NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
623444 |
5w72   |
30307 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5w72
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 1417
_Distance_constraint_stats_list.Viol_count 1056
_Distance_constraint_stats_list.Viol_total 659.222
_Distance_constraint_stats_list.Viol_max 0.271
_Distance_constraint_stats_list.Viol_rms 0.0082
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0012
_Distance_constraint_stats_list.Viol_average_violations_only 0.0312
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 3 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 4 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 5 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 6 ASP 0.076 0.027 15 0 "[ . 1 . 2]"
1 7 ILE 0.127 0.030 8 0 "[ . 1 . 2]"
1 8 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 ARG 0.046 0.019 15 0 "[ . 1 . 2]"
1 10 GLU 0.130 0.022 8 0 "[ . 1 . 2]"
1 11 PRO 0.017 0.017 10 0 "[ . 1 . 2]"
1 12 ARG 0.415 0.054 15 0 "[ . 1 . 2]"
1 13 ARG 0.620 0.057 13 0 "[ . 1 . 2]"
1 14 ILE 0.235 0.094 7 0 "[ . 1 . 2]"
1 15 VAL 0.341 0.054 15 0 "[ . 1 . 2]"
1 16 ILE 0.199 0.053 12 0 "[ . 1 . 2]"
1 17 HIS 0.026 0.020 6 0 "[ . 1 . 2]"
1 18 ARG 1.071 0.123 6 0 "[ . 1 . 2]"
1 19 GLY 1.203 0.122 10 0 "[ . 1 . 2]"
1 21 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 LEU 0.143 0.043 16 0 "[ . 1 . 2]"
1 24 GLY 0.029 0.020 4 0 "[ . 1 . 2]"
1 25 PHE 1.169 0.081 18 0 "[ . 1 . 2]"
1 26 ASN 0.134 0.037 15 0 "[ . 1 . 2]"
1 27 ILE 2.529 0.184 15 0 "[ . 1 . 2]"
1 28 ILE 4.209 0.271 17 0 "[ . 1 . 2]"
1 29 GLY 0.316 0.045 2 0 "[ . 1 . 2]"
1 30 GLY 0.738 0.127 2 0 "[ . 1 . 2]"
1 31 GLU 0.573 0.071 7 0 "[ . 1 . 2]"
1 32 ASP 0.918 0.084 11 0 "[ . 1 . 2]"
1 33 GLY 0.021 0.019 8 0 "[ . 1 . 2]"
1 34 GLU 0.003 0.003 17 0 "[ . 1 . 2]"
1 35 GLY 0.445 0.102 20 0 "[ . 1 . 2]"
1 36 ILE 0.960 0.127 2 0 "[ . 1 . 2]"
1 37 PHE 1.007 0.271 17 0 "[ . 1 . 2]"
1 38 ILE 0.568 0.074 10 0 "[ . 1 . 2]"
1 39 SER 1.753 0.087 4 0 "[ . 1 . 2]"
1 40 PHE 0.878 0.106 5 0 "[ . 1 . 2]"
1 42 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 45 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 PRO 0.083 0.032 15 0 "[ . 1 . 2]"
1 47 ALA 0.067 0.020 4 0 "[ . 1 . 2]"
1 48 ASP 0.042 0.020 14 0 "[ . 1 . 2]"
1 49 LEU 0.039 0.023 7 0 "[ . 1 . 2]"
1 50 SER 0.132 0.019 17 0 "[ . 1 . 2]"
1 51 GLY 0.039 0.023 7 0 "[ . 1 . 2]"
1 52 GLU 0.041 0.018 7 0 "[ . 1 . 2]"
1 53 LEU 0.010 0.006 10 0 "[ . 1 . 2]"
1 54 ARG 0.102 0.031 2 0 "[ . 1 . 2]"
1 55 LYS 0.231 0.074 10 0 "[ . 1 . 2]"
1 56 GLY 0.129 0.024 20 0 "[ . 1 . 2]"
1 57 ASP 0.710 0.086 12 0 "[ . 1 . 2]"
1 58 GLN 1.373 0.123 17 0 "[ . 1 . 2]"
1 59 ILE 1.239 0.096 17 0 "[ . 1 . 2]"
1 60 LEU 1.200 0.147 17 0 "[ . 1 . 2]"
1 61 SER 1.813 0.078 10 0 "[ . 1 . 2]"
1 62 VAL 1.386 0.147 17 0 "[ . 1 . 2]"
1 63 ASN 1.021 0.105 15 0 "[ . 1 . 2]"
1 64 GLY 0.318 0.085 17 0 "[ . 1 . 2]"
1 65 VAL 1.472 0.088 20 0 "[ . 1 . 2]"
1 66 ASP 0.005 0.005 20 0 "[ . 1 . 2]"
1 67 LEU 1.384 0.096 4 0 "[ . 1 . 2]"
1 68 ARG 0.617 0.083 12 0 "[ . 1 . 2]"
1 69 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 ALA 1.060 0.102 20 0 "[ . 1 . 2]"
1 71 SER 1.177 0.084 11 0 "[ . 1 . 2]"
1 72 HIS 2.405 0.107 2 0 "[ . 1 . 2]"
1 73 GLU 0.827 0.077 15 0 "[ . 1 . 2]"
1 74 GLN 2.140 0.107 2 0 "[ . 1 . 2]"
1 75 ALA 1.105 0.098 20 0 "[ . 1 . 2]"
1 76 ALA 0.464 0.039 3 0 "[ . 1 . 2]"
1 77 ILE 1.336 0.098 20 0 "[ . 1 . 2]"
1 78 ALA 0.119 0.031 20 0 "[ . 1 . 2]"
1 79 LEU 0.182 0.075 2 0 "[ . 1 . 2]"
1 80 LYS 0.341 0.063 19 0 "[ . 1 . 2]"
1 81 ASN 0.620 0.063 19 0 "[ . 1 . 2]"
1 82 ALA 0.166 0.075 2 0 "[ . 1 . 2]"
1 83 GLY 0.080 0.029 2 0 "[ . 1 . 2]"
1 84 GLN 1.933 0.180 4 0 "[ . 1 . 2]"
1 85 THR 1.913 0.122 10 0 "[ . 1 . 2]"
1 86 VAL 1.637 0.180 4 0 "[ . 1 . 2]"
1 87 THR 0.356 0.099 10 0 "[ . 1 . 2]"
1 88 ILE 2.686 0.121 10 0 "[ . 1 . 2]"
1 89 ILE 2.341 0.121 10 0 "[ . 1 . 2]"
1 90 ALA 1.062 0.115 6 0 "[ . 1 . 2]"
1 91 GLN 0.111 0.031 8 0 "[ . 1 . 2]"
1 92 TYR 0.367 0.044 14 0 "[ . 1 . 2]"
1 93 LYS 0.073 0.031 8 0 "[ . 1 . 2]"
1 94 PRO 0.035 0.035 4 0 "[ . 1 . 2]"
1 95 GLU 0.116 0.056 6 0 "[ . 1 . 2]"
1 96 GLU 0.091 0.056 6 0 "[ . 1 . 2]"
1 97 TYR 3.012 0.134 4 0 "[ . 1 . 2]"
1 98 SER 0.029 0.015 10 0 "[ . 1 . 2]"
1 99 ARG 2.295 0.134 4 0 "[ . 1 . 2]"
1 100 PHE 0.556 0.113 5 0 "[ . 1 . 2]"
1 101 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 ALA 0.931 0.134 5 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 3 GLY QA 1 4 GLU H . . 6.500 2.304 2.116 2.778 . 0 0 "[ . 1 . 2]" 1
2 1 4 GLU H 1 5 GLU H . . 6.500 3.943 2.011 4.648 . 0 0 "[ . 1 . 2]" 1
3 1 4 GLU HA 1 5 GLU H . . 6.500 2.683 2.141 3.565 . 0 0 "[ . 1 . 2]" 1
4 1 4 GLU QG 1 5 GLU H . . 6.500 3.557 1.910 4.467 . 0 0 "[ . 1 . 2]" 1
5 1 5 GLU H 1 6 ASP H . . 6.500 3.663 2.210 4.455 . 0 0 "[ . 1 . 2]" 1
6 1 5 GLU HA 1 6 ASP H . . 6.500 2.658 2.139 3.568 . 0 0 "[ . 1 . 2]" 1
7 1 5 GLU HB2 1 6 ASP H . . 6.500 3.675 1.999 4.643 . 0 0 "[ . 1 . 2]" 1
8 1 5 GLU HB3 1 6 ASP H . . 6.500 3.369 1.950 4.651 . 0 0 "[ . 1 . 2]" 1
9 1 5 GLU QG 1 6 ASP H . . 6.500 3.820 1.942 4.931 . 0 0 "[ . 1 . 2]" 1
10 1 6 ASP H 1 7 ILE H . . 6.500 3.548 1.899 4.566 . 0 0 "[ . 1 . 2]" 1
11 1 6 ASP H 1 7 ILE HB . . 6.500 5.636 4.150 6.527 0.027 15 0 "[ . 1 . 2]" 1
12 1 6 ASP H 1 7 ILE MD . . 6.500 5.488 2.967 6.504 0.004 15 0 "[ . 1 . 2]" 1
13 1 6 ASP HA 1 7 ILE H . . 6.500 2.863 2.165 3.559 . 0 0 "[ . 1 . 2]" 1
14 1 6 ASP HB2 1 7 ILE H . . 6.500 3.177 1.947 4.441 . 0 0 "[ . 1 . 2]" 1
15 1 6 ASP HB2 1 7 ILE MD . . 6.500 5.318 3.535 6.508 0.008 15 0 "[ . 1 . 2]" 1
16 1 6 ASP HB3 1 7 ILE H . . 6.500 3.339 1.948 4.654 . 0 0 "[ . 1 . 2]" 1
17 1 7 ILE H 1 8 PRO HD2 . . 6.500 3.839 2.902 4.787 . 0 0 "[ . 1 . 2]" 1
18 1 7 ILE H 1 8 PRO HD3 . . 6.500 3.274 2.421 5.031 . 0 0 "[ . 1 . 2]" 1
19 1 7 ILE H 1 8 PRO QG . . 6.500 4.996 4.286 6.129 . 0 0 "[ . 1 . 2]" 1
20 1 7 ILE HA 1 8 PRO HD2 . . 6.500 2.116 1.992 2.476 . 0 0 "[ . 1 . 2]" 1
21 1 7 ILE HA 1 8 PRO HD3 . . 6.500 2.772 2.259 3.065 . 0 0 "[ . 1 . 2]" 1
22 1 7 ILE HA 1 8 PRO QG . . 6.500 3.916 3.828 4.051 . 0 0 "[ . 1 . 2]" 1
23 1 7 ILE HB 1 8 PRO HD2 . . 6.500 4.307 1.979 4.833 . 0 0 "[ . 1 . 2]" 1
24 1 7 ILE HB 1 8 PRO HD3 . . 6.500 4.865 3.428 5.053 . 0 0 "[ . 1 . 2]" 1
25 1 7 ILE MD 1 8 PRO HD2 . . 6.500 4.280 2.016 5.785 . 0 0 "[ . 1 . 2]" 1
26 1 7 ILE MD 1 8 PRO HD3 . . 6.500 4.807 3.273 5.982 . 0 0 "[ . 1 . 2]" 1
27 1 7 ILE MD 1 92 TYR QD . . 6.500 5.706 4.346 6.490 . 0 0 "[ . 1 . 2]" 1
28 1 7 ILE MD 1 92 TYR QE . . 6.500 6.035 3.578 6.530 0.030 8 0 "[ . 1 . 2]" 1
29 1 8 PRO HA 1 9 ARG H . . 6.500 2.774 2.155 3.571 . 0 0 "[ . 1 . 2]" 1
30 1 8 PRO HB2 1 9 ARG H . . 6.500 3.107 2.067 4.286 . 0 0 "[ . 1 . 2]" 1
31 1 8 PRO HB3 1 9 ARG H . . 6.500 3.870 3.207 4.580 . 0 0 "[ . 1 . 2]" 1
32 1 8 PRO HD3 1 9 ARG H . . 6.500 4.913 3.837 5.580 . 0 0 "[ . 1 . 2]" 1
33 1 9 ARG H 1 10 GLU H . . 6.500 3.495 2.330 4.505 . 0 0 "[ . 1 . 2]" 1
34 1 9 ARG H 1 10 GLU HB2 . . 6.500 5.465 4.155 6.519 0.019 15 0 "[ . 1 . 2]" 1
35 1 9 ARG H 1 91 GLN HG3 . . 6.500 5.852 3.541 6.514 0.014 17 0 "[ . 1 . 2]" 1
36 1 9 ARG HA 1 10 GLU H . . 6.500 2.572 2.160 3.537 . 0 0 "[ . 1 . 2]" 1
37 1 9 ARG HA 1 92 TYR H . . 6.500 4.484 2.550 5.847 . 0 0 "[ . 1 . 2]" 1
38 1 9 ARG HB2 1 10 GLU H . . 6.500 4.287 3.845 4.661 . 0 0 "[ . 1 . 2]" 1
39 1 9 ARG HB3 1 10 GLU H . . 6.500 4.089 2.598 4.662 . 0 0 "[ . 1 . 2]" 1
40 1 9 ARG QD 1 10 GLU H . . 6.500 4.599 3.061 5.859 . 0 0 "[ . 1 . 2]" 1
41 1 9 ARG QD 1 92 TYR QD . . 6.500 4.546 2.433 6.506 0.006 20 0 "[ . 1 . 2]" 1
42 1 10 GLU H 1 11 PRO HD2 . . 6.500 4.763 4.708 4.836 . 0 0 "[ . 1 . 2]" 1
43 1 10 GLU H 1 11 PRO HD3 . . 6.500 4.989 4.643 5.097 . 0 0 "[ . 1 . 2]" 1
44 1 10 GLU H 1 91 GLN HG2 . . 6.500 5.567 4.432 6.522 0.022 8 0 "[ . 1 . 2]" 1
45 1 10 GLU H 1 92 TYR HB2 . . 6.500 5.932 4.786 6.509 0.009 13 0 "[ . 1 . 2]" 1
46 1 10 GLU H 1 92 TYR HB3 . . 6.500 6.342 5.859 6.517 0.017 5 0 "[ . 1 . 2]" 1
47 1 10 GLU HA 1 11 PRO HD3 . . 6.500 2.313 2.251 2.350 . 0 0 "[ . 1 . 2]" 1
48 1 10 GLU HA 1 11 PRO HG2 . . 6.500 4.483 4.181 4.606 . 0 0 "[ . 1 . 2]" 1
49 1 10 GLU HB2 1 11 PRO HA . . 6.500 5.656 4.954 6.155 . 0 0 "[ . 1 . 2]" 1
50 1 10 GLU HB2 1 11 PRO HD2 . . 6.500 3.555 1.965 4.466 . 0 0 "[ . 1 . 2]" 1
51 1 10 GLU HB2 1 11 PRO HD3 . . 6.500 4.593 3.382 5.124 . 0 0 "[ . 1 . 2]" 1
52 1 10 GLU HB3 1 11 PRO HD2 . . 6.500 2.681 1.995 4.022 . 0 0 "[ . 1 . 2]" 1
53 1 10 GLU HB3 1 11 PRO HD3 . . 6.500 3.945 3.441 4.929 . 0 0 "[ . 1 . 2]" 1
54 1 10 GLU QG 1 11 PRO HD2 . . 6.500 2.681 1.912 3.671 . 0 0 "[ . 1 . 2]" 1
55 1 10 GLU QG 1 11 PRO HD3 . . 6.500 3.628 3.199 4.676 . 0 0 "[ . 1 . 2]" 1
56 1 11 PRO HA 1 12 ARG H . . 6.500 2.215 2.151 2.309 . 0 0 "[ . 1 . 2]" 1
57 1 11 PRO HA 1 12 ARG HG2 . . 6.500 5.889 5.515 6.517 0.017 10 0 "[ . 1 . 2]" 1
58 1 11 PRO HA 1 89 ILE MG . . 6.500 3.203 2.619 4.249 . 0 0 "[ . 1 . 2]" 1
59 1 11 PRO HA 1 91 GLN H . . 6.500 4.929 4.431 5.633 . 0 0 "[ . 1 . 2]" 1
60 1 11 PRO HA 1 91 GLN HG2 . . 6.500 4.385 3.885 5.350 . 0 0 "[ . 1 . 2]" 1
61 1 11 PRO HA 1 92 TYR H . . 6.500 5.076 4.100 6.147 . 0 0 "[ . 1 . 2]" 1
62 1 11 PRO HB2 1 89 ILE MG . . 6.500 2.448 1.922 3.538 . 0 0 "[ . 1 . 2]" 1
63 1 11 PRO HB3 1 12 ARG H . . 6.500 3.865 3.586 4.136 . 0 0 "[ . 1 . 2]" 1
64 1 11 PRO HB3 1 60 LEU MD2 . . 6.500 4.261 2.469 6.020 . 0 0 "[ . 1 . 2]" 1
65 1 11 PRO HB3 1 89 ILE MG . . 6.500 2.944 2.438 4.288 . 0 0 "[ . 1 . 2]" 1
66 1 11 PRO HB3 1 91 GLN HA . . 6.500 4.789 3.224 6.490 . 0 0 "[ . 1 . 2]" 1
67 1 11 PRO HD2 1 12 ARG H . . 6.500 5.593 5.515 5.649 . 0 0 "[ . 1 . 2]" 1
68 1 11 PRO HD2 1 91 GLN QB . . 6.500 5.525 4.754 6.481 . 0 0 "[ . 1 . 2]" 1
69 1 11 PRO HD3 1 12 ARG H . . 6.500 5.561 5.518 5.594 . 0 0 "[ . 1 . 2]" 1
70 1 11 PRO HD3 1 91 GLN QB . . 6.500 4.376 3.550 5.410 . 0 0 "[ . 1 . 2]" 1
71 1 11 PRO HG2 1 12 ARG H . . 6.500 4.831 4.599 5.020 . 0 0 "[ . 1 . 2]" 1
72 1 11 PRO HG3 1 12 ARG H . . 6.500 5.520 5.263 5.740 . 0 0 "[ . 1 . 2]" 1
73 1 11 PRO HG3 1 60 LEU MD1 . . 6.500 4.116 2.538 5.413 . 0 0 "[ . 1 . 2]" 1
74 1 12 ARG H 1 12 ARG HD2 . . 6.500 3.262 1.911 6.048 . 0 0 "[ . 1 . 2]" 1
75 1 12 ARG H 1 12 ARG HD3 . . 6.500 3.446 1.973 5.451 . 0 0 "[ . 1 . 2]" 1
76 1 12 ARG H 1 13 ARG H . . 6.500 4.268 4.016 4.442 . 0 0 "[ . 1 . 2]" 1
77 1 12 ARG H 1 13 ARG QD . . 6.500 5.897 4.660 6.498 . 0 0 "[ . 1 . 2]" 1
78 1 12 ARG H 1 89 ILE HA . . 6.500 4.086 3.627 4.549 . 0 0 "[ . 1 . 2]" 1
79 1 12 ARG H 1 89 ILE HG12 . . 6.500 5.263 4.430 6.506 0.006 3 0 "[ . 1 . 2]" 1
80 1 12 ARG H 1 89 ILE HG13 . . 6.500 5.808 4.767 6.522 0.022 17 0 "[ . 1 . 2]" 1
81 1 12 ARG H 1 89 ILE MG . . 6.500 2.600 1.899 3.746 . 0 0 "[ . 1 . 2]" 1
82 1 12 ARG H 1 90 ALA H . . 6.500 2.985 2.409 3.709 . 0 0 "[ . 1 . 2]" 1
83 1 12 ARG H 1 90 ALA HA . . 6.500 4.927 4.670 5.544 . 0 0 "[ . 1 . 2]" 1
84 1 12 ARG H 1 90 ALA MB . . 6.500 4.095 3.488 5.034 . 0 0 "[ . 1 . 2]" 1
85 1 12 ARG H 1 91 GLN H . . 6.500 5.226 4.935 5.815 . 0 0 "[ . 1 . 2]" 1
86 1 12 ARG H 1 91 GLN HA . . 6.500 4.169 3.758 4.634 . 0 0 "[ . 1 . 2]" 1
87 1 12 ARG H 1 91 GLN QB . . 6.500 4.028 3.355 4.714 . 0 0 "[ . 1 . 2]" 1
88 1 12 ARG H 1 91 GLN HG2 . . 6.500 6.146 5.660 6.500 . 0 0 "[ . 1 . 2]" 1
89 1 12 ARG H 1 92 TYR H . . 6.500 6.130 5.667 6.524 0.024 7 0 "[ . 1 . 2]" 1
90 1 12 ARG HA 1 13 ARG H . . 6.500 2.231 2.140 2.444 . 0 0 "[ . 1 . 2]" 1
91 1 12 ARG HA 1 13 ARG HB2 . . 6.500 4.981 4.161 5.720 . 0 0 "[ . 1 . 2]" 1
92 1 12 ARG HA 1 14 ILE H . . 6.500 6.134 5.692 6.359 . 0 0 "[ . 1 . 2]" 1
93 1 12 ARG HA 1 90 ALA H . . 6.500 4.810 4.333 5.449 . 0 0 "[ . 1 . 2]" 1
94 1 12 ARG HD2 1 90 ALA H . . 6.500 4.571 2.525 6.517 0.017 2 0 "[ . 1 . 2]" 1
95 1 12 ARG HD3 1 13 ARG H . . 6.500 5.233 4.433 5.973 . 0 0 "[ . 1 . 2]" 1
96 1 12 ARG HD3 1 90 ALA H . . 6.500 3.844 2.221 5.520 . 0 0 "[ . 1 . 2]" 1
97 1 12 ARG HD3 1 92 TYR H . . 6.500 6.312 5.876 6.519 0.019 12 0 "[ . 1 . 2]" 1
98 1 12 ARG HG2 1 13 ARG H . . 6.500 3.463 2.816 3.838 . 0 0 "[ . 1 . 2]" 1
99 1 12 ARG HG2 1 15 VAL H . . 6.500 6.456 6.083 6.554 0.054 15 0 "[ . 1 . 2]" 1
100 1 12 ARG HG3 1 13 ARG H . . 6.500 4.300 3.030 4.997 . 0 0 "[ . 1 . 2]" 1
101 1 13 ARG H 1 14 ILE H . . 6.500 4.527 4.351 4.598 . 0 0 "[ . 1 . 2]" 1
102 1 13 ARG H 1 14 ILE HA . . 6.500 5.195 4.934 5.365 . 0 0 "[ . 1 . 2]" 1
103 1 13 ARG H 1 89 ILE HA . . 6.500 4.450 4.043 4.937 . 0 0 "[ . 1 . 2]" 1
104 1 13 ARG H 1 89 ILE HG13 . . 6.500 5.285 3.669 6.303 . 0 0 "[ . 1 . 2]" 1
105 1 13 ARG H 1 89 ILE MG . . 6.500 4.211 3.562 5.033 . 0 0 "[ . 1 . 2]" 1
106 1 13 ARG H 1 90 ALA H . . 6.500 4.953 4.423 5.750 . 0 0 "[ . 1 . 2]" 1
107 1 13 ARG HA 1 14 ILE H . . 6.500 2.197 2.141 2.225 . 0 0 "[ . 1 . 2]" 1
108 1 13 ARG HA 1 89 ILE HA . . 6.500 2.325 1.993 2.788 . 0 0 "[ . 1 . 2]" 1
109 1 13 ARG HA 1 89 ILE MD . . 6.500 4.275 2.013 5.318 . 0 0 "[ . 1 . 2]" 1
110 1 13 ARG HA 1 89 ILE MG . . 6.500 3.682 3.149 4.349 . 0 0 "[ . 1 . 2]" 1
111 1 13 ARG HA 1 90 ALA H . . 6.500 3.502 2.499 3.919 . 0 0 "[ . 1 . 2]" 1
112 1 13 ARG HB2 1 87 THR MG . . 6.500 3.269 1.876 4.908 . 0 0 "[ . 1 . 2]" 1
113 1 13 ARG HB2 1 89 ILE H . . 6.500 5.913 4.615 6.557 0.057 13 0 "[ . 1 . 2]" 1
114 1 13 ARG HB2 1 89 ILE MG . . 6.500 4.871 3.854 5.501 . 0 0 "[ . 1 . 2]" 1
115 1 13 ARG HB3 1 89 ILE MD . . 6.500 4.454 1.879 6.277 . 0 0 "[ . 1 . 2]" 1
116 1 13 ARG HB3 1 89 ILE MG . . 6.500 4.867 3.520 5.886 . 0 0 "[ . 1 . 2]" 1
117 1 13 ARG HB3 1 90 ALA H . . 6.500 5.844 4.232 6.516 0.016 9 0 "[ . 1 . 2]" 1
118 1 13 ARG QD 1 14 ILE H . . 6.500 4.692 3.022 5.454 . 0 0 "[ . 1 . 2]" 1
119 1 13 ARG QD 1 87 THR MG . . 6.500 3.276 1.886 4.676 . 0 0 "[ . 1 . 2]" 1
120 1 13 ARG QD 1 88 ILE H . . 6.500 5.991 4.040 6.556 0.056 7 0 "[ . 1 . 2]" 1
121 1 13 ARG QD 1 89 ILE MD . . 6.500 3.619 1.902 5.526 . 0 0 "[ . 1 . 2]" 1
122 1 13 ARG HG2 1 14 ILE H . . 6.500 4.136 3.179 5.199 . 0 0 "[ . 1 . 2]" 1
123 1 13 ARG HG2 1 88 ILE H . . 6.500 5.715 3.637 6.522 0.022 13 0 "[ . 1 . 2]" 1
124 1 13 ARG HG2 1 89 ILE MG . . 6.500 5.423 2.507 6.502 0.002 10 0 "[ . 1 . 2]" 1
125 1 13 ARG HG3 1 14 ILE H . . 6.500 4.118 2.449 5.375 . 0 0 "[ . 1 . 2]" 1
126 1 13 ARG HG3 1 87 THR MG . . 6.500 3.010 1.941 5.924 . 0 0 "[ . 1 . 2]" 1
127 1 13 ARG HG3 1 89 ILE HA . . 6.500 4.631 2.219 6.312 . 0 0 "[ . 1 . 2]" 1
128 1 13 ARG HG3 1 89 ILE MD . . 6.500 4.476 3.444 6.075 . 0 0 "[ . 1 . 2]" 1
129 1 14 ILE H 1 15 VAL H . . 6.500 4.416 4.326 4.535 . 0 0 "[ . 1 . 2]" 1
