291 1 24 LEU QD 1 26 PHE QE . . 3.260 2.173 1.944 2.433 . 0 0 "[ . 1 . 2]" 1
292 1 24 LEU QD 1 26 PHE HZ . . 3.450 3.233 2.510 3.504 0.054 1 0 "[ . 1 . 2]" 1
293 1 24 LEU QD 1 51 ALA MB . . 3.150 3.154 2.638 3.253 0.103 12 0 "[ . 1 . 2]" 1
294 1 24 LEU QD 1 93 VAL HB . . 3.770 2.651 2.165 3.270 . 0 0 "[ . 1 . 2]" 1
295 1 24 LEU MD1 1 93 VAL HB . . 4.630 2.958 2.174 4.507 . 0 0 "[ . 1 . 2]" 1
296 1 24 LEU MD2 1 93 VAL HB . . 4.630 3.968 2.250 4.661 0.031 5 0 "[ . 1 . 2]" 1
297 1 25 GLY H 1 26 PHE H . . 4.480 2.353 2.249 2.553 . 0 0 "[ . 1 . 2]" 1
298 1 25 GLY HA2 1 47 LEU H . . 5.400 4.167 3.877 4.410 . 0 0 "[ . 1 . 2]" 1
299 1 25 GLY HA2 1 47 LEU QB . . 4.420 2.735 2.353 2.975 . 0 0 "[ . 1 . 2]" 1
300 1 25 GLY HA2 1 49 ARG H . . 5.500 5.213 4.620 5.787 0.287 9 0 "[ . 1 . 2]" 1
301 1 25 GLY HA2 1 50 GLY HA2 . . 4.770 4.291 3.657 4.859 0.089 18 0 "[ . 1 . 2]" 1
302 1 25 GLY HA2 1 50 GLY HA3 . . 5.350 2.932 2.285 3.419 . 0 0 "[ . 1 . 2]" 1
303 1 25 GLY HA2 1 51 ALA MB . . 5.500 5.569 5.206 5.994 0.494 13 0 "[ . 1 . 2]" 1
304 1 25 GLY HA2 1 52 ALA H . . 4.750 4.860 4.555 5.151 0.401 19 0 "[ . 1 . 2]" 1
305 1 25 GLY HA2 1 52 ALA MB . . 4.600 4.571 4.252 4.895 0.295 19 0 "[ . 1 . 2]" 1
306 1 25 GLY HA3 1 46 ILE MG . . 5.270 4.843 4.519 5.170 . 0 0 "[ . 1 . 2]" 1
307 1 25 GLY HA3 1 47 LEU QB . . 4.760 3.377 3.000 3.629 . 0 0 "[ . 1 . 2]" 1
308 1 25 GLY HA3 1 50 GLY HA2 . . 4.500 3.558 3.292 3.811 . 0 0 "[ . 1 . 2]" 1
309 1 25 GLY HA3 1 50 GLY HA3 . . 4.660 1.984 1.864 2.201 . 0 0 "[ . 1 . 2]" 1
310 1 25 GLY HA3 1 51 ALA MB . . 5.480 4.390 4.023 4.820 . 0 0 "[ . 1 . 2]" 1
311 1 25 GLY HA3 1 52 ALA H . . 4.550 3.182 2.827 3.543 . 0 0 "[ . 1 . 2]" 1
312 1 26 PHE H 1 26 PHE QD . . 4.320 2.692 2.527 2.798 . 0 0 "[ . 1 . 2]" 1
313 1 26 PHE H 1 27 SER H . . 5.500 4.281 4.241 4.324 . 0 0 "[ . 1 . 2]" 1
314 1 26 PHE H 1 47 LEU H . . 5.500 4.624 4.355 4.797 . 0 0 "[ . 1 . 2]" 1
315 1 26 PHE HA 1 26 PHE QD . . 4.120 3.752 3.727 3.768 . 0 0 "[ . 1 . 2]" 1
316 1 26 PHE HA 1 43 VAL QG . . 5.010 3.993 3.825 4.290 . 0 0 "[ . 1 . 2]" 1
317 1 26 PHE HA 1 45 ASN H . . 5.470 4.533 4.232 4.834 . 0 0 "[ . 1 . 2]" 1
318 1 26 PHE HA 1 46 ILE HA . . 4.200 2.768 2.447 2.962 . 0 0 "[ . 1 . 2]" 1
319 1 26 PHE HA 1 46 ILE MD . . 4.660 3.540 3.348 3.680 . 0 0 "[ . 1 . 2]" 1
320 1 26 PHE HA 1 46 ILE MG . . 5.450 4.369 3.946 4.632 . 0 0 "[ . 1 . 2]" 1
321 1 26 PHE HA 1 47 LEU H . . 4.370 2.707 2.480 2.936 . 0 0 "[ . 1 . 2]" 1
322 1 26 PHE HA 1 52 ALA MB . . 5.460 4.049 3.784 4.561 . 0 0 "[ . 1 . 2]" 1
323 1 26 PHE HB2 1 27 SER H . . 4.310 2.441 2.270 2.678 . 0 0 "[ . 1 . 2]" 1
324 1 26 PHE HB2 1 43 VAL QG . . 4.310 2.272 2.089 2.528 . 0 0 "[ . 1 . 2]" 1
325 1 26 PHE HB2 1 45 ASN H . . 5.500 3.914 3.592 4.201 . 0 0 "[ . 1 . 2]" 1
326 1 26 PHE HB2 1 46 ILE HA . . 5.440 3.090 2.879 3.309 . 0 0 "[ . 1 . 2]" 1
327 1 26 PHE HB2 1 46 ILE MD . . 4.290 2.250 2.139 2.432 . 0 0 "[ . 1 . 2]" 1
328 1 26 PHE HB2 1 47 LEU H . . 5.500 4.379 4.122 4.645 . 0 0 "[ . 1 . 2]" 1
329 1 26 PHE HB2 1 52 ALA MB . . 4.800 3.606 3.353 4.010 . 0 0 "[ . 1 . 2]" 1
330 1 26 PHE HB2 1 58 LEU QD . . 5.270 3.619 3.218 3.936 . 0 0 "[ . 1 . 2]" 1
331 1 26 PHE HB3 1 27 SER H . . 4.570 3.774 3.642 3.872 . 0 0 "[ . 1 . 2]" 1
332 1 26 PHE HB3 1 43 VAL QG . . 4.740 3.420 3.244 3.663 . 0 0 "[ . 1 . 2]" 1
333 1 26 PHE HB3 1 46 ILE HA . . 5.230 2.829 2.674 2.953 . 0 0 "[ . 1 . 2]" 1
334 1 26 PHE HB3 1 46 ILE MD . . 4.170 2.291 2.126 2.427 . 0 0 "[ . 1 . 2]" 1
335 1 26 PHE HB3 1 47 LEU H . . 5.490 3.695 3.501 3.897 . 0 0 "[ . 1 . 2]" 1
336 1 26 PHE HB3 1 52 ALA MB . . 4.470 2.297 2.066 2.703 . 0 0 "[ . 1 . 2]" 1
337 1 26 PHE HB3 1 58 LEU QD . . 4.960 3.338 2.921 3.622 . 0 0 "[ . 1 . 2]" 1
338 1 26 PHE QD 1 27 SER H . . 4.690 3.423 3.194 3.789 . 0 0 "[ . 1 . 2]" 1
339 1 26 PHE QD 1 28 ILE HA . . 5.500 4.362 4.090 4.637 . 0 0 "[ . 1 . 2]" 1
340 1 26 PHE QD 1 28 ILE MG . . 3.190 3.080 2.763 3.181 . 0 0 "[ . 1 . 2]" 1
341 1 26 PHE QD 1 43 VAL HA . . 5.490 3.530 3.197 3.962 . 0 0 "[ . 1 . 2]" 1
342 1 26 PHE QD 1 43 VAL QG . . 3.170 2.010 1.870 2.276 . 0 0 "[ . 1 . 2]" 1
343 1 26 PHE QD 1 46 ILE MD . . 4.230 3.491 3.301 3.633 . 0 0 "[ . 1 . 2]" 1
344 1 26 PHE QD 1 51 ALA MB . . 5.500 4.478 4.057 4.939 . 0 0 "[ . 1 . 2]" 1
345 1 26 PHE QD 1 52 ALA H . . 5.240 3.489 3.194 3.765 . 0 0 "[ . 1 . 2]" 1
346 1 26 PHE QD 1 52 ALA MB . . 3.200 1.977 1.883 2.189 . 0 0 "[ . 1 . 2]" 1
347 1 26 PHE QD 1 58 LEU MD1 . . 3.910 3.999 3.959 4.082 0.172 19 0 "[ . 1 . 2]" 1
348 1 26 PHE QD 1 58 LEU MD2 . . 3.910 2.871 2.637 3.041 . 0 0 "[ . 1 . 2]" 1
349 1 26 PHE QD 1 64 LEU QD . . 5.340 4.594 4.149 4.992 . 0 0 "[ . 1 . 2]" 1
350 1 26 PHE QE 1 28 ILE MD . . 4.950 4.821 4.310 4.980 0.030 2 0 "[ . 1 . 2]" 1
351 1 26 PHE QE 1 28 ILE MG . . 3.070 2.757 2.371 3.080 0.010 3 0 "[ . 1 . 2]" 1
352 1 26 PHE QE 1 58 LEU QD . . 4.300 2.774 2.662 2.840 . 0 0 "[ . 1 . 2]" 1
353 1 26 PHE QE 1 64 LEU QD . . 3.820 2.996 2.566 3.351 . 0 0 "[ . 1 . 2]" 1
354 1 26 PHE QE 1 95 LEU MD1 . . 4.050 2.989 2.480 4.063 0.013 9 0 "[ . 1 . 2]" 1
355 1 26 PHE QE 1 95 LEU QD . . 3.530 2.668 2.388 3.387 . 0 0 "[ . 1 . 2]" 1
356 1 26 PHE QE 1 95 LEU MD2 . . 4.050 3.520 2.484 4.181 0.131 7 0 "[ . 1 . 2]" 1
357 1 26 PHE HZ 1 52 ALA MB . . 4.590 4.683 4.639 4.738 0.148 9 0 "[ . 1 . 2]" 1
358 1 26 PHE HZ 1 58 LEU QD . . 5.150 3.174 2.928 3.328 . 0 0 "[ . 1 . 2]" 1
359 1 26 PHE HZ 1 64 LEU QD . . 4.020 3.720 3.259 4.087 0.067 2 0 "[ . 1 . 2]" 1
360 1 27 SER H 1 43 VAL QG . . 4.830 3.019 2.789 3.382 . 0 0 "[ . 1 . 2]" 1
361 1 27 SER H 1 45 ASN H . . 4.140 2.790 2.618 2.957 . 0 0 "[ . 1 . 2]" 1
362 1 27 SER H 1 45 ASN HB2 . . 5.500 5.061 3.880 5.559 0.059 13 0 "[ . 1 . 2]" 1
363 1 27 SER H 1 45 ASN HB3 . . 5.500 3.890 3.189 5.300 . 0 0 "[ . 1 . 2]" 1
364 1 27 SER H 1 46 ILE HA . . 5.140 3.987 3.534 4.344 . 0 0 "[ . 1 . 2]" 1
365 1 27 SER H 1 46 ILE MD . . 5.500 3.983 3.633 4.237 . 0 0 "[ . 1 . 2]" 1
366 1 27 SER H 1 47 LEU H . . 5.500 4.675 4.299 4.935 . 0 0 "[ . 1 . 2]" 1
367 1 27 SER HA 1 28 ILE HG12 . . 5.500 3.732 3.518 3.867 . 0 0 "[ . 1 . 2]" 1
368 1 27 SER HA 1 28 ILE MG . . 5.450 3.715 3.496 3.876 . 0 0 "[ . 1 . 2]" 1
369 1 27 SER HA 1 44 LYS H . . 5.500 4.759 4.702 4.851 . 0 0 "[ . 1 . 2]" 1
370 1 27 SER QB 1 28 ILE H . . 3.930 2.725 2.385 3.437 . 0 0 "[ . 1 . 2]" 1
371 1 27 SER QB 1 45 ASN H . . 4.750 3.228 2.700 3.768 . 0 0 "[ . 1 . 2]" 1
372 1 27 SER HB2 1 28 ILE H . . 4.630 3.693 3.502 4.002 . 0 0 "[ . 1 . 2]" 1
373 1 27 SER HB2 1 44 LYS HB2 . . 5.500 4.372 3.622 5.529 0.029 20 0 "[ . 1 . 2]" 1
374 1 27 SER HB2 1 44 LYS HB3 . . 5.500 2.849 2.020 4.198 . 0 0 "[ . 1 . 2]" 1
375 1 27 SER HB2 1 45 ASN H . . 5.500 3.645 2.729 5.106 . 0 0 "[ . 1 . 2]" 1
376 1 27 SER HB3 1 28 ILE H . . 4.630 2.833 2.427 3.745 . 0 0 "[ . 1 . 2]" 1
377 1 27 SER HB3 1 44 LYS HB2 . . 5.500 4.208 3.781 5.032 . 0 0 "[ . 1 . 2]" 1
378 1 27 SER HB3 1 44 LYS HB3 . . 5.500 3.034 2.167 3.870 . 0 0 "[ . 1 . 2]" 1
379 1 27 SER HB3 1 45 ASN H . . 5.500 4.412 2.946 5.335 . 0 0 "[ . 1 . 2]" 1
380 1 28 ILE H 1 28 ILE MD . . 4.640 3.797 3.701 3.856 . 0 0 "[ . 1 . 2]" 1
381 1 28 ILE H 1 28 ILE HG12 . . 4.530 2.114 1.987 2.187 . 0 0 "[ . 1 . 2]" 1
382 1 28 ILE H 1 28 ILE HG13 . . 4.270 2.766 2.672 2.852 . 0 0 "[ . 1 . 2]" 1
383 1 28 ILE H 1 28 ILE MG . . 4.590 3.076 2.996 3.151 . 0 0 "[ . 1 . 2]" 1
384 1 28 ILE HA 1 41 ILE MG . . 4.000 3.429 3.175 3.609 . 0 0 "[ . 1 . 2]" 1
385 1 28 ILE HA 1 43 VAL HA . . 4.270 2.219 2.073 2.388 . 0 0 "[ . 1 . 2]" 1
386 1 28 ILE HA 1 43 VAL QG . . 4.560 3.448 3.314 3.604 . 0 0 "[ . 1 . 2]" 1
387 1 28 ILE HA 1 44 LYS H . . 4.330 2.034 1.908 2.220 . 0 0 "[ . 1 . 2]" 1
388 1 28 ILE HA 1 44 LYS HB2 . . 5.500 3.261 2.962 3.594 . 0 0 "[ . 1 . 2]" 1
389 1 28 ILE HA 1 44 LYS HB3 . . 5.500 3.673 3.388 4.068 . 0 0 "[ . 1 . 2]" 1
390 1 28 ILE HA 1 45 ASN H . . 5.400 4.362 4.153 4.632 . 0 0 "[ . 1 . 2]" 1
391 1 28 ILE HA 1 64 LEU HB2 . . 5.500 5.640 5.572 5.675 0.175 4 0 "[ . 1 . 2]" 1
392 1 28 ILE HB 1 28 ILE MD . . 3.600 2.466 2.411 2.518 . 0 0 "[ . 1 . 2]" 1
393 1 28 ILE HB 1 29 THR H . . 3.980 2.697 2.550 2.916 . 0 0 "[ . 1 . 2]" 1
394 1 28 ILE HB 1 41 ILE MD . . 4.650 2.780 2.219 3.238 . 0 0 "[ . 1 . 2]" 1
395 1 28 ILE HB 1 41 ILE MG . . 3.450 1.746 1.671 1.819 . 0 0 "[ . 1 . 2]" 1
396 1 28 ILE HB 1 42 TYR H . . 5.500 3.936 3.700 4.301 . 0 0 "[ . 1 . 2]" 1
397 1 28 ILE HB 1 44 LYS H . . 5.500 4.460 4.330 4.677 . 0 0 "[ . 1 . 2]" 1
398 1 28 ILE MD 1 29 THR H . . 4.890 4.620 4.513 4.771 . 0 0 "[ . 1 . 2]" 1
399 1 28 ILE MD 1 41 ILE HA . . 5.500 4.934 4.672 5.506 0.006 4 0 "[ . 1 . 2]" 1
400 1 28 ILE MD 1 80 VAL H . . 5.440 4.990 4.538 5.433 . 0 0 "[ . 1 . 2]" 1
401 1 28 ILE MD 1 80 VAL HB . . 3.570 3.236 2.753 3.609 0.039 1 0 "[ . 1 . 2]" 1
402 1 28 ILE MD 1 81 VAL H . . 4.490 3.525 3.148 3.773 . 0 0 "[ . 1 . 2]" 1
403 1 28 ILE MD 1 81 VAL HA . . 3.340 1.876 1.809 1.989 . 0 0 "[ . 1 . 2]" 1
404 1 28 ILE MD 1 82 SER H . . 5.000 4.773 4.562 4.902 . 0 0 "[ . 1 . 2]" 1
405 1 28 ILE MD 1 83 LEU HB2 . . 5.500 4.460 4.288 4.560 . 0 0 "[ . 1 . 2]" 1
406 1 28 ILE MD 1 83 LEU HB3 . . 5.500 5.561 5.502 5.613 0.113 10 0 "[ . 1 . 2]" 1
407 1 28 ILE MD 1 84 LEU H . . 4.010 3.422 3.245 3.543 . 0 0 "[ . 1 . 2]" 1
408 1 28 ILE MD 1 84 LEU HA . . 4.690 4.607 4.451 4.721 0.031 20 0 "[ . 1 . 2]" 1
409 1 28 ILE MD 1 84 LEU HB2 . . 3.480 2.271 2.041 2.517 . 0 0 "[ . 1 . 2]" 1
410 1 28 ILE MD 1 84 LEU HG . . 3.730 2.291 1.934 3.802 0.072 9 0 "[ . 1 . 2]" 1
411 1 28 ILE MD 1 85 ARG H . . 5.060 4.414 4.087 4.782 . 0 0 "[ . 1 . 2]" 1
412 1 28 ILE HG12 1 29 THR H . . 5.060 4.905 4.851 4.985 . 0 0 "[ . 1 . 2]" 1
413 1 28 ILE HG13 1 29 THR H . . 3.900 3.959 3.925 4.004 0.104 10 0 "[ . 1 . 2]" 1
