NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | in_recoord | stage | program | type | subtype | subsubtype |
|
|
382454 |
1jhb   |
cing | recoord | 4-filtered-FRED | Wattos | check | violation | distance |
data_1jhb
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 1128
_Distance_constraint_stats_list.Viol_count 1507
_Distance_constraint_stats_list.Viol_total 1877.300
_Distance_constraint_stats_list.Viol_max 0.109
_Distance_constraint_stats_list.Viol_rms 0.0166
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0042
_Distance_constraint_stats_list.Viol_average_violations_only 0.0623
_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 2 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 3 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 4 GLU 0.593 0.075 16 0 "[ . 1 . 2]"
1 5 PHE 1.067 0.075 16 0 "[ . 1 . 2]"
1 6 VAL 0.641 0.071 4 0 "[ . 1 . 2]"
1 7 ASN 0.234 0.067 5 0 "[ . 1 . 2]"
1 8 CYS 0.063 0.063 6 0 "[ . 1 . 2]"
1 9 LYS 0.213 0.063 6 0 "[ . 1 . 2]"
1 10 ILE 0.583 0.078 10 0 "[ . 1 . 2]"
1 11 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 PRO 1.500 0.090 16 0 "[ . 1 . 2]"
1 13 GLY 4.037 0.096 7 0 "[ . 1 . 2]"
1 14 LYS 1.948 0.080 7 0 "[ . 1 . 2]"
1 15 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 16 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 17 VAL 0.879 0.075 15 0 "[ . 1 . 2]"
1 18 PHE 0.978 0.083 4 0 "[ . 1 . 2]"
1 19 ILE 1.314 0.083 16 0 "[ . 1 . 2]"
1 20 LYS 1.050 0.086 19 0 "[ . 1 . 2]"
1 21 PRO 0.403 0.075 18 0 "[ . 1 . 2]"
1 22 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 CYS 1.307 0.086 19 0 "[ . 1 . 2]"
1 24 PRO 0.798 0.075 20 0 "[ . 1 . 2]"
1 25 TYR 0.033 0.022 13 0 "[ . 1 . 2]"
1 26 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 27 ARG 1.104 0.087 3 0 "[ . 1 . 2]"
1 28 ARG 1.829 0.092 13 0 "[ . 1 . 2]"
1 29 ALA 2.651 0.092 13 0 "[ . 1 . 2]"
1 30 GLN 6.103 0.102 5 0 "[ . 1 . 2]"
1 31 GLU 5.497 0.091 18 0 "[ . 1 . 2]"
1 32 ILE 3.559 0.082 3 0 "[ . 1 . 2]"
1 33 LEU 2.171 0.078 8 0 "[ . 1 . 2]"
1 34 SER 5.623 0.102 5 0 "[ . 1 . 2]"
1 35 GLN 0.813 0.071 12 0 "[ . 1 . 2]"
1 36 LEU 3.044 0.083 2 0 "[ . 1 . 2]"
1 37 PRO 0.645 0.070 20 0 "[ . 1 . 2]"
1 38 ILE 0.790 0.101 6 0 "[ . 1 . 2]"
1 39 LYS 3.999 0.107 17 0 "[ . 1 . 2]"
1 40 GLN 1.037 0.077 14 0 "[ . 1 . 2]"
1 41 GLY 0.079 0.079 18 0 "[ . 1 . 2]"
1 42 LEU 3.303 0.088 5 0 "[ . 1 . 2]"
1 43 LEU 2.690 0.079 18 0 "[ . 1 . 2]"
1 44 GLU 2.706 0.090 19 0 "[ . 1 . 2]"
1 45 PHE 0.466 0.073 10 0 "[ . 1 . 2]"
1 46 VAL 1.030 0.083 4 0 "[ . 1 . 2]"
1 47 ASP 0.147 0.056 4 0 "[ . 1 . 2]"
1 48 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 49 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 ALA 0.285 0.080 18 0 "[ . 1 . 2]"
1 51 THR 0.285 0.080 18 0 "[ . 1 . 2]"
1 52 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 HIS 1.372 0.092 16 0 "[ . 1 . 2]"
1 54 THR 2.428 0.099 17 0 "[ . 1 . 2]"
1 55 ASN 1.975 0.099 6 0 "[ . 1 . 2]"
1 56 GLU 3.364 0.093 4 0 "[ . 1 . 2]"
1 57 ILE 0.076 0.076 6 0 "[ . 1 . 2]"
1 58 GLN 0.839 0.103 7 0 "[ . 1 . 2]"
1 59 ASP 2.499 0.103 7 0 "[ . 1 . 2]"
1 60 TYR 1.882 0.097 3 0 "[ . 1 . 2]"
1 61 LEU 0.127 0.079 6 0 "[ . 1 . 2]"
1 62 GLN 1.270 0.086 8 0 "[ . 1 . 2]"
1 63 GLN 2.251 0.086 8 0 "[ . 1 . 2]"
1 64 LEU 1.089 0.080 12 0 "[ . 1 . 2]"
1 65 THR 0.385 0.075 12 0 "[ . 1 . 2]"
1 66 GLY 0.438 0.076 6 0 "[ . 1 . 2]"
1 67 ALA 0.171 0.048 11 0 "[ . 1 . 2]"
1 68 ARG 0.161 0.059 11 0 "[ . 1 . 2]"
1 69 THR 1.562 0.076 3 0 "[ . 1 . 2]"
1 70 VAL 1.979 0.083 16 0 "[ . 1 . 2]"
1 71 PRO 0.106 0.083 15 0 "[ . 1 . 2]"
1 72 ARG 0.054 0.054 14 0 "[ . 1 . 2]"
1 73 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 PHE 0.695 0.072 4 0 "[ . 1 . 2]"
1 75 ILE 1.259 0.073 3 0 "[ . 1 . 2]"
1 76 GLY 0.498 0.071 17 0 "[ . 1 . 2]"
1 77 LYS 3.126 0.089 20 0 "[ . 1 . 2]"
1 78 ASP 1.237 0.084 9 0 "[ . 1 . 2]"
1 79 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 ILE 2.580 0.091 5 0 "[ . 1 . 2]"
1 81 GLY 0.937 0.085 18 0 "[ . 1 . 2]"
1 82 GLY 1.051 0.085 18 0 "[ . 1 . 2]"
1 83 CYS 1.573 0.104 19 0 "[ . 1 . 2]"
1 84 SER 1.621 0.104 19 0 "[ . 1 . 2]"
1 85 ASP 0.965 0.079 5 0 "[ . 1 . 2]"
1 86 LEU 0.331 0.068 19 0 "[ . 1 . 2]"
1 87 VAL 1.307 0.074 7 0 "[ . 1 . 2]"
1 88 SER 0.228 0.053 2 0 "[ . 1 . 2]"
1 89 LEU 2.344 0.084 20 0 "[ . 1 . 2]"
1 90 GLN 2.067 0.109 3 0 "[ . 1 . 2]"
1 91 GLN 2.749 0.093 17 0 "[ . 1 . 2]"
1 92 SER 0.205 0.080 20 0 "[ . 1 . 2]"
1 93 GLY 0.203 0.057 14 0 "[ . 1 . 2]"
1 94 GLU 2.549 0.085 19 0 "[ . 1 . 2]"
1 95 LEU 2.865 0.082 20 0 "[ . 1 . 2]"
1 96 LEU 1.719 0.085 17 0 "[ . 1 . 2]"
1 97 THR 2.237 0.083 10 0 "[ . 1 . 2]"
1 98 ARG 0.579 0.073 2 0 "[ . 1 . 2]"
1 99 LEU 3.905 0.093 18 0 "[ . 1 . 2]"
1 100 LYS 3.355 0.094 1 0 "[ . 1 . 2]"
1 101 GLN 2.512 0.094 1 0 "[ . 1 . 2]"
1 102 ILE 5.183 0.093 18 0 "[ . 1 . 2]"
1 103 GLY 0.018 0.011 14 0 "[ . 1 . 2]"
1 104 ALA 4.042 0.107 17 0 "[ . 1 . 2]"
1 105 LEU 5.081 0.104 14 0 "[ . 1 . 2]"
1 106 GLN 4.029 0.101 6 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 2 ALA MB 1 56 GLU QB . . 6.780 3.175 2.028 4.721 . 0 0 "[ . 1 . 2]" 1
2 1 2 ALA MB 1 57 ILE HA . . 4.300 2.500 1.871 3.428 . 0 0 "[ . 1 . 2]" 1
3 1 2 ALA MB 1 57 ILE MD . . 7.000 3.274 2.149 3.763 . 0 0 "[ . 1 . 2]" 1
4 1 2 ALA MB 1 60 TYR HB2 . . 6.000 3.419 2.208 4.661 . 0 0 "[ . 1 . 2]" 1
5 1 2 ALA MB 1 60 TYR HB3 . . 6.000 3.284 2.198 4.678 . 0 0 "[ . 1 . 2]" 1
6 1 3 GLN HA 1 60 TYR QD . . 7.000 4.099 2.815 6.307 . 0 0 "[ . 1 . 2]" 1
7 1 3 GLN HA 1 60 TYR QE . . 7.000 3.495 2.351 5.550 . 0 0 "[ . 1 . 2]" 1
8 1 3 GLN QB 1 7 ASN HD22 . . 6.000 5.198 4.212 5.478 . 0 0 "[ . 1 . 2]" 1
9 1 4 GLU H 1 5 PHE H . . 3.600 2.566 1.873 3.500 . 0 0 "[ . 1 . 2]" 1
10 1 4 GLU HA 1 4 GLU QG . . 3.200 2.423 2.151 2.921 . 0 0 "[ . 1 . 2]" 1
11 1 4 GLU HA 1 5 PHE H . . 3.600 3.595 3.429 3.675 0.075 16 0 "[ . 1 . 2]" 1
12 1 4 GLU HA 1 7 ASN H . . 4.500 3.329 2.651 3.791 . 0 0 "[ . 1 . 2]" 1
13 1 4 GLU HA 1 7 ASN QB . . 4.700 2.488 2.002 3.628 . 0 0 "[ . 1 . 2]" 1
14 1 4 GLU HA 1 8 CYS H . . 4.800 3.124 2.083 3.741 . 0 0 "[ . 1 . 2]" 1
15 1 4 GLU QG 1 5 PHE H . . 6.000 3.880 3.122 4.911 . 0 0 "[ . 1 . 2]" 1
16 1 4 GLU QG 1 8 CYS HA . . 6.000 4.902 4.137 5.468 . 0 0 "[ . 1 . 2]" 1
17 1 5 PHE H 1 5 PHE HB2 . . 3.000 2.369 2.134 2.612 . 0 0 "[ . 1 . 2]" 1
18 1 5 PHE H 1 5 PHE HB3 . . 3.000 2.713 2.529 2.923 . 0 0 "[ . 1 . 2]" 1
19 1 5 PHE H 1 6 VAL H . . 3.000 2.964 2.766 3.071 0.071 4 0 "[ . 1 . 2]" 1
20 1 5 PHE HB2 1 6 VAL H . . 4.100 3.825 3.478 4.053 . 0 0 "[ . 1 . 2]" 1
21 1 5 PHE HB3 1 6 VAL H . . 3.300 2.602 2.232 3.067 . 0 0 "[ . 1 . 2]" 1
22 1 5 PHE QE 1 48 ILE HA . . 7.000 3.734 2.641 5.261 . 0 0 "[ . 1 . 2]" 1
23 1 6 VAL H 1 6 VAL HB . . 2.900 2.251 2.119 2.430 . 0 0 "[ . 1 . 2]" 1
24 1 6 VAL H 1 6 VAL MG2 . . 3.400 2.637 2.371 2.734 . 0 0 "[ . 1 . 2]" 1
25 1 6 VAL H 1 7 ASN H . . 3.000 2.564 2.215 2.742 . 0 0 "[ . 1 . 2]" 1
26 1 6 VAL HA 1 6 VAL MG1 . . 3.400 2.668 2.500 2.817 . 0 0 "[ . 1 . 2]" 1
27 1 6 VAL HA 1 6 VAL MG2 . . 3.400 2.306 2.232 2.364 . 0 0 "[ . 1 . 2]" 1
28 1 6 VAL HA 1 7 ASN H . . 3.600 3.588 3.516 3.645 0.045 13 0 "[ . 1 . 2]" 1
29 1 6 VAL HA 1 9 LYS H . . 4.500 3.763 3.478 4.459 . 0 0 "[ . 1 . 2]" 1
30 1 6 VAL HA 1 18 PHE HZ . . 3.300 2.552 2.315 3.128 . 0 0 "[ . 1 . 2]" 1
31 1 6 VAL HB 1 7 ASN H . . 3.100 2.643 2.404 3.141 0.041 4 0 "[ . 1 . 2]" 1
32 1 6 VAL HB 1 60 TYR QD . . 6.300 3.400 2.298 5.699 . 0 0 "[ . 1 . 2]" 1
33 1 6 VAL HB 1 60 TYR QE . . 6.400 3.447 2.263 5.664 . 0 0 "[ . 1 . 2]" 1
34 1 6 VAL MG1 1 7 ASN H . . 5.600 3.023 2.751 3.414 . 0 0 "[ . 1 . 2]" 1
35 1 6 VAL MG1 1 7 ASN HA . . 4.000 2.881 2.673 3.043 . 0 0 "[ . 1 . 2]" 1
36 1 6 VAL MG1 1 10 ILE MD . . 4.700 2.251 1.975 2.903 . 0 0 "[ . 1 . 2]" 1
37 1 6 VAL MG1 1 18 PHE HZ . . 3.600 2.682 2.474 2.753 . 0 0 "[ . 1 . 2]" 1
38 1 6 VAL MG1 1 60 TYR QE . . 6.300 3.084 2.218 4.882 . 0 0 "[ . 1 . 2]" 1
39 1 6 VAL MG1 1 61 LEU QD . . 5.970 2.331 1.990 3.141 . 0 0 "[ . 1 . 2]" 1
40 1 6 VAL MG2 1 7 ASN H . . 5.500 4.044 3.879 4.299 . 0 0 "[ . 1 . 2]" 1
41 1 6 VAL MG2 1 18 PHE HB3 . . 4.600 3.793 3.729 3.841 . 0 0 "[ . 1 . 2]" 1
42 1 6 VAL MG2 1 18 PHE QD . . 8.000 2.996 2.691 3.124 . 0 0 "[ . 1 . 2]" 1
43 1 6 VAL MG2 1 60 TYR QE . . 8.000 4.467 3.619 6.036 . 0 0 "[ . 1 . 2]" 1
44 1 6 VAL MG2 1 61 LEU QD . . 7.870 2.578 2.082 3.667 . 0 0 "[ . 1 . 2]" 1
45 1 7 ASN H 1 8 CYS H . . 3.300 2.840 2.476 3.048 . 0 0 "[ . 1 . 2]" 1
46 1 7 ASN HA 1 10 ILE H . . 4.700 3.932 3.480 4.608 . 0 0 "[ . 1 . 2]" 1
47 1 7 ASN HA 1 10 ILE HB . . 4.800 4.258 3.508 4.867 0.067 5 0 "[ . 1 . 2]" 1
48 1 7 ASN HA 1 10 ILE MD . . 4.000 2.473 2.027 3.298 . 0 0 "[ . 1 . 2]" 1
49 1 7 ASN HD22 1 64 LEU QD . . 5.470 3.572 2.757 3.931 . 0 0 "[ . 1 . 2]" 1
50 1 8 CYS H 1 9 LYS H . . 3.100 2.532 1.982 3.163 0.063 6 0 "[ . 1 . 2]" 1
51 1 9 LYS H 1 9 LYS HB2 . . 3.200 2.331 2.057 2.973 . 0 0 "[ . 1 . 2]" 1
52 1 9 LYS H 1 10 ILE H . . 2.900 2.595 2.057 2.841 . 0 0 "[ . 1 . 2]" 1
53 1 9 LYS HA 1 9 LYS HD2 . . 3.700 3.038 2.102 3.758 0.058 14 0 "[ . 1 . 2]" 1
54 1 9 LYS HA 1 9 LYS QD . . 3.300 2.222 2.046 2.353 . 0 0 "[ . 1 . 2]" 1
55 1 9 LYS HA 1 9 LYS HD3 . . 3.700 2.661 2.089 3.759 0.059 4 0 "[ . 1 . 2]" 1
56 1 9 LYS HB2 1 10 ILE H . . 4.200 3.023 2.494 3.728 . 0 0 "[ . 1 . 2]" 1
57 1 9 LYS HB2 1 16 VAL MG1 . . 5.200 3.308 2.434 4.059 . 0 0 "[ . 1 . 2]" 1
58 1 9 LYS HB2 1 18 PHE HZ . . 5.000 2.641 2.217 3.368 . 0 0 "[ . 1 . 2]" 1
59 1 9 LYS HB3 1 16 VAL MG1 . . 3.800 2.458 2.097 3.090 . 0 0 "[ . 1 . 2]" 1
60 1 9 LYS HB3 1 46 VAL MG2 . . 5.400 2.664 2.191 3.263 . 0 0 "[ . 1 . 2]" 1
61 1 9 LYS QD 1 46 VAL MG2 . . 5.580 2.888 2.054 4.089 . 0 0 "[ . 1 . 2]" 1
62 1 9 LYS QE 1 46 VAL MG2 . . 5.640 3.160 2.162 4.165 . 0 0 "[ . 1 . 2]" 1
63 1 9 LYS HE2 1 46 VAL MG1 . . 5.900 3.259 2.017 4.856 . 0 0 "[ . 1 . 2]" 1
64 1 9 LYS HE2 1 46 VAL MG2 . . 6.000 3.770 2.266 4.922 . 0 0 "[ . 1 . 2]" 1
65 1 9 LYS HE3 1 46 VAL MG1 . . 5.900 3.601 2.372 4.828 . 0 0 "[ . 1 . 2]" 1
66 1 9 LYS HE3 1 46 VAL MG2 . . 6.000 3.586 2.601 4.804 . 0 0 "[ . 1 . 2]" 1
67 1 10 ILE H 1 10 ILE HB . . 2.800 2.734 2.422 2.878 0.078 10 0 "[ . 1 . 2]" 1
68 1 10 ILE H 1 10 ILE MD . . 3.500 2.764 2.080 2.898 . 0 0 "[ . 1 . 2]" 1
69 1 10 ILE H 1 10 ILE HG12 . . 4.200 3.531 1.998 4.014 . 0 0 "[ . 1 . 2]" 1
70 1 10 ILE H 1 10 ILE QG . . 3.500 2.096 1.763 2.578 . 0 0 "[ . 1 . 2]" 1
71 1 10 ILE H 1 10 ILE HG13 . . 4.200 2.188 1.769 3.532 . 0 0 "[ . 1 . 2]" 1
72 1 10 ILE HA 1 10 ILE MG . . 3.400 2.260 2.156 2.446 . 0 0 "[ . 1 . 2]" 1
73 1 10 ILE HA 1 11 GLN H . . 2.600 2.294 2.162 2.407 . 0 0 "[ . 1 . 2]" 1
74 1 10 ILE HA 1 16 VAL MG1 . . 5.900 3.078 2.178 4.422 . 0 0 "[ . 1 . 2]" 1
75 1 10 ILE HA 1 16 VAL MG2 . . 3.700 2.240 2.025 2.935 . 0 0 "[ . 1 . 2]" 1
76 1 10 ILE HB 1 10 ILE MD . . 3.400 2.196 2.100 3.011 . 0 0 "[ . 1 . 2]" 1
77 1 10 ILE MD 1 64 LEU QD . . 6.770 2.755 2.069 3.379 . 0 0 "[ . 1 . 2]" 1
78 1 10 ILE MD 1 74 PHE QR . . 7.900 2.615 2.068 3.039 . 0 0 "[ . 1 . 2]" 1
79 1 10 ILE MD 1 77 LYS HA . . 4.800 3.638 3.191 3.779 . 0 0 "[ . 1 . 2]" 1
80 1 10 ILE MG 1 11 GLN H . . 3.900 2.321 1.811 2.817 . 0 0 "[ . 1 . 2]" 1
81 1 10 ILE MG 1 74 PHE QB . . 6.280 2.298 1.946 3.485 . 0 0 "[ . 1 . 2]" 1
82 1 10 ILE MG 1 77 LYS H . . 5.700 2.238 1.837 2.635 . 0 0 "[ . 1 . 2]" 1
83 1 10 ILE MG 1 77 LYS HA . . 3.400 1.978 1.847 2.222 . 0 0 "[ . 1 . 2]" 1
84 1 11 GLN H 1 16 VAL MG2 . . 6.000 3.153 2.337 3.856 . 0 0 "[ . 1 . 2]" 1
85 1 11 GLN HA 1 12 PRO QD . . 3.500 2.204 2.073 2.478 . 0 0 "[ . 1 . 2]" 1
86 1 11 GLN HA 1 77 LYS QG . . 5.880 3.510 2.615 4.605 . 0 0 "[ . 1 . 2]" 1
87 1 11 GLN QG 1 12 PRO QD . . 7.000 2.985 2.008 3.936 . 0 0 "[ . 1 . 2]" 1
88 1 11 GLN QG 1 13 GLY H . . 6.000 4.769 2.614 5.470 . 0 0 "[ . 1 . 2]" 1