130 1 14 ILE H 1 53 LEU QD . . 6.500 4.264 3.570 5.412 . 0 0 "[ . 1 . 2]" 1
131 1 14 ILE H 1 87 THR HA . . 6.500 4.083 3.570 4.772 . 0 0 "[ . 1 . 2]" 1
132 1 14 ILE H 1 87 THR MG . . 6.500 3.560 2.708 5.225 . 0 0 "[ . 1 . 2]" 1
133 1 14 ILE H 1 88 ILE H . . 6.500 3.242 2.703 4.005 . 0 0 "[ . 1 . 2]" 1
134 1 14 ILE H 1 88 ILE HA . . 6.500 4.943 4.425 5.472 . 0 0 "[ . 1 . 2]" 1
135 1 14 ILE H 1 88 ILE HB . . 6.500 4.959 3.787 5.966 . 0 0 "[ . 1 . 2]" 1
136 1 14 ILE H 1 88 ILE MG . . 6.500 5.109 4.337 5.950 . 0 0 "[ . 1 . 2]" 1
137 1 14 ILE H 1 89 ILE H . . 6.500 5.133 4.710 5.853 . 0 0 "[ . 1 . 2]" 1
138 1 14 ILE H 1 89 ILE HA . . 6.500 3.681 3.191 4.472 . 0 0 "[ . 1 . 2]" 1
139 1 14 ILE H 1 89 ILE HG12 . . 6.500 5.610 4.257 6.504 0.004 6 0 "[ . 1 . 2]" 1
140 1 14 ILE H 1 89 ILE HG13 . . 6.500 5.185 4.114 6.594 0.094 7 0 "[ . 1 . 2]" 1
141 1 14 ILE H 1 89 ILE MG . . 6.500 5.309 4.706 6.079 . 0 0 "[ . 1 . 2]" 1
142 1 14 ILE H 1 90 ALA H . . 6.500 4.505 3.963 5.211 . 0 0 "[ . 1 . 2]" 1
143 1 14 ILE H 1 90 ALA MB . . 6.500 4.765 4.043 6.010 . 0 0 "[ . 1 . 2]" 1
144 1 14 ILE HA 1 15 VAL H . . 6.500 2.167 2.139 2.255 . 0 0 "[ . 1 . 2]" 1
145 1 14 ILE HB 1 15 VAL H . . 6.500 4.134 3.798 4.294 . 0 0 "[ . 1 . 2]" 1
146 1 14 ILE HB 1 88 ILE HB . . 6.500 5.103 3.453 6.575 0.075 4 0 "[ . 1 . 2]" 1
147 1 14 ILE HB 1 90 ALA H . . 6.500 5.638 4.708 6.520 0.020 17 0 "[ . 1 . 2]" 1
148 1 14 ILE MG 1 15 VAL H . . 6.500 2.798 1.926 4.075 . 0 0 "[ . 1 . 2]" 1
149 1 14 ILE MG 1 16 ILE H . . 6.500 4.394 4.052 4.840 . 0 0 "[ . 1 . 2]" 1
150 1 14 ILE MG 1 16 ILE HB . . 6.500 4.776 4.378 5.490 . 0 0 "[ . 1 . 2]" 1
151 1 14 ILE MG 1 16 ILE HG12 . . 6.500 3.234 2.583 3.926 . 0 0 "[ . 1 . 2]" 1
152 1 14 ILE MG 1 52 GLU HG2 . . 6.500 4.304 3.218 5.830 . 0 0 "[ . 1 . 2]" 1
153 1 14 ILE MG 1 53 LEU H . . 6.500 4.084 2.748 5.186 . 0 0 "[ . 1 . 2]" 1
154 1 14 ILE MG 1 53 LEU HG . . 6.500 3.198 1.938 4.831 . 0 0 "[ . 1 . 2]" 1
155 1 14 ILE MG 1 90 ALA MB . . 6.500 4.680 3.484 5.807 . 0 0 "[ . 1 . 2]" 1
156 1 15 VAL H 1 16 ILE H . . 6.500 4.440 4.276 4.546 . 0 0 "[ . 1 . 2]" 1
157 1 15 VAL H 1 16 ILE HG13 . . 6.500 5.401 3.689 6.511 0.011 17 0 "[ . 1 . 2]" 1
158 1 15 VAL H 1 87 THR MG . . 6.500 4.556 3.987 5.494 . 0 0 "[ . 1 . 2]" 1
159 1 15 VAL H 1 88 ILE H . . 6.500 6.020 5.568 6.520 0.020 17 0 "[ . 1 . 2]" 1
160 1 15 VAL HA 1 16 ILE H . . 6.500 2.146 2.139 2.166 . 0 0 "[ . 1 . 2]" 1
161 1 15 VAL HA 1 87 THR H . . 6.500 5.774 5.406 6.076 . 0 0 "[ . 1 . 2]" 1
162 1 15 VAL HB 1 16 ILE H . . 6.500 4.224 4.139 4.290 . 0 0 "[ . 1 . 2]" 1
163 1 15 VAL HB 1 85 THR MG . . 6.500 4.806 3.795 5.324 . 0 0 "[ . 1 . 2]" 1
164 1 15 VAL MG1 1 17 HIS H . . 6.500 5.575 4.695 5.995 . 0 0 "[ . 1 . 2]" 1
165 1 15 VAL MG2 1 16 ILE H . . 6.500 3.022 2.426 4.132 . 0 0 "[ . 1 . 2]" 1
166 1 15 VAL MG2 1 85 THR MG . . 6.500 3.017 1.890 4.185 . 0 0 "[ . 1 . 2]" 1
167 1 15 VAL MG2 1 86 VAL H . . 6.500 5.533 4.257 6.530 0.030 11 0 "[ . 1 . 2]" 1
168 1 15 VAL MG2 1 87 THR H . . 6.500 6.326 5.639 6.522 0.022 17 0 "[ . 1 . 2]" 1
169 1 16 ILE H 1 17 HIS H . . 6.500 4.431 4.401 4.456 . 0 0 "[ . 1 . 2]" 1
170 1 16 ILE H 1 17 HIS HA . . 6.500 4.993 4.923 5.062 . 0 0 "[ . 1 . 2]" 1
171 1 16 ILE H 1 85 THR HA . . 6.500 4.634 3.681 5.256 . 0 0 "[ . 1 . 2]" 1
172 1 16 ILE H 1 85 THR MG . . 6.500 2.967 1.969 3.579 . 0 0 "[ . 1 . 2]" 1
173 1 16 ILE H 1 86 VAL H . . 6.500 3.795 2.751 4.688 . 0 0 "[ . 1 . 2]" 1
174 1 16 ILE H 1 86 VAL HB . . 6.500 5.065 3.047 6.535 0.035 12 0 "[ . 1 . 2]" 1
175 1 16 ILE H 1 87 THR HA . . 6.500 4.080 3.551 4.606 . 0 0 "[ . 1 . 2]" 1
176 1 16 ILE H 1 87 THR MG . . 6.500 4.357 3.494 5.215 . 0 0 "[ . 1 . 2]" 1
177 1 16 ILE H 1 88 ILE H . . 6.500 5.473 4.667 6.153 . 0 0 "[ . 1 . 2]" 1
178 1 16 ILE HA 1 17 HIS H . . 6.500 2.339 2.268 2.369 . 0 0 "[ . 1 . 2]" 1
179 1 16 ILE HA 1 18 ARG H . . 6.500 6.482 6.458 6.494 . 0 0 "[ . 1 . 2]" 1
180 1 16 ILE HB 1 17 HIS H . . 6.500 3.142 2.462 3.781 . 0 0 "[ . 1 . 2]" 1
181 1 16 ILE HB 1 46 PRO QB . . 6.500 4.300 3.237 5.699 . 0 0 "[ . 1 . 2]" 1
182 1 16 ILE HB 1 46 PRO QG . . 6.500 5.111 4.470 5.899 . 0 0 "[ . 1 . 2]" 1
183 1 16 ILE HB 1 50 SER HB3 . . 6.500 6.255 5.021 6.519 0.019 17 0 "[ . 1 . 2]" 1
184 1 16 ILE HB 1 86 VAL H . . 6.500 4.051 3.004 5.455 . 0 0 "[ . 1 . 2]" 1
185 1 16 ILE HB 1 86 VAL HB . . 6.500 4.169 1.989 6.553 0.053 12 0 "[ . 1 . 2]" 1
186 1 16 ILE HG12 1 17 HIS H . . 6.500 4.837 4.390 5.009 . 0 0 "[ . 1 . 2]" 1
187 1 16 ILE HG12 1 88 ILE MD . . 6.500 4.814 2.999 6.287 . 0 0 "[ . 1 . 2]" 1
188 1 16 ILE HG13 1 17 HIS H . . 6.500 4.578 3.922 5.100 . 0 0 "[ . 1 . 2]" 1
189 1 16 ILE HG13 1 53 LEU QD . . 6.500 4.516 2.402 6.348 . 0 0 "[ . 1 . 2]" 1
190 1 16 ILE MG 1 17 HIS H . . 6.500 2.596 1.953 3.665 . 0 0 "[ . 1 . 2]" 1
191 1 16 ILE MG 1 46 PRO QG . . 6.500 3.757 2.425 5.499 . 0 0 "[ . 1 . 2]" 1
192 1 16 ILE MG 1 47 ALA H . . 6.500 4.529 2.488 5.793 . 0 0 "[ . 1 . 2]" 1
193 1 16 ILE MG 1 86 VAL H . . 6.500 4.769 3.762 5.817 . 0 0 "[ . 1 . 2]" 1
194 1 17 HIS H 1 17 HIS HD2 . . 6.500 4.060 2.129 5.458 . 0 0 "[ . 1 . 2]" 1
195 1 17 HIS H 1 46 PRO QB . . 6.500 4.139 2.231 5.398 . 0 0 "[ . 1 . 2]" 1
196 1 17 HIS H 1 46 PRO QG . . 6.500 5.524 3.778 6.505 0.005 17 0 "[ . 1 . 2]" 1
197 1 17 HIS H 1 85 THR MG . . 6.500 4.948 4.549 5.634 . 0 0 "[ . 1 . 2]" 1
198 1 17 HIS H 1 86 VAL H . . 6.500 5.367 4.709 6.520 0.020 6 0 "[ . 1 . 2]" 1
199 1 17 HIS HA 1 18 ARG H . . 6.500 2.509 2.499 2.522 . 0 0 "[ . 1 . 2]" 1
200 1 17 HIS HA 1 85 THR H . . 6.500 6.047 3.675 6.465 . 0 0 "[ . 1 . 2]" 1
201 1 17 HIS HA 1 85 THR HA . . 6.500 3.701 3.408 4.041 . 0 0 "[ . 1 . 2]" 1
202 1 17 HIS HA 1 85 THR MG . . 6.500 3.643 2.962 4.321 . 0 0 "[ . 1 . 2]" 1
203 1 17 HIS HA 1 86 VAL H . . 6.500 4.790 4.026 6.087 . 0 0 "[ . 1 . 2]" 1
204 1 17 HIS HB2 1 18 ARG H . . 6.500 3.683 3.378 3.867 . 0 0 "[ . 1 . 2]" 1
205 1 17 HIS HB3 1 18 ARG H . . 6.500 2.562 2.187 3.027 . 0 0 "[ . 1 . 2]" 1
206 1 17 HIS HD2 1 18 ARG H . . 6.500 3.887 2.759 5.508 . 0 0 "[ . 1 . 2]" 1
207 1 17 HIS HD2 1 85 THR MG . . 6.500 5.185 4.048 6.495 . 0 0 "[ . 1 . 2]" 1
208 1 18 ARG H 1 19 GLY H . . 6.500 4.519 4.475 4.616 . 0 0 "[ . 1 . 2]" 1
209 1 18 ARG H 1 84 GLN H . . 6.500 6.536 6.472 6.623 0.123 6 0 "[ . 1 . 2]" 1
210 1 18 ARG H 1 84 GLN HA . . 6.500 4.288 3.729 5.070 . 0 0 "[ . 1 . 2]" 1
211 1 18 ARG H 1 84 GLN HB2 . . 6.500 4.467 3.192 6.454 . 0 0 "[ . 1 . 2]" 1
212 1 18 ARG H 1 84 GLN HB3 . . 6.500 5.572 4.176 6.284 . 0 0 "[ . 1 . 2]" 1
213 1 18 ARG H 1 84 GLN HG2 . . 6.500 6.082 4.736 6.505 0.005 8 0 "[ . 1 . 2]" 1
214 1 18 ARG H 1 84 GLN HG3 . . 6.500 5.491 4.219 6.506 0.006 16 0 "[ . 1 . 2]" 1
215 1 18 ARG H 1 85 THR H . . 6.500 5.281 2.938 5.793 . 0 0 "[ . 1 . 2]" 1
216 1 18 ARG H 1 85 THR HA . . 6.500 3.935 3.336 4.633 . 0 0 "[ . 1 . 2]" 1
217 1 18 ARG H 1 85 THR HB . . 6.500 6.425 6.042 6.547 0.047 8 0 "[ . 1 . 2]" 1
218 1 18 ARG H 1 86 VAL H . . 6.500 5.313 4.508 6.384 . 0 0 "[ . 1 . 2]" 1
219 1 18 ARG HA 1 19 GLY H . . 6.500 2.156 2.143 2.213 . 0 0 "[ . 1 . 2]" 1
220 1 18 ARG HA 1 84 GLN HA . . 6.500 2.729 1.977 3.128 . 0 0 "[ . 1 . 2]" 1
221 1 18 ARG QB 1 19 GLY H . . 6.500 3.545 2.911 3.834 . 0 0 "[ . 1 . 2]" 1
222 1 18 ARG QB 1 84 GLN HA . . 6.500 2.160 1.890 3.485 . 0 0 "[ . 1 . 2]" 1
223 1 18 ARG QB 1 85 THR H . . 6.500 4.256 3.006 5.331 . 0 0 "[ . 1 . 2]" 1
224 1 18 ARG QD 1 83 GLY H . . 6.500 6.190 5.571 6.529 0.029 2 0 "[ . 1 . 2]" 1
225 1 18 ARG QD 1 84 GLN HA . . 6.500 3.158 2.005 4.455 . 0 0 "[ . 1 . 2]" 1
226 1 18 ARG QG 1 19 GLY H . . 6.500 3.434 2.529 4.452 . 0 0 "[ . 1 . 2]" 1
227 1 19 GLY H 1 46 PRO QG . . 6.500 6.303 5.771 6.532 0.032 15 0 "[ . 1 . 2]" 1
228 1 19 GLY H 1 84 GLN HA . . 6.500 4.045 2.768 4.367 . 0 0 "[ . 1 . 2]" 1
229 1 19 GLY H 1 84 GLN HB2 . . 6.500 6.066 3.947 6.572 0.072 19 0 "[ . 1 . 2]" 1
230 1 19 GLY H 1 84 GLN HB3 . . 6.500 6.340 4.276 6.572 0.072 8 0 "[ . 1 . 2]" 1
231 1 19 GLY H 1 85 THR HB . . 6.500 6.535 6.455 6.622 0.122 10 0 "[ . 1 . 2]" 1
232 1 21 THR HA 1 22 GLY H . . 6.500 3.031 2.970 3.294 . 0 0 "[ . 1 . 2]" 1
233 1 21 THR MG 1 22 GLY H . . 6.500 4.234 3.399 4.364 . 0 0 "[ . 1 . 2]" 1
234 1 22 GLY H 1 24 GLY H . . 6.500 5.363 4.366 5.995 . 0 0 "[ . 1 . 2]" 1
235 1 22 GLY HA2 1 23 LEU QB . . 6.500 4.562 4.131 5.106 . 0 0 "[ . 1 . 2]" 1
236 1 23 LEU HA 1 24 GLY H . . 6.500 3.509 3.308 3.559 . 0 0 "[ . 1 . 2]" 1
237 1 23 LEU HA 1 25 PHE H . . 6.500 4.314 3.736 5.482 . 0 0 "[ . 1 . 2]" 1
238 1 23 LEU QB 1 25 PHE H . . 6.500 3.730 2.376 4.955 . 0 0 "[ . 1 . 2]" 1
239 1 23 LEU QB 1 25 PHE QD . . 6.500 4.665 2.126 6.346 . 0 0 "[ . 1 . 2]" 1
240 1 23 LEU QB 1 25 PHE QE . . 6.500 4.531 1.950 6.543 0.043 16 0 "[ . 1 . 2]" 1
241 1 23 LEU MD1 1 24 GLY H . . 6.500 4.445 2.991 4.982 . 0 0 "[ . 1 . 2]" 1
242 1 23 LEU MD2 1 24 GLY H . . 6.500 4.407 3.370 5.338 . 0 0 "[ . 1 . 2]" 1
243 1 23 LEU MD2 1 25 PHE H . . 6.500 5.268 4.109 6.502 0.002 14 0 "[ . 1 . 2]" 1
244 1 23 LEU HG 1 24 GLY H . . 6.500 4.317 1.944 5.125 . 0 0 "[ . 1 . 2]" 1
245 1 23 LEU HG 1 25 PHE H . . 6.500 5.270 2.959 6.505 0.005 15 0 "[ . 1 . 2]" 1
246 1 24 GLY H 1 25 PHE H . . 6.500 2.668 2.399 2.955 . 0 0 "[ . 1 . 2]" 1
247 1 24 GLY H 1 25 PHE HB3 . . 6.500 5.572 4.743 5.864 . 0 0 "[ . 1 . 2]" 1
248 1 24 GLY H 1 42 LEU QB . . 6.500 4.396 3.516 5.416 . 0 0 "[ . 1 . 2]" 1
249 1 24 GLY H 1 47 ALA MB . . 6.500 4.857 4.016 5.893 . 0 0 "[ . 1 . 2]" 1
250 1 24 GLY HA2 1 25 PHE H . . 6.500 3.230 2.695 3.562 . 0 0 "[ . 1 . 2]" 1
251 1 24 GLY HA2 1 42 LEU H . . 6.500 3.702 3.044 4.611 . 0 0 "[ . 1 . 2]" 1
252 1 24 GLY HA2 1 47 ALA H . . 6.500 4.906 3.259 6.520 0.020 4 0 "[ . 1 . 2]" 1
253 1 24 GLY HA3 1 25 PHE H . . 6.500 3.182 2.705 3.562 . 0 0 "[ . 1 . 2]" 1
254 1 24 GLY HA3 1 25 PHE QD . . 6.500 3.776 3.078 4.397 . 0 0 "[ . 1 . 2]" 1
255 1 25 PHE H 1 25 PHE QE . . 6.500 4.283 3.851 4.649 . 0 0 "[ . 1 . 2]" 1
256 1 25 PHE H 1 26 ASN H . . 6.500 4.426 4.318 4.561 . 0 0 "[ . 1 . 2]" 1
257 1 25 PHE H 1 26 ASN HA . . 6.500 4.792 4.608 5.177 . 0 0 "[ . 1 . 2]" 1
258 1 25 PHE H 1 38 ILE MG . . 6.500 6.353 5.958 6.515 0.015 4 0 "[ . 1 . 2]" 1
259 1 25 PHE H 1 42 LEU H . . 6.500 4.190 3.530 5.458 . 0 0 "[ . 1 . 2]" 1
260 1 25 PHE H 1 42 LEU QB . . 6.500 4.158 2.938 5.093 . 0 0 "[ . 1 . 2]" 1
261 1 25 PHE H 1 42 LEU QD . . 6.500 3.855 2.494 5.892 . 0 0 "[ . 1 . 2]" 1
262 1 25 PHE H 1 47 ALA H . . 6.500 5.491 4.085 6.465 . 0 0 "[ . 1 . 2]" 1
263 1 25 PHE H 1 47 ALA MB . . 6.500 4.095 3.149 4.819 . 0 0 "[ . 1 . 2]" 1
264 1 25 PHE HA 1 26 ASN H . . 6.500 2.414 2.282 2.470 . 0 0 "[ . 1 . 2]" 1
265 1 25 PHE HA 1 26 ASN HA . . 6.500 4.408 4.338 4.511 . 0 0 "[ . 1 . 2]" 1
266 1 25 PHE HA 1 26 ASN HB3 . . 6.500 4.843 4.501 5.085 . 0 0 "[ . 1 . 2]" 1
267 1 25 PHE HA 1 38 ILE MG . . 6.500 4.681 4.166 5.046 . 0 0 "[ . 1 . 2]" 1
268 1 25 PHE HA 1 39 SER H . . 6.500 6.123 5.520 6.416 . 0 0 "[ . 1 . 2]" 1
269 1 25 PHE HA 1 40 PHE H . . 6.500 4.827 4.412 5.196 . 0 0 "[ . 1 . 2]" 1
270 1 25 PHE HA 1 42 LEU H . . 6.500 2.634 1.998 3.994 . 0 0 "[ . 1 . 2]" 1
271 1 25 PHE HA 1 47 ALA MB . . 6.500 4.174 3.277 5.154 . 0 0 "[ . 1 . 2]" 1
272 1 25 PHE HA 1 48 ASP H . . 6.500 6.407 5.805 6.520 0.020 14 0 "[ . 1 . 2]" 1
273 1 25 PHE HB2 1 26 ASN H . . 6.500 2.430 2.287 2.748 . 0 0 "[ . 1 . 2]" 1
274 1 25 PHE HB3 1 26 ASN H . . 6.500 3.685 3.495 3.886 . 0 0 "[ . 1 . 2]" 1
275 1 25 PHE HB3 1 26 ASN HA . . 6.500 5.745 5.645 5.858 . 0 0 "[ . 1 . 2]" 1
276 1 25 PHE HB3 1 26 ASN HB3 . . 6.500 6.419 6.254 6.537 0.037 15 0 "[ . 1 . 2]" 1
277 1 25 PHE HB3 1 38 ILE MG . . 6.500 4.241 3.731 4.663 . 0 0 "[ . 1 . 2]" 1
278 1 25 PHE HB3 1 39 SER H . . 6.500 6.542 6.519 6.581 0.081 18 0 "[ . 1 . 2]" 1
279 1 25 PHE HB3 1 40 PHE H . . 6.500 5.914 5.611 6.282 . 0 0 "[ . 1 . 2]" 1
280 1 25 PHE HB3 1 42 LEU H . . 6.500 3.983 3.216 6.130 . 0 0 "[ . 1 . 2]" 1
281 1 25 PHE QD 1 26 ASN H . . 6.500 3.478 3.056 4.081 . 0 0 "[ . 1 . 2]" 1
282 1 25 PHE QD 1 26 ASN HA . . 6.500 3.738 3.155 4.576 . 0 0 "[ . 1 . 2]" 1
283 1 25 PHE QD 1 27 ILE HA . . 6.500 4.805 4.200 5.192 . 0 0 "[ . 1 . 2]" 1
284 1 25 PHE QD 1 38 ILE MD . . 6.500 4.388 2.006 5.775 . 0 0 "[ . 1 . 2]" 1
285 1 25 PHE QD 1 38 ILE MG . . 6.500 4.004 2.539 4.566 . 0 0 "[ . 1 . 2]" 1
286 1 25 PHE QD 1 47 ALA H . . 6.500 3.788 2.542 5.451 . 0 0 "[ . 1 . 2]" 1
287 1 25 PHE QE 1 27 ILE HA . . 6.500 5.914 4.406 6.510 0.010 4 0 "[ . 1 . 2]" 1
288 1 25 PHE QE 1 27 ILE MD . . 6.500 4.332 3.190 5.605 . 0 0 "[ . 1 . 2]" 1
289 1 25 PHE QE 1 27 ILE MG . . 6.500 3.105 2.161 4.676 . 0 0 "[ . 1 . 2]" 1
290 1 25 PHE QE 1 38 ILE MD . . 6.500 5.097 2.260 6.512 0.012 15 0 "[ . 1 . 2]" 1
291 1 25 PHE QE 1 38 ILE MG . . 6.500 5.515 4.036 6.210 . 0 0 "[ . 1 . 2]" 1
292 1 25 PHE QE 1 47 ALA H . . 6.500 4.713 3.434 6.513 0.013 3 0 "[ . 1 . 2]" 1
293 1 25 PHE QE 1 47 ALA MB . . 6.500 3.354 2.200 4.608 . 0 0 "[ . 1 . 2]" 1
294 1 25 PHE QE 1 53 LEU QD . . 6.500 3.569 2.169 5.161 . 0 0 "[ . 1 . 2]" 1
295 1 25 PHE QE 1 59 ILE MD . . 6.500 4.815 3.295 6.228 . 0 0 "[ . 1 . 2]" 1
296 1 25 PHE QE 1 79 LEU MD1 . . 6.500 3.066 2.050 4.105 . 0 0 "[ . 1 . 2]" 1
297 1 25 PHE QE 1 88 ILE MD . . 6.500 3.644 2.206 5.773 . 0 0 "[ . 1 . 2]" 1
298 1 26 ASN H 1 27 ILE H . . 6.500 4.490 4.381 4.564 . 0 0 "[ . 1 . 2]" 1
299 1 26 ASN H 1 38 ILE MD . . 6.500 5.405 4.384 6.518 0.018 14 0 "[ . 1 . 2]" 1
300 1 26 ASN H 1 38 ILE MG . . 6.500 3.429 2.795 4.061 . 0 0 "[ . 1 . 2]" 1
301 1 26 ASN H 1 40 PHE H . . 6.500 2.908 2.476 3.339 . 0 0 "[ . 1 . 2]" 1
302 1 26 ASN H 1 40 PHE HA . . 6.500 4.647 2.302 5.165 . 0 0 "[ . 1 . 2]" 1
303 1 26 ASN H 1 40 PHE HB3 . . 6.500 4.635 3.438 5.765 . 0 0 "[ . 1 . 2]" 1
304 1 26 ASN H 1 40 PHE QD . . 6.500 5.429 3.946 6.101 . 0 0 "[ . 1 . 2]" 1
305 1 26 ASN H 1 42 LEU H . . 6.500 4.736 4.169 5.566 . 0 0 "[ . 1 . 2]" 1
306 1 26 ASN H 1 47 ALA MB . . 6.500 5.626 4.901 6.509 0.009 9 0 "[ . 1 . 2]" 1
307 1 26 ASN HA 1 27 ILE H . . 6.500 2.362 2.188 2.459 . 0 0 "[ . 1 . 2]" 1
308 1 26 ASN HA 1 27 ILE HA . . 6.500 4.456 4.390 4.507 . 0 0 "[ . 1 . 2]" 1
309 1 26 ASN HA 1 27 ILE MG . . 6.500 3.551 3.055 3.915 . 0 0 "[ . 1 . 2]" 1
310 1 26 ASN HA 1 39 SER H . . 6.500 4.979 4.691 5.339 . 0 0 "[ . 1 . 2]" 1
311 1 26 ASN HA 1 40 PHE H . . 6.500 4.714 4.383 5.911 . 0 0 "[ . 1 . 2]" 1
312 1 26 ASN HB2 1 27 ILE H . . 6.500 3.962 3.845 4.208 . 0 0 "[ . 1 . 2]" 1
313 1 26 ASN HB2 1 39 SER H . . 6.500 4.989 4.527 5.576 . 0 0 "[ . 1 . 2]" 1
314 1 26 ASN HB2 1 40 PHE H . . 6.500 3.601 2.879 5.713 . 0 0 "[ . 1 . 2]" 1