414 1 28 ILE HG13 1 44 LYS H . . 5.330 5.418 5.371 5.456 0.126 10 0 "[ . 1 . 2]" 1
415 1 28 ILE HG13 1 84 LEU HB2 . . 5.500 4.249 3.913 4.732 . 0 0 "[ . 1 . 2]" 1
416 1 28 ILE HG13 1 84 LEU HB3 . . 5.500 5.028 4.668 5.503 0.003 4 0 "[ . 1 . 2]" 1
417 1 28 ILE MG 1 29 THR H . . 4.060 3.613 3.514 3.802 . 0 0 "[ . 1 . 2]" 1
418 1 28 ILE MG 1 41 ILE HB . . 4.120 4.235 4.166 4.281 0.161 12 0 "[ . 1 . 2]" 1
419 1 28 ILE MG 1 43 VAL HA . . 4.050 2.600 2.331 2.898 . 0 0 "[ . 1 . 2]" 1
420 1 28 ILE MG 1 44 LYS H . . 4.660 3.676 3.541 3.861 . 0 0 "[ . 1 . 2]" 1
421 1 28 ILE MG 1 64 LEU H . . 4.930 4.582 4.290 4.907 . 0 0 "[ . 1 . 2]" 1
422 1 28 ILE MG 1 64 LEU HB3 . . 4.070 3.778 3.560 4.097 0.027 17 0 "[ . 1 . 2]" 1
423 1 28 ILE MG 1 80 VAL HB . . 4.880 4.823 4.379 4.973 0.093 1 0 "[ . 1 . 2]" 1
424 1 29 THR H 1 30 SER HA . . 5.500 4.677 4.555 4.771 . 0 0 "[ . 1 . 2]" 1
425 1 29 THR H 1 41 ILE HA . . 5.420 4.316 4.058 4.926 . 0 0 "[ . 1 . 2]" 1
426 1 29 THR H 1 41 ILE MG . . 4.030 2.914 2.444 3.176 . 0 0 "[ . 1 . 2]" 1
427 1 29 THR H 1 42 TYR H . . 4.690 2.907 2.711 3.194 . 0 0 "[ . 1 . 2]" 1
428 1 29 THR H 1 43 VAL HA . . 4.590 3.533 3.391 3.743 . 0 0 "[ . 1 . 2]" 1
429 1 29 THR H 1 44 LYS H . . 5.270 3.180 3.122 3.238 . 0 0 "[ . 1 . 2]" 1
430 1 29 THR H 1 44 LYS HA . . 5.500 4.056 3.804 4.408 . 0 0 "[ . 1 . 2]" 1
431 1 29 THR HB 1 30 SER H . . 4.560 3.908 3.831 4.022 . 0 0 "[ . 1 . 2]" 1
432 1 29 THR HB 1 44 LYS HB2 . . 5.240 1.954 1.878 2.074 . 0 0 "[ . 1 . 2]" 1
433 1 29 THR HB 1 44 LYS HB3 . . 4.740 3.541 3.330 3.683 . 0 0 "[ . 1 . 2]" 1
434 1 30 SER H 1 31 ARG H . . 5.080 4.333 4.200 4.411 . 0 0 "[ . 1 . 2]" 1
435 1 30 SER H 1 81 VAL QG . . 4.910 4.688 4.191 4.953 0.043 1 0 "[ . 1 . 2]" 1
436 1 30 SER HA 1 41 ILE HA . . 4.290 2.564 2.229 3.116 . 0 0 "[ . 1 . 2]" 1
437 1 30 SER HA 1 41 ILE MD . . 5.020 2.841 2.464 3.870 . 0 0 "[ . 1 . 2]" 1
438 1 30 SER HA 1 41 ILE QG . . 5.430 4.038 2.563 4.823 . 0 0 "[ . 1 . 2]" 1
439 1 30 SER HA 1 41 ILE MG . . 5.500 4.076 3.236 4.318 . 0 0 "[ . 1 . 2]" 1
440 1 30 SER HA 1 42 TYR H . . 4.930 3.249 2.907 3.526 . 0 0 "[ . 1 . 2]" 1
441 1 30 SER HA 1 42 TYR QD . . 4.150 3.380 2.943 3.669 . 0 0 "[ . 1 . 2]" 1
442 1 30 SER HA 1 42 TYR QE . . 4.630 4.605 4.390 4.731 0.101 4 0 "[ . 1 . 2]" 1
443 1 30 SER HA 1 81 VAL QG . . 5.440 5.418 4.795 5.601 0.161 19 0 "[ . 1 . 2]" 1
444 1 30 SER QB 1 31 ARG H . . 4.080 2.941 2.429 3.571 . 0 0 "[ . 1 . 2]" 1
445 1 30 SER QB 1 41 ILE MD . . 3.480 1.814 1.711 2.181 . 0 0 "[ . 1 . 2]" 1
446 1 30 SER QB 1 41 ILE QG . . 4.100 3.038 1.773 3.641 . 0 0 "[ . 1 . 2]" 1
447 1 30 SER QB 1 41 ILE MG . . 4.610 3.857 3.155 4.100 . 0 0 "[ . 1 . 2]" 1
448 1 30 SER QB 1 77 GLN QB . . 4.000 2.383 2.104 2.845 . 0 0 "[ . 1 . 2]" 1
449 1 30 SER QB 1 77 GLN QE . . 5.180 3.636 2.180 5.031 . 0 0 "[ . 1 . 2]" 1
450 1 30 SER HB2 1 31 ARG H . . 4.820 3.067 2.459 4.059 . 0 0 "[ . 1 . 2]" 1
451 1 30 SER HB2 1 41 ILE HA . . 4.920 3.906 3.025 4.328 . 0 0 "[ . 1 . 2]" 1
452 1 30 SER HB2 1 41 ILE MG . . 5.240 4.990 3.894 5.325 0.085 8 0 "[ . 1 . 2]" 1
453 1 30 SER HB2 1 42 TYR H . . 5.500 5.329 4.395 5.568 0.068 11 0 "[ . 1 . 2]" 1
454 1 30 SER HB2 1 77 GLN HB2 . . 5.500 3.444 2.383 4.717 . 0 0 "[ . 1 . 2]" 1
455 1 30 SER HB2 1 77 GLN HB3 . . 5.500 3.067 2.498 4.034 . 0 0 "[ . 1 . 2]" 1
456 1 30 SER HB3 1 31 ARG H . . 4.820 4.009 3.773 4.260 . 0 0 "[ . 1 . 2]" 1
457 1 30 SER HB3 1 41 ILE HA . . 4.920 3.582 3.082 4.577 . 0 0 "[ . 1 . 2]" 1
458 1 30 SER HB3 1 41 ILE MG . . 5.240 4.180 3.226 5.322 0.082 18 0 "[ . 1 . 2]" 1
459 1 30 SER HB3 1 42 TYR H . . 5.500 4.854 4.481 5.636 0.136 14 0 "[ . 1 . 2]" 1
460 1 30 SER HB3 1 77 GLN HB2 . . 5.500 2.948 2.445 3.261 . 0 0 "[ . 1 . 2]" 1
461 1 30 SER HB3 1 77 GLN HB3 . . 5.500 3.201 2.230 4.070 . 0 0 "[ . 1 . 2]" 1
462 1 31 ARG H 1 31 ARG QB . . 3.420 3.050 2.472 3.252 . 0 0 "[ . 1 . 2]" 1
463 1 31 ARG H 1 31 ARG QG . . 3.950 2.428 2.037 2.875 . 0 0 "[ . 1 . 2]" 1
464 1 31 ARG H 1 42 TYR QD . . 4.860 3.712 2.884 4.762 . 0 0 "[ . 1 . 2]" 1
465 1 31 ARG H 1 42 TYR QE . . 5.330 3.817 3.135 4.616 . 0 0 "[ . 1 . 2]" 1
466 1 31 ARG HA 1 31 ARG HD2 . . 5.500 4.977 4.291 5.533 0.033 5 0 "[ . 1 . 2]" 1
467 1 31 ARG HA 1 31 ARG QD . . 4.790 4.363 4.021 4.644 . 0 0 "[ . 1 . 2]" 1
468 1 31 ARG HA 1 31 ARG HD3 . . 5.500 4.911 4.672 5.533 0.033 11 0 "[ . 1 . 2]" 1
469 1 31 ARG HA 1 33 VAL QG . . 5.440 4.609 3.235 5.603 0.163 9 0 "[ . 1 . 2]" 1
470 1 31 ARG QD 1 42 TYR QD . . 5.340 4.096 3.253 4.942 . 0 0 "[ . 1 . 2]" 1
471 1 31 ARG HD2 1 42 TYR QE . . 5.500 4.150 2.388 5.538 0.038 4 0 "[ . 1 . 2]" 1
472 1 31 ARG HD3 1 42 TYR QE . . 5.500 4.186 2.468 5.502 0.002 19 0 "[ . 1 . 2]" 1
473 1 31 ARG QG 1 42 TYR QD . . 3.840 2.963 2.309 3.841 0.001 11 0 "[ . 1 . 2]" 1
474 1 31 ARG QG 1 42 TYR QE . . 3.510 2.625 1.909 3.343 . 0 0 "[ . 1 . 2]" 1
475 1 32 ASP H 1 33 VAL H . . 5.350 3.873 2.510 4.570 . 0 0 "[ . 1 . 2]" 1
476 1 32 ASP H 1 33 VAL QG . . 5.190 3.944 3.316 4.837 . 0 0 "[ . 1 . 2]" 1
477 1 32 ASP HA 1 33 VAL HA . . 5.350 4.430 4.250 4.840 . 0 0 "[ . 1 . 2]" 1
478 1 32 ASP QB 1 33 VAL H . . 4.450 3.604 2.332 3.983 . 0 0 "[ . 1 . 2]" 1
479 1 32 ASP HB2 1 33 VAL H . . 5.230 4.148 2.380 4.544 . 0 0 "[ . 1 . 2]" 1
480 1 32 ASP HB3 1 33 VAL H . . 5.230 4.029 2.699 4.446 . 0 0 "[ . 1 . 2]" 1
481 1 33 VAL H 1 33 VAL HB . . 4.120 3.355 2.550 3.896 . 0 0 "[ . 1 . 2]" 1
482 1 33 VAL H 1 33 VAL QG . . 3.630 2.204 1.875 2.867 . 0 0 "[ . 1 . 2]" 1
483 1 33 VAL H 1 34 THR H . . 5.000 3.620 1.899 4.476 . 0 0 "[ . 1 . 2]" 1
484 1 33 VAL HB 1 34 THR H . . 5.320 3.634 1.995 4.450 . 0 0 "[ . 1 . 2]" 1
485 1 33 VAL QG 1 34 THR H . . 4.600 3.177 1.907 3.754 . 0 0 "[ . 1 . 2]" 1
486 1 34 THR HB 1 35 ILE H . . 4.260 3.825 1.984 4.357 0.097 10 0 "[ . 1 . 2]" 1
487 1 34 THR MG 1 35 ILE H . . 4.640 3.359 2.074 4.318 . 0 0 "[ . 1 . 2]" 1
488 1 38 SER QB 1 39 ALA H . . 4.390 3.122 1.983 4.020 . 0 0 "[ . 1 . 2]" 1
489 1 40 PRO HA 1 41 ILE H . . 3.360 2.233 2.039 2.714 . 0 0 "[ . 1 . 2]" 1
490 1 40 PRO HB2 1 42 TYR H . . 5.500 5.339 5.064 5.561 0.061 17 0 "[ . 1 . 2]" 1
491 1 40 PRO HB2 1 63 ARG HD2 . . 5.360 3.812 2.488 5.360 . 0 0 "[ . 1 . 2]" 1
492 1 40 PRO HB2 1 63 ARG HD3 . . 5.360 4.436 2.972 5.430 0.070 20 0 "[ . 1 . 2]" 1
493 1 41 ILE H 1 41 ILE MD . . 4.400 4.049 3.822 4.438 0.038 4 0 "[ . 1 . 2]" 1
494 1 41 ILE H 1 41 ILE QG . . 3.880 2.861 2.617 3.044 . 0 0 "[ . 1 . 2]" 1
495 1 41 ILE H 1 41 ILE MG . . 4.630 3.677 3.599 3.799 . 0 0 "[ . 1 . 2]" 1
496 1 41 ILE H 1 63 ARG QG . . 4.910 3.431 2.722 4.970 0.060 13 0 "[ . 1 . 2]" 1
497 1 41 ILE HA 1 41 ILE MD . . 3.830 2.263 2.006 3.639 . 0 0 "[ . 1 . 2]" 1
498 1 41 ILE HA 1 42 TYR HB2 . . 5.500 4.583 4.417 4.850 . 0 0 "[ . 1 . 2]" 1
499 1 41 ILE HA 1 42 TYR QD . . 4.000 3.484 2.995 3.649 . 0 0 "[ . 1 . 2]" 1
500 1 41 ILE HA 1 42 TYR QE . . 4.750 4.724 4.011 4.811 0.061 7 0 "[ . 1 . 2]" 1
501 1 41 ILE HB 1 42 TYR H . . 5.210 4.221 3.966 4.339 . 0 0 "[ . 1 . 2]" 1
502 1 41 ILE HB 1 64 LEU H . . 4.830 3.665 3.326 4.588 . 0 0 "[ . 1 . 2]" 1
503 1 41 ILE HB 1 64 LEU HB2 . . 5.360 3.830 3.436 4.219 . 0 0 "[ . 1 . 2]" 1
504 1 41 ILE HB 1 80 VAL MG2 . . 3.200 3.268 2.636 3.384 0.184 13 0 "[ . 1 . 2]" 1
505 1 41 ILE MD 1 42 TYR H . . 4.660 3.422 3.082 4.308 . 0 0 "[ . 1 . 2]" 1
506 1 41 ILE MD 1 77 GLN H . . 5.110 4.732 4.177 5.151 0.041 7 0 "[ . 1 . 2]" 1
507 1 41 ILE MD 1 77 GLN HA . . 3.900 2.675 2.286 3.117 . 0 0 "[ . 1 . 2]" 1
508 1 41 ILE MD 1 77 GLN QB . . 3.720 2.229 1.869 2.787 . 0 0 "[ . 1 . 2]" 1
509 1 41 ILE MD 1 77 GLN QE . . 5.010 4.641 3.471 5.106 0.096 19 0 "[ . 1 . 2]" 1
510 1 41 ILE MD 1 80 VAL H . . 5.000 4.818 4.197 5.026 0.026 10 0 "[ . 1 . 2]" 1
511 1 41 ILE MD 1 81 VAL H . . 4.460 3.912 3.201 4.119 . 0 0 "[ . 1 . 2]" 1
512 1 41 ILE MD 1 81 VAL HA . . 5.460 4.163 3.567 4.501 . 0 0 "[ . 1 . 2]" 1
513 1 41 ILE MD 1 84 LEU HB2 . . 5.500 5.601 5.422 5.658 0.158 11 0 "[ . 1 . 2]" 1
514 1 41 ILE QG 1 42 TYR H . . 4.570 4.348 3.682 4.492 . 0 0 "[ . 1 . 2]" 1
515 1 41 ILE QG 1 80 VAL MG1 . . 3.810 3.534 3.265 3.860 0.050 4 0 "[ . 1 . 2]" 1
516 1 41 ILE QG 1 80 VAL MG2 . . 3.230 1.764 1.688 2.241 . 0 0 "[ . 1 . 2]" 1
517 1 41 ILE MG 1 42 TYR H . . 3.730 2.540 2.137 2.769 . 0 0 "[ . 1 . 2]" 1
518 1 41 ILE MG 1 42 TYR HA . . 5.160 3.384 3.295 3.606 . 0 0 "[ . 1 . 2]" 1
519 1 41 ILE MG 1 44 LYS H . . 5.010 4.901 4.605 5.041 0.031 14 0 "[ . 1 . 2]" 1
520 1 42 TYR H 1 42 TYR QD . . 3.870 2.731 2.423 2.883 . 0 0 "[ . 1 . 2]" 1
521 1 42 TYR H 1 42 TYR QE . . 4.880 4.723 4.461 4.853 . 0 0 "[ . 1 . 2]" 1
522 1 42 TYR H 1 43 VAL H . . 4.350 4.364 4.320 4.390 0.040 17 0 "[ . 1 . 2]" 1
523 1 42 TYR HA 1 42 TYR QD . . 3.810 3.001 2.870 3.156 . 0 0 "[ . 1 . 2]" 1
524 1 42 TYR HA 1 42 TYR QE . . 4.800 4.685 4.612 4.766 . 0 0 "[ . 1 . 2]" 1
525 1 42 TYR HA 1 43 VAL HB . . 5.500 4.782 4.677 4.900 . 0 0 "[ . 1 . 2]" 1
526 1 42 TYR HA 1 63 ARG HA . . 4.150 2.115 1.953 2.317 . 0 0 "[ . 1 . 2]" 1
527 1 42 TYR HA 1 64 LEU H . . 4.480 2.904 2.577 3.128 . 0 0 "[ . 1 . 2]" 1
528 1 42 TYR HB2 1 43 VAL H . . 4.620 3.788 3.573 3.887 . 0 0 "[ . 1 . 2]" 1
529 1 42 TYR HB2 1 61 GLY HA2 . . 5.500 3.800 3.705 3.902 . 0 0 "[ . 1 . 2]" 1
530 1 42 TYR HB3 1 43 VAL H . . 4.460 2.749 2.452 2.867 . 0 0 "[ . 1 . 2]" 1
531 1 42 TYR HB3 1 61 GLY HA2 . . 5.500 2.554 2.379 2.851 . 0 0 "[ . 1 . 2]" 1
532 1 42 TYR QD 1 43 VAL H . . 4.300 3.983 3.826 4.121 . 0 0 "[ . 1 . 2]" 1
533 1 42 TYR QD 1 61 GLY HA2 . . 4.410 3.506 3.206 3.635 . 0 0 "[ . 1 . 2]" 1
534 1 42 TYR QD 1 62 ASP H . . 5.500 4.491 4.179 4.857 . 0 0 "[ . 1 . 2]" 1
535 1 42 TYR QD 1 63 ARG HA . . 4.140 3.031 2.767 3.403 . 0 0 "[ . 1 . 2]" 1
536 1 42 TYR QD 1 63 ARG HB2 . . 5.500 2.859 2.517 3.900 . 0 0 "[ . 1 . 2]" 1
537 1 42 TYR QD 1 64 LEU H . . 5.500 4.780 4.552 4.997 . 0 0 "[ . 1 . 2]" 1