89 1 12 PRO HA 1 13 GLY H . . 2.800 2.468 2.160 2.890 0.090 16 0 "[ . 1 . 2]" 1
90 1 12 PRO HA 1 14 LYS H . . 4.400 3.853 3.106 4.465 0.065 20 0 "[ . 1 . 2]" 1
91 1 12 PRO HA 1 77 LYS H . . 3.500 3.412 2.817 3.571 0.071 11 0 "[ . 1 . 2]" 1
92 1 12 PRO HB2 1 13 GLY H . . 4.500 3.864 2.686 4.457 . 0 0 "[ . 1 . 2]" 1
93 1 12 PRO HB3 1 13 GLY H . . 4.500 4.248 3.533 4.575 0.075 2 0 "[ . 1 . 2]" 1
94 1 12 PRO QD 1 77 LYS QD . . 7.000 3.588 2.263 5.038 . 0 0 "[ . 1 . 2]" 1
95 1 13 GLY H 1 13 GLY HA2 . . 2.900 2.579 2.285 2.951 0.051 17 0 "[ . 1 . 2]" 1
96 1 13 GLY H 1 13 GLY HA3 . . 2.800 2.848 2.696 2.896 0.096 7 0 "[ . 1 . 2]" 1
97 1 13 GLY H 1 14 LYS H . . 3.200 2.271 1.678 3.057 . 0 0 "[ . 1 . 2]" 1
98 1 13 GLY H 1 76 GLY HA2 . . 4.000 2.488 1.960 3.196 . 0 0 "[ . 1 . 2]" 1
99 1 13 GLY H 1 76 GLY HA3 . . 3.900 3.313 2.506 3.971 0.071 17 0 "[ . 1 . 2]" 1
100 1 13 GLY H 1 77 LYS QB . . 5.880 4.642 4.002 5.291 . 0 0 "[ . 1 . 2]" 1
101 1 13 GLY H 1 102 ILE MD . . 5.600 3.621 2.861 4.323 . 0 0 "[ . 1 . 2]" 1
102 1 13 GLY HA2 1 102 ILE HB . . 3.400 2.195 2.106 2.314 . 0 0 "[ . 1 . 2]" 1
103 1 13 GLY HA2 1 102 ILE MD . . 4.300 2.447 2.183 2.893 . 0 0 "[ . 1 . 2]" 1
104 1 13 GLY HA3 1 102 ILE HA . . 5.000 5.005 4.777 5.075 0.075 12 0 "[ . 1 . 2]" 1
105 1 13 GLY HA3 1 102 ILE HB . . 3.800 3.825 3.564 3.879 0.079 2 0 "[ . 1 . 2]" 1
106 1 13 GLY HA3 1 102 ILE MD . . 4.700 3.645 3.332 3.816 . 0 0 "[ . 1 . 2]" 1
107 1 14 LYS H 1 14 LYS HB2 . . 3.600 2.776 2.498 3.073 . 0 0 "[ . 1 . 2]" 1
108 1 14 LYS H 1 14 LYS HB3 . . 3.500 3.316 2.994 3.573 0.073 16 0 "[ . 1 . 2]" 1
109 1 14 LYS H 1 76 GLY H . . 4.200 3.260 2.804 3.633 . 0 0 "[ . 1 . 2]" 1
110 1 14 LYS H 1 76 GLY HA2 . . 3.300 2.496 2.323 2.718 . 0 0 "[ . 1 . 2]" 1
111 1 14 LYS H 1 76 GLY HA3 . . 4.100 3.822 3.333 4.157 0.057 7 0 "[ . 1 . 2]" 1
112 1 14 LYS H 1 102 ILE MD . . 5.200 2.804 2.313 3.415 . 0 0 "[ . 1 . 2]" 1
113 1 14 LYS HA 1 15 VAL H . . 2.600 2.465 2.361 2.553 . 0 0 "[ . 1 . 2]" 1
114 1 14 LYS HA 1 42 LEU HB2 . . 4.200 4.256 4.161 4.280 0.080 7 0 "[ . 1 . 2]" 1
115 1 14 LYS HA 1 42 LEU HB3 . . 3.900 2.554 2.486 2.642 . 0 0 "[ . 1 . 2]" 1
116 1 14 LYS HA 1 42 LEU QD . . 6.170 2.298 2.094 2.660 . 0 0 "[ . 1 . 2]" 1
117 1 14 LYS HA 1 102 ILE MD . . 5.200 3.028 2.641 3.499 . 0 0 "[ . 1 . 2]" 1
118 1 14 LYS HB2 1 15 VAL H . . 4.600 4.147 3.858 4.395 . 0 0 "[ . 1 . 2]" 1
119 1 14 LYS HB2 1 16 VAL MG2 . . 4.500 3.453 2.751 3.823 . 0 0 "[ . 1 . 2]" 1
120 1 14 LYS HB3 1 15 VAL H . . 3.700 3.036 2.399 3.556 . 0 0 "[ . 1 . 2]" 1
121 1 14 LYS HB3 1 16 VAL MG2 . . 4.800 2.256 2.059 2.525 . 0 0 "[ . 1 . 2]" 1
122 1 14 LYS QE 1 16 VAL MG2 . . 4.880 3.040 1.946 3.751 . 0 0 "[ . 1 . 2]" 1
123 1 14 LYS QE 1 42 LEU HA . . 5.780 4.147 2.893 5.048 . 0 0 "[ . 1 . 2]" 1
124 1 14 LYS QG 1 15 VAL H . . 5.300 2.777 2.283 3.631 . 0 0 "[ . 1 . 2]" 1
125 1 14 LYS QG 1 16 VAL MG2 . . 5.500 3.361 2.597 4.159 . 0 0 "[ . 1 . 2]" 1
126 1 14 LYS QG 1 42 LEU HA . . 4.500 2.165 1.969 2.579 . 0 0 "[ . 1 . 2]" 1
127 1 15 VAL H 1 15 VAL HB . . 3.000 2.590 2.481 2.760 . 0 0 "[ . 1 . 2]" 1
128 1 15 VAL H 1 15 VAL MG2 . . 3.500 2.608 2.418 2.778 . 0 0 "[ . 1 . 2]" 1
129 1 15 VAL H 1 16 VAL MG2 . . 5.900 3.501 2.986 3.879 . 0 0 "[ . 1 . 2]" 1
130 1 15 VAL H 1 38 ILE MG . . 5.400 4.587 4.493 4.627 . 0 0 "[ . 1 . 2]" 1
131 1 15 VAL H 1 42 LEU HB3 . . 5.000 2.497 2.227 2.976 . 0 0 "[ . 1 . 2]" 1
132 1 15 VAL H 1 43 LEU HA . . 3.700 3.333 3.077 3.567 . 0 0 "[ . 1 . 2]" 1
133 1 15 VAL HA 1 15 VAL MG1 . . 3.400 2.197 2.156 2.234 . 0 0 "[ . 1 . 2]" 1
134 1 15 VAL HA 1 15 VAL MG2 . . 3.400 2.506 2.460 2.553 . 0 0 "[ . 1 . 2]" 1
135 1 15 VAL HA 1 16 VAL H . . 2.600 2.266 2.179 2.337 . 0 0 "[ . 1 . 2]" 1
136 1 15 VAL HA 1 75 ILE HA . . 2.800 2.482 2.349 2.710 . 0 0 "[ . 1 . 2]" 1
137 1 15 VAL HA 1 76 GLY H . . 3.500 2.992 2.619 3.356 . 0 0 "[ . 1 . 2]" 1
138 1 15 VAL HB 1 38 ILE MD . . 5.900 4.333 3.772 4.935 . 0 0 "[ . 1 . 2]" 1
139 1 15 VAL HB 1 38 ILE MG . . 5.700 3.327 2.981 3.836 . 0 0 "[ . 1 . 2]" 1
140 1 15 VAL HB 1 43 LEU HA . . 3.000 2.133 2.062 2.273 . 0 0 "[ . 1 . 2]" 1
141 1 15 VAL HB 1 43 LEU QD . . 4.970 2.060 1.954 2.181 . 0 0 "[ . 1 . 2]" 1
142 1 15 VAL MG1 1 75 ILE HA . . 5.300 2.782 2.399 3.272 . 0 0 "[ . 1 . 2]" 1
143 1 15 VAL MG1 1 76 GLY H . . 5.700 4.269 3.889 4.653 . 0 0 "[ . 1 . 2]" 1
144 1 15 VAL MG2 1 75 ILE HA . . 4.300 2.960 2.760 3.231 . 0 0 "[ . 1 . 2]" 1
145 1 15 VAL MG2 1 76 GLY H . . 5.500 3.544 3.298 3.824 . 0 0 "[ . 1 . 2]" 1
146 1 15 VAL MG2 1 104 ALA MB . . 4.600 2.953 2.717 3.183 . 0 0 "[ . 1 . 2]" 1
147 1 16 VAL H 1 16 VAL HB . . 3.100 2.503 2.175 2.728 . 0 0 "[ . 1 . 2]" 1
148 1 16 VAL H 1 16 VAL MG2 . . 3.400 2.687 2.521 2.728 . 0 0 "[ . 1 . 2]" 1
149 1 16 VAL H 1 74 PHE H . . 4.300 3.467 3.061 4.046 . 0 0 "[ . 1 . 2]" 1
150 1 16 VAL H 1 74 PHE QB . . 4.980 3.035 2.701 3.271 . 0 0 "[ . 1 . 2]" 1
151 1 16 VAL HA 1 16 VAL MG1 . . 3.400 2.430 2.287 2.653 . 0 0 "[ . 1 . 2]" 1
152 1 16 VAL HA 1 16 VAL MG2 . . 3.400 2.289 2.183 2.444 . 0 0 "[ . 1 . 2]" 1
153 1 16 VAL HA 1 17 VAL H . . 2.500 2.189 2.092 2.282 . 0 0 "[ . 1 . 2]" 1
154 1 16 VAL HA 1 44 GLU H . . 3.100 2.742 2.571 2.972 . 0 0 "[ . 1 . 2]" 1
155 1 16 VAL HB 1 74 PHE HB2 . . 4.700 2.879 2.187 4.293 . 0 0 "[ . 1 . 2]" 1
156 1 16 VAL HB 1 74 PHE QB . . 4.230 2.667 2.143 3.196 . 0 0 "[ . 1 . 2]" 1
157 1 16 VAL HB 1 74 PHE HB3 . . 4.700 3.597 2.647 4.564 . 0 0 "[ . 1 . 2]" 1
158 1 16 VAL MG1 1 17 VAL H . . 3.800 2.709 2.338 3.085 . 0 0 "[ . 1 . 2]" 1
159 1 16 VAL MG1 1 17 VAL HA . . 5.000 3.806 3.243 4.038 . 0 0 "[ . 1 . 2]" 1
160 1 16 VAL MG1 1 18 PHE QD . . 8.000 3.689 3.195 4.120 . 0 0 "[ . 1 . 2]" 1
161 1 16 VAL MG1 1 18 PHE QE . . 7.400 2.950 2.561 3.422 . 0 0 "[ . 1 . 2]" 1
162 1 16 VAL MG1 1 18 PHE HZ . . 6.000 2.855 2.587 3.432 . 0 0 "[ . 1 . 2]" 1
163 1 16 VAL MG1 1 74 PHE QB . . 6.880 3.532 2.809 4.183 . 0 0 "[ . 1 . 2]" 1
164 1 16 VAL MG2 1 44 GLU H . . 4.500 3.527 3.159 3.667 . 0 0 "[ . 1 . 2]" 1
165 1 17 VAL H 1 17 VAL HB . . 3.300 2.790 2.601 3.067 . 0 0 "[ . 1 . 2]" 1
166 1 17 VAL H 1 17 VAL MG2 . . 3.400 2.626 2.388 2.706 . 0 0 "[ . 1 . 2]" 1
167 1 17 VAL H 1 43 LEU QD . . 7.570 3.849 3.461 4.100 . 0 0 "[ . 1 . 2]" 1
168 1 17 VAL H 1 44 GLU H . . 3.800 3.828 3.643 3.875 0.075 15 0 "[ . 1 . 2]" 1
169 1 17 VAL H 1 45 PHE HA . . 3.400 2.919 2.638 3.208 . 0 0 "[ . 1 . 2]" 1
170 1 17 VAL H 1 46 VAL H . . 4.200 3.305 2.973 3.995 . 0 0 "[ . 1 . 2]" 1
171 1 17 VAL H 1 46 VAL MG2 . . 6.000 3.172 2.676 4.044 . 0 0 "[ . 1 . 2]" 1
172 1 17 VAL HA 1 17 VAL MG1 . . 3.400 2.292 2.191 2.470 . 0 0 "[ . 1 . 2]" 1
173 1 17 VAL HA 1 17 VAL MG2 . . 3.400 2.558 2.362 2.694 . 0 0 "[ . 1 . 2]" 1
174 1 17 VAL HA 1 18 PHE H . . 2.500 2.174 2.067 2.370 . 0 0 "[ . 1 . 2]" 1
175 1 17 VAL HA 1 73 VAL HA . . 3.000 2.454 2.249 2.634 . 0 0 "[ . 1 . 2]" 1
176 1 17 VAL HA 1 74 PHE H . . 4.100 3.046 2.774 3.304 . 0 0 "[ . 1 . 2]" 1
177 1 17 VAL HB 1 19 ILE MG . . 5.300 2.840 2.301 3.602 . 0 0 "[ . 1 . 2]" 1
178 1 17 VAL HB 1 45 PHE HA . . 3.200 2.545 2.259 3.054 . 0 0 "[ . 1 . 2]" 1
179 1 17 VAL HB 1 45 PHE QD . . 6.400 2.218 2.081 2.599 . 0 0 "[ . 1 . 2]" 1
180 1 17 VAL MG1 1 18 PHE H . . 3.700 2.904 2.311 2.998 . 0 0 "[ . 1 . 2]" 1
181 1 17 VAL MG1 1 71 PRO HB2 . . 4.100 2.436 2.185 2.972 . 0 0 "[ . 1 . 2]" 1
182 1 17 VAL MG1 1 71 PRO QB . . 3.660 2.348 2.093 2.825 . 0 0 "[ . 1 . 2]" 1
183 1 17 VAL MG1 1 71 PRO HB3 . . 4.100 3.084 2.676 3.533 . 0 0 "[ . 1 . 2]" 1
184 1 17 VAL MG1 1 73 VAL HA . . 5.900 2.376 2.201 2.643 . 0 0 "[ . 1 . 2]" 1
185 1 17 VAL MG2 1 18 PHE H . . 5.900 4.304 4.084 4.453 . 0 0 "[ . 1 . 2]" 1
186 1 17 VAL MG2 1 73 VAL HA . . 4.000 2.434 2.070 2.729 . 0 0 "[ . 1 . 2]" 1
187 1 17 VAL MG2 1 74 PHE H . . 5.800 3.193 2.424 3.688 . 0 0 "[ . 1 . 2]" 1
188 1 18 PHE H 1 18 PHE HB2 . . 3.400 2.495 2.386 2.583 . 0 0 "[ . 1 . 2]" 1
189 1 18 PHE H 1 72 ARG H . . 3.400 2.979 2.711 3.164 . 0 0 "[ . 1 . 2]" 1
190 1 18 PHE HA 1 19 ILE H . . 2.600 2.188 2.128 2.244 . 0 0 "[ . 1 . 2]" 1
191 1 18 PHE HA 1 46 VAL H . . 3.000 3.036 2.904 3.083 0.083 4 0 "[ . 1 . 2]" 1
192 1 18 PHE HA 1 46 VAL HB . . 2.800 2.496 2.265 2.571 . 0 0 "[ . 1 . 2]" 1
193 1 18 PHE HA 1 46 VAL MG1 . . 4.500 3.667 3.438 3.775 . 0 0 "[ . 1 . 2]" 1
194 1 18 PHE HA 1 46 VAL MG2 . . 4.800 3.991 3.541 4.057 . 0 0 "[ . 1 . 2]" 1
195 1 18 PHE HA 1 48 ILE MG . . 4.500 3.251 2.830 3.700 . 0 0 "[ . 1 . 2]" 1
196 1 18 PHE HB2 1 48 ILE MG . . 6.000 3.574 3.374 3.902 . 0 0 "[ . 1 . 2]" 1
197 1 18 PHE HB2 1 70 VAL MG1 . . 5.000 3.197 2.946 3.412 . 0 0 "[ . 1 . 2]" 1
198 1 18 PHE HB2 1 72 ARG QB . . 6.000 2.465 2.117 3.780 . 0 0 "[ . 1 . 2]" 1
199 1 18 PHE HB3 1 48 ILE MG . . 4.000 2.244 2.065 2.457 . 0 0 "[ . 1 . 2]" 1
200 1 18 PHE HB3 1 61 LEU QD . . 6.570 2.793 2.362 3.453 . 0 0 "[ . 1 . 2]" 1
201 1 18 PHE HB3 1 70 VAL MG1 . . 4.100 3.403 3.200 3.500 . 0 0 "[ . 1 . 2]" 1
202 1 18 PHE HB3 1 72 ARG QB . . 6.000 4.044 3.652 5.164 . 0 0 "[ . 1 . 2]" 1
203 1 18 PHE QD 1 46 VAL HB . . 7.000 2.592 2.313 3.084 . 0 0 "[ . 1 . 2]" 1
204 1 18 PHE QD 1 46 VAL MG1 . . 6.300 2.520 2.214 2.675 . 0 0 "[ . 1 . 2]" 1
205 1 18 PHE QD 1 48 ILE MG . . 5.900 2.713 2.236 3.204 . 0 0 "[ . 1 . 2]" 1
206 1 18 PHE QD 1 61 LEU QD . . 9.570 2.678 2.330 3.367 . 0 0 "[ . 1 . 2]" 1
207 1 18 PHE QD 1 72 ARG QB . . 8.000 2.834 2.316 4.552 . 0 0 "[ . 1 . 2]" 1
208 1 18 PHE QE 1 46 VAL MG1 . . 7.200 2.228 2.117 2.354 . 0 0 "[ . 1 . 2]" 1
209 1 19 ILE H 1 19 ILE MD . . 4.900 3.820 3.371 4.027 . 0 0 "[ . 1 . 2]" 1
210 1 19 ILE H 1 19 ILE HG12 . . 3.500 3.140 2.705 3.573 0.073 20 0 "[ . 1 . 2]" 1
211 1 19 ILE H 1 19 ILE HG13 . . 3.500 2.301 2.061 2.537 . 0 0 "[ . 1 . 2]" 1
212 1 19 ILE H 1 19 ILE MG . . 4.600 3.091 2.947 3.232 . 0 0 "[ . 1 . 2]" 1
213 1 19 ILE H 1 46 VAL H . . 3.900 3.641 3.231 3.951 0.051 4 0 "[ . 1 . 2]" 1
214 1 19 ILE H 1 47 ASP HA . . 3.800 3.223 2.883 3.515 . 0 0 "[ . 1 . 2]" 1
215 1 19 ILE H 1 48 ILE MG . . 4.400 2.780 2.381 3.260 . 0 0 "[ . 1 . 2]" 1
216 1 19 ILE HA 1 19 ILE HB . . 2.800 2.493 2.450 2.563 . 0 0 "[ . 1 . 2]" 1
217 1 19 ILE HA 1 19 ILE MG . . 3.400 2.345 2.228 2.441 . 0 0 "[ . 1 . 2]" 1
218 1 19 ILE HA 1 20 LYS H . . 2.800 2.511 2.367 2.709 . 0 0 "[ . 1 . 2]" 1
219 1 19 ILE HA 1 70 VAL HB . . 2.900 2.856 2.466 2.983 0.083 16 0 "[ . 1 . 2]" 1
220 1 19 ILE HA 1 70 VAL MG1 . . 3.900 3.098 2.838 3.177 . 0 0 "[ . 1 . 2]" 1
221 1 19 ILE HA 1 70 VAL MG2 . . 5.200 4.040 3.762 4.216 . 0 0 "[ . 1 . 2]" 1
222 1 19 ILE HA 1 71 PRO HA . . 3.200 2.873 2.693 3.073 . 0 0 "[ . 1 . 2]" 1
223 1 19 ILE HB 1 19 ILE MD . . 3.500 2.236 2.186 2.296 . 0 0 "[ . 1 . 2]" 1
224 1 19 ILE HB 1 20 LYS H . . 2.800 2.199 1.981 2.383 . 0 0 "[ . 1 . 2]" 1
225 1 19 ILE HB 1 26 CYS HB2 . . 4.000 3.505 3.275 3.898 . 0 0 "[ . 1 . 2]" 1
226 1 19 ILE HB 1 26 CYS HB3 . . 3.000 2.273 2.025 2.603 . 0 0 "[ . 1 . 2]" 1
227 1 19 ILE MD 1 20 LYS H . . 6.000 3.246 2.882 3.849 . 0 0 "[ . 1 . 2]" 1
228 1 19 ILE MD 1 20 LYS HA . . 6.000 3.326 2.943 3.999 . 0 0 "[ . 1 . 2]" 1
229 1 19 ILE MD 1 21 PRO HA . . 4.100 3.233 2.668 3.481 . 0 0 "[ . 1 . 2]" 1
230 1 19 ILE MD 1 26 CYS HB3 . . 6.000 3.322 2.922 3.734 . 0 0 "[ . 1 . 2]" 1
231 1 19 ILE MD 1 45 PHE HB2 . . 4.500 3.423 2.954 3.667 . 0 0 "[ . 1 . 2]" 1
232 1 19 ILE MD 1 45 PHE HB3 . . 4.100 2.710 2.208 3.396 . 0 0 "[ . 1 . 2]" 1
233 1 19 ILE MD 1 45 PHE QD . . 8.000 4.153 3.613 4.784 . 0 0 "[ . 1 . 2]" 1
234 1 19 ILE MD 1 46 VAL H . . 6.000 4.369 3.872 5.008 . 0 0 "[ . 1 . 2]" 1
235 1 19 ILE MD 1 47 ASP H . . 6.000 3.964 3.148 4.868 . 0 0 "[ . 1 . 2]" 1
236 1 19 ILE MD 1 47 ASP HA . . 4.000 3.002 2.280 3.322 . 0 0 "[ . 1 . 2]" 1
237 1 19 ILE MD 1 47 ASP HB2 . . 6.000 3.185 2.575 3.977 . 0 0 "[ . 1 . 2]" 1
238 1 19 ILE QG 1 45 PHE HB3 . . 5.880 2.310 2.088 2.834 . 0 0 "[ . 1 . 2]" 1
