NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
452458 |
2v37   |
7268 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2v37
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 2092
_Distance_constraint_stats_list.Viol_count 4518
_Distance_constraint_stats_list.Viol_total 3984.176
_Distance_constraint_stats_list.Viol_max 0.245
_Distance_constraint_stats_list.Viol_rms 0.0185
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0048
_Distance_constraint_stats_list.Viol_average_violations_only 0.0441
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 SER 2.967 0.129 18 0 "[ . 1 . 2]"
1 2 ILE 4.984 0.149 9 0 "[ . 1 . 2]"
1 3 VAL 5.029 0.120 3 0 "[ . 1 . 2]"
1 4 VAL 2.428 0.113 20 0 "[ . 1 . 2]"
1 5 SER 2.209 0.164 16 0 "[ . 1 . 2]"
1 6 PRO 1.477 0.063 7 0 "[ . 1 . 2]"
1 7 ILE 4.596 0.077 5 0 "[ . 1 . 2]"
1 8 LEU 10.481 0.122 11 0 "[ . 1 . 2]"
1 9 ILE 7.197 0.150 12 0 "[ . 1 . 2]"
1 10 PRO 1.877 0.108 13 0 "[ . 1 . 2]"
1 11 GLU 1.931 0.137 15 0 "[ . 1 . 2]"
1 12 ASN 3.050 0.243 8 0 "[ . 1 . 2]"
1 13 GLN 0.839 0.104 11 0 "[ . 1 . 2]"
1 14 ARG 8.381 0.207 14 0 "[ . 1 . 2]"
1 15 GLN 4.833 0.155 12 0 "[ . 1 . 2]"
1 16 PRO 2.611 0.154 3 0 "[ . 1 . 2]"
1 17 PHE 4.537 0.136 7 0 "[ . 1 . 2]"
1 18 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 19 ARG 2.110 0.176 1 0 "[ . 1 . 2]"
1 20 ASP 2.593 0.152 5 0 "[ . 1 . 2]"
1 21 VAL 4.445 0.150 12 0 "[ . 1 . 2]"
1 22 GLY 2.597 0.152 5 0 "[ . 1 . 2]"
1 23 LYS 0.636 0.122 3 0 "[ . 1 . 2]"
1 24 VAL 3.494 0.094 6 0 "[ . 1 . 2]"
1 25 VAL 5.180 0.120 3 0 "[ . 1 . 2]"
1 26 ASP 0.964 0.089 2 0 "[ . 1 . 2]"
1 27 SER 3.249 0.119 3 0 "[ . 1 . 2]"
1 28 ASP 3.150 0.173 6 0 "[ . 1 . 2]"
1 29 ARG 4.187 0.178 20 0 "[ . 1 . 2]"
1 30 PRO 0.287 0.081 1 0 "[ . 1 . 2]"
1 31 GLU 0.395 0.110 18 0 "[ . 1 . 2]"
1 32 ARG 0.782 0.158 16 0 "[ . 1 . 2]"
1 33 SER 1.171 0.151 7 0 "[ . 1 . 2]"
1 34 LYS 7.158 0.169 17 0 "[ . 1 . 2]"
1 35 PHE 2.648 0.105 6 0 "[ . 1 . 2]"
1 36 ARG 6.016 0.174 5 0 "[ . 1 . 2]"
1 37 LEU 2.975 0.101 6 0 "[ . 1 . 2]"
1 38 THR 5.255 0.135 7 0 "[ . 1 . 2]"
1 39 GLY 0.112 0.026 6 0 "[ . 1 . 2]"
1 40 LYS 1.261 0.114 5 0 "[ . 1 . 2]"
1 41 GLY 1.788 0.112 4 0 "[ . 1 . 2]"
1 42 VAL 2.327 0.088 16 0 "[ . 1 . 2]"
1 43 ASP 3.116 0.160 1 0 "[ . 1 . 2]"
1 44 GLN 2.162 0.093 9 0 "[ . 1 . 2]"
1 45 GLU 2.669 0.112 4 0 "[ . 1 . 2]"
1 46 PRO 0.662 0.064 16 0 "[ . 1 . 2]"
1 47 LYS 1.593 0.063 3 0 "[ . 1 . 2]"
1 48 GLY 0.452 0.048 5 0 "[ . 1 . 2]"
1 49 ILE 3.834 0.114 15 0 "[ . 1 . 2]"
1 50 PHE 3.061 0.114 15 0 "[ . 1 . 2]"
1 51 ARG 3.854 0.227 5 0 "[ . 1 . 2]"
1 52 ILE 3.158 0.131 10 0 "[ . 1 . 2]"
1 53 ASN 1.368 0.131 10 0 "[ . 1 . 2]"
1 54 GLU 1.405 0.169 17 0 "[ . 1 . 2]"
1 55 ASN 5.606 0.164 6 0 "[ . 1 . 2]"
1 56 THR 2.736 0.146 16 0 "[ . 1 . 2]"
1 57 GLY 2.210 0.146 16 0 "[ . 1 . 2]"
1 58 SER 0.837 0.061 18 0 "[ . 1 . 2]"
1 59 VAL 2.656 0.093 20 0 "[ . 1 . 2]"
1 60 SER 2.825 0.083 8 0 "[ . 1 . 2]"
1 61 VAL 0.327 0.048 8 0 "[ . 1 . 2]"
1 62 THR 0.381 0.090 5 0 "[ . 1 . 2]"
1 63 ARG 2.122 0.099 9 0 "[ . 1 . 2]"
1 64 THR 2.685 0.121 9 0 "[ . 1 . 2]"
1 65 LEU 1.805 0.090 10 0 "[ . 1 . 2]"
1 66 ASP 0.627 0.111 2 0 "[ . 1 . 2]"
1 67 ARG 1.430 0.117 11 0 "[ . 1 . 2]"
1 68 GLU 4.691 0.150 15 0 "[ . 1 . 2]"
1 69 VAL 4.311 0.135 9 0 "[ . 1 . 2]"
1 70 ILE 7.540 0.128 2 0 "[ . 1 . 2]"
1 71 ALA 0.790 0.064 16 0 "[ . 1 . 2]"
1 72 VAL 3.508 0.123 16 0 "[ . 1 . 2]"
1 73 TYR 2.431 0.066 2 0 "[ . 1 . 2]"
1 74 GLN 1.860 0.166 19 0 "[ . 1 . 2]"
1 75 LEU 8.855 0.114 15 0 "[ . 1 . 2]"
1 76 PHE 6.155 0.135 7 0 "[ . 1 . 2]"
1 77 VAL 11.310 0.128 14 0 "[ . 1 . 2]"
1 78 GLU 4.470 0.103 3 0 "[ . 1 . 2]"
1 79 THR 4.121 0.136 8 0 "[ . 1 . 2]"
1 80 THR 10.289 0.174 5 0 "[ . 1 . 2]"
1 81 ASP 5.348 0.162 2 0 "[ . 1 . 2]"
1 82 VAL 3.478 0.162 2 0 "[ . 1 . 2]"
1 83 ASN 3.607 0.173 20 0 "[ . 1 . 2]"
1 84 GLY 0.478 0.069 11 0 "[ . 1 . 2]"
1 85 LYS 5.337 0.166 7 0 "[ . 1 . 2]"
1 86 THR 2.503 0.099 13 0 "[ . 1 . 2]"
1 87 LEU 8.917 0.218 9 0 "[ . 1 . 2]"
1 88 GLU 3.721 0.175 8 0 "[ . 1 . 2]"
1 89 GLY 1.709 0.099 4 0 "[ . 1 . 2]"
1 90 PRO 0.114 0.028 19 0 "[ . 1 . 2]"
1 91 VAL 8.741 0.100 14 0 "[ . 1 . 2]"
1 92 PRO 3.371 0.128 14 0 "[ . 1 . 2]"
1 93 LEU 7.376 0.117 6 0 "[ . 1 . 2]"
1 94 GLU 1.939 0.117 6 0 "[ . 1 . 2]"
1 95 VAL 4.965 0.150 12 0 "[ . 1 . 2]"
1 96 ILE 2.074 0.245 7 0 "[ . 1 . 2]"
1 97 VAL 0.798 0.117 11 0 "[ . 1 . 2]"
1 98 ILE 4.756 0.137 15 0 "[ . 1 . 2]"
1 99 ASP 4.516 0.150 16 0 "[ . 1 . 2]"
1 100 GLN 1.549 0.218 1 0 "[ . 1 . 2]"
1 101 ASN 0.411 0.234 2 0 "[ . 1 . 2]"
1 102 ASP 0.271 0.064 11 0 "[ . 1 . 2]"
1 103 ASN 2.090 0.234 2 0 "[ . 1 . 2]"
1 104 ARG 0.629 0.093 20 0 "[ . 1 . 2]"
1 105 PRO 0.119 0.065 12 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 1 SER HA 1 1 SER HB2 2.800 . 2.800 2.823 2.590 2.929 0.129 18 0 "[ . 1 . 2]" 1
2 1 1 SER HA 1 1 SER HB3 2.800 . 2.800 2.260 2.219 2.331 . 0 0 "[ . 1 . 2]" 1
3 1 1 SER HA 1 2 ILE H 2.800 . 2.800 2.257 2.132 2.358 . 0 0 "[ . 1 . 2]" 1
4 1 1 SER HA 1 2 ILE H 2.800 . 2.800 2.175 2.072 2.254 . 0 0 "[ . 1 . 2]" 1
5 1 1 SER HA 1 2 ILE HB 4.500 . 4.500 4.480 4.223 4.562 0.062 17 0 "[ . 1 . 2]" 1
6 1 1 SER HA 1 2 ILE HG13 4.500 . 4.500 4.285 3.649 4.571 0.071 15 0 "[ . 1 . 2]" 1
7 1 1 SER HA 1 88 GLU HG3 5.500 . 5.500 3.710 1.884 4.774 . 0 0 "[ . 1 . 2]" 1
8 1 1 SER QB 1 2 ILE H 4.500 . 4.500 3.048 2.650 3.815 . 0 0 "[ . 1 . 2]" 1
9 1 1 SER HB2 1 2 ILE HA 4.500 . 4.500 4.565 4.527 4.609 0.109 17 0 "[ . 1 . 2]" 1
10 1 1 SER HB3 1 2 ILE HA 5.500 . 5.500 5.251 4.828 5.592 0.092 15 0 "[ . 1 . 2]" 1
11 1 2 ILE H 1 2 ILE HB 3.500 . 3.500 2.261 2.146 2.341 . 0 0 "[ . 1 . 2]" 1
12 1 2 ILE H 1 2 ILE MD 3.500 . 3.500 3.338 2.793 3.520 0.020 14 0 "[ . 1 . 2]" 1
13 1 2 ILE H 1 2 ILE HG13 4.500 . 4.500 2.790 2.364 3.124 . 0 0 "[ . 1 . 2]" 1
14 1 2 ILE H 1 2 ILE MG 4.500 . 4.500 3.688 3.590 3.744 . 0 0 "[ . 1 . 2]" 1
15 1 2 ILE H 1 89 GLY H 5.500 . 5.500 4.928 4.367 5.514 0.014 15 0 "[ . 1 . 2]" 1
16 1 2 ILE H 1 91 VAL QG 5.500 . 5.500 3.297 2.812 3.955 . 0 0 "[ . 1 . 2]" 1
17 1 2 ILE HA 1 2 ILE MD 4.500 . 4.500 3.750 3.683 3.803 . 0 0 "[ . 1 . 2]" 1
18 1 2 ILE HA 1 2 ILE HG12 4.500 . 4.500 2.684 2.517 2.893 . 0 0 "[ . 1 . 2]" 1
19 1 2 ILE HA 1 2 ILE QG 3.500 . 3.500 2.270 2.167 2.351 . 0 0 "[ . 1 . 2]" 1
20 1 2 ILE HA 1 2 ILE HG13 . . 3.500 2.458 2.284 2.574 . 0 0 "[ . 1 . 2]" 1
21 1 2 ILE HA 1 2 ILE MG 2.800 . 2.800 2.575 2.407 2.706 . 0 0 "[ . 1 . 2]" 1
22 1 2 ILE HA 1 2 ILE MG 2.800 . 2.800 2.511 2.370 2.611 . 0 0 "[ . 1 . 2]" 1
23 1 2 ILE HA 1 3 VAL H 2.800 . 2.800 2.156 2.079 2.247 . 0 0 "[ . 1 . 2]" 1
24 1 2 ILE HA 1 3 VAL H 2.800 . 2.800 2.105 2.040 2.182 . 0 0 "[ . 1 . 2]" 1
25 1 2 ILE HA 1 3 VAL MG1 2.800 . 2.800 2.809 2.750 2.850 0.050 12 0 "[ . 1 . 2]" 1
26 1 2 ILE HA 1 3 VAL MG1 4.500 . 4.500 3.170 3.065 3.267 . 0 0 "[ . 1 . 2]" 1
27 1 2 ILE HA 1 24 VAL MG1 4.500 . 4.500 3.456 3.291 3.610 . 0 0 "[ . 1 . 2]" 1
28 1 2 ILE HA 1 26 ASP H 2.800 . 2.800 2.371 2.144 2.546 . 0 0 "[ . 1 . 2]" 1
29 1 2 ILE HA 1 26 ASP HA 2.800 . 2.800 2.013 1.821 2.404 . 0 0 "[ . 1 . 2]" 1
30 1 2 ILE HA 1 26 ASP HB2 4.500 . 4.500 2.966 2.255 3.375 . 0 0 "[ . 1 . 2]" 1
31 1 2 ILE HA 1 26 ASP HB3 4.500 . 4.500 4.290 3.827 4.510 0.010 11 0 "[ . 1 . 2]" 1
32 1 2 ILE HB 1 2 ILE MD 2.800 . 2.800 2.170 2.018 2.278 . 0 0 "[ . 1 . 2]" 1
33 1 2 ILE HB 1 2 ILE HG13 . . 2.800 2.647 2.545 2.729 . 0 0 "[ . 1 . 2]" 1
34 1 2 ILE HB 1 3 VAL H 5.500 . 5.500 4.264 4.011 4.451 . 0 0 "[ . 1 . 2]" 1
35 1 2 ILE HB 1 24 VAL MG1 5.500 . 5.500 4.134 4.000 4.375 . 0 0 "[ . 1 . 2]" 1
36 1 2 ILE HB 1 79 THR MG 3.500 . 3.500 2.670 1.791 3.544 0.044 6 0 "[ . 1 . 2]" 1
37 1 2 ILE HB 1 91 VAL MG1 2.800 . 2.800 2.199 1.969 2.579 . 0 0 "[ . 1 . 2]" 1
38 1 2 ILE MD 1 3 VAL H 5.500 . 5.500 5.019 4.775 5.229 . 0 0 "[ . 1 . 2]" 1
39 1 2 ILE MD 1 24 VAL MG1 3.500 . 3.500 3.330 2.968 3.567 0.067 9 0 "[ . 1 . 2]" 1
40 1 2 ILE MD 1 35 PHE QE 5.500 . 5.500 3.232 2.606 3.886 . 0 0 "[ . 1 . 2]" 1
41 1 2 ILE MD 1 35 PHE QE 3.500 . 3.500 2.324 2.055 2.904 . 0 0 "[ . 1 . 2]" 1
42 1 2 ILE MD 1 35 PHE HZ 4.500 . 4.500 3.164 2.520 3.718 . 0 0 "[ . 1 . 2]" 1
43 1 2 ILE MD 1 78 GLU H 3.500 . 3.500 3.315 2.964 3.524 0.024 9 0 "[ . 1 . 2]" 1
44 1 2 ILE MD 1 78 GLU HA 3.500 . 3.500 2.441 2.002 2.765 . 0 0 "[ . 1 . 2]" 1
45 1 2 ILE MD 1 79 THR H 3.500 . 3.500 2.155 1.824 2.517 . 0 0 "[ . 1 . 2]" 1
46 1 2 ILE MD 1 79 THR H 2.800 . 2.800 2.139 1.817 2.480 . 0 0 "[ . 1 . 2]" 1
47 1 2 ILE MD 1 88 GLU H 5.500 . 5.500 4.052 3.406 4.662 . 0 0 "[ . 1 . 2]" 1
48 1 2 ILE MD 1 88 GLU QB 2.800 . 2.800 2.396 1.934 2.869 0.069 11 0 "[ . 1 . 2]" 1
49 1 2 ILE MD 1 88 GLU QG . . 3.500 3.065 1.882 3.649 0.149 9 0 "[ . 1 . 2]" 1
50 1 2 ILE MD 1 89 GLY H 4.500 . 4.500 3.603 2.988 4.166 . 0 0 "[ . 1 . 2]" 1
51 1 2 ILE MD 1 89 GLY QA 4.500 . 4.500 2.806 2.495 3.209 . 0 0 "[ . 1 . 2]" 1
52 1 2 ILE MD 1 91 VAL H 5.500 . 5.500 3.309 3.050 3.597 . 0 0 "[ . 1 . 2]" 1
53 1 2 ILE MD 1 91 VAL HB 4.500 . 4.500 4.201 3.943 4.511 0.011 20 0 "[ . 1 . 2]" 1
54 1 2 ILE MD 1 91 VAL MG1 2.800 . 2.800 2.529 2.067 2.831 0.031 20 0 "[ . 1 . 2]" 1
55 1 2 ILE HG12 1 2 ILE MG . . 2.800 2.178 2.084 2.240 . 0 0 "[ . 1 . 2]" 1
56 1 2 ILE HG12 1 24 VAL MG1 2.800 . 2.800 2.737 2.384 2.855 0.055 15 0 "[ . 1 . 2]" 1
57 1 2 ILE HG12 1 26 ASP HB2 5.500 . 5.500 3.162 2.558 3.736 . 0 0 "[ . 1 . 2]" 1
58 1 2 ILE HG12 1 79 THR MG 3.500 . 3.500 2.808 2.181 3.404 . 0 0 "[ . 1 . 2]" 1
59 1 2 ILE HG12 1 77 VAL HB 3.500 . 3.500 3.546 3.441 3.601 0.101 6 0 "[ . 1 . 2]" 1
60 1 2 ILE HG12 1 79 THR H 4.500 . 4.500 3.866 3.615 4.074 . 0 0 "[ . 1 . 2]" 1
61 1 2 ILE HG12 1 91 VAL MG1 5.500 . 5.500 4.506 4.229 4.698 . 0 0 "[ . 1 . 2]" 1
62 1 2 ILE HG13 1 2 ILE MG 3.500 . 3.500 3.144 3.104 3.176 . 0 0 "[ . 1 . 2]" 1
63 1 2 ILE HG13 1 3 VAL H 5.500 . 5.500 4.470 4.242 4.676 . 0 0 "[ . 1 . 2]" 1
64 1 2 ILE HG13 1 26 ASP HA 5.500 . 5.500 3.721 3.301 4.343 . 0 0 "[ . 1 . 2]" 1
65 1 2 ILE HG13 1 26 ASP HB2 5.500 . 5.500 2.761 2.113 2.999 . 0 0 "[ . 1 . 2]" 1
66 1 2 ILE HG13 1 26 ASP HB3 4.500 . 4.500 4.331 3.659 4.554 0.054 19 0 "[ . 1 . 2]" 1
67 1 2 ILE HG13 1 79 THR H 5.500 . 5.500 4.078 3.624 4.535 . 0 0 "[ . 1 . 2]" 1
68 1 2 ILE HG13 1 91 VAL MG1 . . 4.500 4.246 3.982 4.517 0.017 17 0 "[ . 1 . 2]" 1
69 1 2 ILE MG 1 3 VAL H 2.800 . 2.800 2.460 2.043 2.834 0.034 10 0 "[ . 1 . 2]" 1
70 1 2 ILE MG 1 3 VAL H 2.800 . 2.800 2.403 2.021 2.758 . 0 0 "[ . 1 . 2]" 1
71 1 2 ILE MG 1 3 VAL HA 5.500 . 5.500 3.508 3.238 3.743 . 0 0 "[ . 1 . 2]" 1
72 1 2 ILE MG 1 3 VAL HB 5.500 . 5.500 4.984 4.744 5.210 . 0 0 "[ . 1 . 2]" 1
73 1 2 ILE MG 1 4 VAL H 4.500 . 4.500 3.720 3.303 4.260 . 0 0 "[ . 1 . 2]" 1
74 1 2 ILE MG 1 4 VAL HB 5.500 . 5.500 3.144 2.778 3.385 . 0 0 "[ . 1 . 2]" 1
75 1 2 ILE MG 1 24 VAL HB 5.500 . 5.500 4.130 3.928 4.563 . 0 0 "[ . 1 . 2]" 1
76 1 2 ILE MG 1 25 VAL H 2.800 . 2.800 2.346 1.888 2.779 . 0 0 "[ . 1 . 2]" 1
77 1 2 ILE MG 1 77 VAL MG1 2.800 . 2.800 2.027 1.938 2.185 . 0 0 "[ . 1 . 2]" 1
78 1 2 ILE MG 1 77 VAL MG2 2.800 . 2.800 2.155 1.934 2.381 . 0 0 "[ . 1 . 2]" 1
79 1 2 ILE MG 1 25 VAL H 5.500 . 5.500 3.402 2.965 3.806 . 0 0 "[ . 1 . 2]" 1
80 1 2 ILE MG 1 26 ASP HA 5.500 . 5.500 4.064 3.813 4.446 . 0 0 "[ . 1 . 2]" 1
81 1 2 ILE MG 1 91 VAL HB 4.500 . 4.500 3.147 2.920 3.443 . 0 0 "[ . 1 . 2]" 1
82 1 2 ILE MG 1 91 VAL MG1 2.800 . 2.800 2.716 2.393 2.833 0.033 3 0 "[ . 1 . 2]" 1
83 1 2 ILE MG 1 91 VAL MG2 3.500 . 3.500 1.819 1.789 1.884 0.011 11 0 "[ . 1 . 2]" 1
84 1 3 VAL H 1 3 VAL HB 3.500 . 3.500 3.469 3.364 3.541 0.041 17 0 "[ . 1 . 2]" 1
85 1 3 VAL H 1 3 VAL QG 2.800 . 2.800 1.968 1.814 2.155 . 0 0 "[ . 1 . 2]" 1
86 1 3 VAL H 1 4 VAL H 4.500 . 4.500 4.229 3.973 4.447 . 0 0 "[ . 1 . 2]" 1
87 1 3 VAL H 1 25 VAL H . . 4.500 3.084 2.777 3.336 . 0 0 "[ . 1 . 2]" 1
88 1 3 VAL H 1 25 VAL O 1.900 . 2.300 1.713 1.680 1.777 0.120 3 0 "[ . 1 . 2]" 1
89 1 3 VAL H 1 26 ASP HA 3.500 . 3.500 2.795 2.299 3.222 . 0 0 "[ . 1 . 2]" 1
90 1 3 VAL H 1 26 ASP HB2 5.500 . 5.500 4.517 3.971 5.005 . 0 0 "[ . 1 . 2]" 1
91 1 3 VAL HA 1 3 VAL MG1 3.500 . 3.500 3.139 3.045 3.188 . 0 0 "[ . 1 . 2]" 1
92 1 3 VAL HA 1 3 VAL MG2 2.800 . 2.800 2.757 2.639 2.861 0.061 10 0 "[ . 1 . 2]" 1
93 1 3 VAL HA 1 4 VAL H 2.800 . 2.800 2.188 2.117 2.269 . 0 0 "[ . 1 . 2]" 1
94 1 3 VAL HA 1 4 VAL MG1 4.500 . 4.500 3.243 3.091 3.487 . 0 0 "[ . 1 . 2]" 1
95 1 3 VAL HB 1 4 VAL H 4.500 . 4.500 4.015 3.635 4.277 . 0 0 "[ . 1 . 2]" 1
96 1 3 VAL HB 1 25 VAL H 5.500 . 5.500 5.512 5.239 5.597 0.097 6 0 "[ . 1 . 2]" 1
97 1 3 VAL MG1 1 4 VAL H 4.500 . 4.500 4.396 4.250 4.503 0.003 8 0 "[ . 1 . 2]" 1
98 1 3 VAL MG1 1 25 VAL H 5.500 . 5.500 3.049 2.613 3.377 . 0 0 "[ . 1 . 2]" 1
99 1 3 VAL MG1 1 27 SER H 3.500 . 3.500 2.664 2.102 3.314 . 0 0 "[ . 1 . 2]" 1
100 1 3 VAL MG1 1 27 SER HA 4.500 . 4.500 3.240 2.691 3.878 . 0 0 "[ . 1 . 2]" 1
101 1 3 VAL MG1 1 26 ASP HA 4.500 . 4.500 2.628 2.312 3.211 . 0 0 "[ . 1 . 2]" 1
102 1 3 VAL MG1 1 27 SER HB2 4.500 . 4.500 4.502 4.321 4.580 0.080 8 0 "[ . 1 . 2]" 1
103 1 3 VAL MG1 1 27 SER QB 4.500 . 4.500 3.518 3.048 4.033 . 0 0 "[ . 1 . 2]" 1
104 1 3 VAL MG1 1 27 SER HB3 4.500 . 4.500 3.718 3.104 4.516 0.016 3 0 "[ . 1 . 2]" 1
105 1 3 VAL MG2 1 4 VAL H 3.500 . 3.500 2.922 2.468 3.293 . 0 0 "[ . 1 . 2]" 1
106 1 3 VAL N 1 25 VAL O 2.800 2.700 3.300 2.654 2.614 2.677 0.086 2 0 "[ . 1 . 2]" 1
107 1 3 VAL O 1 25 VAL H 1.900 . 2.300 2.172 1.778 2.336 0.036 1 0 "[ . 1 . 2]" 1
108 1 3 VAL O 1 25 VAL N 2.800 2.700 3.300 3.134 2.757 3.309 0.009 16 0 "[ . 1 . 2]" 1
109 1 4 VAL H 1 4 VAL MG1 2.800 . 2.800 2.162 2.013 2.383 . 0 0 "[ . 1 . 2]" 1
110 1 4 VAL H 1 4 VAL QG 2.800 . 2.800 2.147 2.003 2.355 . 0 0 "[ . 1 . 2]" 1
111 1 4 VAL H 1 4 VAL MG2 4.500 . 4.500 3.664 3.615 3.727 . 0 0 "[ . 1 . 2]" 1
112 1 4 VAL H 1 5 SER H 4.500 . 4.500 4.378 4.283 4.470 . 0 0 "[ . 1 . 2]" 1
113 1 4 VAL HA 1 4 VAL HB . . 2.800 2.332 2.296 2.367 . 0 0 "[ . 1 . 2]" 1
114 1 4 VAL HA 1 4 VAL MG1 3.500 . 3.500 3.170 3.152 3.192 . 0 0 "[ . 1 . 2]" 1