538 1 42 TYR QE 1 63 ARG HA . . 4.510 4.117 3.809 4.547 0.037 14 0 "[ . 1 . 2]" 1
539 1 42 TYR QE 1 63 ARG HB2 . . 4.680 2.424 2.097 3.852 . 0 0 "[ . 1 . 2]" 1
540 1 42 TYR QE 1 63 ARG HB3 . . 3.630 3.569 2.560 3.709 0.079 11 0 "[ . 1 . 2]" 1
541 1 42 TYR QE 1 63 ARG HD2 . . 4.430 3.604 2.700 4.424 . 0 0 "[ . 1 . 2]" 1
542 1 42 TYR QE 1 63 ARG QD . . 3.870 3.163 2.655 3.969 0.099 7 0 "[ . 1 . 2]" 1
543 1 42 TYR QE 1 63 ARG HD3 . . 4.430 3.937 2.770 4.526 0.096 12 0 "[ . 1 . 2]" 1
544 1 42 TYR QE 1 63 ARG QG . . 5.500 3.736 3.362 4.151 . 0 0 "[ . 1 . 2]" 1
545 1 43 VAL H 1 43 VAL HB . . 4.110 2.554 2.518 2.580 . 0 0 "[ . 1 . 2]" 1
546 1 43 VAL H 1 43 VAL QG . . 3.590 2.078 2.023 2.163 . 0 0 "[ . 1 . 2]" 1
547 1 43 VAL H 1 44 LYS H . . 5.500 4.454 4.311 4.548 . 0 0 "[ . 1 . 2]" 1
548 1 43 VAL H 1 58 LEU QD . . 5.220 4.574 4.288 4.680 . 0 0 "[ . 1 . 2]" 1
549 1 43 VAL H 1 60 ALA HA . . 5.500 4.317 4.073 4.701 . 0 0 "[ . 1 . 2]" 1
550 1 43 VAL H 1 62 ASP H . . 5.080 3.278 2.932 3.578 . 0 0 "[ . 1 . 2]" 1
551 1 43 VAL H 1 64 LEU H . . 5.200 4.287 3.972 4.564 . 0 0 "[ . 1 . 2]" 1
552 1 43 VAL HA 1 45 ASN H . . 4.900 3.868 3.733 3.975 . 0 0 "[ . 1 . 2]" 1
553 1 43 VAL HB 1 60 ALA HA . . 4.490 2.057 1.912 2.267 . 0 0 "[ . 1 . 2]" 1
554 1 43 VAL HB 1 61 GLY H . . 4.450 2.268 1.793 2.802 . 0 0 "[ . 1 . 2]" 1
555 1 43 VAL HB 1 61 GLY HA2 . . 5.500 4.393 3.812 4.897 . 0 0 "[ . 1 . 2]" 1
556 1 43 VAL HB 1 62 ASP H . . 3.840 2.754 2.335 2.946 . 0 0 "[ . 1 . 2]" 1
557 1 43 VAL QG 1 44 LYS H . . 4.160 2.769 2.629 2.995 . 0 0 "[ . 1 . 2]" 1
558 1 43 VAL QG 1 44 LYS HB3 . . 5.440 4.190 3.998 4.429 . 0 0 "[ . 1 . 2]" 1
559 1 43 VAL QG 1 45 ASN H . . 4.270 2.289 2.116 2.516 . 0 0 "[ . 1 . 2]" 1
560 1 43 VAL QG 1 46 ILE MD . . 3.430 1.896 1.816 2.020 . 0 0 "[ . 1 . 2]" 1
561 1 43 VAL QG 1 60 ALA H . . 4.770 3.823 3.473 4.027 . 0 0 "[ . 1 . 2]" 1
562 1 43 VAL QG 1 60 ALA HA . . 3.740 2.240 2.041 2.495 . 0 0 "[ . 1 . 2]" 1
563 1 43 VAL QG 1 61 GLY H . . 4.290 3.178 2.840 3.545 . 0 0 "[ . 1 . 2]" 1
564 1 43 VAL QG 1 61 GLY HA2 . . 5.440 4.681 4.283 5.040 . 0 0 "[ . 1 . 2]" 1
565 1 43 VAL QG 1 62 ASP H . . 3.830 3.153 2.660 3.452 . 0 0 "[ . 1 . 2]" 1
566 1 43 VAL QG 1 62 ASP QB . . 4.060 2.947 2.141 4.063 0.003 12 0 "[ . 1 . 2]" 1
567 1 44 LYS H 1 45 ASN H . . 4.020 2.504 2.382 2.665 . 0 0 "[ . 1 . 2]" 1
568 1 44 LYS HA 1 60 ALA MB . . 5.020 4.048 3.404 4.521 . 0 0 "[ . 1 . 2]" 1
569 1 44 LYS HA 1 61 GLY H . . 5.500 4.470 3.996 5.082 . 0 0 "[ . 1 . 2]" 1
570 1 44 LYS HB2 1 45 ASN H . . 3.990 3.952 3.849 4.002 0.012 19 0 "[ . 1 . 2]" 1
571 1 44 LYS HB3 1 45 ASN H . . 3.830 2.744 2.556 2.836 . 0 0 "[ . 1 . 2]" 1
572 1 44 LYS HB3 1 45 ASN QB . . 4.470 3.517 3.102 4.156 . 0 0 "[ . 1 . 2]" 1
573 1 44 LYS QE 1 45 ASN H . . 5.340 4.855 4.101 5.453 0.113 15 0 "[ . 1 . 2]" 1
574 1 45 ASN H 1 46 ILE H . . 5.210 4.169 4.064 4.272 . 0 0 "[ . 1 . 2]" 1
575 1 45 ASN H 1 46 ILE MD . . 5.500 4.175 4.022 4.313 . 0 0 "[ . 1 . 2]" 1
576 1 45 ASN H 1 60 ALA MB . . 5.500 3.744 3.389 4.074 . 0 0 "[ . 1 . 2]" 1
577 1 45 ASN HA 1 46 ILE H . . 3.540 2.215 2.115 2.324 . 0 0 "[ . 1 . 2]" 1
578 1 45 ASN HA 1 46 ILE HB . . 4.890 4.598 4.524 4.711 . 0 0 "[ . 1 . 2]" 1
579 1 45 ASN HA 1 46 ILE MD . . 5.500 4.485 4.273 4.721 . 0 0 "[ . 1 . 2]" 1
580 1 45 ASN HA 1 46 ILE QG . . 5.500 3.693 3.488 3.862 . 0 0 "[ . 1 . 2]" 1
581 1 45 ASN HA 1 60 ALA MB . . 3.970 2.456 1.924 2.990 . 0 0 "[ . 1 . 2]" 1
582 1 45 ASN QB 1 46 ILE H . . 3.890 3.459 2.426 3.700 . 0 0 "[ . 1 . 2]" 1
583 1 45 ASN QB 1 60 ALA MB . . 4.550 4.105 3.648 4.571 0.021 7 0 "[ . 1 . 2]" 1
584 1 45 ASN HB2 1 46 ILE H . . 4.430 3.989 2.456 4.227 . 0 0 "[ . 1 . 2]" 1
585 1 45 ASN HB3 1 46 ILE H . . 4.430 3.861 2.524 4.146 . 0 0 "[ . 1 . 2]" 1
586 1 46 ILE H 1 46 ILE HB . . 3.990 2.508 2.453 2.586 . 0 0 "[ . 1 . 2]" 1
587 1 46 ILE H 1 46 ILE QG . . 4.380 2.617 2.479 2.764 . 0 0 "[ . 1 . 2]" 1
588 1 46 ILE H 1 46 ILE MG . . 4.640 3.805 3.762 3.856 . 0 0 "[ . 1 . 2]" 1
589 1 46 ILE H 1 47 LEU H . . 5.370 4.237 4.129 4.343 . 0 0 "[ . 1 . 2]" 1
590 1 46 ILE HA 1 46 ILE MD . . 3.710 2.123 2.079 2.158 . 0 0 "[ . 1 . 2]" 1
591 1 46 ILE HA 1 53 ILE HB . . 4.790 4.640 4.497 4.783 . 0 0 "[ . 1 . 2]" 1
592 1 46 ILE HB 1 47 LEU H . . 5.120 4.310 4.175 4.382 . 0 0 "[ . 1 . 2]" 1
593 1 46 ILE MD 1 46 ILE MG . . 3.410 1.965 1.906 2.009 . 0 0 "[ . 1 . 2]" 1
594 1 46 ILE MD 1 47 LEU H . . 4.830 3.865 3.762 3.936 . 0 0 "[ . 1 . 2]" 1
595 1 46 ILE MD 1 52 ALA MB . . 3.700 2.297 2.032 2.738 . 0 0 "[ . 1 . 2]" 1
596 1 46 ILE MD 1 53 ILE HA . . 5.500 4.076 3.885 4.245 . 0 0 "[ . 1 . 2]" 1
597 1 46 ILE MD 1 58 LEU H . . 5.500 4.905 4.620 5.252 . 0 0 "[ . 1 . 2]" 1
598 1 46 ILE MD 1 58 LEU HA . . 5.500 4.389 4.260 4.531 . 0 0 "[ . 1 . 2]" 1
599 1 46 ILE MD 1 58 LEU HB2 . . 4.900 4.494 4.191 4.811 . 0 0 "[ . 1 . 2]" 1
600 1 46 ILE MD 1 58 LEU QB . . 4.300 3.287 2.917 3.633 . 0 0 "[ . 1 . 2]" 1
601 1 46 ILE MD 1 58 LEU HB3 . . 4.900 3.380 2.977 3.759 . 0 0 "[ . 1 . 2]" 1
602 1 46 ILE MD 1 58 LEU QD . . 3.630 2.784 2.351 3.100 . 0 0 "[ . 1 . 2]" 1
603 1 46 ILE MD 1 58 LEU HG . . 4.530 2.223 1.968 2.566 . 0 0 "[ . 1 . 2]" 1
604 1 46 ILE MD 1 59 LYS H . . 5.050 3.512 3.366 3.746 . 0 0 "[ . 1 . 2]" 1
605 1 46 ILE MD 1 59 LYS HA . . 4.120 2.613 2.050 2.940 . 0 0 "[ . 1 . 2]" 1
606 1 46 ILE MD 1 60 ALA H . . 4.420 3.592 3.116 3.925 . 0 0 "[ . 1 . 2]" 1
607 1 46 ILE MD 1 60 ALA HA . . 4.980 3.545 3.237 3.744 . 0 0 "[ . 1 . 2]" 1
608 1 46 ILE MD 1 61 GLY H . . 5.500 5.214 4.892 5.508 0.008 10 0 "[ . 1 . 2]" 1
609 1 46 ILE QG 1 59 LYS HA . . 4.390 1.955 1.828 2.280 . 0 0 "[ . 1 . 2]" 1
610 1 46 ILE MG 1 47 LEU H . . 4.260 3.059 2.756 3.209 . 0 0 "[ . 1 . 2]" 1
611 1 46 ILE MG 1 50 GLY HA3 . . 5.500 5.524 5.397 5.598 0.098 13 0 "[ . 1 . 2]" 1
612 1 46 ILE MG 1 52 ALA MB . . 3.660 2.619 2.305 2.963 . 0 0 "[ . 1 . 2]" 1
613 1 46 ILE MG 1 53 ILE H . . 4.000 3.153 2.893 3.445 . 0 0 "[ . 1 . 2]" 1
614 1 46 ILE MG 1 53 ILE HA . . 3.900 2.432 2.129 2.843 . 0 0 "[ . 1 . 2]" 1
615 1 46 ILE MG 1 53 ILE HB . . 3.190 1.938 1.831 2.062 . 0 0 "[ . 1 . 2]" 1
616 1 46 ILE MG 1 53 ILE HG12 . . 3.610 3.716 3.675 3.774 0.164 2 0 "[ . 1 . 2]" 1
617 1 46 ILE MG 1 53 ILE HG13 . . 3.770 2.460 2.391 2.586 . 0 0 "[ . 1 . 2]" 1
618 1 46 ILE MG 1 59 LYS H . . 5.500 5.625 5.555 5.676 0.176 2 0 "[ . 1 . 2]" 1
619 1 47 LEU H 1 47 LEU QB . . 3.540 2.385 2.335 2.468 . 0 0 "[ . 1 . 2]" 1
620 1 47 LEU H 1 48 PRO QD . . 5.500 4.402 4.351 4.439 . 0 0 "[ . 1 . 2]" 1
621 1 47 LEU H 1 52 ALA MB . . 5.500 4.094 3.844 4.561 . 0 0 "[ . 1 . 2]" 1
622 1 47 LEU HA 1 48 PRO QD . . 3.510 1.994 1.920 2.130 . 0 0 "[ . 1 . 2]" 1
623 1 47 LEU HA 1 48 PRO QG . . 4.760 3.863 3.761 4.021 . 0 0 "[ . 1 . 2]" 1
624 1 47 LEU HA 1 49 ARG H . . 5.330 4.050 3.812 4.267 . 0 0 "[ . 1 . 2]" 1
625 1 47 LEU QB 1 48 PRO QD . . 3.720 2.337 2.179 2.531 . 0 0 "[ . 1 . 2]" 1
626 1 47 LEU QB 1 50 GLY HA2 . . 5.340 5.298 4.939 5.862 0.522 13 1 "[ . 1 + . 2]" 1
627 1 47 LEU QB 1 53 ILE MG . . 4.580 4.259 4.073 4.523 . 0 0 "[ . 1 . 2]" 1
628 1 47 LEU HB2 1 48 PRO QD . . 4.350 3.731 3.589 3.859 . 0 0 "[ . 1 . 2]" 1
629 1 47 LEU HB2 1 49 ARG H . . 5.160 3.380 3.031 3.798 . 0 0 "[ . 1 . 2]" 1
630 1 47 LEU HB3 1 48 PRO QD . . 4.350 2.362 2.198 2.567 . 0 0 "[ . 1 . 2]" 1
631 1 47 LEU HB3 1 49 ARG H . . 5.160 2.701 2.485 3.042 . 0 0 "[ . 1 . 2]" 1
632 1 48 PRO HA 1 49 ARG QG . . 5.340 4.690 4.329 5.341 0.001 1 0 "[ . 1 . 2]" 1
633 1 48 PRO HA 1 53 ILE MD . . 3.410 2.029 1.807 2.629 . 0 0 "[ . 1 . 2]" 1
634 1 48 PRO HA 1 53 ILE HG12 . . 5.500 4.727 4.394 5.329 . 0 0 "[ . 1 . 2]" 1
635 1 48 PRO HA 1 53 ILE HG13 . . 5.500 4.606 4.284 5.481 . 0 0 "[ . 1 . 2]" 1
636 1 48 PRO HA 1 53 ILE MG . . 4.350 3.276 2.748 3.805 . 0 0 "[ . 1 . 2]" 1
637 1 48 PRO QD 1 49 ARG H . . 4.320 2.885 2.608 3.073 . 0 0 "[ . 1 . 2]" 1
638 1 48 PRO QD 1 53 ILE MD . . 5.260 4.211 3.903 4.466 . 0 0 "[ . 1 . 2]" 1
639 1 48 PRO QG 1 49 ARG H . . 4.250 3.673 2.625 4.085 . 0 0 "[ . 1 . 2]" 1
640 1 48 PRO QG 1 53 ILE MD . . 4.730 4.255 3.894 4.597 . 0 0 "[ . 1 . 2]" 1
641 1 49 ARG H 1 49 ARG QB . . 3.650 2.719 2.533 3.192 . 0 0 "[ . 1 . 2]" 1
642 1 49 ARG H 1 49 ARG QD . . 5.180 3.946 2.319 4.798 . 0 0 "[ . 1 . 2]" 1
643 1 49 ARG H 1 49 ARG QG . . 3.800 3.029 2.225 3.751 . 0 0 "[ . 1 . 2]" 1
644 1 49 ARG H 1 50 GLY H . . 4.840 4.284 4.097 4.410 . 0 0 "[ . 1 . 2]" 1
645 1 49 ARG H 1 53 ILE MD . . 4.450 4.065 3.851 4.342 . 0 0 "[ . 1 . 2]" 1
646 1 49 ARG H 1 53 ILE MG . . 4.530 3.483 3.288 3.682 . 0 0 "[ . 1 . 2]" 1
647 1 49 ARG HA 1 49 ARG QD . . 4.480 3.283 1.926 4.500 0.020 7 0 "[ . 1 . 2]" 1
648 1 49 ARG HA 1 49 ARG QG . . 3.510 2.803 2.428 3.374 . 0 0 "[ . 1 . 2]" 1
649 1 49 ARG HA 1 50 GLY H . . 3.530 2.209 2.108 2.326 . 0 0 "[ . 1 . 2]" 1
650 1 49 ARG HA 1 53 ILE MG . . 4.070 2.704 2.171 3.403 . 0 0 "[ . 1 . 2]" 1
651 1 49 ARG QB 1 50 GLY H . . 4.180 2.976 2.589 3.511 . 0 0 "[ . 1 . 2]" 1
652 1 49 ARG QD 1 50 GLY H . . 5.340 4.546 3.236 5.425 0.085 10 0 "[ . 1 . 2]" 1
653 1 49 ARG QG 1 50 GLY H . . 4.730 4.283 3.822 4.779 0.049 13 0 "[ . 1 . 2]" 1
654 1 50 GLY H 1 51 ALA H . . 5.080 4.306 4.199 4.434 . 0 0 "[ . 1 . 2]" 1
655 1 50 GLY H 1 53 ILE MG . . 4.310 2.754 2.410 3.027 . 0 0 "[ . 1 . 2]" 1
656 1 50 GLY H 1 54 GLN QG . . 5.340 3.150 2.669 4.120 . 0 0 "[ . 1 . 2]" 1
657 1 50 GLY HA2 1 51 ALA MB . . 5.120 4.106 4.033 4.183 . 0 0 "[ . 1 . 2]" 1
658 1 50 GLY HA2 1 52 ALA H . . 5.500 4.620 4.341 4.880 . 0 0 "[ . 1 . 2]" 1
659 1 50 GLY HA3 1 51 ALA HA . . 5.500 4.652 4.454 4.726 . 0 0 "[ . 1 . 2]" 1
660 1 50 GLY HA3 1 51 ALA MB . . 4.800 4.313 4.180 4.417 . 0 0 "[ . 1 . 2]" 1
661 1 50 GLY HA3 1 52 ALA H . . 5.500 3.726 3.496 3.873 . 0 0 "[ . 1 . 2]" 1