239 1 19 ILE QG 1 47 ASP HA . . 3.890 2.411 2.027 3.097 . 0 0 "[ . 1 . 2]" 1
240 1 19 ILE HG12 1 47 ASP HA . . 4.500 3.960 3.408 4.556 0.056 4 0 "[ . 1 . 2]" 1
241 1 19 ILE HG13 1 47 ASP HA . . 4.500 2.434 2.042 3.152 . 0 0 "[ . 1 . 2]" 1
242 1 19 ILE MG 1 20 LYS H . . 4.300 3.574 3.460 3.647 . 0 0 "[ . 1 . 2]" 1
243 1 19 ILE MG 1 26 CYS HA . . 5.100 3.108 2.555 3.481 . 0 0 "[ . 1 . 2]" 1
244 1 19 ILE MG 1 26 CYS HB2 . . 4.900 3.993 3.674 4.039 . 0 0 "[ . 1 . 2]" 1
245 1 19 ILE MG 1 26 CYS HB3 . . 3.600 2.614 2.300 2.690 . 0 0 "[ . 1 . 2]" 1
246 1 19 ILE MG 1 45 PHE QD . . 6.700 2.863 2.173 3.798 . 0 0 "[ . 1 . 2]" 1
247 1 19 ILE MG 1 71 PRO HA . . 6.000 2.982 2.327 3.450 . 0 0 "[ . 1 . 2]" 1
248 1 20 LYS H 1 20 LYS HB2 . . 4.100 3.769 3.495 3.965 . 0 0 "[ . 1 . 2]" 1
249 1 20 LYS H 1 23 CYS QB . . 5.800 3.441 2.760 4.951 . 0 0 "[ . 1 . 2]" 1
250 1 20 LYS H 1 26 CYS HB3 . . 5.000 3.213 2.952 3.687 . 0 0 "[ . 1 . 2]" 1
251 1 20 LYS HA 1 21 PRO HD2 . . 2.800 2.614 2.224 2.875 0.075 18 0 "[ . 1 . 2]" 1
252 1 20 LYS HA 1 21 PRO QD . . 2.510 2.166 2.055 2.307 . 0 0 "[ . 1 . 2]" 1
253 1 20 LYS HA 1 21 PRO HD3 . . 2.800 2.348 2.125 2.555 . 0 0 "[ . 1 . 2]" 1
254 1 20 LYS HA 1 49 THR MG . . 4.100 2.654 2.255 3.279 . 0 0 "[ . 1 . 2]" 1
255 1 20 LYS HB2 1 21 PRO QD . . 4.980 2.417 1.927 3.110 . 0 0 "[ . 1 . 2]" 1
256 1 20 LYS HB2 1 23 CYS H . . 4.400 4.104 3.349 4.486 0.086 19 0 "[ . 1 . 2]" 1
257 1 20 LYS HB2 1 23 CYS QB . . 5.100 4.122 2.975 4.638 . 0 0 "[ . 1 . 2]" 1
258 1 20 LYS HB2 1 49 THR MG . . 3.400 2.566 2.225 2.901 . 0 0 "[ . 1 . 2]" 1
259 1 20 LYS HB3 1 49 THR MG . . 4.500 2.523 1.912 3.639 . 0 0 "[ . 1 . 2]" 1
260 1 20 LYS QE 1 48 ILE MD . . 5.300 2.814 1.945 3.774 . 0 0 "[ . 1 . 2]" 1
261 1 20 LYS QE 1 49 THR MG . . 7.000 3.165 2.164 4.543 . 0 0 "[ . 1 . 2]" 1
262 1 20 LYS QE 1 54 THR MG . . 5.900 3.812 2.788 4.277 . 0 0 "[ . 1 . 2]" 1
263 1 20 LYS QE 1 70 VAL MG2 . . 6.400 2.936 1.905 4.411 . 0 0 "[ . 1 . 2]" 1
264 1 21 PRO QD 1 49 THR MG . . 3.660 2.077 1.844 2.438 . 0 0 "[ . 1 . 2]" 1
265 1 21 PRO HD2 1 49 THR MG . . 4.100 2.176 1.971 2.518 . 0 0 "[ . 1 . 2]" 1
266 1 21 PRO HD3 1 49 THR MG . . 4.100 2.823 2.075 3.377 . 0 0 "[ . 1 . 2]" 1
267 1 21 PRO QG 1 22 THR MG . . 5.600 2.536 2.110 3.244 . 0 0 "[ . 1 . 2]" 1
268 1 22 THR HA 1 22 THR HB . . 2.700 2.510 2.126 2.660 . 0 0 "[ . 1 . 2]" 1
269 1 22 THR HA 1 22 THR MG . . 3.400 2.396 2.201 3.007 . 0 0 "[ . 1 . 2]" 1
270 1 23 CYS H 1 23 CYS QB . . 3.500 2.368 2.019 2.918 . 0 0 "[ . 1 . 2]" 1
271 1 23 CYS H 1 26 CYS HB2 . . 5.000 3.802 3.228 4.915 . 0 0 "[ . 1 . 2]" 1
272 1 23 CYS HA 1 24 PRO HD2 . . 2.500 2.183 2.050 2.416 . 0 0 "[ . 1 . 2]" 1
273 1 23 CYS HA 1 24 PRO HD3 . . 2.500 2.504 2.231 2.575 0.075 20 0 "[ . 1 . 2]" 1
274 1 23 CYS QB 1 26 CYS H . . 5.000 2.485 1.823 3.133 . 0 0 "[ . 1 . 2]" 1
275 1 23 CYS QB 1 26 CYS HB2 . . 4.700 2.473 2.024 3.368 . 0 0 "[ . 1 . 2]" 1
276 1 23 CYS QB 1 26 CYS HB3 . . 5.500 3.865 3.453 4.807 . 0 0 "[ . 1 . 2]" 1
277 1 23 CYS QB 1 70 VAL MG2 . . 7.000 3.746 3.284 4.733 . 0 0 "[ . 1 . 2]" 1
278 1 24 PRO HA 1 27 ARG H . . 3.800 3.275 2.945 3.825 0.025 10 0 "[ . 1 . 2]" 1
279 1 24 PRO HA 1 27 ARG QB . . 4.000 2.463 2.133 3.268 . 0 0 "[ . 1 . 2]" 1
280 1 24 PRO HA 1 27 ARG QD . . 6.000 3.357 2.213 4.480 . 0 0 "[ . 1 . 2]" 1
281 1 24 PRO HA 1 28 ARG H . . 4.900 4.109 3.670 4.963 0.063 6 0 "[ . 1 . 2]" 1
282 1 24 PRO QD 1 25 TYR H . . 4.530 2.581 2.285 2.801 . 0 0 "[ . 1 . 2]" 1
283 1 24 PRO HD2 1 25 TYR H . . 5.000 2.622 2.310 2.860 . 0 0 "[ . 1 . 2]" 1
284 1 24 PRO HD3 1 25 TYR H . . 5.000 3.856 3.631 4.010 . 0 0 "[ . 1 . 2]" 1
285 1 24 PRO QG 1 25 TYR H . . 5.150 2.736 2.299 3.174 . 0 0 "[ . 1 . 2]" 1
286 1 25 TYR H 1 25 TYR HB2 . . 3.300 2.448 2.267 2.562 . 0 0 "[ . 1 . 2]" 1
287 1 25 TYR H 1 25 TYR HB3 . . 4.100 3.587 3.468 3.669 . 0 0 "[ . 1 . 2]" 1
288 1 25 TYR H 1 26 CYS H . . 2.700 2.448 2.155 2.697 . 0 0 "[ . 1 . 2]" 1
289 1 25 TYR HA 1 28 ARG H . . 3.900 3.298 3.019 3.717 . 0 0 "[ . 1 . 2]" 1
290 1 25 TYR HA 1 28 ARG HB2 . . 3.800 3.353 2.710 3.822 0.022 13 0 "[ . 1 . 2]" 1
291 1 25 TYR HA 1 28 ARG QB . . 3.310 2.739 2.260 3.060 . 0 0 "[ . 1 . 2]" 1
292 1 25 TYR HA 1 28 ARG HB3 . . 3.800 2.928 2.420 3.482 . 0 0 "[ . 1 . 2]" 1
293 1 25 TYR HA 1 29 ALA H . . 4.600 4.022 3.616 4.611 0.011 6 0 "[ . 1 . 2]" 1
294 1 25 TYR HB2 1 26 CYS H . . 3.900 2.738 2.345 3.194 . 0 0 "[ . 1 . 2]" 1
295 1 25 TYR HB2 1 71 PRO HD2 . . 4.700 3.297 2.597 4.080 . 0 0 "[ . 1 . 2]" 1
296 1 25 TYR HB2 1 71 PRO QD . . 4.470 2.597 2.149 3.338 . 0 0 "[ . 1 . 2]" 1
297 1 25 TYR HB2 1 71 PRO HD3 . . 4.700 2.732 2.292 3.542 . 0 0 "[ . 1 . 2]" 1
298 1 25 TYR HB3 1 26 CYS H . . 4.700 3.753 3.523 3.972 . 0 0 "[ . 1 . 2]" 1
299 1 25 TYR HB3 1 71 PRO HD2 . . 5.000 2.683 2.286 3.508 . 0 0 "[ . 1 . 2]" 1
300 1 25 TYR HB3 1 71 PRO HD3 . . 5.000 2.843 2.332 3.359 . 0 0 "[ . 1 . 2]" 1
301 1 26 CYS H 1 26 CYS HB2 . . 3.200 2.393 2.277 2.543 . 0 0 "[ . 1 . 2]" 1
302 1 26 CYS H 1 27 ARG H . . 3.200 2.654 2.390 2.866 . 0 0 "[ . 1 . 2]" 1
303 1 26 CYS H 1 71 PRO QD . . 5.880 3.053 2.717 3.360 . 0 0 "[ . 1 . 2]" 1
304 1 26 CYS HA 1 29 ALA H . . 4.400 3.548 3.180 3.839 . 0 0 "[ . 1 . 2]" 1
305 1 26 CYS HA 1 29 ALA MB . . 3.800 2.653 2.460 2.925 . 0 0 "[ . 1 . 2]" 1
306 1 26 CYS HA 1 71 PRO HB2 . . 5.000 3.796 3.588 4.410 . 0 0 "[ . 1 . 2]" 1
307 1 26 CYS HA 1 71 PRO QB . . 4.400 2.287 2.088 2.924 . 0 0 "[ . 1 . 2]" 1
308 1 26 CYS HA 1 71 PRO HB3 . . 5.000 2.307 2.099 2.967 . 0 0 "[ . 1 . 2]" 1
309 1 26 CYS HB2 1 27 ARG H . . 3.300 2.587 2.275 3.023 . 0 0 "[ . 1 . 2]" 1
310 1 26 CYS HB3 1 27 ARG H . . 4.200 3.460 3.226 3.814 . 0 0 "[ . 1 . 2]" 1
311 1 27 ARG H 1 27 ARG QB . . 3.600 2.239 2.042 2.428 . 0 0 "[ . 1 . 2]" 1
312 1 27 ARG H 1 27 ARG HG2 . . 5.000 4.366 3.784 4.558 . 0 0 "[ . 1 . 2]" 1
313 1 27 ARG H 1 27 ARG QG . . 4.490 3.626 2.459 3.998 . 0 0 "[ . 1 . 2]" 1
314 1 27 ARG H 1 27 ARG HG3 . . 5.000 3.936 2.491 4.463 . 0 0 "[ . 1 . 2]" 1
315 1 27 ARG H 1 28 ARG H . . 3.200 2.943 2.684 3.110 . 0 0 "[ . 1 . 2]" 1
316 1 27 ARG HA 1 27 ARG HG2 . . 2.700 2.668 2.328 2.787 0.087 3 0 "[ . 1 . 2]" 1
317 1 27 ARG HA 1 27 ARG HG3 . . 2.700 2.561 2.370 2.778 0.078 4 0 "[ . 1 . 2]" 1
318 1 27 ARG QB 1 28 ARG H . . 4.300 2.564 2.363 2.818 . 0 0 "[ . 1 . 2]" 1
319 1 27 ARG QD 1 28 ARG QB . . 6.880 5.383 4.891 5.568 . 0 0 "[ . 1 . 2]" 1
320 1 28 ARG H 1 28 ARG HB2 . . 3.100 2.533 2.413 2.674 . 0 0 "[ . 1 . 2]" 1
321 1 28 ARG H 1 28 ARG HB3 . . 3.100 2.619 2.361 2.785 . 0 0 "[ . 1 . 2]" 1
322 1 28 ARG H 1 29 ALA H . . 3.000 2.851 2.679 2.952 . 0 0 "[ . 1 . 2]" 1
323 1 28 ARG HA 1 28 ARG HD2 . . 5.000 3.611 2.128 4.497 . 0 0 "[ . 1 . 2]" 1
324 1 28 ARG HA 1 28 ARG QD . . 4.350 3.313 2.087 3.794 . 0 0 "[ . 1 . 2]" 1
325 1 28 ARG HA 1 28 ARG HD3 . . 5.000 4.091 2.881 4.736 . 0 0 "[ . 1 . 2]" 1
326 1 28 ARG HA 1 31 GLU H . . 3.900 3.480 3.177 3.745 . 0 0 "[ . 1 . 2]" 1
327 1 28 ARG QB 1 29 ALA H . . 3.290 2.167 2.122 2.228 . 0 0 "[ . 1 . 2]" 1
328 1 28 ARG HB2 1 29 ALA H . . 3.500 3.585 3.577 3.592 0.092 13 0 "[ . 1 . 2]" 1
329 1 28 ARG HB3 1 29 ALA H . . 3.500 2.186 2.138 2.251 . 0 0 "[ . 1 . 2]" 1
330 1 28 ARG QD 1 87 VAL MG2 . . 6.880 3.507 2.892 4.796 . 0 0 "[ . 1 . 2]" 1
331 1 28 ARG QG 1 29 ALA H . . 6.000 3.270 2.825 3.505 . 0 0 "[ . 1 . 2]" 1
332 1 28 ARG QG 1 32 ILE MD . . 4.700 1.968 1.889 2.059 . 0 0 "[ . 1 . 2]" 1
333 1 28 ARG QG 1 32 ILE MG . . 5.200 3.853 3.715 3.916 . 0 0 "[ . 1 . 2]" 1
334 1 29 ALA H 1 29 ALA MB . . 3.400 2.309 2.266 2.362 . 0 0 "[ . 1 . 2]" 1
335 1 29 ALA H 1 30 GLN H . . 3.300 3.011 2.895 3.126 . 0 0 "[ . 1 . 2]" 1
336 1 29 ALA HA 1 32 ILE H . . 3.600 3.642 3.543 3.671 0.071 16 0 "[ . 1 . 2]" 1
337 1 29 ALA HA 1 32 ILE HB . . 3.200 2.246 2.142 2.366 . 0 0 "[ . 1 . 2]" 1
338 1 29 ALA HA 1 32 ILE MD . . 4.000 3.021 2.946 3.046 . 0 0 "[ . 1 . 2]" 1
339 1 29 ALA HA 1 86 LEU QD . . 4.970 2.361 2.068 2.680 . 0 0 "[ . 1 . 2]" 1
340 1 29 ALA MB 1 30 GLN H . . 3.400 2.690 2.616 2.734 . 0 0 "[ . 1 . 2]" 1
341 1 29 ALA MB 1 71 PRO HB2 . . 5.800 2.890 2.470 3.631 . 0 0 "[ . 1 . 2]" 1
342 1 29 ALA MB 1 71 PRO QB . . 5.580 2.596 2.219 3.187 . 0 0 "[ . 1 . 2]" 1
343 1 29 ALA MB 1 71 PRO HB3 . . 5.800 2.945 2.500 3.530 . 0 0 "[ . 1 . 2]" 1
344 1 29 ALA MB 1 71 PRO QG . . 4.600 1.984 1.891 2.112 . 0 0 "[ . 1 . 2]" 1
345 1 30 GLN H 1 30 GLN HA . . 2.900 2.761 2.675 2.865 . 0 0 "[ . 1 . 2]" 1
346 1 30 GLN H 1 30 GLN HB2 . . 2.900 2.073 1.925 2.195 . 0 0 "[ . 1 . 2]" 1
347 1 30 GLN H 1 30 GLN HB3 . . 3.400 3.306 2.918 3.467 0.067 10 0 "[ . 1 . 2]" 1
348 1 30 GLN H 1 30 GLN HG2 . . 5.000 4.328 4.036 4.477 . 0 0 "[ . 1 . 2]" 1
349 1 30 GLN H 1 30 GLN HG3 . . 3.500 3.532 3.008 3.597 0.097 16 0 "[ . 1 . 2]" 1
350 1 30 GLN H 1 31 GLU H . . 2.900 2.947 2.808 2.979 0.079 6 0 "[ . 1 . 2]" 1
351 1 30 GLN HA 1 30 GLN HB2 . . 3.000 2.952 2.719 3.049 0.049 10 0 "[ . 1 . 2]" 1
352 1 30 GLN HA 1 30 GLN HB3 . . 2.900 2.841 2.682 2.980 0.080 16 0 "[ . 1 . 2]" 1
353 1 30 GLN HA 1 30 GLN HG2 . . 3.900 3.141 2.671 3.481 . 0 0 "[ . 1 . 2]" 1
354 1 30 GLN HA 1 30 GLN HG3 . . 3.200 1.994 1.933 2.057 . 0 0 "[ . 1 . 2]" 1
355 1 30 GLN HA 1 33 LEU H . . 4.000 3.646 3.437 3.786 . 0 0 "[ . 1 . 2]" 1
356 1 30 GLN HA 1 33 LEU HB2 . . 4.100 3.172 2.765 3.551 . 0 0 "[ . 1 . 2]" 1
357 1 30 GLN HA 1 34 SER H . . 3.800 3.555 3.160 3.738 . 0 0 "[ . 1 . 2]" 1
358 1 30 GLN HA 1 45 PHE QE . . 5.700 2.725 2.491 3.088 . 0 0 "[ . 1 . 2]" 1
359 1 30 GLN HA 1 45 PHE HZ . . 3.200 2.949 2.430 3.273 0.073 10 0 "[ . 1 . 2]" 1
360 1 30 GLN HB2 1 31 GLU H . . 3.400 3.107 2.844 3.442 0.042 16 0 "[ . 1 . 2]" 1
361 1 30 GLN HB3 1 30 GLN HG2 . . 2.900 2.279 2.183 2.442 . 0 0 "[ . 1 . 2]" 1
362 1 30 GLN HB3 1 31 GLU H . . 3.300 2.967 2.474 3.372 0.072 5 0 "[ . 1 . 2]" 1
363 1 30 GLN HG3 1 31 GLU H . . 5.000 4.838 4.718 4.967 . 0 0 "[ . 1 . 2]" 1
364 1 30 GLN HG3 1 34 SER H . . 5.000 5.093 5.082 5.102 0.102 5 0 "[ . 1 . 2]" 1
365 1 31 GLU H 1 31 GLU HB3 . . 3.100 2.785 2.156 3.180 0.080 13 0 "[ . 1 . 2]" 1
366 1 31 GLU H 1 31 GLU HG2 . . 4.300 3.030 1.939 4.366 0.066 17 0 "[ . 1 . 2]" 1
367 1 31 GLU H 1 31 GLU QG . . 3.820 2.744 1.923 3.588 . 0 0 "[ . 1 . 2]" 1
368 1 31 GLU H 1 31 GLU HG3 . . 4.300 3.563 2.546 4.208 . 0 0 "[ . 1 . 2]" 1
369 1 31 GLU H 1 32 ILE H . . 3.200 2.498 2.389 2.708 . 0 0 "[ . 1 . 2]" 1
370 1 31 GLU H 1 33 LEU H . . 4.000 4.070 4.043 4.078 0.078 8 0 "[ . 1 . 2]" 1
371 1 31 GLU HA 1 34 SER H . . 3.400 3.480 3.463 3.491 0.091 18 0 "[ . 1 . 2]" 1
372 1 31 GLU HB2 1 32 ILE H . . 3.900 3.552 2.920 3.975 0.075 16 0 "[ . 1 . 2]" 1
373 1 31 GLU HB3 1 32 ILE H . . 3.900 3.363 2.227 3.978 0.078 20 0 "[ . 1 . 2]" 1
374 1 32 ILE H 1 32 ILE HB . . 2.500 2.127 2.037 2.206 . 0 0 "[ . 1 . 2]" 1
375 1 32 ILE H 1 32 ILE MD . . 4.700 3.804 3.699 3.953 . 0 0 "[ . 1 . 2]" 1
376 1 32 ILE H 1 32 ILE QG . . 4.580 2.518 2.392 2.606 . 0 0 "[ . 1 . 2]" 1
377 1 32 ILE H 1 33 LEU H . . 2.900 2.872 2.703 2.959 0.059 1 0 "[ . 1 . 2]" 1
378 1 32 ILE H 1 86 LEU QD . . 7.270 4.754 4.534 5.033 . 0 0 "[ . 1 . 2]" 1
379 1 32 ILE HA 1 32 ILE HG12 . . 3.400 2.270 2.216 2.373 . 0 0 "[ . 1 . 2]" 1
380 1 32 ILE HA 1 32 ILE QG . . 3.040 2.172 2.133 2.238 . 0 0 "[ . 1 . 2]" 1
381 1 32 ILE HA 1 32 ILE HG13 . . 3.400 2.777 2.676 2.871 . 0 0 "[ . 1 . 2]" 1
382 1 32 ILE HA 1 32 ILE MG . . 3.400 2.785 2.702 2.864 . 0 0 "[ . 1 . 2]" 1
383 1 32 ILE HB 1 33 LEU H . . 3.100 2.667 2.568 2.782 . 0 0 "[ . 1 . 2]" 1
384 1 32 ILE HB 1 34 SER H . . 5.000 5.074 5.052 5.082 0.082 3 0 "[ . 1 . 2]" 1
385 1 32 ILE HB 1 86 LEU QD . . 6.670 3.180 2.952 3.382 . 0 0 "[ . 1 . 2]" 1
386 1 32 ILE MD 1 87 VAL H . . 6.000 4.250 3.938 4.694 . 0 0 "[ . 1 . 2]" 1
387 1 32 ILE MD 1 87 VAL HA . . 3.600 2.737 2.347 2.933 . 0 0 "[ . 1 . 2]" 1