315 1 26 ASN HB2 1 40 PHE HA . . 6.500 5.513 3.876 6.492 . 0 0 "[ . 1 . 2]" 1
316 1 26 ASN HB2 1 40 PHE HB3 . . 6.500 4.267 2.616 6.531 0.031 15 0 "[ . 1 . 2]" 1
317 1 26 ASN HB3 1 27 ILE H . . 6.500 3.505 3.144 4.080 . 0 0 "[ . 1 . 2]" 1
318 1 26 ASN HB3 1 38 ILE MG . . 6.500 4.359 3.969 5.065 . 0 0 "[ . 1 . 2]" 1
319 1 26 ASN HB3 1 39 SER H . . 6.500 3.410 2.962 4.115 . 0 0 "[ . 1 . 2]" 1
320 1 26 ASN HB3 1 40 PHE H . . 6.500 2.314 1.946 4.394 . 0 0 "[ . 1 . 2]" 1
321 1 27 ILE H 1 28 ILE H . . 6.500 4.362 4.236 4.479 . 0 0 "[ . 1 . 2]" 1
322 1 27 ILE H 1 28 ILE HG13 . . 6.500 6.336 4.960 6.578 0.078 3 0 "[ . 1 . 2]" 1
323 1 27 ILE H 1 28 ILE MG . . 6.500 5.294 4.108 6.386 . 0 0 "[ . 1 . 2]" 1
324 1 27 ILE H 1 38 ILE HA . . 6.500 5.354 4.898 5.771 . 0 0 "[ . 1 . 2]" 1
325 1 27 ILE HA 1 28 ILE H . . 6.500 2.203 2.162 2.345 . 0 0 "[ . 1 . 2]" 1
326 1 27 ILE HA 1 28 ILE HA . . 6.500 4.411 4.397 4.428 . 0 0 "[ . 1 . 2]" 1
327 1 27 ILE HA 1 28 ILE HG12 . . 6.500 6.200 3.940 6.684 0.184 15 0 "[ . 1 . 2]" 1
328 1 27 ILE HA 1 28 ILE MG . . 6.500 3.932 3.670 5.434 . 0 0 "[ . 1 . 2]" 1
329 1 27 ILE HA 1 29 GLY H . . 6.500 6.191 6.014 6.373 . 0 0 "[ . 1 . 2]" 1
330 1 27 ILE HA 1 36 ILE HG12 . . 6.500 5.386 4.588 6.564 0.064 2 0 "[ . 1 . 2]" 1
331 1 27 ILE HA 1 36 ILE HG13 . . 6.500 4.699 4.102 6.142 . 0 0 "[ . 1 . 2]" 1
332 1 27 ILE HA 1 36 ILE MG . . 6.500 6.055 3.807 6.527 0.027 17 0 "[ . 1 . 2]" 1
333 1 27 ILE HA 1 37 PHE H . . 6.500 5.033 4.651 5.370 . 0 0 "[ . 1 . 2]" 1
334 1 27 ILE HA 1 38 ILE HB . . 6.500 5.753 5.324 6.103 . 0 0 "[ . 1 . 2]" 1
335 1 27 ILE HA 1 38 ILE MD . . 6.500 4.965 3.254 6.047 . 0 0 "[ . 1 . 2]" 1
336 1 27 ILE HA 1 38 ILE MG . . 6.500 4.054 3.526 4.402 . 0 0 "[ . 1 . 2]" 1
337 1 27 ILE HA 1 39 SER H . . 6.500 2.923 2.159 3.324 . 0 0 "[ . 1 . 2]" 1
338 1 27 ILE HA 1 39 SER HA . . 6.500 5.101 3.972 5.641 . 0 0 "[ . 1 . 2]" 1
339 1 27 ILE HA 1 39 SER HB2 . . 6.500 4.231 2.546 4.986 . 0 0 "[ . 1 . 2]" 1
340 1 27 ILE HA 1 39 SER HB3 . . 6.500 3.505 3.077 4.021 . 0 0 "[ . 1 . 2]" 1
341 1 27 ILE HA 1 40 PHE H . . 6.500 4.871 4.243 5.381 . 0 0 "[ . 1 . 2]" 1
342 1 27 ILE HA 1 59 ILE MD . . 6.500 5.212 4.132 6.264 . 0 0 "[ . 1 . 2]" 1
343 1 27 ILE HB 1 28 ILE H . . 6.500 3.154 2.517 4.166 . 0 0 "[ . 1 . 2]" 1
344 1 27 ILE HB 1 36 ILE MD . . 6.500 3.026 2.022 5.871 . 0 0 "[ . 1 . 2]" 1
345 1 27 ILE HB 1 36 ILE MG . . 6.500 4.930 2.781 6.180 . 0 0 "[ . 1 . 2]" 1
346 1 27 ILE HB 1 37 PHE H . . 6.500 5.202 3.829 6.442 . 0 0 "[ . 1 . 2]" 1
347 1 27 ILE HB 1 37 PHE HA . . 6.500 6.014 5.035 6.546 0.046 18 0 "[ . 1 . 2]" 1
348 1 27 ILE HB 1 38 ILE H . . 6.500 6.367 5.335 6.531 0.031 16 0 "[ . 1 . 2]" 1
349 1 27 ILE HB 1 39 SER H . . 6.500 5.283 4.398 5.748 . 0 0 "[ . 1 . 2]" 1
350 1 27 ILE MD 1 72 HIS HA . . 6.500 4.671 3.575 6.504 0.004 9 0 "[ . 1 . 2]" 1
351 1 27 ILE MD 1 75 ALA MB . . 6.500 2.650 1.948 4.601 . 0 0 "[ . 1 . 2]" 1
352 1 27 ILE MD 1 76 ALA H . . 6.500 3.877 2.489 5.408 . 0 0 "[ . 1 . 2]" 1
353 1 27 ILE MD 1 76 ALA HA . . 6.500 3.701 2.433 5.474 . 0 0 "[ . 1 . 2]" 1
354 1 27 ILE QG 1 28 ILE H . . 6.500 3.733 2.269 4.382 . 0 0 "[ . 1 . 2]" 1
355 1 27 ILE MG 1 28 ILE H . . 6.500 3.828 3.551 4.064 . 0 0 "[ . 1 . 2]" 1
356 1 27 ILE MG 1 38 ILE HA . . 6.500 3.612 1.975 5.146 . 0 0 "[ . 1 . 2]" 1
357 1 27 ILE MG 1 39 SER H . . 6.500 4.254 2.564 5.338 . 0 0 "[ . 1 . 2]" 1
358 1 27 ILE MG 1 72 HIS HD2 . . 6.500 4.988 2.647 5.779 . 0 0 "[ . 1 . 2]" 1
359 1 28 ILE H 1 29 GLY H . . 6.500 4.388 4.297 4.472 . 0 0 "[ . 1 . 2]" 1
360 1 28 ILE H 1 36 ILE HA . . 6.500 4.590 4.177 4.879 . 0 0 "[ . 1 . 2]" 1
361 1 28 ILE H 1 36 ILE HB . . 6.500 5.944 5.627 6.259 . 0 0 "[ . 1 . 2]" 1
362 1 28 ILE H 1 36 ILE MD . . 6.500 3.708 2.280 5.856 . 0 0 "[ . 1 . 2]" 1
363 1 28 ILE H 1 36 ILE MG . . 6.500 5.363 2.939 5.805 . 0 0 "[ . 1 . 2]" 1
364 1 28 ILE H 1 37 PHE H . . 6.500 3.287 2.960 3.554 . 0 0 "[ . 1 . 2]" 1
365 1 28 ILE H 1 37 PHE HB2 . . 6.500 4.805 4.074 5.263 . 0 0 "[ . 1 . 2]" 1
366 1 28 ILE H 1 37 PHE HB3 . . 6.500 5.839 5.321 6.266 . 0 0 "[ . 1 . 2]" 1
367 1 28 ILE H 1 37 PHE QD . . 6.500 5.723 5.015 6.063 . 0 0 "[ . 1 . 2]" 1
368 1 28 ILE H 1 38 ILE H . . 6.500 5.060 4.794 5.369 . 0 0 "[ . 1 . 2]" 1
369 1 28 ILE H 1 39 SER H . . 6.500 3.972 3.714 4.299 . 0 0 "[ . 1 . 2]" 1
370 1 28 ILE H 1 39 SER HA . . 6.500 4.955 4.609 5.518 . 0 0 "[ . 1 . 2]" 1
371 1 28 ILE H 1 39 SER HB2 . . 6.500 3.957 3.328 4.336 . 0 0 "[ . 1 . 2]" 1
372 1 28 ILE H 1 39 SER HB3 . . 6.500 4.144 3.820 4.872 . 0 0 "[ . 1 . 2]" 1
373 1 28 ILE H 1 40 PHE H . . 6.500 6.082 5.822 6.391 . 0 0 "[ . 1 . 2]" 1
374 1 28 ILE H 1 97 TYR QD . . 6.500 5.573 4.969 6.004 . 0 0 "[ . 1 . 2]" 1
375 1 28 ILE H 1 97 TYR QE . . 6.500 5.043 4.397 5.387 . 0 0 "[ . 1 . 2]" 1
376 1 28 ILE HA 1 29 GLY H . . 6.500 2.206 2.146 2.330 . 0 0 "[ . 1 . 2]" 1
377 1 28 ILE HA 1 37 PHE H . . 6.500 5.007 4.671 5.285 . 0 0 "[ . 1 . 2]" 1
378 1 28 ILE HB 1 29 GLY H . . 6.500 3.921 2.572 4.362 . 0 0 "[ . 1 . 2]" 1
379 1 28 ILE HB 1 39 SER H . . 6.500 5.125 4.390 6.435 . 0 0 "[ . 1 . 2]" 1
380 1 28 ILE HB 1 39 SER HB2 . . 6.500 2.829 2.010 4.402 . 0 0 "[ . 1 . 2]" 1
381 1 28 ILE HB 1 39 SER HB3 . . 6.500 4.006 3.015 6.120 . 0 0 "[ . 1 . 2]" 1
382 1 28 ILE MD 1 29 GLY H . . 6.500 4.093 3.269 5.087 . 0 0 "[ . 1 . 2]" 1
383 1 28 ILE MD 1 39 SER HB2 . . 6.500 3.332 1.926 4.273 . 0 0 "[ . 1 . 2]" 1
384 1 28 ILE MD 1 39 SER HB3 . . 6.500 4.659 3.232 5.508 . 0 0 "[ . 1 . 2]" 1
385 1 28 ILE MD 1 40 PHE H . . 6.500 6.443 4.625 6.606 0.106 5 0 "[ . 1 . 2]" 1
386 1 28 ILE MD 1 100 PHE H . . 6.500 4.991 3.800 5.486 . 0 0 "[ . 1 . 2]" 1
387 1 28 ILE MD 1 100 PHE HB3 . . 6.500 2.348 1.965 3.517 . 0 0 "[ . 1 . 2]" 1
388 1 28 ILE HG12 1 29 GLY H . . 6.500 3.385 2.490 5.466 . 0 0 "[ . 1 . 2]" 1
389 1 28 ILE HG12 1 37 PHE H . . 6.500 4.953 3.649 6.317 . 0 0 "[ . 1 . 2]" 1
390 1 28 ILE HG12 1 100 PHE H . . 6.500 6.526 6.476 6.613 0.113 5 0 "[ . 1 . 2]" 1
391 1 28 ILE HG13 1 29 GLY H . . 6.500 3.173 2.330 4.811 . 0 0 "[ . 1 . 2]" 1
392 1 28 ILE HG13 1 37 PHE H . . 6.500 5.449 2.100 6.191 . 0 0 "[ . 1 . 2]" 1
393 1 28 ILE HG13 1 100 PHE QE . . 6.500 4.598 3.927 6.000 . 0 0 "[ . 1 . 2]" 1
394 1 28 ILE MG 1 29 GLY H . . 6.500 3.644 2.629 3.907 . 0 0 "[ . 1 . 2]" 1
395 1 28 ILE MG 1 37 PHE HA . . 6.500 4.967 3.758 6.771 0.271 17 0 "[ . 1 . 2]" 1
396 1 28 ILE MG 1 37 PHE HB2 . . 6.500 3.614 2.094 5.746 . 0 0 "[ . 1 . 2]" 1
397 1 28 ILE MG 1 39 SER H . . 6.500 4.133 3.525 6.559 0.059 4 0 "[ . 1 . 2]" 1
398 1 28 ILE MG 1 39 SER HA . . 6.500 3.424 2.860 5.672 . 0 0 "[ . 1 . 2]" 1
399 1 28 ILE MG 1 39 SER HB2 . . 6.500 2.734 1.901 5.056 . 0 0 "[ . 1 . 2]" 1
400 1 28 ILE MG 1 39 SER HB3 . . 6.500 3.745 2.006 6.500 . 0 0 "[ . 1 . 2]" 1
401 1 28 ILE MG 1 97 TYR QD . . 6.500 3.451 2.580 5.499 . 0 0 "[ . 1 . 2]" 1
402 1 28 ILE MG 1 97 TYR QE . . 6.500 2.561 1.917 4.466 . 0 0 "[ . 1 . 2]" 1
403 1 28 ILE MG 1 100 PHE QD . . 6.500 3.092 2.536 4.681 . 0 0 "[ . 1 . 2]" 1
404 1 29 GLY H 1 30 GLY H . . 6.500 4.305 4.146 4.467 . 0 0 "[ . 1 . 2]" 1
405 1 29 GLY H 1 36 ILE HG12 . . 6.500 6.161 5.413 6.517 0.017 15 0 "[ . 1 . 2]" 1
406 1 29 GLY H 1 37 PHE H . . 6.500 5.079 4.750 5.541 . 0 0 "[ . 1 . 2]" 1
407 1 29 GLY H 1 39 SER HB2 . . 6.500 6.451 6.054 6.545 0.045 2 0 "[ . 1 . 2]" 1
408 1 29 GLY H 1 72 HIS HB2 . . 6.500 3.484 2.658 4.496 . 0 0 "[ . 1 . 2]" 1
409 1 29 GLY H 1 72 HIS HB3 . . 6.500 4.776 4.129 5.482 . 0 0 "[ . 1 . 2]" 1
410 1 29 GLY HA2 1 30 GLY H . . 6.500 2.757 2.302 2.977 . 0 0 "[ . 1 . 2]" 1
411 1 29 GLY HA2 1 35 GLY H . . 6.500 4.345 4.081 4.587 . 0 0 "[ . 1 . 2]" 1
412 1 29 GLY HA2 1 36 ILE MD . . 6.500 3.247 2.566 4.314 . 0 0 "[ . 1 . 2]" 1
413 1 29 GLY HA2 1 37 PHE H . . 6.500 3.650 3.298 4.301 . 0 0 "[ . 1 . 2]" 1
414 1 29 GLY HA2 1 37 PHE QD . . 6.500 5.084 4.004 6.254 . 0 0 "[ . 1 . 2]" 1
415 1 29 GLY HA2 1 100 PHE QD . . 6.500 4.920 4.416 6.309 . 0 0 "[ . 1 . 2]" 1
416 1 29 GLY HA2 1 100 PHE QE . . 6.500 3.267 2.952 4.826 . 0 0 "[ . 1 . 2]" 1
417 1 29 GLY HA3 1 30 GLY H . . 6.500 2.403 2.235 2.875 . 0 0 "[ . 1 . 2]" 1
418 1 29 GLY HA3 1 36 ILE H . . 6.500 5.152 4.476 6.246 . 0 0 "[ . 1 . 2]" 1
419 1 29 GLY HA3 1 72 HIS H . . 6.500 4.189 3.526 5.232 . 0 0 "[ . 1 . 2]" 1
420 1 30 GLY H 1 31 GLU H . . 6.500 4.011 3.925 4.074 . 0 0 "[ . 1 . 2]" 1
421 1 30 GLY H 1 31 GLU HA . . 6.500 4.919 4.768 5.090 . 0 0 "[ . 1 . 2]" 1
422 1 30 GLY H 1 33 GLY HA2 . . 6.500 3.706 3.516 4.027 . 0 0 "[ . 1 . 2]" 1
423 1 30 GLY H 1 34 GLU H . . 6.500 3.718 3.278 4.092 . 0 0 "[ . 1 . 2]" 1
424 1 30 GLY H 1 34 GLU QB . . 6.500 4.232 3.482 5.484 . 0 0 "[ . 1 . 2]" 1
425 1 30 GLY H 1 34 GLU QG . . 6.500 5.495 2.965 6.291 . 0 0 "[ . 1 . 2]" 1
426 1 30 GLY H 1 36 ILE HA . . 6.500 4.312 3.985 4.741 . 0 0 "[ . 1 . 2]" 1
427 1 30 GLY H 1 37 PHE H . . 6.500 6.133 5.858 6.549 0.049 4 0 "[ . 1 . 2]" 1
428 1 30 GLY H 1 71 SER HA . . 6.500 4.128 3.489 4.938 . 0 0 "[ . 1 . 2]" 1
429 1 30 GLY H 1 71 SER HB2 . . 6.500 5.730 4.593 6.518 0.018 2 0 "[ . 1 . 2]" 1
430 1 30 GLY HA2 1 31 GLU H . . 6.500 3.061 3.051 3.110 . 0 0 "[ . 1 . 2]" 1
431 1 30 GLY HA2 1 32 ASP H . . 6.500 6.468 6.405 6.552 0.052 20 0 "[ . 1 . 2]" 1
432 1 30 GLY HA2 1 33 GLY H . . 6.500 5.938 5.822 6.162 . 0 0 "[ . 1 . 2]" 1
433 1 30 GLY HA2 1 36 ILE MD . . 6.500 5.923 5.140 6.323 . 0 0 "[ . 1 . 2]" 1
434 1 30 GLY HA2 1 72 HIS H . . 6.500 4.785 4.086 5.306 . 0 0 "[ . 1 . 2]" 1
435 1 30 GLY HA3 1 31 GLU H . . 6.500 2.187 2.166 2.191 . 0 0 "[ . 1 . 2]" 1
436 1 30 GLY HA3 1 36 ILE HA . . 6.500 6.345 5.918 6.627 0.127 2 0 "[ . 1 . 2]" 1
437 1 30 GLY HA3 1 36 ILE MD . . 6.500 6.095 4.719 6.513 0.013 11 0 "[ . 1 . 2]" 1
438 1 30 GLY HA3 1 72 HIS H . . 6.500 5.372 4.682 5.821 . 0 0 "[ . 1 . 2]" 1
439 1 30 GLY HA3 1 72 HIS HA . . 6.500 6.416 6.030 6.560 0.060 12 0 "[ . 1 . 2]" 1
440 1 31 GLU H 1 32 ASP H . . 6.500 4.547 4.532 4.563 . 0 0 "[ . 1 . 2]" 1
441 1 31 GLU H 1 32 ASP HA . . 6.500 6.183 6.163 6.211 . 0 0 "[ . 1 . 2]" 1
442 1 31 GLU H 1 33 GLY H . . 6.500 4.597 4.509 4.816 . 0 0 "[ . 1 . 2]" 1
443 1 31 GLU H 1 34 GLU H . . 6.500 3.629 3.498 3.858 . 0 0 "[ . 1 . 2]" 1
444 1 31 GLU H 1 34 GLU HA . . 6.500 5.688 5.416 6.068 . 0 0 "[ . 1 . 2]" 1
445 1 31 GLU H 1 34 GLU QB . . 6.500 3.191 2.887 3.901 . 0 0 "[ . 1 . 2]" 1
446 1 31 GLU H 1 34 GLU QG . . 6.500 4.208 2.628 5.402 . 0 0 "[ . 1 . 2]" 1
447 1 31 GLU H 1 35 GLY H . . 6.500 5.275 4.850 5.651 . 0 0 "[ . 1 . 2]" 1
448 1 31 GLU H 1 71 SER HA . . 6.500 5.511 5.117 5.930 . 0 0 "[ . 1 . 2]" 1
449 1 31 GLU H 1 71 SER HB2 . . 6.500 6.022 4.842 6.525 0.025 18 0 "[ . 1 . 2]" 1
450 1 31 GLU H 1 72 HIS H . . 6.500 5.576 5.048 5.898 . 0 0 "[ . 1 . 2]" 1
451 1 31 GLU HA 1 32 ASP H . . 6.500 2.247 2.216 2.295 . 0 0 "[ . 1 . 2]" 1
452 1 31 GLU HA 1 73 GLU H . . 6.500 6.173 5.518 6.507 0.007 12 0 "[ . 1 . 2]" 1
453 1 31 GLU HB2 1 32 ASP H . . 6.500 3.329 2.779 4.140 . 0 0 "[ . 1 . 2]" 1
454 1 31 GLU HB3 1 32 ASP H . . 6.500 3.800 2.795 4.115 . 0 0 "[ . 1 . 2]" 1
455 1 31 GLU HB3 1 72 HIS H . . 6.500 6.511 6.352 6.571 0.071 7 0 "[ . 1 . 2]" 1
456 1 31 GLU QG 1 32 ASP H . . 6.500 3.458 1.970 4.305 . 0 0 "[ . 1 . 2]" 1
457 1 31 GLU QG 1 34 GLU H . . 6.500 4.691 3.867 5.737 . 0 0 "[ . 1 . 2]" 1
458 1 32 ASP H 1 33 GLY HA3 . . 6.500 5.330 5.242 5.470 . 0 0 "[ . 1 . 2]" 1
459 1 32 ASP H 1 34 GLU H . . 6.500 4.676 4.438 4.895 . 0 0 "[ . 1 . 2]" 1
460 1 32 ASP H 1 34 GLU QB . . 6.500 5.552 5.203 6.117 . 0 0 "[ . 1 . 2]" 1
461 1 32 ASP HA 1 33 GLY H . . 6.500 2.915 2.827 2.996 . 0 0 "[ . 1 . 2]" 1
462 1 32 ASP HA 1 71 SER H . . 6.500 4.516 4.225 4.691 . 0 0 "[ . 1 . 2]" 1
463 1 32 ASP HB3 1 34 GLU H . . 6.500 5.207 4.533 5.793 . 0 0 "[ . 1 . 2]" 1
464 1 32 ASP HB3 1 71 SER H . . 6.500 6.540 6.493 6.584 0.084 11 0 "[ . 1 . 2]" 1
465 1 33 GLY H 1 34 GLU H . . 6.500 2.887 2.745 2.994 . 0 0 "[ . 1 . 2]" 1
466 1 33 GLY H 1 34 GLU QB . . 6.500 4.636 4.424 4.932 . 0 0 "[ . 1 . 2]" 1
467 1 33 GLY H 1 34 GLU QG . . 6.500 5.631 4.519 6.503 0.003 17 0 "[ . 1 . 2]" 1
468 1 33 GLY H 1 36 ILE MD . . 6.500 5.901 3.726 6.519 0.019 8 0 "[ . 1 . 2]" 1
469 1 33 GLY H 1 69 ASN HA . . 6.500 5.341 4.625 5.679 . 0 0 "[ . 1 . 2]" 1
470 1 33 GLY H 1 70 ALA H . . 6.500 5.656 4.953 5.959 . 0 0 "[ . 1 . 2]" 1
471 1 33 GLY H 1 70 ALA HA . . 6.500 4.930 4.539 5.354 . 0 0 "[ . 1 . 2]" 1
472 1 33 GLY HA2 1 34 GLU H . . 6.500 2.727 2.620 2.876 . 0 0 "[ . 1 . 2]" 1
473 1 33 GLY HA2 1 69 ASN HA . . 6.500 4.267 3.945 4.462 . 0 0 "[ . 1 . 2]" 1
474 1 33 GLY HA3 1 34 GLU H . . 6.500 3.557 3.523 3.569 . 0 0 "[ . 1 . 2]" 1
475 1 33 GLY HA3 1 35 GLY H . . 6.500 4.306 4.140 4.416 . 0 0 "[ . 1 . 2]" 1
476 1 34 GLU H 1 35 GLY H . . 6.500 2.654 2.515 2.724 . 0 0 "[ . 1 . 2]" 1
477 1 34 GLU H 1 69 ASN HA . . 6.500 5.199 4.988 5.427 . 0 0 "[ . 1 . 2]" 1
478 1 34 GLU HA 1 35 GLY H . . 6.500 3.484 3.453 3.489 . 0 0 "[ . 1 . 2]" 1
479 1 34 GLU QB 1 35 GLY H . . 6.500 2.959 2.806 3.562 . 0 0 "[ . 1 . 2]" 1
480 1 34 GLU QG 1 35 GLY H . . 6.500 4.025 2.292 4.603 . 0 0 "[ . 1 . 2]" 1
481 1 35 GLY H 1 36 ILE H . . 6.500 3.473 3.064 3.823 . 0 0 "[ . 1 . 2]" 1
482 1 35 GLY H 1 36 ILE HA . . 6.500 4.383 4.278 4.523 . 0 0 "[ . 1 . 2]" 1
483 1 35 GLY H 1 70 ALA H . . 6.500 6.037 5.872 6.180 . 0 0 "[ . 1 . 2]" 1
484 1 35 GLY H 1 70 ALA MB . . 6.500 6.488 6.362 6.602 0.102 20 0 "[ . 1 . 2]" 1
485 1 35 GLY H 1 71 SER HA . . 6.500 5.212 4.759 5.968 . 0 0 "[ . 1 . 2]" 1
486 1 35 GLY HA2 1 36 ILE H . . 6.500 2.194 2.139 2.295 . 0 0 "[ . 1 . 2]" 1
487 1 35 GLY HA2 1 37 PHE QD . . 6.500 5.024 4.783 5.288 . 0 0 "[ . 1 . 2]" 1
488 1 35 GLY HA2 1 37 PHE QE . . 6.500 3.773 3.399 4.158 . 0 0 "[ . 1 . 2]" 1
489 1 35 GLY HA3 1 36 ILE H . . 6.500 3.405 3.260 3.504 . 0 0 "[ . 1 . 2]" 1
490 1 36 ILE H 1 37 PHE H . . 6.500 4.429 4.318 4.535 . 0 0 "[ . 1 . 2]" 1
491 1 36 ILE H 1 37 PHE HA . . 6.500 5.193 5.064 5.308 . 0 0 "[ . 1 . 2]" 1
492 1 36 ILE H 1 58 GLN HB2 . . 6.500 6.170 5.665 6.535 0.035 12 0 "[ . 1 . 2]" 1
493 1 36 ILE H 1 70 ALA H . . 6.500 5.284 4.782 5.679 . 0 0 "[ . 1 . 2]" 1
494 1 36 ILE H 1 75 ALA MB . . 6.500 5.991 5.443 6.323 . 0 0 "[ . 1 . 2]" 1
495 1 36 ILE HA 1 37 PHE H . . 6.500 2.149 2.139 2.175 . 0 0 "[ . 1 . 2]" 1
496 1 36 ILE HA 1 38 ILE H . . 6.500 6.375 6.323 6.408 . 0 0 "[ . 1 . 2]" 1
497 1 36 ILE HA 1 59 ILE H . . 6.500 5.774 5.349 6.114 . 0 0 "[ . 1 . 2]" 1
498 1 36 ILE HB 1 37 PHE H . . 6.500 4.255 4.190 4.425 . 0 0 "[ . 1 . 2]" 1