662 1 51 ALA H 1 51 ALA MB . . 3.160 2.215 2.182 2.255 . 0 0 "[ . 1 . 2]" 1
663 1 51 ALA H 1 52 ALA H . . 4.030 2.678 2.285 2.887 . 0 0 "[ . 1 . 2]" 1
664 1 51 ALA H 1 52 ALA HA . . 5.500 5.265 4.938 5.437 . 0 0 "[ . 1 . 2]" 1
665 1 51 ALA H 1 52 ALA MB . . 5.420 4.356 3.960 4.532 . 0 0 "[ . 1 . 2]" 1
666 1 51 ALA H 1 53 ILE H . . 5.500 4.401 4.140 4.590 . 0 0 "[ . 1 . 2]" 1
667 1 51 ALA H 1 54 GLN H . . 5.030 4.910 4.751 5.042 0.012 15 0 "[ . 1 . 2]" 1
668 1 51 ALA H 1 54 GLN HB2 . . 5.460 5.201 4.660 5.492 0.032 11 0 "[ . 1 . 2]" 1
669 1 51 ALA HA 1 53 ILE MG . . 5.230 4.565 4.194 4.809 . 0 0 "[ . 1 . 2]" 1
670 1 51 ALA HA 1 54 GLN H . . 4.730 3.604 3.330 3.786 . 0 0 "[ . 1 . 2]" 1
671 1 51 ALA HA 1 54 GLN HB2 . . 4.130 2.784 2.474 3.070 . 0 0 "[ . 1 . 2]" 1
672 1 51 ALA HA 1 54 GLN HG2 . . 5.500 4.022 2.747 5.408 . 0 0 "[ . 1 . 2]" 1
673 1 51 ALA HA 1 54 GLN QG . . 4.810 3.441 2.525 4.193 . 0 0 "[ . 1 . 2]" 1
674 1 51 ALA HA 1 54 GLN HG3 . . 5.500 3.878 2.945 5.508 0.008 2 0 "[ . 1 . 2]" 1
675 1 51 ALA MB 1 52 ALA H . . 3.910 2.483 2.341 2.676 . 0 0 "[ . 1 . 2]" 1
676 1 51 ALA MB 1 54 GLN H . . 5.500 4.631 4.479 4.776 . 0 0 "[ . 1 . 2]" 1
677 1 52 ALA H 1 52 ALA MB . . 3.500 2.247 2.226 2.266 . 0 0 "[ . 1 . 2]" 1
678 1 52 ALA H 1 53 ILE H . . 4.610 2.818 2.751 2.918 . 0 0 "[ . 1 . 2]" 1
679 1 52 ALA H 1 54 GLN H . . 5.500 4.113 3.947 4.271 . 0 0 "[ . 1 . 2]" 1
680 1 52 ALA HA 1 55 ASP H . . 4.600 3.610 3.408 3.872 . 0 0 "[ . 1 . 2]" 1
681 1 52 ALA HA 1 55 ASP HB2 . . 5.430 3.813 3.090 4.829 . 0 0 "[ . 1 . 2]" 1
682 1 52 ALA HA 1 55 ASP HB3 . . 5.430 3.171 2.666 4.775 . 0 0 "[ . 1 . 2]" 1
683 1 52 ALA HA 1 56 GLY H . . 4.810 4.112 3.807 4.434 . 0 0 "[ . 1 . 2]" 1
684 1 52 ALA MB 1 53 ILE H . . 4.280 2.567 2.379 2.692 . 0 0 "[ . 1 . 2]" 1
685 1 52 ALA MB 1 54 GLN H . . 5.020 4.431 4.312 4.531 . 0 0 "[ . 1 . 2]" 1
686 1 52 ALA MB 1 55 ASP H . . 5.200 4.666 4.472 4.932 . 0 0 "[ . 1 . 2]" 1
687 1 52 ALA MB 1 58 LEU HA . . 5.380 5.205 4.948 5.398 0.018 3 0 "[ . 1 . 2]" 1
688 1 52 ALA MB 1 58 LEU QD . . 3.790 1.955 1.847 2.099 . 0 0 "[ . 1 . 2]" 1
689 1 53 ILE H 1 53 ILE MD . . 5.190 4.504 4.438 4.552 . 0 0 "[ . 1 . 2]" 1
690 1 53 ILE H 1 53 ILE HG12 . . 5.500 4.525 4.451 4.559 . 0 0 "[ . 1 . 2]" 1
691 1 53 ILE H 1 53 ILE HG13 . . 5.500 4.443 4.374 4.472 . 0 0 "[ . 1 . 2]" 1
692 1 53 ILE H 1 53 ILE MG . . 3.870 2.200 2.059 2.274 . 0 0 "[ . 1 . 2]" 1
693 1 53 ILE H 1 54 GLN H . . 4.320 2.483 2.401 2.619 . 0 0 "[ . 1 . 2]" 1
694 1 53 ILE H 1 55 ASP H . . 5.500 4.028 3.804 4.305 . 0 0 "[ . 1 . 2]" 1
695 1 53 ILE HA 1 53 ILE HG12 . . 4.050 2.922 2.832 3.014 . 0 0 "[ . 1 . 2]" 1
696 1 53 ILE HA 1 53 ILE HG13 . . 3.890 2.411 2.356 2.512 . 0 0 "[ . 1 . 2]" 1
697 1 53 ILE HA 1 56 GLY H . . 5.250 3.386 3.188 3.702 . 0 0 "[ . 1 . 2]" 1
698 1 53 ILE HB 1 53 ILE MD . . 3.620 2.467 2.423 2.522 . 0 0 "[ . 1 . 2]" 1
699 1 53 ILE HB 1 54 GLN H . . 4.920 4.032 3.962 4.120 . 0 0 "[ . 1 . 2]" 1
700 1 53 ILE HG12 1 53 ILE MG . . 3.750 2.458 2.389 2.553 . 0 0 "[ . 1 . 2]" 1
701 1 53 ILE HG12 1 54 GLN H . . 5.500 4.211 4.042 4.289 . 0 0 "[ . 1 . 2]" 1
702 1 53 ILE HG12 1 54 GLN HA . . 5.500 4.083 3.753 4.267 . 0 0 "[ . 1 . 2]" 1
703 1 53 ILE MG 1 54 GLN H . . 3.670 2.368 2.317 2.416 . 0 0 "[ . 1 . 2]" 1
704 1 53 ILE MG 1 54 GLN HA . . 4.570 3.260 3.136 3.368 . 0 0 "[ . 1 . 2]" 1
705 1 53 ILE MG 1 54 GLN HB2 . . 4.760 3.987 3.679 4.341 . 0 0 "[ . 1 . 2]" 1
706 1 53 ILE MG 1 54 GLN HE21 . . 5.500 2.955 1.652 5.190 . 0 0 "[ . 1 . 2]" 1
707 1 53 ILE MG 1 54 GLN HE22 . . 5.500 3.819 2.034 5.576 0.076 5 0 "[ . 1 . 2]" 1
708 1 53 ILE MG 1 54 GLN HG2 . . 4.330 2.821 2.150 4.330 0.000 2 0 "[ . 1 . 2]" 1
709 1 53 ILE MG 1 54 GLN HG3 . . 4.330 3.623 2.258 4.347 0.017 14 0 "[ . 1 . 2]" 1
710 1 53 ILE MG 1 55 ASP H . . 5.500 4.405 4.269 4.608 . 0 0 "[ . 1 . 2]" 1
711 1 54 GLN H 1 54 GLN HB2 . . 3.600 2.437 2.184 2.622 . 0 0 "[ . 1 . 2]" 1
712 1 54 GLN H 1 54 GLN HG2 . . 4.310 2.767 2.237 4.075 . 0 0 "[ . 1 . 2]" 1
713 1 54 GLN H 1 54 GLN HG3 . . 4.310 3.443 2.231 4.164 . 0 0 "[ . 1 . 2]" 1
714 1 54 GLN H 1 55 ASP H . . 3.870 2.533 2.401 2.762 . 0 0 "[ . 1 . 2]" 1
715 1 54 GLN H 1 56 GLY H . . 5.160 4.148 3.845 4.303 . 0 0 "[ . 1 . 2]" 1
716 1 54 GLN HA 1 54 GLN QG . . 3.640 2.789 2.362 3.055 . 0 0 "[ . 1 . 2]" 1
717 1 54 GLN HB2 1 55 ASP H . . 3.940 2.835 2.509 3.097 . 0 0 "[ . 1 . 2]" 1
718 1 54 GLN HB2 1 56 GLY H . . 5.270 5.229 4.786 5.340 0.070 8 0 "[ . 1 . 2]" 1
719 1 54 GLN HG2 1 55 ASP H . . 5.500 4.612 4.159 5.369 . 0 0 "[ . 1 . 2]" 1
720 1 54 GLN HG3 1 55 ASP H . . 5.500 4.955 4.302 5.300 . 0 0 "[ . 1 . 2]" 1
721 1 55 ASP H 1 55 ASP HB2 . . 3.880 2.639 2.441 2.816 . 0 0 "[ . 1 . 2]" 1
722 1 55 ASP H 1 55 ASP HB3 . . 3.880 2.553 2.296 3.644 . 0 0 "[ . 1 . 2]" 1
723 1 55 ASP QB 1 56 GLY H . . 3.990 2.399 2.290 2.785 . 0 0 "[ . 1 . 2]" 1
724 1 55 ASP HB2 1 56 GLY H . . 4.550 3.708 2.645 3.899 . 0 0 "[ . 1 . 2]" 1
725 1 55 ASP HB2 1 57 ARG H . . 5.200 4.391 3.105 4.821 . 0 0 "[ . 1 . 2]" 1
726 1 55 ASP HB3 1 56 GLY H . . 4.550 2.471 2.312 3.464 . 0 0 "[ . 1 . 2]" 1
727 1 55 ASP HB3 1 57 ARG H . . 5.200 3.137 2.810 3.300 . 0 0 "[ . 1 . 2]" 1
728 1 56 GLY H 1 57 ARG QB . . 5.340 4.878 3.956 5.191 . 0 0 "[ . 1 . 2]" 1
729 1 56 GLY H 1 58 LEU H . . 5.500 3.688 3.372 4.353 . 0 0 "[ . 1 . 2]" 1
730 1 57 ARG H 1 57 ARG QB . . 3.550 2.430 2.232 2.716 . 0 0 "[ . 1 . 2]" 1
731 1 57 ARG H 1 57 ARG QD . . 5.090 3.623 2.002 4.630 . 0 0 "[ . 1 . 2]" 1
732 1 57 ARG H 1 57 ARG QG . . 4.960 2.857 2.145 4.110 . 0 0 "[ . 1 . 2]" 1
733 1 57 ARG H 1 58 LEU H . . 3.920 2.279 2.070 2.436 . 0 0 "[ . 1 . 2]" 1
734 1 57 ARG H 1 58 LEU QB . . 4.930 4.009 3.673 4.218 . 0 0 "[ . 1 . 2]" 1
735 1 57 ARG HA 1 57 ARG HD2 . . 5.500 3.872 2.136 4.881 . 0 0 "[ . 1 . 2]" 1
736 1 57 ARG HA 1 57 ARG HD3 . . 5.500 3.859 2.081 4.869 . 0 0 "[ . 1 . 2]" 1
737 1 57 ARG HA 1 57 ARG QG . . 3.730 2.667 2.413 3.215 . 0 0 "[ . 1 . 2]" 1
738 1 57 ARG QG 1 58 LEU H . . 5.090 4.059 3.313 4.679 . 0 0 "[ . 1 . 2]" 1
739 1 58 LEU H 1 58 LEU MD1 . . 5.300 4.192 4.067 4.286 . 0 0 "[ . 1 . 2]" 1
740 1 58 LEU H 1 58 LEU QD . . 4.590 3.741 3.629 3.819 . 0 0 "[ . 1 . 2]" 1
741 1 58 LEU H 1 58 LEU MD2 . . 5.300 4.206 4.058 4.291 . 0 0 "[ . 1 . 2]" 1
742 1 58 LEU H 1 58 LEU HG . . 5.500 4.428 4.361 4.494 . 0 0 "[ . 1 . 2]" 1
743 1 58 LEU H 1 59 LYS H . . 5.500 4.506 4.402 4.613 . 0 0 "[ . 1 . 2]" 1
744 1 58 LEU HA 1 58 LEU QD . . 3.640 2.184 2.120 2.267 . 0 0 "[ . 1 . 2]" 1
745 1 58 LEU HA 1 59 LYS H . . 3.570 2.199 2.118 2.320 . 0 0 "[ . 1 . 2]" 1
746 1 58 LEU QD 1 59 LYS H . . 3.830 2.352 2.027 2.585 . 0 0 "[ . 1 . 2]" 1
747 1 58 LEU QD 1 62 ASP H . . 5.440 4.270 3.727 4.536 . 0 0 "[ . 1 . 2]" 1
748 1 58 LEU QD 1 63 ARG H . . 5.440 5.453 5.126 5.568 0.128 12 0 "[ . 1 . 2]" 1
749 1 58 LEU QD 1 97 VAL MG1 . . 5.440 2.095 1.934 2.358 . 0 0 "[ . 1 . 2]" 1
750 1 58 LEU QD 1 97 VAL MG2 . . 5.440 2.822 2.290 3.197 . 0 0 "[ . 1 . 2]" 1
751 1 58 LEU MD1 1 59 LYS H . . 5.160 2.361 2.031 2.597 . 0 0 "[ . 1 . 2]" 1
752 1 58 LEU MD2 1 59 LYS H . . 5.160 4.489 4.181 4.781 . 0 0 "[ . 1 . 2]" 1
753 1 58 LEU HG 1 59 LYS H . . 3.890 3.117 2.738 3.536 . 0 0 "[ . 1 . 2]" 1
754 1 58 LEU HG 1 59 LYS HA . . 3.940 3.928 3.812 3.982 0.042 2 0 "[ . 1 . 2]" 1
755 1 59 LYS H 1 62 ASP HB2 . . 5.500 3.781 2.984 5.366 . 0 0 "[ . 1 . 2]" 1
756 1 59 LYS H 1 62 ASP HB3 . . 5.500 4.512 3.895 5.180 . 0 0 "[ . 1 . 2]" 1
757 1 59 LYS HA 1 60 ALA H . . 3.520 2.482 2.302 2.582 . 0 0 "[ . 1 . 2]" 1
758 1 59 LYS HA 1 60 ALA MB . . 4.290 4.109 4.017 4.204 . 0 0 "[ . 1 . 2]" 1
759 1 59 LYS QB 1 60 ALA MB . . 4.280 3.928 3.649 4.431 0.151 12 0 "[ . 1 . 2]" 1
760 1 59 LYS HB2 1 60 ALA H . . 5.400 3.321 2.221 4.056 . 0 0 "[ . 1 . 2]" 1
761 1 59 LYS HB3 1 60 ALA H . . 5.400 2.767 2.088 3.762 . 0 0 "[ . 1 . 2]" 1
762 1 60 ALA H 1 60 ALA MB . . 3.220 2.237 2.143 2.318 . 0 0 "[ . 1 . 2]" 1
763 1 60 ALA H 1 61 GLY H . . 5.410 4.531 4.451 4.618 . 0 0 "[ . 1 . 2]" 1
764 1 60 ALA H 1 62 ASP H . . 5.470 4.797 4.564 5.048 . 0 0 "[ . 1 . 2]" 1
765 1 60 ALA HA 1 62 ASP H . . 4.520 3.359 3.125 3.478 . 0 0 "[ . 1 . 2]" 1
766 1 60 ALA HA 1 62 ASP QB . . 5.340 4.993 4.584 5.497 0.157 10 0 "[ . 1 . 2]" 1
767 1 60 ALA MB 1 61 GLY H . . 4.240 2.884 2.597 3.122 . 0 0 "[ . 1 . 2]" 1
768 1 60 ALA MB 1 61 GLY HA2 . . 5.500 4.175 4.030 4.302 . 0 0 "[ . 1 . 2]" 1
769 1 60 ALA MB 1 62 ASP H . . 4.760 4.429 4.281 4.613 . 0 0 "[ . 1 . 2]" 1
770 1 61 GLY H 1 62 ASP H . . 4.040 2.545 2.305 2.787 . 0 0 "[ . 1 . 2]" 1
771 1 61 GLY H 1 62 ASP QB . . 5.340 4.700 4.354 5.230 . 0 0 "[ . 1 . 2]" 1
772 1 62 ASP H 1 62 ASP QB . . 3.660 2.541 2.344 2.952 . 0 0 "[ . 1 . 2]" 1
773 1 62 ASP H 1 63 ARG H . . 5.320 4.542 4.472 4.604 . 0 0 "[ . 1 . 2]" 1
774 1 62 ASP HA 1 63 ARG HB2 . . 5.500 4.379 3.979 5.536 0.036 13 0 "[ . 1 . 2]" 1
775 1 62 ASP HA 1 97 VAL HB . . 5.500 4.561 4.140 4.821 . 0 0 "[ . 1 . 2]" 1
776 1 62 ASP HA 1 97 VAL MG1 . . 5.330 5.258 4.708 5.443 0.113 14 0 "[ . 1 . 2]" 1
777 1 62 ASP QB 1 97 VAL HB . . 4.740 2.483 2.255 2.826 . 0 0 "[ . 1 . 2]" 1
778 1 63 ARG H 1 63 ARG HB2 . . 4.090 3.002 2.762 3.852 . 0 0 "[ . 1 . 2]" 1
779 1 63 ARG H 1 63 ARG QD . . 5.180 4.549 4.055 5.062 . 0 0 "[ . 1 . 2]" 1
780 1 63 ARG H 1 65 ILE MD . . 5.380 4.968 4.695 5.336 . 0 0 "[ . 1 . 2]" 1
781 1 63 ARG H 1 65 ILE QG . . 5.310 4.978 4.664 5.306 . 0 0 "[ . 1 . 2]" 1
782 1 63 ARG H 1 97 VAL HA . . 5.500 4.793 4.594 5.011 . 0 0 "[ . 1 . 2]" 1
783 1 63 ARG H 1 97 VAL HB . . 5.110 3.356 3.206 3.538 . 0 0 "[ . 1 . 2]" 1
784 1 63 ARG H 1 97 VAL MG1 . . 5.030 4.513 4.302 4.765 . 0 0 "[ . 1 . 2]" 1
785 1 63 ARG H 1 97 VAL MG2 . . 4.230 4.267 4.239 4.301 0.071 9 0 "[ . 1 . 2]" 1
786 1 63 ARG H 1 98 PHE H . . 4.500 3.029 2.734 3.234 . 0 0 "[ . 1 . 2]" 1