388 1 32 ILE MG 1 33 LEU H . . 3.900 2.704 2.584 2.801 . 0 0 "[ . 1 . 2]" 1
389 1 32 ILE MG 1 33 LEU HA . . 3.800 2.953 2.901 3.011 . 0 0 "[ . 1 . 2]" 1
390 1 32 ILE MG 1 90 GLN HE21 . . 6.000 3.394 2.282 4.856 . 0 0 "[ . 1 . 2]" 1
391 1 32 ILE MG 1 90 GLN HE22 . . 5.900 3.859 2.626 4.762 . 0 0 "[ . 1 . 2]" 1
392 1 32 ILE MG 1 90 GLN HG2 . . 6.000 3.734 2.196 4.621 . 0 0 "[ . 1 . 2]" 1
393 1 32 ILE MG 1 90 GLN HG3 . . 6.000 2.910 2.185 3.998 . 0 0 "[ . 1 . 2]" 1
394 1 33 LEU H 1 33 LEU HB2 . . 3.000 2.339 2.283 2.445 . 0 0 "[ . 1 . 2]" 1
395 1 33 LEU H 1 33 LEU HB3 . . 3.600 3.576 3.514 3.647 0.047 2 0 "[ . 1 . 2]" 1
396 1 33 LEU H 1 33 LEU HG . . 3.400 3.202 2.902 3.453 0.053 8 0 "[ . 1 . 2]" 1
397 1 33 LEU H 1 34 SER H . . 3.200 2.603 2.459 2.714 . 0 0 "[ . 1 . 2]" 1
398 1 33 LEU HA 1 33 LEU HG . . 3.100 2.873 2.606 3.159 0.059 9 0 "[ . 1 . 2]" 1
399 1 33 LEU HA 1 36 LEU H . . 4.800 3.907 3.503 4.289 . 0 0 "[ . 1 . 2]" 1
400 1 33 LEU HA 1 36 LEU QD . . 5.070 2.985 2.408 3.489 . 0 0 "[ . 1 . 2]" 1
401 1 33 LEU HA 1 36 LEU HG . . 4.200 3.607 2.935 4.277 0.077 7 0 "[ . 1 . 2]" 1
402 1 33 LEU HA 1 38 ILE MD . . 5.200 3.765 3.489 4.106 . 0 0 "[ . 1 . 2]" 1
403 1 33 LEU HB2 1 34 SER H . . 3.600 2.837 2.423 3.139 . 0 0 "[ . 1 . 2]" 1
404 1 33 LEU HB2 1 43 LEU QD . . 7.270 3.132 2.846 3.366 . 0 0 "[ . 1 . 2]" 1
405 1 33 LEU HB3 1 43 LEU QD . . 5.470 2.189 2.036 2.314 . 0 0 "[ . 1 . 2]" 1
406 1 33 LEU HG 1 73 VAL MG2 . . 4.000 3.248 3.175 3.301 . 0 0 "[ . 1 . 2]" 1
407 1 34 SER H 1 34 SER QB . . 3.700 2.316 2.137 2.549 . 0 0 "[ . 1 . 2]" 1
408 1 34 SER H 1 35 GLN H . . 3.100 2.865 2.663 3.086 . 0 0 "[ . 1 . 2]" 1
409 1 34 SER HA 1 43 LEU HG . . 3.700 3.686 3.422 3.777 0.077 8 0 "[ . 1 . 2]" 1
410 1 35 GLN H 1 35 GLN HB2 . . 2.800 2.308 2.136 2.608 . 0 0 "[ . 1 . 2]" 1
411 1 35 GLN H 1 35 GLN HB3 . . 3.700 3.556 3.441 3.667 . 0 0 "[ . 1 . 2]" 1
412 1 35 GLN H 1 35 GLN HG2 . . 4.200 3.357 2.437 4.151 . 0 0 "[ . 1 . 2]" 1
413 1 35 GLN H 1 35 GLN HG3 . . 4.300 3.128 2.671 3.870 . 0 0 "[ . 1 . 2]" 1
414 1 35 GLN H 1 36 LEU H . . 2.700 2.667 2.538 2.771 0.071 12 0 "[ . 1 . 2]" 1
415 1 35 GLN HA 1 35 GLN HB3 . . 3.000 2.599 2.408 2.766 . 0 0 "[ . 1 . 2]" 1
416 1 35 GLN HA 1 35 GLN HG2 . . 3.300 2.587 2.152 3.339 0.039 16 0 "[ . 1 . 2]" 1
417 1 35 GLN HA 1 35 GLN HG3 . . 4.000 3.247 2.504 3.824 . 0 0 "[ . 1 . 2]" 1
418 1 35 GLN HA 1 36 LEU H . . 3.500 3.505 3.360 3.568 0.068 2 0 "[ . 1 . 2]" 1
419 1 36 LEU H 1 36 LEU HB2 . . 3.000 2.365 2.275 2.442 . 0 0 "[ . 1 . 2]" 1
420 1 36 LEU H 1 36 LEU HB3 . . 3.500 3.567 3.524 3.581 0.081 9 0 "[ . 1 . 2]" 1
421 1 36 LEU H 1 36 LEU QD . . 4.970 3.131 2.116 3.522 . 0 0 "[ . 1 . 2]" 1
422 1 36 LEU H 1 36 LEU HG . . 3.700 2.699 2.313 3.783 0.083 2 0 "[ . 1 . 2]" 1
423 1 36 LEU H 1 38 ILE MD . . 6.000 3.607 3.371 3.914 . 0 0 "[ . 1 . 2]" 1
424 1 36 LEU HA 1 37 PRO HD2 . . 2.700 2.447 2.321 2.617 . 0 0 "[ . 1 . 2]" 1
425 1 36 LEU HA 1 37 PRO QD . . 2.400 2.094 2.028 2.155 . 0 0 "[ . 1 . 2]" 1
426 1 36 LEU HA 1 37 PRO HD3 . . 2.700 2.286 2.195 2.522 . 0 0 "[ . 1 . 2]" 1
427 1 36 LEU HB2 1 37 PRO QD . . 5.880 3.898 3.659 4.035 . 0 0 "[ . 1 . 2]" 1
428 1 36 LEU HB3 1 37 PRO HD2 . . 3.900 2.659 2.330 2.936 . 0 0 "[ . 1 . 2]" 1
429 1 36 LEU HB3 1 37 PRO QD . . 3.370 2.612 2.302 2.862 . 0 0 "[ . 1 . 2]" 1
430 1 36 LEU HB3 1 37 PRO HD3 . . 3.900 3.857 3.549 3.970 0.070 20 0 "[ . 1 . 2]" 1
431 1 36 LEU QD 1 37 PRO QD . . 5.200 2.757 2.300 3.160 . 0 0 "[ . 1 . 2]" 1
432 1 36 LEU MD1 1 37 PRO HD2 . . 7.140 4.168 2.479 4.683 . 0 0 "[ . 1 . 2]" 1
433 1 36 LEU MD1 1 37 PRO HD3 . . 7.140 5.137 3.336 5.497 . 0 0 "[ . 1 . 2]" 1
434 1 36 LEU MD2 1 37 PRO HD2 . . 7.140 3.153 2.378 4.434 . 0 0 "[ . 1 . 2]" 1
435 1 36 LEU MD2 1 37 PRO HD3 . . 7.140 3.636 3.176 4.856 . 0 0 "[ . 1 . 2]" 1
436 1 37 PRO HA 1 38 ILE H . . 2.700 2.411 2.214 2.758 0.058 14 0 "[ . 1 . 2]" 1
437 1 37 PRO QD 1 96 LEU QD . . 6.690 3.323 2.535 3.921 . 0 0 "[ . 1 . 2]" 1
438 1 37 PRO QD 1 105 LEU QD . . 6.720 2.665 2.125 3.341 . 0 0 "[ . 1 . 2]" 1
439 1 37 PRO HD2 1 96 LEU MD1 . . 7.750 3.995 2.585 5.610 . 0 0 "[ . 1 . 2]" 1
440 1 37 PRO HD2 1 96 LEU MD2 . . 7.750 4.641 3.141 5.504 . 0 0 "[ . 1 . 2]" 1
441 1 37 PRO HD2 1 105 LEU MD1 . . 9.140 3.416 2.146 4.491 . 0 0 "[ . 1 . 2]" 1
442 1 37 PRO HD2 1 105 LEU MD2 . . 9.140 3.335 2.269 4.637 . 0 0 "[ . 1 . 2]" 1
443 1 37 PRO HD3 1 96 LEU MD1 . . 7.750 5.118 3.789 6.420 . 0 0 "[ . 1 . 2]" 1
444 1 37 PRO HD3 1 96 LEU MD2 . . 7.750 5.686 4.417 6.401 . 0 0 "[ . 1 . 2]" 1
445 1 37 PRO HD3 1 105 LEU MD1 . . 9.140 4.834 3.565 5.860 . 0 0 "[ . 1 . 2]" 1
446 1 37 PRO HD3 1 105 LEU MD2 . . 9.140 4.786 3.756 6.067 . 0 0 "[ . 1 . 2]" 1
447 1 38 ILE H 1 38 ILE HB . . 2.600 2.267 2.077 2.647 0.047 6 0 "[ . 1 . 2]" 1
448 1 38 ILE H 1 38 ILE MD . . 4.700 3.372 2.208 3.878 . 0 0 "[ . 1 . 2]" 1
449 1 38 ILE H 1 38 ILE HG12 . . 5.000 4.254 3.911 4.913 . 0 0 "[ . 1 . 2]" 1
450 1 38 ILE H 1 38 ILE QG . . 4.440 3.129 2.621 3.947 . 0 0 "[ . 1 . 2]" 1
451 1 38 ILE H 1 38 ILE HG13 . . 5.000 3.234 2.663 4.159 . 0 0 "[ . 1 . 2]" 1
452 1 38 ILE H 1 38 ILE MG . . 4.500 3.669 3.611 3.737 . 0 0 "[ . 1 . 2]" 1
453 1 38 ILE H 1 105 LEU QD . . 7.570 3.981 3.071 4.737 . 0 0 "[ . 1 . 2]" 1
454 1 38 ILE HA 1 38 ILE MD . . 4.800 3.664 3.034 3.865 . 0 0 "[ . 1 . 2]" 1
455 1 38 ILE HA 1 38 ILE HG12 . . 3.800 2.842 2.479 3.611 . 0 0 "[ . 1 . 2]" 1
456 1 38 ILE HA 1 38 ILE QG . . 3.550 2.293 2.222 2.392 . 0 0 "[ . 1 . 2]" 1
457 1 38 ILE HA 1 38 ILE HG13 . . 3.800 2.503 2.266 2.697 . 0 0 "[ . 1 . 2]" 1
458 1 38 ILE HA 1 38 ILE MG . . 3.400 2.734 2.645 2.808 . 0 0 "[ . 1 . 2]" 1
459 1 38 ILE HA 1 39 LYS H . . 2.600 2.298 2.158 2.380 . 0 0 "[ . 1 . 2]" 1
460 1 38 ILE HA 1 104 ALA MB . . 4.600 2.858 2.412 3.340 . 0 0 "[ . 1 . 2]" 1
461 1 38 ILE HA 1 105 LEU QD . . 4.970 2.574 2.163 3.143 . 0 0 "[ . 1 . 2]" 1
462 1 38 ILE HA 1 106 GLN H . . 4.200 4.101 3.332 4.301 0.101 6 0 "[ . 1 . 2]" 1
463 1 38 ILE HA 1 106 GLN QB . . 5.680 4.863 4.009 5.184 . 0 0 "[ . 1 . 2]" 1
464 1 38 ILE HB 1 42 LEU QD . . 7.570 5.134 4.929 5.462 . 0 0 "[ . 1 . 2]" 1
465 1 38 ILE MD 1 39 LYS H . . 6.000 5.023 4.836 5.102 . 0 0 "[ . 1 . 2]" 1
466 1 38 ILE MG 1 39 LYS H . . 3.400 2.585 2.436 2.669 . 0 0 "[ . 1 . 2]" 1
467 1 38 ILE MG 1 43 LEU H . . 5.200 3.123 2.772 3.612 . 0 0 "[ . 1 . 2]" 1
468 1 38 ILE MG 1 43 LEU HA . . 6.000 3.813 3.431 4.095 . 0 0 "[ . 1 . 2]" 1
469 1 38 ILE MG 1 104 ALA HA . . 4.700 3.211 2.976 3.413 . 0 0 "[ . 1 . 2]" 1
470 1 39 LYS H 1 39 LYS HB2 . . 3.200 2.241 2.089 2.630 . 0 0 "[ . 1 . 2]" 1
471 1 39 LYS H 1 39 LYS HB3 . . 3.800 3.507 3.403 3.675 . 0 0 "[ . 1 . 2]" 1
472 1 39 LYS H 1 39 LYS QD . . 6.000 4.311 3.421 4.619 . 0 0 "[ . 1 . 2]" 1
473 1 39 LYS H 1 39 LYS QE . . 6.000 4.819 4.368 5.051 . 0 0 "[ . 1 . 2]" 1
474 1 39 LYS H 1 39 LYS HG2 . . 3.600 3.003 2.594 3.694 0.094 17 0 "[ . 1 . 2]" 1
475 1 39 LYS H 1 39 LYS QG . . 3.390 2.781 2.409 2.920 . 0 0 "[ . 1 . 2]" 1
476 1 39 LYS H 1 39 LYS HG3 . . 3.600 3.480 2.441 3.689 0.089 5 0 "[ . 1 . 2]" 1
477 1 39 LYS H 1 42 LEU QD . . 7.570 3.167 2.919 3.327 . 0 0 "[ . 1 . 2]" 1
478 1 39 LYS H 1 104 ALA HA . . 4.900 2.500 2.214 2.636 . 0 0 "[ . 1 . 2]" 1
479 1 39 LYS H 1 104 ALA MB . . 6.000 3.063 2.786 3.376 . 0 0 "[ . 1 . 2]" 1
480 1 39 LYS H 1 105 LEU HA . . 4.100 3.525 3.266 4.102 0.002 6 0 "[ . 1 . 2]" 1
481 1 39 LYS H 1 105 LEU QD . . 7.570 4.133 3.760 4.742 . 0 0 "[ . 1 . 2]" 1
482 1 39 LYS HA 1 39 LYS QE . . 5.500 3.945 3.374 4.755 . 0 0 "[ . 1 . 2]" 1
483 1 39 LYS HA 1 104 ALA HA . . 4.500 4.597 4.587 4.607 0.107 17 0 "[ . 1 . 2]" 1
484 1 39 LYS HB2 1 42 LEU QD . . 5.070 2.212 2.100 2.397 . 0 0 "[ . 1 . 2]" 1
485 1 39 LYS HB3 1 40 GLN H . . 3.400 3.406 2.832 3.477 0.077 14 0 "[ . 1 . 2]" 1
486 1 39 LYS QD 1 104 ALA HA . . 6.000 4.881 2.390 5.364 . 0 0 "[ . 1 . 2]" 1
487 1 39 LYS QD 1 106 GLN H . . 6.000 5.354 4.957 5.474 . 0 0 "[ . 1 . 2]" 1
488 1 39 LYS QE 1 42 LEU QD . . 8.570 3.087 2.209 3.809 . 0 0 "[ . 1 . 2]" 1
489 1 39 LYS QE 1 104 ALA HA . . 6.000 4.658 3.677 5.270 . 0 0 "[ . 1 . 2]" 1
490 1 40 GLN H 1 40 GLN HB2 . . 3.200 2.340 2.169 2.562 . 0 0 "[ . 1 . 2]" 1
491 1 40 GLN H 1 40 GLN HB3 . . 3.100 2.759 2.506 3.083 . 0 0 "[ . 1 . 2]" 1
492 1 40 GLN H 1 42 LEU HG . . 5.000 4.805 4.210 5.028 0.028 14 0 "[ . 1 . 2]" 1
493 1 40 GLN HA 1 41 GLY H . . 2.600 2.234 2.143 2.424 . 0 0 "[ . 1 . 2]" 1
494 1 40 GLN HA 1 42 LEU H . . 4.500 3.493 3.174 4.212 . 0 0 "[ . 1 . 2]" 1
495 1 40 GLN QG 1 41 GLY H . . 6.000 2.877 1.943 4.048 . 0 0 "[ . 1 . 2]" 1
496 1 41 GLY H 1 42 LEU H . . 3.200 2.783 2.339 3.142 . 0 0 "[ . 1 . 2]" 1
497 1 41 GLY H 1 43 LEU H . . 4.100 3.375 2.937 4.179 0.079 18 0 "[ . 1 . 2]" 1
498 1 42 LEU H 1 42 LEU HB2 . . 3.700 2.519 2.438 2.611 . 0 0 "[ . 1 . 2]" 1
499 1 42 LEU H 1 42 LEU HB3 . . 3.500 3.584 3.576 3.588 0.088 5 0 "[ . 1 . 2]" 1
500 1 42 LEU H 1 42 LEU MD1 . . 4.700 3.989 3.935 4.033 . 0 0 "[ . 1 . 2]" 1
501 1 42 LEU H 1 42 LEU QD . . 4.220 2.975 2.830 3.196 . 0 0 "[ . 1 . 2]" 1
502 1 42 LEU H 1 42 LEU MD2 . . 4.700 3.075 2.897 3.371 . 0 0 "[ . 1 . 2]" 1
503 1 42 LEU H 1 42 LEU HG . . 4.000 2.629 2.508 2.721 . 0 0 "[ . 1 . 2]" 1
504 1 42 LEU H 1 43 LEU H . . 2.600 2.530 2.403 2.651 0.051 7 0 "[ . 1 . 2]" 1
505 1 42 LEU HA 1 42 LEU HB3 . . 2.600 2.388 2.323 2.474 . 0 0 "[ . 1 . 2]" 1
506 1 42 LEU HA 1 42 LEU MD1 . . 4.300 3.657 3.639 3.683 . 0 0 "[ . 1 . 2]" 1
507 1 42 LEU HA 1 42 LEU QD . . 3.540 2.179 2.112 2.256 . 0 0 "[ . 1 . 2]" 1
508 1 42 LEU HA 1 42 LEU MD2 . . 4.300 2.196 2.125 2.278 . 0 0 "[ . 1 . 2]" 1
509 1 42 LEU QD 1 104 ALA HA . . 4.280 2.071 1.994 2.125 . 0 0 "[ . 1 . 2]" 1
510 1 42 LEU MD1 1 104 ALA HA . . 5.200 2.075 1.997 2.130 . 0 0 "[ . 1 . 2]" 1
511 1 42 LEU MD2 1 104 ALA HA . . 5.200 4.355 4.322 4.408 . 0 0 "[ . 1 . 2]" 1
512 1 42 LEU HG 1 104 ALA HA . . 3.900 3.810 3.542 3.967 0.067 15 0 "[ . 1 . 2]" 1
513 1 43 LEU H 1 43 LEU HB2 . . 2.800 2.373 2.241 2.587 . 0 0 "[ . 1 . 2]" 1
514 1 43 LEU H 1 43 LEU HB3 . . 3.800 2.967 2.725 3.124 . 0 0 "[ . 1 . 2]" 1
515 1 43 LEU HA 1 43 LEU HB3 . . 2.900 2.964 2.936 2.975 0.075 9 0 "[ . 1 . 2]" 1
516 1 43 LEU HA 1 44 GLU H . . 2.500 2.231 2.162 2.265 . 0 0 "[ . 1 . 2]" 1
517 1 43 LEU QD 1 44 GLU H . . 4.970 2.534 2.356 2.704 . 0 0 "[ . 1 . 2]" 1
518 1 43 LEU QD 1 45 PHE HZ . . 6.170 2.845 2.555 3.472 . 0 0 "[ . 1 . 2]" 1
519 1 43 LEU QD 1 75 ILE MD . . 5.970 3.473 3.369 3.526 . 0 0 "[ . 1 . 2]" 1
520 1 43 LEU HG 1 44 GLU H . . 5.000 4.944 4.682 5.074 0.074 6 0 "[ . 1 . 2]" 1
521 1 43 LEU HG 1 45 PHE HZ . . 3.700 2.696 2.306 3.195 . 0 0 "[ . 1 . 2]" 1
522 1 44 GLU HA 1 44 GLU HG2 . . 2.800 2.857 2.604 2.890 0.090 19 0 "[ . 1 . 2]" 1
523 1 44 GLU HA 1 44 GLU QG . . 2.560 2.186 2.016 2.302 . 0 0 "[ . 1 . 2]" 1
524 1 44 GLU HA 1 44 GLU HG3 . . 2.800 2.273 2.057 2.431 . 0 0 "[ . 1 . 2]" 1
525 1 44 GLU HA 1 45 PHE H . . 2.500 2.137 2.019 2.316 . 0 0 "[ . 1 . 2]" 1
526 1 44 GLU QG 1 45 PHE H . . 4.210 2.956 2.139 3.477 . 0 0 "[ . 1 . 2]" 1
527 1 44 GLU QG 1 46 VAL MG2 . . 4.340 2.475 2.204 2.944 . 0 0 "[ . 1 . 2]" 1
528 1 44 GLU HG2 1 45 PHE H . . 4.400 3.275 2.211 3.949 . 0 0 "[ . 1 . 2]" 1
529 1 44 GLU HG2 1 46 VAL MG2 . . 5.200 2.502 2.223 2.993 . 0 0 "[ . 1 . 2]" 1
530 1 44 GLU HG3 1 45 PHE H . . 4.400 3.402 2.845 3.861 . 0 0 "[ . 1 . 2]" 1
531 1 44 GLU HG3 1 46 VAL MG2 . . 5.200 3.927 3.598 4.367 . 0 0 "[ . 1 . 2]" 1
532 1 45 PHE H 1 45 PHE HB2 . . 3.100 2.556 2.420 2.903 . 0 0 "[ . 1 . 2]" 1
533 1 45 PHE H 1 45 PHE HB3 . . 3.800 3.644 3.576 3.846 0.046 10 0 "[ . 1 . 2]" 1
534 1 45 PHE HA 1 46 VAL H . . 2.500 2.221 2.157 2.279 . 0 0 "[ . 1 . 2]" 1
535 1 45 PHE HB3 1 46 VAL H . . 4.700 3.709 3.238 4.031 . 0 0 "[ . 1 . 2]" 1