499 1 36 ILE HB 1 59 ILE H . . 6.500 6.153 4.692 6.539 0.039 12 0 "[ . 1 . 2]" 1
500 1 36 ILE HB 1 70 ALA H . . 6.500 5.082 4.514 5.460 . 0 0 "[ . 1 . 2]" 1
501 1 36 ILE MD 1 37 PHE H . . 6.500 3.753 2.616 4.671 . 0 0 "[ . 1 . 2]" 1
502 1 36 ILE MD 1 71 SER HB3 . . 6.500 6.242 5.471 6.559 0.059 20 0 "[ . 1 . 2]" 1
503 1 36 ILE MD 1 72 HIS H . . 6.500 4.299 3.825 5.055 . 0 0 "[ . 1 . 2]" 1
504 1 36 ILE MD 1 72 HIS HA . . 6.500 2.359 1.953 3.128 . 0 0 "[ . 1 . 2]" 1
505 1 36 ILE MD 1 72 HIS HB3 . . 6.500 4.784 4.360 5.463 . 0 0 "[ . 1 . 2]" 1
506 1 36 ILE MD 1 73 GLU H . . 6.500 5.203 4.749 5.814 . 0 0 "[ . 1 . 2]" 1
507 1 36 ILE MD 1 74 GLN H . . 6.500 5.421 4.978 5.946 . 0 0 "[ . 1 . 2]" 1
508 1 36 ILE MD 1 75 ALA H . . 6.500 3.951 3.501 4.742 . 0 0 "[ . 1 . 2]" 1
509 1 36 ILE MD 1 75 ALA MB . . 6.500 2.325 1.858 3.649 . 0 0 "[ . 1 . 2]" 1
510 1 36 ILE MD 1 76 ALA H . . 6.500 4.856 4.169 6.516 0.016 2 0 "[ . 1 . 2]" 1
511 1 36 ILE HG13 1 37 PHE H . . 6.500 2.639 2.203 3.996 . 0 0 "[ . 1 . 2]" 1
512 1 36 ILE MG 1 37 PHE H . . 6.500 3.846 2.553 4.096 . 0 0 "[ . 1 . 2]" 1
513 1 36 ILE MG 1 37 PHE HA . . 6.500 3.836 3.243 4.099 . 0 0 "[ . 1 . 2]" 1
514 1 36 ILE MG 1 59 ILE HB . . 6.500 2.468 1.942 2.994 . 0 0 "[ . 1 . 2]" 1
515 1 36 ILE MG 1 72 HIS HA . . 6.500 5.096 4.655 5.824 . 0 0 "[ . 1 . 2]" 1
516 1 36 ILE MG 1 75 ALA MB . . 6.500 3.226 2.769 3.758 . 0 0 "[ . 1 . 2]" 1
517 1 37 PHE H 1 37 PHE QE . . 6.500 4.824 4.613 4.991 . 0 0 "[ . 1 . 2]" 1
518 1 37 PHE H 1 38 ILE H . . 6.500 4.433 4.424 4.446 . 0 0 "[ . 1 . 2]" 1
519 1 37 PHE H 1 38 ILE HA . . 6.500 5.019 4.920 5.091 . 0 0 "[ . 1 . 2]" 1
520 1 37 PHE H 1 58 GLN HA . . 6.500 5.173 4.961 5.489 . 0 0 "[ . 1 . 2]" 1
521 1 37 PHE H 1 59 ILE HB . . 6.500 5.558 4.906 6.058 . 0 0 "[ . 1 . 2]" 1
522 1 37 PHE H 1 97 TYR QD . . 6.500 4.555 4.243 5.001 . 0 0 "[ . 1 . 2]" 1
523 1 37 PHE H 1 97 TYR QE . . 6.500 5.474 5.127 5.864 . 0 0 "[ . 1 . 2]" 1
524 1 37 PHE HA 1 38 ILE H . . 6.500 2.442 2.329 2.464 . 0 0 "[ . 1 . 2]" 1
525 1 37 PHE HA 1 38 ILE HA . . 6.500 4.307 4.298 4.325 . 0 0 "[ . 1 . 2]" 1
526 1 37 PHE HA 1 38 ILE HB . . 6.500 4.952 4.852 5.084 . 0 0 "[ . 1 . 2]" 1
527 1 37 PHE HA 1 58 GLN H . . 6.500 5.261 4.923 5.605 . 0 0 "[ . 1 . 2]" 1
528 1 37 PHE HA 1 58 GLN HB2 . . 6.500 4.282 3.880 5.505 . 0 0 "[ . 1 . 2]" 1
529 1 37 PHE HA 1 59 ILE H . . 6.500 2.519 2.019 2.988 . 0 0 "[ . 1 . 2]" 1
530 1 37 PHE HA 1 97 TYR QD . . 6.500 4.990 4.563 5.570 . 0 0 "[ . 1 . 2]" 1
531 1 37 PHE HA 1 97 TYR QE . . 6.500 6.300 6.070 6.512 0.012 20 0 "[ . 1 . 2]" 1
532 1 37 PHE HB2 1 38 ILE H . . 6.500 3.283 3.127 3.464 . 0 0 "[ . 1 . 2]" 1
533 1 37 PHE HB2 1 39 SER H . . 6.500 5.908 5.717 6.053 . 0 0 "[ . 1 . 2]" 1
534 1 37 PHE HB2 1 57 ASP H . . 6.500 6.159 5.686 6.525 0.025 4 0 "[ . 1 . 2]" 1
535 1 37 PHE HB2 1 97 TYR QD . . 6.500 2.157 1.987 2.978 . 0 0 "[ . 1 . 2]" 1
536 1 37 PHE HB2 1 97 TYR QE . . 6.500 3.937 3.554 4.281 . 0 0 "[ . 1 . 2]" 1
537 1 37 PHE HB3 1 38 ILE H . . 6.500 2.470 2.376 2.737 . 0 0 "[ . 1 . 2]" 1
538 1 37 PHE HB3 1 97 TYR QD . . 6.500 3.328 2.563 4.227 . 0 0 "[ . 1 . 2]" 1
539 1 37 PHE HB3 1 97 TYR QE . . 6.500 5.123 4.553 5.578 . 0 0 "[ . 1 . 2]" 1
540 1 37 PHE QD 1 38 ILE H . . 6.500 4.143 3.947 4.321 . 0 0 "[ . 1 . 2]" 1
541 1 37 PHE QD 1 38 ILE MD . . 6.500 5.835 4.337 6.553 0.053 12 0 "[ . 1 . 2]" 1
542 1 37 PHE QD 1 56 GLY HA2 . . 6.500 5.752 4.593 6.274 . 0 0 "[ . 1 . 2]" 1
543 1 37 PHE QD 1 58 GLN H . . 6.500 4.569 3.591 4.902 . 0 0 "[ . 1 . 2]" 1
544 1 37 PHE QD 1 58 GLN HB2 . . 6.500 2.264 1.987 3.578 . 0 0 "[ . 1 . 2]" 1
545 1 37 PHE QD 1 59 ILE H . . 6.500 2.854 2.208 4.131 . 0 0 "[ . 1 . 2]" 1
546 1 37 PHE QD 1 93 LYS HB2 . . 6.500 5.123 3.823 6.043 . 0 0 "[ . 1 . 2]" 1
547 1 37 PHE QD 1 93 LYS HB3 . . 6.500 4.867 3.159 5.666 . 0 0 "[ . 1 . 2]" 1
548 1 37 PHE QD 1 97 TYR H . . 6.500 4.484 4.085 5.563 . 0 0 "[ . 1 . 2]" 1
549 1 37 PHE QD 1 97 TYR HA . . 6.500 2.481 1.996 3.672 . 0 0 "[ . 1 . 2]" 1
550 1 37 PHE QD 1 97 TYR QD . . 6.500 2.870 2.033 3.814 . 0 0 "[ . 1 . 2]" 1
551 1 37 PHE QD 1 97 TYR QE . . 6.500 4.803 4.127 5.401 . 0 0 "[ . 1 . 2]" 1
552 1 37 PHE QD 1 100 PHE QD . . 6.500 2.458 1.989 3.488 . 0 0 "[ . 1 . 2]" 1
553 1 37 PHE QE 1 58 GLN H . . 6.500 6.011 4.820 6.475 . 0 0 "[ . 1 . 2]" 1
554 1 37 PHE QE 1 93 LYS HB2 . . 6.500 5.366 3.497 6.524 0.024 4 0 "[ . 1 . 2]" 1
555 1 37 PHE QE 1 93 LYS HB3 . . 6.500 4.850 2.554 5.836 . 0 0 "[ . 1 . 2]" 1
556 1 37 PHE QE 1 96 GLU HA . . 6.500 4.584 4.074 6.066 . 0 0 "[ . 1 . 2]" 1
557 1 37 PHE QE 1 96 GLU HB2 . . 6.500 4.073 2.755 5.072 . 0 0 "[ . 1 . 2]" 1
558 1 37 PHE QE 1 96 GLU HB3 . . 6.500 3.247 2.264 5.601 . 0 0 "[ . 1 . 2]" 1
559 1 37 PHE QE 1 97 TYR H . . 6.500 4.679 4.122 5.985 . 0 0 "[ . 1 . 2]" 1
560 1 37 PHE QE 1 97 TYR HA . . 6.500 3.403 2.713 4.541 . 0 0 "[ . 1 . 2]" 1
561 1 37 PHE QE 1 97 TYR QD . . 6.500 4.928 4.177 5.520 . 0 0 "[ . 1 . 2]" 1
562 1 38 ILE H 1 39 SER H . . 6.500 4.602 4.562 4.627 . 0 0 "[ . 1 . 2]" 1
563 1 38 ILE H 1 55 LYS HA . . 6.500 5.112 4.064 5.624 . 0 0 "[ . 1 . 2]" 1
564 1 38 ILE H 1 55 LYS HG2 . . 6.500 6.368 5.738 6.574 0.074 10 0 "[ . 1 . 2]" 1
565 1 38 ILE H 1 56 GLY H . . 6.500 4.262 2.887 4.625 . 0 0 "[ . 1 . 2]" 1
566 1 38 ILE H 1 56 GLY HA3 . . 6.500 6.270 5.100 6.524 0.024 20 0 "[ . 1 . 2]" 1
567 1 38 ILE H 1 57 ASP H . . 6.500 4.336 3.501 4.693 . 0 0 "[ . 1 . 2]" 1
568 1 38 ILE H 1 57 ASP HB3 . . 6.500 4.620 4.113 5.528 . 0 0 "[ . 1 . 2]" 1
569 1 38 ILE H 1 58 GLN H . . 6.500 4.905 4.618 5.494 . 0 0 "[ . 1 . 2]" 1
570 1 38 ILE H 1 58 GLN HA . . 6.500 3.181 2.719 4.111 . 0 0 "[ . 1 . 2]" 1
571 1 38 ILE H 1 59 ILE H . . 6.500 4.096 3.436 4.736 . 0 0 "[ . 1 . 2]" 1
572 1 38 ILE H 1 59 ILE HB . . 6.500 5.502 5.085 6.101 . 0 0 "[ . 1 . 2]" 1
573 1 38 ILE H 1 97 TYR QD . . 6.500 4.507 3.897 5.330 . 0 0 "[ . 1 . 2]" 1
574 1 38 ILE H 1 97 TYR QE . . 6.500 5.346 5.072 5.924 . 0 0 "[ . 1 . 2]" 1
575 1 38 ILE HA 1 39 SER H . . 6.500 2.211 2.160 2.256 . 0 0 "[ . 1 . 2]" 1
576 1 38 ILE HA 1 40 PHE H . . 6.500 4.499 3.937 4.925 . 0 0 "[ . 1 . 2]" 1
577 1 38 ILE HA 1 59 ILE H . . 6.500 6.011 5.428 6.496 . 0 0 "[ . 1 . 2]" 1
578 1 38 ILE HB 1 39 SER H . . 6.500 3.981 3.809 4.145 . 0 0 "[ . 1 . 2]" 1
579 1 38 ILE HB 1 40 PHE H . . 6.500 5.372 4.017 5.786 . 0 0 "[ . 1 . 2]" 1
580 1 38 ILE HB 1 54 ARG H . . 6.500 4.575 4.219 4.822 . 0 0 "[ . 1 . 2]" 1
581 1 38 ILE HB 1 55 LYS H . . 6.500 5.090 4.383 6.103 . 0 0 "[ . 1 . 2]" 1
582 1 38 ILE HB 1 55 LYS HA . . 6.500 3.058 1.979 4.138 . 0 0 "[ . 1 . 2]" 1
583 1 38 ILE HB 1 55 LYS HG2 . . 6.500 5.035 4.610 5.838 . 0 0 "[ . 1 . 2]" 1
584 1 38 ILE HB 1 56 GLY H . . 6.500 3.178 2.374 3.908 . 0 0 "[ . 1 . 2]" 1
585 1 38 ILE HB 1 57 ASP H . . 6.500 3.044 2.734 3.719 . 0 0 "[ . 1 . 2]" 1
586 1 38 ILE HB 1 58 GLN H . . 6.500 5.700 5.125 6.554 0.054 12 0 "[ . 1 . 2]" 1
587 1 38 ILE MD 1 39 SER H . . 6.500 4.383 3.304 4.999 . 0 0 "[ . 1 . 2]" 1
588 1 38 ILE MD 1 40 PHE H . . 6.500 5.521 4.726 6.393 . 0 0 "[ . 1 . 2]" 1
589 1 38 ILE MD 1 53 LEU H . . 6.500 5.674 4.647 6.491 . 0 0 "[ . 1 . 2]" 1
590 1 38 ILE MD 1 53 LEU QD . . 6.500 2.425 1.829 3.453 . 0 0 "[ . 1 . 2]" 1
591 1 38 ILE MD 1 54 ARG H . . 6.500 3.646 2.269 5.083 . 0 0 "[ . 1 . 2]" 1
592 1 38 ILE MD 1 55 LYS H . . 6.500 5.614 4.192 6.546 0.046 4 0 "[ . 1 . 2]" 1
593 1 38 ILE MD 1 56 GLY H . . 6.500 5.035 4.106 5.887 . 0 0 "[ . 1 . 2]" 1
594 1 38 ILE MD 1 57 ASP H . . 6.500 4.108 2.983 5.440 . 0 0 "[ . 1 . 2]" 1
595 1 38 ILE MD 1 57 ASP HB2 . . 6.500 2.841 1.906 4.451 . 0 0 "[ . 1 . 2]" 1
596 1 38 ILE MD 1 57 ASP HB3 . . 6.500 3.106 1.930 4.830 . 0 0 "[ . 1 . 2]" 1
597 1 38 ILE MD 1 59 ILE H . . 6.500 4.724 3.503 5.510 . 0 0 "[ . 1 . 2]" 1
598 1 38 ILE MD 1 59 ILE MG . . 6.500 4.621 3.901 5.387 . 0 0 "[ . 1 . 2]" 1
599 1 38 ILE MG 1 39 SER H . . 6.500 2.277 2.006 2.453 . 0 0 "[ . 1 . 2]" 1
600 1 38 ILE MG 1 40 PHE H . . 6.500 2.889 1.903 3.250 . 0 0 "[ . 1 . 2]" 1
601 1 38 ILE MG 1 55 LYS H . . 6.500 3.785 3.257 5.013 . 0 0 "[ . 1 . 2]" 1
602 1 38 ILE MG 1 55 LYS HA . . 6.500 2.523 1.979 3.715 . 0 0 "[ . 1 . 2]" 1
603 1 38 ILE MG 1 56 GLY H . . 6.500 3.785 3.350 4.447 . 0 0 "[ . 1 . 2]" 1
604 1 38 ILE MG 1 57 ASP H . . 6.500 4.099 3.734 4.737 . 0 0 "[ . 1 . 2]" 1
605 1 39 SER H 1 40 PHE H . . 6.500 2.476 2.050 2.725 . 0 0 "[ . 1 . 2]" 1
606 1 39 SER H 1 40 PHE HB2 . . 6.500 5.372 4.607 6.441 . 0 0 "[ . 1 . 2]" 1
607 1 39 SER H 1 40 PHE HB3 . . 6.500 5.628 4.263 6.353 . 0 0 "[ . 1 . 2]" 1
608 1 39 SER H 1 55 LYS HG2 . . 6.500 5.831 4.840 6.512 0.012 10 0 "[ . 1 . 2]" 1
609 1 39 SER H 1 55 LYS HG3 . . 6.500 6.184 4.508 6.515 0.015 4 0 "[ . 1 . 2]" 1
610 1 39 SER H 1 56 GLY H . . 6.500 5.395 4.621 5.999 . 0 0 "[ . 1 . 2]" 1
611 1 39 SER H 1 97 TYR QE . . 6.500 4.710 4.372 5.274 . 0 0 "[ . 1 . 2]" 1
612 1 39 SER HA 1 40 PHE H . . 6.500 3.522 2.855 3.570 . 0 0 "[ . 1 . 2]" 1
613 1 39 SER HA 1 55 LYS HG2 . . 6.500 3.953 3.421 4.561 . 0 0 "[ . 1 . 2]" 1
614 1 39 SER HA 1 55 LYS HG3 . . 6.500 4.172 2.393 5.468 . 0 0 "[ . 1 . 2]" 1
615 1 39 SER HA 1 56 GLY H . . 6.500 4.366 3.953 4.976 . 0 0 "[ . 1 . 2]" 1
616 1 39 SER HA 1 97 TYR QD . . 6.500 4.338 3.955 5.189 . 0 0 "[ . 1 . 2]" 1
617 1 39 SER HA 1 97 TYR QE . . 6.500 2.409 1.980 3.485 . 0 0 "[ . 1 . 2]" 1
618 1 39 SER HB2 1 40 PHE H . . 6.500 3.845 3.548 4.617 . 0 0 "[ . 1 . 2]" 1
619 1 39 SER HB2 1 97 TYR QD . . 6.500 5.454 4.939 5.718 . 0 0 "[ . 1 . 2]" 1
620 1 39 SER HB2 1 97 TYR QE . . 6.500 3.452 3.060 3.761 . 0 0 "[ . 1 . 2]" 1
621 1 39 SER HB3 1 40 PHE H . . 6.500 2.593 2.033 4.174 . 0 0 "[ . 1 . 2]" 1
622 1 39 SER HB3 1 97 TYR QD . . 6.500 6.526 6.481 6.587 0.087 4 0 "[ . 1 . 2]" 1
623 1 39 SER HB3 1 97 TYR QE . . 6.500 4.748 4.631 4.956 . 0 0 "[ . 1 . 2]" 1
624 1 40 PHE H 1 40 PHE QE . . 6.500 6.034 4.156 6.505 0.005 20 0 "[ . 1 . 2]" 1
625 1 40 PHE H 1 54 ARG HA . . 6.500 6.458 6.149 6.531 0.031 2 0 "[ . 1 . 2]" 1
626 1 40 PHE H 1 55 LYS H . . 6.500 5.961 5.503 6.304 . 0 0 "[ . 1 . 2]" 1
627 1 40 PHE H 1 55 LYS HA . . 6.500 4.764 4.231 5.081 . 0 0 "[ . 1 . 2]" 1
628 1 40 PHE H 1 55 LYS QB . . 6.500 4.736 3.606 6.012 . 0 0 "[ . 1 . 2]" 1
629 1 40 PHE H 1 55 LYS HG2 . . 6.500 5.821 4.047 6.501 0.001 10 0 "[ . 1 . 2]" 1
630 1 40 PHE H 1 55 LYS HG3 . . 6.500 5.570 4.500 6.038 . 0 0 "[ . 1 . 2]" 1
631 1 40 PHE H 1 56 GLY H . . 6.500 6.242 5.530 6.504 0.004 14 0 "[ . 1 . 2]" 1
632 1 42 LEU H 1 43 ALA H . . 6.500 4.497 4.374 4.608 . 0 0 "[ . 1 . 2]" 1
633 1 42 LEU H 1 47 ALA MB . . 6.500 4.300 3.308 5.495 . 0 0 "[ . 1 . 2]" 1
634 1 42 LEU QB 1 43 ALA H . . 6.500 3.071 2.547 3.418 . 0 0 "[ . 1 . 2]" 1
635 1 42 LEU QB 1 45 GLY H . . 6.500 4.127 3.430 4.721 . 0 0 "[ . 1 . 2]" 1
636 1 42 LEU QD 1 43 ALA H . . 6.500 3.174 2.073 4.001 . 0 0 "[ . 1 . 2]" 1
637 1 43 ALA H 1 44 GLY H . . 6.500 4.611 4.545 4.643 . 0 0 "[ . 1 . 2]" 1
638 1 43 ALA H 1 45 GLY H . . 6.500 4.790 4.385 5.171 . 0 0 "[ . 1 . 2]" 1
639 1 43 ALA HA 1 44 GLY H . . 6.500 2.238 2.160 2.325 . 0 0 "[ . 1 . 2]" 1
640 1 43 ALA MB 1 44 GLY H . . 6.500 2.840 2.553 3.081 . 0 0 "[ . 1 . 2]" 1
641 1 43 ALA MB 1 45 GLY H . . 6.500 4.326 4.235 4.410 . 0 0 "[ . 1 . 2]" 1
642 1 44 GLY H 1 45 GLY H . . 6.500 2.600 2.405 2.770 . 0 0 "[ . 1 . 2]" 1
643 1 44 GLY H 1 48 ASP HB3 . . 6.500 3.627 2.816 4.999 . 0 0 "[ . 1 . 2]" 1
644 1 44 GLY H 1 49 LEU QD . . 6.500 4.741 3.224 6.181 . 0 0 "[ . 1 . 2]" 1
645 1 44 GLY HA2 1 45 GLY H . . 6.500 3.299 3.133 3.466 . 0 0 "[ . 1 . 2]" 1
646 1 44 GLY HA2 1 49 LEU H . . 6.500 5.961 5.076 6.445 . 0 0 "[ . 1 . 2]" 1
647 1 44 GLY HA3 1 45 GLY H . . 6.500 3.223 3.026 3.403 . 0 0 "[ . 1 . 2]" 1
648 1 45 GLY H 1 46 PRO HA . . 6.500 5.660 5.373 5.872 . 0 0 "[ . 1 . 2]" 1
649 1 45 GLY H 1 46 PRO QD . . 6.500 4.282 4.179 4.362 . 0 0 "[ . 1 . 2]" 1
650 1 45 GLY H 1 48 ASP H . . 6.500 4.062 3.531 4.465 . 0 0 "[ . 1 . 2]" 1
651 1 45 GLY H 1 48 ASP HA . . 6.500 5.771 5.061 6.249 . 0 0 "[ . 1 . 2]" 1
652 1 45 GLY H 1 48 ASP HB2 . . 6.500 3.670 2.737 5.090 . 0 0 "[ . 1 . 2]" 1
653 1 45 GLY H 1 48 ASP HB3 . . 6.500 3.629 2.460 5.117 . 0 0 "[ . 1 . 2]" 1
654 1 45 GLY H 1 49 LEU H . . 6.500 4.765 3.813 5.898 . 0 0 "[ . 1 . 2]" 1
655 1 45 GLY H 1 49 LEU HG . . 6.500 5.112 3.820 6.385 . 0 0 "[ . 1 . 2]" 1
656 1 45 GLY HA3 1 46 PRO HD3 . . 6.500 3.206 3.023 3.387 . 0 0 "[ . 1 . 2]" 1
657 1 46 PRO HA 1 47 ALA H . . 6.500 3.542 3.520 3.567 . 0 0 "[ . 1 . 2]" 1
658 1 46 PRO HA 1 49 LEU H . . 6.500 3.598 3.338 3.816 . 0 0 "[ . 1 . 2]" 1
659 1 46 PRO HA 1 49 LEU QB . . 6.500 2.911 2.025 4.179 . 0 0 "[ . 1 . 2]" 1
660 1 46 PRO HA 1 49 LEU QD . . 6.500 2.545 1.997 3.957 . 0 0 "[ . 1 . 2]" 1
661 1 46 PRO QB 1 47 ALA H . . 6.500 3.091 2.879 3.216 . 0 0 "[ . 1 . 2]" 1
662 1 46 PRO QD 1 47 ALA H . . 6.500 2.620 2.601 2.674 . 0 0 "[ . 1 . 2]" 1
663 1 46 PRO QD 1 48 ASP H . . 6.500 4.277 3.878 4.564 . 0 0 "[ . 1 . 2]" 1
664 1 46 PRO QG 1 47 ALA H . . 6.500 2.209 1.963 2.368 . 0 0 "[ . 1 . 2]" 1
665 1 47 ALA H 1 48 ASP H . . 6.500 2.704 2.528 2.874 . 0 0 "[ . 1 . 2]" 1
666 1 47 ALA H 1 48 ASP HA . . 6.500 5.296 5.143 5.435 . 0 0 "[ . 1 . 2]" 1
667 1 47 ALA H 1 48 ASP HB2 . . 6.500 5.156 4.375 6.397 . 0 0 "[ . 1 . 2]" 1
668 1 47 ALA H 1 49 LEU H . . 6.500 4.194 3.915 4.519 . 0 0 "[ . 1 . 2]" 1
669 1 47 ALA H 1 49 LEU QB . . 6.500 5.034 4.487 6.144 . 0 0 "[ . 1 . 2]" 1
670 1 47 ALA H 1 53 LEU QD . . 6.500 5.022 3.917 6.504 0.004 7 0 "[ . 1 . 2]" 1
671 1 47 ALA HA 1 48 ASP H . . 6.500 3.536 3.483 3.565 . 0 0 "[ . 1 . 2]" 1
672 1 47 ALA HA 1 50 SER H . . 6.500 3.732 3.408 4.061 . 0 0 "[ . 1 . 2]" 1
673 1 47 ALA HA 1 51 GLY H . . 6.500 4.257 2.666 5.013 . 0 0 "[ . 1 . 2]" 1
674 1 47 ALA HA 1 53 LEU H . . 6.500 4.773 3.512 6.388 . 0 0 "[ . 1 . 2]" 1
675 1 47 ALA MB 1 48 ASP H . . 6.500 2.597 2.391 2.790 . 0 0 "[ . 1 . 2]" 1
676 1 47 ALA MB 1 49 LEU H . . 6.500 4.544 4.314 4.849 . 0 0 "[ . 1 . 2]" 1
677 1 47 ALA MB 1 53 LEU H . . 6.500 4.311 3.268 5.319 . 0 0 "[ . 1 . 2]" 1
678 1 48 ASP H 1 49 LEU H . . 6.500 2.666 2.513 2.847 . 0 0 "[ . 1 . 2]" 1
679 1 48 ASP H 1 49 LEU HA . . 6.500 5.262 5.119 5.408 . 0 0 "[ . 1 . 2]" 1
680 1 48 ASP H 1 49 LEU QB . . 6.500 4.537 4.200 5.081 . 0 0 "[ . 1 . 2]" 1
681 1 48 ASP H 1 49 LEU HG . . 6.500 4.984 3.805 6.507 0.007 7 0 "[ . 1 . 2]" 1
682 1 48 ASP HA 1 49 LEU H . . 6.500 3.534 3.506 3.566 . 0 0 "[ . 1 . 2]" 1
683 1 48 ASP HA 1 52 GLU H . . 6.500 5.111 4.264 6.126 . 0 0 "[ . 1 . 2]" 1
684 1 48 ASP HB2 1 49 LEU H . . 6.500 3.539 2.368 4.103 . 0 0 "[ . 1 . 2]" 1