787 1 63 ARG HA 1 64 LEU HB2 . . 5.500 4.252 4.017 4.393 . 0 0 "[ . 1 . 2]" 1
788 1 63 ARG HA 1 64 LEU HB3 . . 5.500 4.712 4.593 4.851 . 0 0 "[ . 1 . 2]" 1
789 1 63 ARG HA 1 98 PHE H . . 5.500 4.549 4.377 4.743 . 0 0 "[ . 1 . 2]" 1
790 1 63 ARG HB3 1 64 LEU H . . 5.500 4.268 4.086 4.467 . 0 0 "[ . 1 . 2]" 1
791 1 63 ARG HB3 1 65 ILE MD . . 5.500 3.482 3.042 4.733 . 0 0 "[ . 1 . 2]" 1
792 1 63 ARG HB3 1 98 PHE H . . 4.880 3.392 2.981 4.949 0.069 14 0 "[ . 1 . 2]" 1
793 1 63 ARG HB3 1 98 PHE QB . . 4.420 2.407 1.850 4.488 0.068 13 0 "[ . 1 . 2]" 1
794 1 63 ARG QD 1 65 ILE MD . . 3.530 2.835 2.156 3.523 . 0 0 "[ . 1 . 2]" 1
795 1 63 ARG HD2 1 98 PHE QD . . 5.500 4.403 3.084 5.526 0.026 8 0 "[ . 1 . 2]" 1
796 1 63 ARG HD3 1 98 PHE QD . . 5.500 3.987 2.309 5.257 . 0 0 "[ . 1 . 2]" 1
797 1 63 ARG QG 1 64 LEU H . . 4.150 2.986 2.650 4.030 . 0 0 "[ . 1 . 2]" 1
798 1 63 ARG QG 1 65 ILE MD . . 3.460 2.338 2.109 2.693 . 0 0 "[ . 1 . 2]" 1
799 1 63 ARG QG 1 98 PHE H . . 4.940 3.872 2.676 4.198 . 0 0 "[ . 1 . 2]" 1
800 1 63 ARG QG 1 98 PHE QD . . 5.050 4.385 2.521 5.065 0.015 6 0 "[ . 1 . 2]" 1
801 1 64 LEU H 1 64 LEU HB3 . . 4.050 2.639 2.562 2.802 . 0 0 "[ . 1 . 2]" 1
802 1 64 LEU H 1 64 LEU QD . . 5.020 3.716 3.611 3.810 . 0 0 "[ . 1 . 2]" 1
803 1 64 LEU H 1 64 LEU HG . . 4.700 4.528 4.231 4.666 . 0 0 "[ . 1 . 2]" 1
804 1 64 LEU H 1 65 ILE H . . 5.140 4.480 4.396 4.564 . 0 0 "[ . 1 . 2]" 1
805 1 64 LEU H 1 97 VAL MG1 . . 4.680 4.153 3.787 4.489 . 0 0 "[ . 1 . 2]" 1
806 1 64 LEU HA 1 64 LEU QD . . 3.730 2.134 1.934 2.705 . 0 0 "[ . 1 . 2]" 1
807 1 64 LEU HA 1 66 GLU H . . 4.860 4.284 4.093 4.491 . 0 0 "[ . 1 . 2]" 1
808 1 64 LEU HA 1 97 VAL HA . . 4.490 2.558 2.344 2.842 . 0 0 "[ . 1 . 2]" 1
809 1 64 LEU HA 1 97 VAL HB . . 5.390 3.427 3.135 3.709 . 0 0 "[ . 1 . 2]" 1
810 1 64 LEU HA 1 97 VAL MG1 . . 3.990 2.130 1.881 2.435 . 0 0 "[ . 1 . 2]" 1
811 1 64 LEU HA 1 98 PHE H . . 5.280 3.844 3.568 4.154 . 0 0 "[ . 1 . 2]" 1
812 1 64 LEU HB2 1 65 ILE H . . 5.100 4.492 4.396 4.568 . 0 0 "[ . 1 . 2]" 1
813 1 64 LEU HB3 1 65 ILE H . . 4.580 4.106 3.992 4.202 . 0 0 "[ . 1 . 2]" 1
814 1 64 LEU QD 1 65 ILE H . . 5.370 2.479 2.225 2.899 . 0 0 "[ . 1 . 2]" 1
815 1 64 LEU QD 1 95 LEU HB3 . . 3.890 2.403 1.979 3.457 . 0 0 "[ . 1 . 2]" 1
816 1 64 LEU HG 1 65 ILE H . . 5.500 3.816 3.080 4.976 . 0 0 "[ . 1 . 2]" 1
817 1 64 LEU HG 1 95 LEU QD . . 3.370 3.270 2.402 3.536 0.166 20 0 "[ . 1 . 2]" 1
818 1 65 ILE H 1 65 ILE MD . . 4.700 3.586 3.475 3.686 . 0 0 "[ . 1 . 2]" 1
819 1 65 ILE H 1 65 ILE QG . . 4.270 2.584 2.483 2.686 . 0 0 "[ . 1 . 2]" 1
820 1 65 ILE H 1 65 ILE MG . . 4.660 3.798 3.763 3.854 . 0 0 "[ . 1 . 2]" 1
821 1 65 ILE H 1 66 GLU H . . 3.900 2.341 2.236 2.493 . 0 0 "[ . 1 . 2]" 1
822 1 65 ILE H 1 72 LEU MD2 . . 5.500 4.900 4.582 5.231 . 0 0 "[ . 1 . 2]" 1
823 1 65 ILE H 1 97 VAL HA . . 4.520 2.381 2.163 2.553 . 0 0 "[ . 1 . 2]" 1
824 1 65 ILE H 1 97 VAL MG1 . . 4.310 3.377 3.103 3.641 . 0 0 "[ . 1 . 2]" 1
825 1 65 ILE HA 1 65 ILE MD . . 3.900 2.033 1.990 2.134 . 0 0 "[ . 1 . 2]" 1
826 1 65 ILE HA 1 65 ILE MG . . 3.440 2.447 2.392 2.492 . 0 0 "[ . 1 . 2]" 1
827 1 65 ILE HA 1 66 GLU QG . . 5.240 4.783 4.604 5.027 . 0 0 "[ . 1 . 2]" 1
828 1 65 ILE HA 1 72 LEU HG . . 4.700 4.283 3.465 4.770 0.070 15 0 "[ . 1 . 2]" 1
829 1 65 ILE HB 1 66 GLU H . . 3.720 2.350 2.155 2.515 . 0 0 "[ . 1 . 2]" 1
830 1 65 ILE HB 1 66 GLU HA . . 5.500 4.721 4.599 4.842 . 0 0 "[ . 1 . 2]" 1
831 1 65 ILE HB 1 97 VAL HA . . 5.500 3.421 3.111 3.621 . 0 0 "[ . 1 . 2]" 1
832 1 65 ILE MD 1 66 GLU H . . 5.400 4.611 4.534 4.683 . 0 0 "[ . 1 . 2]" 1
833 1 65 ILE MD 1 97 VAL HA . . 5.110 4.062 3.937 4.237 . 0 0 "[ . 1 . 2]" 1
834 1 65 ILE MD 1 98 PHE H . . 4.830 3.488 3.207 3.694 . 0 0 "[ . 1 . 2]" 1
835 1 65 ILE MD 1 98 PHE HA . . 4.840 4.163 4.052 4.301 . 0 0 "[ . 1 . 2]" 1
836 1 65 ILE MD 1 98 PHE QB . . 4.280 1.880 1.805 1.994 . 0 0 "[ . 1 . 2]" 1
837 1 65 ILE MD 1 98 PHE QD . . 4.460 3.293 3.017 3.507 . 0 0 "[ . 1 . 2]" 1
838 1 65 ILE MD 1 98 PHE QE . . 4.940 4.665 4.360 4.920 . 0 0 "[ . 1 . 2]" 1
839 1 65 ILE QG 1 66 GLU H . . 4.680 3.916 3.803 4.037 . 0 0 "[ . 1 . 2]" 1
840 1 65 ILE QG 1 97 VAL HA . . 5.020 2.431 2.293 2.633 . 0 0 "[ . 1 . 2]" 1
841 1 65 ILE QG 1 97 VAL MG2 . . 4.390 4.506 4.455 4.550 0.160 15 0 "[ . 1 . 2]" 1
842 1 65 ILE QG 1 98 PHE H . . 5.190 2.540 2.385 2.735 . 0 0 "[ . 1 . 2]" 1
843 1 65 ILE QG 1 98 PHE QB . . 4.740 1.991 1.857 2.103 . 0 0 "[ . 1 . 2]" 1
844 1 65 ILE MG 1 66 GLU H . . 4.400 3.159 2.959 3.286 . 0 0 "[ . 1 . 2]" 1
845 1 65 ILE MG 1 66 GLU HA . . 5.270 3.960 3.761 4.065 . 0 0 "[ . 1 . 2]" 1
846 1 65 ILE MG 1 66 GLU HB2 . . 4.160 4.119 3.886 4.219 0.059 15 0 "[ . 1 . 2]" 1
847 1 65 ILE MG 1 66 GLU HB3 . . 4.010 2.636 2.396 2.786 . 0 0 "[ . 1 . 2]" 1
848 1 65 ILE MG 1 66 GLU QG . . 4.710 2.517 2.334 2.780 . 0 0 "[ . 1 . 2]" 1
849 1 65 ILE MG 1 71 ASP HA . . 5.060 4.103 3.754 4.676 . 0 0 "[ . 1 . 2]" 1
850 1 65 ILE MG 1 73 ALA H . . 5.500 4.065 3.666 4.840 . 0 0 "[ . 1 . 2]" 1
851 1 65 ILE MG 1 97 VAL HA . . 5.500 4.749 4.525 4.889 . 0 0 "[ . 1 . 2]" 1
852 1 65 ILE MG 1 98 PHE QB . . 5.400 3.873 3.698 4.043 . 0 0 "[ . 1 . 2]" 1
853 1 65 ILE MG 1 98 PHE QD . . 4.790 4.521 4.176 4.801 0.011 17 0 "[ . 1 . 2]" 1
854 1 66 GLU H 1 67 VAL H . . 5.390 4.248 4.145 4.312 . 0 0 "[ . 1 . 2]" 1
855 1 66 GLU H 1 72 LEU MD1 . . 4.570 3.867 3.428 4.638 0.068 7 0 "[ . 1 . 2]" 1
856 1 66 GLU H 1 95 LEU HA . . 5.310 4.785 4.535 5.178 . 0 0 "[ . 1 . 2]" 1
857 1 66 GLU H 1 96 LEU H . . 4.330 3.093 2.819 3.335 . 0 0 "[ . 1 . 2]" 1
858 1 66 GLU H 1 96 LEU HB2 . . 4.410 3.882 3.029 4.295 . 0 0 "[ . 1 . 2]" 1
859 1 66 GLU H 1 96 LEU HB3 . . 4.930 2.485 2.045 3.559 . 0 0 "[ . 1 . 2]" 1
860 1 66 GLU H 1 96 LEU QD . . 4.270 3.368 3.031 4.238 . 0 0 "[ . 1 . 2]" 1
861 1 66 GLU H 1 97 VAL HA . . 5.500 4.174 3.974 4.431 . 0 0 "[ . 1 . 2]" 1
862 1 66 GLU HA 1 67 VAL HB . . 5.500 4.349 4.172 4.570 . 0 0 "[ . 1 . 2]" 1
863 1 66 GLU HA 1 67 VAL MG1 . . 5.090 3.659 3.482 3.834 . 0 0 "[ . 1 . 2]" 1
864 1 66 GLU HA 1 69 GLY H . . 5.500 5.361 5.115 5.544 0.044 17 0 "[ . 1 . 2]" 1
865 1 66 GLU HA 1 70 VAL H . . 5.160 4.982 4.652 5.183 0.023 7 0 "[ . 1 . 2]" 1
866 1 66 GLU HA 1 71 ASP HA . . 4.460 3.158 2.559 3.978 . 0 0 "[ . 1 . 2]" 1
867 1 66 GLU HA 1 72 LEU H . . 4.700 2.743 2.405 3.189 . 0 0 "[ . 1 . 2]" 1
868 1 66 GLU HA 1 72 LEU MD1 . . 4.500 3.089 2.547 3.759 . 0 0 "[ . 1 . 2]" 1
869 1 66 GLU HA 1 72 LEU MD2 . . 4.530 2.080 1.827 2.324 . 0 0 "[ . 1 . 2]" 1
870 1 66 GLU HA 1 72 LEU HG . . 5.100 2.070 1.778 2.843 . 0 0 "[ . 1 . 2]" 1
871 1 66 GLU HB2 1 67 VAL H . . 3.800 2.482 2.228 2.748 . 0 0 "[ . 1 . 2]" 1
872 1 66 GLU HB2 1 69 GLY H . . 5.070 3.674 3.343 4.189 . 0 0 "[ . 1 . 2]" 1
873 1 66 GLU HB2 1 69 GLY QA . . 5.340 3.988 3.640 4.601 . 0 0 "[ . 1 . 2]" 1
874 1 66 GLU HB2 1 70 VAL H . . 4.700 3.530 3.356 3.781 . 0 0 "[ . 1 . 2]" 1
875 1 66 GLU HB2 1 70 VAL HA . . 5.500 4.507 4.341 4.768 . 0 0 "[ . 1 . 2]" 1
876 1 66 GLU HB2 1 71 ASP H . . 5.240 4.161 3.821 4.603 . 0 0 "[ . 1 . 2]" 1
877 1 66 GLU HB2 1 71 ASP HA . . 4.750 2.627 2.022 3.154 . 0 0 "[ . 1 . 2]" 1
878 1 66 GLU HB2 1 72 LEU H . . 4.800 3.792 3.389 4.271 . 0 0 "[ . 1 . 2]" 1
879 1 66 GLU HB2 1 96 LEU H . . 5.500 5.224 4.959 5.503 0.003 14 0 "[ . 1 . 2]" 1
880 1 66 GLU HB3 1 67 VAL H . . 5.190 3.728 3.581 3.853 . 0 0 "[ . 1 . 2]" 1
881 1 66 GLU HB3 1 70 VAL H . . 5.470 5.230 5.028 5.494 0.024 20 0 "[ . 1 . 2]" 1
882 1 66 GLU HB3 1 71 ASP H . . 5.500 4.676 4.422 5.323 . 0 0 "[ . 1 . 2]" 1
883 1 66 GLU HB3 1 71 ASP HA . . 4.920 2.202 1.884 2.921 . 0 0 "[ . 1 . 2]" 1
884 1 66 GLU HB3 1 72 LEU H . . 5.370 3.039 2.549 3.454 . 0 0 "[ . 1 . 2]" 1
885 1 66 GLU QG 1 67 VAL H . . 4.740 3.616 3.317 3.910 . 0 0 "[ . 1 . 2]" 1
886 1 66 GLU QG 1 69 GLY H . . 4.850 3.641 3.096 4.812 . 0 0 "[ . 1 . 2]" 1
887 1 66 GLU QG 1 69 GLY QA . . 5.340 3.987 3.376 4.662 . 0 0 "[ . 1 . 2]" 1
888 1 66 GLU QG 1 70 VAL H . . 4.710 4.654 4.128 4.788 0.078 1 0 "[ . 1 . 2]" 1
889 1 66 GLU QG 1 71 ASP HA . . 4.640 4.084 3.223 4.664 0.024 15 0 "[ . 1 . 2]" 1
890 1 66 GLU QG 1 72 LEU MD2 . . 4.370 4.430 4.230 4.583 0.213 10 0 "[ . 1 . 2]" 1
891 1 66 GLU QG 1 96 LEU H . . 4.840 3.426 3.020 3.798 . 0 0 "[ . 1 . 2]" 1
892 1 67 VAL H 1 67 VAL MG1 . . 3.960 2.313 2.223 2.459 . 0 0 "[ . 1 . 2]" 1
893 1 67 VAL H 1 67 VAL MG2 . . 4.540 3.931 3.870 3.999 . 0 0 "[ . 1 . 2]" 1
894 1 67 VAL H 1 68 ASN H . . 5.460 4.215 4.055 4.347 . 0 0 "[ . 1 . 2]" 1
895 1 67 VAL H 1 69 GLY H . . 5.330 3.688 3.502 3.951 . 0 0 "[ . 1 . 2]" 1
896 1 67 VAL H 1 70 VAL H . . 4.360 3.143 3.024 3.275 . 0 0 "[ . 1 . 2]" 1
897 1 67 VAL H 1 70 VAL HB . . 4.680 3.246 2.999 3.484 . 0 0 "[ . 1 . 2]" 1
898 1 67 VAL H 1 70 VAL QG . . 4.890 3.844 3.628 4.048 . 0 0 "[ . 1 . 2]" 1
899 1 67 VAL H 1 71 ASP HA . . 5.020 4.085 3.691 4.939 . 0 0 "[ . 1 . 2]" 1
900 1 67 VAL H 1 72 LEU H . . 4.840 4.333 3.907 4.808 . 0 0 "[ . 1 . 2]" 1
901 1 67 VAL H 1 72 LEU MD1 . . 4.220 4.281 4.224 4.358 0.138 11 0 "[ . 1 . 2]" 1
902 1 67 VAL H 1 72 LEU MD2 . . 4.230 2.214 2.046 2.399 . 0 0 "[ . 1 . 2]" 1
903 1 67 VAL H 1 72 LEU HG . . 4.230 3.724 3.412 4.347 0.117 14 0 "[ . 1 . 2]" 1
904 1 67 VAL H 1 96 LEU HB2 . . 5.500 5.574 5.293 5.623 0.123 14 0 "[ . 1 . 2]" 1
905 1 67 VAL HA 1 72 LEU MD1 . . 5.500 5.457 5.062 5.602 0.102 15 0 "[ . 1 . 2]" 1
906 1 67 VAL HA 1 72 LEU MD2 . . 5.500 3.862 3.660 4.099 . 0 0 "[ . 1 . 2]" 1
907 1 67 VAL HA 1 95 LEU MD1 . . 5.500 4.611 2.918 5.582 0.082 17 0 "[ . 1 . 2]" 1
908 1 67 VAL HA 1 95 LEU QD . . 4.040 3.116 2.801 4.107 0.067 1 0 "[ . 1 . 2]" 1
909 1 67 VAL HA 1 95 LEU MD2 . . 5.500 3.687 2.811 5.002 . 0 0 "[ . 1 . 2]" 1
910 1 67 VAL HA 1 96 LEU H . . 5.500 3.071 2.903 3.248 . 0 0 "[ . 1 . 2]" 1