536 1 46 VAL H 1 46 VAL HB . . 3.000 2.447 2.347 2.564 . 0 0 "[ . 1 . 2]" 1
537 1 46 VAL H 1 46 VAL MG1 . . 4.400 3.769 3.713 3.793 . 0 0 "[ . 1 . 2]" 1
538 1 46 VAL H 1 46 VAL MG2 . . 3.500 2.499 2.151 2.766 . 0 0 "[ . 1 . 2]" 1
539 1 46 VAL HA 1 46 VAL MG1 . . 3.400 2.395 2.304 2.465 . 0 0 "[ . 1 . 2]" 1
540 1 46 VAL HA 1 46 VAL MG2 . . 3.400 2.421 2.333 2.516 . 0 0 "[ . 1 . 2]" 1
541 1 46 VAL HA 1 47 ASP H . . 2.500 2.178 2.129 2.288 . 0 0 "[ . 1 . 2]" 1
542 1 46 VAL MG1 1 47 ASP H . . 4.300 3.087 2.565 3.375 . 0 0 "[ . 1 . 2]" 1
543 1 47 ASP H 1 47 ASP HB2 . . 3.100 2.407 2.220 2.634 . 0 0 "[ . 1 . 2]" 1
544 1 47 ASP H 1 47 ASP HB3 . . 2.800 2.582 2.460 2.735 . 0 0 "[ . 1 . 2]" 1
545 1 47 ASP H 1 50 ALA MB . . 6.000 4.113 3.327 4.943 . 0 0 "[ . 1 . 2]" 1
546 1 47 ASP HA 1 48 ILE H . . 2.600 2.184 2.105 2.265 . 0 0 "[ . 1 . 2]" 1
547 1 47 ASP HB2 1 50 ALA MB . . 6.000 3.576 3.090 4.407 . 0 0 "[ . 1 . 2]" 1
548 1 47 ASP HB3 1 50 ALA MB . . 3.800 2.263 2.058 2.797 . 0 0 "[ . 1 . 2]" 1
549 1 48 ILE H 1 48 ILE HG12 . . 4.300 2.373 2.142 2.644 . 0 0 "[ . 1 . 2]" 1
550 1 48 ILE H 1 48 ILE QG . . 3.600 2.299 2.111 2.489 . 0 0 "[ . 1 . 2]" 1
551 1 48 ILE H 1 48 ILE HG13 . . 4.300 3.146 2.797 3.415 . 0 0 "[ . 1 . 2]" 1
552 1 48 ILE H 1 48 ILE MG . . 3.400 2.363 2.065 2.665 . 0 0 "[ . 1 . 2]" 1
553 1 48 ILE H 1 49 THR H . . 3.000 2.610 2.152 2.851 . 0 0 "[ . 1 . 2]" 1
554 1 48 ILE H 1 49 THR MG . . 5.800 3.753 3.162 4.338 . 0 0 "[ . 1 . 2]" 1
555 1 48 ILE HA 1 48 ILE HB . . 2.800 2.394 2.333 2.440 . 0 0 "[ . 1 . 2]" 1
556 1 48 ILE HA 1 48 ILE MG . . 3.400 2.313 2.226 2.410 . 0 0 "[ . 1 . 2]" 1
557 1 48 ILE HA 1 57 ILE MD . . 4.400 2.775 2.204 3.465 . 0 0 "[ . 1 . 2]" 1
558 1 48 ILE HA 1 57 ILE MG . . 5.100 3.602 2.427 4.066 . 0 0 "[ . 1 . 2]" 1
559 1 48 ILE HB 1 54 THR MG . . 5.100 4.292 3.806 4.390 . 0 0 "[ . 1 . 2]" 1
560 1 48 ILE HB 1 57 ILE MG . . 4.000 2.685 2.426 3.070 . 0 0 "[ . 1 . 2]" 1
561 1 48 ILE MD 1 58 GLN HG2 . . 4.200 2.416 2.163 3.101 . 0 0 "[ . 1 . 2]" 1
562 1 48 ILE MD 1 58 GLN QG . . 3.720 2.230 1.939 2.851 . 0 0 "[ . 1 . 2]" 1
563 1 48 ILE MD 1 58 GLN HG3 . . 4.200 2.978 2.032 3.593 . 0 0 "[ . 1 . 2]" 1
564 1 48 ILE MG 1 57 ILE MD . . 6.200 2.807 2.299 3.680 . 0 0 "[ . 1 . 2]" 1
565 1 48 ILE MG 1 57 ILE MG . . 4.400 2.010 1.901 2.318 . 0 0 "[ . 1 . 2]" 1
566 1 48 ILE MG 1 61 LEU QD . . 7.070 3.032 2.556 3.865 . 0 0 "[ . 1 . 2]" 1
567 1 49 THR H 1 49 THR MG . . 3.400 2.365 2.123 2.688 . 0 0 "[ . 1 . 2]" 1
568 1 49 THR H 1 50 ALA H . . 2.900 2.237 1.823 2.694 . 0 0 "[ . 1 . 2]" 1
569 1 49 THR H 1 50 ALA MB . . 6.000 3.903 3.608 4.205 . 0 0 "[ . 1 . 2]" 1
570 1 49 THR HA 1 49 THR HB . . 2.800 2.421 2.290 2.694 . 0 0 "[ . 1 . 2]" 1
571 1 50 ALA H 1 50 ALA MB . . 3.400 2.225 2.144 2.299 . 0 0 "[ . 1 . 2]" 1
572 1 50 ALA H 1 51 THR H . . 3.500 3.118 2.514 3.580 0.080 18 0 "[ . 1 . 2]" 1
573 1 51 THR H 1 52 ASN H . . 4.700 2.560 1.616 4.277 . 0 0 "[ . 1 . 2]" 1
574 1 51 THR HA 1 51 THR MG . . 3.500 2.572 2.141 3.074 . 0 0 "[ . 1 . 2]" 1
575 1 53 HIS H 1 54 THR H . . 3.400 3.137 2.352 3.485 0.085 9 0 "[ . 1 . 2]" 1
576 1 53 HIS HA 1 54 THR H . . 3.400 2.587 2.118 3.406 0.006 19 0 "[ . 1 . 2]" 1
577 1 53 HIS HA 1 56 GLU H . . 4.200 3.990 2.989 4.292 0.092 16 0 "[ . 1 . 2]" 1
578 1 53 HIS HB2 1 57 ILE MD . . 6.000 3.721 2.308 4.884 . 0 0 "[ . 1 . 2]" 1
579 1 53 HIS HB3 1 56 GLU HB2 . . 5.000 3.111 2.048 5.063 0.063 4 0 "[ . 1 . 2]" 1
580 1 53 HIS HB3 1 56 GLU QB . . 4.400 2.613 1.910 3.825 . 0 0 "[ . 1 . 2]" 1
581 1 53 HIS HB3 1 56 GLU HB3 . . 5.000 3.261 2.165 4.354 . 0 0 "[ . 1 . 2]" 1
582 1 53 HIS HB3 1 57 ILE MD . . 6.000 3.950 2.351 4.870 . 0 0 "[ . 1 . 2]" 1
583 1 54 THR H 1 54 THR HB . . 3.200 3.040 2.853 3.299 0.099 17 0 "[ . 1 . 2]" 1
584 1 54 THR H 1 55 ASN H . . 3.600 3.048 2.649 3.397 . 0 0 "[ . 1 . 2]" 1
585 1 54 THR HA 1 54 THR HB . . 2.800 2.185 2.107 2.264 . 0 0 "[ . 1 . 2]" 1
586 1 54 THR HA 1 54 THR MG . . 3.600 3.071 2.636 3.128 . 0 0 "[ . 1 . 2]" 1
587 1 54 THR HA 1 57 ILE HB . . 4.300 2.535 2.297 3.015 . 0 0 "[ . 1 . 2]" 1
588 1 54 THR HA 1 57 ILE MD . . 6.000 3.047 2.533 4.012 . 0 0 "[ . 1 . 2]" 1
589 1 54 THR HA 1 57 ILE MG . . 5.100 3.509 3.156 4.033 . 0 0 "[ . 1 . 2]" 1
590 1 54 THR HB 1 55 ASN H . . 3.700 3.789 3.773 3.799 0.099 6 0 "[ . 1 . 2]" 1
591 1 54 THR MG 1 58 GLN QG . . 5.980 4.444 4.251 4.565 . 0 0 "[ . 1 . 2]" 1
592 1 55 ASN H 1 56 GLU H . . 3.300 3.170 2.972 3.356 0.056 6 0 "[ . 1 . 2]" 1
593 1 55 ASN HA 1 58 GLN H . . 4.100 3.595 3.020 4.160 0.060 1 0 "[ . 1 . 2]" 1
594 1 55 ASN HA 1 58 GLN QB . . 4.880 2.692 1.959 4.303 . 0 0 "[ . 1 . 2]" 1
595 1 55 ASN QB 1 56 GLU H . . 4.500 2.781 2.475 3.506 . 0 0 "[ . 1 . 2]" 1
596 1 56 GLU H 1 56 GLU HG2 . . 3.900 3.637 2.754 3.978 0.078 5 0 "[ . 1 . 2]" 1
597 1 56 GLU H 1 56 GLU QG . . 3.700 3.219 2.706 3.479 . 0 0 "[ . 1 . 2]" 1
598 1 56 GLU H 1 56 GLU HG3 . . 3.900 3.772 2.901 3.992 0.092 6 0 "[ . 1 . 2]" 1
599 1 56 GLU HA 1 56 GLU HG2 . . 3.600 2.586 2.044 3.693 0.093 4 0 "[ . 1 . 2]" 1
600 1 56 GLU HA 1 56 GLU QG . . 3.340 2.383 2.020 3.140 . 0 0 "[ . 1 . 2]" 1
601 1 56 GLU HA 1 56 GLU HG3 . . 3.600 3.287 2.380 3.638 0.038 10 0 "[ . 1 . 2]" 1
602 1 56 GLU HA 1 59 ASP H . . 3.800 3.623 2.987 3.864 0.064 8 0 "[ . 1 . 2]" 1
603 1 56 GLU HA 1 59 ASP HB2 . . 3.300 3.084 2.441 3.376 0.076 5 0 "[ . 1 . 2]" 1
604 1 56 GLU HA 1 59 ASP HB3 . . 3.800 3.291 2.696 3.877 0.077 10 0 "[ . 1 . 2]" 1
605 1 57 ILE H 1 57 ILE HB . . 2.700 2.171 2.072 2.292 . 0 0 "[ . 1 . 2]" 1
606 1 57 ILE H 1 57 ILE MD . . 5.000 3.420 3.114 3.689 . 0 0 "[ . 1 . 2]" 1
607 1 57 ILE H 1 57 ILE QG . . 3.880 2.685 2.539 2.969 . 0 0 "[ . 1 . 2]" 1
608 1 57 ILE HA 1 57 ILE HG12 . . 3.900 2.592 2.451 2.755 . 0 0 "[ . 1 . 2]" 1
609 1 57 ILE HA 1 57 ILE QG . . 3.460 2.275 2.122 2.393 . 0 0 "[ . 1 . 2]" 1
610 1 57 ILE HA 1 57 ILE HG13 . . 3.900 2.532 2.206 2.637 . 0 0 "[ . 1 . 2]" 1
611 1 57 ILE HA 1 57 ILE MG . . 3.400 2.672 2.510 2.841 . 0 0 "[ . 1 . 2]" 1
612 1 57 ILE HA 1 60 TYR H . . 5.000 3.588 3.314 4.121 . 0 0 "[ . 1 . 2]" 1
613 1 57 ILE HA 1 60 TYR HB2 . . 4.400 3.533 2.973 4.476 0.076 6 0 "[ . 1 . 2]" 1
614 1 57 ILE HA 1 60 TYR HB3 . . 3.700 2.575 2.161 2.991 . 0 0 "[ . 1 . 2]" 1
615 1 57 ILE HA 1 60 TYR QD . . 7.000 3.950 3.141 4.683 . 0 0 "[ . 1 . 2]" 1
616 1 57 ILE HB 1 57 ILE MD . . 3.500 2.318 2.243 2.366 . 0 0 "[ . 1 . 2]" 1
617 1 57 ILE HB 1 58 GLN H . . 3.500 2.875 2.610 3.172 . 0 0 "[ . 1 . 2]" 1
618 1 57 ILE MG 1 58 GLN HA . . 5.700 3.231 3.013 3.396 . 0 0 "[ . 1 . 2]" 1
619 1 57 ILE MG 1 61 LEU HG . . 3.700 2.801 2.589 3.053 . 0 0 "[ . 1 . 2]" 1
620 1 58 GLN H 1 58 GLN QB . . 3.810 2.200 2.041 3.002 . 0 0 "[ . 1 . 2]" 1
621 1 58 GLN H 1 58 GLN QG . . 4.280 2.702 2.016 2.961 . 0 0 "[ . 1 . 2]" 1
622 1 58 GLN HA 1 58 GLN HG2 . . 4.100 2.842 2.177 4.167 0.067 15 0 "[ . 1 . 2]" 1
623 1 58 GLN HA 1 58 GLN QG . . 3.760 2.694 2.136 3.457 . 0 0 "[ . 1 . 2]" 1
624 1 58 GLN HA 1 58 GLN HG3 . . 4.100 3.569 3.009 3.786 . 0 0 "[ . 1 . 2]" 1
625 1 58 GLN HA 1 61 LEU H . . 4.200 3.481 2.838 3.899 . 0 0 "[ . 1 . 2]" 1
626 1 58 GLN HA 1 61 LEU QD . . 5.670 2.491 2.098 3.126 . 0 0 "[ . 1 . 2]" 1
627 1 58 GLN QB 1 58 GLN QG . . 2.480 2.042 1.969 2.123 . 0 0 "[ . 1 . 2]" 1
628 1 58 GLN QB 1 59 ASP H . . 3.490 2.560 2.302 3.275 . 0 0 "[ . 1 . 2]" 1
629 1 58 GLN HB2 1 59 ASP H . . 3.700 2.693 2.407 3.587 . 0 0 "[ . 1 . 2]" 1
630 1 58 GLN HB3 1 59 ASP H . . 3.700 3.229 2.931 3.803 0.103 7 0 "[ . 1 . 2]" 1
631 1 58 GLN HE21 1 69 THR HA . . 5.000 3.981 2.717 5.070 0.070 7 0 "[ . 1 . 2]" 1
632 1 59 ASP H 1 59 ASP HB2 . . 3.200 2.191 2.017 2.374 . 0 0 "[ . 1 . 2]" 1
633 1 59 ASP H 1 59 ASP HB3 . . 3.500 2.898 2.504 3.591 0.091 9 0 "[ . 1 . 2]" 1
634 1 59 ASP H 1 60 TYR H . . 3.200 2.731 2.502 3.039 . 0 0 "[ . 1 . 2]" 1
635 1 59 ASP HA 1 62 GLN H . . 4.000 3.502 3.036 3.835 . 0 0 "[ . 1 . 2]" 1
636 1 59 ASP HA 1 62 GLN HB3 . . 4.600 3.373 2.655 4.573 . 0 0 "[ . 1 . 2]" 1
637 1 59 ASP HB2 1 60 TYR H . . 3.200 3.217 2.900 3.297 0.097 3 0 "[ . 1 . 2]" 1
638 1 59 ASP HB3 1 60 TYR H . . 3.800 2.358 1.854 3.475 . 0 0 "[ . 1 . 2]" 1
639 1 60 TYR H 1 60 TYR HB2 . . 3.000 2.507 2.288 2.749 . 0 0 "[ . 1 . 2]" 1
640 1 60 TYR H 1 60 TYR HB3 . . 2.900 2.602 2.376 2.862 . 0 0 "[ . 1 . 2]" 1
641 1 60 TYR H 1 61 LEU H . . 3.100 2.903 2.690 3.030 . 0 0 "[ . 1 . 2]" 1
642 1 60 TYR HA 1 60 TYR HB2 . . 2.900 2.466 2.358 2.558 . 0 0 "[ . 1 . 2]" 1
643 1 60 TYR HA 1 63 GLN H . . 3.700 3.330 2.890 3.626 . 0 0 "[ . 1 . 2]" 1
644 1 60 TYR HA 1 63 GLN HB2 . . 3.600 3.075 2.392 3.611 0.011 4 0 "[ . 1 . 2]" 1
645 1 60 TYR HA 1 63 GLN QB . . 3.390 2.812 2.363 3.187 . 0 0 "[ . 1 . 2]" 1
646 1 60 TYR HA 1 63 GLN HB3 . . 3.600 3.342 2.833 3.668 0.068 9 0 "[ . 1 . 2]" 1
647 1 60 TYR HB2 1 61 LEU H . . 4.600 3.980 3.717 4.568 . 0 0 "[ . 1 . 2]" 1
648 1 60 TYR HB3 1 61 LEU H . . 4.100 2.744 2.441 3.840 . 0 0 "[ . 1 . 2]" 1
649 1 60 TYR QD 1 64 LEU QD . . 9.570 3.228 2.381 4.001 . 0 0 "[ . 1 . 2]" 1
650 1 60 TYR QE 1 64 LEU MD1 . . 8.000 3.453 2.168 4.122 . 0 0 "[ . 1 . 2]" 1
651 1 60 TYR QE 1 64 LEU QD . . 7.300 2.363 1.895 3.200 . 0 0 "[ . 1 . 2]" 1
652 1 60 TYR QE 1 64 LEU MD2 . . 8.000 2.459 2.049 3.825 . 0 0 "[ . 1 . 2]" 1
653 1 61 LEU H 1 61 LEU HB2 . . 3.300 2.371 2.220 2.675 . 0 0 "[ . 1 . 2]" 1
654 1 61 LEU H 1 61 LEU HB3 . . 3.900 3.595 3.505 3.706 . 0 0 "[ . 1 . 2]" 1
655 1 61 LEU H 1 61 LEU HG . . 3.100 2.698 2.410 3.179 0.079 6 0 "[ . 1 . 2]" 1
656 1 61 LEU H 1 62 GLN H . . 3.000 2.722 2.157 2.856 . 0 0 "[ . 1 . 2]" 1
657 1 61 LEU HA 1 64 LEU H . . 3.900 3.279 2.975 3.652 . 0 0 "[ . 1 . 2]" 1
658 1 61 LEU HA 1 64 LEU HB2 . . 4.900 4.011 3.590 4.356 . 0 0 "[ . 1 . 2]" 1
659 1 61 LEU HA 1 64 LEU QB . . 4.390 2.384 2.111 2.714 . 0 0 "[ . 1 . 2]" 1
660 1 61 LEU HA 1 64 LEU HB3 . . 4.900 2.403 2.123 2.742 . 0 0 "[ . 1 . 2]" 1
661 1 61 LEU HA 1 64 LEU QD . . 7.570 2.889 2.442 3.366 . 0 0 "[ . 1 . 2]" 1
662 1 61 LEU HA 1 65 THR MG . . 4.700 3.179 2.708 3.670 . 0 0 "[ . 1 . 2]" 1
663 1 61 LEU HB2 1 62 GLN H . . 3.200 2.918 2.540 3.231 0.031 20 0 "[ . 1 . 2]" 1
664 1 61 LEU HB3 1 62 GLN H . . 4.300 3.631 3.321 3.957 . 0 0 "[ . 1 . 2]" 1
665 1 61 LEU HB3 1 68 ARG HA . . 5.000 3.342 2.225 4.948 . 0 0 "[ . 1 . 2]" 1
666 1 61 LEU HB3 1 72 ARG QD . . 6.000 3.106 2.027 4.863 . 0 0 "[ . 1 . 2]" 1
667 1 61 LEU QD 1 65 THR MG . . 7.470 2.609 2.128 3.699 . 0 0 "[ . 1 . 2]" 1
668 1 61 LEU QD 1 72 ARG HE . . 5.770 3.630 2.557 4.215 . 0 0 "[ . 1 . 2]" 1
669 1 61 LEU QD 1 72 ARG QG . . 5.160 2.310 1.853 3.272 . 0 0 "[ . 1 . 2]" 1
670 1 61 LEU QD 1 74 PHE QR . . 9.970 2.463 2.046 4.334 . 0 0 "[ . 1 . 2]" 1
671 1 61 LEU MD1 1 72 ARG QB . . 7.000 2.763 2.089 3.413 . 0 0 "[ . 1 . 2]" 1
672 1 61 LEU MD1 1 72 ARG HG2 . . 5.900 3.355 2.462 4.385 . 0 0 "[ . 1 . 2]" 1
673 1 61 LEU MD1 1 72 ARG HG3 . . 5.900 3.387 2.072 4.799 . 0 0 "[ . 1 . 2]" 1
674 1 61 LEU MD2 1 72 ARG QB . . 7.000 2.980 2.307 3.536 . 0 0 "[ . 1 . 2]" 1
675 1 61 LEU MD2 1 72 ARG HG2 . . 5.900 3.353 2.123 4.698 . 0 0 "[ . 1 . 2]" 1
676 1 61 LEU MD2 1 72 ARG HG3 . . 5.900 3.373 2.116 4.677 . 0 0 "[ . 1 . 2]" 1
677 1 62 GLN H 1 62 GLN HB2 . . 3.100 2.354 2.098 2.717 . 0 0 "[ . 1 . 2]" 1
678 1 62 GLN H 1 62 GLN HB3 . . 3.200 2.786 2.452 3.065 . 0 0 "[ . 1 . 2]" 1
679 1 62 GLN H 1 63 GLN H . . 3.300 2.718 2.563 2.884 . 0 0 "[ . 1 . 2]" 1
680 1 62 GLN H 1 68 ARG HA . . 3.600 3.214 2.578 3.659 0.059 11 0 "[ . 1 . 2]" 1
681 1 62 GLN HA 1 62 GLN HG2 . . 3.800 2.675 2.179 3.536 . 0 0 "[ . 1 . 2]" 1
682 1 62 GLN HA 1 62 GLN QG . . 3.400 2.305 2.156 2.483 . 0 0 "[ . 1 . 2]" 1
683 1 62 GLN HA 1 62 GLN HG3 . . 3.800 2.795 2.229 3.666 . 0 0 "[ . 1 . 2]" 1
684 1 62 GLN HA 1 66 GLY H . . 3.400 3.052 2.688 3.476 0.076 6 0 "[ . 1 . 2]" 1
685 1 62 GLN HA 1 66 GLY QA . . 5.580 3.944 3.488 4.363 . 0 0 "[ . 1 . 2]" 1