115 1 4 VAL HA 1 4 VAL QG 2.800 . 2.800 2.578 2.558 2.597 . 0 0 "[ . 1 . 2]" 1
116 1 4 VAL HA 1 4 VAL MG2 2.800 . 2.800 2.729 2.699 2.754 . 0 0 "[ . 1 . 2]" 1
117 1 4 VAL HA 1 5 SER H 2.800 . 2.800 2.356 2.273 2.484 . 0 0 "[ . 1 . 2]" 1
118 1 4 VAL HA 1 5 SER HA 5.500 . 5.500 3.984 3.954 4.011 . 0 0 "[ . 1 . 2]" 1
119 1 4 VAL HA 1 5 SER QB 5.500 . 5.500 4.586 3.867 4.816 . 0 0 "[ . 1 . 2]" 1
120 1 4 VAL HA 1 24 VAL HA 4.500 . 4.500 3.079 2.631 3.476 . 0 0 "[ . 1 . 2]" 1
121 1 4 VAL HA 1 24 VAL MG1 5.500 . 5.500 3.258 2.514 3.583 . 0 0 "[ . 1 . 2]" 1
122 1 4 VAL HA 1 24 VAL MG2 5.500 . 5.500 3.931 3.547 4.225 . 0 0 "[ . 1 . 2]" 1
123 1 4 VAL HA 1 25 VAL H 5.500 . 5.500 3.799 3.202 4.206 . 0 0 "[ . 1 . 2]" 1
124 1 4 VAL HA 1 25 VAL MG2 5.500 . 5.500 4.741 3.870 5.419 . 0 0 "[ . 1 . 2]" 1
125 1 4 VAL HB 1 5 SER H 3.500 . 3.500 3.516 3.498 3.532 0.032 10 0 "[ . 1 . 2]" 1
126 1 4 VAL HB 1 24 VAL MG1 3.500 . 3.500 2.206 2.009 2.478 . 0 0 "[ . 1 . 2]" 1
127 1 4 VAL HB 1 91 VAL MG2 4.500 . 4.500 3.975 3.351 4.412 . 0 0 "[ . 1 . 2]" 1
128 1 4 VAL HB 1 93 LEU HB2 5.500 . 5.500 3.791 3.760 3.888 . 0 0 "[ . 1 . 2]" 1
129 1 4 VAL HB 1 93 LEU HB3 5.500 . 5.500 5.514 5.496 5.530 0.030 2 0 "[ . 1 . 2]" 1
130 1 4 VAL HB 1 93 LEU MD1 3.500 . 3.500 3.539 3.352 3.613 0.113 20 0 "[ . 1 . 2]" 1
131 1 4 VAL HB 1 93 LEU MD2 5.500 . 5.500 4.335 3.937 4.952 . 0 0 "[ . 1 . 2]" 1
132 1 4 VAL QG 1 5 SER H 2.800 . 2.800 1.896 1.785 2.021 0.015 16 0 "[ . 1 . 2]" 1
133 1 4 VAL QG 1 5 SER HA 4.500 . 4.500 3.064 2.911 3.219 . 0 0 "[ . 1 . 2]" 1
134 1 4 VAL QG 1 5 SER HB2 4.500 . 4.500 4.360 4.087 4.526 0.026 12 0 "[ . 1 . 2]" 1
135 1 4 VAL QG 1 5 SER HB3 4.500 . 4.500 4.494 4.097 4.555 0.055 20 0 "[ . 1 . 2]" 1
136 1 4 VAL QG 1 6 PRO HA 5.500 . 5.500 3.892 3.462 4.308 . 0 0 "[ . 1 . 2]" 1
137 1 4 VAL QG 1 24 VAL MG2 3.500 . 3.500 2.978 2.450 3.370 . 0 0 "[ . 1 . 2]" 1
138 1 4 VAL QG 1 93 LEU HA 4.500 . 4.500 2.219 2.038 2.627 . 0 0 "[ . 1 . 2]" 1
139 1 4 VAL QG 1 93 LEU MD1 2.800 . 2.800 1.795 1.732 1.846 0.068 20 0 "[ . 1 . 2]" 1
140 1 4 VAL QG 1 94 GLU H 3.500 . 3.500 3.254 2.969 3.461 . 0 0 "[ . 1 . 2]" 1
141 1 4 VAL MG1 1 5 SER H 4.500 . 4.500 3.919 3.753 3.990 . 0 0 "[ . 1 . 2]" 1
142 1 4 VAL MG1 1 5 SER HA 5.500 . 5.500 4.364 4.115 4.519 . 0 0 "[ . 1 . 2]" 1
143 1 4 VAL MG1 1 93 LEU HA 4.500 . 4.500 3.402 2.935 3.752 . 0 0 "[ . 1 . 2]" 1
144 1 4 VAL MG2 1 5 SER H 4.500 . 4.500 1.900 1.789 2.027 0.011 16 0 "[ . 1 . 2]" 1
145 1 4 VAL MG2 1 5 SER HA 5.500 . 5.500 3.130 2.966 3.295 . 0 0 "[ . 1 . 2]" 1
146 1 4 VAL MG2 1 24 VAL HA 4.500 . 4.500 4.187 3.625 4.499 . 0 0 "[ . 1 . 2]" 1
147 1 4 VAL MG2 1 24 VAL HA 4.500 . 4.500 3.130 2.867 3.432 . 0 0 "[ . 1 . 2]" 1
148 1 4 VAL MG2 1 93 LEU HB2 4.500 . 4.500 2.214 2.001 2.495 . 0 0 "[ . 1 . 2]" 1
149 1 4 VAL MG2 1 93 LEU HB3 4.500 . 4.500 2.880 2.631 3.101 . 0 0 "[ . 1 . 2]" 1
150 1 4 VAL MG2 1 93 LEU MD2 2.800 . 2.800 1.976 1.845 2.117 . 0 0 "[ . 1 . 2]" 1
151 1 5 SER H 1 5 SER QB 3.500 . 3.500 3.079 2.547 3.253 . 0 0 "[ . 1 . 2]" 1
152 1 5 SER H 1 93 LEU MD1 4.500 . 4.500 3.399 2.985 3.771 . 0 0 "[ . 1 . 2]" 1
153 1 5 SER H 1 93 LEU MD1 3.500 . 3.500 2.162 1.980 2.624 . 0 0 "[ . 1 . 2]" 1
154 1 5 SER HA 1 5 SER HB2 2.800 . 2.800 2.840 2.578 2.964 0.164 16 0 "[ . 1 . 2]" 1
155 1 5 SER HA 1 5 SER QB 2.800 . 2.800 2.202 2.143 2.485 . 0 0 "[ . 1 . 2]" 1
156 1 5 SER HA 1 5 SER HB3 2.800 . 2.800 1.925 1.871 2.054 . 0 0 "[ . 1 . 2]" 1
157 1 5 SER HA 1 6 PRO QD 2.800 . 2.800 2.069 2.013 2.177 . 0 0 "[ . 1 . 2]" 1
158 1 5 SER HA 1 6 PRO QG 4.500 . 4.500 3.990 3.904 4.120 . 0 0 "[ . 1 . 2]" 1
159 1 6 PRO HA 1 6 PRO HB3 2.800 . 2.800 2.263 2.228 2.309 . 0 0 "[ . 1 . 2]" 1
160 1 6 PRO HA 1 6 PRO QG 3.500 . 3.500 2.996 2.933 3.122 . 0 0 "[ . 1 . 2]" 1
161 1 6 PRO HA 1 7 ILE H 2.800 . 2.800 2.245 2.200 2.335 . 0 0 "[ . 1 . 2]" 1
162 1 6 PRO HA 1 7 ILE HA 5.500 . 5.500 4.477 4.439 4.514 . 0 0 "[ . 1 . 2]" 1
163 1 6 PRO HA 1 93 LEU MD1 3.500 . 3.500 3.117 2.775 3.503 0.003 16 0 "[ . 1 . 2]" 1
164 1 6 PRO HA 1 94 GLU QB 4.500 . 4.500 2.615 2.294 3.023 . 0 0 "[ . 1 . 2]" 1
165 1 6 PRO HA 1 96 ILE MD 4.500 . 4.500 3.287 2.860 4.368 . 0 0 "[ . 1 . 2]" 1
166 1 6 PRO HB2 1 7 ILE H 5.500 . 5.500 3.775 3.498 3.883 . 0 0 "[ . 1 . 2]" 1
167 1 6 PRO HB2 1 7 ILE H 2.800 . 2.800 2.579 2.495 2.693 . 0 0 "[ . 1 . 2]" 1
168 1 6 PRO HB2 1 94 GLU QB 4.500 . 4.500 4.161 3.849 4.404 . 0 0 "[ . 1 . 2]" 1
169 1 6 PRO HB2 1 96 ILE MD 2.800 . 2.800 2.601 2.438 2.810 0.010 20 0 "[ . 1 . 2]" 1
170 1 6 PRO HB3 1 7 ILE H 3.500 . 3.500 3.469 3.132 3.544 0.044 1 0 "[ . 1 . 2]" 1
171 1 6 PRO HB3 1 8 LEU MD1 4.500 . 4.500 3.194 3.031 3.390 . 0 0 "[ . 1 . 2]" 1
172 1 6 PRO HB3 1 8 LEU MD2 4.500 . 4.500 4.496 4.327 4.549 0.049 14 0 "[ . 1 . 2]" 1
173 1 6 PRO HB3 1 94 GLU QB 2.800 . 2.800 2.582 2.218 2.826 0.026 2 0 "[ . 1 . 2]" 1
174 1 6 PRO HB3 1 96 ILE MD 3.500 . 3.500 1.989 1.816 2.348 . 0 0 "[ . 1 . 2]" 1
175 1 6 PRO QG 1 7 ILE H 5.500 . 5.500 4.739 4.567 4.818 . 0 0 "[ . 1 . 2]" 1
176 1 6 PRO QG 1 8 LEU MD1 4.500 . 4.500 3.718 3.457 3.996 . 0 0 "[ . 1 . 2]" 1
177 1 6 PRO QG 1 8 LEU MD2 4.500 . 4.500 4.535 4.509 4.563 0.063 7 0 "[ . 1 . 2]" 1
178 1 6 PRO QG 1 96 ILE MD 3.500 . 3.500 3.286 3.027 3.455 . 0 0 "[ . 1 . 2]" 1
179 1 7 ILE H 1 7 ILE HB 3.500 . 3.500 2.628 2.531 2.779 . 0 0 "[ . 1 . 2]" 1
180 1 7 ILE H 1 7 ILE MD 4.500 . 4.500 3.934 3.829 4.097 . 0 0 "[ . 1 . 2]" 1
181 1 7 ILE H 1 7 ILE HG12 3.500 . 3.500 3.495 3.121 3.566 0.066 11 0 "[ . 1 . 2]" 1
182 1 7 ILE H 1 7 ILE HG13 5.500 . 5.500 2.491 2.364 2.656 . 0 0 "[ . 1 . 2]" 1
183 1 7 ILE H 1 7 ILE HG13 3.500 . 3.500 2.457 2.343 2.608 . 0 0 "[ . 1 . 2]" 1
184 1 7 ILE H 1 7 ILE MG 3.500 . 3.500 2.894 2.651 3.310 . 0 0 "[ . 1 . 2]" 1
185 1 7 ILE H 1 96 ILE H 4.500 . 4.500 3.121 2.911 3.481 . 0 0 "[ . 1 . 2]" 1
186 1 7 ILE H 1 8 LEU QD 4.500 . 4.500 3.356 3.177 3.492 . 0 0 "[ . 1 . 2]" 1
187 1 7 ILE H 1 93 LEU MD1 5.500 . 5.500 3.000 2.700 3.571 . 0 0 "[ . 1 . 2]" 1
188 1 7 ILE H 1 94 GLU O 1.900 . 2.300 1.775 1.726 1.891 0.074 9 0 "[ . 1 . 2]" 1
189 1 7 ILE H 1 95 VAL HA 5.500 . 5.500 2.389 2.254 2.600 . 0 0 "[ . 1 . 2]" 1
190 1 7 ILE H 1 95 VAL MG2 3.500 . 3.500 3.462 3.248 3.538 0.038 9 0 "[ . 1 . 2]" 1
191 1 7 ILE H 1 96 ILE H 4.500 . 4.500 3.188 2.949 3.629 . 0 0 "[ . 1 . 2]" 1
192 1 7 ILE H 1 96 ILE MG 3.500 . 3.500 2.596 2.347 2.798 . 0 0 "[ . 1 . 2]" 1
193 1 7 ILE HA 1 7 ILE MD 4.500 . 4.500 3.755 3.671 3.804 . 0 0 "[ . 1 . 2]" 1
194 1 7 ILE HA 1 7 ILE MD 3.500 . 3.500 2.120 1.930 2.317 . 0 0 "[ . 1 . 2]" 1
195 1 7 ILE HA 1 7 ILE HG12 3.500 . 3.500 2.449 2.417 2.490 . 0 0 "[ . 1 . 2]" 1
196 1 7 ILE HA 1 7 ILE HG13 3.500 . 3.500 3.209 3.097 3.404 . 0 0 "[ . 1 . 2]" 1
197 1 7 ILE HA 1 7 ILE MG 2.800 . 2.800 2.332 2.267 2.437 . 0 0 "[ . 1 . 2]" 1
198 1 7 ILE HA 1 8 LEU H 2.800 . 2.800 2.148 2.118 2.210 . 0 0 "[ . 1 . 2]" 1
199 1 7 ILE HA 1 8 LEU HB2 5.500 . 5.500 4.733 4.461 4.954 . 0 0 "[ . 1 . 2]" 1
200 1 7 ILE HA 1 8 LEU MD1 3.500 . 3.500 3.238 2.673 3.523 0.023 16 0 "[ . 1 . 2]" 1
201 1 7 ILE HA 1 95 VAL MG2 5.500 . 5.500 4.781 4.629 4.961 . 0 0 "[ . 1 . 2]" 1
202 1 7 ILE HB 1 7 ILE MD . . 2.800 2.455 2.378 2.521 . 0 0 "[ . 1 . 2]" 1
203 1 7 ILE HB 1 8 LEU H 5.500 . 5.500 4.279 4.202 4.343 . 0 0 "[ . 1 . 2]" 1
204 1 7 ILE HB 1 96 ILE H 4.500 . 4.500 3.521 3.099 3.819 . 0 0 "[ . 1 . 2]" 1
205 1 7 ILE HB 1 9 ILE MD 5.500 . 5.500 3.369 2.875 3.932 . 0 0 "[ . 1 . 2]" 1
206 1 7 ILE HB 1 93 LEU MD1 4.500 . 4.500 3.464 3.161 4.097 . 0 0 "[ . 1 . 2]" 1
207 1 7 ILE HB 1 95 VAL HA 4.500 . 4.500 2.241 1.993 2.440 . 0 0 "[ . 1 . 2]" 1
208 1 7 ILE HB 1 95 VAL HA 2.800 . 2.800 2.183 1.967 2.345 . 0 0 "[ . 1 . 2]" 1
209 1 7 ILE HB 1 95 VAL MG2 3.500 . 3.500 2.138 1.926 2.400 . 0 0 "[ . 1 . 2]" 1
210 1 7 ILE MD 1 7 ILE MG 2.800 . 2.800 1.886 1.832 1.924 . 0 0 "[ . 1 . 2]" 1
211 1 7 ILE MD 1 7 ILE MG 2.800 . 2.800 1.813 1.762 1.882 0.038 9 0 "[ . 1 . 2]" 1
212 1 7 ILE MD 1 8 LEU H 5.500 . 5.500 5.231 5.148 5.307 . 0 0 "[ . 1 . 2]" 1
213 1 7 ILE MD 1 21 VAL MG2 2.800 . 2.800 2.523 2.085 2.807 0.007 11 0 "[ . 1 . 2]" 1
214 1 7 ILE MD 1 22 GLY H 4.500 . 4.500 3.783 2.993 4.275 . 0 0 "[ . 1 . 2]" 1
215 1 7 ILE MD 1 22 GLY QA . . 3.500 2.132 1.936 2.338 . 0 0 "[ . 1 . 2]" 1
216 1 7 ILE MD 1 59 VAL H 4.500 . 4.500 3.633 3.417 3.787 . 0 0 "[ . 1 . 2]" 1
217 1 7 ILE MD 1 59 VAL MG2 2.800 . 2.800 2.092 1.847 2.377 . 0 0 "[ . 1 . 2]" 1
218 1 7 ILE MD 1 59 VAL HA 5.500 . 5.500 4.642 4.309 4.941 . 0 0 "[ . 1 . 2]" 1
219 1 7 ILE MD 1 59 VAL HB 3.500 . 3.500 2.367 1.987 2.720 . 0 0 "[ . 1 . 2]" 1
220 1 7 ILE MD 1 59 VAL MG1 2.800 . 2.800 2.374 2.162 2.668 . 0 0 "[ . 1 . 2]" 1
221 1 7 ILE MD 1 93 LEU HG 4.500 . 4.500 3.864 3.474 4.373 . 0 0 "[ . 1 . 2]" 1
222 1 7 ILE MD 1 95 VAL MG2 2.800 . 2.800 2.292 2.056 2.567 . 0 0 "[ . 1 . 2]" 1
223 1 7 ILE HG12 1 7 ILE MG 2.800 . 2.800 2.339 2.221 2.414 . 0 0 "[ . 1 . 2]" 1
224 1 7 ILE HG12 1 7 ILE MG 2.800 . 2.800 2.291 2.194 2.345 . 0 0 "[ . 1 . 2]" 1
225 1 7 ILE HG12 1 8 LEU H 4.500 . 4.500 4.541 4.510 4.574 0.074 20 0 "[ . 1 . 2]" 1
226 1 7 ILE HG12 1 22 GLY QA 5.500 . 5.500 3.124 2.026 3.888 . 0 0 "[ . 1 . 2]" 1
227 1 7 ILE HG12 1 93 LEU MD1 3.500 . 3.500 3.321 2.828 3.466 . 0 0 "[ . 1 . 2]" 1
228 1 7 ILE HG13 1 7 ILE MG 3.500 . 3.500 3.186 3.168 3.202 . 0 0 "[ . 1 . 2]" 1
229 1 7 ILE HG13 1 7 ILE MG 3.500 . 3.500 1.939 1.826 2.021 . 0 0 "[ . 1 . 2]" 1
230 1 7 ILE HG13 1 59 VAL MG2 4.500 . 4.500 4.227 3.947 4.489 . 0 0 "[ . 1 . 2]" 1
231 1 7 ILE HG13 1 93 LEU MD2 4.500 . 4.500 3.375 2.852 3.701 . 0 0 "[ . 1 . 2]" 1
232 1 7 ILE HG13 1 93 LEU MD1 2.800 . 2.800 1.956 1.837 2.044 . 0 0 "[ . 1 . 2]" 1
233 1 7 ILE HG13 1 93 LEU HG 4.500 . 4.500 4.061 3.086 4.369 . 0 0 "[ . 1 . 2]" 1
234 1 7 ILE HG13 1 95 VAL MG2 5.500 . 5.500 3.051 2.720 3.402 . 0 0 "[ . 1 . 2]" 1
235 1 7 ILE MG 1 8 LEU H 2.800 . 2.800 2.845 2.816 2.877 0.077 5 0 "[ . 1 . 2]" 1
236 1 7 ILE MG 1 8 LEU HA 5.500 . 5.500 4.117 3.950 4.224 . 0 0 "[ . 1 . 2]" 1
237 1 7 ILE MG 1 9 ILE H 4.500 . 4.500 3.218 2.870 3.308 . 0 0 "[ . 1 . 2]" 1
238 1 7 ILE MG 1 9 ILE HA 4.500 . 4.500 3.966 3.731 4.383 . 0 0 "[ . 1 . 2]" 1
239 1 7 ILE MG 1 9 ILE HA 5.500 . 5.500 3.388 3.260 3.558 . 0 0 "[ . 1 . 2]" 1
240 1 7 ILE MG 1 9 ILE HB 4.500 . 4.500 4.419 4.217 4.532 0.032 11 0 "[ . 1 . 2]" 1
241 1 7 ILE MG 1 9 ILE MD 2.800 . 2.800 2.038 1.840 2.342 . 0 0 "[ . 1 . 2]" 1
242 1 7 ILE MG 1 9 ILE HG12 2.800 . 2.800 2.146 1.986 2.415 . 0 0 "[ . 1 . 2]" 1
243 1 7 ILE MG 1 9 ILE HG13 2.800 . 2.800 2.432 2.083 2.613 . 0 0 "[ . 1 . 2]" 1
244 1 7 ILE MG 1 9 ILE HG13 2.800 . 2.800 2.395 2.072 2.565 . 0 0 "[ . 1 . 2]" 1
245 1 7 ILE MG 1 21 VAL HB 2.800 . 2.800 2.556 2.085 2.838 0.038 8 0 "[ . 1 . 2]" 1
246 1 7 ILE MG 1 22 GLY QA . . 4.500 2.654 2.152 3.196 . 0 0 "[ . 1 . 2]" 1
247 1 7 ILE MG 1 59 VAL HB 5.500 . 5.500 3.869 3.606 4.160 . 0 0 "[ . 1 . 2]" 1
248 1 7 ILE MG 1 95 VAL HA 5.500 . 5.500 3.800 3.499 3.992 . 0 0 "[ . 1 . 2]" 1
249 1 7 ILE MG 1 95 VAL MG2 2.800 . 2.800 2.018 1.985 2.039 . 0 0 "[ . 1 . 2]" 1
250 1 7 ILE MG 1 95 VAL MG2 3.500 . 3.500 3.199 2.759 3.507 0.007 3 0 "[ . 1 . 2]" 1
251 1 7 ILE N 1 94 GLU O 2.700 2.600 3.100 2.695 2.629 2.813 . 0 0 "[ . 1 . 2]" 1
252 1 7 ILE O 1 96 ILE H 1.900 . 2.300 1.864 1.745 2.008 0.055 1 0 "[ . 1 . 2]" 1
253 1 7 ILE O 1 96 ILE N 2.700 2.600 3.100 2.572 2.543 2.624 0.057 2 0 "[ . 1 . 2]" 1
254 1 8 LEU H 1 8 LEU HB2 2.800 . 2.800 2.611 2.364 2.806 0.006 12 0 "[ . 1 . 2]" 1
255 1 8 LEU H 1 8 LEU HB2 3.500 . 3.500 2.607 2.361 2.798 . 0 0 "[ . 1 . 2]" 1
256 1 8 LEU H 1 8 LEU HB3 3.500 . 3.500 3.563 3.523 3.612 0.112 11 0 "[ . 1 . 2]" 1
257 1 8 LEU H 1 8 LEU MD1 4.500 . 4.500 2.388 1.956 2.663 . 0 0 "[ . 1 . 2]" 1
258 1 8 LEU H 1 8 LEU QD 2.800 . 2.800 1.820 1.717 2.052 0.083 12 0 "[ . 1 . 2]" 1
259 1 8 LEU H 1 8 LEU MD2 4.500 . 4.500 2.544 1.742 4.066 0.058 12 0 "[ . 1 . 2]" 1
260 1 8 LEU H 1 8 LEU HG 3.500 . 3.500 3.565 3.507 3.603 0.103 3 0 "[ . 1 . 2]" 1
261 1 8 LEU H 1 9 ILE H 4.500 . 4.500 4.137 3.713 4.285 . 0 0 "[ . 1 . 2]" 1
262 1 8 LEU H 1 9 ILE H 3.500 . 3.500 3.058 2.818 3.369 . 0 0 "[ . 1 . 2]" 1
263 1 8 LEU H 1 9 ILE HA 5.500 . 5.500 4.928 4.645 5.094 . 0 0 "[ . 1 . 2]" 1
264 1 8 LEU HA 1 8 LEU HB2 2.800 . 2.800 2.295 2.089 2.491 . 0 0 "[ . 1 . 2]" 1
265 1 8 LEU HA 1 8 LEU QD 2.800 . 2.800 2.448 2.177 2.867 0.067 17 0 "[ . 1 . 2]" 1
266 1 8 LEU HA 1 8 LEU MD2 3.500 . 3.500 3.550 3.500 3.575 0.075 19 0 "[ . 1 . 2]" 1
267 1 8 LEU HA 1 8 LEU HG 4.500 . 4.500 3.221 2.202 3.797 . 0 0 "[ . 1 . 2]" 1
268 1 8 LEU HA 1 9 ILE H 2.800 . 2.800 2.223 2.056 2.362 . 0 0 "[ . 1 . 2]" 1
269 1 8 LEU HA 1 96 ILE H 4.500 . 4.500 2.989 2.574 3.270 . 0 0 "[ . 1 . 2]" 1
270 1 8 LEU HA 1 96 ILE HB 4.500 . 4.500 2.384 2.132 2.654 . 0 0 "[ . 1 . 2]" 1
271 1 8 LEU HA 1 96 ILE MG 5.500 . 5.500 3.607 3.247 4.069 . 0 0 "[ . 1 . 2]" 1
272 1 8 LEU HA 1 98 ILE MD 5.500 . 5.500 3.992 3.540 4.699 . 0 0 "[ . 1 . 2]" 1
273 1 8 LEU HA 1 98 ILE MG 4.500 . 4.500 2.617 2.198 2.871 . 0 0 "[ . 1 . 2]" 1
274 1 8 LEU HB2 1 8 LEU QD 2.800 . 2.800 2.189 2.071 2.292 . 0 0 "[ . 1 . 2]" 1
275 1 8 LEU HB2 1 8 LEU MD1 2.800 . 2.800 2.028 1.898 2.204 . 0 0 "[ . 1 . 2]" 1
276 1 8 LEU HB2 1 8 LEU MD2 2.800 . 2.800 2.385 2.233 2.596 . 0 0 "[ . 1 . 2]" 1
277 1 8 LEU HB2 1 8 LEU HG 2.800 . 2.800 2.385 2.017 2.547 . 0 0 "[ . 1 . 2]" 1
278 1 8 LEU HB2 1 9 ILE H 4.500 . 4.500 4.262 4.102 4.416 . 0 0 "[ . 1 . 2]" 1
279 1 8 LEU HB2 1 9 ILE H 4.500 . 4.500 3.671 3.549 3.927 . 0 0 "[ . 1 . 2]" 1
280 1 8 LEU HB2 1 98 ILE MG 3.500 . 3.500 2.736 2.510 2.848 . 0 0 "[ . 1 . 2]" 1
281 1 8 LEU HB2 1 98 ILE H 5.500 . 5.500 5.562 5.524 5.593 0.093 11 0 "[ . 1 . 2]" 1
282 1 8 LEU HB2 1 98 ILE MD 3.500 . 3.500 2.769 2.240 3.508 0.008 15 0 "[ . 1 . 2]" 1
283 1 8 LEU HB3 1 8 LEU MD1 3.500 . 3.500 2.770 2.521 3.176 . 0 0 "[ . 1 . 2]" 1
284 1 8 LEU HB3 1 8 LEU QD 2.800 . 2.800 2.393 2.243 2.491 . 0 0 "[ . 1 . 2]" 1