685 1 48 ASP HB2 1 50 SER H . . 6.500 5.710 4.866 6.219 . 0 0 "[ . 1 . 2]" 1
686 1 48 ASP HB3 1 49 LEU H . . 6.500 2.998 2.362 4.068 . 0 0 "[ . 1 . 2]" 1
687 1 48 ASP HB3 1 50 SER H . . 6.500 5.381 4.791 6.232 . 0 0 "[ . 1 . 2]" 1
688 1 49 LEU H 1 50 SER H . . 6.500 2.747 2.574 2.865 . 0 0 "[ . 1 . 2]" 1
689 1 49 LEU H 1 50 SER HB2 . . 6.500 5.588 4.762 6.381 . 0 0 "[ . 1 . 2]" 1
690 1 49 LEU H 1 51 GLY H . . 6.500 4.096 3.657 4.332 . 0 0 "[ . 1 . 2]" 1
691 1 49 LEU H 1 51 GLY QA . . 6.500 5.441 5.219 5.645 . 0 0 "[ . 1 . 2]" 1
692 1 49 LEU QB 1 50 SER H . . 6.500 2.519 2.262 3.425 . 0 0 "[ . 1 . 2]" 1
693 1 49 LEU HG 1 50 SER H . . 6.500 4.500 2.384 4.925 . 0 0 "[ . 1 . 2]" 1
694 1 49 LEU HG 1 51 GLY H . . 6.500 6.225 4.876 6.523 0.023 7 0 "[ . 1 . 2]" 1
695 1 50 SER H 1 51 GLY H . . 6.500 2.669 2.349 2.776 . 0 0 "[ . 1 . 2]" 1
696 1 50 SER HA 1 51 GLY H . . 6.500 3.529 3.513 3.554 . 0 0 "[ . 1 . 2]" 1
697 1 50 SER HA 1 51 GLY QA . . 6.500 4.355 4.317 4.417 . 0 0 "[ . 1 . 2]" 1
698 1 50 SER HA 1 52 GLU H . . 6.500 5.093 4.425 6.518 0.018 7 0 "[ . 1 . 2]" 1
699 1 50 SER HB2 1 52 GLU H . . 6.500 4.270 2.468 6.495 . 0 0 "[ . 1 . 2]" 1
700 1 51 GLY H 1 52 GLU QB . . 6.500 4.852 4.241 6.333 . 0 0 "[ . 1 . 2]" 1
701 1 51 GLY H 1 53 LEU HG . . 6.500 6.096 5.141 6.506 0.006 10 0 "[ . 1 . 2]" 1
702 1 51 GLY QA 1 52 GLU H . . 6.500 2.649 2.214 2.789 . 0 0 "[ . 1 . 2]" 1
703 1 52 GLU H 1 53 LEU H . . 6.500 2.148 1.858 2.674 . 0 0 "[ . 1 . 2]" 1
704 1 52 GLU H 1 53 LEU QD . . 6.500 4.322 3.240 4.753 . 0 0 "[ . 1 . 2]" 1
705 1 52 GLU H 1 53 LEU HG . . 6.500 4.166 3.313 5.491 . 0 0 "[ . 1 . 2]" 1
706 1 52 GLU HA 1 53 LEU H . . 6.500 3.473 3.037 3.565 . 0 0 "[ . 1 . 2]" 1
707 1 52 GLU HA 1 53 LEU HB2 . . 6.500 5.792 5.150 6.162 . 0 0 "[ . 1 . 2]" 1
708 1 52 GLU QB 1 53 LEU H . . 6.500 2.689 2.273 3.690 . 0 0 "[ . 1 . 2]" 1
709 1 52 GLU HG2 1 53 LEU H . . 6.500 4.488 2.049 5.916 . 0 0 "[ . 1 . 2]" 1
710 1 52 GLU HG3 1 53 LEU H . . 6.500 4.479 2.806 5.814 . 0 0 "[ . 1 . 2]" 1
711 1 53 LEU H 1 54 ARG H . . 6.500 4.489 4.347 4.623 . 0 0 "[ . 1 . 2]" 1
712 1 53 LEU H 1 54 ARG HA . . 6.500 5.485 5.303 5.580 . 0 0 "[ . 1 . 2]" 1
713 1 53 LEU HA 1 54 ARG H . . 6.500 2.154 2.139 2.251 . 0 0 "[ . 1 . 2]" 1
714 1 53 LEU HB2 1 54 ARG H . . 6.500 4.228 4.019 4.431 . 0 0 "[ . 1 . 2]" 1
715 1 53 LEU HB3 1 54 ARG H . . 6.500 3.365 2.850 3.588 . 0 0 "[ . 1 . 2]" 1
716 1 53 LEU QD 1 54 ARG H . . 6.500 3.534 2.991 3.971 . 0 0 "[ . 1 . 2]" 1
717 1 53 LEU QD 1 88 ILE H . . 6.500 4.115 3.557 5.225 . 0 0 "[ . 1 . 2]" 1
718 1 53 LEU QD 1 90 ALA H . . 6.500 4.289 3.552 5.752 . 0 0 "[ . 1 . 2]" 1
719 1 53 LEU QD 1 90 ALA MB . . 6.500 2.288 1.703 3.365 . 0 0 "[ . 1 . 2]" 1
720 1 53 LEU HG 1 54 ARG H . . 6.500 5.087 4.636 5.410 . 0 0 "[ . 1 . 2]" 1
721 1 54 ARG H 1 55 LYS H . . 6.500 4.403 4.368 4.431 . 0 0 "[ . 1 . 2]" 1
722 1 54 ARG H 1 55 LYS QB . . 6.500 5.827 5.786 5.947 . 0 0 "[ . 1 . 2]" 1
723 1 54 ARG H 1 57 ASP H . . 6.500 4.132 3.707 4.544 . 0 0 "[ . 1 . 2]" 1
724 1 54 ARG H 1 57 ASP HA . . 6.500 5.500 5.050 6.030 . 0 0 "[ . 1 . 2]" 1
725 1 54 ARG H 1 57 ASP HB2 . . 6.500 3.174 2.692 4.618 . 0 0 "[ . 1 . 2]" 1
726 1 54 ARG H 1 57 ASP HB3 . . 6.500 4.126 2.550 4.903 . 0 0 "[ . 1 . 2]" 1
727 1 54 ARG H 1 90 ALA MB . . 6.500 4.330 3.798 5.113 . 0 0 "[ . 1 . 2]" 1
728 1 54 ARG HA 1 55 LYS H . . 6.500 2.464 2.190 2.524 . 0 0 "[ . 1 . 2]" 1
729 1 54 ARG HA 1 57 ASP H . . 6.500 5.406 5.140 5.656 . 0 0 "[ . 1 . 2]" 1
730 1 54 ARG HB2 1 55 LYS H . . 6.500 3.253 2.179 4.284 . 0 0 "[ . 1 . 2]" 1
731 1 54 ARG HB2 1 57 ASP H . . 6.500 5.263 4.563 6.034 . 0 0 "[ . 1 . 2]" 1
732 1 54 ARG HB3 1 55 LYS H . . 6.500 2.978 2.167 3.879 . 0 0 "[ . 1 . 2]" 1
733 1 54 ARG QG 1 55 LYS H . . 6.500 3.207 1.927 4.224 . 0 0 "[ . 1 . 2]" 1
734 1 54 ARG QG 1 57 ASP H . . 6.500 5.220 3.328 6.429 . 0 0 "[ . 1 . 2]" 1
735 1 55 LYS H 1 56 GLY H . . 6.500 4.601 4.524 4.615 . 0 0 "[ . 1 . 2]" 1
736 1 55 LYS H 1 56 GLY HA3 . . 6.500 5.558 5.484 5.640 . 0 0 "[ . 1 . 2]" 1
737 1 55 LYS HA 1 56 GLY H . . 6.500 2.195 2.148 2.209 . 0 0 "[ . 1 . 2]" 1
738 1 55 LYS HA 1 57 ASP H . . 6.500 3.522 3.493 3.660 . 0 0 "[ . 1 . 2]" 1
739 1 55 LYS HA 1 97 TYR QD . . 6.500 5.180 4.182 5.805 . 0 0 "[ . 1 . 2]" 1
740 1 55 LYS HA 1 97 TYR QE . . 6.500 4.619 3.730 5.117 . 0 0 "[ . 1 . 2]" 1
741 1 55 LYS QB 1 56 GLY H . . 6.500 3.561 3.015 3.716 . 0 0 "[ . 1 . 2]" 1
742 1 55 LYS QB 1 97 TYR QD . . 6.500 5.153 3.828 5.641 . 0 0 "[ . 1 . 2]" 1
743 1 55 LYS QB 1 97 TYR QE . . 6.500 4.126 2.552 4.804 . 0 0 "[ . 1 . 2]" 1
744 1 55 LYS HG2 1 56 GLY H . . 6.500 2.553 2.228 3.917 . 0 0 "[ . 1 . 2]" 1
745 1 55 LYS HG2 1 57 ASP H . . 6.500 4.901 4.693 5.821 . 0 0 "[ . 1 . 2]" 1
746 1 55 LYS HG2 1 97 TYR QD . . 6.500 3.873 2.411 5.655 . 0 0 "[ . 1 . 2]" 1
747 1 55 LYS HG2 1 97 TYR QE . . 6.500 2.865 2.010 4.399 . 0 0 "[ . 1 . 2]" 1
748 1 55 LYS HG3 1 56 GLY H . . 6.500 4.054 3.018 5.164 . 0 0 "[ . 1 . 2]" 1
749 1 56 GLY H 1 57 ASP H . . 6.500 2.738 2.672 2.827 . 0 0 "[ . 1 . 2]" 1
750 1 56 GLY H 1 57 ASP HB3 . . 6.500 5.822 4.795 6.165 . 0 0 "[ . 1 . 2]" 1
751 1 56 GLY H 1 97 TYR HB2 . . 6.500 4.172 3.822 4.691 . 0 0 "[ . 1 . 2]" 1
752 1 56 GLY H 1 97 TYR QD . . 6.500 3.639 2.441 4.191 . 0 0 "[ . 1 . 2]" 1
753 1 56 GLY H 1 97 TYR QE . . 6.500 3.860 3.287 4.135 . 0 0 "[ . 1 . 2]" 1
754 1 56 GLY HA2 1 57 ASP H . . 6.500 3.490 3.488 3.493 . 0 0 "[ . 1 . 2]" 1
755 1 56 GLY HA3 1 57 ASP H . . 6.500 2.959 2.954 2.963 . 0 0 "[ . 1 . 2]" 1
756 1 56 GLY HA3 1 97 TYR QE . . 6.500 4.983 4.160 5.569 . 0 0 "[ . 1 . 2]" 1
757 1 56 GLY HA3 1 98 SER H . . 6.500 6.341 5.805 6.515 0.015 10 0 "[ . 1 . 2]" 1
758 1 57 ASP H 1 58 GLN H . . 6.500 4.628 4.607 4.640 . 0 0 "[ . 1 . 2]" 1
759 1 57 ASP H 1 58 GLN HA . . 6.500 5.468 5.360 5.560 . 0 0 "[ . 1 . 2]" 1
760 1 57 ASP H 1 90 ALA MB . . 6.500 5.273 4.714 5.960 . 0 0 "[ . 1 . 2]" 1
761 1 57 ASP H 1 91 GLN H . . 6.500 5.972 5.479 6.510 0.010 3 0 "[ . 1 . 2]" 1
762 1 57 ASP H 1 92 TYR HA . . 6.500 5.286 4.669 5.894 . 0 0 "[ . 1 . 2]" 1
763 1 57 ASP H 1 92 TYR QD . . 6.500 5.653 4.995 6.280 . 0 0 "[ . 1 . 2]" 1
764 1 57 ASP H 1 97 TYR QD . . 6.500 5.405 4.867 5.627 . 0 0 "[ . 1 . 2]" 1
765 1 57 ASP H 1 97 TYR QE . . 6.500 6.108 5.794 6.377 . 0 0 "[ . 1 . 2]" 1
766 1 57 ASP HA 1 58 GLN H . . 6.500 2.261 2.201 2.274 . 0 0 "[ . 1 . 2]" 1
767 1 57 ASP HA 1 90 ALA MB . . 6.500 4.224 3.473 5.119 . 0 0 "[ . 1 . 2]" 1
768 1 57 ASP HA 1 91 GLN H . . 6.500 3.521 3.091 3.988 . 0 0 "[ . 1 . 2]" 1
769 1 57 ASP HA 1 91 GLN QB . . 6.500 4.938 4.377 5.456 . 0 0 "[ . 1 . 2]" 1
770 1 57 ASP HA 1 92 TYR HA . . 6.500 3.354 2.787 3.778 . 0 0 "[ . 1 . 2]" 1
771 1 57 ASP HA 1 93 LYS H . . 6.500 3.075 2.348 3.493 . 0 0 "[ . 1 . 2]" 1
772 1 57 ASP HA 1 97 TYR QD . . 6.500 6.521 6.387 6.583 0.083 5 0 "[ . 1 . 2]" 1
773 1 57 ASP HB2 1 90 ALA MB . . 6.500 3.507 3.007 4.265 . 0 0 "[ . 1 . 2]" 1
774 1 57 ASP HB2 1 93 LYS H . . 6.500 5.845 4.468 6.455 . 0 0 "[ . 1 . 2]" 1
775 1 57 ASP HB3 1 58 GLN H . . 6.500 2.976 2.773 4.123 . 0 0 "[ . 1 . 2]" 1
776 1 57 ASP HB3 1 59 ILE H . . 6.500 5.631 4.902 6.586 0.086 12 0 "[ . 1 . 2]" 1
777 1 57 ASP HB3 1 90 ALA MB . . 6.500 2.559 1.898 3.954 . 0 0 "[ . 1 . 2]" 1
778 1 57 ASP HB3 1 91 GLN H . . 6.500 3.294 2.457 4.374 . 0 0 "[ . 1 . 2]" 1
779 1 57 ASP HB3 1 92 TYR H . . 6.500 6.126 5.366 6.544 0.044 14 0 "[ . 1 . 2]" 1
780 1 58 GLN H 1 59 ILE H . . 6.500 4.459 4.265 4.523 . 0 0 "[ . 1 . 2]" 1
781 1 58 GLN H 1 59 ILE HA . . 6.500 5.001 4.917 5.084 . 0 0 "[ . 1 . 2]" 1
782 1 58 GLN H 1 59 ILE MG . . 6.500 6.504 6.380 6.572 0.072 9 0 "[ . 1 . 2]" 1
783 1 58 GLN H 1 60 LEU MD1 . . 6.500 5.341 4.121 6.456 . 0 0 "[ . 1 . 2]" 1
784 1 58 GLN H 1 90 ALA HA . . 6.500 3.633 3.058 4.327 . 0 0 "[ . 1 . 2]" 1
785 1 58 GLN H 1 90 ALA MB . . 6.500 4.081 2.388 4.956 . 0 0 "[ . 1 . 2]" 1
786 1 58 GLN H 1 91 GLN H . . 6.500 2.271 1.897 2.710 . 0 0 "[ . 1 . 2]" 1
787 1 58 GLN H 1 91 GLN QB . . 6.500 3.589 2.832 4.497 . 0 0 "[ . 1 . 2]" 1
788 1 58 GLN H 1 92 TYR H . . 6.500 5.234 4.677 5.681 . 0 0 "[ . 1 . 2]" 1
789 1 58 GLN H 1 92 TYR HA . . 6.500 4.652 4.126 5.019 . 0 0 "[ . 1 . 2]" 1
790 1 58 GLN H 1 92 TYR QD . . 6.500 6.280 5.288 6.524 0.024 17 0 "[ . 1 . 2]" 1
791 1 58 GLN H 1 93 LYS H . . 6.500 4.206 3.587 4.513 . 0 0 "[ . 1 . 2]" 1
792 1 58 GLN H 1 93 LYS HB2 . . 6.500 3.750 3.336 4.274 . 0 0 "[ . 1 . 2]" 1
793 1 58 GLN HA 1 59 ILE H . . 6.500 2.208 2.139 2.242 . 0 0 "[ . 1 . 2]" 1
794 1 58 GLN HA 1 60 LEU H . . 6.500 5.899 5.576 6.030 . 0 0 "[ . 1 . 2]" 1
795 1 58 GLN HA 1 93 LYS H . . 6.500 6.150 5.743 6.476 . 0 0 "[ . 1 . 2]" 1
796 1 58 GLN HA 1 97 TYR HB3 . . 6.500 6.506 6.176 6.567 0.067 12 0 "[ . 1 . 2]" 1
797 1 58 GLN HB2 1 59 ILE H . . 6.500 3.341 2.873 4.302 . 0 0 "[ . 1 . 2]" 1
798 1 58 GLN HB2 1 60 LEU H . . 6.500 5.853 5.014 6.623 0.123 17 0 "[ . 1 . 2]" 1
799 1 58 GLN HB2 1 60 LEU MD1 . . 6.500 5.048 3.334 6.308 . 0 0 "[ . 1 . 2]" 1
800 1 58 GLN HB2 1 90 ALA HA . . 6.500 5.954 5.158 6.511 0.011 11 0 "[ . 1 . 2]" 1
801 1 58 GLN HB2 1 91 GLN H . . 6.500 5.010 4.541 5.431 . 0 0 "[ . 1 . 2]" 1
802 1 58 GLN HB2 1 93 LYS HB3 . . 6.500 4.150 2.390 5.467 . 0 0 "[ . 1 . 2]" 1
803 1 58 GLN HB3 1 59 ILE H . . 6.500 4.063 3.597 4.327 . 0 0 "[ . 1 . 2]" 1
804 1 58 GLN QG 1 59 ILE H . . 6.500 3.617 2.252 4.466 . 0 0 "[ . 1 . 2]" 1
805 1 58 GLN QG 1 60 LEU MD1 . . 6.500 3.542 2.207 6.026 . 0 0 "[ . 1 . 2]" 1
806 1 58 GLN QG 1 93 LYS HB2 . . 6.500 3.057 1.984 5.020 . 0 0 "[ . 1 . 2]" 1
807 1 59 ILE H 1 60 LEU H . . 6.500 4.417 4.306 4.528 . 0 0 "[ . 1 . 2]" 1
808 1 59 ILE H 1 60 LEU HA . . 6.500 5.129 5.024 5.381 . 0 0 "[ . 1 . 2]" 1
809 1 59 ILE H 1 60 LEU MD1 . . 6.500 5.567 4.130 6.504 0.004 19 0 "[ . 1 . 2]" 1
810 1 59 ILE H 1 60 LEU HG . . 6.500 5.367 4.978 6.115 . 0 0 "[ . 1 . 2]" 1
811 1 59 ILE H 1 61 SER H . . 6.500 6.198 5.950 6.517 0.017 8 0 "[ . 1 . 2]" 1
812 1 59 ILE H 1 67 LEU HB2 . . 6.500 5.880 5.288 6.549 0.049 20 0 "[ . 1 . 2]" 1
813 1 59 ILE HA 1 60 LEU H . . 6.500 2.148 2.141 2.155 . 0 0 "[ . 1 . 2]" 1
814 1 59 ILE HA 1 61 SER H . . 6.500 3.870 3.687 4.263 . 0 0 "[ . 1 . 2]" 1
815 1 59 ILE HA 1 88 ILE MG . . 6.500 4.060 2.848 5.540 . 0 0 "[ . 1 . 2]" 1
816 1 59 ILE HA 1 90 ALA H . . 6.500 5.407 5.110 5.576 . 0 0 "[ . 1 . 2]" 1
817 1 59 ILE HA 1 90 ALA HA . . 6.500 3.730 3.586 3.857 . 0 0 "[ . 1 . 2]" 1
818 1 59 ILE HA 1 90 ALA MB . . 6.500 4.669 2.531 5.157 . 0 0 "[ . 1 . 2]" 1
819 1 59 ILE HA 1 91 GLN H . . 6.500 4.926 4.430 5.350 . 0 0 "[ . 1 . 2]" 1
820 1 59 ILE HB 1 89 ILE H . . 6.500 6.129 5.406 6.539 0.039 3 0 "[ . 1 . 2]" 1
821 1 59 ILE HB 1 90 ALA HA . . 6.500 6.463 6.216 6.525 0.025 16 0 "[ . 1 . 2]" 1
822 1 59 ILE MD 1 79 LEU MD1 . . 6.500 5.190 3.712 6.517 0.017 20 0 "[ . 1 . 2]" 1
823 1 59 ILE MD 1 89 ILE HA . . 6.500 5.722 4.824 6.596 0.096 17 0 "[ . 1 . 2]" 1
824 1 59 ILE QG 1 88 ILE MD . . 6.500 4.206 2.196 5.618 . 0 0 "[ . 1 . 2]" 1
825 1 59 ILE QG 1 88 ILE MG . . 6.500 3.243 1.862 4.649 . 0 0 "[ . 1 . 2]" 1
826 1 59 ILE MG 1 60 LEU H . . 6.500 2.711 2.397 3.058 . 0 0 "[ . 1 . 2]" 1
827 1 59 ILE MG 1 61 SER H . . 6.500 2.750 2.281 3.112 . 0 0 "[ . 1 . 2]" 1
828 1 59 ILE MG 1 67 LEU HB2 . . 6.500 2.331 1.944 3.146 . 0 0 "[ . 1 . 2]" 1
829 1 59 ILE MG 1 88 ILE H . . 6.500 5.793 5.477 6.216 . 0 0 "[ . 1 . 2]" 1
830 1 59 ILE MG 1 89 ILE H . . 6.500 3.211 2.671 3.702 . 0 0 "[ . 1 . 2]" 1
831 1 59 ILE MG 1 90 ALA HA . . 6.500 5.177 4.770 5.475 . 0 0 "[ . 1 . 2]" 1
832 1 60 LEU H 1 61 SER H . . 6.500 2.234 2.033 2.530 . 0 0 "[ . 1 . 2]" 1
833 1 60 LEU H 1 61 SER HA . . 6.500 4.788 4.579 5.072 . 0 0 "[ . 1 . 2]" 1
834 1 60 LEU H 1 61 SER HB2 . . 6.500 5.534 5.098 6.324 . 0 0 "[ . 1 . 2]" 1
835 1 60 LEU H 1 62 VAL MG1 . . 6.500 5.917 4.789 6.647 0.147 17 0 "[ . 1 . 2]" 1
836 1 60 LEU H 1 88 ILE HA . . 6.500 5.371 4.980 6.064 . 0 0 "[ . 1 . 2]" 1
837 1 60 LEU H 1 88 ILE MG . . 6.500 4.640 3.163 5.827 . 0 0 "[ . 1 . 2]" 1
838 1 60 LEU H 1 89 ILE H . . 6.500 3.517 3.238 4.034 . 0 0 "[ . 1 . 2]" 1
839 1 60 LEU H 1 89 ILE HB . . 6.500 2.547 2.074 3.579 . 0 0 "[ . 1 . 2]" 1
840 1 60 LEU H 1 89 ILE HG12 . . 6.500 5.286 4.351 6.238 . 0 0 "[ . 1 . 2]" 1
841 1 60 LEU H 1 90 ALA H . . 6.500 5.445 4.884 5.679 . 0 0 "[ . 1 . 2]" 1
842 1 60 LEU H 1 90 ALA HA . . 6.500 4.634 3.611 4.912 . 0 0 "[ . 1 . 2]" 1
843 1 60 LEU H 1 90 ALA MB . . 6.500 5.590 3.569 5.971 . 0 0 "[ . 1 . 2]" 1
844 1 60 LEU H 1 91 GLN H . . 6.500 5.685 5.174 6.255 . 0 0 "[ . 1 . 2]" 1
845 1 60 LEU HA 1 61 SER H . . 6.500 3.527 3.497 3.566 . 0 0 "[ . 1 . 2]" 1
846 1 60 LEU HA 1 67 LEU H . . 6.500 3.990 3.713 4.316 . 0 0 "[ . 1 . 2]" 1
847 1 60 LEU HA 1 68 ARG H . . 6.500 4.558 4.150 5.127 . 0 0 "[ . 1 . 2]" 1
848 1 60 LEU QB 1 61 SER H . . 6.500 2.598 2.248 2.734 . 0 0 "[ . 1 . 2]" 1
849 1 60 LEU QB 1 89 ILE HB . . 6.500 2.201 1.972 2.958 . 0 0 "[ . 1 . 2]" 1
850 1 60 LEU QB 1 90 ALA H . . 6.500 5.706 4.969 6.196 . 0 0 "[ . 1 . 2]" 1
851 1 60 LEU MD1 1 61 SER H . . 6.500 4.130 3.362 4.622 . 0 0 "[ . 1 . 2]" 1
852 1 60 LEU MD1 1 91 GLN H . . 6.500 4.458 3.165 5.688 . 0 0 "[ . 1 . 2]" 1
853 1 60 LEU MD1 1 91 GLN HG3 . . 6.500 4.536 3.151 5.553 . 0 0 "[ . 1 . 2]" 1
854 1 60 LEU MD2 1 61 SER H . . 6.500 4.741 4.491 4.931 . 0 0 "[ . 1 . 2]" 1
855 1 60 LEU MD2 1 67 LEU H . . 6.500 5.650 4.593 6.518 0.018 1 0 "[ . 1 . 2]" 1
856 1 60 LEU MD2 1 91 GLN H . . 6.500 5.974 4.834 6.508 0.008 6 0 "[ . 1 . 2]" 1
857 1 60 LEU HG 1 61 SER H . . 6.500 4.657 4.262 4.927 . 0 0 "[ . 1 . 2]" 1
858 1 60 LEU HG 1 90 ALA HA . . 6.500 5.703 2.623 6.515 0.015 11 0 "[ . 1 . 2]" 1
859 1 60 LEU HG 1 91 GLN H . . 6.500 5.639 4.403 6.508 0.008 18 0 "[ . 1 . 2]" 1
860 1 61 SER H 1 62 VAL H . . 6.500 4.359 4.290 4.413 . 0 0 "[ . 1 . 2]" 1
861 1 61 SER H 1 62 VAL MG1 . . 6.500 4.760 3.766 5.836 . 0 0 "[ . 1 . 2]" 1
862 1 61 SER H 1 63 ASN H . . 6.500 6.439 6.239 6.578 0.078 10 0 "[ . 1 . 2]" 1
863 1 61 SER H 1 65 VAL MG2 . . 6.500 6.522 6.425 6.571 0.071 4 0 "[ . 1 . 2]" 1
864 1 61 SER H 1 66 ASP HA . . 6.500 4.588 4.447 4.774 . 0 0 "[ . 1 . 2]" 1
865 1 61 SER H 1 67 LEU H . . 6.500 4.087 3.873 4.359 . 0 0 "[ . 1 . 2]" 1
866 1 61 SER H 1 67 LEU HB2 . . 6.500 4.347 3.911 4.803 . 0 0 "[ . 1 . 2]" 1
867 1 61 SER H 1 67 LEU HB3 . . 6.500 5.982 5.370 6.531 0.031 19 0 "[ . 1 . 2]" 1
868 1 61 SER H 1 67 LEU MD1 . . 6.500 5.083 3.681 6.525 0.025 10 0 "[ . 1 . 2]" 1