686 1 62 GLN HA 1 67 ALA H . . 3.000 2.744 2.224 3.048 0.048 11 0 "[ . 1 . 2]" 1
687 1 62 GLN HB2 1 63 GLN H . . 3.700 3.659 3.399 3.786 0.086 8 0 "[ . 1 . 2]" 1
688 1 62 GLN HB2 1 68 ARG HA . . 4.700 3.216 2.379 4.387 . 0 0 "[ . 1 . 2]" 1
689 1 62 GLN HB3 1 63 GLN H . . 3.500 2.561 2.235 2.892 . 0 0 "[ . 1 . 2]" 1
690 1 63 GLN H 1 63 GLN HB2 . . 3.100 2.173 2.002 2.362 . 0 0 "[ . 1 . 2]" 1
691 1 63 GLN H 1 63 GLN HB3 . . 3.100 2.935 2.722 3.175 0.075 18 0 "[ . 1 . 2]" 1
692 1 63 GLN H 1 63 GLN HG2 . . 5.000 4.432 3.562 4.650 . 0 0 "[ . 1 . 2]" 1
693 1 63 GLN H 1 63 GLN QG . . 4.630 3.894 3.381 4.097 . 0 0 "[ . 1 . 2]" 1
694 1 63 GLN H 1 63 GLN HG3 . . 5.000 4.348 3.961 4.588 . 0 0 "[ . 1 . 2]" 1
695 1 63 GLN H 1 64 LEU H . . 3.300 2.683 2.470 2.899 . 0 0 "[ . 1 . 2]" 1
696 1 63 GLN HA 1 63 GLN HG2 . . 4.000 3.100 2.211 3.737 . 0 0 "[ . 1 . 2]" 1
697 1 63 GLN HA 1 63 GLN QG . . 3.700 2.389 2.164 2.785 . 0 0 "[ . 1 . 2]" 1
698 1 63 GLN HA 1 63 GLN HG3 . . 4.000 2.720 2.222 3.635 . 0 0 "[ . 1 . 2]" 1
699 1 63 GLN HB2 1 64 LEU H . . 3.400 3.417 3.007 3.480 0.080 12 0 "[ . 1 . 2]" 1
700 1 63 GLN HB3 1 64 LEU H . . 3.400 2.537 2.217 2.952 . 0 0 "[ . 1 . 2]" 1
701 1 64 LEU H 1 64 LEU QB . . 3.490 2.109 2.046 2.172 . 0 0 "[ . 1 . 2]" 1
702 1 64 LEU HA 1 64 LEU MD1 . . 4.800 2.531 2.420 2.625 . 0 0 "[ . 1 . 2]" 1
703 1 64 LEU HA 1 64 LEU QD . . 4.280 2.506 2.402 2.592 . 0 0 "[ . 1 . 2]" 1
704 1 64 LEU HA 1 64 LEU MD2 . . 4.800 4.039 3.971 4.104 . 0 0 "[ . 1 . 2]" 1
705 1 64 LEU HA 1 64 LEU HG . . 4.000 3.428 3.318 3.479 . 0 0 "[ . 1 . 2]" 1
706 1 64 LEU QB 1 65 THR H . . 4.480 2.988 2.610 3.238 . 0 0 "[ . 1 . 2]" 1
707 1 64 LEU QD 1 74 PHE HZ . . 7.570 2.350 2.169 2.889 . 0 0 "[ . 1 . 2]" 1
708 1 64 LEU HG 1 65 THR HB . . 5.000 4.705 4.383 5.064 0.064 18 0 "[ . 1 . 2]" 1
709 1 65 THR H 1 65 THR MG . . 3.400 2.624 2.409 2.756 . 0 0 "[ . 1 . 2]" 1
710 1 65 THR H 1 66 GLY H . . 2.500 2.298 2.051 2.575 0.075 12 0 "[ . 1 . 2]" 1
711 1 65 THR HA 1 65 THR HB . . 2.600 2.348 2.228 2.429 . 0 0 "[ . 1 . 2]" 1
712 1 65 THR HA 1 65 THR MG . . 3.400 2.466 2.351 2.703 . 0 0 "[ . 1 . 2]" 1
713 1 65 THR HB 1 79 CYS QB . . 5.880 2.570 2.108 3.010 . 0 0 "[ . 1 . 2]" 1
714 1 65 THR MG 1 66 GLY H . . 6.000 3.912 3.586 4.259 . 0 0 "[ . 1 . 2]" 1
715 1 65 THR MG 1 72 ARG QB . . 6.600 4.141 3.116 4.854 . 0 0 "[ . 1 . 2]" 1
716 1 65 THR MG 1 72 ARG QD . . 7.000 3.435 2.157 5.142 . 0 0 "[ . 1 . 2]" 1
717 1 65 THR MG 1 74 PHE QR . . 8.400 2.462 1.995 2.734 . 0 0 "[ . 1 . 2]" 1
718 1 65 THR MG 1 79 CYS HB2 . . 3.600 2.274 2.054 2.644 . 0 0 "[ . 1 . 2]" 1
719 1 65 THR MG 1 79 CYS QB . . 3.390 2.182 1.992 2.418 . 0 0 "[ . 1 . 2]" 1
720 1 65 THR MG 1 79 CYS HB3 . . 3.600 2.846 2.665 2.937 . 0 0 "[ . 1 . 2]" 1
721 1 66 GLY H 1 67 ALA H . . 3.200 2.196 1.780 2.632 . 0 0 "[ . 1 . 2]" 1
722 1 66 GLY H 1 67 ALA MB . . 5.500 4.427 4.067 4.636 . 0 0 "[ . 1 . 2]" 1
723 1 67 ALA H 1 67 ALA MB . . 3.600 2.651 2.398 2.795 . 0 0 "[ . 1 . 2]" 1
724 1 67 ALA HA 1 68 ARG H . . 2.700 2.266 2.044 2.446 . 0 0 "[ . 1 . 2]" 1
725 1 67 ALA MB 1 68 ARG H . . 3.400 2.673 2.447 2.784 . 0 0 "[ . 1 . 2]" 1
726 1 67 ALA MB 1 68 ARG HA . . 6.000 4.275 4.107 4.415 . 0 0 "[ . 1 . 2]" 1
727 1 67 ALA MB 1 69 THR H . . 4.000 2.650 2.339 3.046 . 0 0 "[ . 1 . 2]" 1
728 1 67 ALA MB 1 72 ARG QD . . 6.400 3.809 2.109 4.647 . 0 0 "[ . 1 . 2]" 1
729 1 68 ARG H 1 68 ARG HG2 . . 4.700 2.504 2.071 2.907 . 0 0 "[ . 1 . 2]" 1
730 1 68 ARG H 1 68 ARG QG . . 4.420 2.469 2.054 2.855 . 0 0 "[ . 1 . 2]" 1
731 1 68 ARG H 1 68 ARG HG3 . . 4.700 3.789 3.398 4.174 . 0 0 "[ . 1 . 2]" 1
732 1 68 ARG H 1 69 THR H . . 2.900 2.414 2.081 2.901 0.001 15 0 "[ . 1 . 2]" 1
733 1 68 ARG QG 1 69 THR H . . 5.880 2.851 2.325 3.631 . 0 0 "[ . 1 . 2]" 1
734 1 68 ARG QG 1 70 VAL MG2 . . 6.880 4.815 4.489 5.051 . 0 0 "[ . 1 . 2]" 1
735 1 69 THR H 1 69 THR HB . . 4.200 3.488 3.391 3.574 . 0 0 "[ . 1 . 2]" 1
736 1 69 THR HA 1 69 THR HB . . 2.900 2.590 2.474 2.733 . 0 0 "[ . 1 . 2]" 1
737 1 69 THR HA 1 69 THR MG . . 3.400 2.257 2.140 2.342 . 0 0 "[ . 1 . 2]" 1
738 1 69 THR HA 1 70 VAL H . . 2.500 2.173 2.059 2.277 . 0 0 "[ . 1 . 2]" 1
739 1 69 THR HA 1 70 VAL MG2 . . 4.300 3.303 2.868 3.432 . 0 0 "[ . 1 . 2]" 1
740 1 69 THR HB 1 70 VAL H . . 3.100 3.127 2.536 3.176 0.076 3 0 "[ . 1 . 2]" 1
741 1 69 THR MG 1 70 VAL H . . 4.800 3.657 3.192 4.004 . 0 0 "[ . 1 . 2]" 1
742 1 70 VAL H 1 70 VAL MG1 . . 3.900 3.193 3.035 3.276 . 0 0 "[ . 1 . 2]" 1
743 1 70 VAL H 1 70 VAL MG2 . . 3.400 1.959 1.863 2.113 . 0 0 "[ . 1 . 2]" 1
744 1 70 VAL HA 1 70 VAL HB . . 3.000 2.669 2.592 2.766 . 0 0 "[ . 1 . 2]" 1
745 1 70 VAL HA 1 70 VAL MG1 . . 3.400 2.167 2.075 2.246 . 0 0 "[ . 1 . 2]" 1
746 1 70 VAL HA 1 71 PRO HA . . 2.900 2.653 2.381 2.890 . 0 0 "[ . 1 . 2]" 1
747 1 70 VAL HA 1 72 ARG H . . 4.200 3.387 2.851 3.846 . 0 0 "[ . 1 . 2]" 1
748 1 70 VAL HA 1 72 ARG QB . . 5.700 3.460 2.529 4.329 . 0 0 "[ . 1 . 2]" 1
749 1 70 VAL HA 1 72 ARG QG . . 5.580 3.783 2.306 5.077 . 0 0 "[ . 1 . 2]" 1
750 1 70 VAL HB 1 71 PRO HA . . 2.600 2.363 2.180 2.683 0.083 15 0 "[ . 1 . 2]" 1
751 1 70 VAL MG1 1 71 PRO HA . . 3.800 2.735 2.351 3.006 . 0 0 "[ . 1 . 2]" 1
752 1 70 VAL MG2 1 71 PRO HA . . 5.800 4.010 3.871 4.250 . 0 0 "[ . 1 . 2]" 1
753 1 71 PRO HA 1 72 ARG H . . 2.700 2.372 2.217 2.500 . 0 0 "[ . 1 . 2]" 1
754 1 71 PRO QB 1 72 ARG H . . 4.300 2.834 2.515 3.360 . 0 0 "[ . 1 . 2]" 1
755 1 71 PRO QB 1 73 VAL MG2 . . 4.880 3.110 2.895 3.292 . 0 0 "[ . 1 . 2]" 1
756 1 71 PRO QG 1 82 GLY QA . . 6.880 3.549 2.101 4.354 . 0 0 "[ . 1 . 2]" 1
757 1 71 PRO QG 1 83 CYS H . . 6.000 3.705 2.905 4.747 . 0 0 "[ . 1 . 2]" 1
758 1 71 PRO QG 1 83 CYS HA . . 6.000 3.179 2.797 4.653 . 0 0 "[ . 1 . 2]" 1
759 1 71 PRO QG 1 83 CYS HB2 . . 6.000 3.240 2.106 5.309 . 0 0 "[ . 1 . 2]" 1
760 1 71 PRO QG 1 83 CYS QB . . 5.590 2.710 2.076 3.962 . 0 0 "[ . 1 . 2]" 1
761 1 71 PRO QG 1 83 CYS HB3 . . 6.000 3.621 2.154 4.548 . 0 0 "[ . 1 . 2]" 1
762 1 72 ARG H 1 73 VAL MG2 . . 5.600 4.267 3.950 4.556 . 0 0 "[ . 1 . 2]" 1
763 1 72 ARG HA 1 72 ARG HE . . 5.000 3.872 2.955 5.054 0.054 14 0 "[ . 1 . 2]" 1
764 1 72 ARG HA 1 73 VAL H . . 2.600 2.215 2.137 2.271 . 0 0 "[ . 1 . 2]" 1
765 1 72 ARG HA 1 73 VAL MG2 . . 5.200 4.000 3.279 4.173 . 0 0 "[ . 1 . 2]" 1
766 1 73 VAL H 1 73 VAL HB . . 2.900 2.354 2.290 2.429 . 0 0 "[ . 1 . 2]" 1
767 1 73 VAL H 1 73 VAL MG2 . . 3.500 2.599 2.432 2.784 . 0 0 "[ . 1 . 2]" 1
768 1 73 VAL H 1 80 ILE MD . . 6.000 3.952 3.488 4.472 . 0 0 "[ . 1 . 2]" 1
769 1 73 VAL H 1 81 GLY H . . 5.000 3.732 3.337 4.968 . 0 0 "[ . 1 . 2]" 1
770 1 73 VAL HA 1 73 VAL MG1 . . 3.400 2.512 2.459 2.563 . 0 0 "[ . 1 . 2]" 1
771 1 73 VAL HA 1 73 VAL MG2 . . 3.400 2.353 2.279 2.458 . 0 0 "[ . 1 . 2]" 1
772 1 73 VAL HA 1 74 PHE H . . 2.700 2.147 2.069 2.233 . 0 0 "[ . 1 . 2]" 1
773 1 73 VAL HB 1 80 ILE QG . . 3.580 2.151 1.998 2.431 . 0 0 "[ . 1 . 2]" 1
774 1 73 VAL MG1 1 74 PHE H . . 3.500 2.801 2.768 2.818 . 0 0 "[ . 1 . 2]" 1
775 1 73 VAL MG1 1 75 ILE HB . . 4.000 3.270 3.220 3.311 . 0 0 "[ . 1 . 2]" 1
776 1 73 VAL MG1 1 75 ILE QG . . 4.480 3.513 3.499 3.522 . 0 0 "[ . 1 . 2]" 1
777 1 73 VAL MG1 1 80 ILE QG . . 4.280 2.156 2.055 2.296 . 0 0 "[ . 1 . 2]" 1
778 1 73 VAL MG2 1 74 PHE H . . 6.000 3.980 3.865 4.097 . 0 0 "[ . 1 . 2]" 1
779 1 73 VAL MG2 1 80 ILE H . . 6.000 5.085 4.803 5.119 . 0 0 "[ . 1 . 2]" 1
780 1 73 VAL MG2 1 80 ILE QG . . 5.680 3.446 3.154 3.659 . 0 0 "[ . 1 . 2]" 1
781 1 73 VAL MG2 1 82 GLY QA . . 6.280 4.128 2.885 4.257 . 0 0 "[ . 1 . 2]" 1
782 1 74 PHE H 1 74 PHE HB2 . . 3.600 2.489 2.346 2.684 . 0 0 "[ . 1 . 2]" 1
783 1 74 PHE H 1 74 PHE QB . . 3.340 2.436 2.293 2.524 . 0 0 "[ . 1 . 2]" 1
784 1 74 PHE H 1 74 PHE HB3 . . 3.600 3.526 2.916 3.672 0.072 4 0 "[ . 1 . 2]" 1
785 1 74 PHE HA 1 75 ILE H . . 2.500 2.189 2.141 2.224 . 0 0 "[ . 1 . 2]" 1
786 1 74 PHE HA 1 79 CYS HA . . 2.700 2.117 2.016 2.376 . 0 0 "[ . 1 . 2]" 1
787 1 74 PHE HA 1 79 CYS QB . . 5.880 3.904 3.667 4.115 . 0 0 "[ . 1 . 2]" 1
788 1 74 PHE HA 1 80 ILE H . . 3.500 3.229 2.856 3.551 0.051 19 0 "[ . 1 . 2]" 1
789 1 74 PHE HA 1 80 ILE MG . . 5.900 3.550 3.238 4.107 . 0 0 "[ . 1 . 2]" 1
790 1 74 PHE QR 1 77 LYS HA . . 7.400 2.635 1.995 3.267 . 0 0 "[ . 1 . 2]" 1
791 1 74 PHE QR 1 79 CYS QB . . 8.280 2.700 1.917 3.064 . 0 0 "[ . 1 . 2]" 1
792 1 75 ILE H 1 75 ILE HB . . 3.100 2.395 2.228 2.737 . 0 0 "[ . 1 . 2]" 1
793 1 75 ILE H 1 75 ILE MD . . 5.700 3.393 3.122 3.769 . 0 0 "[ . 1 . 2]" 1
794 1 75 ILE H 1 75 ILE HG12 . . 5.000 4.729 4.554 5.027 0.027 9 0 "[ . 1 . 2]" 1
795 1 75 ILE H 1 75 ILE QG . . 4.820 4.054 3.952 4.236 . 0 0 "[ . 1 . 2]" 1
796 1 75 ILE H 1 75 ILE HG13 . . 5.000 4.414 4.266 4.561 . 0 0 "[ . 1 . 2]" 1
797 1 75 ILE H 1 78 ASP H . . 4.300 3.457 2.836 4.339 0.039 20 0 "[ . 1 . 2]" 1
798 1 75 ILE HA 1 75 ILE HB . . 2.900 2.960 2.944 2.973 0.073 3 0 "[ . 1 . 2]" 1
799 1 75 ILE HA 1 75 ILE MD . . 4.400 2.733 2.512 2.998 . 0 0 "[ . 1 . 2]" 1
800 1 75 ILE HA 1 75 ILE HG12 . . 4.100 3.555 3.420 3.629 . 0 0 "[ . 1 . 2]" 1
801 1 75 ILE HA 1 75 ILE QG . . 3.570 2.219 2.069 2.377 . 0 0 "[ . 1 . 2]" 1
802 1 75 ILE HA 1 75 ILE HG13 . . 4.100 2.242 2.087 2.410 . 0 0 "[ . 1 . 2]" 1
803 1 75 ILE HA 1 75 ILE MG . . 3.400 2.824 2.726 2.878 . 0 0 "[ . 1 . 2]" 1
804 1 75 ILE HA 1 76 GLY H . . 2.600 2.173 2.058 2.213 . 0 0 "[ . 1 . 2]" 1
805 1 75 ILE HA 1 102 ILE MD . . 6.000 3.644 2.971 4.132 . 0 0 "[ . 1 . 2]" 1
806 1 75 ILE HB 1 75 ILE MD . . 3.400 2.407 2.296 2.599 . 0 0 "[ . 1 . 2]" 1
807 1 75 ILE MD 1 76 GLY H . . 5.800 4.601 4.316 4.797 . 0 0 "[ . 1 . 2]" 1
808 1 75 ILE MD 1 80 ILE QG . . 6.180 2.788 2.297 3.238 . 0 0 "[ . 1 . 2]" 1
809 1 75 ILE MD 1 95 LEU HA . . 6.000 4.774 4.420 4.893 . 0 0 "[ . 1 . 2]" 1
810 1 75 ILE MD 1 98 ARG HD2 . . 6.000 4.586 3.909 4.934 . 0 0 "[ . 1 . 2]" 1
811 1 75 ILE MD 1 98 ARG HD3 . . 6.000 4.956 4.643 5.046 . 0 0 "[ . 1 . 2]" 1
812 1 75 ILE MD 1 99 LEU H . . 6.000 4.934 4.612 5.024 . 0 0 "[ . 1 . 2]" 1
813 1 75 ILE MD 1 99 LEU QB . . 6.280 4.541 3.143 4.669 . 0 0 "[ . 1 . 2]" 1
814 1 75 ILE MG 1 76 GLY H . . 5.600 3.355 3.060 3.685 . 0 0 "[ . 1 . 2]" 1
815 1 75 ILE MG 1 80 ILE QG . . 6.880 4.760 4.039 5.077 . 0 0 "[ . 1 . 2]" 1
816 1 75 ILE MG 1 99 LEU HA . . 4.400 2.708 2.226 3.475 . 0 0 "[ . 1 . 2]" 1
817 1 75 ILE MG 1 102 ILE QG . . 5.980 2.375 2.160 2.836 . 0 0 "[ . 1 . 2]" 1
818 1 76 GLY H 1 76 GLY HA2 . . 2.800 2.271 2.245 2.309 . 0 0 "[ . 1 . 2]" 1
819 1 76 GLY H 1 102 ILE MD . . 4.600 2.719 2.395 3.217 . 0 0 "[ . 1 . 2]" 1
820 1 76 GLY HA2 1 77 LYS H . . 3.400 2.473 2.296 2.629 . 0 0 "[ . 1 . 2]" 1
821 1 76 GLY HA2 1 78 ASP H . . 4.800 4.292 4.128 4.521 . 0 0 "[ . 1 . 2]" 1
822 1 76 GLY HA2 1 102 ILE MD . . 5.500 3.248 2.801 3.591 . 0 0 "[ . 1 . 2]" 1
823 1 76 GLY HA3 1 102 ILE MG . . 5.700 2.117 2.010 2.291 . 0 0 "[ . 1 . 2]" 1
824 1 77 LYS H 1 77 LYS HB2 . . 3.900 2.925 2.720 3.355 . 0 0 "[ . 1 . 2]" 1
825 1 77 LYS H 1 77 LYS QB . . 3.550 2.842 2.656 3.190 . 0 0 "[ . 1 . 2]" 1
826 1 77 LYS H 1 77 LYS HB3 . . 3.900 3.867 3.649 3.989 0.089 20 0 "[ . 1 . 2]" 1
827 1 77 LYS H 1 77 LYS HG2 . . 4.100 3.937 2.902 4.181 0.081 14 0 "[ . 1 . 2]" 1
828 1 77 LYS H 1 77 LYS QG . . 3.810 3.387 2.851 3.558 . 0 0 "[ . 1 . 2]" 1
829 1 77 LYS H 1 77 LYS HG3 . . 4.100 3.805 3.043 4.181 0.081 12 0 "[ . 1 . 2]" 1
830 1 77 LYS H 1 78 ASP H . . 3.100 3.160 3.095 3.184 0.084 9 0 "[ . 1 . 2]" 1
831 1 77 LYS HA 1 77 LYS QG . . 3.940 2.111 2.020 2.329 . 0 0 "[ . 1 . 2]" 1
832 1 77 LYS HA 1 78 ASP H . . 3.500 3.171 2.910 3.383 . 0 0 "[ . 1 . 2]" 1
833 1 77 LYS QB 1 78 ASP H . . 5.880 3.785 3.302 4.034 . 0 0 "[ . 1 . 2]" 1
834 1 78 ASP H 1 78 ASP QB . . 3.800 2.510 2.231 2.855 . 0 0 "[ . 1 . 2]" 1