285 1 8 LEU HB3 1 8 LEU MD2 3.500 . 3.500 2.909 2.293 3.247 . 0 0 "[ . 1 . 2]" 1
286 1 8 LEU HB3 1 9 ILE H 4.500 . 4.500 3.838 3.436 4.123 . 0 0 "[ . 1 . 2]" 1
287 1 8 LEU HB3 1 98 ILE MG 2.800 . 2.800 1.833 1.760 1.917 0.040 1 0 "[ . 1 . 2]" 1
288 1 8 LEU MD1 1 9 ILE H 4.500 . 4.500 4.305 4.075 4.622 0.122 11 0 "[ . 1 . 2]" 1
289 1 8 LEU MD1 1 96 ILE H 3.500 . 3.500 2.984 2.684 3.339 . 0 0 "[ . 1 . 2]" 1
290 1 8 LEU HG 1 96 ILE MG 4.500 . 4.500 4.198 3.485 4.535 0.035 6 0 "[ . 1 . 2]" 1
291 1 8 LEU HG 1 98 ILE MG 3.500 . 3.500 3.341 2.994 3.551 0.051 3 0 "[ . 1 . 2]" 1
292 1 9 ILE H 1 9 ILE HB 3.500 . 3.500 2.746 2.640 2.972 . 0 0 "[ . 1 . 2]" 1
293 1 9 ILE H 1 9 ILE MD 4.500 . 4.500 3.689 3.019 3.978 . 0 0 "[ . 1 . 2]" 1
294 1 9 ILE H 1 9 ILE MD 2.800 . 2.800 2.849 2.819 2.927 0.127 17 0 "[ . 1 . 2]" 1
295 1 9 ILE H 1 9 ILE HG13 4.500 . 4.500 2.294 1.830 2.606 . 0 0 "[ . 1 . 2]" 1
296 1 9 ILE H 1 9 ILE MG 4.500 . 4.500 3.886 3.774 3.945 . 0 0 "[ . 1 . 2]" 1
297 1 9 ILE H 1 10 PRO QD 4.500 . 4.500 4.311 4.211 4.426 . 0 0 "[ . 1 . 2]" 1
298 1 9 ILE H 1 95 VAL MG1 3.500 . 3.500 3.464 3.264 3.525 0.025 15 0 "[ . 1 . 2]" 1
299 1 9 ILE H 1 96 ILE O 1.900 . 2.300 1.813 1.739 2.245 0.061 4 0 "[ . 1 . 2]" 1
300 1 9 ILE H 1 97 VAL HA 4.500 . 4.500 3.080 2.918 3.435 . 0 0 "[ . 1 . 2]" 1
301 1 9 ILE H 1 98 ILE H 5.500 . 5.500 3.166 2.865 3.861 . 0 0 "[ . 1 . 2]" 1
302 1 9 ILE H 1 98 ILE MG 5.500 . 5.500 3.006 2.893 3.931 . 0 0 "[ . 1 . 2]" 1
303 1 9 ILE HA 1 9 ILE MD 3.500 . 3.500 2.750 2.635 3.004 . 0 0 "[ . 1 . 2]" 1
304 1 9 ILE HA 1 9 ILE MD 4.500 . 4.500 3.700 3.600 3.816 . 0 0 "[ . 1 . 2]" 1
305 1 9 ILE HA 1 9 ILE HG12 4.500 . 4.500 2.813 2.683 3.105 . 0 0 "[ . 1 . 2]" 1
306 1 9 ILE HA 1 9 ILE HG13 4.500 . 4.500 3.262 3.048 3.437 . 0 0 "[ . 1 . 2]" 1
307 1 9 ILE HA 1 9 ILE MG 2.800 . 2.800 2.297 2.239 2.354 . 0 0 "[ . 1 . 2]" 1
308 1 9 ILE HA 1 10 PRO QD 2.800 . 2.800 2.039 1.960 2.102 . 0 0 "[ . 1 . 2]" 1
309 1 9 ILE HA 1 10 PRO QG . . 4.500 3.975 3.885 4.053 . 0 0 "[ . 1 . 2]" 1
310 1 9 ILE HA 1 98 ILE MG 2.800 . 2.800 2.413 2.346 2.578 . 0 0 "[ . 1 . 2]" 1
311 1 9 ILE HB 1 9 ILE MD 2.800 . 2.800 2.193 2.068 2.258 . 0 0 "[ . 1 . 2]" 1
312 1 9 ILE HB 1 97 VAL HA . . 4.500 3.253 2.993 3.677 . 0 0 "[ . 1 . 2]" 1
313 1 9 ILE HB 1 98 ILE H 5.500 . 5.500 4.096 3.786 4.352 . 0 0 "[ . 1 . 2]" 1
314 1 9 ILE MD 1 21 VAL HA 5.500 . 5.500 4.055 3.837 4.291 . 0 0 "[ . 1 . 2]" 1
315 1 9 ILE MD 1 21 VAL HB 2.800 . 2.800 2.078 1.922 2.388 . 0 0 "[ . 1 . 2]" 1
316 1 9 ILE MD 1 21 VAL MG1 2.800 . 2.800 2.079 1.969 2.416 . 0 0 "[ . 1 . 2]" 1
317 1 9 ILE MD 1 95 VAL MG1 2.800 . 2.800 1.836 1.790 1.899 0.010 17 0 "[ . 1 . 2]" 1
318 1 9 ILE MD 1 9 ILE MG 2.800 . 2.800 1.885 1.830 2.003 . 0 0 "[ . 1 . 2]" 1
319 1 9 ILE MD 1 9 ILE MG 2.800 . 2.800 1.798 1.759 1.877 0.041 8 0 "[ . 1 . 2]" 1
320 1 9 ILE MD 1 21 VAL HB 3.500 . 3.500 2.680 2.356 3.040 . 0 0 "[ . 1 . 2]" 1
321 1 9 ILE MD 1 21 VAL MG1 2.800 . 2.800 2.127 1.989 2.511 . 0 0 "[ . 1 . 2]" 1
322 1 9 ILE MD 1 21 VAL MG2 2.800 . 2.800 1.927 1.852 2.049 . 0 0 "[ . 1 . 2]" 1
323 1 9 ILE MD 1 21 VAL MG2 2.800 . 2.800 1.675 1.650 1.706 0.150 12 0 "[ . 1 . 2]" 1
324 1 9 ILE MD 1 50 PHE QD 3.500 . 3.500 2.971 2.528 3.350 . 0 0 "[ . 1 . 2]" 1
325 1 9 ILE MD 1 50 PHE QD 5.500 . 5.500 3.599 3.187 4.168 . 0 0 "[ . 1 . 2]" 1
326 1 9 ILE MD 1 50 PHE QE 2.800 . 2.800 1.842 1.771 1.907 0.029 15 0 "[ . 1 . 2]" 1
327 1 9 ILE MD 1 50 PHE QE 2.800 . 2.800 1.868 1.782 2.106 0.018 10 0 "[ . 1 . 2]" 1
328 1 9 ILE MD 1 50 PHE HZ 3.500 . 3.500 1.860 1.746 1.997 0.054 4 0 "[ . 1 . 2]" 1
329 1 9 ILE MD 1 61 VAL HA 5.500 . 5.500 4.752 4.431 5.036 . 0 0 "[ . 1 . 2]" 1
330 1 9 ILE MD 1 61 VAL HB 3.500 . 3.500 2.881 2.581 3.095 . 0 0 "[ . 1 . 2]" 1
331 1 9 ILE MD 1 61 VAL MG1 4.500 . 4.500 3.308 2.732 3.558 . 0 0 "[ . 1 . 2]" 1
332 1 9 ILE MD 1 61 VAL MG2 2.800 . 2.800 2.133 1.985 2.320 . 0 0 "[ . 1 . 2]" 1
333 1 9 ILE MD 1 65 LEU HG 4.500 . 4.500 3.705 3.483 3.885 . 0 0 "[ . 1 . 2]" 1
334 1 9 ILE MD 1 95 VAL MG2 . . 4.500 3.073 2.479 3.632 . 0 0 "[ . 1 . 2]" 1
335 1 9 ILE HG12 1 9 ILE MG 2.800 . 2.800 2.333 2.210 2.465 . 0 0 "[ . 1 . 2]" 1
336 1 9 ILE HG12 1 21 VAL HB 4.500 . 4.500 2.175 1.957 2.512 . 0 0 "[ . 1 . 2]" 1
337 1 9 ILE HG12 1 21 VAL MG1 4.500 . 4.500 3.080 2.490 3.379 . 0 0 "[ . 1 . 2]" 1
338 1 9 ILE HG12 1 21 VAL MG2 2.800 . 2.800 2.857 2.827 2.882 0.082 12 0 "[ . 1 . 2]" 1
339 1 9 ILE HG13 1 9 ILE MG 3.500 . 3.500 3.196 3.161 3.206 . 0 0 "[ . 1 . 2]" 1
340 1 9 ILE HG13 1 21 VAL HB 4.500 . 4.500 3.790 3.475 4.076 . 0 0 "[ . 1 . 2]" 1
341 1 9 ILE HG13 1 21 VAL MG1 4.500 . 4.500 4.337 3.943 4.517 0.017 8 0 "[ . 1 . 2]" 1
342 1 9 ILE HG13 1 21 VAL MG2 5.500 . 5.500 3.633 3.337 3.789 . 0 0 "[ . 1 . 2]" 1
343 1 9 ILE HG13 1 95 VAL MG1 3.500 . 3.500 2.259 2.089 2.660 . 0 0 "[ . 1 . 2]" 1
344 1 9 ILE MG 1 10 PRO HB2 5.500 . 5.500 4.801 4.540 5.168 . 0 0 "[ . 1 . 2]" 1
345 1 9 ILE MG 1 10 PRO HB2 4.500 . 4.500 3.585 3.217 3.908 . 0 0 "[ . 1 . 2]" 1
346 1 9 ILE MG 1 10 PRO QD 3.500 . 3.500 2.233 1.933 2.495 . 0 0 "[ . 1 . 2]" 1
347 1 9 ILE MG 1 10 PRO QG 5.500 . 5.500 3.596 3.246 4.137 . 0 0 "[ . 1 . 2]" 1
348 1 9 ILE MG 1 13 GLN QE 3.500 . 3.500 2.202 1.789 3.434 0.011 20 0 "[ . 1 . 2]" 1
349 1 9 ILE MG 1 13 GLN QG 5.500 . 5.500 3.115 1.873 4.041 . 0 0 "[ . 1 . 2]" 1
350 1 9 ILE MG 1 13 GLN QG 4.500 . 4.500 2.538 1.767 3.309 0.033 19 0 "[ . 1 . 2]" 1
351 1 9 ILE MG 1 21 VAL MG2 3.500 . 3.500 3.416 3.239 3.544 0.044 11 0 "[ . 1 . 2]" 1
352 1 9 ILE MG 1 50 PHE QE 5.500 . 5.500 3.469 2.969 3.884 . 0 0 "[ . 1 . 2]" 1
353 1 9 ILE MG 1 50 PHE QE 4.500 . 4.500 2.760 2.412 3.087 . 0 0 "[ . 1 . 2]" 1
354 1 9 ILE MG 1 65 LEU MD1 2.800 . 2.800 1.957 1.828 2.161 . 0 0 "[ . 1 . 2]" 1
355 1 9 ILE MG 1 65 LEU MD2 2.800 . 2.800 1.999 1.891 2.285 . 0 0 "[ . 1 . 2]" 1
356 1 9 ILE MG 1 65 LEU HG 4.500 . 4.500 2.252 2.011 2.690 . 0 0 "[ . 1 . 2]" 1
357 1 9 ILE MG 1 65 LEU MD2 4.500 . 4.500 4.403 4.034 4.543 0.043 19 0 "[ . 1 . 2]" 1
358 1 9 ILE MG 1 65 LEU HG 4.500 . 4.500 3.904 3.373 4.353 . 0 0 "[ . 1 . 2]" 1
359 1 9 ILE N 1 96 ILE O 2.700 2.600 3.100 2.723 2.665 2.885 . 0 0 "[ . 1 . 2]" 1
360 1 9 ILE O 1 98 ILE H 1.900 . 2.300 1.800 1.743 2.013 0.057 7 0 "[ . 1 . 2]" 1
361 1 9 ILE O 1 98 ILE N 2.700 2.600 3.100 2.675 2.597 2.766 0.003 19 0 "[ . 1 . 2]" 1
362 1 10 PRO HA 1 11 GLU H 3.500 . 3.500 2.191 2.105 2.254 . 0 0 "[ . 1 . 2]" 1
363 1 10 PRO HA 1 12 ASN H 2.800 . 2.800 2.357 2.239 2.804 0.004 16 0 "[ . 1 . 2]" 1
364 1 10 PRO HA 1 98 ILE H 4.500 . 4.500 2.837 2.398 3.315 . 0 0 "[ . 1 . 2]" 1
365 1 10 PRO HA 1 98 ILE MD 4.500 . 4.500 3.438 3.389 3.521 . 0 0 "[ . 1 . 2]" 1
366 1 10 PRO HA 1 98 ILE MD 4.500 . 4.500 3.225 3.140 3.349 . 0 0 "[ . 1 . 2]" 1
367 1 10 PRO HA 1 98 ILE HG12 . . 3.500 2.178 1.982 3.065 . 0 0 "[ . 1 . 2]" 1
368 1 10 PRO HA 1 98 ILE HG13 3.500 . 3.500 2.118 1.945 2.341 . 0 0 "[ . 1 . 2]" 1
369 1 10 PRO HA 1 98 ILE MG 5.500 . 5.500 3.926 3.564 4.479 . 0 0 "[ . 1 . 2]" 1
370 1 10 PRO HB2 1 11 GLU H 3.500 . 3.500 3.083 2.092 3.330 . 0 0 "[ . 1 . 2]" 1
371 1 10 PRO HB2 1 13 GLN QG 5.500 . 5.500 3.363 2.413 4.438 . 0 0 "[ . 1 . 2]" 1
372 1 10 PRO HB2 1 99 ASP HA 4.500 . 4.500 4.558 4.511 4.595 0.095 19 0 "[ . 1 . 2]" 1
373 1 10 PRO HB2 1 100 GLN HA 5.500 . 5.500 3.373 2.042 5.540 0.040 8 0 "[ . 1 . 2]" 1
374 1 10 PRO HB3 1 11 GLU H 5.500 . 5.500 3.844 3.469 4.120 . 0 0 "[ . 1 . 2]" 1
375 1 10 PRO HB3 1 11 GLU H 3.500 . 3.500 2.724 2.410 3.140 . 0 0 "[ . 1 . 2]" 1
376 1 10 PRO HB3 1 98 ILE HG13 5.500 . 5.500 2.400 1.990 3.180 . 0 0 "[ . 1 . 2]" 1
377 1 10 PRO HB3 1 99 ASP HA 4.500 . 4.500 4.451 3.782 4.608 0.108 13 0 "[ . 1 . 2]" 1
378 1 10 PRO HB3 1 100 GLN HA 4.500 . 4.500 3.180 2.070 4.496 . 0 0 "[ . 1 . 2]" 1
379 1 10 PRO HB3 1 100 GLN HA 3.500 . 3.500 2.510 1.963 3.250 . 0 0 "[ . 1 . 2]" 1
380 1 10 PRO QD 1 13 GLN QE 4.500 . 4.500 2.617 1.797 4.419 0.003 4 0 "[ . 1 . 2]" 1
381 1 10 PRO QD 1 98 ILE MD 4.500 . 4.500 2.715 2.265 3.372 . 0 0 "[ . 1 . 2]" 1
382 1 10 PRO QG 1 13 GLN QE 4.500 . 4.500 2.562 2.125 3.556 . 0 0 "[ . 1 . 2]" 1
383 1 10 PRO QG 1 13 GLN QE 5.500 . 5.500 3.000 2.129 4.888 . 0 0 "[ . 1 . 2]" 1
384 1 10 PRO QG 1 13 GLN QG 5.500 . 5.500 2.757 1.959 3.589 . 0 0 "[ . 1 . 2]" 1
385 1 10 PRO QG 1 98 ILE MD . . 3.500 3.303 2.547 3.545 0.045 8 0 "[ . 1 . 2]" 1
386 1 11 GLU H 1 11 GLU QG 3.500 . 3.500 2.166 1.786 3.524 0.024 19 0 "[ . 1 . 2]" 1
387 1 11 GLU H 1 97 VAL HA 5.500 . 5.500 4.452 4.099 4.781 . 0 0 "[ . 1 . 2]" 1
388 1 11 GLU H 1 97 VAL MG1 3.500 . 3.500 2.851 2.570 3.287 . 0 0 "[ . 1 . 2]" 1
389 1 11 GLU H 1 98 ILE H 4.500 . 4.500 3.618 3.304 4.118 . 0 0 "[ . 1 . 2]" 1
390 1 11 GLU H 1 98 ILE MD 5.500 . 5.500 5.158 5.011 5.225 . 0 0 "[ . 1 . 2]" 1
391 1 11 GLU H 1 98 ILE MD 4.500 . 4.500 4.564 4.517 4.637 0.137 15 0 "[ . 1 . 2]" 1
392 1 11 GLU H 1 98 ILE HG12 5.500 . 5.500 4.085 3.880 4.521 . 0 0 "[ . 1 . 2]" 1
393 1 11 GLU H 1 98 ILE HG13 5.500 . 5.500 3.919 3.564 4.217 . 0 0 "[ . 1 . 2]" 1
394 1 11 GLU HA 1 11 GLU HB3 2.800 . 2.800 2.450 2.315 2.905 0.105 19 0 "[ . 1 . 2]" 1
395 1 11 GLU HA 1 12 ASN H 3.500 . 3.500 2.605 2.197 3.515 0.015 16 0 "[ . 1 . 2]" 1
396 1 11 GLU HA 1 65 LEU H 5.500 . 5.500 3.344 2.785 3.932 . 0 0 "[ . 1 . 2]" 1
397 1 11 GLU HA 1 65 LEU HB3 4.500 . 4.500 3.664 3.219 4.181 . 0 0 "[ . 1 . 2]" 1
398 1 11 GLU HA 1 66 ASP HA 5.500 . 5.500 3.844 3.571 4.161 . 0 0 "[ . 1 . 2]" 1
399 1 11 GLU HA 1 97 VAL MG1 3.500 . 3.500 2.602 2.100 3.198 . 0 0 "[ . 1 . 2]" 1
400 1 11 GLU HB2 1 12 ASN H 4.500 . 4.500 2.256 1.840 4.221 . 0 0 "[ . 1 . 2]" 1
401 1 11 GLU HB2 1 66 ASP HA . . 4.500 2.491 1.854 4.531 0.031 19 0 "[ . 1 . 2]" 1
402 1 11 GLU HB2 1 67 ARG H 5.500 . 5.500 2.894 2.210 3.935 . 0 0 "[ . 1 . 2]" 1
403 1 11 GLU HB2 1 97 VAL MG1 3.500 . 3.500 3.095 2.561 3.444 . 0 0 "[ . 1 . 2]" 1
404 1 11 GLU HB3 1 11 GLU QG 2.800 . 2.800 2.254 2.146 2.446 . 0 0 "[ . 1 . 2]" 1
405 1 11 GLU HB3 1 12 ASN H 4.500 . 4.500 3.511 3.032 3.861 . 0 0 "[ . 1 . 2]" 1
406 1 11 GLU HB3 1 66 ASP HA . . 4.500 3.424 2.285 4.524 0.024 6 0 "[ . 1 . 2]" 1
407 1 11 GLU HB3 1 67 ARG H 5.500 . 5.500 2.994 2.237 4.560 . 0 0 "[ . 1 . 2]" 1
408 1 11 GLU HB3 1 97 VAL MG1 4.500 . 4.500 2.024 1.790 4.035 0.010 9 0 "[ . 1 . 2]" 1
409 1 11 GLU QG 1 12 ASN H 5.500 . 5.500 3.353 2.141 3.959 . 0 0 "[ . 1 . 2]" 1
410 1 11 GLU QG 1 12 ASN HB2 5.500 . 5.500 3.619 2.508 5.536 0.036 2 0 "[ . 1 . 2]" 1
411 1 11 GLU QG 1 12 ASN QD 4.500 . 4.500 4.169 2.630 4.517 0.017 9 0 "[ . 1 . 2]" 1
412 1 11 GLU QG 1 66 ASP HA . . 4.500 4.042 1.911 4.611 0.111 2 0 "[ . 1 . 2]" 1
413 1 11 GLU QG 1 67 ARG H 5.500 . 5.500 3.071 1.984 3.652 . 0 0 "[ . 1 . 2]" 1
414 1 11 GLU QG 1 97 VAL MG1 5.500 . 5.500 2.983 1.970 3.648 . 0 0 "[ . 1 . 2]" 1
415 1 11 GLU QG 1 99 ASP HA 5.500 . 5.500 2.455 1.889 4.586 . 0 0 "[ . 1 . 2]" 1
416 1 12 ASN H 1 13 GLN H 5.500 . 5.500 3.049 2.780 3.544 . 0 0 "[ . 1 . 2]" 1
417 1 12 ASN H 1 64 THR MG 5.500 . 5.500 4.337 3.643 5.529 0.029 16 0 "[ . 1 . 2]" 1
418 1 12 ASN H 1 65 LEU H 5.500 . 5.500 3.378 2.583 5.110 . 0 0 "[ . 1 . 2]" 1
419 1 12 ASN H 1 65 LEU QB 5.500 . 5.500 3.656 3.080 5.474 . 0 0 "[ . 1 . 2]" 1
420 1 12 ASN H 1 97 VAL MG1 5.500 . 5.500 4.201 3.565 4.785 . 0 0 "[ . 1 . 2]" 1
421 1 12 ASN HA 1 12 ASN HB3 . . 2.800 2.771 2.365 2.953 0.153 14 0 "[ . 1 . 2]" 1
422 1 12 ASN HA 1 12 ASN QD 4.500 . 4.500 3.910 3.386 4.448 . 0 0 "[ . 1 . 2]" 1
423 1 12 ASN HA 1 13 GLN H 5.500 . 5.500 3.069 2.468 3.503 . 0 0 "[ . 1 . 2]" 1
424 1 12 ASN HA 1 64 THR MG 3.500 . 3.500 3.422 2.375 3.621 0.121 9 0 "[ . 1 . 2]" 1
425 1 12 ASN HA 1 65 LEU H 4.500 . 4.500 4.011 3.345 4.548 0.048 16 0 "[ . 1 . 2]" 1
426 1 12 ASN HB2 1 12 ASN QD 2.800 . 2.800 2.463 2.030 2.864 0.064 11 0 "[ . 1 . 2]" 1
427 1 12 ASN HB3 1 12 ASN QD 2.800 . 2.800 2.666 2.088 3.043 0.243 8 0 "[ . 1 . 2]" 1
428 1 13 GLN H 1 14 ARG H 5.500 . 5.500 4.486 3.252 4.724 . 0 0 "[ . 1 . 2]" 1
429 1 13 GLN HA 1 13 GLN QE 5.500 . 5.500 4.698 3.329 5.468 . 0 0 "[ . 1 . 2]" 1
430 1 13 GLN HA 1 13 GLN QG . . 3.500 2.487 2.222 3.329 . 0 0 "[ . 1 . 2]" 1
431 1 13 GLN HA 1 14 ARG H 2.800 . 2.800 2.344 2.232 2.634 . 0 0 "[ . 1 . 2]" 1
432 1 13 GLN HA 1 14 ARG QG 4.500 . 4.500 3.574 3.018 4.361 . 0 0 "[ . 1 . 2]" 1
433 1 13 GLN QB 1 17 PHE QD 5.500 . 5.500 4.967 4.679 5.247 . 0 0 "[ . 1 . 2]" 1
434 1 13 GLN QB 1 17 PHE QE 5.500 . 5.500 3.149 2.727 3.412 . 0 0 "[ . 1 . 2]" 1
435 1 13 GLN HB2 1 14 ARG H 4.500 . 4.500 4.073 3.126 4.361 . 0 0 "[ . 1 . 2]" 1
436 1 13 GLN HB2 1 14 ARG H 3.500 . 3.500 2.698 2.320 3.170 . 0 0 "[ . 1 . 2]" 1
437 1 13 GLN HB2 1 17 PHE QD 5.500 . 5.500 4.384 4.004 4.767 . 0 0 "[ . 1 . 2]" 1
438 1 13 GLN HB2 1 17 PHE QD 5.500 . 5.500 5.472 5.067 5.604 0.104 11 0 "[ . 1 . 2]" 1
439 1 13 GLN HB2 1 17 PHE QE 5.500 . 5.500 3.421 2.781 3.606 . 0 0 "[ . 1 . 2]" 1
440 1 13 GLN HB2 1 64 THR HA 5.500 . 5.500 3.538 2.956 4.512 . 0 0 "[ . 1 . 2]" 1
441 1 13 GLN HB3 1 17 PHE QE 4.500 . 4.500 3.858 2.929 4.556 0.056 1 0 "[ . 1 . 2]" 1
442 1 13 GLN HB3 1 64 THR HA 5.500 . 5.500 4.834 3.997 5.430 . 0 0 "[ . 1 . 2]" 1
443 1 13 GLN QE 1 21 VAL MG1 . . 4.500 3.438 1.992 4.503 0.003 7 0 "[ . 1 . 2]" 1
444 1 13 GLN QG 1 14 ARG H 4.500 . 4.500 4.301 4.002 4.572 0.072 13 0 "[ . 1 . 2]" 1
445 1 14 ARG H 1 14 ARG HB3 3.500 . 3.500 3.601 3.530 3.661 0.161 2 0 "[ . 1 . 2]" 1
446 1 14 ARG H 1 14 ARG QD 4.500 . 4.500 3.008 1.742 4.545 0.058 14 0 "[ . 1 . 2]" 1
447 1 14 ARG H 1 14 ARG QG 2.800 . 2.800 2.383 1.871 2.864 0.064 9 0 "[ . 1 . 2]" 1
448 1 14 ARG H 1 15 GLN H 4.500 . 4.500 4.433 4.247 4.539 0.039 16 0 "[ . 1 . 2]" 1
449 1 14 ARG HA 1 14 ARG HB2 2.800 . 2.800 2.943 2.920 2.964 0.164 11 0 "[ . 1 . 2]" 1
450 1 14 ARG HA 1 14 ARG QD 3.500 . 3.500 3.564 3.502 3.707 0.207 14 0 "[ . 1 . 2]" 1
451 1 14 ARG HA 1 14 ARG QG . . 2.800 2.582 2.172 2.883 0.083 8 0 "[ . 1 . 2]" 1
452 1 14 ARG HA 1 15 GLN H 2.800 . 2.800 2.510 2.182 2.803 0.003 15 0 "[ . 1 . 2]" 1