911 1 67 VAL HB 1 68 ASN H . . 5.500 4.237 4.115 4.318 . 0 0 "[ . 1 . 2]" 1
912 1 67 VAL HB 1 72 LEU MD2 . . 3.470 2.747 2.323 3.173 . 0 0 "[ . 1 . 2]" 1
913 1 67 VAL MG1 1 68 ASN H . . 4.710 3.989 3.816 4.251 . 0 0 "[ . 1 . 2]" 1
914 1 67 VAL MG1 1 68 ASN HB2 . . 5.220 3.376 3.013 4.346 . 0 0 "[ . 1 . 2]" 1
915 1 67 VAL MG1 1 68 ASN QB . . 4.540 3.178 2.730 3.463 . 0 0 "[ . 1 . 2]" 1
916 1 67 VAL MG1 1 68 ASN HB3 . . 5.220 4.377 3.080 5.065 . 0 0 "[ . 1 . 2]" 1
917 1 67 VAL MG1 1 68 ASN QD . . 5.080 4.766 3.371 5.187 0.107 16 0 "[ . 1 . 2]" 1
918 1 67 VAL MG1 1 69 GLY H . . 4.960 4.352 3.722 4.600 . 0 0 "[ . 1 . 2]" 1
919 1 67 VAL MG1 1 70 VAL H . . 3.440 3.485 3.420 3.548 0.108 1 0 "[ . 1 . 2]" 1
920 1 67 VAL MG1 1 72 LEU HB3 . . 4.470 3.887 3.461 4.345 . 0 0 "[ . 1 . 2]" 1
921 1 67 VAL MG2 1 68 ASN H . . 4.570 2.716 2.460 3.018 . 0 0 "[ . 1 . 2]" 1
922 1 67 VAL MG2 1 68 ASN HB2 . . 4.850 2.785 1.889 3.567 . 0 0 "[ . 1 . 2]" 1
923 1 67 VAL MG2 1 68 ASN QB . . 4.070 2.718 1.876 3.435 . 0 0 "[ . 1 . 2]" 1
924 1 67 VAL MG2 1 68 ASN HB3 . . 4.850 3.892 2.386 4.483 . 0 0 "[ . 1 . 2]" 1
925 1 67 VAL MG2 1 68 ASN HD21 . . 4.730 3.920 2.790 4.690 . 0 0 "[ . 1 . 2]" 1
926 1 67 VAL MG2 1 68 ASN QD . . 4.130 3.480 2.564 3.907 . 0 0 "[ . 1 . 2]" 1
927 1 67 VAL MG2 1 68 ASN HD22 . . 4.730 4.112 2.846 4.919 0.189 4 0 "[ . 1 . 2]" 1
928 1 67 VAL MG2 1 69 GLY H . . 5.340 4.469 4.265 4.643 . 0 0 "[ . 1 . 2]" 1
929 1 67 VAL MG2 1 70 VAL H . . 4.860 4.618 4.269 4.817 . 0 0 "[ . 1 . 2]" 1
930 1 67 VAL MG2 1 94 SER H . . 4.770 3.369 2.896 3.819 . 0 0 "[ . 1 . 2]" 1
931 1 67 VAL MG2 1 94 SER QB . . 4.270 4.032 3.534 4.325 0.055 14 0 "[ . 1 . 2]" 1
932 1 67 VAL MG2 1 95 LEU HA . . 5.210 3.013 2.833 3.241 . 0 0 "[ . 1 . 2]" 1
933 1 67 VAL MG2 1 96 LEU H . . 4.410 4.447 4.287 4.526 0.116 8 0 "[ . 1 . 2]" 1
934 1 68 ASN H 1 69 GLY H . . 4.240 2.816 2.596 3.622 . 0 0 "[ . 1 . 2]" 1
935 1 68 ASN H 1 70 VAL H . . 5.500 4.244 4.059 4.677 . 0 0 "[ . 1 . 2]" 1
936 1 68 ASN H 1 94 SER H . . 4.510 3.692 2.909 4.225 . 0 0 "[ . 1 . 2]" 1
937 1 68 ASN H 1 94 SER HA . . 5.270 4.805 4.253 5.288 0.018 14 0 "[ . 1 . 2]" 1
938 1 68 ASN H 1 94 SER QB . . 5.030 2.793 2.106 3.216 . 0 0 "[ . 1 . 2]" 1
939 1 68 ASN HA 1 70 VAL H . . 4.990 4.545 4.368 4.995 0.005 17 0 "[ . 1 . 2]" 1
940 1 68 ASN QB 1 70 VAL H . . 4.830 3.393 3.160 3.667 . 0 0 "[ . 1 . 2]" 1
941 1 68 ASN HB2 1 69 GLY H . . 5.500 3.974 2.194 4.506 . 0 0 "[ . 1 . 2]" 1
942 1 68 ASN HB2 1 70 VAL H . . 5.500 3.886 3.263 4.994 . 0 0 "[ . 1 . 2]" 1
943 1 68 ASN HB3 1 69 GLY H . . 5.500 4.121 3.218 4.413 . 0 0 "[ . 1 . 2]" 1
944 1 68 ASN HB3 1 70 VAL H . . 5.500 4.175 3.223 4.762 . 0 0 "[ . 1 . 2]" 1
945 1 68 ASN QD 1 93 VAL QG . . 4.270 3.206 1.988 4.357 0.087 2 0 "[ . 1 . 2]" 1
946 1 68 ASN QD 1 94 SER H . . 4.960 3.255 2.016 4.194 . 0 0 "[ . 1 . 2]" 1
947 1 68 ASN QD 1 94 SER QB . . 5.090 4.016 2.248 5.047 . 0 0 "[ . 1 . 2]" 1
948 1 69 GLY H 1 70 VAL H . . 3.980 2.262 1.566 2.497 . 0 0 "[ . 1 . 2]" 1
949 1 69 GLY H 1 70 VAL HB . . 5.500 4.565 3.808 4.720 . 0 0 "[ . 1 . 2]" 1
950 1 69 GLY H 1 72 LEU MD2 . . 5.500 5.286 5.037 5.508 0.008 9 0 "[ . 1 . 2]" 1
951 1 70 VAL H 1 70 VAL HB . . 3.510 2.506 2.434 2.559 . 0 0 "[ . 1 . 2]" 1
952 1 70 VAL H 1 70 VAL QG . . 4.180 2.342 2.157 2.486 . 0 0 "[ . 1 . 2]" 1
953 1 70 VAL H 1 71 ASP H . . 5.150 4.343 4.267 4.426 . 0 0 "[ . 1 . 2]" 1
954 1 70 VAL HA 1 71 ASP H . . 3.300 2.129 2.057 2.175 . 0 0 "[ . 1 . 2]" 1
955 1 70 VAL HA 1 72 LEU MD2 . . 5.230 5.095 4.612 5.357 0.127 11 0 "[ . 1 . 2]" 1
956 1 70 VAL HB 1 71 ASP H . . 5.110 4.253 4.216 4.291 . 0 0 "[ . 1 . 2]" 1
957 1 70 VAL QG 1 71 ASP H . . 3.760 2.859 2.820 2.915 . 0 0 "[ . 1 . 2]" 1
958 1 70 VAL QG 1 71 ASP HA . . 5.330 4.045 3.882 4.137 . 0 0 "[ . 1 . 2]" 1
959 1 70 VAL QG 1 72 LEU H . . 5.000 4.363 3.701 4.724 . 0 0 "[ . 1 . 2]" 1
960 1 70 VAL QG 1 72 LEU HA . . 4.840 4.045 3.538 4.455 . 0 0 "[ . 1 . 2]" 1
961 1 70 VAL QG 1 72 LEU HB3 . . 3.770 3.402 2.839 3.858 0.088 14 0 "[ . 1 . 2]" 1
962 1 71 ASP H 1 71 ASP QB . . 3.280 2.438 2.275 2.802 . 0 0 "[ . 1 . 2]" 1
963 1 71 ASP H 1 72 LEU H . . 5.470 4.427 4.095 4.560 . 0 0 "[ . 1 . 2]" 1
964 1 71 ASP H 1 72 LEU MD2 . . 5.460 4.932 4.202 5.405 . 0 0 "[ . 1 . 2]" 1
965 1 71 ASP HA 1 72 LEU MD1 . . 5.230 4.889 4.441 5.295 0.065 20 0 "[ . 1 . 2]" 1
966 1 71 ASP HA 1 72 LEU MD2 . . 5.410 3.781 2.766 4.605 . 0 0 "[ . 1 . 2]" 1
967 1 71 ASP HA 1 72 LEU HG . . 4.660 3.668 3.019 4.198 . 0 0 "[ . 1 . 2]" 1
968 1 71 ASP HA 1 73 ALA H . . 5.140 3.453 3.038 3.738 . 0 0 "[ . 1 . 2]" 1
969 1 71 ASP HA 1 73 ALA MB . . 4.710 4.493 4.154 4.718 0.008 10 0 "[ . 1 . 2]" 1
970 1 71 ASP QB 1 73 ALA H . . 5.030 3.462 2.487 4.224 . 0 0 "[ . 1 . 2]" 1
971 1 72 LEU H 1 72 LEU HB3 . . 3.830 3.258 2.876 3.442 . 0 0 "[ . 1 . 2]" 1
972 1 72 LEU H 1 72 LEU MD1 . . 4.140 3.373 2.953 3.971 . 0 0 "[ . 1 . 2]" 1
973 1 72 LEU H 1 72 LEU MD2 . . 4.490 3.031 1.839 3.684 . 0 0 "[ . 1 . 2]" 1
974 1 72 LEU H 1 72 LEU HG . . 3.840 2.068 1.827 2.430 . 0 0 "[ . 1 . 2]" 1
975 1 72 LEU H 1 73 ALA H . . 4.080 2.097 1.804 2.506 . 0 0 "[ . 1 . 2]" 1
976 1 72 LEU H 1 73 ALA MB . . 5.130 3.682 3.340 4.044 . 0 0 "[ . 1 . 2]" 1
977 1 72 LEU H 1 80 VAL MG1 . . 5.500 4.773 4.221 5.047 . 0 0 "[ . 1 . 2]" 1
978 1 72 LEU HA 1 72 LEU MD2 . . 4.410 3.782 3.142 4.055 . 0 0 "[ . 1 . 2]" 1
979 1 72 LEU HA 1 74 GLY H . . 3.730 3.431 2.668 3.828 0.098 15 0 "[ . 1 . 2]" 1
980 1 72 LEU HA 1 75 LYS H . . 4.010 2.992 2.397 3.574 . 0 0 "[ . 1 . 2]" 1
981 1 72 LEU HA 1 75 LYS HB2 . . 5.230 2.584 1.923 3.324 . 0 0 "[ . 1 . 2]" 1
982 1 72 LEU HA 1 75 LYS HB3 . . 5.500 4.016 3.553 4.690 . 0 0 "[ . 1 . 2]" 1
983 1 72 LEU HA 1 75 LYS HG2 . . 4.780 2.423 1.835 4.142 . 0 0 "[ . 1 . 2]" 1
984 1 72 LEU HA 1 80 VAL MG1 . . 4.800 3.697 3.341 4.189 . 0 0 "[ . 1 . 2]" 1
985 1 72 LEU HB3 1 72 LEU MD1 . . 3.490 2.991 2.445 3.214 . 0 0 "[ . 1 . 2]" 1
986 1 72 LEU HB3 1 80 VAL MG1 . . 3.990 2.739 1.796 3.676 . 0 0 "[ . 1 . 2]" 1
987 1 72 LEU MD1 1 73 ALA H . . 5.120 3.884 3.157 5.148 0.028 14 0 "[ . 1 . 2]" 1
988 1 72 LEU MD1 1 80 VAL HA . . 4.740 4.368 3.310 4.818 0.078 13 0 "[ . 1 . 2]" 1
989 1 72 LEU MD1 1 80 VAL HB . . 5.500 2.904 2.425 3.351 . 0 0 "[ . 1 . 2]" 1
990 1 72 LEU MD2 1 75 LYS HB2 . . 5.050 4.760 3.768 5.101 0.051 1 0 "[ . 1 . 2]" 1
991 1 73 ALA H 1 73 ALA MB . . 3.080 2.256 2.203 2.297 . 0 0 "[ . 1 . 2]" 1
992 1 73 ALA HA 1 74 GLY QA . . 4.770 4.252 3.885 4.417 . 0 0 "[ . 1 . 2]" 1
993 1 73 ALA MB 1 74 GLY H . . 4.580 2.966 2.619 3.604 . 0 0 "[ . 1 . 2]" 1
994 1 73 ALA MB 1 74 GLY QA . . 5.340 3.732 3.579 4.004 . 0 0 "[ . 1 . 2]" 1
995 1 74 GLY H 1 75 LYS H . . 4.160 2.239 1.629 2.523 . 0 0 "[ . 1 . 2]" 1
996 1 75 LYS H 1 75 LYS HB2 . . 3.770 2.396 2.300 2.590 . 0 0 "[ . 1 . 2]" 1
997 1 75 LYS H 1 75 LYS HB3 . . 4.040 3.609 3.541 3.696 . 0 0 "[ . 1 . 2]" 1
998 1 75 LYS H 1 75 LYS QD . . 4.380 3.875 3.568 4.034 . 0 0 "[ . 1 . 2]" 1
999 1 75 LYS H 1 75 LYS HG2 . . 3.790 2.849 2.611 3.054 . 0 0 "[ . 1 . 2]" 1
1000 1 75 LYS H 1 76 SER H . . 5.110 4.536 4.488 4.613 . 0 0 "[ . 1 . 2]" 1
1001 1 75 LYS H 1 80 VAL MG1 . . 5.040 4.331 3.815 5.047 0.007 14 0 "[ . 1 . 2]" 1
1002 1 75 LYS HA 1 79 GLU HB2 . . 5.500 4.488 4.220 4.844 . 0 0 "[ . 1 . 2]" 1
1003 1 75 LYS HA 1 79 GLU HB3 . . 5.500 5.218 4.813 5.508 0.008 13 0 "[ . 1 . 2]" 1
1004 1 75 LYS HA 1 80 VAL MG1 . . 5.500 4.846 4.356 5.526 0.026 13 0 "[ . 1 . 2]" 1
1005 1 75 LYS HB2 1 76 SER H . . 5.500 3.781 3.687 4.002 . 0 0 "[ . 1 . 2]" 1
1006 1 75 LYS HB2 1 79 GLU HG3 . . 5.200 4.416 3.699 5.275 0.075 18 0 "[ . 1 . 2]" 1
1007 1 75 LYS HB2 1 80 VAL MG1 . . 3.930 2.659 2.155 3.207 . 0 0 "[ . 1 . 2]" 1
1008 1 75 LYS HB2 1 80 VAL MG2 . . 5.020 4.225 3.593 4.800 . 0 0 "[ . 1 . 2]" 1
1009 1 75 LYS HB3 1 76 SER H . . 4.580 2.494 2.403 2.758 . 0 0 "[ . 1 . 2]" 1
1010 1 75 LYS HB3 1 79 GLU H . . 5.120 4.349 4.122 4.601 . 0 0 "[ . 1 . 2]" 1
1011 1 75 LYS HB3 1 79 GLU HB3 . . 4.600 3.091 2.693 3.459 . 0 0 "[ . 1 . 2]" 1
1012 1 75 LYS HB3 1 79 GLU HG2 . . 5.500 3.762 3.243 4.684 . 0 0 "[ . 1 . 2]" 1
1013 1 75 LYS HB3 1 79 GLU HG3 . . 5.300 2.701 1.985 3.664 . 0 0 "[ . 1 . 2]" 1
1014 1 75 LYS HB3 1 80 VAL H . . 5.280 4.037 3.730 4.623 . 0 0 "[ . 1 . 2]" 1
1015 1 75 LYS HB3 1 80 VAL MG1 . . 4.680 2.880 2.328 3.631 . 0 0 "[ . 1 . 2]" 1
1016 1 75 LYS QD 1 76 SER HA . . 5.340 5.377 5.217 5.449 0.109 15 0 "[ . 1 . 2]" 1
1017 1 75 LYS QD 1 76 SER QB . . 4.480 4.485 4.252 4.563 0.083 6 0 "[ . 1 . 2]" 1
1018 1 75 LYS QD 1 79 GLU HB3 . . 5.070 3.187 2.324 4.070 . 0 0 "[ . 1 . 2]" 1
1019 1 75 LYS QD 1 79 GLU HG2 . . 5.320 3.826 3.402 4.202 . 0 0 "[ . 1 . 2]" 1
1020 1 75 LYS QD 1 79 GLU HG3 . . 5.340 2.361 1.845 3.947 . 0 0 "[ . 1 . 2]" 1
1021 1 75 LYS HG2 1 76 SER H . . 4.960 4.691 4.542 4.810 . 0 0 "[ . 1 . 2]" 1
1022 1 75 LYS HG2 1 79 GLU HB3 . . 5.350 5.173 4.569 5.420 0.070 13 0 "[ . 1 . 2]" 1
1023 1 76 SER H 1 79 GLU H . . 4.700 3.963 3.802 4.107 . 0 0 "[ . 1 . 2]" 1
1024 1 76 SER H 1 79 GLU HA . . 5.500 5.549 5.417 5.618 0.118 12 0 "[ . 1 . 2]" 1
1025 1 76 SER H 1 79 GLU HB2 . . 4.810 3.239 2.969 3.572 . 0 0 "[ . 1 . 2]" 1
1026 1 76 SER H 1 79 GLU HB3 . . 4.550 4.351 4.134 4.571 0.021 11 0 "[ . 1 . 2]" 1
1027 1 76 SER H 1 79 GLU HG2 . . 5.380 3.012 2.486 4.105 . 0 0 "[ . 1 . 2]" 1
1028 1 76 SER H 1 79 GLU HG3 . . 4.110 2.509 2.229 2.944 . 0 0 "[ . 1 . 2]" 1
1029 1 76 SER H 1 80 VAL H . . 5.500 4.952 4.672 5.385 . 0 0 "[ . 1 . 2]" 1
1030 1 76 SER H 1 80 VAL MG1 . . 5.170 4.538 4.093 5.116 . 0 0 "[ . 1 . 2]" 1
1031 1 76 SER HA 1 77 GLN HA . . 4.350 4.287 4.187 4.340 . 0 0 "[ . 1 . 2]" 1
1032 1 76 SER HA 1 79 GLU H . . 5.500 4.727 4.490 4.908 . 0 0 "[ . 1 . 2]" 1