869 1 61 SER H 1 88 ILE HA . . 6.500 4.304 3.882 4.981 . 0 0 "[ . 1 . 2]" 1
870 1 61 SER H 1 88 ILE QG . . 6.500 5.857 4.675 6.530 0.030 6 0 "[ . 1 . 2]" 1
871 1 61 SER H 1 89 ILE H . . 6.500 2.861 2.575 3.317 . 0 0 "[ . 1 . 2]" 1
872 1 61 SER H 1 89 ILE HB . . 6.500 2.596 2.288 3.177 . 0 0 "[ . 1 . 2]" 1
873 1 61 SER H 1 89 ILE HG13 . . 6.500 4.017 3.049 5.071 . 0 0 "[ . 1 . 2]" 1
874 1 61 SER H 1 90 ALA HA . . 6.500 6.345 5.431 6.564 0.064 12 0 "[ . 1 . 2]" 1
875 1 61 SER HA 1 62 VAL H . . 6.500 2.343 2.220 2.403 . 0 0 "[ . 1 . 2]" 1
876 1 61 SER HA 1 63 ASN H . . 6.500 6.051 5.863 6.219 . 0 0 "[ . 1 . 2]" 1
877 1 61 SER HA 1 65 VAL H . . 6.500 6.019 5.847 6.219 . 0 0 "[ . 1 . 2]" 1
878 1 61 SER HA 1 65 VAL HB . . 6.500 5.668 5.442 5.906 . 0 0 "[ . 1 . 2]" 1
879 1 61 SER HA 1 66 ASP H . . 6.500 4.683 4.579 4.879 . 0 0 "[ . 1 . 2]" 1
880 1 61 SER HA 1 66 ASP HA . . 6.500 2.067 1.974 2.278 . 0 0 "[ . 1 . 2]" 1
881 1 61 SER HA 1 67 LEU H . . 6.500 2.083 1.925 2.488 . 0 0 "[ . 1 . 2]" 1
882 1 61 SER HA 1 67 LEU HB2 . . 6.500 3.279 2.625 3.895 . 0 0 "[ . 1 . 2]" 1
883 1 61 SER HA 1 67 LEU HB3 . . 6.500 4.827 4.327 5.211 . 0 0 "[ . 1 . 2]" 1
884 1 61 SER HA 1 67 LEU MD2 . . 6.500 3.776 2.521 4.728 . 0 0 "[ . 1 . 2]" 1
885 1 61 SER HA 1 68 ARG H . . 6.500 4.653 4.265 4.922 . 0 0 "[ . 1 . 2]" 1
886 1 61 SER HB2 1 62 VAL H . . 6.500 3.221 2.490 3.677 . 0 0 "[ . 1 . 2]" 1
887 1 61 SER HB2 1 62 VAL HB . . 6.500 6.073 5.479 6.530 0.030 20 0 "[ . 1 . 2]" 1
888 1 61 SER HB2 1 64 GLY H . . 6.500 3.930 3.264 5.074 . 0 0 "[ . 1 . 2]" 1
889 1 61 SER HB2 1 65 VAL H . . 6.500 5.764 4.685 6.482 . 0 0 "[ . 1 . 2]" 1
890 1 61 SER HB2 1 66 ASP H . . 6.500 5.352 4.056 6.183 . 0 0 "[ . 1 . 2]" 1
891 1 61 SER HB2 1 66 ASP HA . . 6.500 3.336 1.992 4.089 . 0 0 "[ . 1 . 2]" 1
892 1 61 SER HB2 1 67 LEU H . . 6.500 4.562 3.379 5.227 . 0 0 "[ . 1 . 2]" 1
893 1 61 SER HB2 1 67 LEU MD2 . . 6.500 5.866 4.728 6.503 0.003 16 0 "[ . 1 . 2]" 1
894 1 61 SER HB2 1 88 ILE HA . . 6.500 5.194 4.166 6.464 . 0 0 "[ . 1 . 2]" 1
895 1 61 SER HB2 1 89 ILE H . . 6.500 4.708 3.773 5.849 . 0 0 "[ . 1 . 2]" 1
896 1 61 SER HB3 1 62 VAL H . . 6.500 3.127 2.603 3.937 . 0 0 "[ . 1 . 2]" 1
897 1 61 SER HB3 1 62 VAL HB . . 6.500 6.279 5.746 6.560 0.060 20 0 "[ . 1 . 2]" 1
898 1 61 SER HB3 1 64 GLY H . . 6.500 4.382 3.796 5.406 . 0 0 "[ . 1 . 2]" 1
899 1 61 SER HB3 1 65 VAL H . . 6.500 5.486 4.879 6.562 0.062 9 0 "[ . 1 . 2]" 1
900 1 61 SER HB3 1 66 ASP H . . 6.500 4.384 3.884 5.819 . 0 0 "[ . 1 . 2]" 1
901 1 61 SER HB3 1 66 ASP HA . . 6.500 2.373 1.996 3.599 . 0 0 "[ . 1 . 2]" 1
902 1 61 SER HB3 1 67 LEU H . . 6.500 3.864 3.408 4.600 . 0 0 "[ . 1 . 2]" 1
903 1 61 SER HB3 1 67 LEU MD2 . . 6.500 5.414 3.980 6.483 . 0 0 "[ . 1 . 2]" 1
904 1 61 SER HB3 1 68 ARG H . . 6.500 5.874 5.193 6.553 0.053 5 0 "[ . 1 . 2]" 1
905 1 61 SER HB3 1 88 ILE HA . . 6.500 6.048 5.203 6.562 0.062 9 0 "[ . 1 . 2]" 1
906 1 61 SER HB3 1 89 ILE H . . 6.500 5.535 4.287 5.957 . 0 0 "[ . 1 . 2]" 1
907 1 62 VAL H 1 63 ASN H . . 6.500 4.165 3.997 4.316 . 0 0 "[ . 1 . 2]" 1
908 1 62 VAL H 1 64 GLY H . . 6.500 3.613 3.344 3.873 . 0 0 "[ . 1 . 2]" 1
909 1 62 VAL H 1 65 VAL H . . 6.500 4.212 4.021 4.383 . 0 0 "[ . 1 . 2]" 1
910 1 62 VAL H 1 65 VAL HB . . 6.500 4.701 4.535 4.992 . 0 0 "[ . 1 . 2]" 1
911 1 62 VAL H 1 65 VAL MG2 . . 6.500 2.773 2.654 2.860 . 0 0 "[ . 1 . 2]" 1
912 1 62 VAL H 1 66 ASP H . . 6.500 4.800 4.728 4.865 . 0 0 "[ . 1 . 2]" 1
913 1 62 VAL H 1 66 ASP HA . . 6.500 3.369 3.233 3.478 . 0 0 "[ . 1 . 2]" 1
914 1 62 VAL H 1 67 LEU H . . 6.500 4.018 3.772 4.314 . 0 0 "[ . 1 . 2]" 1
915 1 62 VAL H 1 67 LEU HB3 . . 6.500 5.894 5.387 6.147 . 0 0 "[ . 1 . 2]" 1
916 1 62 VAL H 1 67 LEU MD1 . . 6.500 3.910 2.692 5.665 . 0 0 "[ . 1 . 2]" 1
917 1 62 VAL H 1 67 LEU MD2 . . 6.500 3.637 2.251 4.759 . 0 0 "[ . 1 . 2]" 1
918 1 62 VAL H 1 78 ALA MB . . 6.500 4.995 4.473 5.713 . 0 0 "[ . 1 . 2]" 1
919 1 62 VAL H 1 88 ILE HA . . 6.500 4.927 4.728 5.246 . 0 0 "[ . 1 . 2]" 1
920 1 62 VAL HA 1 63 ASN H . . 6.500 2.150 2.141 2.161 . 0 0 "[ . 1 . 2]" 1
921 1 62 VAL HA 1 64 GLY H . . 6.500 3.729 3.631 3.871 . 0 0 "[ . 1 . 2]" 1
922 1 62 VAL HA 1 65 VAL H . . 6.500 5.852 5.773 5.994 . 0 0 "[ . 1 . 2]" 1
923 1 62 VAL HA 1 89 ILE H . . 6.500 4.063 3.561 4.624 . 0 0 "[ . 1 . 2]" 1
924 1 62 VAL HB 1 63 ASN H . . 6.500 3.864 3.185 4.351 . 0 0 "[ . 1 . 2]" 1
925 1 62 VAL HB 1 64 GLY H . . 6.500 5.330 4.999 5.676 . 0 0 "[ . 1 . 2]" 1
926 1 62 VAL HB 1 65 VAL H . . 6.500 6.066 4.900 6.584 0.084 16 0 "[ . 1 . 2]" 1
927 1 62 VAL HB 1 78 ALA MB . . 6.500 4.212 2.921 5.474 . 0 0 "[ . 1 . 2]" 1
928 1 62 VAL MG1 1 63 ASN H . . 6.500 3.773 2.430 4.205 . 0 0 "[ . 1 . 2]" 1
929 1 62 VAL MG1 1 63 ASN HA . . 6.500 5.266 4.073 5.795 . 0 0 "[ . 1 . 2]" 1
930 1 62 VAL MG1 1 64 GLY H . . 6.500 4.818 4.345 5.343 . 0 0 "[ . 1 . 2]" 1
931 1 62 VAL MG1 1 65 VAL H . . 6.500 5.209 3.922 6.367 . 0 0 "[ . 1 . 2]" 1
932 1 62 VAL MG1 1 65 VAL HB . . 6.500 5.239 3.633 6.442 . 0 0 "[ . 1 . 2]" 1
933 1 62 VAL MG1 1 78 ALA MB . . 6.500 3.297 1.921 4.773 . 0 0 "[ . 1 . 2]" 1
934 1 62 VAL MG1 1 79 LEU HA . . 6.500 4.075 2.326 5.086 . 0 0 "[ . 1 . 2]" 1
935 1 63 ASN H 1 64 GLY H . . 6.500 2.822 2.706 2.885 . 0 0 "[ . 1 . 2]" 1
936 1 63 ASN H 1 64 GLY HA2 . . 6.500 5.218 5.108 5.276 . 0 0 "[ . 1 . 2]" 1
937 1 63 ASN H 1 65 VAL H . . 6.500 5.437 5.300 5.534 . 0 0 "[ . 1 . 2]" 1
938 1 63 ASN H 1 65 VAL MG2 . . 6.500 4.731 4.677 4.869 . 0 0 "[ . 1 . 2]" 1
939 1 63 ASN H 1 82 ALA MB . . 6.500 5.220 4.361 6.249 . 0 0 "[ . 1 . 2]" 1
940 1 63 ASN H 1 87 THR H . . 6.500 2.913 2.334 3.587 . 0 0 "[ . 1 . 2]" 1
941 1 63 ASN H 1 87 THR HB . . 6.500 3.201 2.481 4.534 . 0 0 "[ . 1 . 2]" 1
942 1 63 ASN H 1 88 ILE HA . . 6.500 3.707 3.383 3.983 . 0 0 "[ . 1 . 2]" 1
943 1 63 ASN H 1 89 ILE H . . 6.500 5.443 5.155 5.746 . 0 0 "[ . 1 . 2]" 1
944 1 63 ASN HA 1 64 GLY H . . 6.500 2.889 2.857 2.920 . 0 0 "[ . 1 . 2]" 1
945 1 63 ASN HA 1 65 VAL H . . 6.500 5.159 5.064 5.339 . 0 0 "[ . 1 . 2]" 1
946 1 63 ASN HA 1 87 THR HB . . 6.500 3.254 2.362 4.837 . 0 0 "[ . 1 . 2]" 1
947 1 63 ASN HB2 1 64 GLY H . . 6.500 4.446 4.198 4.523 . 0 0 "[ . 1 . 2]" 1
948 1 63 ASN HB2 1 65 VAL H . . 6.500 5.049 4.530 5.579 . 0 0 "[ . 1 . 2]" 1
949 1 63 ASN HB2 1 85 THR H . . 6.500 6.231 5.387 6.605 0.105 15 0 "[ . 1 . 2]" 1
950 1 63 ASN HB2 1 86 VAL QG . . 6.500 4.302 2.773 5.521 . 0 0 "[ . 1 . 2]" 1
951 1 63 ASN HB2 1 87 THR H . . 6.500 3.768 2.748 4.686 . 0 0 "[ . 1 . 2]" 1
952 1 63 ASN HB3 1 64 GLY H . . 6.500 4.419 4.103 4.622 . 0 0 "[ . 1 . 2]" 1
953 1 63 ASN HB3 1 65 VAL H . . 6.500 5.015 4.010 5.745 . 0 0 "[ . 1 . 2]" 1
954 1 63 ASN HB3 1 85 THR H . . 6.500 6.285 5.593 6.559 0.059 4 0 "[ . 1 . 2]" 1
955 1 63 ASN HB3 1 87 THR H . . 6.500 3.777 2.698 5.017 . 0 0 "[ . 1 . 2]" 1
956 1 64 GLY H 1 65 VAL H . . 6.500 3.572 3.482 3.651 . 0 0 "[ . 1 . 2]" 1
957 1 64 GLY H 1 65 VAL HA . . 6.500 5.443 5.376 5.504 . 0 0 "[ . 1 . 2]" 1
958 1 64 GLY H 1 65 VAL HB . . 6.500 6.446 6.344 6.543 0.043 7 0 "[ . 1 . 2]" 1
959 1 64 GLY H 1 65 VAL MG2 . . 6.500 4.081 4.015 4.153 . 0 0 "[ . 1 . 2]" 1
960 1 64 GLY H 1 88 ILE HA . . 6.500 5.452 4.852 5.858 . 0 0 "[ . 1 . 2]" 1
961 1 64 GLY H 1 89 ILE H . . 6.500 6.398 6.166 6.585 0.085 17 0 "[ . 1 . 2]" 1
962 1 64 GLY H 1 89 ILE MD . . 6.500 4.934 3.886 6.048 . 0 0 "[ . 1 . 2]" 1
963 1 64 GLY HA2 1 65 VAL H . . 6.500 3.557 3.545 3.564 . 0 0 "[ . 1 . 2]" 1
964 1 64 GLY HA3 1 65 VAL H . . 6.500 2.453 2.399 2.485 . 0 0 "[ . 1 . 2]" 1
965 1 65 VAL H 1 66 ASP H . . 6.500 4.555 4.505 4.614 . 0 0 "[ . 1 . 2]" 1
966 1 65 VAL H 1 67 LEU MD2 . . 6.500 5.693 4.770 6.588 0.088 20 0 "[ . 1 . 2]" 1
967 1 65 VAL H 1 78 ALA MB . . 6.500 4.957 4.427 5.857 . 0 0 "[ . 1 . 2]" 1
968 1 65 VAL HA 1 66 ASP H . . 6.500 2.161 2.141 2.207 . 0 0 "[ . 1 . 2]" 1
969 1 65 VAL HA 1 66 ASP HB2 . . 6.500 5.249 4.316 5.698 . 0 0 "[ . 1 . 2]" 1
970 1 65 VAL HA 1 66 ASP HB3 . . 6.500 4.951 4.385 5.683 . 0 0 "[ . 1 . 2]" 1
971 1 65 VAL HB 1 66 ASP H . . 6.500 3.214 2.945 3.400 . 0 0 "[ . 1 . 2]" 1
972 1 65 VAL MG1 1 66 ASP H . . 6.500 3.801 3.707 3.981 . 0 0 "[ . 1 . 2]" 1
973 1 65 VAL MG1 1 78 ALA MB . . 6.500 3.386 2.921 4.055 . 0 0 "[ . 1 . 2]" 1
974 1 65 VAL MG2 1 66 ASP H . . 6.500 4.056 3.860 4.186 . 0 0 "[ . 1 . 2]" 1
975 1 65 VAL MG2 1 67 LEU HB2 . . 6.500 5.412 4.879 5.982 . 0 0 "[ . 1 . 2]" 1
976 1 66 ASP H 1 67 LEU H . . 6.500 4.567 4.464 4.606 . 0 0 "[ . 1 . 2]" 1
977 1 66 ASP H 1 67 LEU MD2 . . 6.500 4.969 3.839 6.505 0.005 20 0 "[ . 1 . 2]" 1
978 1 66 ASP H 1 68 ARG H . . 6.500 5.277 5.073 5.509 . 0 0 "[ . 1 . 2]" 1
979 1 66 ASP HA 1 67 LEU H . . 6.500 2.197 2.142 2.259 . 0 0 "[ . 1 . 2]" 1
980 1 66 ASP HA 1 67 LEU HB2 . . 6.500 4.409 4.136 4.791 . 0 0 "[ . 1 . 2]" 1
981 1 66 ASP HA 1 68 ARG H . . 6.500 3.888 3.754 4.040 . 0 0 "[ . 1 . 2]" 1
982 1 66 ASP HB2 1 67 LEU H . . 6.500 3.475 2.833 4.372 . 0 0 "[ . 1 . 2]" 1
983 1 66 ASP HB3 1 67 LEU H . . 6.500 3.749 2.864 4.300 . 0 0 "[ . 1 . 2]" 1
984 1 66 ASP HB3 1 68 ARG H . . 6.500 3.783 2.448 4.554 . 0 0 "[ . 1 . 2]" 1
985 1 67 LEU H 1 68 ARG H . . 6.500 2.656 2.368 2.923 . 0 0 "[ . 1 . 2]" 1
986 1 67 LEU H 1 68 ARG HA . . 6.500 4.496 4.337 4.683 . 0 0 "[ . 1 . 2]" 1
987 1 67 LEU H 1 68 ARG HG2 . . 6.500 5.054 3.893 6.538 0.038 12 0 "[ . 1 . 2]" 1
988 1 67 LEU H 1 70 ALA H . . 6.500 5.469 5.385 5.568 . 0 0 "[ . 1 . 2]" 1
989 1 67 LEU H 1 70 ALA MB . . 6.500 4.565 4.511 4.620 . 0 0 "[ . 1 . 2]" 1
990 1 67 LEU H 1 89 ILE HB . . 6.500 6.516 6.351 6.596 0.096 4 0 "[ . 1 . 2]" 1
991 1 67 LEU HA 1 68 ARG H . . 6.500 2.929 2.850 3.004 . 0 0 "[ . 1 . 2]" 1
992 1 67 LEU HA 1 69 ASN H . . 6.500 3.636 3.463 3.988 . 0 0 "[ . 1 . 2]" 1
993 1 67 LEU HA 1 70 ALA H . . 6.500 3.172 3.033 3.373 . 0 0 "[ . 1 . 2]" 1
994 1 67 LEU HA 1 70 ALA MB . . 6.500 2.089 1.942 2.170 . 0 0 "[ . 1 . 2]" 1
995 1 67 LEU HB2 1 69 ASN H . . 6.500 5.777 5.489 6.006 . 0 0 "[ . 1 . 2]" 1
996 1 67 LEU HB2 1 70 ALA H . . 6.500 5.198 4.793 5.531 . 0 0 "[ . 1 . 2]" 1
997 1 67 LEU HB2 1 70 ALA MB . . 6.500 3.966 3.695 4.137 . 0 0 "[ . 1 . 2]" 1
998 1 67 LEU HB2 1 75 ALA MB . . 6.500 4.650 4.350 5.147 . 0 0 "[ . 1 . 2]" 1
999 1 67 LEU HB2 1 78 ALA MB . . 6.500 5.952 4.664 6.515 0.015 11 0 "[ . 1 . 2]" 1
1000 1 67 LEU HB3 1 68 ARG H . . 6.500 4.368 4.221 4.520 . 0 0 "[ . 1 . 2]" 1
1001 1 67 LEU MD1 1 68 ARG H . . 6.500 5.069 4.211 5.610 . 0 0 "[ . 1 . 2]" 1
1002 1 67 LEU MD1 1 68 ARG HA . . 6.500 5.933 5.379 6.230 . 0 0 "[ . 1 . 2]" 1
1003 1 67 LEU MD1 1 68 ARG QB . . 6.500 6.293 5.728 6.583 0.083 12 0 "[ . 1 . 2]" 1
1004 1 67 LEU MD1 1 70 ALA H . . 6.500 4.983 3.521 5.833 . 0 0 "[ . 1 . 2]" 1
1005 1 67 LEU MD1 1 70 ALA MB . . 6.500 3.006 1.754 3.969 . 0 0 "[ . 1 . 2]" 1
1006 1 67 LEU MD1 1 75 ALA H . . 6.500 4.882 3.538 5.899 . 0 0 "[ . 1 . 2]" 1
1007 1 67 LEU MD1 1 75 ALA HA . . 6.500 2.978 1.885 3.781 . 0 0 "[ . 1 . 2]" 1
1008 1 67 LEU MD1 1 76 ALA H . . 6.500 5.535 4.625 6.524 0.024 1 0 "[ . 1 . 2]" 1
1009 1 67 LEU MD1 1 78 ALA H . . 6.500 5.041 4.277 5.836 . 0 0 "[ . 1 . 2]" 1
1010 1 67 LEU MD1 1 78 ALA MB . . 6.500 3.326 1.896 4.035 . 0 0 "[ . 1 . 2]" 1
1011 1 67 LEU MD1 1 79 LEU H . . 6.500 4.884 4.092 5.607 . 0 0 "[ . 1 . 2]" 1
1012 1 67 LEU MD2 1 75 ALA H . . 6.500 4.681 3.635 6.090 . 0 0 "[ . 1 . 2]" 1
1013 1 67 LEU MD2 1 75 ALA HA . . 6.500 2.691 1.900 3.958 . 0 0 "[ . 1 . 2]" 1
1014 1 67 LEU MD2 1 75 ALA MB . . 6.500 2.877 1.907 4.228 . 0 0 "[ . 1 . 2]" 1
1015 1 67 LEU MD2 1 78 ALA H . . 6.500 4.550 3.851 5.262 . 0 0 "[ . 1 . 2]" 1
1016 1 67 LEU MD2 1 78 ALA MB . . 6.500 2.775 2.070 3.815 . 0 0 "[ . 1 . 2]" 1
1017 1 67 LEU MD2 1 79 LEU H . . 6.500 4.706 3.455 5.526 . 0 0 "[ . 1 . 2]" 1
1018 1 68 ARG H 1 69 ASN H . . 6.500 2.537 2.505 2.615 . 0 0 "[ . 1 . 2]" 1
1019 1 68 ARG H 1 69 ASN HA . . 6.500 5.174 5.151 5.245 . 0 0 "[ . 1 . 2]" 1
1020 1 68 ARG H 1 69 ASN HB3 . . 6.500 5.938 5.092 6.279 . 0 0 "[ . 1 . 2]" 1
1021 1 68 ARG H 1 70 ALA H . . 6.500 3.894 3.774 4.015 . 0 0 "[ . 1 . 2]" 1
1022 1 68 ARG H 1 70 ALA MB . . 6.500 4.167 4.017 4.276 . 0 0 "[ . 1 . 2]" 1
1023 1 68 ARG HA 1 69 ASN H . . 6.500 3.519 3.501 3.557 . 0 0 "[ . 1 . 2]" 1
1024 1 68 ARG HA 1 70 ALA H . . 6.500 4.156 3.967 4.293 . 0 0 "[ . 1 . 2]" 1
1025 1 68 ARG QB 1 69 ASN H . . 6.500 3.178 2.375 3.499 . 0 0 "[ . 1 . 2]" 1
1026 1 68 ARG QD 1 69 ASN H . . 6.500 4.320 2.903 5.497 . 0 0 "[ . 1 . 2]" 1
1027 1 68 ARG HG3 1 69 ASN H . . 6.500 3.213 1.947 5.093 . 0 0 "[ . 1 . 2]" 1
1028 1 68 ARG HG3 1 70 ALA H . . 6.500 5.249 4.293 6.520 0.020 12 0 "[ . 1 . 2]" 1
1029 1 69 ASN H 1 70 ALA H . . 6.500 2.478 2.362 2.644 . 0 0 "[ . 1 . 2]" 1
1030 1 69 ASN H 1 70 ALA HA . . 6.500 4.494 4.408 4.646 . 0 0 "[ . 1 . 2]" 1
1031 1 69 ASN H 1 70 ALA MB . . 6.500 3.684 3.554 3.803 . 0 0 "[ . 1 . 2]" 1
1032 1 69 ASN HA 1 70 ALA H . . 6.500 2.948 2.941 2.955 . 0 0 "[ . 1 . 2]" 1
1033 1 69 ASN HA 1 70 ALA MB . . 6.500 4.681 4.653 4.691 . 0 0 "[ . 1 . 2]" 1
1034 1 69 ASN HB2 1 70 ALA H . . 6.500 4.210 4.075 4.541 . 0 0 "[ . 1 . 2]" 1
1035 1 69 ASN HB2 1 70 ALA MB . . 6.500 5.130 4.836 5.744 . 0 0 "[ . 1 . 2]" 1
1036 1 69 ASN HB3 1 70 ALA H . . 6.500 4.289 4.056 4.431 . 0 0 "[ . 1 . 2]" 1
1037 1 69 ASN HB3 1 71 SER H . . 6.500 5.998 5.823 6.331 . 0 0 "[ . 1 . 2]" 1
1038 1 70 ALA H 1 71 SER H . . 6.500 4.493 4.479 4.510 . 0 0 "[ . 1 . 2]" 1
1039 1 70 ALA H 1 75 ALA H . . 6.500 6.526 6.436 6.580 0.080 17 0 "[ . 1 . 2]" 1
1040 1 70 ALA HA 1 71 SER H . . 6.500 2.156 2.154 2.163 . 0 0 "[ . 1 . 2]" 1
1041 1 70 ALA MB 1 71 SER H . . 6.500 3.072 3.033 3.121 . 0 0 "[ . 1 . 2]" 1
1042 1 70 ALA MB 1 72 HIS H . . 6.500 5.704 5.663 5.725 . 0 0 "[ . 1 . 2]" 1
1043 1 70 ALA MB 1 74 GLN H . . 6.500 4.754 4.529 5.023 . 0 0 "[ . 1 . 2]" 1
1044 1 70 ALA MB 1 74 GLN HB2 . . 6.500 3.381 2.458 4.328 . 0 0 "[ . 1 . 2]" 1
1045 1 70 ALA MB 1 74 GLN HB3 . . 6.500 2.606 2.009 3.160 . 0 0 "[ . 1 . 2]" 1
1046 1 70 ALA MB 1 74 GLN HG3 . . 6.500 3.861 1.954 5.080 . 0 0 "[ . 1 . 2]" 1
1047 1 70 ALA MB 1 75 ALA H . . 6.500 3.365 3.239 3.476 . 0 0 "[ . 1 . 2]" 1
1048 1 70 ALA MB 1 75 ALA HA . . 6.500 3.069 2.847 3.455 . 0 0 "[ . 1 . 2]" 1
1049 1 71 SER H 1 72 HIS H . . 6.500 4.593 4.568 4.626 . 0 0 "[ . 1 . 2]" 1
1050 1 71 SER H 1 73 GLU H . . 6.500 5.667 5.447 5.752 . 0 0 "[ . 1 . 2]" 1
1051 1 71 SER H 1 73 GLU QG . . 6.500 5.256 4.951 6.532 0.032 5 0 "[ . 1 . 2]" 1
1052 1 71 SER H 1 74 GLN H . . 6.500 4.074 3.761 4.236 . 0 0 "[ . 1 . 2]" 1
1053 1 71 SER H 1 74 GLN HA . . 6.500 5.031 4.660 5.221 . 0 0 "[ . 1 . 2]" 1