453 1 14 ARG HA 1 17 PHE QD 4.500 . 4.500 4.167 3.380 4.543 0.043 19 0 "[ . 1 . 2]" 1
454 1 14 ARG HB2 1 14 ARG QD . . 2.800 2.521 1.999 2.977 0.177 8 0 "[ . 1 . 2]" 1
455 1 14 ARG HB2 1 14 ARG QG 2.800 . 2.800 2.380 2.197 2.568 . 0 0 "[ . 1 . 2]" 1
456 1 14 ARG HB2 1 15 GLN H 3.500 . 3.500 2.911 2.518 3.535 0.035 6 0 "[ . 1 . 2]" 1
457 1 14 ARG HB2 1 15 GLN H 2.800 . 2.800 2.442 2.168 2.955 0.155 12 0 "[ . 1 . 2]" 1
458 1 14 ARG HB3 1 15 GLN H 3.500 . 3.500 2.256 1.842 2.588 . 0 0 "[ . 1 . 2]" 1
459 1 14 ARG HB3 1 15 GLN H 4.500 . 4.500 2.268 1.847 2.607 . 0 0 "[ . 1 . 2]" 1
460 1 14 ARG QD 1 15 GLN H 4.500 . 4.500 4.327 3.851 4.583 0.083 19 0 "[ . 1 . 2]" 1
461 1 15 GLN H 1 15 GLN HB3 3.500 . 3.500 3.424 3.166 3.537 0.037 7 0 "[ . 1 . 2]" 1
462 1 15 GLN H 1 15 GLN QG 2.800 . 2.800 2.154 1.761 2.846 0.046 2 0 "[ . 1 . 2]" 1
463 1 15 GLN H 1 16 PRO HA 4.500 . 4.500 4.606 4.566 4.654 0.154 3 0 "[ . 1 . 2]" 1
464 1 15 GLN H 1 17 PHE QD 5.500 . 5.500 3.093 2.850 3.173 . 0 0 "[ . 1 . 2]" 1
465 1 15 GLN H 1 17 PHE QD 3.500 . 3.500 3.523 3.431 3.561 0.061 7 0 "[ . 1 . 2]" 1
466 1 15 GLN H 1 64 THR MG 5.500 . 5.500 5.370 4.504 5.572 0.072 6 0 "[ . 1 . 2]" 1
467 1 15 GLN HA 1 15 GLN QG . . 3.500 2.717 2.224 3.500 0.000 12 0 "[ . 1 . 2]" 1
468 1 15 GLN HA 1 16 PRO HA 3.500 . 3.500 2.606 2.351 3.225 . 0 0 "[ . 1 . 2]" 1
469 1 15 GLN HA 1 17 PHE H 3.500 . 3.500 2.717 2.223 3.278 . 0 0 "[ . 1 . 2]" 1
470 1 15 GLN HA 1 17 PHE QD 3.500 . 3.500 2.610 2.170 2.956 . 0 0 "[ . 1 . 2]" 1
471 1 15 GLN QB 1 16 PRO HA 3.500 . 3.500 1.822 1.783 1.896 0.017 13 0 "[ . 1 . 2]" 1
472 1 15 GLN QB 1 17 PHE H 2.800 . 2.800 2.583 1.784 2.871 0.071 5 0 "[ . 1 . 2]" 1
473 1 15 GLN QB 1 17 PHE H 3.500 . 3.500 2.867 1.791 3.532 0.032 17 0 "[ . 1 . 2]" 1
474 1 15 GLN HB3 1 16 PRO HA 2.800 . 2.800 1.952 1.797 2.368 0.003 3 0 "[ . 1 . 2]" 1
475 1 15 GLN HB3 1 17 PHE QD 5.500 . 5.500 3.955 2.579 4.612 . 0 0 "[ . 1 . 2]" 1
476 1 15 GLN QG 1 16 PRO HA 5.500 . 5.500 3.495 2.796 3.946 . 0 0 "[ . 1 . 2]" 1
477 1 15 GLN QG 1 17 PHE H 4.500 . 4.500 3.653 2.347 4.522 0.022 12 0 "[ . 1 . 2]" 1
478 1 15 GLN QG 1 17 PHE QD 4.500 . 4.500 2.788 1.916 4.349 . 0 0 "[ . 1 . 2]" 1
479 1 16 PRO HA 1 17 PHE H 2.800 . 2.800 2.192 2.097 2.277 . 0 0 "[ . 1 . 2]" 1
480 1 16 PRO QB 1 17 PHE H 3.500 . 3.500 3.253 2.815 3.509 0.009 3 0 "[ . 1 . 2]" 1
481 1 16 PRO HB2 1 17 PHE H 4.500 . 4.500 3.598 2.928 3.911 . 0 0 "[ . 1 . 2]" 1
482 1 16 PRO HB3 1 17 PHE H 4.500 . 4.500 3.741 3.446 4.128 . 0 0 "[ . 1 . 2]" 1
483 1 16 PRO QG 1 17 PHE H 5.500 . 5.500 4.799 4.380 4.990 . 0 0 "[ . 1 . 2]" 1
484 1 17 PHE H 1 17 PHE HB2 3.500 . 3.500 2.349 2.233 2.485 . 0 0 "[ . 1 . 2]" 1
485 1 17 PHE H 1 17 PHE HB3 3.500 . 3.500 3.568 3.517 3.636 0.136 7 0 "[ . 1 . 2]" 1
486 1 17 PHE H 1 17 PHE QD 3.500 . 3.500 3.435 3.005 3.580 0.080 11 0 "[ . 1 . 2]" 1
487 1 17 PHE H 1 18 PRO HA 5.500 . 5.500 4.829 4.770 4.908 . 0 0 "[ . 1 . 2]" 1
488 1 17 PHE HA 1 17 PHE QD 3.500 . 3.500 2.339 2.112 2.615 . 0 0 "[ . 1 . 2]" 1
489 1 17 PHE HA 1 18 PRO HA 4.500 . 4.500 2.718 2.521 2.881 . 0 0 "[ . 1 . 2]" 1
490 1 17 PHE HA 1 19 ARG H 4.500 . 4.500 3.492 3.160 3.817 . 0 0 "[ . 1 . 2]" 1
491 1 17 PHE HB2 1 18 PRO HA 4.500 . 4.500 3.612 3.519 3.738 . 0 0 "[ . 1 . 2]" 1
492 1 17 PHE HB2 1 19 ARG H 5.500 . 5.500 5.438 5.273 5.555 0.055 20 0 "[ . 1 . 2]" 1
493 1 17 PHE HB2 1 62 THR HA 4.500 . 4.500 4.324 4.054 4.525 0.025 12 0 "[ . 1 . 2]" 1
494 1 17 PHE HB3 1 18 PRO HA 3.500 . 3.500 1.983 1.872 2.124 . 0 0 "[ . 1 . 2]" 1
495 1 17 PHE HB3 1 19 ARG H 4.500 . 4.500 3.943 3.805 4.048 . 0 0 "[ . 1 . 2]" 1
496 1 17 PHE HB3 1 62 THR HA 4.500 . 4.500 2.718 2.388 3.013 . 0 0 "[ . 1 . 2]" 1
497 1 17 PHE QD 1 18 PRO HA 4.500 . 4.500 2.609 2.205 2.847 . 0 0 "[ . 1 . 2]" 1
498 1 17 PHE QD 1 19 ARG H 2.800 . 2.800 2.392 2.087 2.697 . 0 0 "[ . 1 . 2]" 1
499 1 17 PHE QD 1 19 ARG HB2 5.500 . 5.500 2.245 1.966 2.829 . 0 0 "[ . 1 . 2]" 1
500 1 17 PHE QD 1 19 ARG QB 5.500 . 5.500 2.226 1.932 2.790 . 0 0 "[ . 1 . 2]" 1
501 1 17 PHE QD 1 19 ARG HB3 5.500 . 5.500 3.733 2.850 4.255 . 0 0 "[ . 1 . 2]" 1
502 1 17 PHE QD 1 19 ARG QD . . 4.500 3.862 2.924 4.569 0.069 3 0 "[ . 1 . 2]" 1
503 1 17 PHE QD 1 19 ARG QG 5.500 . 5.500 3.301 2.089 4.547 . 0 0 "[ . 1 . 2]" 1
504 1 17 PHE QD 1 61 VAL MG1 3.500 . 3.500 2.376 2.154 2.609 . 0 0 "[ . 1 . 2]" 1
505 1 17 PHE QD 1 61 VAL MG1 3.500 . 3.500 2.446 2.171 2.887 . 0 0 "[ . 1 . 2]" 1
506 1 17 PHE QD 1 62 THR HA 5.500 . 5.500 3.901 3.258 4.253 . 0 0 "[ . 1 . 2]" 1
507 1 17 PHE QD 1 64 THR H 3.500 . 3.500 3.507 3.218 3.599 0.099 9 0 "[ . 1 . 2]" 1
508 1 17 PHE QD 1 63 ARG HA 4.500 . 4.500 2.806 2.233 3.425 . 0 0 "[ . 1 . 2]" 1
509 1 17 PHE QD 1 64 THR HA 5.500 . 5.500 4.526 3.947 5.083 . 0 0 "[ . 1 . 2]" 1
510 1 17 PHE QD 1 64 THR HB 5.500 . 5.500 4.270 3.719 4.926 . 0 0 "[ . 1 . 2]" 1
511 1 17 PHE QE 1 61 VAL MG1 4.500 . 4.500 2.071 1.880 2.323 . 0 0 "[ . 1 . 2]" 1
512 1 17 PHE QE 1 64 THR H 5.500 . 5.500 3.208 2.399 4.267 . 0 0 "[ . 1 . 2]" 1
513 1 17 PHE QE 1 64 THR HA 4.500 . 4.500 2.886 2.478 3.284 . 0 0 "[ . 1 . 2]" 1
514 1 17 PHE QE 1 64 THR HB 4.500 . 4.500 2.601 2.300 3.536 . 0 0 "[ . 1 . 2]" 1
515 1 18 PRO HA 1 19 ARG H 3.500 . 3.500 2.396 2.333 2.471 . 0 0 "[ . 1 . 2]" 1
516 1 18 PRO HA 1 62 THR HA . . 3.500 2.080 1.907 2.248 . 0 0 "[ . 1 . 2]" 1
517 1 18 PRO HA 1 62 THR MG 4.500 . 4.500 3.681 3.105 4.020 . 0 0 "[ . 1 . 2]" 1
518 1 18 PRO QB 1 19 ARG H 4.500 . 4.500 2.794 2.558 3.031 . 0 0 "[ . 1 . 2]" 1
519 1 18 PRO QB 1 60 SER HB2 4.500 . 4.500 2.548 2.002 3.013 . 0 0 "[ . 1 . 2]" 1
520 1 18 PRO QB 1 60 SER HB3 4.500 . 4.500 3.610 3.197 4.035 . 0 0 "[ . 1 . 2]" 1
521 1 18 PRO HB2 1 19 ARG H 4.500 . 4.500 3.112 2.635 3.486 . 0 0 "[ . 1 . 2]" 1
522 1 18 PRO HB2 1 60 SER HB2 4.500 . 4.500 2.718 2.017 3.440 . 0 0 "[ . 1 . 2]" 1
523 1 18 PRO HB2 1 60 SER HB3 5.500 . 5.500 3.765 3.241 4.365 . 0 0 "[ . 1 . 2]" 1
524 1 18 PRO HB2 1 62 THR HA 4.500 . 4.500 3.765 3.328 4.042 . 0 0 "[ . 1 . 2]" 1
525 1 18 PRO HB2 1 62 THR MG 4.500 . 4.500 3.732 3.296 4.325 . 0 0 "[ . 1 . 2]" 1
526 1 18 PRO HB3 1 19 ARG H 4.500 . 4.500 3.227 2.848 3.760 . 0 0 "[ . 1 . 2]" 1
527 1 18 PRO HB3 1 60 SER HB2 5.500 . 5.500 3.235 2.715 3.944 . 0 0 "[ . 1 . 2]" 1
528 1 18 PRO HB3 1 62 THR HA . . 3.500 2.226 1.996 2.473 . 0 0 "[ . 1 . 2]" 1
529 1 18 PRO HB3 1 62 THR MG 4.500 . 4.500 2.352 1.912 2.871 . 0 0 "[ . 1 . 2]" 1
530 1 18 PRO QG 1 62 THR HA 5.500 . 5.500 3.150 2.497 4.229 . 0 0 "[ . 1 . 2]" 1
531 1 18 PRO QG 1 62 THR MG . . 4.500 2.646 2.020 3.785 . 0 0 "[ . 1 . 2]" 1
532 1 19 ARG H 1 19 ARG HB2 3.500 . 3.500 2.644 2.410 2.967 . 0 0 "[ . 1 . 2]" 1
533 1 19 ARG H 1 19 ARG HB3 3.500 . 3.500 3.473 2.982 3.676 0.176 1 0 "[ . 1 . 2]" 1
534 1 19 ARG H 1 19 ARG QG 4.500 . 4.500 3.735 2.808 4.346 . 0 0 "[ . 1 . 2]" 1
535 1 19 ARG H 1 60 SER HA 4.500 . 4.500 4.196 3.847 4.372 . 0 0 "[ . 1 . 2]" 1
536 1 19 ARG H 1 60 SER HB2 4.500 . 4.500 3.259 2.983 3.484 . 0 0 "[ . 1 . 2]" 1
537 1 19 ARG H 1 60 SER HB3 4.500 . 4.500 3.883 3.618 4.346 . 0 0 "[ . 1 . 2]" 1
538 1 19 ARG H 1 61 VAL H 3.500 . 3.500 2.590 2.459 2.698 . 0 0 "[ . 1 . 2]" 1
539 1 19 ARG H 1 61 VAL MG1 3.500 . 3.500 2.582 2.312 2.872 . 0 0 "[ . 1 . 2]" 1
540 1 19 ARG H 1 62 THR HA 4.500 . 4.500 3.697 3.521 3.879 . 0 0 "[ . 1 . 2]" 1
541 1 19 ARG HA 1 19 ARG QD 4.500 . 4.500 3.794 2.397 4.127 . 0 0 "[ . 1 . 2]" 1
542 1 19 ARG HA 1 19 ARG QG . . 3.500 2.193 2.076 2.435 . 0 0 "[ . 1 . 2]" 1
543 1 19 ARG HA 1 20 ASP H 2.800 . 2.800 2.205 2.112 2.310 . 0 0 "[ . 1 . 2]" 1
544 1 19 ARG HA 1 20 ASP HA 5.500 . 5.500 4.483 4.393 4.526 . 0 0 "[ . 1 . 2]" 1
545 1 19 ARG HA 1 60 SER HB2 4.500 . 4.500 4.509 4.301 4.560 0.060 13 0 "[ . 1 . 2]" 1
546 1 19 ARG HA 1 60 SER HB3 4.500 . 4.500 3.994 3.643 4.492 . 0 0 "[ . 1 . 2]" 1
547 1 19 ARG HA 1 61 VAL H 5.500 . 5.500 4.500 4.369 4.702 . 0 0 "[ . 1 . 2]" 1
548 1 19 ARG HA 1 61 VAL MG1 5.500 . 5.500 4.338 4.103 4.832 . 0 0 "[ . 1 . 2]" 1
549 1 19 ARG HB2 1 20 ASP H 4.500 . 4.500 4.319 4.154 4.463 . 0 0 "[ . 1 . 2]" 1
550 1 19 ARG HB2 1 21 VAL MG1 . . 4.500 3.859 3.403 4.466 . 0 0 "[ . 1 . 2]" 1
551 1 19 ARG HB2 1 61 VAL H 5.500 . 5.500 3.958 3.374 4.709 . 0 0 "[ . 1 . 2]" 1
552 1 19 ARG HB2 1 61 VAL MG1 3.500 . 3.500 2.631 2.016 3.503 0.003 4 0 "[ . 1 . 2]" 1
553 1 19 ARG HB3 1 20 ASP H 3.500 . 3.500 3.355 3.002 3.598 0.098 3 0 "[ . 1 . 2]" 1
554 1 19 ARG HB3 1 21 VAL MG1 . . 4.500 3.103 2.690 3.754 . 0 0 "[ . 1 . 2]" 1
555 1 19 ARG HB3 1 61 VAL MG1 . . 3.500 3.029 2.444 3.547 0.047 5 0 "[ . 1 . 2]" 1
556 1 19 ARG QG 1 20 ASP H 4.500 . 4.500 3.328 2.466 4.201 . 0 0 "[ . 1 . 2]" 1
557 1 20 ASP H 1 20 ASP HB2 2.800 . 2.800 2.772 2.528 2.901 0.101 4 0 "[ . 1 . 2]" 1
558 1 20 ASP H 1 20 ASP HB3 2.800 . 2.800 2.336 2.021 2.689 . 0 0 "[ . 1 . 2]" 1
559 1 20 ASP H 1 21 VAL H 5.500 . 5.500 4.556 4.409 4.602 . 0 0 "[ . 1 . 2]" 1
560 1 20 ASP HA 1 21 VAL H 3.500 . 3.500 2.164 2.129 2.218 . 0 0 "[ . 1 . 2]" 1
561 1 20 ASP HA 1 21 VAL MG1 4.500 . 4.500 3.686 3.448 4.141 . 0 0 "[ . 1 . 2]" 1
562 1 20 ASP HA 1 21 VAL MG2 4.500 . 4.500 3.656 3.234 3.824 . 0 0 "[ . 1 . 2]" 1
563 1 20 ASP HA 1 22 GLY H 3.500 . 3.500 3.523 3.449 3.571 0.071 10 0 "[ . 1 . 2]" 1
564 1 20 ASP HA 1 60 SER HA . . 2.800 1.999 1.874 2.181 . 0 0 "[ . 1 . 2]" 1
565 1 20 ASP HA 1 60 SER HB2 5.500 . 5.500 3.688 3.417 4.062 . 0 0 "[ . 1 . 2]" 1
566 1 20 ASP HA 1 60 SER HB3 . . 3.500 2.198 1.985 2.638 . 0 0 "[ . 1 . 2]" 1
567 1 20 ASP HA 1 61 VAL H 5.500 . 5.500 3.777 3.588 3.948 . 0 0 "[ . 1 . 2]" 1
568 1 20 ASP HB2 1 21 VAL H 4.500 . 4.500 4.027 3.822 4.168 . 0 0 "[ . 1 . 2]" 1
569 1 20 ASP HB2 1 22 GLY H 4.500 . 4.500 4.562 4.480 4.652 0.152 5 0 "[ . 1 . 2]" 1
570 1 20 ASP HB3 1 21 VAL H 5.500 . 5.500 4.163 3.741 4.527 . 0 0 "[ . 1 . 2]" 1
571 1 20 ASP HB3 1 22 GLY H 5.500 . 5.500 4.637 4.129 5.147 . 0 0 "[ . 1 . 2]" 1
572 1 21 VAL H 1 21 VAL MG1 3.500 . 3.500 2.991 2.812 3.279 . 0 0 "[ . 1 . 2]" 1
573 1 21 VAL H 1 21 VAL MG2 2.800 . 2.800 2.093 1.934 2.269 . 0 0 "[ . 1 . 2]" 1
574 1 21 VAL H 1 22 GLY H 2.800 . 2.800 1.893 1.779 2.169 0.021 19 0 "[ . 1 . 2]" 1
575 1 21 VAL H 1 59 VAL HB 5.500 . 5.500 3.578 3.459 3.754 . 0 0 "[ . 1 . 2]" 1
576 1 21 VAL H 1 60 SER HA 3.500 . 3.500 2.517 2.267 2.795 . 0 0 "[ . 1 . 2]" 1
577 1 21 VAL H 1 60 SER HB3 4.500 . 4.500 4.067 3.745 4.518 0.018 2 0 "[ . 1 . 2]" 1
578 1 21 VAL H 1 61 VAL H 5.500 . 5.500 4.206 3.940 4.493 . 0 0 "[ . 1 . 2]" 1
579 1 21 VAL HA 1 21 VAL HB . . 2.800 2.477 2.423 2.637 . 0 0 "[ . 1 . 2]" 1
580 1 21 VAL HA 1 21 VAL MG1 2.800 . 2.800 2.338 2.232 2.431 . 0 0 "[ . 1 . 2]" 1
581 1 21 VAL HA 1 21 VAL MG2 3.500 . 3.500 3.206 3.170 3.219 . 0 0 "[ . 1 . 2]" 1
582 1 21 VAL HA 1 22 GLY H 4.500 . 4.500 3.286 3.222 3.390 . 0 0 "[ . 1 . 2]" 1
583 1 21 VAL HB 1 22 GLY H 4.500 . 4.500 4.331 4.022 4.413 . 0 0 "[ . 1 . 2]" 1
584 1 21 VAL MG1 1 21 VAL MG2 2.800 . 2.800 2.036 1.907 2.082 . 0 0 "[ . 1 . 2]" 1
585 1 21 VAL MG1 1 22 GLY H 4.500 . 4.500 4.248 4.179 4.335 . 0 0 "[ . 1 . 2]" 1
586 1 21 VAL MG1 1 60 SER HA 5.500 . 5.500 3.161 2.580 3.939 . 0 0 "[ . 1 . 2]" 1
587 1 21 VAL MG1 1 61 VAL H 4.500 . 4.500 2.777 2.310 3.444 . 0 0 "[ . 1 . 2]" 1
588 1 21 VAL MG1 1 61 VAL HB 3.500 . 3.500 2.794 2.260 3.504 0.004 11 0 "[ . 1 . 2]" 1
589 1 21 VAL MG1 1 61 VAL MG1 2.800 . 2.800 2.191 1.933 2.503 . 0 0 "[ . 1 . 2]" 1
590 1 21 VAL MG2 1 22 GLY H 3.500 . 3.500 2.855 2.658 2.904 . 0 0 "[ . 1 . 2]" 1
591 1 21 VAL MG2 1 22 GLY H 2.800 . 2.800 2.794 2.608 2.842 0.042 18 0 "[ . 1 . 2]" 1
592 1 21 VAL MG2 1 50 PHE QD 5.500 . 5.500 3.035 2.726 3.582 . 0 0 "[ . 1 . 2]" 1
593 1 21 VAL MG2 1 59 VAL HB 3.500 . 3.500 2.544 2.206 3.148 . 0 0 "[ . 1 . 2]" 1
594 1 21 VAL MG2 1 60 SER H 2.800 . 2.800 2.736 2.476 2.825 0.025 2 0 "[ . 1 . 2]" 1
595 1 21 VAL MG2 1 60 SER HA 3.500 . 3.500 2.786 2.423 3.141 . 0 0 "[ . 1 . 2]" 1
596 1 21 VAL MG2 1 61 VAL H 3.500 . 3.500 3.195 2.478 3.501 0.001 8 0 "[ . 1 . 2]" 1
597 1 21 VAL MG2 1 61 VAL HB 3.500 . 3.500 2.824 2.300 3.292 . 0 0 "[ . 1 . 2]" 1
598 1 21 VAL MG2 1 61 VAL MG1 3.500 . 3.500 3.309 2.787 3.513 0.013 16 0 "[ . 1 . 2]" 1
599 1 22 GLY H 1 22 GLY QA 2.800 . 2.800 2.536 2.518 2.562 . 0 0 "[ . 1 . 2]" 1
600 1 22 GLY H 1 23 LYS H 5.500 . 5.500 4.380 4.120 4.481 . 0 0 "[ . 1 . 2]" 1
601 1 22 GLY H 1 58 SER HA 4.500 . 4.500 4.439 4.197 4.561 0.061 18 0 "[ . 1 . 2]" 1
602 1 22 GLY H 1 59 VAL H 3.500 . 3.500 3.203 2.910 3.382 . 0 0 "[ . 1 . 2]" 1
603 1 22 GLY H 1 59 VAL HB 3.500 . 3.500 3.362 3.000 3.511 0.011 6 0 "[ . 1 . 2]" 1
604 1 22 GLY H 1 59 VAL MG1 5.500 . 5.500 4.795 4.414 4.957 . 0 0 "[ . 1 . 2]" 1
605 1 22 GLY H 1 59 VAL MG2 5.500 . 5.500 3.975 3.784 4.253 . 0 0 "[ . 1 . 2]" 1
606 1 22 GLY H 1 60 SER HA 4.500 . 4.500 4.254 4.110 4.428 . 0 0 "[ . 1 . 2]" 1
607 1 22 GLY QA 1 23 LYS H 4.500 . 4.500 2.313 2.190 2.364 . 0 0 "[ . 1 . 2]" 1
608 1 23 LYS HA 1 23 LYS HB2 . . 2.800 2.612 2.381 2.922 0.122 3 0 "[ . 1 . 2]" 1
609 1 23 LYS HA 1 24 VAL H 2.800 . 2.800 2.122 2.082 2.159 . 0 0 "[ . 1 . 2]" 1
610 1 23 LYS HA 1 24 VAL MG2 5.500 . 5.500 3.770 3.523 3.920 . 0 0 "[ . 1 . 2]" 1
611 1 23 LYS HA 1 58 SER H 4.500 . 4.500 4.210 4.069 4.387 . 0 0 "[ . 1 . 2]" 1
612 1 23 LYS HA 1 58 SER HA 2.800 . 2.800 1.936 1.875 2.107 . 0 0 "[ . 1 . 2]" 1
613 1 23 LYS HA 1 58 SER HB3 5.500 . 5.500 4.283 4.056 4.930 . 0 0 "[ . 1 . 2]" 1
614 1 23 LYS HA 1 59 VAL H 3.500 . 3.500 2.318 2.044 2.580 . 0 0 "[ . 1 . 2]" 1
615 1 23 LYS HA 1 59 VAL MG2 . . 3.500 2.619 2.400 2.993 . 0 0 "[ . 1 . 2]" 1
616 1 23 LYS QB 1 58 SER HA 4.500 . 4.500 3.015 2.159 3.796 . 0 0 "[ . 1 . 2]" 1
617 1 23 LYS QB 1 59 VAL H 4.500 . 4.500 4.010 3.445 4.425 . 0 0 "[ . 1 . 2]" 1
618 1 23 LYS QB 1 59 VAL MG2 5.500 . 5.500 4.179 3.962 4.723 . 0 0 "[ . 1 . 2]" 1
619 1 23 LYS HB2 1 24 VAL H 4.500 . 4.500 3.998 3.620 4.310 . 0 0 "[ . 1 . 2]" 1
620 1 23 LYS HB2 1 24 VAL H 5.500 . 5.500 4.355 3.870 4.567 . 0 0 "[ . 1 . 2]" 1
621 1 23 LYS HB2 1 25 VAL MG2 5.500 . 5.500 4.221 3.629 4.835 . 0 0 "[ . 1 . 2]" 1