1033 1 76 SER QB 1 78 GLU H . . 4.510 2.987 2.736 3.276 . 0 0 "[ . 1 . 2]" 1
1034 1 76 SER QB 1 78 GLU QB . . 5.180 3.229 2.860 4.000 . 0 0 "[ . 1 . 2]" 1
1035 1 76 SER QB 1 79 GLU H . . 4.830 2.961 2.504 3.860 . 0 0 "[ . 1 . 2]" 1
1036 1 76 SER QB 1 79 GLU HG2 . . 4.070 2.455 1.908 3.647 . 0 0 "[ . 1 . 2]" 1
1037 1 76 SER QB 1 79 GLU HG3 . . 4.060 3.166 2.096 3.998 . 0 0 "[ . 1 . 2]" 1
1038 1 76 SER HB2 1 78 GLU H . . 5.340 3.788 3.141 4.735 . 0 0 "[ . 1 . 2]" 1
1039 1 76 SER HB2 1 79 GLU H . . 5.500 3.705 2.763 4.883 . 0 0 "[ . 1 . 2]" 1
1040 1 76 SER HB3 1 78 GLU H . . 5.340 3.214 2.902 4.693 . 0 0 "[ . 1 . 2]" 1
1041 1 76 SER HB3 1 79 GLU H . . 5.500 3.586 2.523 4.811 . 0 0 "[ . 1 . 2]" 1
1042 1 77 GLN H 1 77 GLN QB . . 3.680 2.534 2.399 2.647 . 0 0 "[ . 1 . 2]" 1
1043 1 77 GLN H 1 78 GLU H . . 4.330 2.701 2.537 2.859 . 0 0 "[ . 1 . 2]" 1
1044 1 77 GLN HA 1 79 GLU H . . 5.500 4.143 3.977 4.491 . 0 0 "[ . 1 . 2]" 1
1045 1 77 GLN HA 1 79 GLU HB2 . . 5.260 4.838 4.494 5.258 . 0 0 "[ . 1 . 2]" 1
1046 1 77 GLN HA 1 80 VAL H . . 4.620 3.508 3.269 3.743 . 0 0 "[ . 1 . 2]" 1
1047 1 77 GLN HA 1 80 VAL MG1 . . 4.310 3.931 3.748 4.169 . 0 0 "[ . 1 . 2]" 1
1048 1 77 GLN HA 1 80 VAL MG2 . . 5.140 2.102 1.890 2.350 . 0 0 "[ . 1 . 2]" 1
1049 1 77 GLN HA 1 81 VAL H . . 5.290 3.837 3.419 4.240 . 0 0 "[ . 1 . 2]" 1
1050 1 77 GLN HA 1 81 VAL QG . . 5.350 3.381 2.876 3.855 . 0 0 "[ . 1 . 2]" 1
1051 1 77 GLN QB 1 78 GLU H . . 4.230 3.480 3.317 3.616 . 0 0 "[ . 1 . 2]" 1
1052 1 77 GLN QB 1 81 VAL QG . . 5.070 2.720 2.117 3.181 . 0 0 "[ . 1 . 2]" 1
1053 1 77 GLN HB2 1 78 GLU H . . 4.910 3.820 3.519 4.005 . 0 0 "[ . 1 . 2]" 1
1054 1 77 GLN HB3 1 78 GLU H . . 4.910 4.016 3.897 4.203 . 0 0 "[ . 1 . 2]" 1
1055 1 77 GLN QE 1 81 VAL QG . . 4.480 4.097 2.889 4.699 0.219 5 0 "[ . 1 . 2]" 1
1056 1 77 GLN QG 1 78 GLU H . . 4.040 2.288 2.059 2.613 . 0 0 "[ . 1 . 2]" 1
1057 1 77 GLN QG 1 78 GLU HA . . 4.030 3.435 3.018 4.138 0.108 13 0 "[ . 1 . 2]" 1
1058 1 77 GLN QG 1 78 GLU QB . . 3.480 3.418 2.969 3.735 0.255 12 0 "[ . 1 . 2]" 1
1059 1 78 GLU H 1 78 GLU HB2 . . 4.040 2.478 2.215 2.636 . 0 0 "[ . 1 . 2]" 1
1060 1 78 GLU H 1 78 GLU QB . . 3.330 2.273 2.185 2.501 . 0 0 "[ . 1 . 2]" 1
1061 1 78 GLU H 1 78 GLU HB3 . . 4.040 2.912 2.373 3.615 . 0 0 "[ . 1 . 2]" 1
1062 1 78 GLU H 1 78 GLU QG . . 4.720 3.422 2.137 3.988 . 0 0 "[ . 1 . 2]" 1
1063 1 78 GLU H 1 79 GLU H . . 3.930 2.608 2.458 2.696 . 0 0 "[ . 1 . 2]" 1
1064 1 78 GLU H 1 80 VAL H . . 5.290 4.252 4.132 4.335 . 0 0 "[ . 1 . 2]" 1
1065 1 78 GLU H 1 80 VAL MG1 . . 5.500 5.558 5.516 5.613 0.113 20 0 "[ . 1 . 2]" 1
1066 1 78 GLU H 1 80 VAL MG2 . . 5.500 4.271 4.067 4.487 . 0 0 "[ . 1 . 2]" 1
1067 1 78 GLU H 1 81 VAL HB . . 5.500 5.032 4.726 5.273 . 0 0 "[ . 1 . 2]" 1
1068 1 78 GLU H 1 81 VAL QG . . 5.160 4.360 3.960 4.567 . 0 0 "[ . 1 . 2]" 1
1069 1 78 GLU HA 1 80 VAL H . . 5.500 4.464 4.363 4.568 . 0 0 "[ . 1 . 2]" 1
1070 1 78 GLU HA 1 81 VAL H . . 4.540 3.528 3.326 3.727 . 0 0 "[ . 1 . 2]" 1
1071 1 78 GLU HA 1 81 VAL HA . . 5.500 5.483 5.238 5.594 0.094 4 0 "[ . 1 . 2]" 1
1072 1 78 GLU HA 1 81 VAL HB . . 3.960 2.740 2.433 2.901 . 0 0 "[ . 1 . 2]" 1
1073 1 78 GLU HA 1 81 VAL MG1 . . 4.530 4.150 3.853 4.338 . 0 0 "[ . 1 . 2]" 1
1074 1 78 GLU HA 1 81 VAL QG . . 3.830 3.293 2.912 3.559 . 0 0 "[ . 1 . 2]" 1
1075 1 78 GLU HA 1 81 VAL MG2 . . 4.530 3.464 2.991 3.818 . 0 0 "[ . 1 . 2]" 1
1076 1 78 GLU HA 1 82 SER H . . 5.170 3.865 3.630 4.106 . 0 0 "[ . 1 . 2]" 1
1077 1 78 GLU QB 1 79 GLU H . . 3.870 2.703 2.467 2.905 . 0 0 "[ . 1 . 2]" 1
1078 1 78 GLU QB 1 79 GLU HG2 . . 3.670 3.521 3.309 3.721 0.051 19 0 "[ . 1 . 2]" 1
1079 1 78 GLU HB2 1 79 GLU H . . 4.540 3.509 2.629 3.995 . 0 0 "[ . 1 . 2]" 1
1080 1 78 GLU HB3 1 79 GLU H . . 4.540 3.119 2.498 3.881 . 0 0 "[ . 1 . 2]" 1
1081 1 78 GLU QG 1 79 GLU H . . 5.340 3.937 3.429 4.707 . 0 0 "[ . 1 . 2]" 1
1082 1 79 GLU H 1 79 GLU HB2 . . 3.710 2.450 2.365 2.549 . 0 0 "[ . 1 . 2]" 1
1083 1 79 GLU H 1 79 GLU HB3 . . 3.950 3.558 3.517 3.594 . 0 0 "[ . 1 . 2]" 1
1084 1 79 GLU H 1 79 GLU HG2 . . 4.020 2.232 2.012 3.003 . 0 0 "[ . 1 . 2]" 1
1085 1 79 GLU H 1 79 GLU HG3 . . 4.260 3.389 1.896 3.633 . 0 0 "[ . 1 . 2]" 1
1086 1 79 GLU H 1 80 VAL H . . 3.800 2.580 2.428 2.709 . 0 0 "[ . 1 . 2]" 1
1087 1 79 GLU H 1 80 VAL MG1 . . 4.480 4.150 3.964 4.331 . 0 0 "[ . 1 . 2]" 1
1088 1 79 GLU H 1 80 VAL MG2 . . 5.500 3.732 3.424 3.998 . 0 0 "[ . 1 . 2]" 1
1089 1 79 GLU H 1 81 VAL H . . 4.890 4.026 3.887 4.195 . 0 0 "[ . 1 . 2]" 1
1090 1 79 GLU HA 1 79 GLU HG2 . . 4.050 2.967 2.491 3.182 . 0 0 "[ . 1 . 2]" 1
1091 1 79 GLU HB2 1 80 VAL H . . 4.580 2.302 2.195 2.391 . 0 0 "[ . 1 . 2]" 1
1092 1 79 GLU HB3 1 80 VAL H . . 4.500 3.429 3.360 3.536 . 0 0 "[ . 1 . 2]" 1
1093 1 79 GLU HB3 1 80 VAL MG1 . . 5.080 3.432 3.222 3.639 . 0 0 "[ . 1 . 2]" 1
1094 1 79 GLU HG2 1 80 VAL H . . 5.500 4.119 3.858 4.560 . 0 0 "[ . 1 . 2]" 1
1095 1 79 GLU HG2 1 80 VAL MG1 . . 5.500 4.817 4.495 5.179 . 0 0 "[ . 1 . 2]" 1
1096 1 79 GLU HG2 1 80 VAL MG2 . . 5.500 5.187 4.929 5.613 0.113 18 0 "[ . 1 . 2]" 1
1097 1 79 GLU HG3 1 80 VAL H . . 5.500 4.519 3.699 4.738 . 0 0 "[ . 1 . 2]" 1
1098 1 79 GLU HG3 1 80 VAL MG1 . . 5.500 4.503 4.303 4.793 . 0 0 "[ . 1 . 2]" 1
1099 1 79 GLU HG3 1 80 VAL MG2 . . 5.500 5.415 4.522 5.579 0.079 3 0 "[ . 1 . 2]" 1
1100 1 80 VAL H 1 80 VAL HB . . 3.840 3.645 3.604 3.678 . 0 0 "[ . 1 . 2]" 1
1101 1 80 VAL H 1 80 VAL MG1 . . 3.450 2.268 2.193 2.368 . 0 0 "[ . 1 . 2]" 1
1102 1 80 VAL H 1 80 VAL MG2 . . 4.400 1.931 1.793 2.079 . 0 0 "[ . 1 . 2]" 1
1103 1 80 VAL H 1 81 VAL H . . 4.000 2.565 2.508 2.671 . 0 0 "[ . 1 . 2]" 1
1104 1 80 VAL HA 1 80 VAL MG1 . . 3.390 2.264 2.209 2.316 . 0 0 "[ . 1 . 2]" 1
1105 1 80 VAL HA 1 80 VAL MG2 . . 3.500 3.184 3.146 3.208 . 0 0 "[ . 1 . 2]" 1
1106 1 80 VAL HA 1 83 LEU H . . 4.400 3.045 2.787 3.313 . 0 0 "[ . 1 . 2]" 1
1107 1 80 VAL HA 1 83 LEU HA . . 5.440 4.982 4.668 5.242 . 0 0 "[ . 1 . 2]" 1
1108 1 80 VAL HA 1 83 LEU HB2 . . 5.500 2.540 2.127 3.011 . 0 0 "[ . 1 . 2]" 1
1109 1 80 VAL HA 1 83 LEU HB3 . . 4.460 4.000 3.657 4.378 . 0 0 "[ . 1 . 2]" 1
1110 1 80 VAL HA 1 83 LEU HG . . 5.500 2.594 2.306 2.911 . 0 0 "[ . 1 . 2]" 1
1111 1 80 VAL HA 1 84 LEU H . . 4.850 4.101 3.651 4.563 . 0 0 "[ . 1 . 2]" 1
1112 1 80 VAL HA 1 84 LEU QD . . 4.570 3.503 2.971 3.947 . 0 0 "[ . 1 . 2]" 1
1113 1 80 VAL HB 1 83 LEU H . . 5.230 4.949 4.828 5.095 . 0 0 "[ . 1 . 2]" 1
1114 1 80 VAL MG1 1 81 VAL H . . 4.400 4.009 3.934 4.103 . 0 0 "[ . 1 . 2]" 1
1115 1 80 VAL MG1 1 83 LEU H . . 5.350 4.826 4.639 5.052 . 0 0 "[ . 1 . 2]" 1
1116 1 80 VAL MG2 1 81 VAL H . . 4.180 2.328 2.184 2.467 . 0 0 "[ . 1 . 2]" 1
1117 1 81 VAL H 1 81 VAL HB . . 3.520 2.550 2.482 2.586 . 0 0 "[ . 1 . 2]" 1
1118 1 81 VAL H 1 81 VAL MG1 . . 4.730 3.802 3.763 3.829 . 0 0 "[ . 1 . 2]" 1
1119 1 81 VAL H 1 81 VAL QG . . 3.510 2.250 2.181 2.333 . 0 0 "[ . 1 . 2]" 1
1120 1 81 VAL H 1 81 VAL MG2 . . 4.730 2.266 2.194 2.355 . 0 0 "[ . 1 . 2]" 1
1121 1 81 VAL H 1 82 SER H . . 3.780 2.638 2.553 2.819 . 0 0 "[ . 1 . 2]" 1
1122 1 81 VAL H 1 83 LEU HB2 . . 5.060 4.953 4.829 5.061 0.001 20 0 "[ . 1 . 2]" 1
1123 1 81 VAL HA 1 84 LEU H . . 4.300 3.397 3.114 3.648 . 0 0 "[ . 1 . 2]" 1
1124 1 81 VAL HA 1 84 LEU HB2 . . 3.980 2.959 2.557 3.213 . 0 0 "[ . 1 . 2]" 1
1125 1 81 VAL HA 1 84 LEU HB3 . . 4.850 4.602 4.210 4.873 0.023 17 0 "[ . 1 . 2]" 1
1126 1 81 VAL HA 1 84 LEU HG . . 5.400 4.721 4.179 5.537 0.137 6 0 "[ . 1 . 2]" 1
1127 1 81 VAL HA 1 85 ARG H . . 5.410 3.897 3.687 4.043 . 0 0 "[ . 1 . 2]" 1
1128 1 81 VAL HB 1 82 SER H . . 3.810 2.858 2.679 3.020 . 0 0 "[ . 1 . 2]" 1
1129 1 81 VAL QG 1 82 SER H . . 3.750 3.297 3.142 3.388 . 0 0 "[ . 1 . 2]" 1
1130 1 81 VAL QG 1 85 ARG H . . 4.690 3.822 3.624 4.044 . 0 0 "[ . 1 . 2]" 1
1131 1 81 VAL QG 1 85 ARG QB . . 4.070 3.126 2.710 3.731 . 0 0 "[ . 1 . 2]" 1
1132 1 81 VAL QG 1 85 ARG QG . . 4.850 3.714 2.315 4.583 . 0 0 "[ . 1 . 2]" 1
1133 1 81 VAL MG1 1 82 SER H . . 4.340 3.516 3.299 3.652 . 0 0 "[ . 1 . 2]" 1
1134 1 81 VAL MG1 1 85 ARG H . . 5.500 3.902 3.679 4.153 . 0 0 "[ . 1 . 2]" 1
1135 1 81 VAL MG2 1 82 SER H . . 4.340 3.989 3.916 4.090 . 0 0 "[ . 1 . 2]" 1
1136 1 81 VAL MG2 1 85 ARG H . . 5.500 5.474 5.347 5.576 0.076 7 0 "[ . 1 . 2]" 1
1137 1 82 SER H 1 83 LEU H . . 3.670 2.623 2.563 2.691 . 0 0 "[ . 1 . 2]" 1
1138 1 82 SER H 1 83 LEU HB2 . . 4.790 4.593 4.490 4.694 . 0 0 "[ . 1 . 2]" 1
1139 1 82 SER H 1 83 LEU HG . . 5.410 4.394 4.251 4.602 . 0 0 "[ . 1 . 2]" 1
1140 1 82 SER HA 1 83 LEU HB2 . . 5.500 5.563 5.532 5.599 0.099 18 0 "[ . 1 . 2]" 1
1141 1 82 SER HA 1 85 ARG H . . 5.500 3.525 3.310 3.884 . 0 0 "[ . 1 . 2]" 1
1142 1 82 SER QB 1 83 LEU H . . 3.820 2.782 2.477 3.581 . 0 0 "[ . 1 . 2]" 1
1143 1 83 LEU H 1 83 LEU HB2 . . 3.660 2.276 2.217 2.321 . 0 0 "[ . 1 . 2]" 1
1144 1 83 LEU H 1 83 LEU HB3 . . 3.780 3.552 3.530 3.589 . 0 0 "[ . 1 . 2]" 1
1145 1 83 LEU H 1 83 LEU HG . . 3.940 2.369 2.255 2.520 . 0 0 "[ . 1 . 2]" 1
1146 1 83 LEU H 1 84 LEU H . . 3.860 2.791 2.650 2.957 . 0 0 "[ . 1 . 2]" 1
1147 1 83 LEU H 1 84 LEU QD . . 3.990 3.850 3.696 3.964 . 0 0 "[ . 1 . 2]" 1
1148 1 83 LEU H 1 85 ARG H . . 5.460 3.993 3.813 4.226 . 0 0 "[ . 1 . 2]" 1
1149 1 83 LEU HA 1 84 LEU QD . . 5.440 4.230 4.124 4.370 . 0 0 "[ . 1 . 2]" 1
1150 1 83 LEU HA 1 86 SER H . . 4.250 3.651 3.316 3.856 . 0 0 "[ . 1 . 2]" 1
1151 1 83 LEU HA 1 87 THR H . . 5.500 4.164 3.698 4.762 . 0 0 "[ . 1 . 2]" 1
1152 1 83 LEU HB2 1 84 LEU H . . 5.500 2.320 2.246 2.372 . 0 0 "[ . 1 . 2]" 1
1153 1 83 LEU HB3 1 84 LEU H . . 4.300 3.284 3.207 3.342 . 0 0 "[ . 1 . 2]" 1
1154 1 83 LEU HB3 1 84 LEU HA . . 4.890 4.146 4.031 4.261 . 0 0 "[ . 1 . 2]" 1
1155 1 84 LEU H 1 84 LEU HB2 . . 3.730 2.306 2.249 2.474 . 0 0 "[ . 1 . 2]" 1