1054 1 71 SER H 1 74 GLN HB2 . . 6.500 2.415 2.094 3.209 . 0 0 "[ . 1 . 2]" 1
1055 1 71 SER H 1 74 GLN HB3 . . 6.500 2.826 2.108 3.309 . 0 0 "[ . 1 . 2]" 1
1056 1 71 SER H 1 74 GLN HG3 . . 6.500 3.142 1.953 4.111 . 0 0 "[ . 1 . 2]" 1
1057 1 71 SER HA 1 72 HIS H . . 6.500 2.541 2.447 2.562 . 0 0 "[ . 1 . 2]" 1
1058 1 71 SER HA 1 72 HIS HB2 . . 6.500 4.661 4.524 4.799 . 0 0 "[ . 1 . 2]" 1
1059 1 71 SER HA 1 73 GLU H . . 6.500 4.844 4.768 4.880 . 0 0 "[ . 1 . 2]" 1
1060 1 71 SER HA 1 74 GLN H . . 6.500 4.597 4.513 4.711 . 0 0 "[ . 1 . 2]" 1
1061 1 71 SER HA 1 75 ALA H . . 6.500 5.164 5.013 5.334 . 0 0 "[ . 1 . 2]" 1
1062 1 71 SER HB2 1 72 HIS H . . 6.500 2.850 2.365 3.692 . 0 0 "[ . 1 . 2]" 1
1063 1 71 SER HB2 1 73 GLU H . . 6.500 4.191 3.772 4.880 . 0 0 "[ . 1 . 2]" 1
1064 1 71 SER HB2 1 73 GLU QG . . 6.500 3.957 3.663 4.832 . 0 0 "[ . 1 . 2]" 1
1065 1 71 SER HB2 1 75 ALA H . . 6.500 5.679 5.420 6.013 . 0 0 "[ . 1 . 2]" 1
1066 1 71 SER HB3 1 72 HIS H . . 6.500 3.650 3.213 3.951 . 0 0 "[ . 1 . 2]" 1
1067 1 71 SER HB3 1 73 GLU H . . 6.500 4.401 3.448 4.837 . 0 0 "[ . 1 . 2]" 1
1068 1 71 SER HB3 1 74 GLN H . . 6.500 3.348 2.307 3.878 . 0 0 "[ . 1 . 2]" 1
1069 1 71 SER HB3 1 75 ALA H . . 6.500 5.048 4.072 5.497 . 0 0 "[ . 1 . 2]" 1
1070 1 72 HIS H 1 72 HIS HD2 . . 6.500 4.918 4.842 5.157 . 0 0 "[ . 1 . 2]" 1
1071 1 72 HIS H 1 73 GLU H . . 6.500 2.824 2.781 2.894 . 0 0 "[ . 1 . 2]" 1
1072 1 72 HIS H 1 73 GLU HB2 . . 6.500 6.313 5.359 6.472 . 0 0 "[ . 1 . 2]" 1
1073 1 72 HIS H 1 73 GLU HB3 . . 6.500 5.468 5.298 6.467 . 0 0 "[ . 1 . 2]" 1
1074 1 72 HIS H 1 73 GLU QG . . 6.500 3.952 3.828 4.230 . 0 0 "[ . 1 . 2]" 1
1075 1 72 HIS H 1 74 GLN H . . 6.500 3.872 3.836 3.917 . 0 0 "[ . 1 . 2]" 1
1076 1 72 HIS H 1 74 GLN HA . . 6.500 6.573 6.543 6.607 0.107 2 0 "[ . 1 . 2]" 1
1077 1 72 HIS H 1 75 ALA H . . 6.500 4.882 4.728 5.014 . 0 0 "[ . 1 . 2]" 1
1078 1 72 HIS H 1 75 ALA MB . . 6.500 5.164 4.997 5.365 . 0 0 "[ . 1 . 2]" 1
1079 1 72 HIS HA 1 73 GLU H . . 6.500 3.567 3.567 3.569 . 0 0 "[ . 1 . 2]" 1
1080 1 72 HIS HA 1 74 GLN H . . 6.500 4.502 4.356 4.633 . 0 0 "[ . 1 . 2]" 1
1081 1 72 HIS HA 1 75 ALA H . . 6.500 3.975 3.889 4.010 . 0 0 "[ . 1 . 2]" 1
1082 1 72 HIS HA 1 75 ALA MB . . 6.500 3.440 3.322 3.603 . 0 0 "[ . 1 . 2]" 1
1083 1 72 HIS HB2 1 73 GLU H . . 6.500 3.652 3.511 3.777 . 0 0 "[ . 1 . 2]" 1
1084 1 72 HIS HB2 1 74 GLN H . . 6.500 5.551 5.409 5.694 . 0 0 "[ . 1 . 2]" 1
1085 1 72 HIS HB3 1 73 GLU H . . 6.500 2.291 2.253 2.345 . 0 0 "[ . 1 . 2]" 1
1086 1 72 HIS HB3 1 74 GLN H . . 6.500 4.627 4.603 4.665 . 0 0 "[ . 1 . 2]" 1
1087 1 72 HIS HB3 1 76 ALA H . . 6.500 6.478 6.359 6.524 0.024 17 0 "[ . 1 . 2]" 1
1088 1 72 HIS HD2 1 76 ALA MB . . 6.500 4.859 4.482 5.443 . 0 0 "[ . 1 . 2]" 1
1089 1 73 GLU H 1 74 GLN H . . 6.500 2.514 2.491 2.574 . 0 0 "[ . 1 . 2]" 1
1090 1 73 GLU H 1 74 GLN HG3 . . 6.500 6.014 5.102 6.577 0.077 15 0 "[ . 1 . 2]" 1
1091 1 73 GLU H 1 75 ALA H . . 6.500 4.271 4.137 4.403 . 0 0 "[ . 1 . 2]" 1
1092 1 73 GLU H 1 75 ALA MB . . 6.500 5.028 4.856 5.178 . 0 0 "[ . 1 . 2]" 1
1093 1 73 GLU H 1 76 ALA MB . . 6.500 5.130 5.002 5.339 . 0 0 "[ . 1 . 2]" 1
1094 1 73 GLU H 1 77 ILE H . . 6.500 6.525 6.508 6.551 0.051 1 0 "[ . 1 . 2]" 1
1095 1 73 GLU HA 1 74 GLN H . . 6.500 3.506 3.497 3.521 . 0 0 "[ . 1 . 2]" 1
1096 1 73 GLU HA 1 76 ALA MB . . 6.500 2.762 2.623 2.940 . 0 0 "[ . 1 . 2]" 1
1097 1 73 GLU HB2 1 74 GLN H . . 6.500 3.739 2.823 3.900 . 0 0 "[ . 1 . 2]" 1
1098 1 73 GLU HB2 1 76 ALA H . . 6.500 5.017 4.916 5.305 . 0 0 "[ . 1 . 2]" 1
1099 1 73 GLU HB3 1 74 GLN H . . 6.500 4.019 3.921 4.077 . 0 0 "[ . 1 . 2]" 1
1100 1 73 GLU HB3 1 75 ALA H . . 6.500 5.880 5.690 5.975 . 0 0 "[ . 1 . 2]" 1
1101 1 73 GLU HB3 1 76 ALA H . . 6.500 5.596 4.975 5.709 . 0 0 "[ . 1 . 2]" 1
1102 1 73 GLU HB3 1 77 ILE H . . 6.500 6.378 5.244 6.496 . 0 0 "[ . 1 . 2]" 1
1103 1 73 GLU QG 1 74 GLN H . . 6.500 2.232 1.930 3.731 . 0 0 "[ . 1 . 2]" 1
1104 1 73 GLU QG 1 75 ALA H . . 6.500 4.573 4.429 5.508 . 0 0 "[ . 1 . 2]" 1
1105 1 73 GLU QG 1 76 ALA H . . 6.500 5.186 5.041 5.534 . 0 0 "[ . 1 . 2]" 1
1106 1 73 GLU QG 1 77 ILE H . . 6.500 5.409 5.042 6.495 . 0 0 "[ . 1 . 2]" 1
1107 1 73 GLU QG 1 77 ILE MD . . 6.500 3.593 2.927 5.388 . 0 0 "[ . 1 . 2]" 1
1108 1 74 GLN H 1 75 ALA H . . 6.500 2.775 2.738 2.802 . 0 0 "[ . 1 . 2]" 1
1109 1 74 GLN H 1 75 ALA HA . . 6.500 5.357 5.322 5.379 . 0 0 "[ . 1 . 2]" 1
1110 1 74 GLN H 1 75 ALA MB . . 6.500 4.387 4.315 4.444 . 0 0 "[ . 1 . 2]" 1
1111 1 74 GLN H 1 76 ALA MB . . 6.500 4.894 4.784 5.094 . 0 0 "[ . 1 . 2]" 1
1112 1 74 GLN H 1 77 ILE H . . 6.500 4.952 4.923 5.052 . 0 0 "[ . 1 . 2]" 1
1113 1 74 GLN H 1 77 ILE MG . . 6.500 6.500 6.150 6.548 0.048 8 0 "[ . 1 . 2]" 1
1114 1 74 GLN HA 1 76 ALA H . . 6.500 4.291 4.170 4.561 . 0 0 "[ . 1 . 2]" 1
1115 1 74 GLN HA 1 77 ILE H . . 6.500 3.402 3.310 3.584 . 0 0 "[ . 1 . 2]" 1
1116 1 74 GLN HB2 1 75 ALA H . . 6.500 3.138 2.607 4.069 . 0 0 "[ . 1 . 2]" 1
1117 1 74 GLN HB2 1 75 ALA HA . . 6.500 4.938 4.422 5.611 . 0 0 "[ . 1 . 2]" 1
1118 1 74 GLN HG3 1 75 ALA H . . 6.500 4.662 3.198 5.262 . 0 0 "[ . 1 . 2]" 1
1119 1 74 GLN HG3 1 75 ALA HA . . 6.500 5.779 3.237 6.504 0.004 10 0 "[ . 1 . 2]" 1
1120 1 75 ALA H 1 76 ALA H . . 6.500 2.708 2.605 2.751 . 0 0 "[ . 1 . 2]" 1
1121 1 75 ALA H 1 76 ALA MB . . 6.500 4.313 4.200 4.383 . 0 0 "[ . 1 . 2]" 1
1122 1 75 ALA H 1 77 ILE HB . . 6.500 5.350 4.936 5.459 . 0 0 "[ . 1 . 2]" 1
1123 1 75 ALA H 1 77 ILE HG12 . . 6.500 6.522 6.507 6.598 0.098 20 0 "[ . 1 . 2]" 1
1124 1 75 ALA H 1 78 ALA H . . 6.500 5.184 4.816 5.305 . 0 0 "[ . 1 . 2]" 1
1125 1 75 ALA H 1 79 LEU H . . 6.500 6.357 6.086 6.520 0.020 1 0 "[ . 1 . 2]" 1
1126 1 75 ALA HA 1 76 ALA H . . 6.500 3.530 3.515 3.559 . 0 0 "[ . 1 . 2]" 1
1127 1 75 ALA HA 1 78 ALA H . . 6.500 3.631 3.394 3.744 . 0 0 "[ . 1 . 2]" 1
1128 1 75 ALA HA 1 78 ALA MB . . 6.500 3.222 2.745 3.504 . 0 0 "[ . 1 . 2]" 1
1129 1 75 ALA HA 1 79 LEU H . . 6.500 4.422 4.056 4.728 . 0 0 "[ . 1 . 2]" 1
1130 1 75 ALA MB 1 76 ALA H . . 6.500 2.641 2.507 2.755 . 0 0 "[ . 1 . 2]" 1
1131 1 75 ALA MB 1 78 ALA H . . 6.500 4.738 4.520 4.897 . 0 0 "[ . 1 . 2]" 1
1132 1 75 ALA MB 1 79 LEU HA . . 6.500 6.216 5.831 6.534 0.034 20 0 "[ . 1 . 2]" 1
1133 1 75 ALA MB 1 79 LEU HB3 . . 6.500 5.683 4.672 6.300 . 0 0 "[ . 1 . 2]" 1
1134 1 75 ALA MB 1 79 LEU HG . . 6.500 5.280 3.619 6.508 0.008 13 0 "[ . 1 . 2]" 1
1135 1 76 ALA H 1 77 ILE H . . 6.500 2.618 2.565 2.694 . 0 0 "[ . 1 . 2]" 1
1136 1 76 ALA H 1 77 ILE HA . . 6.500 5.213 5.168 5.295 . 0 0 "[ . 1 . 2]" 1
1137 1 76 ALA H 1 77 ILE HB . . 6.500 4.922 4.624 5.005 . 0 0 "[ . 1 . 2]" 1
1138 1 76 ALA H 1 77 ILE HG12 . . 6.500 5.462 5.269 6.189 . 0 0 "[ . 1 . 2]" 1
1139 1 76 ALA H 1 78 ALA H . . 6.500 4.396 4.196 4.558 . 0 0 "[ . 1 . 2]" 1
1140 1 76 ALA H 1 79 LEU H . . 6.500 4.865 4.691 5.041 . 0 0 "[ . 1 . 2]" 1
1141 1 76 ALA HA 1 77 ILE H . . 6.500 3.508 3.499 3.520 . 0 0 "[ . 1 . 2]" 1
1142 1 76 ALA HA 1 77 ILE HB . . 6.500 5.794 5.590 5.882 . 0 0 "[ . 1 . 2]" 1
1143 1 76 ALA HA 1 77 ILE MG . . 6.500 6.107 5.947 6.131 . 0 0 "[ . 1 . 2]" 1
1144 1 76 ALA HA 1 79 LEU H . . 6.500 3.391 3.235 3.678 . 0 0 "[ . 1 . 2]" 1
1145 1 76 ALA HA 1 79 LEU MD1 . . 6.500 3.457 1.933 5.309 . 0 0 "[ . 1 . 2]" 1
1146 1 76 ALA HA 1 81 ASN H . . 6.500 6.494 6.319 6.539 0.039 3 0 "[ . 1 . 2]" 1
1147 1 76 ALA MB 1 77 ILE H . . 6.500 2.775 2.715 2.853 . 0 0 "[ . 1 . 2]" 1
1148 1 76 ALA MB 1 77 ILE HB . . 6.500 4.891 4.495 4.962 . 0 0 "[ . 1 . 2]" 1
1149 1 76 ALA MB 1 77 ILE MG . . 6.500 5.012 4.954 5.139 . 0 0 "[ . 1 . 2]" 1
1150 1 76 ALA MB 1 78 ALA H . . 6.500 4.700 4.569 4.825 . 0 0 "[ . 1 . 2]" 1
1151 1 77 ILE H 1 78 ALA H . . 6.500 2.756 2.554 2.832 . 0 0 "[ . 1 . 2]" 1
1152 1 77 ILE H 1 78 ALA HA . . 6.500 5.349 5.181 5.401 . 0 0 "[ . 1 . 2]" 1
1153 1 77 ILE H 1 78 ALA MB . . 6.500 4.380 4.148 4.456 . 0 0 "[ . 1 . 2]" 1
1154 1 77 ILE H 1 79 LEU H . . 6.500 4.121 3.928 4.313 . 0 0 "[ . 1 . 2]" 1
1155 1 77 ILE H 1 80 LYS QB . . 6.500 5.006 4.440 6.026 . 0 0 "[ . 1 . 2]" 1
1156 1 77 ILE HA 1 78 ALA H . . 6.500 3.548 3.526 3.565 . 0 0 "[ . 1 . 2]" 1
1157 1 77 ILE HA 1 79 LEU H . . 6.500 4.550 4.336 4.799 . 0 0 "[ . 1 . 2]" 1
1158 1 77 ILE HA 1 80 LYS H . . 6.500 3.721 3.480 3.843 . 0 0 "[ . 1 . 2]" 1
1159 1 77 ILE HA 1 80 LYS QB . . 6.500 3.047 2.278 4.206 . 0 0 "[ . 1 . 2]" 1
1160 1 77 ILE HA 1 80 LYS QG . . 6.500 4.554 2.318 5.390 . 0 0 "[ . 1 . 2]" 1
1161 1 77 ILE HA 1 81 ASN H . . 6.500 4.579 4.125 5.152 . 0 0 "[ . 1 . 2]" 1
1162 1 77 ILE HB 1 78 ALA H . . 6.500 2.515 2.324 2.863 . 0 0 "[ . 1 . 2]" 1
1163 1 77 ILE HB 1 78 ALA MB . . 6.500 3.838 3.622 4.237 . 0 0 "[ . 1 . 2]" 1
1164 1 77 ILE HG12 1 78 ALA H . . 6.500 4.883 4.783 5.147 . 0 0 "[ . 1 . 2]" 1
1165 1 77 ILE HG13 1 78 ALA H . . 6.500 4.168 3.972 5.137 . 0 0 "[ . 1 . 2]" 1
1166 1 77 ILE HG13 1 80 LYS H . . 6.500 6.248 5.944 6.457 . 0 0 "[ . 1 . 2]" 1
1167 1 77 ILE MG 1 78 ALA H . . 6.500 3.392 2.837 3.669 . 0 0 "[ . 1 . 2]" 1
1168 1 77 ILE MG 1 78 ALA HA . . 6.500 3.481 2.967 3.779 . 0 0 "[ . 1 . 2]" 1
1169 1 77 ILE MG 1 80 LYS QE . . 6.500 4.435 2.060 6.507 0.007 13 0 "[ . 1 . 2]" 1
1170 1 78 ALA H 1 79 LEU H . . 6.500 2.604 2.538 2.726 . 0 0 "[ . 1 . 2]" 1
1171 1 78 ALA H 1 79 LEU MD1 . . 6.500 5.469 3.940 6.343 . 0 0 "[ . 1 . 2]" 1
1172 1 78 ALA H 1 80 LYS H . . 6.500 4.129 3.884 4.359 . 0 0 "[ . 1 . 2]" 1
1173 1 78 ALA H 1 80 LYS QB . . 6.500 5.012 4.547 6.085 . 0 0 "[ . 1 . 2]" 1
1174 1 78 ALA H 1 81 ASN HB2 . . 6.500 5.743 4.848 6.503 0.003 4 0 "[ . 1 . 2]" 1
1175 1 78 ALA H 1 82 ALA MB . . 6.500 6.396 5.708 6.531 0.031 20 0 "[ . 1 . 2]" 1
1176 1 78 ALA HA 1 79 LEU H . . 6.500 3.533 3.511 3.560 . 0 0 "[ . 1 . 2]" 1
1177 1 78 ALA HA 1 80 LYS H . . 6.500 4.319 4.082 4.482 . 0 0 "[ . 1 . 2]" 1
1178 1 78 ALA HA 1 81 ASN HB2 . . 6.500 3.443 2.652 4.901 . 0 0 "[ . 1 . 2]" 1
1179 1 78 ALA HA 1 82 ALA H . . 6.500 4.917 4.623 5.294 . 0 0 "[ . 1 . 2]" 1
1180 1 78 ALA MB 1 79 LEU H . . 6.500 2.643 2.484 2.807 . 0 0 "[ . 1 . 2]" 1
1181 1 78 ALA MB 1 79 LEU MD1 . . 6.500 4.507 2.887 5.389 . 0 0 "[ . 1 . 2]" 1
1182 1 79 LEU H 1 80 LYS H . . 6.500 2.684 2.495 2.781 . 0 0 "[ . 1 . 2]" 1
1183 1 79 LEU H 1 81 ASN H . . 6.500 4.138 3.933 4.399 . 0 0 "[ . 1 . 2]" 1
1184 1 79 LEU H 1 81 ASN HB2 . . 6.500 5.884 5.110 6.503 0.003 4 0 "[ . 1 . 2]" 1
1185 1 79 LEU H 1 82 ALA H . . 6.500 5.054 4.732 5.207 . 0 0 "[ . 1 . 2]" 1
1186 1 79 LEU HA 1 80 LYS H . . 6.500 3.526 3.497 3.554 . 0 0 "[ . 1 . 2]" 1
1187 1 79 LEU HA 1 81 ASN H . . 6.500 4.295 4.083 4.575 . 0 0 "[ . 1 . 2]" 1
1188 1 79 LEU HA 1 82 ALA H . . 6.500 3.572 3.314 3.896 . 0 0 "[ . 1 . 2]" 1
1189 1 79 LEU HA 1 82 ALA MB . . 6.500 2.350 1.959 2.696 . 0 0 "[ . 1 . 2]" 1
1190 1 79 LEU HA 1 83 GLY H . . 6.500 5.730 5.087 6.112 . 0 0 "[ . 1 . 2]" 1
1191 1 79 LEU HB2 1 80 LYS H . . 6.500 3.222 2.535 4.065 . 0 0 "[ . 1 . 2]" 1
1192 1 79 LEU HB3 1 81 ASN H . . 6.500 5.207 4.803 5.692 . 0 0 "[ . 1 . 2]" 1
1193 1 79 LEU MD1 1 80 LYS H . . 6.500 4.468 3.024 4.891 . 0 0 "[ . 1 . 2]" 1
1194 1 79 LEU HG 1 82 ALA H . . 6.500 5.776 4.600 6.575 0.075 2 0 "[ . 1 . 2]" 1
1195 1 80 LYS H 1 81 ASN HA . . 6.500 5.256 5.147 5.358 . 0 0 "[ . 1 . 2]" 1
1196 1 80 LYS H 1 81 ASN HB2 . . 6.500 4.990 4.429 5.483 . 0 0 "[ . 1 . 2]" 1
1197 1 80 LYS H 1 81 ASN HB3 . . 6.500 6.005 5.221 6.500 . 0 0 "[ . 1 . 2]" 1
1198 1 80 LYS H 1 82 ALA H . . 6.500 3.962 3.802 4.064 . 0 0 "[ . 1 . 2]" 1
1199 1 80 LYS H 1 82 ALA MB . . 6.500 4.520 4.231 4.644 . 0 0 "[ . 1 . 2]" 1
1200 1 80 LYS HA 1 81 ASN H . . 6.500 3.518 3.494 3.562 . 0 0 "[ . 1 . 2]" 1
1201 1 80 LYS HA 1 81 ASN HB2 . . 6.500 5.825 5.413 6.159 . 0 0 "[ . 1 . 2]" 1
1202 1 80 LYS HA 1 81 ASN HB3 . . 6.500 6.440 6.087 6.563 0.063 19 0 "[ . 1 . 2]" 1
1203 1 80 LYS HA 1 82 ALA H . . 6.500 3.735 3.572 3.929 . 0 0 "[ . 1 . 2]" 1
1204 1 80 LYS QB 1 81 ASN H . . 6.500 2.724 2.424 3.521 . 0 0 "[ . 1 . 2]" 1
1205 1 80 LYS QB 1 82 ALA H . . 6.500 4.474 4.271 4.660 . 0 0 "[ . 1 . 2]" 1
1206 1 80 LYS QD 1 81 ASN H . . 6.500 4.875 4.365 5.453 . 0 0 "[ . 1 . 2]" 1
1207 1 80 LYS QG 1 81 ASN H . . 6.500 3.830 2.240 4.412 . 0 0 "[ . 1 . 2]" 1
1208 1 80 LYS QG 1 82 ALA H . . 6.500 4.948 4.306 5.402 . 0 0 "[ . 1 . 2]" 1
1209 1 81 ASN H 1 82 ALA H . . 6.500 2.591 2.494 2.655 . 0 0 "[ . 1 . 2]" 1
1210 1 81 ASN HA 1 82 ALA H . . 6.500 3.063 3.056 3.071 . 0 0 "[ . 1 . 2]" 1
1211 1 81 ASN HA 1 82 ALA MB . . 6.500 4.631 4.554 4.703 . 0 0 "[ . 1 . 2]" 1
1212 1 81 ASN HA 1 83 GLY H . . 6.500 4.078 3.465 4.319 . 0 0 "[ . 1 . 2]" 1
1213 1 81 ASN HB2 1 82 ALA H . . 6.500 4.044 3.912 4.421 . 0 0 "[ . 1 . 2]" 1
1214 1 81 ASN HB3 1 82 ALA H . . 6.500 4.313 3.912 4.553 . 0 0 "[ . 1 . 2]" 1
1215 1 81 ASN HB3 1 82 ALA HA . . 6.500 4.927 4.442 5.389 . 0 0 "[ . 1 . 2]" 1
1216 1 81 ASN HB3 1 83 GLY H . . 6.500 5.767 5.296 5.988 . 0 0 "[ . 1 . 2]" 1
1217 1 82 ALA H 1 83 GLY H . . 6.500 2.892 2.530 3.032 . 0 0 "[ . 1 . 2]" 1
1218 1 82 ALA H 1 86 VAL QG . . 6.500 4.946 3.797 6.459 . 0 0 "[ . 1 . 2]" 1
1219 1 82 ALA HA 1 83 GLY H . . 6.500 3.566 3.517 3.577 . 0 0 "[ . 1 . 2]" 1
1220 1 82 ALA HA 1 86 VAL QG . . 6.500 4.633 2.326 5.883 . 0 0 "[ . 1 . 2]" 1
1221 1 82 ALA MB 1 83 GLY H . . 6.500 2.290 2.146 2.696 . 0 0 "[ . 1 . 2]" 1
1222 1 82 ALA MB 1 85 THR H . . 6.500 4.183 3.745 6.137 . 0 0 "[ . 1 . 2]" 1
1223 1 82 ALA MB 1 86 VAL H . . 6.500 4.763 3.888 5.829 . 0 0 "[ . 1 . 2]" 1
1224 1 82 ALA MB 1 86 VAL HA . . 6.500 3.273 2.336 4.575 . 0 0 "[ . 1 . 2]" 1
1225 1 82 ALA MB 1 86 VAL QG . . 6.500 2.597 1.674 3.694 . 0 0 "[ . 1 . 2]" 1
1226 1 82 ALA MB 1 87 THR H . . 6.500 4.510 3.500 6.056 . 0 0 "[ . 1 . 2]" 1
1227 1 83 GLY H 1 84 GLN H . . 6.500 4.414 4.346 4.516 . 0 0 "[ . 1 . 2]" 1
1228 1 83 GLY H 1 85 THR H . . 6.500 4.604 3.946 6.513 0.013 6 0 "[ . 1 . 2]" 1
1229 1 83 GLY H 1 86 VAL QG . . 6.500 4.620 3.085 5.906 . 0 0 "[ . 1 . 2]" 1
1230 1 83 GLY HA2 1 85 THR H . . 6.500 4.641 4.233 6.250 . 0 0 "[ . 1 . 2]" 1
1231 1 84 GLN H 1 85 THR H . . 6.500 2.621 2.120 4.562 . 0 0 "[ . 1 . 2]" 1
1232 1 84 GLN H 1 86 VAL H . . 6.500 6.371 5.199 6.680 0.180 4 0 "[ . 1 . 2]" 1
1233 1 84 GLN HA 1 85 THR H . . 6.500 3.088 2.195 3.561 . 0 0 "[ . 1 . 2]" 1
1234 1 84 GLN HB2 1 85 THR H . . 6.500 4.221 2.475 4.479 . 0 0 "[ . 1 . 2]" 1
1235 1 84 GLN HB3 1 85 THR H . . 6.500 4.236 2.817 4.622 . 0 0 "[ . 1 . 2]" 1
1236 1 84 GLN HG2 1 85 THR H . . 6.500 3.684 1.896 5.152 . 0 0 "[ . 1 . 2]" 1