835 1 78 ASP HA 1 79 CYS H . . 2.500 2.236 1.997 2.488 . 0 0 "[ . 1 . 2]" 1
836 1 78 ASP QB 1 80 ILE MG . . 7.000 3.632 2.914 4.667 . 0 0 "[ . 1 . 2]" 1
837 1 79 CYS H 1 79 CYS HB2 . . 3.100 2.626 2.421 3.078 . 0 0 "[ . 1 . 2]" 1
838 1 79 CYS H 1 79 CYS HB3 . . 3.100 2.641 2.531 2.799 . 0 0 "[ . 1 . 2]" 1
839 1 79 CYS HA 1 80 ILE H . . 2.500 2.290 2.110 2.430 . 0 0 "[ . 1 . 2]" 1
840 1 80 ILE H 1 80 ILE HB . . 3.500 3.582 3.565 3.591 0.091 5 0 "[ . 1 . 2]" 1
841 1 80 ILE H 1 80 ILE MD . . 4.700 3.546 2.935 3.875 . 0 0 "[ . 1 . 2]" 1
842 1 80 ILE H 1 80 ILE HG12 . . 4.600 3.462 3.323 3.593 . 0 0 "[ . 1 . 2]" 1
843 1 80 ILE H 1 80 ILE QG . . 3.820 2.160 1.972 2.375 . 0 0 "[ . 1 . 2]" 1
844 1 80 ILE H 1 80 ILE HG13 . . 4.600 2.184 1.984 2.418 . 0 0 "[ . 1 . 2]" 1
845 1 80 ILE H 1 80 ILE MG . . 3.400 2.251 1.957 2.706 . 0 0 "[ . 1 . 2]" 1
846 1 80 ILE H 1 81 GLY H . . 2.800 2.378 2.156 2.547 . 0 0 "[ . 1 . 2]" 1
847 1 80 ILE H 1 86 LEU QD . . 7.570 5.251 4.984 5.428 . 0 0 "[ . 1 . 2]" 1
848 1 80 ILE HA 1 80 ILE HB . . 2.500 2.313 2.284 2.356 . 0 0 "[ . 1 . 2]" 1
849 1 80 ILE HA 1 80 ILE MD . . 4.300 3.558 3.481 3.594 . 0 0 "[ . 1 . 2]" 1
850 1 80 ILE HA 1 80 ILE MG . . 3.400 2.396 2.273 2.548 . 0 0 "[ . 1 . 2]" 1
851 1 80 ILE HA 1 81 GLY H . . 3.400 3.428 3.149 3.476 0.076 10 0 "[ . 1 . 2]" 1
852 1 80 ILE HB 1 80 ILE MD . . 3.400 2.265 2.212 2.323 . 0 0 "[ . 1 . 2]" 1
853 1 80 ILE HB 1 89 LEU QD . . 6.170 2.311 2.109 2.650 . 0 0 "[ . 1 . 2]" 1
854 1 80 ILE MD 1 81 GLY H . . 5.300 3.092 2.751 3.413 . 0 0 "[ . 1 . 2]" 1
855 1 80 ILE MD 1 85 ASP HB2 . . 5.800 3.308 2.293 4.788 . 0 0 "[ . 1 . 2]" 1
856 1 80 ILE MD 1 85 ASP QB . . 5.390 2.724 2.104 3.749 . 0 0 "[ . 1 . 2]" 1
857 1 80 ILE MD 1 85 ASP HB3 . . 5.800 2.945 2.215 3.917 . 0 0 "[ . 1 . 2]" 1
858 1 80 ILE MD 1 86 LEU H . . 5.100 3.163 2.644 4.164 . 0 0 "[ . 1 . 2]" 1
859 1 80 ILE MD 1 86 LEU HA . . 3.400 2.348 2.091 2.797 . 0 0 "[ . 1 . 2]" 1
860 1 80 ILE MD 1 86 LEU QB . . 6.480 2.414 2.120 3.436 . 0 0 "[ . 1 . 2]" 1
861 1 80 ILE QG 1 81 GLY H . . 5.580 2.882 2.345 3.912 . 0 0 "[ . 1 . 2]" 1
862 1 80 ILE MG 1 81 GLY H . . 6.000 4.041 3.772 4.327 . 0 0 "[ . 1 . 2]" 1
863 1 80 ILE MG 1 98 ARG QD . . 6.880 2.109 1.996 2.237 . 0 0 "[ . 1 . 2]" 1
864 1 81 GLY H 1 81 GLY HA2 . . 2.900 2.562 2.338 2.705 . 0 0 "[ . 1 . 2]" 1
865 1 81 GLY HA2 1 82 GLY H . . 3.300 2.791 2.500 3.385 0.085 18 0 "[ . 1 . 2]" 1
866 1 81 GLY HA3 1 82 GLY H . . 2.900 2.338 2.146 2.617 . 0 0 "[ . 1 . 2]" 1
867 1 82 GLY H 1 85 ASP H . . 4.000 3.480 3.173 4.055 0.055 19 0 "[ . 1 . 2]" 1
868 1 82 GLY H 1 85 ASP HB2 . . 4.000 2.585 2.363 3.134 . 0 0 "[ . 1 . 2]" 1
869 1 82 GLY H 1 85 ASP QB . . 3.470 2.554 2.344 3.036 . 0 0 "[ . 1 . 2]" 1
870 1 82 GLY H 1 85 ASP HB3 . . 4.000 4.030 3.907 4.079 0.079 5 0 "[ . 1 . 2]" 1
871 1 83 CYS H 1 83 CYS HB2 . . 3.900 2.889 2.105 3.939 0.039 19 0 "[ . 1 . 2]" 1
872 1 83 CYS H 1 83 CYS QB . . 3.700 2.516 2.085 3.164 . 0 0 "[ . 1 . 2]" 1
873 1 83 CYS H 1 83 CYS HB3 . . 3.900 3.011 2.521 3.799 . 0 0 "[ . 1 . 2]" 1
874 1 83 CYS H 1 84 SER HA . . 5.000 5.026 4.793 5.104 0.104 19 0 "[ . 1 . 2]" 1
875 1 83 CYS HA 1 86 LEU H . . 4.100 3.476 2.974 3.913 . 0 0 "[ . 1 . 2]" 1
876 1 83 CYS HA 1 86 LEU HB2 . . 3.500 3.226 2.379 3.568 0.068 19 0 "[ . 1 . 2]" 1
877 1 83 CYS HA 1 86 LEU QB . . 3.240 2.295 1.955 2.694 . 0 0 "[ . 1 . 2]" 1
878 1 83 CYS HA 1 86 LEU HB3 . . 3.500 2.358 2.078 2.787 . 0 0 "[ . 1 . 2]" 1
879 1 83 CYS HA 1 86 LEU QD . . 6.770 3.089 2.204 4.017 . 0 0 "[ . 1 . 2]" 1
880 1 83 CYS HA 1 87 VAL H . . 5.000 3.975 3.806 4.158 . 0 0 "[ . 1 . 2]" 1
881 1 84 SER HA 1 87 VAL H . . 3.800 3.483 3.030 3.701 . 0 0 "[ . 1 . 2]" 1
882 1 84 SER HA 1 87 VAL HB . . 3.000 2.797 2.316 3.061 0.061 16 0 "[ . 1 . 2]" 1
883 1 84 SER HA 1 87 VAL MG2 . . 4.200 3.278 2.871 3.440 . 0 0 "[ . 1 . 2]" 1
884 1 84 SER QB 1 87 VAL MG2 . . 7.000 4.845 4.325 5.061 . 0 0 "[ . 1 . 2]" 1
885 1 85 ASP H 1 85 ASP HB2 . . 4.000 2.284 2.103 2.498 . 0 0 "[ . 1 . 2]" 1
886 1 85 ASP H 1 85 ASP QB . . 3.470 2.256 2.085 2.455 . 0 0 "[ . 1 . 2]" 1
887 1 85 ASP H 1 85 ASP HB3 . . 4.000 3.523 3.330 3.610 . 0 0 "[ . 1 . 2]" 1
888 1 85 ASP H 1 86 LEU H . . 3.100 2.607 2.305 2.803 . 0 0 "[ . 1 . 2]" 1
889 1 85 ASP HA 1 88 SER H . . 4.000 3.482 3.150 3.924 . 0 0 "[ . 1 . 2]" 1
890 1 85 ASP HA 1 88 SER QB . . 4.500 3.190 2.443 4.154 . 0 0 "[ . 1 . 2]" 1
891 1 85 ASP QB 1 86 LEU H . . 3.560 2.415 2.076 2.751 . 0 0 "[ . 1 . 2]" 1
892 1 85 ASP HB2 1 86 LEU H . . 4.000 2.521 2.127 3.129 . 0 0 "[ . 1 . 2]" 1
893 1 85 ASP HB3 1 86 LEU H . . 4.000 3.214 2.842 3.719 . 0 0 "[ . 1 . 2]" 1
894 1 86 LEU H 1 86 LEU HB2 . . 3.000 2.376 2.124 2.547 . 0 0 "[ . 1 . 2]" 1
895 1 86 LEU H 1 86 LEU HB3 . . 3.000 2.533 2.173 2.734 . 0 0 "[ . 1 . 2]" 1
896 1 86 LEU H 1 86 LEU HG . . 5.000 4.475 4.371 4.562 . 0 0 "[ . 1 . 2]" 1
897 1 86 LEU H 1 87 VAL H . . 3.100 2.964 2.615 3.121 0.021 5 0 "[ . 1 . 2]" 1
898 1 86 LEU HA 1 89 LEU H . . 3.700 3.478 3.220 3.725 0.025 19 0 "[ . 1 . 2]" 1
899 1 86 LEU HA 1 89 LEU HB2 . . 5.000 2.602 2.338 2.897 . 0 0 "[ . 1 . 2]" 1
900 1 86 LEU HA 1 89 LEU QB . . 4.310 2.579 2.321 2.867 . 0 0 "[ . 1 . 2]" 1
901 1 86 LEU HA 1 89 LEU HB3 . . 5.000 4.232 3.882 4.582 . 0 0 "[ . 1 . 2]" 1
902 1 86 LEU HA 1 89 LEU QD . . 7.370 2.641 2.071 3.327 . 0 0 "[ . 1 . 2]" 1
903 1 86 LEU QB 1 87 VAL H . . 3.680 2.706 2.590 2.959 . 0 0 "[ . 1 . 2]" 1
904 1 86 LEU QB 1 89 LEU QD . . 8.450 4.048 3.578 4.617 . 0 0 "[ . 1 . 2]" 1
905 1 86 LEU HB2 1 87 VAL H . . 4.500 4.017 3.841 4.262 . 0 0 "[ . 1 . 2]" 1
906 1 86 LEU HB3 1 87 VAL H . . 4.500 2.752 2.624 3.018 . 0 0 "[ . 1 . 2]" 1
907 1 86 LEU QD 1 90 GLN HA . . 7.070 4.785 4.377 5.279 . 0 0 "[ . 1 . 2]" 1
908 1 87 VAL H 1 87 VAL HB . . 2.600 2.127 2.050 2.213 . 0 0 "[ . 1 . 2]" 1
909 1 87 VAL H 1 87 VAL MG1 . . 4.100 3.572 3.536 3.589 . 0 0 "[ . 1 . 2]" 1
910 1 87 VAL H 1 87 VAL MG2 . . 3.400 2.412 2.118 2.723 . 0 0 "[ . 1 . 2]" 1
911 1 87 VAL H 1 88 SER H . . 3.000 2.828 2.611 2.992 . 0 0 "[ . 1 . 2]" 1
912 1 87 VAL HA 1 87 VAL MG1 . . 3.400 2.592 2.432 2.801 . 0 0 "[ . 1 . 2]" 1
913 1 87 VAL HA 1 87 VAL MG2 . . 3.400 2.305 2.210 2.423 . 0 0 "[ . 1 . 2]" 1
914 1 87 VAL HA 1 90 GLN H . . 3.600 3.343 3.097 3.508 . 0 0 "[ . 1 . 2]" 1
915 1 87 VAL HA 1 90 GLN HB2 . . 3.600 3.580 3.280 3.674 0.074 7 0 "[ . 1 . 2]" 1
916 1 87 VAL HA 1 90 GLN QB . . 3.240 2.670 2.452 2.897 . 0 0 "[ . 1 . 2]" 1
917 1 87 VAL HA 1 90 GLN HB3 . . 3.600 2.759 2.515 3.036 . 0 0 "[ . 1 . 2]" 1
918 1 87 VAL HA 1 91 GLN H . . 4.700 3.795 3.583 3.936 . 0 0 "[ . 1 . 2]" 1
919 1 87 VAL HB 1 88 SER H . . 3.000 2.899 2.633 3.053 0.053 2 0 "[ . 1 . 2]" 1
920 1 87 VAL MG1 1 88 SER H . . 4.500 3.144 2.837 3.514 . 0 0 "[ . 1 . 2]" 1
921 1 87 VAL MG1 1 88 SER QB . . 7.000 4.343 3.978 4.760 . 0 0 "[ . 1 . 2]" 1
922 1 87 VAL MG1 1 91 GLN H . . 6.000 3.834 3.637 4.071 . 0 0 "[ . 1 . 2]" 1
923 1 87 VAL MG1 1 91 GLN QG . . 4.580 3.177 2.874 3.369 . 0 0 "[ . 1 . 2]" 1
924 1 88 SER H 1 88 SER QB . . 3.600 2.309 2.133 2.951 . 0 0 "[ . 1 . 2]" 1
925 1 88 SER H 1 89 LEU H . . 3.000 2.665 2.468 2.998 . 0 0 "[ . 1 . 2]" 1
926 1 88 SER HA 1 91 GLN H . . 3.900 3.464 3.220 3.903 0.003 7 0 "[ . 1 . 2]" 1
927 1 88 SER HA 1 91 GLN HB2 . . 3.800 3.025 2.477 3.656 . 0 0 "[ . 1 . 2]" 1
928 1 88 SER HA 1 91 GLN QB . . 3.600 2.804 2.421 3.331 . 0 0 "[ . 1 . 2]" 1
929 1 88 SER HA 1 91 GLN HB3 . . 3.800 3.357 3.034 3.838 0.038 7 0 "[ . 1 . 2]" 1
930 1 88 SER HA 1 91 GLN QG . . 5.880 4.508 4.034 5.020 . 0 0 "[ . 1 . 2]" 1
931 1 88 SER QB 1 89 LEU H . . 4.500 2.575 2.278 3.331 . 0 0 "[ . 1 . 2]" 1
932 1 88 SER QB 1 91 GLN QB . . 6.880 4.542 3.993 5.022 . 0 0 "[ . 1 . 2]" 1
933 1 88 SER QB 1 94 GLU H . . 6.000 5.202 5.153 5.246 . 0 0 "[ . 1 . 2]" 1
934 1 89 LEU H 1 89 LEU HB2 . . 3.700 2.437 2.330 2.542 . 0 0 "[ . 1 . 2]" 1
935 1 89 LEU H 1 89 LEU QB . . 3.250 2.399 2.299 2.496 . 0 0 "[ . 1 . 2]" 1
936 1 89 LEU H 1 89 LEU HB3 . . 3.700 3.581 3.514 3.647 . 0 0 "[ . 1 . 2]" 1
937 1 89 LEU H 1 89 LEU HG . . 3.400 3.307 2.263 3.484 0.084 20 0 "[ . 1 . 2]" 1
938 1 89 LEU H 1 90 GLN H . . 3.000 2.854 2.725 3.054 0.054 20 0 "[ . 1 . 2]" 1
939 1 89 LEU HA 1 95 LEU H . . 3.800 2.857 2.557 3.083 . 0 0 "[ . 1 . 2]" 1
940 1 89 LEU QB 1 90 GLN H . . 4.040 2.883 2.686 3.106 . 0 0 "[ . 1 . 2]" 1
941 1 89 LEU QB 1 95 LEU HA . . 5.280 2.630 2.312 2.976 . 0 0 "[ . 1 . 2]" 1
942 1 89 LEU HB2 1 90 GLN H . . 4.600 3.002 2.795 3.263 . 0 0 "[ . 1 . 2]" 1
943 1 89 LEU HB2 1 95 LEU H . . 3.900 3.963 3.933 3.982 0.082 20 0 "[ . 1 . 2]" 1
944 1 89 LEU HB3 1 90 GLN H . . 4.600 3.735 3.477 3.947 . 0 0 "[ . 1 . 2]" 1
945 1 89 LEU HB3 1 95 LEU H . . 3.900 2.450 2.372 2.598 . 0 0 "[ . 1 . 2]" 1
946 1 89 LEU QD 1 94 GLU QB . . 5.150 2.693 1.869 3.146 . 0 0 "[ . 1 . 2]" 1
947 1 89 LEU QD 1 94 GLU QG . . 6.570 2.709 2.171 3.833 . 0 0 "[ . 1 . 2]" 1
948 1 89 LEU QD 1 95 LEU HA . . 6.270 2.583 2.168 3.215 . 0 0 "[ . 1 . 2]" 1
949 1 89 LEU QD 1 98 ARG QD . . 8.450 3.317 2.076 4.286 . 0 0 "[ . 1 . 2]" 1
950 1 89 LEU MD1 1 94 GLU HB2 . . 7.040 4.945 3.908 5.964 . 0 0 "[ . 1 . 2]" 1
951 1 89 LEU MD1 1 94 GLU HB3 . . 7.040 3.933 3.534 4.546 . 0 0 "[ . 1 . 2]" 1
952 1 89 LEU MD1 1 94 GLU HG2 . . 8.440 4.512 3.607 5.794 . 0 0 "[ . 1 . 2]" 1
953 1 89 LEU MD1 1 94 GLU HG3 . . 8.440 5.426 4.119 6.401 . 0 0 "[ . 1 . 2]" 1
954 1 89 LEU MD2 1 94 GLU HB2 . . 7.040 4.121 2.163 4.821 . 0 0 "[ . 1 . 2]" 1
955 1 89 LEU MD2 1 94 GLU HB3 . . 7.040 2.876 2.026 3.642 . 0 0 "[ . 1 . 2]" 1
956 1 89 LEU MD2 1 94 GLU HG2 . . 8.440 2.941 2.199 4.528 . 0 0 "[ . 1 . 2]" 1
957 1 89 LEU MD2 1 94 GLU HG3 . . 8.440 3.772 2.274 4.938 . 0 0 "[ . 1 . 2]" 1
958 1 90 GLN H 1 90 GLN HB2 . . 2.900 2.561 2.470 2.620 . 0 0 "[ . 1 . 2]" 1
959 1 90 GLN H 1 90 GLN QB . . 2.660 2.270 2.183 2.320 . 0 0 "[ . 1 . 2]" 1
960 1 90 GLN H 1 90 GLN HB3 . . 2.900 2.536 2.402 2.607 . 0 0 "[ . 1 . 2]" 1
961 1 90 GLN H 1 90 GLN HG2 . . 5.000 4.488 4.438 4.569 . 0 0 "[ . 1 . 2]" 1
962 1 90 GLN H 1 90 GLN HG3 . . 5.000 4.547 4.481 4.636 . 0 0 "[ . 1 . 2]" 1
963 1 90 GLN H 1 95 LEU QD . . 7.270 3.287 2.699 3.991 . 0 0 "[ . 1 . 2]" 1
964 1 90 GLN HA 1 90 GLN HG2 . . 3.300 2.793 2.335 3.409 0.109 3 0 "[ . 1 . 2]" 1
965 1 90 GLN HA 1 90 GLN HG3 . . 3.300 2.951 2.453 3.362 0.062 8 0 "[ . 1 . 2]" 1
966 1 90 GLN HA 1 95 LEU HB2 . . 3.100 2.931 2.468 3.171 0.071 19 0 "[ . 1 . 2]" 1
967 1 90 GLN HA 1 95 LEU HB3 . . 3.100 2.974 2.510 3.178 0.078 15 0 "[ . 1 . 2]" 1
968 1 90 GLN HA 1 95 LEU QD . . 6.970 2.928 2.274 4.127 . 0 0 "[ . 1 . 2]" 1
969 1 90 GLN QB 1 95 LEU QD . . 8.450 2.666 2.099 4.041 . 0 0 "[ . 1 . 2]" 1
970 1 90 GLN QG 1 95 LEU QD . . 8.450 3.402 2.538 4.576 . 0 0 "[ . 1 . 2]" 1
971 1 91 GLN H 1 91 GLN HA . . 2.900 2.756 2.670 2.810 . 0 0 "[ . 1 . 2]" 1
972 1 91 GLN H 1 91 GLN HB2 . . 3.000 1.897 1.839 1.929 . 0 0 "[ . 1 . 2]" 1
973 1 91 GLN H 1 91 GLN HB3 . . 3.000 3.051 2.922 3.077 0.077 11 0 "[ . 1 . 2]" 1
974 1 91 GLN H 1 91 GLN HG2 . . 3.800 3.636 3.350 3.892 0.092 11 0 "[ . 1 . 2]" 1
975 1 91 GLN H 1 91 GLN QG . . 3.600 3.303 3.164 3.367 . 0 0 "[ . 1 . 2]" 1
976 1 91 GLN H 1 91 GLN HG3 . . 3.800 3.824 3.431 3.893 0.093 17 0 "[ . 1 . 2]" 1
977 1 91 GLN H 1 92 SER H . . 3.000 2.834 2.673 2.990 . 0 0 "[ . 1 . 2]" 1
978 1 91 GLN HB2 1 92 SER H . . 4.700 3.185 2.899 3.493 . 0 0 "[ . 1 . 2]" 1
979 1 91 GLN HB3 1 92 SER H . . 4.700 2.654 2.320 3.073 . 0 0 "[ . 1 . 2]" 1
980 1 92 SER H 1 92 SER HB2 . . 3.200 2.358 2.023 2.601 . 0 0 "[ . 1 . 2]" 1
981 1 92 SER H 1 92 SER QB . . 2.830 2.168 2.005 2.322 . 0 0 "[ . 1 . 2]" 1
982 1 92 SER H 1 92 SER HB3 . . 3.200 2.671 2.324 3.280 0.080 20 0 "[ . 1 . 2]" 1
983 1 92 SER H 1 93 GLY H . . 2.900 2.484 2.337 2.634 . 0 0 "[ . 1 . 2]" 1
984 1 93 GLY H 1 93 GLY HA2 . . 2.600 2.272 2.201 2.418 . 0 0 "[ . 1 . 2]" 1