622 1 23 LYS HB2 1 58 SER HA 4.500 . 4.500 3.141 2.173 4.176 . 0 0 "[ . 1 . 2]" 1
623 1 23 LYS HB3 1 24 VAL H 4.500 . 4.500 4.026 3.230 4.336 . 0 0 "[ . 1 . 2]" 1
624 1 23 LYS HB3 1 25 VAL MG2 5.500 . 5.500 2.993 2.104 3.736 . 0 0 "[ . 1 . 2]" 1
625 1 23 LYS HB3 1 58 SER HA 5.500 . 5.500 4.140 3.742 4.405 . 0 0 "[ . 1 . 2]" 1
626 1 23 LYS QD 1 25 VAL MG2 3.500 . 3.500 2.636 1.814 3.538 0.038 3 0 "[ . 1 . 2]" 1
627 1 23 LYS QE 1 23 LYS QG . . 2.800 2.487 2.121 2.895 0.095 1 0 "[ . 1 . 2]" 1
628 1 23 LYS QE 1 25 VAL MG2 4.500 . 4.500 3.384 1.886 4.571 0.071 8 0 "[ . 1 . 2]" 1
629 1 23 LYS QG 1 24 VAL H . . 3.500 2.863 2.296 3.551 0.051 3 0 "[ . 1 . 2]" 1
630 1 23 LYS QG 1 25 VAL MG2 4.500 . 4.500 2.565 1.858 3.661 . 0 0 "[ . 1 . 2]" 1
631 1 23 LYS QG 1 58 SER H 3.500 . 3.500 3.104 2.907 3.444 . 0 0 "[ . 1 . 2]" 1
632 1 23 LYS QG 1 59 VAL H 5.500 . 5.500 3.413 2.897 3.768 . 0 0 "[ . 1 . 2]" 1
633 1 23 LYS QG 1 58 SER H 5.500 . 5.500 3.177 2.931 3.642 . 0 0 "[ . 1 . 2]" 1
634 1 23 LYS QG 1 58 SER HA . . 4.500 2.321 1.847 2.947 . 0 0 "[ . 1 . 2]" 1
635 1 23 LYS QG 1 59 VAL H 4.500 . 4.500 3.928 3.040 4.343 . 0 0 "[ . 1 . 2]" 1
636 1 24 VAL H 1 24 VAL HB 3.500 . 3.500 2.658 2.554 2.760 . 0 0 "[ . 1 . 2]" 1
637 1 24 VAL H 1 24 VAL MG1 4.500 . 4.500 3.872 3.820 3.940 . 0 0 "[ . 1 . 2]" 1
638 1 24 VAL H 1 24 VAL MG1 2.800 . 2.800 2.494 2.266 2.698 . 0 0 "[ . 1 . 2]" 1
639 1 24 VAL H 1 24 VAL MG2 2.800 . 2.800 2.444 2.253 2.622 . 0 0 "[ . 1 . 2]" 1
640 1 24 VAL H 1 25 VAL H 5.500 . 5.500 4.518 4.149 4.694 . 0 0 "[ . 1 . 2]" 1
641 1 24 VAL H 1 25 VAL MG2 4.500 . 4.500 3.951 3.514 4.264 . 0 0 "[ . 1 . 2]" 1
642 1 24 VAL H 1 57 GLY QA . . 4.500 3.134 3.004 3.318 . 0 0 "[ . 1 . 2]" 1
643 1 24 VAL H 1 58 SER HA 3.500 . 3.500 3.438 3.263 3.533 0.033 6 0 "[ . 1 . 2]" 1
644 1 24 VAL H 1 59 VAL H . . 3.500 3.552 3.509 3.593 0.093 20 0 "[ . 1 . 2]" 1
645 1 24 VAL H 1 59 VAL MG2 4.500 . 4.500 2.526 2.282 2.751 . 0 0 "[ . 1 . 2]" 1
646 1 24 VAL HA 1 24 VAL MG1 2.800 . 2.800 2.223 2.127 2.300 . 0 0 "[ . 1 . 2]" 1
647 1 24 VAL HA 1 24 VAL MG2 2.800 . 2.800 2.512 2.456 2.639 . 0 0 "[ . 1 . 2]" 1
648 1 24 VAL HA 1 25 VAL H 2.800 . 2.800 2.267 2.142 2.397 . 0 0 "[ . 1 . 2]" 1
649 1 24 VAL HA 1 25 VAL HA 4.500 . 4.500 4.443 4.346 4.514 0.014 5 0 "[ . 1 . 2]" 1
650 1 24 VAL HA 1 25 VAL HB 4.500 . 4.500 4.549 4.523 4.594 0.094 6 0 "[ . 1 . 2]" 1
651 1 24 VAL HA 1 25 VAL MG2 4.500 . 4.500 3.246 2.936 3.654 . 0 0 "[ . 1 . 2]" 1
652 1 24 VAL HB 1 25 VAL H 4.500 . 4.500 3.879 3.542 4.168 . 0 0 "[ . 1 . 2]" 1
653 1 24 VAL HB 1 25 VAL HA 4.500 . 4.500 4.489 4.417 4.548 0.048 6 0 "[ . 1 . 2]" 1
654 1 24 VAL HB 1 26 ASP HB3 5.500 . 5.500 4.832 4.440 5.297 . 0 0 "[ . 1 . 2]" 1
655 1 24 VAL HB 1 35 PHE QE 5.500 . 5.500 4.305 3.154 4.880 . 0 0 "[ . 1 . 2]" 1
656 1 24 VAL HB 1 52 ILE MD 4.500 . 4.500 2.070 1.914 2.270 . 0 0 "[ . 1 . 2]" 1
657 1 24 VAL HB 1 52 ILE HG12 4.500 . 4.500 4.433 4.232 4.521 0.021 17 0 "[ . 1 . 2]" 1
658 1 24 VAL HB 1 57 GLY QA . . 4.500 3.146 2.708 3.583 . 0 0 "[ . 1 . 2]" 1
659 1 24 VAL HB 1 77 VAL MG1 . . 4.500 2.768 2.275 3.214 . 0 0 "[ . 1 . 2]" 1
660 1 24 VAL MG1 1 24 VAL MG2 2.800 . 2.800 1.982 1.920 2.044 . 0 0 "[ . 1 . 2]" 1
661 1 24 VAL QG 1 77 VAL HB 4.500 . 4.500 2.778 2.489 3.063 . 0 0 "[ . 1 . 2]" 1
662 1 24 VAL MG1 1 25 VAL H 2.800 . 2.800 2.394 1.905 2.861 0.061 8 0 "[ . 1 . 2]" 1
663 1 24 VAL MG1 1 25 VAL HA 5.500 . 5.500 3.957 3.761 4.248 . 0 0 "[ . 1 . 2]" 1
664 1 24 VAL MG1 1 25 VAL HB 5.500 . 5.500 4.668 4.322 5.055 . 0 0 "[ . 1 . 2]" 1
665 1 24 VAL MG1 1 26 ASP H 5.500 . 5.500 4.987 4.411 5.275 . 0 0 "[ . 1 . 2]" 1
666 1 24 VAL MG1 1 26 ASP HB3 5.500 . 5.500 4.991 4.814 5.311 . 0 0 "[ . 1 . 2]" 1
667 1 24 VAL MG1 1 35 PHE QD . . 3.500 3.341 2.861 3.518 0.018 19 0 "[ . 1 . 2]" 1
668 1 24 VAL MG1 1 35 PHE QE 3.500 . 3.500 3.083 2.035 3.502 0.002 1 0 "[ . 1 . 2]" 1
669 1 24 VAL MG1 1 35 PHE HZ . . 4.500 4.382 3.897 4.516 0.016 10 0 "[ . 1 . 2]" 1
670 1 24 VAL MG1 1 52 ILE MD 3.500 . 3.500 3.257 3.073 3.396 . 0 0 "[ . 1 . 2]" 1
671 1 24 VAL MG1 1 52 ILE MD 2.800 . 2.800 2.607 2.080 2.825 0.025 2 0 "[ . 1 . 2]" 1
672 1 24 VAL MG1 1 57 GLY QA 5.500 . 5.500 4.200 3.937 4.456 . 0 0 "[ . 1 . 2]" 1
673 1 24 VAL MG1 1 77 VAL HB 5.500 . 5.500 2.835 2.525 3.138 . 0 0 "[ . 1 . 2]" 1
674 1 24 VAL MG1 1 77 VAL MG1 2.800 . 2.800 2.053 1.955 2.210 . 0 0 "[ . 1 . 2]" 1
675 1 24 VAL MG2 1 25 VAL H 4.500 . 4.500 4.160 4.045 4.339 . 0 0 "[ . 1 . 2]" 1
676 1 24 VAL MG2 1 26 ASP HB3 5.500 . 5.500 5.421 4.955 5.565 0.065 8 0 "[ . 1 . 2]" 1
677 1 24 VAL MG2 1 35 PHE QD 5.500 . 5.500 4.716 3.970 5.055 . 0 0 "[ . 1 . 2]" 1
678 1 24 VAL MG2 1 52 ILE MD 2.800 . 2.800 2.151 1.922 2.617 . 0 0 "[ . 1 . 2]" 1
679 1 24 VAL MG2 1 52 ILE MD 2.800 . 2.800 1.985 1.810 2.246 . 0 0 "[ . 1 . 2]" 1
680 1 24 VAL MG2 1 57 GLY QA 4.500 . 4.500 3.983 3.473 4.485 . 0 0 "[ . 1 . 2]" 1
681 1 24 VAL MG2 1 77 VAL HB 4.500 . 4.500 4.001 3.770 4.371 . 0 0 "[ . 1 . 2]" 1
682 1 24 VAL MG2 1 77 VAL MG1 2.800 . 2.800 2.181 2.057 2.404 . 0 0 "[ . 1 . 2]" 1
683 1 24 VAL MG2 1 77 VAL MG2 2.800 . 2.800 2.301 2.041 2.780 . 0 0 "[ . 1 . 2]" 1
684 1 25 VAL H 1 25 VAL HB 2.800 . 2.800 2.701 2.501 2.826 0.026 18 0 "[ . 1 . 2]" 1
685 1 25 VAL H 1 25 VAL QG 2.800 . 2.800 2.653 2.364 2.743 . 0 0 "[ . 1 . 2]" 1
686 1 25 VAL H 1 25 VAL MG2 2.800 . 2.800 2.700 2.387 2.803 0.003 16 0 "[ . 1 . 2]" 1
687 1 25 VAL H 1 26 ASP H 4.500 . 4.500 4.374 4.283 4.468 . 0 0 "[ . 1 . 2]" 1
688 1 25 VAL HA 1 25 VAL QG 2.800 . 2.800 2.105 2.058 2.155 . 0 0 "[ . 1 . 2]" 1
689 1 25 VAL HA 1 25 VAL MG1 2.800 . 2.800 2.279 2.138 2.369 . 0 0 "[ . 1 . 2]" 1
690 1 25 VAL HA 1 25 VAL MG2 2.800 . 2.800 2.449 2.319 2.583 . 0 0 "[ . 1 . 2]" 1
691 1 25 VAL HA 1 26 ASP H 2.800 . 2.800 2.381 2.150 2.560 . 0 0 "[ . 1 . 2]" 1
692 1 25 VAL HA 1 35 PHE QE 5.500 . 5.500 3.303 2.827 3.905 . 0 0 "[ . 1 . 2]" 1
693 1 25 VAL HA 1 35 PHE HZ 4.500 . 4.500 2.753 2.362 3.543 . 0 0 "[ . 1 . 2]" 1
694 1 25 VAL HB 1 26 ASP H 4.500 . 4.500 3.617 3.202 4.212 . 0 0 "[ . 1 . 2]" 1
695 1 25 VAL QG 1 26 ASP H 2.800 . 2.800 2.127 1.828 2.708 . 0 0 "[ . 1 . 2]" 1
696 1 25 VAL MG1 1 26 ASP H 3.500 . 3.500 2.137 1.831 2.751 . 0 0 "[ . 1 . 2]" 1
697 1 25 VAL MG1 1 26 ASP HA 4.500 . 4.500 3.835 3.494 4.084 . 0 0 "[ . 1 . 2]" 1
698 1 26 ASP H 1 26 ASP HB2 3.500 . 3.500 3.143 2.853 3.505 0.005 3 0 "[ . 1 . 2]" 1
699 1 26 ASP H 1 26 ASP HB3 3.500 . 3.500 2.838 2.635 3.016 . 0 0 "[ . 1 . 2]" 1
700 1 26 ASP H 1 27 SER H 5.500 . 5.500 4.240 3.159 4.461 . 0 0 "[ . 1 . 2]" 1
701 1 26 ASP H 1 35 PHE QE 3.500 . 3.500 3.458 3.104 3.589 0.089 2 0 "[ . 1 . 2]" 1
702 1 26 ASP H 1 35 PHE HZ 3.500 . 3.500 2.214 1.795 2.511 0.005 14 0 "[ . 1 . 2]" 1
703 1 26 ASP HA 1 27 SER H 3.500 . 3.500 2.170 2.072 2.279 . 0 0 "[ . 1 . 2]" 1
704 1 26 ASP HA 1 27 SER HA 5.500 . 5.500 4.354 4.215 4.552 . 0 0 "[ . 1 . 2]" 1
705 1 26 ASP HA 1 28 ASP H 5.500 . 5.500 3.954 3.442 5.186 . 0 0 "[ . 1 . 2]" 1
706 1 26 ASP HB2 1 29 ARG H 4.500 . 4.500 4.097 2.933 4.472 . 0 0 "[ . 1 . 2]" 1
707 1 26 ASP HB2 1 35 PHE QE 5.500 . 5.500 2.294 1.954 3.454 . 0 0 "[ . 1 . 2]" 1
708 1 26 ASP HB2 1 35 PHE HZ 5.500 . 5.500 2.552 1.877 3.499 . 0 0 "[ . 1 . 2]" 1
709 1 26 ASP HB3 1 29 ARG HA 5.500 . 5.500 3.643 2.185 5.124 . 0 0 "[ . 1 . 2]" 1
710 1 26 ASP HB3 1 29 ARG HB2 5.500 . 5.500 3.806 1.941 4.848 . 0 0 "[ . 1 . 2]" 1
711 1 26 ASP HB3 1 29 ARG HB3 5.500 . 5.500 4.048 3.123 4.759 . 0 0 "[ . 1 . 2]" 1
712 1 26 ASP HB3 1 29 ARG QG 4.500 . 4.500 2.350 1.792 4.229 0.008 16 0 "[ . 1 . 2]" 1
713 1 26 ASP HB3 1 35 PHE QE 4.500 . 4.500 3.525 2.772 4.071 . 0 0 "[ . 1 . 2]" 1
714 1 26 ASP HB3 1 35 PHE QE 5.500 . 5.500 2.961 2.587 3.333 . 0 0 "[ . 1 . 2]" 1
715 1 26 ASP HB3 1 35 PHE HZ 4.500 . 4.500 2.785 2.164 3.549 . 0 0 "[ . 1 . 2]" 1
716 1 27 SER H 1 28 ASP H . . 3.500 2.687 2.182 3.202 . 0 0 "[ . 1 . 2]" 1
717 1 27 SER HA 1 27 SER HB2 . . 2.800 2.796 2.610 2.919 0.119 3 0 "[ . 1 . 2]" 1
718 1 27 SER HA 1 27 SER HB3 2.800 . 2.800 2.252 2.186 2.380 . 0 0 "[ . 1 . 2]" 1
719 1 27 SER HA 1 28 ASP H 3.500 . 3.500 3.456 3.234 3.560 0.060 3 0 "[ . 1 . 2]" 1
720 1 27 SER HA 1 29 ARG H 5.500 . 5.500 4.733 3.824 5.572 0.072 20 0 "[ . 1 . 2]" 1
721 1 27 SER HB2 1 28 ASP H 4.500 . 4.500 3.227 2.143 4.037 . 0 0 "[ . 1 . 2]" 1
722 1 27 SER HB3 1 28 ASP H 4.500 . 4.500 4.207 3.507 4.554 0.054 13 0 "[ . 1 . 2]" 1
723 1 28 ASP H 1 28 ASP HB2 3.500 . 3.500 3.137 2.650 3.626 0.126 1 0 "[ . 1 . 2]" 1
724 1 28 ASP H 1 28 ASP HB3 2.800 . 2.800 2.719 2.124 2.904 0.104 1 0 "[ . 1 . 2]" 1
725 1 28 ASP H 1 29 ARG H 3.500 . 3.500 3.059 1.792 3.536 0.036 17 0 "[ . 1 . 2]" 1
726 1 28 ASP HA 1 28 ASP HB3 . . 2.800 2.757 2.286 2.973 0.173 6 0 "[ . 1 . 2]" 1
727 1 28 ASP HB3 1 29 ARG H 4.500 . 4.500 3.161 1.864 4.131 . 0 0 "[ . 1 . 2]" 1
728 1 29 ARG H 1 29 ARG HB2 3.500 . 3.500 2.450 2.175 3.073 . 0 0 "[ . 1 . 2]" 1
729 1 29 ARG H 1 29 ARG HB3 3.500 . 3.500 2.646 1.795 3.402 0.005 11 0 "[ . 1 . 2]" 1
730 1 29 ARG H 1 29 ARG QG 4.500 . 4.500 2.819 1.800 4.045 0.000 11 0 "[ . 1 . 2]" 1
731 1 29 ARG H 1 30 PRO QD 5.500 . 5.500 4.258 3.698 4.437 . 0 0 "[ . 1 . 2]" 1
732 1 29 ARG HA 1 29 ARG HB2 2.800 . 2.800 2.941 2.913 2.978 0.178 20 0 "[ . 1 . 2]" 1
733 1 29 ARG HA 1 30 PRO QD 2.800 . 2.800 2.021 1.927 2.136 . 0 0 "[ . 1 . 2]" 1
734 1 29 ARG HA 1 30 PRO QG 4.500 . 4.500 3.952 3.835 4.064 . 0 0 "[ . 1 . 2]" 1
735 1 29 ARG HB2 1 29 ARG QD . . 2.800 2.607 2.140 2.929 0.129 13 0 "[ . 1 . 2]" 1
736 1 29 ARG HB3 1 29 ARG QD . . 3.500 2.989 2.105 3.557 0.057 13 0 "[ . 1 . 2]" 1
737 1 29 ARG HB3 1 30 PRO QD 4.500 . 4.500 2.991 2.161 4.051 . 0 0 "[ . 1 . 2]" 1
738 1 29 ARG QD 1 35 PHE HZ 5.500 . 5.500 3.646 2.103 5.581 0.081 1 0 "[ . 1 . 2]" 1
739 1 30 PRO HA 1 30 PRO HB3 2.800 . 2.800 2.289 2.222 2.330 . 0 0 "[ . 1 . 2]" 1
740 1 30 PRO HB2 1 33 SER HB2 5.500 . 5.500 4.428 3.685 5.532 0.032 6 0 "[ . 1 . 2]" 1
741 1 30 PRO HB2 1 33 SER QB 4.500 . 4.500 3.050 1.994 4.023 . 0 0 "[ . 1 . 2]" 1
742 1 30 PRO HB2 1 87 LEU MD2 2.800 . 2.800 2.192 2.086 2.601 . 0 0 "[ . 1 . 2]" 1
743 1 30 PRO HB2 1 87 LEU MD2 4.500 . 4.500 4.130 3.124 4.530 0.030 19 0 "[ . 1 . 2]" 1
744 1 30 PRO HB3 1 33 SER HB3 5.500 . 5.500 4.626 3.496 5.581 0.081 1 0 "[ . 1 . 2]" 1
745 1 30 PRO HB3 1 87 LEU MD2 5.500 . 5.500 4.795 2.899 5.535 0.035 18 0 "[ . 1 . 2]" 1
746 1 30 PRO QD 1 33 SER HB2 5.500 . 5.500 3.188 2.420 5.347 . 0 0 "[ . 1 . 2]" 1
747 1 30 PRO QD 1 33 SER HB3 5.500 . 5.500 2.576 1.943 3.950 . 0 0 "[ . 1 . 2]" 1
748 1 30 PRO QD 1 87 LEU MD2 . . 4.500 3.303 2.393 4.235 . 0 0 "[ . 1 . 2]" 1
749 1 30 PRO QG 1 33 SER QB 5.500 . 5.500 2.787 2.015 3.978 . 0 0 "[ . 1 . 2]" 1
750 1 30 PRO QG 1 87 LEU MD2 . . 3.500 2.748 1.937 3.512 0.012 1 0 "[ . 1 . 2]" 1
751 1 31 GLU HA 1 31 GLU QB 2.800 . 2.800 2.255 2.148 2.558 . 0 0 "[ . 1 . 2]" 1
752 1 31 GLU HA 1 33 SER H 3.500 . 3.500 2.816 2.317 3.201 . 0 0 "[ . 1 . 2]" 1
753 1 31 GLU HA 1 32 ARG QG 4.500 . 4.500 4.258 3.690 4.610 0.110 18 0 "[ . 1 . 2]" 1
754 1 31 GLU QB 1 33 SER H 4.500 . 4.500 3.586 3.124 3.818 . 0 0 "[ . 1 . 2]" 1
755 1 31 GLU QB 1 32 ARG QG 4.500 . 4.500 2.581 1.941 3.299 . 0 0 "[ . 1 . 2]" 1
756 1 31 GLU QG 1 32 ARG QG 4.500 . 4.500 3.984 2.494 4.525 0.025 6 0 "[ . 1 . 2]" 1
757 1 32 ARG HA 1 32 ARG QB 2.800 . 2.800 2.330 2.210 2.512 . 0 0 "[ . 1 . 2]" 1
758 1 32 ARG HA 1 32 ARG QG 2.800 . 2.800 2.643 2.361 2.958 0.158 16 0 "[ . 1 . 2]" 1
759 1 32 ARG HA 1 33 SER H 4.500 . 4.500 2.879 2.321 3.445 . 0 0 "[ . 1 . 2]" 1
760 1 32 ARG QB 1 82 VAL MG1 3.500 . 3.500 2.301 1.816 3.554 0.054 10 0 "[ . 1 . 2]" 1
761 1 32 ARG HB2 1 82 VAL QG 4.500 . 4.500 2.477 1.873 3.824 . 0 0 "[ . 1 . 2]" 1
762 1 32 ARG HB3 1 32 ARG QG 2.800 . 2.800 2.385 2.172 2.574 . 0 0 "[ . 1 . 2]" 1
763 1 32 ARG QG 1 33 SER H 5.500 . 5.500 4.384 3.750 4.749 . 0 0 "[ . 1 . 2]" 1
764 1 33 SER HA 1 33 SER HB2 2.800 . 2.800 2.764 2.539 2.951 0.151 7 0 "[ . 1 . 2]" 1
765 1 33 SER HA 1 33 SER HB3 2.800 . 2.800 2.265 2.207 2.352 . 0 0 "[ . 1 . 2]" 1
766 1 33 SER HA 1 34 LYS H 2.800 . 2.800 2.215 2.092 2.433 . 0 0 "[ . 1 . 2]" 1
767 1 33 SER HA 1 80 THR H 5.500 . 5.500 4.392 3.656 4.899 . 0 0 "[ . 1 . 2]" 1
768 1 33 SER HA 1 82 VAL H 4.500 . 4.500 2.413 2.335 2.481 . 0 0 "[ . 1 . 2]" 1
769 1 33 SER HA 1 87 LEU MD2 4.500 . 4.500 3.596 2.600 4.500 . 0 0 "[ . 1 . 2]" 1
770 1 33 SER QB 1 34 LYS H 3.500 . 3.500 2.854 2.093 3.564 0.064 6 0 "[ . 1 . 2]" 1
771 1 33 SER QB 1 79 THR HB 5.500 . 5.500 3.600 2.763 4.354 . 0 0 "[ . 1 . 2]" 1
772 1 33 SER QB 1 79 THR MG 5.500 . 5.500 2.494 1.878 3.332 . 0 0 "[ . 1 . 2]" 1
773 1 33 SER QB 1 87 LEU MD2 4.500 . 4.500 2.690 2.046 4.490 . 0 0 "[ . 1 . 2]" 1
774 1 33 SER HB3 1 79 THR HB 4.500 . 4.500 4.128 2.932 4.547 0.047 15 0 "[ . 1 . 2]" 1
775 1 34 LYS H 1 34 LYS HB2 3.500 . 3.500 2.639 1.950 3.160 . 0 0 "[ . 1 . 2]" 1
776 1 34 LYS H 1 35 PHE H 5.500 . 5.500 4.412 4.244 4.535 . 0 0 "[ . 1 . 2]" 1
777 1 34 LYS H 1 80 THR H 3.500 . 3.500 2.845 2.410 3.336 . 0 0 "[ . 1 . 2]" 1
778 1 34 LYS H 1 80 THR H 4.500 . 4.500 2.809 2.400 3.245 . 0 0 "[ . 1 . 2]" 1
779 1 34 LYS H 1 80 THR MG 4.500 . 4.500 3.348 2.833 3.664 . 0 0 "[ . 1 . 2]" 1
780 1 34 LYS H 1 80 THR O 1.900 . 2.300 1.753 1.694 1.906 0.106 6 0 "[ . 1 . 2]" 1
781 1 34 LYS HA 1 34 LYS HB2 2.800 . 2.800 2.707 2.251 2.922 0.122 18 0 "[ . 1 . 2]" 1
782 1 34 LYS HA 1 34 LYS HB3 . . 2.800 2.352 2.217 2.535 . 0 0 "[ . 1 . 2]" 1
783 1 34 LYS HA 1 34 LYS QG . . 3.500 2.830 2.235 3.420 . 0 0 "[ . 1 . 2]" 1
784 1 34 LYS HA 1 35 PHE H 4.500 . 4.500 2.320 2.170 2.505 . 0 0 "[ . 1 . 2]" 1
785 1 34 LYS HA 1 35 PHE QD 5.500 . 5.500 4.035 3.459 4.983 . 0 0 "[ . 1 . 2]" 1
786 1 34 LYS HA 1 54 GLU QB 5.500 . 5.500 3.293 2.349 4.185 . 0 0 "[ . 1 . 2]" 1
787 1 34 LYS HA 1 54 GLU HB3 4.500 . 4.500 3.711 2.548 4.471 . 0 0 "[ . 1 . 2]" 1
788 1 34 LYS HA 1 55 ASN HA 5.500 . 5.500 3.150 2.547 4.031 . 0 0 "[ . 1 . 2]" 1