1237 1 84 GLN HG3 1 85 THR H . . 6.500 4.373 3.020 5.285 . 0 0 "[ . 1 . 2]" 1
1238 1 85 THR H 1 86 VAL H . . 6.500 3.986 2.790 4.384 . 0 0 "[ . 1 . 2]" 1
1239 1 85 THR H 1 86 VAL HA . . 6.500 4.594 4.281 5.132 . 0 0 "[ . 1 . 2]" 1
1240 1 85 THR H 1 86 VAL QG . . 6.500 4.064 3.519 4.937 . 0 0 "[ . 1 . 2]" 1
1241 1 85 THR H 1 87 THR H . . 6.500 6.106 5.701 6.599 0.099 10 0 "[ . 1 . 2]" 1
1242 1 85 THR HA 1 86 VAL H . . 6.500 2.214 2.142 2.584 . 0 0 "[ . 1 . 2]" 1
1243 1 85 THR HA 1 87 THR H . . 6.500 5.700 5.445 5.965 . 0 0 "[ . 1 . 2]" 1
1244 1 85 THR HB 1 86 VAL H . . 6.500 4.044 3.128 4.508 . 0 0 "[ . 1 . 2]" 1
1245 1 85 THR HB 1 87 THR H . . 6.500 5.161 4.664 5.661 . 0 0 "[ . 1 . 2]" 1
1246 1 85 THR HB 1 87 THR HA . . 6.500 6.447 5.992 6.538 0.038 6 0 "[ . 1 . 2]" 1
1247 1 85 THR MG 1 86 VAL H . . 6.500 2.711 1.910 3.994 . 0 0 "[ . 1 . 2]" 1
1248 1 85 THR MG 1 87 THR H . . 6.500 4.270 3.857 4.888 . 0 0 "[ . 1 . 2]" 1
1249 1 85 THR MG 1 87 THR HA . . 6.500 4.433 3.955 4.739 . 0 0 "[ . 1 . 2]" 1
1250 1 85 THR MG 1 88 ILE H . . 6.500 6.139 5.330 6.511 0.011 14 0 "[ . 1 . 2]" 1
1251 1 86 VAL H 1 87 THR HA . . 6.500 5.034 4.776 5.289 . 0 0 "[ . 1 . 2]" 1
1252 1 86 VAL H 1 88 ILE H . . 6.500 6.374 5.661 6.604 0.104 14 0 "[ . 1 . 2]" 1
1253 1 86 VAL HA 1 87 THR H . . 6.500 2.147 2.141 2.153 . 0 0 "[ . 1 . 2]" 1
1254 1 86 VAL HB 1 87 THR H . . 6.500 4.285 3.594 4.371 . 0 0 "[ . 1 . 2]" 1
1255 1 86 VAL QG 1 87 THR H . . 6.500 2.851 2.460 3.648 . 0 0 "[ . 1 . 2]" 1
1256 1 86 VAL QG 1 87 THR HA . . 6.500 3.728 3.426 4.120 . 0 0 "[ . 1 . 2]" 1
1257 1 87 THR H 1 88 ILE H . . 6.500 4.133 4.009 4.400 . 0 0 "[ . 1 . 2]" 1
1258 1 87 THR HA 1 88 ILE H . . 6.500 2.171 2.145 2.178 . 0 0 "[ . 1 . 2]" 1
1259 1 87 THR HB 1 88 ILE H . . 6.500 4.125 3.666 4.434 . 0 0 "[ . 1 . 2]" 1
1260 1 87 THR HB 1 88 ILE HA . . 6.500 4.594 4.304 4.901 . 0 0 "[ . 1 . 2]" 1
1261 1 87 THR MG 1 88 ILE H . . 6.500 3.333 3.010 4.215 . 0 0 "[ . 1 . 2]" 1
1262 1 88 ILE H 1 89 ILE H . . 6.500 4.456 4.396 4.518 . 0 0 "[ . 1 . 2]" 1
1263 1 88 ILE H 1 89 ILE HA . . 6.500 4.997 4.831 5.131 . 0 0 "[ . 1 . 2]" 1
1264 1 88 ILE HA 1 89 ILE H . . 6.500 2.200 2.140 2.224 . 0 0 "[ . 1 . 2]" 1
1265 1 88 ILE HA 1 89 ILE HB . . 6.500 4.651 4.550 4.751 . 0 0 "[ . 1 . 2]" 1
1266 1 88 ILE HB 1 90 ALA H . . 6.500 5.690 5.315 6.155 . 0 0 "[ . 1 . 2]" 1
1267 1 88 ILE QG 1 89 ILE H . . 6.500 4.063 3.532 4.390 . 0 0 "[ . 1 . 2]" 1
1268 1 88 ILE QG 1 89 ILE HB . . 6.500 6.081 5.144 6.348 . 0 0 "[ . 1 . 2]" 1
1269 1 88 ILE QG 1 89 ILE MG . . 6.500 6.206 5.143 6.621 0.121 10 0 "[ . 1 . 2]" 1
1270 1 88 ILE MG 1 89 ILE H . . 6.500 3.035 2.065 4.060 . 0 0 "[ . 1 . 2]" 1
1271 1 88 ILE MG 1 89 ILE HA . . 6.500 4.701 3.509 5.652 . 0 0 "[ . 1 . 2]" 1
1272 1 88 ILE MG 1 90 ALA H . . 6.500 5.375 3.502 6.602 0.102 14 0 "[ . 1 . 2]" 1
1273 1 88 ILE MG 1 90 ALA HA . . 6.500 5.283 3.892 6.615 0.115 6 0 "[ . 1 . 2]" 1
1274 1 88 ILE MG 1 90 ALA MB . . 6.500 4.594 2.680 5.850 . 0 0 "[ . 1 . 2]" 1
1275 1 89 ILE H 1 90 ALA H . . 6.500 4.482 4.220 4.573 . 0 0 "[ . 1 . 2]" 1
1276 1 89 ILE H 1 90 ALA MB . . 6.500 5.189 4.426 5.395 . 0 0 "[ . 1 . 2]" 1
1277 1 89 ILE HA 1 90 ALA H . . 6.500 2.161 2.139 2.219 . 0 0 "[ . 1 . 2]" 1
1278 1 89 ILE HA 1 90 ALA MB . . 6.500 3.936 3.857 4.076 . 0 0 "[ . 1 . 2]" 1
1279 1 89 ILE HB 1 90 ALA H . . 6.500 4.180 3.955 4.339 . 0 0 "[ . 1 . 2]" 1
1280 1 89 ILE MD 1 90 ALA MB . . 6.500 5.932 4.987 6.273 . 0 0 "[ . 1 . 2]" 1
1281 1 89 ILE HG12 1 90 ALA H . . 6.500 4.730 4.236 5.390 . 0 0 "[ . 1 . 2]" 1
1282 1 89 ILE HG13 1 90 ALA H . . 6.500 4.756 4.037 5.409 . 0 0 "[ . 1 . 2]" 1
1283 1 89 ILE MG 1 90 ALA H . . 6.500 2.587 2.186 2.950 . 0 0 "[ . 1 . 2]" 1
1284 1 90 ALA H 1 91 GLN H . . 6.500 4.421 4.371 4.485 . 0 0 "[ . 1 . 2]" 1
1285 1 90 ALA HA 1 91 GLN H . . 6.500 2.193 2.159 2.443 . 0 0 "[ . 1 . 2]" 1
1286 1 90 ALA MB 1 91 GLN H . . 6.500 2.977 2.301 3.120 . 0 0 "[ . 1 . 2]" 1
1287 1 91 GLN H 1 92 TYR H . . 6.500 4.245 3.824 4.434 . 0 0 "[ . 1 . 2]" 1
1288 1 91 GLN H 1 92 TYR HB2 . . 6.500 6.223 5.621 6.506 0.006 5 0 "[ . 1 . 2]" 1
1289 1 91 GLN H 1 93 LYS HB2 . . 6.500 5.079 4.618 5.509 . 0 0 "[ . 1 . 2]" 1
1290 1 91 GLN HA 1 92 TYR H . . 6.500 2.178 2.139 2.269 . 0 0 "[ . 1 . 2]" 1
1291 1 91 GLN QB 1 92 TYR H . . 6.500 3.665 3.446 3.934 . 0 0 "[ . 1 . 2]" 1
1292 1 91 GLN QB 1 93 LYS H . . 6.500 5.189 4.909 5.367 . 0 0 "[ . 1 . 2]" 1
1293 1 91 GLN HG2 1 92 TYR H . . 6.500 2.784 2.055 4.350 . 0 0 "[ . 1 . 2]" 1
1294 1 91 GLN HG2 1 93 LYS H . . 6.500 5.368 4.790 6.531 0.031 8 0 "[ . 1 . 2]" 1
1295 1 91 GLN HG3 1 92 TYR H . . 6.500 3.485 2.835 4.150 . 0 0 "[ . 1 . 2]" 1
1296 1 92 TYR H 1 93 LYS H . . 6.500 4.409 4.391 4.423 . 0 0 "[ . 1 . 2]" 1
1297 1 92 TYR H 1 93 LYS HA . . 6.500 5.708 5.615 5.723 . 0 0 "[ . 1 . 2]" 1
1298 1 92 TYR H 1 93 LYS HD3 . . 6.500 5.893 5.271 6.428 . 0 0 "[ . 1 . 2]" 1
1299 1 92 TYR HA 1 93 LYS H . . 6.500 2.145 2.142 2.149 . 0 0 "[ . 1 . 2]" 1
1300 1 92 TYR HA 1 93 LYS HD2 . . 6.500 5.944 5.277 6.509 0.009 16 0 "[ . 1 . 2]" 1
1301 1 92 TYR HB2 1 93 LYS H . . 6.500 4.481 4.372 4.559 . 0 0 "[ . 1 . 2]" 1
1302 1 92 TYR HB3 1 93 LYS H . . 6.500 4.113 3.645 4.371 . 0 0 "[ . 1 . 2]" 1
1303 1 92 TYR QD 1 93 LYS H . . 6.500 3.665 3.131 4.441 . 0 0 "[ . 1 . 2]" 1
1304 1 92 TYR QD 1 94 PRO QD . . 6.500 3.171 2.887 4.220 . 0 0 "[ . 1 . 2]" 1
1305 1 93 LYS H 1 93 LYS HD2 . . 6.500 4.743 4.306 5.167 . 0 0 "[ . 1 . 2]" 1
1306 1 93 LYS H 1 94 PRO HA . . 6.500 4.256 4.234 4.298 . 0 0 "[ . 1 . 2]" 1
1307 1 93 LYS H 1 94 PRO HB3 . . 6.500 4.801 4.718 4.952 . 0 0 "[ . 1 . 2]" 1
1308 1 93 LYS H 1 94 PRO QD . . 6.500 2.664 2.542 2.871 . 0 0 "[ . 1 . 2]" 1
1309 1 93 LYS H 1 94 PRO HG2 . . 6.500 5.404 5.300 5.582 . 0 0 "[ . 1 . 2]" 1
1310 1 93 LYS H 1 95 GLU H . . 6.500 5.210 4.854 5.324 . 0 0 "[ . 1 . 2]" 1
1311 1 93 LYS HA 1 94 PRO QD . . 6.500 2.090 2.013 2.138 . 0 0 "[ . 1 . 2]" 1
1312 1 93 LYS HA 1 94 PRO HG2 . . 6.500 4.248 4.195 4.281 . 0 0 "[ . 1 . 2]" 1
1313 1 93 LYS HA 1 95 GLU H . . 6.500 3.398 3.056 3.555 . 0 0 "[ . 1 . 2]" 1
1314 1 93 LYS HA 1 96 GLU H . . 6.500 3.834 3.655 4.096 . 0 0 "[ . 1 . 2]" 1
1315 1 93 LYS HA 1 97 TYR H . . 6.500 5.003 4.705 5.257 . 0 0 "[ . 1 . 2]" 1
1316 1 93 LYS HB2 1 94 PRO QD . . 6.500 4.312 4.262 4.378 . 0 0 "[ . 1 . 2]" 1
1317 1 93 LYS HB2 1 95 GLU H . . 6.500 5.537 5.152 5.737 . 0 0 "[ . 1 . 2]" 1
1318 1 93 LYS HB2 1 97 TYR H . . 6.500 4.868 4.136 5.641 . 0 0 "[ . 1 . 2]" 1
1319 1 93 LYS HB3 1 95 GLU H . . 6.500 4.683 4.086 5.093 . 0 0 "[ . 1 . 2]" 1
1320 1 93 LYS HB3 1 98 SER H . . 6.500 6.027 5.759 6.486 . 0 0 "[ . 1 . 2]" 1
1321 1 93 LYS HD3 1 95 GLU H . . 6.500 5.915 4.869 6.424 . 0 0 "[ . 1 . 2]" 1
1322 1 94 PRO HA 1 95 GLU H . . 6.500 3.520 3.392 3.549 . 0 0 "[ . 1 . 2]" 1
1323 1 94 PRO HA 1 97 TYR H . . 6.500 3.677 3.442 3.866 . 0 0 "[ . 1 . 2]" 1
1324 1 94 PRO HA 1 97 TYR HB2 . . 6.500 4.361 4.054 4.648 . 0 0 "[ . 1 . 2]" 1
1325 1 94 PRO HA 1 97 TYR HB3 . . 6.500 2.856 2.540 3.277 . 0 0 "[ . 1 . 2]" 1
1326 1 94 PRO HB2 1 95 GLU H . . 6.500 3.347 3.182 3.786 . 0 0 "[ . 1 . 2]" 1
1327 1 94 PRO HB2 1 96 GLU H . . 6.500 5.473 5.317 5.993 . 0 0 "[ . 1 . 2]" 1
1328 1 94 PRO HB3 1 95 GLU H . . 6.500 4.148 4.053 4.404 . 0 0 "[ . 1 . 2]" 1
1329 1 94 PRO HB3 1 96 GLU H . . 6.500 6.069 5.890 6.535 0.035 4 0 "[ . 1 . 2]" 1
1330 1 94 PRO HB3 1 97 TYR H . . 6.500 5.881 5.688 6.042 . 0 0 "[ . 1 . 2]" 1
1331 1 94 PRO QD 1 95 GLU H . . 6.500 2.613 2.602 2.770 . 0 0 "[ . 1 . 2]" 1
1332 1 94 PRO QD 1 96 GLU H . . 6.500 4.303 4.116 4.768 . 0 0 "[ . 1 . 2]" 1
1333 1 94 PRO HG2 1 95 GLU H . . 6.500 2.391 2.190 3.025 . 0 0 "[ . 1 . 2]" 1
1334 1 94 PRO HG3 1 95 GLU H . . 6.500 3.897 3.749 4.373 . 0 0 "[ . 1 . 2]" 1
1335 1 95 GLU H 1 96 GLU H . . 6.500 2.605 2.470 2.699 . 0 0 "[ . 1 . 2]" 1
1336 1 95 GLU H 1 96 GLU HB3 . . 6.500 5.957 4.535 6.209 . 0 0 "[ . 1 . 2]" 1
1337 1 95 GLU H 1 96 GLU HG2 . . 6.500 5.271 3.863 6.556 0.056 6 0 "[ . 1 . 2]" 1
1338 1 95 GLU H 1 97 TYR H . . 6.500 4.180 3.697 4.273 . 0 0 "[ . 1 . 2]" 1
1339 1 95 GLU H 1 97 TYR HB2 . . 6.500 6.425 5.958 6.528 0.028 3 0 "[ . 1 . 2]" 1
1340 1 95 GLU H 1 98 SER H . . 6.500 4.516 4.303 4.628 . 0 0 "[ . 1 . 2]" 1
1341 1 95 GLU H 1 98 SER QB . . 6.500 4.445 4.310 4.637 . 0 0 "[ . 1 . 2]" 1
1342 1 95 GLU HB2 1 96 GLU H . . 6.500 3.019 2.424 3.753 . 0 0 "[ . 1 . 2]" 1
1343 1 95 GLU HB3 1 96 GLU H . . 6.500 3.223 2.336 3.828 . 0 0 "[ . 1 . 2]" 1
1344 1 95 GLU HG2 1 96 GLU H . . 6.500 4.517 3.419 5.065 . 0 0 "[ . 1 . 2]" 1
1345 1 96 GLU H 1 97 TYR H . . 6.500 2.650 2.544 2.742 . 0 0 "[ . 1 . 2]" 1
1346 1 96 GLU H 1 97 TYR HB2 . . 6.500 5.316 5.170 5.483 . 0 0 "[ . 1 . 2]" 1
1347 1 96 GLU H 1 97 TYR HB3 . . 6.500 4.682 4.467 4.904 . 0 0 "[ . 1 . 2]" 1
1348 1 96 GLU HB2 1 97 TYR H . . 6.500 2.705 2.429 3.941 . 0 0 "[ . 1 . 2]" 1
1349 1 96 GLU HB3 1 97 TYR H . . 6.500 3.332 2.573 3.878 . 0 0 "[ . 1 . 2]" 1
1350 1 96 GLU HG2 1 97 TYR H . . 6.500 4.499 3.173 5.013 . 0 0 "[ . 1 . 2]" 1
1351 1 96 GLU HG3 1 97 TYR H . . 6.500 4.625 2.053 5.039 . 0 0 "[ . 1 . 2]" 1
1352 1 97 TYR H 1 97 TYR QE . . 6.500 6.172 6.109 6.224 . 0 0 "[ . 1 . 2]" 1
1353 1 97 TYR H 1 98 SER H . . 6.500 2.544 2.456 2.634 . 0 0 "[ . 1 . 2]" 1
1354 1 97 TYR H 1 98 SER HA . . 6.500 5.129 5.052 5.207 . 0 0 "[ . 1 . 2]" 1
1355 1 97 TYR H 1 99 ARG H . . 6.500 4.163 4.108 4.214 . 0 0 "[ . 1 . 2]" 1
1356 1 97 TYR H 1 100 PHE H . . 6.500 5.550 5.451 5.604 . 0 0 "[ . 1 . 2]" 1
1357 1 97 TYR H 1 100 PHE QD . . 6.500 5.498 5.121 6.518 0.018 5 0 "[ . 1 . 2]" 1
1358 1 97 TYR HA 1 98 SER H . . 6.500 3.493 3.485 3.497 . 0 0 "[ . 1 . 2]" 1
1359 1 97 TYR HA 1 99 ARG H . . 6.500 3.659 3.630 3.723 . 0 0 "[ . 1 . 2]" 1
1360 1 97 TYR HA 1 100 PHE H . . 6.500 3.548 3.388 3.588 . 0 0 "[ . 1 . 2]" 1
1361 1 97 TYR HB2 1 98 SER H . . 6.500 4.119 4.041 4.171 . 0 0 "[ . 1 . 2]" 1
1362 1 97 TYR HB2 1 100 PHE H . . 6.500 5.611 5.499 5.663 . 0 0 "[ . 1 . 2]" 1
1363 1 97 TYR HB3 1 98 SER H . . 6.500 2.897 2.837 2.950 . 0 0 "[ . 1 . 2]" 1
1364 1 97 TYR QD 1 98 SER H . . 6.500 3.589 3.212 4.260 . 0 0 "[ . 1 . 2]" 1
1365 1 97 TYR QD 1 99 ARG H . . 6.500 5.106 4.897 5.197 . 0 0 "[ . 1 . 2]" 1
1366 1 97 TYR QD 1 99 ARG HG2 . . 6.500 5.153 4.339 5.364 . 0 0 "[ . 1 . 2]" 1
1367 1 97 TYR QD 1 100 PHE H . . 6.500 4.555 3.656 4.720 . 0 0 "[ . 1 . 2]" 1
1368 1 97 TYR QE 1 98 SER H . . 6.500 5.533 5.279 5.959 . 0 0 "[ . 1 . 2]" 1
1369 1 97 TYR QE 1 99 ARG H . . 6.500 6.514 6.376 6.554 0.054 6 0 "[ . 1 . 2]" 1
1370 1 97 TYR QE 1 99 ARG HG2 . . 6.500 6.504 6.036 6.634 0.134 4 0 "[ . 1 . 2]" 1
1371 1 97 TYR QE 1 100 PHE H . . 6.500 5.336 4.801 5.442 . 0 0 "[ . 1 . 2]" 1
1372 1 97 TYR QE 1 100 PHE HB3 . . 6.500 4.143 3.018 4.750 . 0 0 "[ . 1 . 2]" 1
1373 1 97 TYR QE 1 100 PHE QD . . 6.500 4.240 3.517 5.156 . 0 0 "[ . 1 . 2]" 1
1374 1 97 TYR QE 1 101 GLU H . . 6.500 4.477 4.137 4.666 . 0 0 "[ . 1 . 2]" 1
1375 1 97 TYR QE 1 101 GLU HA . . 6.500 5.558 5.204 5.823 . 0 0 "[ . 1 . 2]" 1
1376 1 97 TYR QE 1 101 GLU HB3 . . 6.500 4.156 3.273 5.537 . 0 0 "[ . 1 . 2]" 1
1377 1 97 TYR QE 1 101 GLU QG . . 6.500 4.057 3.209 5.297 . 0 0 "[ . 1 . 2]" 1
1378 1 98 SER H 1 99 ARG H . . 6.500 2.722 2.709 2.737 . 0 0 "[ . 1 . 2]" 1
1379 1 98 SER H 1 99 ARG HB2 . . 6.500 6.246 6.221 6.274 . 0 0 "[ . 1 . 2]" 1
1380 1 98 SER H 1 100 PHE H . . 6.500 4.397 4.351 4.438 . 0 0 "[ . 1 . 2]" 1
1381 1 98 SER H 1 101 GLU HB2 . . 6.500 6.212 5.557 6.395 . 0 0 "[ . 1 . 2]" 1
1382 1 98 SER HA 1 99 ARG H . . 6.500 3.458 3.453 3.468 . 0 0 "[ . 1 . 2]" 1
1383 1 98 SER HA 1 101 GLU H . . 6.500 3.231 3.204 3.283 . 0 0 "[ . 1 . 2]" 1
1384 1 98 SER HA 1 101 GLU HB2 . . 6.500 3.934 3.187 4.255 . 0 0 "[ . 1 . 2]" 1
1385 1 98 SER HA 1 101 GLU QG . . 6.500 5.036 4.685 5.305 . 0 0 "[ . 1 . 2]" 1
1386 1 98 SER QB 1 99 ARG H . . 6.500 3.022 2.916 3.114 . 0 0 "[ . 1 . 2]" 1
1387 1 99 ARG H 1 100 PHE H . . 6.500 2.669 2.620 2.688 . 0 0 "[ . 1 . 2]" 1
1388 1 99 ARG H 1 100 PHE HA . . 6.500 5.282 5.238 5.308 . 0 0 "[ . 1 . 2]" 1
1389 1 99 ARG H 1 100 PHE HB2 . . 6.500 4.660 4.586 4.787 . 0 0 "[ . 1 . 2]" 1
1390 1 99 ARG H 1 100 PHE HB3 . . 6.500 6.151 6.058 6.230 . 0 0 "[ . 1 . 2]" 1
1391 1 99 ARG H 1 101 GLU H . . 6.500 4.344 4.154 4.377 . 0 0 "[ . 1 . 2]" 1
1392 1 99 ARG H 1 101 GLU HB2 . . 6.500 6.303 5.612 6.484 . 0 0 "[ . 1 . 2]" 1
1393 1 99 ARG H 1 101 GLU HB3 . . 6.500 6.130 5.896 6.498 . 0 0 "[ . 1 . 2]" 1
1394 1 99 ARG HA 1 100 PHE H . . 6.500 3.502 3.498 3.510 . 0 0 "[ . 1 . 2]" 1
1395 1 99 ARG HA 1 101 GLU H . . 6.500 4.734 4.393 4.931 . 0 0 "[ . 1 . 2]" 1
1396 1 99 ARG HA 1 102 ALA H . . 6.500 6.547 6.506 6.634 0.134 5 0 "[ . 1 . 2]" 1
1397 1 99 ARG HB2 1 100 PHE H . . 6.500 4.030 4.001 4.068 . 0 0 "[ . 1 . 2]" 1
1398 1 99 ARG HB2 1 100 PHE HA . . 6.500 4.824 4.786 4.877 . 0 0 "[ . 1 . 2]" 1
1399 1 99 ARG HG2 1 100 PHE H . . 6.500 2.197 2.096 2.334 . 0 0 "[ . 1 . 2]" 1
1400 1 99 ARG HG2 1 100 PHE HB2 . . 6.500 3.731 3.320 3.940 . 0 0 "[ . 1 . 2]" 1
1401 1 99 ARG HG2 1 100 PHE HB3 . . 6.500 5.030 4.885 5.174 . 0 0 "[ . 1 . 2]" 1
1402 1 99 ARG HG3 1 100 PHE H . . 6.500 2.954 2.834 3.064 . 0 0 "[ . 1 . 2]" 1
1403 1 100 PHE H 1 100 PHE QE . . 6.500 4.915 4.626 5.212 . 0 0 "[ . 1 . 2]" 1
1404 1 100 PHE H 1 101 GLU H . . 6.500 2.555 2.458 2.606 . 0 0 "[ . 1 . 2]" 1
1405 1 100 PHE H 1 101 GLU HA . . 6.500 5.187 5.100 5.231 . 0 0 "[ . 1 . 2]" 1
1406 1 100 PHE H 1 101 GLU HB2 . . 6.500 4.794 4.494 4.906 . 0 0 "[ . 1 . 2]" 1
1407 1 100 PHE H 1 102 ALA H . . 6.500 6.154 6.009 6.251 . 0 0 "[ . 1 . 2]" 1
1408 1 100 PHE HA 1 101 GLU H . . 6.500 3.552 3.524 3.556 . 0 0 "[ . 1 . 2]" 1
1409 1 100 PHE HB3 1 101 GLU H . . 6.500 3.243 3.006 3.451 . 0 0 "[ . 1 . 2]" 1
1410 1 100 PHE HB3 1 101 GLU HA . . 6.500 4.166 4.034 4.302 . 0 0 "[ . 1 . 2]" 1
1411 1 100 PHE HB3 1 102 ALA H . . 6.500 5.710 5.631 5.802 . 0 0 "[ . 1 . 2]" 1
1412 1 100 PHE QD 1 101 GLU H . . 6.500 4.409 4.274 4.504 . 0 0 "[ . 1 . 2]" 1
1413 1 101 GLU H 1 102 ALA H . . 6.500 4.281 4.254 4.291 . 0 0 "[ . 1 . 2]" 1
1414 1 101 GLU HA 1 102 ALA H . . 6.500 2.165 2.161 2.171 . 0 0 "[ . 1 . 2]" 1
1415 1 101 GLU HB2 1 102 ALA H . . 6.500 4.574 4.541 4.627 . 0 0 "[ . 1 . 2]" 1
1416 1 101 GLU HB3 1 102 ALA H . . 6.500 4.211 4.013 4.309 . 0 0 "[ . 1 . 2]" 1
1417 1 101 GLU QG 1 102 ALA H . . 6.500 3.544 3.298 4.237 . 0 0 "[ . 1 . 2]" 1
stop_
save_
Contact the webmaster for help, if required. Saturday, May 4, 2024 6:12:07 PM GMT (wattos1)