985 1 93 GLY H 1 94 GLU H . . 2.900 2.715 2.146 2.957 0.057 14 0 "[ . 1 . 2]" 1
986 1 93 GLY HA2 1 94 GLU H . . 3.600 3.350 3.221 3.443 . 0 0 "[ . 1 . 2]" 1
987 1 94 GLU H 1 94 GLU HA . . 2.800 2.866 2.801 2.880 0.080 11 0 "[ . 1 . 2]" 1
988 1 94 GLU H 1 94 GLU HB2 . . 3.200 2.402 1.910 2.736 . 0 0 "[ . 1 . 2]" 1
989 1 94 GLU H 1 94 GLU HB3 . . 3.200 2.569 2.210 3.285 0.085 19 0 "[ . 1 . 2]" 1
990 1 94 GLU H 1 95 LEU H . . 3.000 2.563 2.444 2.722 . 0 0 "[ . 1 . 2]" 1
991 1 94 GLU HA 1 97 THR H . . 3.600 3.556 3.196 3.681 0.081 16 0 "[ . 1 . 2]" 1
992 1 94 GLU QB 1 94 GLU QG . . 2.480 2.076 2.000 2.134 . 0 0 "[ . 1 . 2]" 1
993 1 94 GLU HB2 1 95 LEU H . . 5.000 3.923 2.999 4.280 . 0 0 "[ . 1 . 2]" 1
994 1 94 GLU HB3 1 95 LEU H . . 5.000 3.052 2.456 3.483 . 0 0 "[ . 1 . 2]" 1
995 1 95 LEU H 1 95 LEU HB2 . . 3.200 2.279 2.067 2.464 . 0 0 "[ . 1 . 2]" 1
996 1 95 LEU H 1 95 LEU QB . . 2.930 2.170 2.039 2.297 . 0 0 "[ . 1 . 2]" 1
997 1 95 LEU H 1 95 LEU HB3 . . 3.200 2.801 2.454 3.129 . 0 0 "[ . 1 . 2]" 1
998 1 95 LEU H 1 96 LEU H . . 3.100 2.761 2.477 3.075 . 0 0 "[ . 1 . 2]" 1
999 1 95 LEU HA 1 95 LEU QD . . 4.170 2.170 2.014 3.028 . 0 0 "[ . 1 . 2]" 1
1000 1 95 LEU HA 1 98 ARG H . . 3.600 3.501 3.169 3.651 0.051 7 0 "[ . 1 . 2]" 1
1001 1 95 LEU QB 1 96 LEU H . . 3.540 2.729 2.415 3.151 . 0 0 "[ . 1 . 2]" 1
1002 1 95 LEU HB2 1 95 LEU HG . . 3.000 2.869 2.359 3.042 0.042 15 0 "[ . 1 . 2]" 1
1003 1 95 LEU HB2 1 96 LEU H . . 4.200 3.775 3.351 4.043 . 0 0 "[ . 1 . 2]" 1
1004 1 95 LEU HB3 1 95 LEU HG . . 3.000 2.575 2.346 3.053 0.053 5 0 "[ . 1 . 2]" 1
1005 1 95 LEU HB3 1 96 LEU H . . 4.200 2.807 2.443 3.287 . 0 0 "[ . 1 . 2]" 1
1006 1 95 LEU QD 1 99 LEU H . . 7.370 3.770 3.174 4.206 . 0 0 "[ . 1 . 2]" 1
1007 1 95 LEU HG 1 96 LEU H . . 5.000 4.535 3.918 5.078 0.078 9 0 "[ . 1 . 2]" 1
1008 1 96 LEU H 1 96 LEU QB . . 3.670 2.343 2.099 2.484 . 0 0 "[ . 1 . 2]" 1
1009 1 96 LEU H 1 96 LEU HG . . 5.000 3.772 2.636 4.490 . 0 0 "[ . 1 . 2]" 1
1010 1 96 LEU HA 1 96 LEU MD1 . . 4.000 2.623 2.055 3.404 . 0 0 "[ . 1 . 2]" 1
1011 1 96 LEU HA 1 96 LEU QD . . 3.410 2.316 2.032 2.947 . 0 0 "[ . 1 . 2]" 1
1012 1 96 LEU HA 1 96 LEU MD2 . . 4.000 2.820 2.090 3.404 . 0 0 "[ . 1 . 2]" 1
1013 1 96 LEU HA 1 99 LEU H . . 3.500 3.567 3.485 3.585 0.085 17 0 "[ . 1 . 2]" 1
1014 1 96 LEU HA 1 105 LEU QD . . 6.070 2.474 2.075 3.155 . 0 0 "[ . 1 . 2]" 1
1015 1 96 LEU QB 1 97 THR H . . 3.440 2.530 2.258 2.838 . 0 0 "[ . 1 . 2]" 1
1016 1 96 LEU HB2 1 97 THR H . . 3.700 2.780 2.474 3.721 0.021 14 0 "[ . 1 . 2]" 1
1017 1 96 LEU HB3 1 97 THR H . . 3.700 3.301 2.284 3.755 0.055 6 0 "[ . 1 . 2]" 1
1018 1 97 THR H 1 97 THR HB . . 3.000 2.539 2.308 2.997 . 0 0 "[ . 1 . 2]" 1
1019 1 97 THR H 1 97 THR MG . . 4.300 3.694 3.592 3.729 . 0 0 "[ . 1 . 2]" 1
1020 1 97 THR H 1 98 ARG H . . 3.000 2.730 2.514 2.875 . 0 0 "[ . 1 . 2]" 1
1021 1 97 THR HA 1 97 THR MG . . 3.400 2.387 2.197 2.516 . 0 0 "[ . 1 . 2]" 1
1022 1 97 THR HA 1 100 LYS H . . 4.100 3.428 3.082 3.738 . 0 0 "[ . 1 . 2]" 1
1023 1 97 THR HA 1 100 LYS HB2 . . 3.900 2.858 2.344 3.596 . 0 0 "[ . 1 . 2]" 1
1024 1 97 THR HA 1 100 LYS QB . . 3.700 2.765 2.328 3.342 . 0 0 "[ . 1 . 2]" 1
1025 1 97 THR HA 1 100 LYS HB3 . . 3.900 3.959 3.723 3.983 0.083 10 0 "[ . 1 . 2]" 1
1026 1 97 THR HA 1 100 LYS QD . . 6.000 4.431 3.126 5.258 . 0 0 "[ . 1 . 2]" 1
1027 1 97 THR HA 1 101 GLN H . . 4.900 3.982 3.706 4.291 . 0 0 "[ . 1 . 2]" 1
1028 1 97 THR HB 1 98 ARG H . . 3.100 2.483 2.321 2.726 . 0 0 "[ . 1 . 2]" 1
1029 1 97 THR HB 1 98 ARG QB . . 4.980 4.023 3.692 4.260 . 0 0 "[ . 1 . 2]" 1
1030 1 97 THR MG 1 98 ARG H . . 4.700 3.575 3.281 3.940 . 0 0 "[ . 1 . 2]" 1
1031 1 98 ARG H 1 98 ARG HB2 . . 3.400 2.174 2.030 2.455 . 0 0 "[ . 1 . 2]" 1
1032 1 98 ARG H 1 98 ARG QB . . 3.080 2.098 2.012 2.188 . 0 0 "[ . 1 . 2]" 1
1033 1 98 ARG H 1 98 ARG HB3 . . 3.400 2.970 2.367 3.407 0.007 16 0 "[ . 1 . 2]" 1
1034 1 98 ARG H 1 98 ARG QG . . 4.600 3.662 3.090 4.018 . 0 0 "[ . 1 . 2]" 1
1035 1 98 ARG H 1 99 LEU H . . 3.000 2.916 2.772 3.061 0.061 4 0 "[ . 1 . 2]" 1
1036 1 98 ARG HA 1 98 ARG HD2 . . 4.200 4.070 3.770 4.273 0.073 2 0 "[ . 1 . 2]" 1
1037 1 98 ARG HA 1 98 ARG QD . . 4.010 3.013 2.181 3.740 . 0 0 "[ . 1 . 2]" 1
1038 1 98 ARG HA 1 98 ARG HD3 . . 4.200 3.189 2.195 4.259 0.059 12 0 "[ . 1 . 2]" 1
1039 1 98 ARG HA 1 98 ARG QG . . 3.300 2.335 2.081 3.014 . 0 0 "[ . 1 . 2]" 1
1040 1 98 ARG HA 1 101 GLN H . . 4.500 3.794 3.127 4.350 . 0 0 "[ . 1 . 2]" 1
1041 1 98 ARG HB2 1 99 LEU H . . 3.900 3.540 2.977 3.956 0.056 4 0 "[ . 1 . 2]" 1
1042 1 98 ARG HB3 1 99 LEU H . . 3.900 2.738 2.403 3.130 . 0 0 "[ . 1 . 2]" 1
1043 1 99 LEU H 1 99 LEU HB2 . . 3.600 2.260 2.072 3.653 0.053 12 0 "[ . 1 . 2]" 1
1044 1 99 LEU H 1 99 LEU QB . . 3.200 2.201 2.054 2.897 . 0 0 "[ . 1 . 2]" 1
1045 1 99 LEU H 1 99 LEU HB3 . . 3.600 3.453 3.038 3.560 . 0 0 "[ . 1 . 2]" 1
1046 1 99 LEU H 1 99 LEU MD1 . . 5.500 3.249 2.289 3.856 . 0 0 "[ . 1 . 2]" 1
1047 1 99 LEU H 1 99 LEU QD . . 4.500 2.988 2.276 3.257 . 0 0 "[ . 1 . 2]" 1
1048 1 99 LEU H 1 99 LEU MD2 . . 5.500 3.788 2.323 4.218 . 0 0 "[ . 1 . 2]" 1
1049 1 99 LEU H 1 99 LEU HG . . 3.500 2.802 1.767 3.591 0.091 5 0 "[ . 1 . 2]" 1
1050 1 99 LEU H 1 100 LYS H . . 2.800 2.788 2.611 2.872 0.072 1 0 "[ . 1 . 2]" 1
1051 1 99 LEU HA 1 102 ILE H . . 3.400 3.477 3.420 3.493 0.093 18 0 "[ . 1 . 2]" 1
1052 1 99 LEU HA 1 102 ILE HG12 . . 5.000 2.660 2.376 3.100 . 0 0 "[ . 1 . 2]" 1
1053 1 99 LEU HA 1 102 ILE HG13 . . 5.000 3.383 2.963 3.810 . 0 0 "[ . 1 . 2]" 1
1054 1 99 LEU HA 1 104 ALA MB . . 4.300 3.161 2.902 3.554 . 0 0 "[ . 1 . 2]" 1
1055 1 99 LEU QB 1 100 LYS H . . 3.860 2.577 2.347 3.496 . 0 0 "[ . 1 . 2]" 1
1056 1 99 LEU QB 1 104 ALA MB . . 3.830 2.034 1.961 2.135 . 0 0 "[ . 1 . 2]" 1
1057 1 99 LEU HB2 1 100 LYS H . . 4.200 2.686 2.423 3.710 . 0 0 "[ . 1 . 2]" 1
1058 1 99 LEU HB2 1 104 ALA MB . . 4.400 3.357 2.092 3.570 . 0 0 "[ . 1 . 2]" 1
1059 1 99 LEU HB3 1 100 LYS H . . 4.200 3.336 3.137 4.273 0.073 12 0 "[ . 1 . 2]" 1
1060 1 99 LEU HB3 1 104 ALA MB . . 4.400 2.117 1.974 3.426 . 0 0 "[ . 1 . 2]" 1
1061 1 99 LEU QD 1 100 LYS H . . 7.570 3.976 2.659 4.149 . 0 0 "[ . 1 . 2]" 1
1062 1 100 LYS H 1 100 LYS QB . . 3.460 2.206 2.129 2.332 . 0 0 "[ . 1 . 2]" 1
1063 1 100 LYS H 1 100 LYS HG2 . . 5.000 3.911 3.296 4.475 . 0 0 "[ . 1 . 2]" 1
1064 1 100 LYS H 1 100 LYS HG3 . . 5.000 3.156 2.461 4.057 . 0 0 "[ . 1 . 2]" 1
1065 1 100 LYS H 1 101 GLN H . . 2.800 2.744 2.582 2.876 0.076 17 0 "[ . 1 . 2]" 1
1066 1 100 LYS H 1 105 LEU MD1 . . 6.000 4.013 3.143 5.091 . 0 0 "[ . 1 . 2]" 1
1067 1 100 LYS H 1 105 LEU QD . . 5.250 3.244 2.390 4.031 . 0 0 "[ . 1 . 2]" 1
1068 1 100 LYS H 1 105 LEU MD2 . . 6.000 3.903 2.394 4.918 . 0 0 "[ . 1 . 2]" 1
1069 1 100 LYS HA 1 103 GLY H . . 4.000 3.123 2.865 3.403 . 0 0 "[ . 1 . 2]" 1
1070 1 100 LYS HA 1 105 LEU H . . 3.600 2.831 2.589 3.141 . 0 0 "[ . 1 . 2]" 1
1071 1 100 LYS HA 1 105 LEU QB . . 5.880 4.262 3.538 4.836 . 0 0 "[ . 1 . 2]" 1
1072 1 100 LYS HA 1 105 LEU QD . . 5.870 3.726 2.806 4.341 . 0 0 "[ . 1 . 2]" 1
1073 1 100 LYS QB 1 101 GLN H . . 3.290 2.944 2.805 3.083 . 0 0 "[ . 1 . 2]" 1
1074 1 100 LYS HB2 1 101 GLN H . . 3.500 3.283 2.935 3.594 0.094 1 0 "[ . 1 . 2]" 1
1075 1 100 LYS HB3 1 101 GLN H . . 3.500 3.428 3.051 3.585 0.085 17 0 "[ . 1 . 2]" 1
1076 1 100 LYS QG 1 104 ALA MB . . 4.980 3.517 3.364 3.596 . 0 0 "[ . 1 . 2]" 1
1077 1 101 GLN H 1 101 GLN HA . . 2.900 2.781 2.737 2.809 . 0 0 "[ . 1 . 2]" 1
1078 1 101 GLN H 1 101 GLN HB2 . . 2.900 2.241 2.071 2.579 . 0 0 "[ . 1 . 2]" 1
1079 1 101 GLN H 1 101 GLN HB3 . . 2.900 2.797 2.483 2.977 0.077 19 0 "[ . 1 . 2]" 1
1080 1 101 GLN H 1 101 GLN HG2 . . 5.000 4.547 4.368 4.671 . 0 0 "[ . 1 . 2]" 1
1081 1 101 GLN H 1 101 GLN QG . . 4.680 3.982 3.806 4.131 . 0 0 "[ . 1 . 2]" 1
1082 1 101 GLN H 1 101 GLN HG3 . . 5.000 4.409 4.097 4.626 . 0 0 "[ . 1 . 2]" 1
1083 1 101 GLN H 1 102 ILE H . . 3.200 2.960 2.874 3.080 . 0 0 "[ . 1 . 2]" 1
1084 1 101 GLN HB2 1 102 ILE H . . 4.000 3.962 3.631 4.077 0.077 12 0 "[ . 1 . 2]" 1
1085 1 101 GLN HB3 1 102 ILE H . . 4.000 2.961 2.654 3.400 . 0 0 "[ . 1 . 2]" 1
1086 1 102 ILE H 1 102 ILE MD . . 5.200 4.073 3.964 4.179 . 0 0 "[ . 1 . 2]" 1
1087 1 102 ILE H 1 102 ILE HG12 . . 3.000 2.996 2.724 3.073 0.073 13 0 "[ . 1 . 2]" 1
1088 1 102 ILE H 1 102 ILE QG . . 2.720 2.459 2.311 2.583 . 0 0 "[ . 1 . 2]" 1
1089 1 102 ILE H 1 102 ILE HG13 . . 3.000 2.625 2.391 2.818 . 0 0 "[ . 1 . 2]" 1
1090 1 102 ILE H 1 102 ILE MG . . 3.400 2.295 2.025 2.571 . 0 0 "[ . 1 . 2]" 1
1091 1 102 ILE H 1 103 GLY H . . 2.800 2.588 2.252 2.783 . 0 0 "[ . 1 . 2]" 1
1092 1 102 ILE HA 1 102 ILE HB . . 2.800 2.302 2.266 2.333 . 0 0 "[ . 1 . 2]" 1
1093 1 102 ILE HA 1 102 ILE MG . . 3.400 2.468 2.364 2.587 . 0 0 "[ . 1 . 2]" 1
1094 1 102 ILE HB 1 102 ILE MD . . 3.400 2.202 2.175 2.266 . 0 0 "[ . 1 . 2]" 1
1095 1 102 ILE HB 1 102 ILE HG12 . . 3.000 2.939 2.892 3.027 0.027 20 0 "[ . 1 . 2]" 1
1096 1 102 ILE HB 1 102 ILE HG13 . . 3.000 2.816 2.631 2.875 . 0 0 "[ . 1 . 2]" 1
1097 1 102 ILE MD 1 104 ALA H . . 5.800 4.297 3.909 4.824 . 0 0 "[ . 1 . 2]" 1
1098 1 102 ILE QG 1 104 ALA H . . 4.310 3.142 2.646 3.676 . 0 0 "[ . 1 . 2]" 1
1099 1 102 ILE HG12 1 102 ILE MG . . 3.400 2.093 2.038 2.128 . 0 0 "[ . 1 . 2]" 1
1100 1 102 ILE HG12 1 104 ALA H . . 5.000 4.682 4.071 5.077 0.077 17 0 "[ . 1 . 2]" 1
1101 1 102 ILE HG13 1 102 ILE MG . . 3.400 2.922 2.896 2.962 . 0 0 "[ . 1 . 2]" 1
1102 1 102 ILE HG13 1 104 ALA H . . 5.000 3.195 2.680 3.774 . 0 0 "[ . 1 . 2]" 1
1103 1 103 GLY H 1 103 GLY HA2 . . 2.500 2.296 2.252 2.345 . 0 0 "[ . 1 . 2]" 1
1104 1 103 GLY HA2 1 104 ALA H . . 3.400 2.822 2.269 3.175 . 0 0 "[ . 1 . 2]" 1
1105 1 103 GLY HA3 1 104 ALA H . . 3.600 3.558 3.483 3.611 0.011 14 0 "[ . 1 . 2]" 1
1106 1 104 ALA H 1 104 ALA MB . . 3.400 2.166 2.017 2.505 . 0 0 "[ . 1 . 2]" 1
1107 1 104 ALA H 1 105 LEU H . . 2.800 2.857 2.569 2.891 0.091 19 0 "[ . 1 . 2]" 1
1108 1 104 ALA MB 1 105 LEU H . . 3.600 2.095 1.872 2.274 . 0 0 "[ . 1 . 2]" 1
1109 1 105 LEU H 1 105 LEU HB2 . . 3.400 2.719 2.193 3.037 . 0 0 "[ . 1 . 2]" 1
1110 1 105 LEU H 1 105 LEU QB . . 3.180 2.622 2.170 2.860 . 0 0 "[ . 1 . 2]" 1
1111 1 105 LEU H 1 105 LEU HB3 . . 3.400 3.495 3.461 3.504 0.104 14 0 "[ . 1 . 2]" 1
1112 1 105 LEU H 1 105 LEU MD1 . . 5.700 3.363 2.233 3.687 . 0 0 "[ . 1 . 2]" 1
1113 1 105 LEU H 1 105 LEU MD2 . . 5.700 2.671 1.764 4.058 . 0 0 "[ . 1 . 2]" 1
1114 1 105 LEU H 1 105 LEU HG . . 3.800 2.612 1.844 3.867 0.067 14 0 "[ . 1 . 2]" 1
1115 1 105 LEU QB 1 106 GLN H . . 3.340 2.793 2.407 3.110 . 0 0 "[ . 1 . 2]" 1
1116 1 105 LEU HB2 1 106 GLN H . . 3.600 3.669 3.388 3.696 0.096 13 0 "[ . 1 . 2]" 1
1117 1 105 LEU HB3 1 106 GLN H . . 3.600 2.919 2.440 3.620 0.020 6 0 "[ . 1 . 2]" 1
1118 1 105 LEU QD 1 106 GLN H . . 7.570 3.779 3.234 4.232 . 0 0 "[ . 1 . 2]" 1
1119 1 106 GLN H 1 106 GLN HB2 . . 3.300 2.642 2.253 3.364 0.064 12 0 "[ . 1 . 2]" 1
1120 1 106 GLN H 1 106 GLN HB3 . . 3.300 2.687 2.260 3.390 0.090 13 0 "[ . 1 . 2]" 1
1121 1 106 GLN H 1 106 GLN HG2 . . 4.600 4.474 4.301 4.607 0.007 3 0 "[ . 1 . 2]" 1
1122 1 106 GLN H 1 106 GLN QG . . 4.410 3.962 3.522 4.051 . 0 0 "[ . 1 . 2]" 1
1123 1 106 GLN H 1 106 GLN HG3 . . 4.600 4.439 3.739 4.679 0.079 1 0 "[ . 1 . 2]" 1
1124 1 106 GLN HA 1 106 GLN HB2 . . 3.000 2.529 2.412 3.040 0.040 13 0 "[ . 1 . 2]" 1
1125 1 106 GLN HA 1 106 GLN HB3 . . 3.000 3.030 2.726 3.066 0.066 1 0 "[ . 1 . 2]" 1
1126 1 106 GLN HA 1 106 GLN HG2 . . 3.200 3.006 2.193 3.262 0.062 9 0 "[ . 1 . 2]" 1
1127 1 106 GLN HA 1 106 GLN QG . . 2.780 2.337 2.128 2.531 . 0 0 "[ . 1 . 2]" 1
1128 1 106 GLN HA 1 106 GLN HG3 . . 3.200 2.525 2.249 3.248 0.048 6 0 "[ . 1 . 2]" 1
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