1156 1 84 LEU H 1 84 LEU QD . . 4.160 2.127 2.012 2.237 . 0 0 "[ . 1 . 2]" 1
1157 1 84 LEU H 1 84 LEU HG . . 3.690 3.805 3.601 3.844 0.154 19 0 "[ . 1 . 2]" 1
1158 1 84 LEU H 1 85 ARG H . . 4.120 2.666 2.539 2.788 . 0 0 "[ . 1 . 2]" 1
1159 1 84 LEU H 1 86 SER H . . 5.330 4.181 4.044 4.500 . 0 0 "[ . 1 . 2]" 1
1160 1 84 LEU HA 1 84 LEU QD . . 3.380 2.096 1.956 2.817 . 0 0 "[ . 1 . 2]" 1
1161 1 84 LEU HA 1 86 SER H . . 5.060 4.273 3.969 4.685 . 0 0 "[ . 1 . 2]" 1
1162 1 84 LEU HB2 1 85 ARG H . . 5.500 3.055 2.862 3.288 . 0 0 "[ . 1 . 2]" 1
1163 1 84 LEU HB3 1 85 ARG H . . 4.820 3.679 3.488 3.837 . 0 0 "[ . 1 . 2]" 1
1164 1 84 LEU HB3 1 85 ARG HA . . 5.460 4.354 4.242 4.476 . 0 0 "[ . 1 . 2]" 1
1165 1 84 LEU QD 1 86 SER H . . 5.440 5.017 4.736 5.394 . 0 0 "[ . 1 . 2]" 1
1166 1 84 LEU HG 1 85 ARG H . . 5.500 5.235 5.063 5.333 . 0 0 "[ . 1 . 2]" 1
1167 1 85 ARG H 1 85 ARG QB . . 3.590 2.306 2.187 2.469 . 0 0 "[ . 1 . 2]" 1
1168 1 85 ARG H 1 85 ARG QG . . 4.340 3.563 2.412 4.088 . 0 0 "[ . 1 . 2]" 1
1169 1 85 ARG H 1 86 SER H . . 4.170 2.594 2.501 2.710 . 0 0 "[ . 1 . 2]" 1
1170 1 85 ARG H 1 86 SER HA . . 5.500 5.199 5.107 5.264 . 0 0 "[ . 1 . 2]" 1
1171 1 85 ARG H 1 86 SER QB . . 5.060 4.447 4.229 5.031 . 0 0 "[ . 1 . 2]" 1
1172 1 85 ARG HA 1 85 ARG QG . . 3.590 2.651 2.376 3.062 . 0 0 "[ . 1 . 2]" 1
1173 1 85 ARG HB2 1 86 SER H . . 4.630 3.655 2.748 4.173 . 0 0 "[ . 1 . 2]" 1
1174 1 85 ARG HB3 1 86 SER H . . 4.630 3.029 2.348 3.886 . 0 0 "[ . 1 . 2]" 1
1175 1 85 ARG QG 1 86 SER H . . 5.220 3.973 3.411 4.459 . 0 0 "[ . 1 . 2]" 1
1176 1 86 SER H 1 86 SER QB . . 3.410 2.313 2.198 2.619 . 0 0 "[ . 1 . 2]" 1
1177 1 86 SER H 1 87 THR H . . 5.180 2.582 2.362 2.844 . 0 0 "[ . 1 . 2]" 1
1178 1 86 SER H 1 87 THR HA . . 5.500 4.737 4.463 5.052 . 0 0 "[ . 1 . 2]" 1
1179 1 86 SER H 1 87 THR MG . . 5.500 4.698 3.871 5.690 0.190 16 0 "[ . 1 . 2]" 1
1180 1 87 THR HA 1 87 THR MG . . 3.700 2.309 2.206 2.413 . 0 0 "[ . 1 . 2]" 1
1181 1 87 THR HA 1 88 LYS QB . . 5.270 4.233 3.759 4.695 . 0 0 "[ . 1 . 2]" 1
1182 1 87 THR MG 1 88 LYS H . . 4.610 3.705 2.652 4.266 . 0 0 "[ . 1 . 2]" 1
1183 1 88 LYS H 1 88 LYS QG . . 4.760 3.377 1.908 4.443 . 0 0 "[ . 1 . 2]" 1
1184 1 88 LYS QG 1 90 GLU H . . 5.110 3.538 2.005 5.163 0.053 14 0 "[ . 1 . 2]" 1
1185 1 89 MET H 1 90 GLU H . . 4.730 2.850 2.212 4.085 . 0 0 "[ . 1 . 2]" 1
1186 1 89 MET HA 1 90 GLU HA . . 4.570 4.592 4.213 4.715 0.145 7 0 "[ . 1 . 2]" 1
1187 1 89 MET HA 1 90 GLU QB . . 5.230 4.797 4.430 5.259 0.029 17 0 "[ . 1 . 2]" 1
1188 1 89 MET HA 1 91 GLY H . . 4.150 3.759 3.024 4.204 0.054 3 0 "[ . 1 . 2]" 1
1189 1 89 MET QB 1 90 GLU H . . 4.320 3.846 3.348 4.047 . 0 0 "[ . 1 . 2]" 1
1190 1 89 MET QB 1 90 GLU HA . . 4.440 4.475 4.319 4.554 0.114 3 0 "[ . 1 . 2]" 1
1191 1 89 MET QG 1 90 GLU H . . 5.030 3.952 2.111 4.509 . 0 0 "[ . 1 . 2]" 1
1192 1 89 MET QG 1 90 GLU HA . . 5.340 4.159 3.298 4.763 . 0 0 "[ . 1 . 2]" 1
1193 1 90 GLU QG 1 91 GLY H . . 5.160 3.927 3.396 4.666 . 0 0 "[ . 1 . 2]" 1
1194 1 91 GLY H 1 92 THR H . . 5.170 3.377 2.591 4.139 . 0 0 "[ . 1 . 2]" 1
1195 1 91 GLY HA3 1 92 THR MG . . 5.500 3.960 3.709 4.481 . 0 0 "[ . 1 . 2]" 1
1196 1 92 THR H 1 92 THR HB . . 4.020 3.557 3.428 3.661 . 0 0 "[ . 1 . 2]" 1
1197 1 92 THR H 1 92 THR MG . . 4.750 2.965 2.747 3.205 . 0 0 "[ . 1 . 2]" 1
1198 1 92 THR H 1 93 VAL H . . 5.450 4.383 4.263 4.456 . 0 0 "[ . 1 . 2]" 1
1199 1 92 THR HA 1 92 THR MG . . 3.740 2.255 2.193 2.302 . 0 0 "[ . 1 . 2]" 1
1200 1 92 THR HA 1 93 VAL H . . 3.160 2.110 2.015 2.253 . 0 0 "[ . 1 . 2]" 1
1201 1 92 THR HA 1 93 VAL QG . . 4.720 3.574 3.385 3.890 . 0 0 "[ . 1 . 2]" 1
1202 1 92 THR HB 1 93 VAL H . . 4.150 2.982 2.648 3.220 . 0 0 "[ . 1 . 2]" 1
1203 1 92 THR HB 1 93 VAL HB . . 5.500 5.360 5.160 5.534 0.034 11 0 "[ . 1 . 2]" 1
1204 1 92 THR HB 1 93 VAL QG . . 4.530 4.565 4.483 4.627 0.097 17 0 "[ . 1 . 2]" 1
1205 1 92 THR HB 1 94 SER HA . . 5.500 4.833 4.361 5.253 . 0 0 "[ . 1 . 2]" 1
1206 1 92 THR MG 1 93 VAL H . . 3.820 3.520 3.298 3.689 . 0 0 "[ . 1 . 2]" 1
1207 1 93 VAL H 1 93 VAL HB . . 3.950 2.574 2.416 2.692 . 0 0 "[ . 1 . 2]" 1
1208 1 93 VAL H 1 93 VAL QG . . 4.170 2.611 2.198 2.979 . 0 0 "[ . 1 . 2]" 1
1209 1 93 VAL H 1 94 SER HA . . 5.500 4.688 4.522 4.858 . 0 0 "[ . 1 . 2]" 1
1210 1 93 VAL HB 1 94 SER HA . . 5.060 4.882 4.514 5.078 0.018 20 0 "[ . 1 . 2]" 1
1211 1 93 VAL HB 1 95 LEU QD . . 5.250 3.157 2.304 3.819 . 0 0 "[ . 1 . 2]" 1
1212 1 93 VAL QG 1 94 SER H . . 3.690 2.677 2.302 2.843 . 0 0 "[ . 1 . 2]" 1
1213 1 93 VAL QG 1 94 SER HA . . 3.740 3.787 3.699 3.833 0.093 3 0 "[ . 1 . 2]" 1
1214 1 93 VAL MG1 1 94 SER H . . 4.230 2.719 2.319 2.896 . 0 0 "[ . 1 . 2]" 1
1215 1 93 VAL MG2 1 94 SER H . . 4.230 4.028 3.852 4.257 0.027 3 0 "[ . 1 . 2]" 1
1216 1 94 SER H 1 94 SER QB . . 3.630 2.424 2.286 2.541 . 0 0 "[ . 1 . 2]" 1
1217 1 94 SER HA 1 95 LEU QD . . 4.190 3.756 2.976 4.319 0.129 10 0 "[ . 1 . 2]" 1
1218 1 95 LEU H 1 95 LEU MD1 . . 4.490 3.590 2.158 3.965 . 0 0 "[ . 1 . 2]" 1
1219 1 95 LEU H 1 95 LEU QD . . 3.820 2.851 2.152 3.416 . 0 0 "[ . 1 . 2]" 1
1220 1 95 LEU H 1 95 LEU MD2 . . 4.490 3.282 2.209 4.340 . 0 0 "[ . 1 . 2]" 1
1221 1 95 LEU H 1 96 LEU H . . 5.500 4.276 4.167 4.405 . 0 0 "[ . 1 . 2]" 1
1222 1 95 LEU HA 1 95 LEU QD . . 3.600 2.164 2.009 3.104 . 0 0 "[ . 1 . 2]" 1
1223 1 95 LEU HA 1 96 LEU HB3 . . 5.480 4.653 4.422 5.494 0.014 8 0 "[ . 1 . 2]" 1
1224 1 95 LEU HB2 1 96 LEU H . . 5.290 4.152 3.831 4.306 . 0 0 "[ . 1 . 2]" 1
1225 1 95 LEU HB3 1 96 LEU H . . 4.740 3.298 2.879 3.525 . 0 0 "[ . 1 . 2]" 1
1226 1 95 LEU HB3 1 96 LEU HA . . 5.500 4.610 4.418 4.748 . 0 0 "[ . 1 . 2]" 1
1227 1 95 LEU QD 1 96 LEU H . . 4.120 3.609 3.301 4.151 0.031 3 0 "[ . 1 . 2]" 1
1228 1 95 LEU MD1 1 96 LEU H . . 5.500 4.544 3.381 5.231 . 0 0 "[ . 1 . 2]" 1
1229 1 95 LEU MD2 1 96 LEU H . . 5.500 4.127 3.417 4.903 . 0 0 "[ . 1 . 2]" 1
1230 1 96 LEU H 1 96 LEU HB3 . . 4.170 2.604 2.436 3.510 . 0 0 "[ . 1 . 2]" 1
1231 1 96 LEU H 1 96 LEU HG . . 5.490 4.528 3.401 4.690 . 0 0 "[ . 1 . 2]" 1
1232 1 96 LEU H 1 97 VAL H . . 5.030 4.284 4.211 4.372 . 0 0 "[ . 1 . 2]" 1
1233 1 96 LEU H 1 97 VAL MG1 . . 5.500 4.051 3.860 4.226 . 0 0 "[ . 1 . 2]" 1
1234 1 96 LEU HA 1 96 LEU QD . . 3.950 2.500 2.040 3.047 . 0 0 "[ . 1 . 2]" 1
1235 1 96 LEU HA 1 97 VAL MG1 . . 4.200 3.696 3.589 3.844 . 0 0 "[ . 1 . 2]" 1
1236 1 96 LEU HA 1 97 VAL MG2 . . 4.920 3.857 3.606 4.048 . 0 0 "[ . 1 . 2]" 1
1237 1 96 LEU HB2 1 97 VAL H . . 5.480 4.454 4.362 4.538 . 0 0 "[ . 1 . 2]" 1
1238 1 96 LEU HB3 1 97 VAL H . . 5.500 4.069 3.589 4.162 . 0 0 "[ . 1 . 2]" 1
1239 1 96 LEU HG 1 97 VAL H . . 4.970 3.860 3.104 5.013 0.043 2 0 "[ . 1 . 2]" 1
1240 1 97 VAL H 1 97 VAL MG1 . . 4.100 2.781 2.711 2.898 . 0 0 "[ . 1 . 2]" 1
1241 1 97 VAL H 1 97 VAL MG2 . . 3.530 2.209 2.069 2.316 . 0 0 "[ . 1 . 2]" 1
1242 1 97 VAL H 1 98 PHE H . . 4.910 4.411 4.375 4.456 . 0 0 "[ . 1 . 2]" 1
1243 1 97 VAL H 1 98 PHE HA . . 5.450 4.956 4.826 5.072 . 0 0 "[ . 1 . 2]" 1
1244 1 97 VAL H 1 98 PHE QB . . 5.500 5.456 5.366 5.518 0.018 10 0 "[ . 1 . 2]" 1
1245 1 97 VAL HA 1 98 PHE QB . . 5.500 3.861 3.696 4.015 . 0 0 "[ . 1 . 2]" 1
1246 1 97 VAL HB 1 98 PHE H . . 4.170 2.342 2.223 2.476 . 0 0 "[ . 1 . 2]" 1
1247 1 97 VAL MG1 1 98 PHE H . . 4.290 3.664 3.519 3.753 . 0 0 "[ . 1 . 2]" 1
1248 1 97 VAL MG2 1 98 PHE H . . 4.680 3.204 3.091 3.339 . 0 0 "[ . 1 . 2]" 1
1249 1 98 PHE H 1 98 PHE QD . . 5.500 4.214 4.108 4.303 . 0 0 "[ . 1 . 2]" 1
1250 1 98 PHE H 1 99 ARG H . . 5.500 4.201 4.117 4.403 . 0 0 "[ . 1 . 2]" 1
1251 1 98 PHE HA 1 98 PHE QD . . 4.200 2.910 2.736 3.095 . 0 0 "[ . 1 . 2]" 1
1252 1 98 PHE HA 1 98 PHE QE . . 4.650 4.666 4.555 4.722 0.072 20 0 "[ . 1 . 2]" 1
1253 1 98 PHE HA 1 99 ARG H . . 3.520 2.124 2.066 2.209 . 0 0 "[ . 1 . 2]" 1
1254 1 98 PHE HA 1 99 ARG QB . . 4.710 4.203 3.937 4.668 . 0 0 "[ . 1 . 2]" 1
1255 1 98 PHE QB 1 99 ARG H . . 4.790 3.820 3.726 3.908 . 0 0 "[ . 1 . 2]" 1
1256 1 98 PHE QD 1 99 ARG H . . 5.130 3.857 3.639 4.048 . 0 0 "[ . 1 . 2]" 1
1257 1 98 PHE QD 1 100 GLN HA . . 4.890 4.178 2.847 4.904 0.014 16 0 "[ . 1 . 2]" 1
1258 1 98 PHE QD 1 100 GLN QB . . 4.260 2.628 1.993 3.496 . 0 0 "[ . 1 . 2]" 1
1259 1 98 PHE QE 1 100 GLN HA . . 5.030 3.447 2.149 4.310 . 0 0 "[ . 1 . 2]" 1
1260 1 98 PHE QE 1 100 GLN QB . . 4.450 2.287 1.957 3.492 . 0 0 "[ . 1 . 2]" 1
1261 1 98 PHE QE 1 100 GLN QG . . 4.480 3.151 2.319 4.302 . 0 0 "[ . 1 . 2]" 1
1262 1 99 ARG HA 1 100 GLN QB . . 5.140 3.998 3.658 4.533 . 0 0 "[ . 1 . 2]" 1
1263 1 100 GLN H 1 100 GLN QB . . 3.590 2.517 2.204 3.016 . 0 0 "[ . 1 . 2]" 1
1264 1 100 GLN H 1 100 GLN QG . . 4.370 3.520 1.839 4.097 . 0 0 "[ . 1 . 2]" 1
1265 1 100 GLN QG 1 101 GLU H . . 5.210 3.186 2.437 4.273 . 0 0 "[ . 1 . 2]" 1
1266 1 102 GLU HA 1 103 ALA MB . . 4.870 4.180 3.848 4.855 . 0 0 "[ . 1 . 2]" 1
1267 1 103 ALA HA 1 104 PHE HB2 . . 5.470 4.860 4.347 5.533 0.063 13 0 "[ . 1 . 2]" 1
1268 1 103 ALA MB 1 104 PHE H . . 5.470 2.986 1.952 3.661 . 0 0 "[ . 1 . 2]" 1
1269 1 103 ALA MB 1 104 PHE HB2 . . 5.200 4.793 3.540 5.263 0.063 16 0 "[ . 1 . 2]" 1
1270 1 104 PHE HA 1 104 PHE QD . . 4.180 2.702 2.484 2.878 . 0 0 "[ . 1 . 2]" 1
1271 1 104 PHE HA 1 104 PHE QE . . 4.580 4.569 4.477 4.624 0.044 15 0 "[ . 1 . 2]" 1
1272 1 104 PHE HB2 1 105 HIS H . . 5.420 4.076 3.706 4.344 . 0 0 "[ . 1 . 2]" 1
1273 1 106 PRO HA 1 107 ARG QD . . 5.040 4.543 2.720 5.246 0.206 6 0 "[ . 1 . 2]" 1
1274 1 106 PRO HA 1 107 ARG QG . . 5.190 4.000 3.306 5.259 0.069 6 0 "[ . 1 . 2]" 1
1275 1 107 ARG HB2 1 108 GLU H . . 4.330 3.288 1.860 4.380 0.050 5 0 "[ . 1 . 2]" 1
1276 1 107 ARG HB3 1 108 GLU H . . 4.330 3.186 2.164 3.978 . 0 0 "[ . 1 . 2]" 1
1277 1 110 ASN QB 1 111 ALA H . . 4.390 3.303 2.092 4.004 . 0 0 "[ . 1 . 2]" 1
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