789 1 34 LYS QB 1 79 THR MG 4.500 . 4.500 4.479 4.141 4.636 0.136 8 0 "[ . 1 . 2]" 1
790 1 34 LYS HB2 1 35 PHE H 4.500 . 4.500 3.374 2.688 3.932 . 0 0 "[ . 1 . 2]" 1
791 1 34 LYS HB2 1 54 GLU HA 4.500 . 4.500 4.012 3.216 4.537 0.037 18 0 "[ . 1 . 2]" 1
792 1 34 LYS HB2 1 54 GLU QB 3.500 . 3.500 2.497 2.051 3.015 . 0 0 "[ . 1 . 2]" 1
793 1 34 LYS HB2 1 54 GLU QG 5.500 . 5.500 3.927 2.899 4.656 . 0 0 "[ . 1 . 2]" 1
794 1 34 LYS HB2 1 35 PHE H 5.500 . 5.500 3.502 2.705 4.166 . 0 0 "[ . 1 . 2]" 1
795 1 34 LYS HB2 1 54 GLU QB 4.500 . 4.500 3.098 2.106 4.283 . 0 0 "[ . 1 . 2]" 1
796 1 34 LYS HB2 1 79 THR HB 5.500 . 5.500 4.227 2.953 5.048 . 0 0 "[ . 1 . 2]" 1
797 1 34 LYS HB2 1 80 THR H 5.500 . 5.500 4.035 3.427 4.644 . 0 0 "[ . 1 . 2]" 1
798 1 34 LYS HB3 1 35 PHE H 4.500 . 4.500 3.005 2.383 3.612 . 0 0 "[ . 1 . 2]" 1
799 1 34 LYS HB3 1 54 GLU HA 3.500 . 3.500 3.545 3.450 3.669 0.169 17 0 "[ . 1 . 2]" 1
800 1 34 LYS HB3 1 54 GLU QB 3.500 . 3.500 2.072 1.795 2.608 0.005 15 0 "[ . 1 . 2]" 1
801 1 34 LYS HB3 1 54 GLU QG 5.500 . 5.500 3.968 2.989 4.458 . 0 0 "[ . 1 . 2]" 1
802 1 34 LYS QD 1 54 GLU QB 4.500 . 4.500 3.026 2.099 4.503 0.003 14 0 "[ . 1 . 2]" 1
803 1 34 LYS QD 1 80 THR HB 5.500 . 5.500 4.990 2.653 5.565 0.065 16 0 "[ . 1 . 2]" 1
804 1 34 LYS QD 1 82 VAL HA 5.500 . 5.500 3.967 2.061 5.339 . 0 0 "[ . 1 . 2]" 1
805 1 34 LYS QE 1 34 LYS QG . . 3.500 2.412 2.078 2.988 . 0 0 "[ . 1 . 2]" 1
806 1 34 LYS QE 1 54 GLU QB 5.500 . 5.500 4.392 3.623 5.320 . 0 0 "[ . 1 . 2]" 1
807 1 34 LYS QE 1 82 VAL HA . . 3.500 3.064 1.948 3.528 0.028 16 0 "[ . 1 . 2]" 1
808 1 34 LYS QE 1 82 VAL MG1 4.500 . 4.500 3.552 2.189 4.567 0.067 17 0 "[ . 1 . 2]" 1
809 1 34 LYS QG 1 35 PHE H 5.500 . 5.500 4.394 4.030 4.811 . 0 0 "[ . 1 . 2]" 1
810 1 34 LYS QG 1 54 GLU QB 5.500 . 5.500 3.522 2.203 4.227 . 0 0 "[ . 1 . 2]" 1
811 1 34 LYS QG 1 54 GLU QB 5.500 . 5.500 3.453 2.189 4.121 . 0 0 "[ . 1 . 2]" 1
812 1 34 LYS QG 1 82 VAL HA 5.500 . 5.500 3.785 2.350 5.508 0.008 11 0 "[ . 1 . 2]" 1
813 1 34 LYS N 1 80 THR O 2.800 2.700 3.300 2.654 2.604 2.708 0.096 20 0 "[ . 1 . 2]" 1
814 1 34 LYS O 1 80 THR H 1.900 . 2.300 1.747 1.674 1.815 0.126 4 0 "[ . 1 . 2]" 1
815 1 34 LYS O 1 80 THR N 2.800 2.700 3.300 2.646 2.584 2.692 0.116 17 0 "[ . 1 . 2]" 1
816 1 35 PHE H 1 35 PHE HB2 3.500 . 3.500 2.399 2.308 2.528 . 0 0 "[ . 1 . 2]" 1
817 1 35 PHE H 1 35 PHE QD 3.500 . 3.500 2.885 2.421 3.555 0.055 5 0 "[ . 1 . 2]" 1
818 1 35 PHE H 1 35 PHE QD 3.500 . 3.500 2.738 2.383 3.169 . 0 0 "[ . 1 . 2]" 1
819 1 35 PHE H 1 36 ARG H 5.500 . 5.500 4.518 4.338 4.638 . 0 0 "[ . 1 . 2]" 1
820 1 35 PHE H 1 54 GLU H 5.500 . 5.500 4.733 4.360 4.965 . 0 0 "[ . 1 . 2]" 1
821 1 35 PHE H 1 54 GLU HA 3.500 . 3.500 2.120 1.789 2.429 0.011 14 0 "[ . 1 . 2]" 1
822 1 35 PHE H 1 54 GLU QB 3.500 . 3.500 2.947 2.446 3.305 . 0 0 "[ . 1 . 2]" 1
823 1 35 PHE H 1 54 GLU QG 5.500 . 5.500 4.328 3.174 5.063 . 0 0 "[ . 1 . 2]" 1
824 1 35 PHE HA 1 35 PHE QD 3.500 . 3.500 2.560 2.085 2.943 . 0 0 "[ . 1 . 2]" 1
825 1 35 PHE HA 1 35 PHE QD 3.500 . 3.500 2.446 2.057 2.853 . 0 0 "[ . 1 . 2]" 1
826 1 35 PHE HA 1 36 ARG H 2.800 . 2.800 2.188 2.100 2.285 . 0 0 "[ . 1 . 2]" 1
827 1 35 PHE HA 1 36 ARG H 2.800 . 2.800 2.165 2.085 2.253 . 0 0 "[ . 1 . 2]" 1
828 1 35 PHE HA 1 52 ILE MD 5.500 . 5.500 4.128 3.921 4.339 . 0 0 "[ . 1 . 2]" 1
829 1 35 PHE HA 1 52 ILE MG 5.500 . 5.500 4.281 3.891 4.670 . 0 0 "[ . 1 . 2]" 1
830 1 35 PHE HA 1 79 THR MG 2.800 . 2.800 2.068 1.977 2.188 . 0 0 "[ . 1 . 2]" 1
831 1 35 PHE HA 1 79 THR MG 4.500 . 4.500 3.367 2.742 3.752 . 0 0 "[ . 1 . 2]" 1
832 1 35 PHE HB2 1 35 PHE QD 2.800 . 2.800 2.178 2.024 2.347 . 0 0 "[ . 1 . 2]" 1
833 1 35 PHE HB2 1 36 ARG H 4.500 . 4.500 4.208 3.990 4.454 . 0 0 "[ . 1 . 2]" 1
834 1 35 PHE HB2 1 52 ILE MD 3.500 . 3.500 2.429 2.014 3.126 . 0 0 "[ . 1 . 2]" 1
835 1 35 PHE HB2 1 52 ILE MD 2.800 . 2.800 1.928 1.735 2.185 0.065 10 0 "[ . 1 . 2]" 1
836 1 35 PHE HB2 1 52 ILE MG 4.500 . 4.500 2.718 2.292 3.329 . 0 0 "[ . 1 . 2]" 1
837 1 35 PHE HB2 1 54 GLU HA . . 2.800 2.555 1.999 2.805 0.005 5 0 "[ . 1 . 2]" 1
838 1 35 PHE HB3 1 35 PHE QD . . 2.800 2.480 2.288 2.683 . 0 0 "[ . 1 . 2]" 1
839 1 35 PHE HB3 1 36 ARG H 3.500 . 3.500 3.154 2.777 3.542 0.042 19 0 "[ . 1 . 2]" 1
840 1 35 PHE HB3 1 52 ILE MD . . 2.800 2.031 1.838 2.337 . 0 0 "[ . 1 . 2]" 1
841 1 35 PHE HB3 1 52 ILE MG 4.500 . 4.500 2.645 2.162 3.130 . 0 0 "[ . 1 . 2]" 1
842 1 35 PHE HB3 1 54 GLU HA 4.500 . 4.500 3.952 3.512 4.273 . 0 0 "[ . 1 . 2]" 1
843 1 35 PHE HB3 1 79 THR HA 5.500 . 5.500 4.672 4.316 5.001 . 0 0 "[ . 1 . 2]" 1
844 1 35 PHE QD 1 36 ARG H 3.500 . 3.500 3.545 3.505 3.605 0.105 6 0 "[ . 1 . 2]" 1
845 1 35 PHE QD 1 52 ILE MD 4.500 . 4.500 3.159 2.420 3.584 . 0 0 "[ . 1 . 2]" 1
846 1 35 PHE QD 1 54 GLU HA 4.500 . 4.500 3.802 3.268 4.474 . 0 0 "[ . 1 . 2]" 1
847 1 35 PHE QD 1 57 GLY H 3.500 . 3.500 3.116 2.609 3.511 0.011 1 0 "[ . 1 . 2]" 1
848 1 35 PHE QD 1 57 GLY QA 4.500 . 4.500 2.556 2.188 2.892 . 0 0 "[ . 1 . 2]" 1
849 1 35 PHE QD 1 77 VAL MG1 3.500 . 3.500 2.783 2.114 2.865 . 0 0 "[ . 1 . 2]" 1
850 1 35 PHE QD 1 77 VAL QG 2.800 . 2.800 2.770 2.110 2.852 0.052 19 0 "[ . 1 . 2]" 1
851 1 35 PHE QD 1 77 VAL MG2 5.500 . 5.500 5.072 4.515 5.231 . 0 0 "[ . 1 . 2]" 1
852 1 35 PHE QD 1 79 THR HA 4.500 . 4.500 3.198 2.756 3.829 . 0 0 "[ . 1 . 2]" 1
853 1 35 PHE QD 1 79 THR MG 3.500 . 3.500 3.065 2.465 3.286 . 0 0 "[ . 1 . 2]" 1
854 1 35 PHE QE 1 57 GLY H 5.500 . 5.500 4.465 3.719 5.195 . 0 0 "[ . 1 . 2]" 1
855 1 35 PHE QE 1 57 GLY QA 5.500 . 5.500 3.238 2.797 3.939 . 0 0 "[ . 1 . 2]" 1
856 1 35 PHE QE 1 79 THR MG 3.500 . 3.500 2.397 2.094 2.998 . 0 0 "[ . 1 . 2]" 1
857 1 36 ARG H 1 36 ARG QB 3.500 . 3.500 2.457 2.307 2.667 . 0 0 "[ . 1 . 2]" 1
858 1 36 ARG H 1 36 ARG QG 4.500 . 4.500 3.359 2.199 4.240 . 0 0 "[ . 1 . 2]" 1
859 1 36 ARG H 1 37 LEU H 4.500 . 4.500 4.410 4.265 4.506 0.006 5 0 "[ . 1 . 2]" 1
860 1 36 ARG H 1 52 ILE MD 4.500 . 4.500 4.286 3.810 4.548 0.048 2 0 "[ . 1 . 2]" 1
861 1 36 ARG H 1 77 VAL HA 5.500 . 5.500 4.463 4.154 4.669 . 0 0 "[ . 1 . 2]" 1
862 1 36 ARG H 1 77 VAL MG1 3.500 . 3.500 3.503 3.333 3.559 0.059 3 0 "[ . 1 . 2]" 1
863 1 36 ARG H 1 78 GLU QB 3.500 . 3.500 3.279 2.866 3.531 0.031 11 0 "[ . 1 . 2]" 1
864 1 36 ARG H 1 78 GLU O 1.900 . 2.300 1.739 1.699 1.784 0.101 6 0 "[ . 1 . 2]" 1
865 1 36 ARG H 1 80 THR MG 3.500 . 3.500 3.559 3.515 3.674 0.174 5 0 "[ . 1 . 2]" 1
866 1 36 ARG HA 1 36 ARG HB3 2.800 . 2.800 2.670 2.397 2.939 0.139 19 0 "[ . 1 . 2]" 1
867 1 36 ARG HA 1 37 LEU H 2.800 . 2.800 2.210 2.108 2.329 . 0 0 "[ . 1 . 2]" 1
868 1 36 ARG HA 1 52 ILE MG 3.500 . 3.500 3.114 2.503 3.471 . 0 0 "[ . 1 . 2]" 1
869 1 36 ARG HA 1 52 ILE MG 3.500 . 3.500 3.056 2.495 3.358 . 0 0 "[ . 1 . 2]" 1
870 1 36 ARG HA 1 80 THR MG 5.500 . 5.500 4.546 4.266 4.845 . 0 0 "[ . 1 . 2]" 1
871 1 36 ARG QB 1 36 ARG QD . . 2.800 2.388 1.946 2.885 0.085 20 0 "[ . 1 . 2]" 1
872 1 36 ARG QB 1 37 LEU H 3.500 . 3.500 3.142 2.639 3.514 0.014 20 0 "[ . 1 . 2]" 1
873 1 36 ARG QB 1 52 ILE MG 4.500 . 4.500 4.021 3.735 4.201 . 0 0 "[ . 1 . 2]" 1
874 1 36 ARG QB 1 78 GLU H 5.500 . 5.500 3.056 2.757 3.352 . 0 0 "[ . 1 . 2]" 1
875 1 36 ARG QB 1 78 GLU QB 4.500 . 4.500 2.114 1.882 2.763 . 0 0 "[ . 1 . 2]" 1
876 1 36 ARG QB 1 78 GLU QB 4.500 . 4.500 2.043 1.870 2.313 . 0 0 "[ . 1 . 2]" 1
877 1 36 ARG QB 1 78 GLU QG 5.500 . 5.500 3.348 2.115 3.967 . 0 0 "[ . 1 . 2]" 1
878 1 36 ARG QB 1 80 THR MG . . 3.500 2.602 2.102 3.442 . 0 0 "[ . 1 . 2]" 1
879 1 36 ARG HB2 1 38 THR MG 4.500 . 4.500 4.476 3.740 4.593 0.093 8 0 "[ . 1 . 2]" 1
880 1 36 ARG HB3 1 38 THR MG 3.500 . 3.500 3.247 3.022 3.514 0.014 5 0 "[ . 1 . 2]" 1
881 1 36 ARG QD 1 38 THR MG 4.500 . 4.500 4.013 3.033 4.520 0.020 1 0 "[ . 1 . 2]" 1
882 1 36 ARG QD 1 80 THR MG 4.500 . 4.500 3.123 2.232 4.109 . 0 0 "[ . 1 . 2]" 1
883 1 36 ARG QG 1 37 LEU H 4.500 . 4.500 3.827 2.215 4.549 0.049 1 0 "[ . 1 . 2]" 1
884 1 36 ARG QG 1 80 THR MG 5.500 . 5.500 2.340 1.785 4.224 0.015 5 0 "[ . 1 . 2]" 1
885 1 36 ARG N 1 78 GLU O 2.800 2.700 3.300 2.687 2.651 2.764 0.049 20 0 "[ . 1 . 2]" 1
886 1 36 ARG O 1 78 GLU H 1.900 . 2.300 1.885 1.764 2.105 0.036 3 0 "[ . 1 . 2]" 1
887 1 36 ARG O 1 78 GLU N 2.800 2.700 3.300 2.775 2.680 2.995 0.020 13 0 "[ . 1 . 2]" 1
888 1 37 LEU H 1 37 LEU HB2 3.500 . 3.500 2.941 2.730 3.152 . 0 0 "[ . 1 . 2]" 1
889 1 37 LEU H 1 37 LEU HB2 3.500 . 3.500 2.750 2.482 2.963 . 0 0 "[ . 1 . 2]" 1
890 1 37 LEU H 1 37 LEU HB3 3.500 . 3.500 2.690 2.512 2.813 . 0 0 "[ . 1 . 2]" 1
891 1 37 LEU H 1 37 LEU HB3 3.500 . 3.500 2.520 2.358 2.670 . 0 0 "[ . 1 . 2]" 1
892 1 37 LEU H 1 37 LEU MD1 3.500 . 3.500 2.755 2.368 3.096 . 0 0 "[ . 1 . 2]" 1
893 1 37 LEU H 1 37 LEU MD2 4.500 . 4.500 4.503 4.416 4.576 0.076 1 0 "[ . 1 . 2]" 1
894 1 37 LEU H 1 38 THR H 5.500 . 5.500 4.388 4.206 4.475 . 0 0 "[ . 1 . 2]" 1
895 1 37 LEU H 1 38 THR H 3.500 . 3.500 2.471 2.294 2.658 . 0 0 "[ . 1 . 2]" 1
896 1 37 LEU H 1 52 ILE MG 2.800 . 2.800 2.126 1.848 2.359 . 0 0 "[ . 1 . 2]" 1
897 1 37 LEU HA 1 37 LEU MD1 2.800 . 2.800 2.044 1.943 2.153 . 0 0 "[ . 1 . 2]" 1
898 1 37 LEU HA 1 37 LEU MD2 4.500 . 4.500 3.837 3.801 3.880 . 0 0 "[ . 1 . 2]" 1
899 1 37 LEU HA 1 37 LEU HG 3.500 . 3.500 2.874 2.777 3.106 . 0 0 "[ . 1 . 2]" 1
900 1 37 LEU HA 1 38 THR H 2.800 . 2.800 2.247 2.197 2.366 . 0 0 "[ . 1 . 2]" 1
901 1 37 LEU HA 1 38 THR MG 5.500 . 5.500 4.029 3.808 4.345 . 0 0 "[ . 1 . 2]" 1
902 1 37 LEU HA 1 52 ILE HB 4.500 . 4.500 4.456 4.240 4.526 0.026 14 0 "[ . 1 . 2]" 1
903 1 37 LEU HA 1 52 ILE MD 5.500 . 5.500 4.118 3.562 4.371 . 0 0 "[ . 1 . 2]" 1
904 1 37 LEU HA 1 52 ILE MG 5.500 . 5.500 3.609 3.434 3.792 . 0 0 "[ . 1 . 2]" 1
905 1 37 LEU HA 1 77 VAL HA . . 3.500 2.339 2.145 2.583 . 0 0 "[ . 1 . 2]" 1
906 1 37 LEU HA 1 77 VAL MG1 4.500 . 4.500 2.769 2.493 3.066 . 0 0 "[ . 1 . 2]" 1
907 1 37 LEU HB2 1 37 LEU MD1 2.800 . 2.800 2.329 2.252 2.400 . 0 0 "[ . 1 . 2]" 1
908 1 37 LEU HB2 1 37 LEU MD1 2.800 . 2.800 2.250 2.199 2.306 . 0 0 "[ . 1 . 2]" 1
909 1 37 LEU HB2 1 37 LEU MD2 . . 2.800 2.481 2.401 2.566 . 0 0 "[ . 1 . 2]" 1
910 1 37 LEU HB2 1 38 THR H 3.500 . 3.500 3.293 3.180 3.440 . 0 0 "[ . 1 . 2]" 1
911 1 37 LEU HB2 1 42 VAL MG1 5.500 . 5.500 3.745 3.543 4.070 . 0 0 "[ . 1 . 2]" 1
912 1 37 LEU HB2 1 52 ILE H 4.500 . 4.500 3.297 2.624 3.925 . 0 0 "[ . 1 . 2]" 1
913 1 37 LEU HB2 1 52 ILE HB . . 3.500 2.045 1.937 2.194 . 0 0 "[ . 1 . 2]" 1
914 1 37 LEU HB2 1 52 ILE MD 4.500 . 4.500 2.946 2.249 3.390 . 0 0 "[ . 1 . 2]" 1
915 1 37 LEU HB2 1 52 ILE MG 2.800 . 2.800 2.067 1.967 2.218 . 0 0 "[ . 1 . 2]" 1
916 1 37 LEU HB3 1 37 LEU MD1 3.500 . 3.500 3.227 3.195 3.245 . 0 0 "[ . 1 . 2]" 1
917 1 37 LEU HB3 1 37 LEU MD2 2.800 . 2.800 2.264 2.207 2.321 . 0 0 "[ . 1 . 2]" 1
918 1 37 LEU HB3 1 38 THR H 4.500 . 4.500 3.897 3.572 4.122 . 0 0 "[ . 1 . 2]" 1
919 1 37 LEU HB3 1 42 VAL MG1 . . 3.500 2.240 1.944 2.655 . 0 0 "[ . 1 . 2]" 1
920 1 37 LEU HB3 1 52 ILE H 5.500 . 5.500 3.110 2.637 3.770 . 0 0 "[ . 1 . 2]" 1
921 1 37 LEU HB3 1 52 ILE HB 4.500 . 4.500 3.138 2.680 3.651 . 0 0 "[ . 1 . 2]" 1
922 1 37 LEU HB3 1 52 ILE MD 5.500 . 5.500 4.440 3.691 4.898 . 0 0 "[ . 1 . 2]" 1
923 1 37 LEU HB3 1 52 ILE MD 4.500 . 4.500 3.973 3.589 4.157 . 0 0 "[ . 1 . 2]" 1
924 1 37 LEU HB3 1 52 ILE MG 3.500 . 3.500 2.880 2.449 3.250 . 0 0 "[ . 1 . 2]" 1
925 1 37 LEU MD1 1 37 LEU MD2 2.800 . 2.800 2.070 2.047 2.080 . 0 0 "[ . 1 . 2]" 1
926 1 37 LEU MD1 1 37 LEU MD2 2.800 . 2.800 1.809 1.786 1.833 0.014 17 0 "[ . 1 . 2]" 1
927 1 37 LEU MD1 1 38 THR H 2.800 . 2.800 2.534 2.165 2.847 0.047 3 0 "[ . 1 . 2]" 1
928 1 37 LEU MD1 1 50 PHE HB2 2.800 . 2.800 1.981 1.829 2.184 . 0 0 "[ . 1 . 2]" 1
929 1 37 LEU MD1 1 51 ARG HA 4.500 . 4.500 3.647 3.232 4.066 . 0 0 "[ . 1 . 2]" 1
930 1 37 LEU MD1 1 75 LEU HA 5.500 . 5.500 3.510 3.327 3.747 . 0 0 "[ . 1 . 2]" 1
931 1 37 LEU MD1 1 75 LEU HB2 4.500 . 4.500 2.711 2.294 2.789 . 0 0 "[ . 1 . 2]" 1
932 1 37 LEU MD1 1 75 LEU HB3 4.500 . 4.500 2.122 1.979 2.256 . 0 0 "[ . 1 . 2]" 1
933 1 37 LEU MD1 1 75 LEU MD2 2.800 . 2.800 2.819 2.708 2.888 0.088 16 0 "[ . 1 . 2]" 1
934 1 37 LEU MD1 1 75 LEU HG 5.500 . 5.500 1.935 1.866 2.034 . 0 0 "[ . 1 . 2]" 1
935 1 37 LEU MD1 1 75 LEU HB2 2.800 . 2.800 2.753 2.312 2.837 0.037 4 0 "[ . 1 . 2]" 1
936 1 37 LEU MD1 1 75 LEU MD2 3.500 . 3.500 3.244 3.116 3.369 . 0 0 "[ . 1 . 2]" 1
937 1 37 LEU MD1 1 76 PHE H 3.500 . 3.500 3.219 2.922 3.426 . 0 0 "[ . 1 . 2]" 1
938 1 37 LEU MD1 1 77 VAL H 4.500 . 4.500 3.946 3.732 4.430 . 0 0 "[ . 1 . 2]" 1
939 1 37 LEU MD1 1 77 VAL HA 3.500 . 3.500 2.705 2.356 3.283 . 0 0 "[ . 1 . 2]" 1
940 1 37 LEU MD1 1 93 LEU MD2 2.800 . 2.800 1.995 1.855 2.147 . 0 0 "[ . 1 . 2]" 1
941 1 37 LEU MD2 1 38 THR H 4.500 . 4.500 4.123 3.772 4.368 . 0 0 "[ . 1 . 2]" 1
942 1 37 LEU MD2 1 42 VAL MG1 . . 2.800 2.617 2.386 2.834 0.034 14 0 "[ . 1 . 2]" 1
943 1 37 LEU MD2 1 42 VAL MG2 2.800 . 2.800 1.791 1.760 1.849 0.040 1 0 "[ . 1 . 2]" 1
944 1 37 LEU MD2 1 50 PHE HA 4.500 . 4.500 3.763 3.609 4.069 . 0 0 "[ . 1 . 2]" 1
945 1 37 LEU MD2 1 50 PHE HB2 4.500 . 4.500 2.803 2.547 3.076 . 0 0 "[ . 1 . 2]" 1
946 1 37 LEU MD2 1 50 PHE HB2 3.500 . 3.500 2.763 2.528 3.013 . 0 0 "[ . 1 . 2]" 1
947 1 37 LEU MD2 1 50 PHE HB3 4.500 . 4.500 2.365 2.147 2.605 . 0 0 "[ . 1 . 2]" 1
948 1 37 LEU MD2 1 50 PHE HB3 3.500 . 3.500 2.253 2.097 2.424 . 0 0 "[ . 1 . 2]" 1
949 1 37 LEU MD2 1 51 ARG H 3.500 . 3.500 3.130 2.779 3.346 . 0 0 "[ . 1 . 2]" 1
950 1 37 LEU MD2 1 51 ARG HA . . 3.500 2.846 2.201 3.505 0.005 16 0 "[ . 1 . 2]" 1
951 1 37 LEU MD2 1 52 ILE H 3.500 . 3.500 3.150 2.469 3.540 0.040 19 0 "[ . 1 . 2]" 1
952 1 37 LEU MD2 1 52 ILE HB 2.800 . 2.800 2.177 2.016 2.537 . 0 0 "[ . 1 . 2]" 1
953 1 37 LEU MD2 1 52 ILE HB 2.800 . 2.800 2.207 2.032 2.542 . 0 0 "[ . 1 . 2]" 1
954 1 37 LEU MD2 1 75 LEU MD2 3.500 . 3.500 2.990 2.350 3.514 0.014 19 0 "[ . 1 . 2]" 1
955 1 37 LEU HG 1 38 THR H 3.500 . 3.500 2.465 2.011 2.860 . 0 0 "[ . 1 . 2]" 1
956 1 37 LEU HG 1 42 VAL MG1 . . 3.500 2.607 2.153 3.264 . 0 0 "[ . 1 . 2]" 1
957 1 37 LEU HG 1 42 VAL MG2 2.800 . 2.800 1.970 1.890 2.206 . 0 0 "[ . 1 . 2]" 1
958 1 37 LEU HG 1 52 ILE HB 5.500 . 5.500 4.382 4.180 4.708 . 0 0 "[ . 1 . 2]" 1
959 1 37 LEU HG 1 52 ILE MD 5.500 . 5.500 5.159 4.595 5.434 . 0 0 "[ . 1 . 2]" 1
960 1 38 THR H 1 42 VAL MG1 4.500 . 4.500 3.564 3.303 4.092 . 0 0 "[ . 1 . 2]" 1
961 1 38 THR H 1 75 LEU HA 5.500 . 5.500 4.359 4.077 4.640 . 0 0 "[ . 1 . 2]" 1
962 1 38 THR H 1 75 LEU QB 5.500 . 5.500 3.194 2.981 3.740 . 0 0 "[ . 1 . 2]" 1
963 1 38 THR H 1 76 PHE H 3.500 . 3.500 2.486 2.301 2.688 . 0 0 "[ . 1 . 2]" 1
964 1 38 THR H 1 76 PHE O 1.900 . 2.300 1.858 1.733 2.007 0.067 3 0 "[ . 1 . 2]" 1
965 1 38 THR HA 1 38 THR HB 2.800 . 2.800 2.645 2.579 2.730 . 0 0 "[ . 1 . 2]" 1
966 1 38 THR HA 1 38 THR MG 2.800 . 2.800 2.143 2.073 2.218 . 0 0 "[ . 1 . 2]" 1
967 1 38 THR HA 1 39 GLY H 2.800 . 2.800 2.545 2.471 2.606 . 0 0 "[ . 1 . 2]" 1
968 1 38 THR HA 1 42 VAL HB . . 3.500 2.389 2.172 2.648 . 0 0 "[ . 1 . 2]" 1
969 1 38 THR HA 1 42 VAL MG1 2.800 . 2.800 2.456 2.069 2.804 0.004 15 0 "[ . 1 . 2]" 1
970 1 38 THR HA 1 42 VAL MG1 3.500 . 3.500 2.418 2.060 2.723 . 0 0 "[ . 1 . 2]" 1
971 1 38 THR HA 1 42 VAL MG2 4.500 . 4.500 3.521 3.182 3.888 . 0 0 "[ . 1 . 2]" 1
972 1 38 THR HA 1 44 GLN H 3.500 . 3.500 3.279 3.222 3.378 . 0 0 "[ . 1 . 2]" 1
973 1 38 THR HA 1 44 GLN QE 5.500 . 5.500 4.671 3.824 5.534 0.034 1 0 "[ . 1 . 2]" 1
974 1 38 THR HB 1 39 GLY H 2.800 . 2.800 2.467 2.392 2.589 . 0 0 "[ . 1 . 2]" 1
975 1 38 THR HB 1 42 VAL MG2 5.500 . 5.500 5.305 5.036 5.549 0.049 6 0 "[ . 1 . 2]" 1
976 1 38 THR HB 1 43 ASP H 4.500 . 4.500 4.373 4.107 4.517 0.017 9 0 "[ . 1 . 2]" 1
977 1 38 THR HB 1 44 GLN H 5.500 . 5.500 5.349 4.956 5.561 0.061 14 0 "[ . 1 . 2]" 1
978 1 38 THR HB 1 44 GLN QE 4.500 . 4.500 3.287 2.535 4.518 0.018 16 0 "[ . 1 . 2]" 1
979 1 38 THR MG 1 39 GLY H 3.500 . 3.500 3.434 3.147 3.523 0.023 20 0 "[ . 1 . 2]" 1
980 1 38 THR MG 1 43 ASP H 5.500 . 5.500 3.696 3.406 3.945 . 0 0 "[ . 1 . 2]" 1
981 1 38 THR N 1 76 PHE O 2.800 2.700 3.300 2.661 2.595 2.702 0.105 6 0 "[ . 1 . 2]" 1
982 1 38 THR O 1 76 PHE H 1.900 . 2.300 1.720 1.683 1.762 0.117 5 0 "[ . 1 . 2]" 1
983 1 38 THR O 1 76 PHE N 2.800 2.700 3.300 2.623 2.565 2.653 0.135 7 0 "[ . 1 . 2]" 1
984 1 39 GLY H 1 40 LYS H 4.500 . 4.500 4.382 4.272 4.482 . 0 0 "[ . 1 . 2]" 1
985 1 39 GLY H 1 42 VAL H . . 4.500 4.200 3.968 4.437 . 0 0 "[ . 1 . 2]" 1
986 1 39 GLY H 1 42 VAL HB 4.500 . 4.500 3.075 2.732 3.363 . 0 0 "[ . 1 . 2]" 1
987 1 39 GLY H 1 42 VAL MG1 4.500 . 4.500 4.153 3.811 4.489 . 0 0 "[ . 1 . 2]" 1
988 1 39 GLY H 1 42 VAL MG2 4.500 . 4.500 4.255 3.929 4.526 0.026 6 0 "[ . 1 . 2]" 1
989 1 39 GLY H 1 43 ASP H 3.500 . 3.500 2.723 2.347 2.987 . 0 0 "[ . 1 . 2]" 1
990 1 39 GLY H 1 44 GLN H 5.500 . 5.500 3.083 2.816 3.317 . 0 0 "[ . 1 . 2]" 1
991 1 39 GLY H 1 44 GLN QE . . 4.500 2.900 2.101 3.708 . 0 0 "[ . 1 . 2]" 1
992 1 39 GLY H 1 75 LEU MD1 5.500 . 5.500 4.079 3.812 4.257 . 0 0 "[ . 1 . 2]" 1
993 1 39 GLY QA 1 40 LYS H . . 2.800 2.258 2.215 2.290 . 0 0 "[ . 1 . 2]" 1
994 1 39 GLY QA 1 40 LYS H 2.800 . 2.800 2.176 2.140 2.200 . 0 0 "[ . 1 . 2]" 1
995 1 39 GLY QA 1 44 GLN H 3.500 . 3.500 3.269 3.039 3.406 . 0 0 "[ . 1 . 2]" 1
996 1 39 GLY QA 1 43 ASP H 5.500 . 5.500 4.301 3.983 4.538 . 0 0 "[ . 1 . 2]" 1
997 1 39 GLY QA 1 44 GLN QE 4.500 . 4.500 2.977 1.832 4.462 . 0 0 "[ . 1 . 2]" 1
998 1 39 GLY QA 1 44 GLN QG 4.500 . 4.500 3.225 1.956 4.113 . 0 0 "[ . 1 . 2]" 1
999 1 39 GLY QA 1 75 LEU HA 4.500 . 4.500 2.045 1.856 2.253 . 0 0 "[ . 1 . 2]" 1
1000 1 39 GLY QA 1 75 LEU MD1 3.500 . 3.500 2.327 2.073 2.576 . 0 0 "[ . 1 . 2]" 1
1001 1 39 GLY QA 1 76 PHE QD 3.500 . 3.500 2.323 2.093 2.595 . 0 0 "[ . 1 . 2]" 1
1002 1 39 GLY QA 1 76 PHE QD 5.500 . 5.500 2.534 2.140 2.876 . 0 0 "[ . 1 . 2]" 1
1003 1 39 GLY QA 1 76 PHE QD 5.500 . 5.500 2.510 2.136 2.816 . 0 0 "[ . 1 . 2]" 1
1004 1 40 LYS H 1 40 LYS QB 3.500 . 3.500 2.562 1.912 3.007 . 0 0 "[ . 1 . 2]" 1
1005 1 40 LYS H 1 40 LYS QD 4.500 . 4.500 3.817 3.017 4.292 . 0 0 "[ . 1 . 2]" 1
1006 1 40 LYS H 1 40 LYS QG 3.500 . 3.500 2.138 1.788 3.537 0.037 9 0 "[ . 1 . 2]" 1
1007 1 40 LYS H 1 75 LEU HA 5.500 . 5.500 4.030 3.721 4.455 . 0 0 "[ . 1 . 2]" 1
1008 1 40 LYS H 1 75 LEU MD1 5.500 . 5.500 3.351 3.164 3.517 . 0 0 "[ . 1 . 2]" 1
1009 1 40 LYS HA 1 40 LYS QB 2.800 . 2.800 2.309 2.174 2.415 . 0 0 "[ . 1 . 2]" 1
1010 1 40 LYS HA 1 40 LYS QG . . 3.500 2.717 2.315 3.362 . 0 0 "[ . 1 . 2]" 1
1011 1 40 LYS HA 1 40 LYS QG 2.800 . 2.800 2.044 1.838 2.309 . 0 0 "[ . 1 . 2]" 1
1012 1 40 LYS HA 1 41 GLY H 2.800 . 2.800 2.179 2.116 2.228 . 0 0 "[ . 1 . 2]" 1
1013 1 40 LYS HA 1 42 VAL H 3.500 . 3.500 3.457 3.344 3.535 0.035 7 0 "[ . 1 . 2]" 1
1014 1 40 LYS HA 1 43 ASP H 5.500 . 5.500 5.363 5.020 5.534 0.034 14 0 "[ . 1 . 2]" 1
1015 1 40 LYS HA 1 44 GLN HB2 2.800 . 2.800 2.146 1.923 2.388 . 0 0 "[ . 1 . 2]" 1
1016 1 40 LYS HA 1 44 GLN HB3 4.500 . 4.500 3.213 2.974 3.469 . 0 0 "[ . 1 . 2]" 1
1017 1 40 LYS HA 1 46 PRO QD . . 4.500 3.429 3.247 3.640 . 0 0 "[ . 1 . 2]" 1
1018 1 40 LYS QB 1 40 LYS QE . . 3.500 2.432 2.030 3.259 . 0 0 "[ . 1 . 2]" 1
1019 1 40 LYS QB 1 44 GLN HB2 4.500 . 4.500 3.716 3.242 4.146 . 0 0 "[ . 1 . 2]" 1
1020 1 40 LYS QB 1 46 PRO QD 4.500 . 4.500 2.376 2.035 3.696 . 0 0 "[ . 1 . 2]" 1
1021 1 40 LYS QB 1 74 GLN H 5.500 . 5.500 3.681 2.783 4.945 . 0 0 "[ . 1 . 2]" 1
1022 1 40 LYS HB2 1 41 GLY H 4.500 . 4.500 4.122 3.488 4.400 . 0 0 "[ . 1 . 2]" 1
1023 1 40 LYS HB2 1 74 GLN H 2.800 . 2.800 2.530 2.009 2.827 0.027 1 0 "[ . 1 . 2]" 1
1024 1 40 LYS HB3 1 41 GLY H 4.500 . 4.500 3.851 3.504 4.579 0.079 9 0 "[ . 1 . 2]" 1
1025 1 40 LYS QD 1 46 PRO QD 4.500 . 4.500 4.038 3.164 4.542 0.042 17 0 "[ . 1 . 2]" 1
1026 1 40 LYS QD 1 70 ILE MD 5.500 . 5.500 3.278 2.149 4.580 . 0 0 "[ . 1 . 2]" 1
1027 1 40 LYS QD 1 74 GLN QE 4.500 . 4.500 3.441 2.249 4.521 0.021 17 0 "[ . 1 . 2]" 1
1028 1 40 LYS QE 1 40 LYS QG . . 2.800 2.626 2.068 2.914 0.114 5 0 "[ . 1 . 2]" 1
1029 1 40 LYS QE 1 70 ILE MD 3.500 . 3.500 2.684 1.892 3.453 . 0 0 "[ . 1 . 2]" 1
1030 1 40 LYS QG 1 41 GLY H 5.500 . 5.500 4.343 3.451 4.675 . 0 0 "[ . 1 . 2]" 1
1031 1 40 LYS QG 1 41 GLY H 3.500 . 3.500 3.430 3.124 3.524 0.024 5 0 "[ . 1 . 2]" 1
1032 1 40 LYS QG 1 44 GLN QB 4.500 . 4.500 3.006 2.127 4.297 . 0 0 "[ . 1 . 2]" 1
1033 1 40 LYS QG 1 46 PRO QD . . 4.500 3.915 1.901 4.467 . 0 0 "[ . 1 . 2]" 1
1034 1 41 GLY H 1 42 VAL H . . 2.800 2.234 1.997 2.464 . 0 0 "[ . 1 . 2]" 1
1035 1 41 GLY H 1 42 VAL HA 5.500 . 5.500 4.621 4.472 4.774 . 0 0 "[ . 1 . 2]" 1
1036 1 41 GLY H 1 43 ASP H 5.500 . 5.500 4.809 4.513 5.158 . 0 0 "[ . 1 . 2]" 1
1037 1 41 GLY H 1 44 GLN H 3.500 . 3.500 3.377 3.217 3.533 0.033 19 0 "[ . 1 . 2]" 1
1038 1 41 GLY H 1 45 GLU H . . 4.500 4.561 4.492 4.612 0.112 4 0 "[ . 1 . 2]" 1
1039 1 41 GLY H 1 46 PRO QD 4.500 . 4.500 2.989 2.666 3.539 . 0 0 "[ . 1 . 2]" 1
1040 1 41 GLY H 1 46 PRO QG 4.500 . 4.500 4.130 3.549 4.546 0.046 9 0 "[ . 1 . 2]" 1
1041 1 41 GLY H 1 47 LYS QG 4.500 . 4.500 4.225 3.765 4.540 0.040 18 0 "[ . 1 . 2]" 1
1042 1 41 GLY H 1 49 ILE HG12 4.500 . 4.500 4.417 4.190 4.522 0.022 7 0 "[ . 1 . 2]" 1
1043 1 41 GLY QA 1 42 VAL H 3.500 . 3.500 2.858 2.802 2.894 . 0 0 "[ . 1 . 2]" 1
1044 1 41 GLY QA 1 42 VAL HA 4.500 . 4.500 4.033 3.995 4.058 . 0 0 "[ . 1 . 2]" 1
1045 1 41 GLY QA 1 46 PRO HB2 5.500 . 5.500 3.289 3.018 3.676 . 0 0 "[ . 1 . 2]" 1
1046 1 41 GLY QA 1 46 PRO QD 5.500 . 5.500 2.696 2.146 3.386 . 0 0 "[ . 1 . 2]" 1
1047 1 41 GLY QA 1 47 LYS HA 5.500 . 5.500 3.268 2.930 3.571 . 0 0 "[ . 1 . 2]" 1
1048 1 41 GLY QA 1 46 PRO HB3 5.500 . 5.500 4.689 4.526 5.089 . 0 0 "[ . 1 . 2]" 1
1049 1 41 GLY QA 1 46 PRO QG 4.500 . 4.500 2.768 2.061 3.410 . 0 0 "[ . 1 . 2]" 1
1050 1 41 GLY QA 1 49 ILE H 5.500 . 5.500 3.181 3.003 3.602 . 0 0 "[ . 1 . 2]" 1
1051 1 41 GLY QA 1 49 ILE HB 4.500 . 4.500 2.326 2.142 2.532 . 0 0 "[ . 1 . 2]" 1
1052 1 41 GLY QA 1 49 ILE MD 4.500 . 4.500 3.698 3.552 3.965 . 0 0 "[ . 1 . 2]" 1
1053 1 41 GLY QA 1 49 ILE MD 4.500 . 4.500 2.515 2.280 2.787 . 0 0 "[ . 1 . 2]" 1
1054 1 41 GLY QA 1 49 ILE HG13 5.500 . 5.500 2.129 1.899 2.510 . 0 0 "[ . 1 . 2]" 1
1055 1 41 GLY QA 1 50 PHE QD . . 4.500 2.407 2.088 2.834 . 0 0 "[ . 1 . 2]" 1
1056 1 41 GLY QA 1 73 TYR QD . . 3.500 2.354 1.984 2.740 . 0 0 "[ . 1 . 2]" 1
1057 1 41 GLY QA 1 73 TYR QE 3.500 . 3.500 3.147 2.664 3.511 0.011 7 0 "[ . 1 . 2]" 1
1058 1 41 GLY QA 1 75 LEU MD1 5.500 . 5.500 2.563 2.305 2.886 . 0 0 "[ . 1 . 2]" 1
1059 1 42 VAL H 1 42 VAL HB 3.500 . 3.500 2.692 2.584 2.818 . 0 0 "[ . 1 . 2]" 1
1060 1 42 VAL H 1 42 VAL MG1 4.500 . 4.500 3.898 3.846 3.946 . 0 0 "[ . 1 . 2]" 1
1061 1 42 VAL H 1 42 VAL MG1 4.500 . 4.500 3.579 3.450 3.709 . 0 0 "[ . 1 . 2]" 1
1062 1 42 VAL H 1 42 VAL MG2 2.800 . 2.800 2.587 2.401 2.733 . 0 0 "[ . 1 . 2]" 1
1063 1 42 VAL H 1 43 ASP H 3.500 . 3.500 3.042 2.776 3.274 . 0 0 "[ . 1 . 2]" 1
1064 1 42 VAL H 1 44 GLN H 3.500 . 3.500 2.682 2.454 2.855 . 0 0 "[ . 1 . 2]" 1
1065 1 42 VAL H 1 44 GLN HB2 4.500 . 4.500 4.101 3.793 4.302 . 0 0 "[ . 1 . 2]" 1
1066 1 42 VAL H 1 47 LYS HA 5.500 . 5.500 3.773 3.424 4.140 . 0 0 "[ . 1 . 2]" 1
1067 1 42 VAL H 1 47 LYS HA 2.800 . 2.800 2.228 2.139 2.369 . 0 0 "[ . 1 . 2]" 1
1068 1 42 VAL H 1 50 PHE H 4.500 . 4.500 3.940 3.768 4.072 . 0 0 "[ . 1 . 2]" 1
1069 1 42 VAL H 1 75 LEU MD1 3.500 . 3.500 3.044 2.924 3.186 . 0 0 "[ . 1 . 2]" 1
1070 1 42 VAL HA 1 42 VAL MG1 2.800 . 2.800 2.274 2.189 2.437 . 0 0 "[ . 1 . 2]" 1
1071 1 42 VAL HA 1 42 VAL MG2 . . 2.800 2.489 2.394 2.565 . 0 0 "[ . 1 . 2]" 1
1072 1 42 VAL HA 1 43 ASP H 5.500 . 5.500 3.505 3.449 3.554 . 0 0 "[ . 1 . 2]" 1
1073 1 42 VAL HA 1 48 GLY H 3.500 . 3.500 2.922 2.477 3.287 . 0 0 "[ . 1 . 2]" 1
1074 1 42 VAL HA 1 49 ILE H 5.500 . 5.500 3.079 2.816 3.469 . 0 0 "[ . 1 . 2]" 1
1075 1 42 VAL HA 1 50 PHE H 4.500 . 4.500 2.886 2.669 3.218 . 0 0 "[ . 1 . 2]" 1
1076 1 42 VAL HB 1 43 ASP H 2.800 . 2.800 1.778 1.743 1.790 0.057 6 0 "[ . 1 . 2]" 1
1077 1 42 VAL HB 1 44 GLN H 3.500 . 3.500 3.398 3.248 3.528 0.028 7 0 "[ . 1 . 2]" 1
1078 1 42 VAL MG1 1 42 VAL MG2 2.800 . 2.800 2.040 1.959 2.059 . 0 0 "[ . 1 . 2]" 1
1079 1 42 VAL MG1 1 43 ASP H 2.800 . 2.800 2.446 2.186 2.817 0.017 19 0 "[ . 1 . 2]" 1
1080 1 42 VAL MG1 1 43 ASP HA 5.500 . 5.500 3.735 3.533 4.006 . 0 0 "[ . 1 . 2]" 1
1081 1 42 VAL MG1 1 43 ASP HB2 4.500 . 4.500 3.266 2.817 4.503 0.003 7 0 "[ . 1 . 2]" 1
1082 1 42 VAL MG1 1 43 ASP HB3 5.500 . 5.500 4.086 2.974 4.808 . 0 0 "[ . 1 . 2]" 1
1083 1 42 VAL MG1 1 44 GLN H 4.500 . 4.500 4.332 4.186 4.526 0.026 19 0 "[ . 1 . 2]" 1
1084 1 42 VAL MG1 1 44 GLN H 5.500 . 5.500 3.779 3.690 3.839 . 0 0 "[ . 1 . 2]" 1
1085 1 42 VAL MG1 1 48 GLY H 4.500 . 4.500 4.188 3.815 4.537 0.037 6 0 "[ . 1 . 2]" 1
1086 1 42 VAL MG1 1 49 ILE H 5.500 . 5.500 4.806 4.531 5.218 . 0 0 "[ . 1 . 2]" 1
1087 1 42 VAL MG1 1 50 PHE H 4.500 . 4.500 4.179 3.940 4.448 . 0 0 "[ . 1 . 2]" 1
1088 1 42 VAL MG1 1 50 PHE HB3 5.500 . 5.500 4.449 3.805 4.981 . 0 0 "[ . 1 . 2]" 1
1089 1 42 VAL MG1 1 51 ARG HA 4.500 . 4.500 3.037 2.690 3.544 . 0 0 "[ . 1 . 2]" 1
1090 1 42 VAL MG2 1 43 ASP H 3.500 . 3.500 3.513 3.474 3.527 0.027 13 0 "[ . 1 . 2]" 1
1091 1 42 VAL MG2 1 49 ILE H 4.500 . 4.500 4.251 3.867 4.534 0.034 19 0 "[ . 1 . 2]" 1
1092 1 42 VAL MG2 1 50 PHE H 3.500 . 3.500 3.070 2.737 3.325 . 0 0 "[ . 1 . 2]" 1
1093 1 42 VAL MG2 1 50 PHE HA 5.500 . 5.500 4.150 3.915 4.289 . 0 0 "[ . 1 . 2]" 1
1094 1 42 VAL MG2 1 50 PHE HB2 2.800 . 2.800 1.982 1.831 2.187 . 0 0 "[ . 1 . 2]" 1
1095 1 42 VAL MG2 1 50 PHE HB3 . . 3.500 2.894 2.635 3.208 . 0 0 "[ . 1 . 2]" 1
1096 1 42 VAL MG2 1 50 PHE QD 3.500 . 3.500 3.178 2.611 3.530 0.030 11 0 "[ . 1 . 2]" 1
1097 1 42 VAL MG2 1 50 PHE QE 5.500 . 5.500 5.016 4.536 5.293 . 0 0 "[ . 1 . 2]" 1
1098 1 42 VAL MG2 1 51 ARG H 4.500 . 4.500 4.330 3.940 4.526 0.026 2 0 "[ . 1 . 2]" 1
1099 1 42 VAL MG2 1 75 LEU MD2 3.500 . 3.500 3.103 2.911 3.252 . 0 0 "[ . 1 . 2]" 1
1100 1 43 ASP H 1 44 GLN H 3.500 . 3.500 2.269 2.068 2.632 . 0 0 "[ . 1 . 2]" 1
1101 1 43 ASP H 1 75 LEU MD1 5.500 . 5.500 4.453 4.224 4.789 . 0 0 "[ . 1 . 2]" 1
1102 1 43 ASP HA 1 43 ASP HB2 2.800 . 2.800 2.669 2.313 2.900 0.100 14 0 "[ . 1 . 2]" 1
1103 1 43 ASP HA 1 43 ASP HB3 2.800 . 2.800 2.847 2.517 2.960 0.160 1 0 "[ . 1 . 2]" 1
1104 1 43 ASP HA 1 46 PRO HA 2.800 . 2.800 2.174 1.961 2.515 . 0 0 "[ . 1 . 2]" 1
1105 1 43 ASP HA 1 47 LYS HA 5.500 . 5.500 4.048 3.617 5.336 . 0 0 "[ . 1 . 2]" 1
1106 1 43 ASP HA 1 47 LYS HB2 4.500 . 4.500 4.049 2.645 4.412 . 0 0 "[ . 1 . 2]" 1
1107 1 43 ASP HA 1 47 LYS HB3 5.500 . 5.500 4.168 3.718 5.185 . 0 0 "[ . 1 . 2]" 1
1108 1 43 ASP HA 1 47 LYS QD 4.500 . 4.500 4.208 2.649 4.523 0.023 2 0 "[ . 1 . 2]" 1
1109 1 43 ASP HA 1 47 LYS QE . . 3.500 2.999 2.152 3.563 0.063 3 0 "[ . 1 . 2]" 1
1110 1 43 ASP HA 1 47 LYS QG . . 4.500 2.868 2.099 3.681 . 0 0 "[ . 1 . 2]" 1
1111 1 43 ASP HA 1 48 GLY H 5.500 . 5.500 3.907 3.455 5.439 . 0 0 "[ . 1 . 2]" 1
1112 1 43 ASP HB2 1 44 GLN H 4.500 . 4.500 3.932 3.300 4.464 . 0 0 "[ . 1 . 2]" 1
1113 1 43 ASP HB3 1 44 GLN H 5.500 . 5.500 3.501 3.155 4.159 . 0 0 "[ . 1 . 2]" 1
1114 1 44 GLN H 1 44 GLN HB2 2.800 . 2.800 2.706 2.477 2.844 0.044 16 0 "[ . 1 . 2]" 1
1115 1 44 GLN H 1 44 GLN HB3 3.500 . 3.500 2.803 2.255 3.226 . 0 0 "[ . 1 . 2]" 1
1116 1 44 GLN H 1 44 GLN QG 3.500 . 3.500 2.941 2.273 3.580 0.080 3 0 "[ . 1 . 2]" 1
1117 1 44 GLN H 1 47 LYS QG . . 3.500 3.412 3.212 3.563 0.063 16 0 "[ . 1 . 2]" 1
1118 1 44 GLN HA 1 44 GLN QG . . 3.500 2.567 2.270 3.208 . 0 0 "[ . 1 . 2]" 1
1119 1 44 GLN HA 1 45 GLU H 2.800 . 2.800 2.246 2.139 2.321 . 0 0 "[ . 1 . 2]" 1
1120 1 44 GLN HA 1 47 LYS QE 5.500 . 5.500 3.990 2.518 4.860 . 0 0 "[ . 1 . 2]" 1
1121 1 44 GLN HB2 1 44 GLN QE 4.500 . 4.500 3.763 2.783 4.406 . 0 0 "[ . 1 . 2]" 1
1122 1 44 GLN HB2 1 45 GLU H 3.500 . 3.500 3.551 3.398 3.593 0.093 9 0 "[ . 1 . 2]" 1
1123 1 44 GLN HB3 1 45 GLU H 3.500 . 3.500 2.590 2.394 2.909 . 0 0 "[ . 1 . 2]" 1
1124 1 44 GLN QG 1 45 GLU H 2.800 . 2.800 2.189 1.853 2.818 0.018 14 0 "[ . 1 . 2]" 1
1125 1 45 GLU H 1 45 GLU QB 2.800 . 2.800 2.597 2.312 2.831 0.031 3 0 "[ . 1 . 2]" 1
1126 1 45 GLU H 1 45 GLU QG 4.500 . 4.500 2.203 1.857 2.872 . 0 0 "[ . 1 . 2]" 1
1127 1 45 GLU H 1 46 PRO HA 5.500 . 5.500 4.815 4.671 4.931 . 0 0 "[ . 1 . 2]" 1
1128 1 45 GLU H 1 47 LYS H 5.500 . 5.500 4.536 4.135 4.891 . 0 0 "[ . 1 . 2]" 1
1129 1 45 GLU H 1 47 LYS H 5.500 . 5.500 4.062 3.853 4.187 . 0 0 "[ . 1 . 2]" 1
1130 1 45 GLU H 1 47 LYS QE 5.500 . 5.500 5.193 3.855 5.530 0.030 11 0 "[ . 1 . 2]" 1
1131 1 45 GLU H 1 47 LYS QG 4.500 . 4.500 3.119 2.750 3.553 . 0 0 "[ . 1 . 2]" 1
1132 1 45 GLU HA 1 46 PRO HA 2.800 . 2.800 2.174 1.962 2.515 . 0 0 "[ . 1 . 2]" 1
1133 1 45 GLU HA 1 47 LYS H 2.800 . 2.800 2.023 1.885 2.246 . 0 0 "[ . 1 . 2]" 1
1134 1 45 GLU HA 1 47 LYS QG . . 3.500 2.638 2.068 3.213 . 0 0 "[ . 1 . 2]" 1
1135 1 45 GLU QB 1 46 PRO HA 4.500 . 4.500 2.650 2.210 2.968 . 0 0 "[ . 1 . 2]" 1
1136 1 45 GLU QB 1 47 LYS H 3.500 . 3.500 3.275 2.952 3.526 0.026 18 0 "[ . 1 . 2]" 1
1137 1 45 GLU QB 1 47 LYS H 4.500 . 4.500 3.586 3.062 4.175 . 0 0 "[ . 1 . 2]" 1
1138 1 45 GLU HB2 1 46 PRO HA 4.500 . 4.500 3.716 2.630 4.264 . 0 0 "[ . 1 . 2]" 1
1139 1 45 GLU QG 1 46 PRO HA 4.500 . 4.500 4.012 3.591 4.516 0.016 3 0 "[ . 1 . 2]" 1
1140 1 46 PRO HA 1 47 LYS H 2.800 . 2.800 2.252 2.229 2.295 . 0 0 "[ . 1 . 2]" 1
1141 1 46 PRO HA 1 47 LYS QG 5.500 . 5.500 4.309 3.849 4.510 . 0 0 "[ . 1 . 2]" 1
1142 1 46 PRO HB2 1 49 ILE MD 2.800 . 2.800 2.125 1.895 2.297 . 0 0 "[ . 1 . 2]" 1
1143 1 46 PRO HB2 1 47 LYS H 5.500 . 5.500 3.829 3.593 4.014 . 0 0 "[ . 1 . 2]" 1
1144 1 46 PRO HB2 1 49 ILE MD 3.500 . 3.500 2.167 1.935 2.345 . 0 0 "[ . 1 . 2]" 1
1145 1 46 PRO HB3 1 49 ILE MD 3.500 . 3.500 2.811 2.512 3.091 . 0 0 "[ . 1 . 2]" 1
1146 1 46 PRO HB3 1 47 LYS H 4.500 . 4.500 4.096 3.927 4.287 . 0 0 "[ . 1 . 2]" 1
1147 1 46 PRO HB3 1 49 ILE MD 4.500 . 4.500 3.260 2.969 3.724 . 0 0 "[ . 1 . 2]" 1
1148 1 46 PRO QD 1 49 ILE MD 5.500 . 5.500 4.503 4.070 4.941 . 0 0 "[ . 1 . 2]" 1
1149 1 46 PRO QD 1 70 ILE MD 3.500 . 3.500 2.211 1.953 2.514 . 0 0 "[ . 1 . 2]" 1
1150 1 46 PRO QD 1 73 TYR QE . . 4.500 3.007 2.266 3.561 . 0 0 "[ . 1 . 2]" 1
1151 1 46 PRO QG 1 49 ILE MD 3.500 . 3.500 3.098 2.698 3.400 . 0 0 "[ . 1 . 2]" 1
1152 1 46 PRO QG 1 49 ILE HG13 5.500 . 5.500 2.268 1.905 2.765 . 0 0 "[ . 1 . 2]" 1
1153 1 46 PRO QG 1 70 ILE MD . . 2.800 2.716 2.338 2.864 0.064 16 0 "[ . 1 . 2]" 1
1154 1 46 PRO QG 1 73 TYR QE . . 3.500 2.076 1.929 2.288 . 0 0 "[ . 1 . 2]" 1
1155 1 47 LYS H 1 47 LYS HB2 2.800 . 2.800 2.227 2.187 2.287 . 0 0 "[ . 1 . 2]" 1
1156 1 47 LYS H 1 47 LYS HB3 3.500 . 3.500 3.528 3.511 3.549 0.049 15 0 "[ . 1 . 2]" 1
1157 1 47 LYS H 1 47 LYS QE 5.500 . 5.500 5.256 4.897 5.532 0.032 7 0 "[ . 1 . 2]" 1
1158 1 47 LYS H 1 47 LYS QG 2.800 . 2.800 2.685 2.430 2.815 0.015 12 0 "[ . 1 . 2]" 1
1159 1 47 LYS HA 1 47 LYS QE 5.500 . 5.500 4.351 3.286 4.870 . 0 0 "[ . 1 . 2]" 1
1160 1 47 LYS HA 1 47 LYS QG . . 3.500 2.199 2.038 2.281 . 0 0 "[ . 1 . 2]" 1
1161 1 47 LYS HA 1 48 GLY H 2.800 . 2.800 1.991 1.928 2.052 . 0 0 "[ . 1 . 2]" 1
1162 1 47 LYS HB2 1 48 GLY H 4.500 . 4.500 3.782 3.307 4.028 . 0 0 "[ . 1 . 2]" 1
1163 1 47 LYS HB2 1 48 GLY H 5.500 . 5.500 3.994 3.728 4.206 . 0 0 "[ . 1 . 2]" 1
1164 1 47 LYS HB3 1 48 GLY H 3.500 . 3.500 2.748 2.381 3.087 . 0 0 "[ . 1 . 2]" 1
1165 1 47 LYS QE 1 47 LYS QG 2.800 . 2.800 2.379 2.166 2.637 . 0 0 "[ . 1 . 2]" 1
1166 1 47 LYS QG 1 48 GLY H . . 3.500 3.461 3.240 3.548 0.048 5 0 "[ . 1 . 2]" 1
1167 1 48 GLY H 1 48 GLY QA 2.800 . 2.800 2.229 2.176 2.266 . 0 0 "[ . 1 . 2]" 1
1168 1 48 GLY H 1 49 ILE H 3.500 . 3.500 2.887 2.701 3.044 . 0 0 "[ . 1 . 2]" 1
1169 1 48 GLY H 1 49 ILE HG12 4.500 . 4.500 4.144 3.781 4.440 . 0 0 "[ . 1 . 2]" 1
1170 1 48 GLY H 1 50 PHE H 4.500 . 4.500 4.395 4.101 4.531 0.031 14 0 "[ . 1 . 2]" 1
1171 1 48 GLY QA 1 49 ILE H 3.500 . 3.500 2.863 2.691 2.996 . 0 0 "[ . 1 . 2]" 1
1172 1 49 ILE H 1 49 ILE HB 2.800 . 2.800 2.636 2.528 2.745 . 0 0 "[ . 1 . 2]" 1
1173 1 49 ILE H 1 49 ILE MD 4.500 . 4.500 3.511 3.053 3.859 . 0 0 "[ . 1 . 2]" 1
1174 1 49 ILE H 1 49 ILE MD 2.800 . 2.800 2.111 1.857 2.359 . 0 0 "[ . 1 . 2]" 1
1175 1 49 ILE H 1 49 ILE HG12 4.500 . 4.500 2.128 1.865 2.380 . 0 0 "[ . 1 . 2]" 1
1176 1 49 ILE H 1 49 ILE HG13 3.500 . 3.500 3.508 3.347 3.556 0.056 7 0 "[ . 1 . 2]" 1
1177 1 49 ILE H 1 49 ILE MG 4.500 . 4.500 3.829 3.809 3.854 . 0 0 "[ . 1 . 2]" 1
1178 1 49 ILE H 1 50 PHE H 2.800 . 2.800 2.159 1.863 2.539 . 0 0 "[ . 1 . 2]" 1
1179 1 49 ILE H 1 50 PHE QD 5.500 . 5.500 4.354 4.041 4.571 . 0 0 "[ . 1 . 2]" 1
1180 1 49 ILE HA 1 49 ILE MD 3.500 . 3.500 2.162 2.044 2.453 . 0 0 "[ . 1 . 2]" 1
1181 1 49 ILE HA 1 49 ILE MD 3.500 . 3.500 2.117 2.013 2.337 . 0 0 "[ . 1 . 2]" 1
1182 1 49 ILE HA 1 49 ILE MG 3.500 . 3.500 2.256 2.210 2.310 . 0 0 "[ . 1 . 2]" 1
1183 1 49 ILE HA 1 50 PHE H 4.500 . 4.500 3.483 3.452 3.542 . 0 0 "[ . 1 . 2]" 1
1184 1 49 ILE HA 1 61 VAL MG2 5.500 . 5.500 3.791 3.456 4.388 . 0 0 "[ . 1 . 2]" 1
1185 1 49 ILE HA 1 62 THR H 4.500 . 4.500 3.236 2.992 3.638 . 0 0 "[ . 1 . 2]" 1
1186 1 49 ILE HA 1 62 THR MG 4.500 . 4.500 3.872 3.430 4.521 0.021 9 0 "[ . 1 . 2]" 1
1187 1 49 ILE HA 1 63 ARG QG 3.500 . 3.500 2.595 2.168 3.135 . 0 0 "[ . 1 . 2]" 1
1188 1 49 ILE HA 1 63 ARG QG 4.500 . 4.500 2.738 2.197 3.854 . 0 0 "[ . 1 . 2]" 1
1189 1 49 ILE HB 1 49 ILE MD 3.500 . 3.500 3.195 3.163 3.213 . 0 0 "[ . 1 . 2]" 1
1190 1 49 ILE HB 1 50 PHE H 3.500 . 3.500 2.326 2.269 2.383 . 0 0 "[ . 1 . 2]" 1
1191 1 49 ILE HB 1 50 PHE QD 5.500 . 5.500 2.453 2.160 2.846 . 0 0 "[ . 1 . 2]" 1
1192 1 49 ILE HB 1 73 TYR QE 5.500 . 5.500 3.689 3.362 4.129 . 0 0 "[ . 1 . 2]" 1
1193 1 49 ILE MD 1 49 ILE MG 2.800 . 2.800 1.884 1.786 1.994 0.014 13 0 "[ . 1 . 2]" 1
1194 1 49 ILE MD 1 62 THR H 5.500 . 5.500 4.584 4.302 4.779 . 0 0 "[ . 1 . 2]" 1
1195 1 49 ILE MD 1 49 ILE MG 2.800 . 2.800 1.898 1.795 2.014 0.005 13 0 "[ . 1 . 2]" 1
1196 1 49 ILE MD 1 50 PHE H 5.500 . 5.500 4.519 4.373 4.623 . 0 0 "[ . 1 . 2]" 1
1197 1 49 ILE MD 1 50 PHE QE 5.500 . 5.500 4.785 4.491 5.160 . 0 0 "[ . 1 . 2]" 1
1198 1 49 ILE MD 1 63 ARG H 4.500 . 4.500 3.622 3.235 4.028 . 0 0 "[ . 1 . 2]" 1
1199 1 49 ILE MD 1 63 ARG HB3 4.500 . 4.500 4.392 3.843 4.532 0.032 14 0 "[ . 1 . 2]" 1
1200 1 49 ILE MD 1 63 ARG QD 3.500 . 3.500 2.188 1.845 2.852 . 0 0 "[ . 1 . 2]" 1
1201 1 49 ILE MD 1 63 ARG QD 2.800 . 2.800 2.089 1.803 2.812 0.012 5 0 "[ . 1 . 2]" 1
1202 1 49 ILE MD 1 63 ARG QG 4.500 . 4.500 2.283 2.101 2.834 . 0 0 "[ . 1 . 2]" 1
1203 1 49 ILE MD 1 73 TYR QE 2.800 . 2.800 2.676 2.218 2.821 0.021 19 0 "[ . 1 . 2]" 1
1204 1 49 ILE MD 1 73 TYR QE 4.500 . 4.500 3.782 3.196 4.513 0.013 12 0 "[ . 1 . 2]" 1
1205 1 49 ILE HG12 1 50 PHE H 3.500 . 3.500 3.573 3.533 3.614 0.114 15 0 "[ . 1 . 2]" 1
1206 1 49 ILE HG12 1 63 ARG QD 5.500 . 5.500 4.788 4.370 5.500 0.000 5 0 "[ . 1 . 2]" 1
1207 1 49 ILE HG13 1 49 ILE MG . . 3.500 2.450 2.306 2.570 . 0 0 "[ . 1 . 2]" 1
1208 1 49 ILE HG13 1 50 PHE H 4.500 . 4.500 4.393 4.276 4.501 0.001 2 0 "[ . 1 . 2]" 1
1209 1 49 ILE MG 1 50 PHE H 3.500 . 3.500 3.535 3.478 3.574 0.074 6 0 "[ . 1 . 2]" 1
1210 1 49 ILE MG 1 50 PHE QD 4.500 . 4.500 3.055 2.621 3.391 . 0 0 "[ . 1 . 2]" 1
1211 1 49 ILE MG 1 50 PHE QE 4.500 . 4.500 2.627 2.343 3.054 . 0 0 "[ . 1 . 2]" 1
1212 1 49 ILE MG 1 61 VAL HA 5.500 . 5.500 3.924 3.666 4.126 . 0 0 "[ . 1 . 2]" 1
1213 1 49 ILE MG 1 61 VAL MG2 2.800 . 2.800 2.269 2.086 2.678 . 0 0 "[ . 1 . 2]" 1
1214 1 49 ILE MG 1 62 THR H 4.500 . 4.500 3.448 3.098 3.864 . 0 0 "[ . 1 . 2]" 1
1215 1 49 ILE MG 1 63 ARG H 4.500 . 4.500 3.392 2.955 3.835 . 0 0 "[ . 1 . 2]" 1
1216 1 49 ILE MG 1 63 ARG QD 4.500 . 4.500 2.716 1.964 3.785 . 0 0 "[ . 1 . 2]" 1
1217 1 49 ILE MG 1 63 ARG QG 4.500 . 4.500 2.344 2.042 2.759 . 0 0 "[ . 1 . 2]" 1
1218 1 49 ILE MG 1 65 LEU MD1 3.500 . 3.500 3.544 3.502 3.590 0.090 10 0 "[ . 1 . 2]" 1
1219 1 49 ILE MG 1 65 LEU MD2 2.800 . 2.800 1.950 1.797 2.183 0.003 7 0 "[ . 1 . 2]" 1
1220 1 49 ILE MG 1 73 TYR QE 5.500 . 5.500 3.013 2.599 3.564 . 0 0 "[ . 1 . 2]" 1
1221 1 50 PHE H 1 50 PHE HB2 3.500 . 3.500 2.528 2.416 2.662 . 0 0 "[ . 1 . 2]" 1
1222 1 50 PHE H 1 50 PHE QD 3.500 . 3.500 2.897 2.584 3.168 . 0 0 "[ . 1 . 2]" 1
1223 1 50 PHE H 1 51 ARG H 5.500 . 5.500 4.507 4.451 4.551 . 0 0 "[ . 1 . 2]" 1
1224 1 50 PHE HA 1 50 PHE QD 3.500 . 3.500 2.632 2.300 2.886 . 0 0 "[ . 1 . 2]" 1
1225 1 50 PHE HA 1 51 ARG H 2.800 . 2.800 2.213 2.114 2.345 . 0 0 "[ . 1 . 2]" 1
1226 1 50 PHE HA 1 59 VAL MG1 5.500 . 5.500 4.299 4.029 4.613 . 0 0 "[ . 1 . 2]" 1
1227 1 50 PHE HA 1 61 VAL HA 3.500 . 3.500 2.120 1.962 2.350 . 0 0 "[ . 1 . 2]" 1
1228 1 50 PHE HA 1 61 VAL MG2 5.500 . 5.500 3.544 3.131 3.828 . 0 0 "[ . 1 . 2]" 1
1229 1 50 PHE HA 1 61 VAL MG2 4.500 . 4.500 3.113 2.700 3.474 . 0 0 "[ . 1 . 2]" 1
1230 1 50 PHE HA 1 62 THR H . . 4.500 3.191 2.859 3.477 . 0 0 "[ . 1 . 2]" 1
1231 1 50 PHE HA 1 62 THR MG 5.500 . 5.500 3.510 2.814 4.352 . 0 0 "[ . 1 . 2]" 1
1232 1 50 PHE HB2 1 50 PHE QD . . 2.800 2.363 2.321 2.417 . 0 0 "[ . 1 . 2]" 1
1233 1 50 PHE HB2 1 51 ARG H 4.500 . 4.500 3.958 3.618 4.191 . 0 0 "[ . 1 . 2]" 1
1234 1 50 PHE HB2 1 59 VAL MG1 4.500 . 4.500 4.221 3.896 4.450 . 0 0 "[ . 1 . 2]" 1
1235 1 50 PHE HB2 1 75 LEU MD2 5.500 . 5.500 3.254 2.753 3.895 . 0 0 "[ . 1 . 2]" 1
1236 1 50 PHE HB3 1 50 PHE QD . . 2.800 2.456 2.381 2.551 . 0 0 "[ . 1 . 2]" 1
1237 1 50 PHE HB3 1 51 ARG H 3.500 . 3.500 2.829 2.350 3.103 . 0 0 "[ . 1 . 2]" 1
1238 1 50 PHE HB3 1 59 VAL MG1 4.500 . 4.500 2.866 2.565 3.033 . 0 0 "[ . 1 . 2]" 1
1239 1 50 PHE HB3 1 59 VAL MG2 5.500 . 5.500 5.429 4.919 5.534 0.034 10 0 "[ . 1 . 2]" 1
1240 1 50 PHE HB3 1 75 LEU MD2 4.500 . 4.500 2.230 2.001 2.445 . 0 0 "[ . 1 . 2]" 1
1241 1 50 PHE HB3 1 75 LEU MD2 5.500 . 5.500 3.577 3.040 4.211 . 0 0 "[ . 1 . 2]" 1
1242 1 50 PHE QD 1 51 ARG H 3.500 . 3.500 3.505 3.360 3.558 0.058 20 0 "[ . 1 . 2]" 1
1243 1 50 PHE QD 1 59 VAL MG1 4.500 . 4.500 2.901 2.235 3.405 . 0 0 "[ . 1 . 2]" 1
1244 1 50 PHE QD 1 59 VAL MG1 2.800 . 2.800 2.597 2.197 2.793 . 0 0 "[ . 1 . 2]" 1
1245 1 50 PHE QD 1 61 VAL HA 4.500 . 4.500 2.796 2.439 3.300 . 0 0 "[ . 1 . 2]" 1
1246 1 50 PHE QD 1 61 VAL HB 4.500 . 4.500 3.060 2.674 3.670 . 0 0 "[ . 1 . 2]" 1
1247 1 50 PHE QD 1 61 VAL MG2 4.500 . 4.500 3.425 3.084 3.743 . 0 0 "[ . 1 . 2]" 1
1248 1 50 PHE QD 1 62 THR H 5.500 . 5.500 4.650 4.401 4.910 . 0 0 "[ . 1 . 2]" 1
1249 1 50 PHE QD 1 75 LEU MD1 4.500 . 4.500 3.119 2.621 3.546 . 0 0 "[ . 1 . 2]" 1
1250 1 50 PHE QD 1 75 LEU MD2 . . 3.500 2.989 2.508 3.509 0.009 19 0 "[ . 1 . 2]" 1
1251 1 50 PHE QE 1 61 VAL MG1 5.500 . 5.500 3.635 3.352 3.818 . 0 0 "[ . 1 . 2]" 1
1252 1 50 PHE QE 1 65 LEU MD1 3.500 . 3.500 1.875 1.801 2.006 . 0 0 "[ . 1 . 2]" 1
1253 1 50 PHE QE 1 65 LEU MD2 4.500 . 4.500 2.290 2.029 2.636 . 0 0 "[ . 1 . 2]" 1
1254 1 50 PHE QE 1 75 LEU MD1 5.500 . 5.500 4.297 3.626 4.515 . 0 0 "[ . 1 . 2]" 1
1255 1 50 PHE QE 1 95 VAL HB 5.500 . 5.500 3.589 3.019 3.986 . 0 0 "[ . 1 . 2]" 1
1256 1 50 PHE QE 1 95 VAL MG1 2.800 . 2.800 2.167 1.906 2.334 . 0 0 "[ . 1 . 2]" 1
1257 1 50 PHE QE 1 95 VAL MG2 4.500 . 4.500 3.365 2.926 3.623 . 0 0 "[ . 1 . 2]" 1
1258 1 50 PHE QE 1 61 VAL HB 4.500 . 4.500 2.280 2.070 2.530 . 0 0 "[ . 1 . 2]" 1
1259 1 50 PHE QE 1 61 VAL MG2 3.500 . 3.500 2.860 2.460 3.244 . 0 0 "[ . 1 . 2]" 1
1260 1 50 PHE QE 1 65 LEU MD2 4.500 . 4.500 2.340 2.176 2.486 . 0 0 "[ . 1 . 2]" 1
1261 1 50 PHE QE 1 73 TYR QD . . 3.500 2.861 2.665 2.964 . 0 0 "[ . 1 . 2]" 1
1262 1 50 PHE QE 1 73 TYR QE 3.500 . 3.500 3.082 2.944 3.306 . 0 0 "[ . 1 . 2]" 1
1263 1 50 PHE HZ 1 65 LEU MD2 4.500 . 4.500 2.111 1.982 2.329 . 0 0 "[ . 1 . 2]" 1
1264 1 50 PHE HZ 1 97 VAL MG2 5.500 . 5.500 3.850 3.381 4.407 . 0 0 "[ . 1 . 2]" 1
1265 1 51 ARG H 1 51 ARG HB3 3.500 . 3.500 3.511 3.332 3.727 0.227 5 0 "[ . 1 . 2]" 1
1266 1 51 ARG H 1 51 ARG QD 5.500 . 5.500 4.284 3.678 4.819 . 0 0 "[ . 1 . 2]" 1
1267 1 51 ARG H 1 51 ARG QG 4.500 . 4.500 2.331 1.965 3.368 . 0 0 "[ . 1 . 2]" 1
1268 1 51 ARG H 1 52 ILE H 4.500 . 4.500 4.210 3.988 4.358 . 0 0 "[ . 1 . 2]" 1
1269 1 51 ARG H 1 59 VAL HA 4.500 . 4.500 4.501 4.323 4.556 0.056 8 0 "[ . 1 . 2]" 1
1270 1 51 ARG H 1 59 VAL MG1 5.500 . 5.500 3.591 3.314 3.778 . 0 0 "[ . 1 . 2]" 1
1271 1 51 ARG H 1 60 SER H 3.500 . 3.500 2.908 2.783 3.051 . 0 0 "[ . 1 . 2]" 1
1272 1 51 ARG H 1 60 SER O 1.900 . 2.300 1.774 1.718 1.883 0.082 18 0 "[ . 1 . 2]" 1
1273 1 51 ARG H 1 61 VAL HA 4.500 . 4.500 3.440 3.187 3.643 . 0 0 "[ . 1 . 2]" 1
1274 1 51 ARG H 1 62 THR MG 5.500 . 5.500 3.744 3.371 4.187 . 0 0 "[ . 1 . 2]" 1
1275 1 51 ARG HA 1 51 ARG HB2 . . 2.800 2.579 2.452 2.946 0.146 13 0 "[ . 1 . 2]" 1
1276 1 51 ARG HA 1 51 ARG QG . . 3.500 3.277 2.230 3.371 . 0 0 "[ . 1 . 2]" 1
1277 1 51 ARG HA 1 52 ILE H 2.800 . 2.800 2.271 2.143 2.527 . 0 0 "[ . 1 . 2]" 1
1278 1 51 ARG HA 1 52 ILE HA 4.500 . 4.500 4.404 4.338 4.491 . 0 0 "[ . 1 . 2]" 1
1279 1 51 ARG QB 1 52 ILE H 3.500 . 3.500 2.929 2.218 3.309 . 0 0 "[ . 1 . 2]" 1
1280 1 51 ARG HB2 1 51 ARG QD 3.500 . 3.500 2.859 2.157 3.507 0.007 5 0 "[ . 1 . 2]" 1
1281 1 51 ARG HB2 1 51 ARG QG 2.800 . 2.800 2.460 2.171 2.584 . 0 0 "[ . 1 . 2]" 1
1282 1 51 ARG HB2 1 52 ILE H 3.500 . 3.500 3.101 2.376 3.592 0.092 13 0 "[ . 1 . 2]" 1
1283 1 51 ARG HB2 1 60 SER H 5.500 . 5.500 4.835 3.302 5.246 . 0 0 "[ . 1 . 2]" 1
1284 1 51 ARG HB2 1 62 THR MG . . 4.500 4.159 3.178 4.498 . 0 0 "[ . 1 . 2]" 1
1285 1 51 ARG HB3 1 51 ARG QD 3.500 . 3.500 2.979 2.602 3.337 . 0 0 "[ . 1 . 2]" 1
1286 1 51 ARG HB3 1 51 ARG QG 2.800 . 2.800 2.312 2.187 2.509 . 0 0 "[ . 1 . 2]" 1
1287 1 51 ARG HB3 1 52 ILE H 4.500 . 4.500 3.897 2.240 4.224 . 0 0 "[ . 1 . 2]" 1
1288 1 51 ARG HB3 1 62 THR MG 4.500 . 4.500 3.293 2.603 4.333 . 0 0 "[ . 1 . 2]" 1
1289 1 51 ARG QD 1 62 THR MG 2.800 . 2.800 2.415 1.872 2.826 0.026 7 0 "[ . 1 . 2]" 1
1290 1 51 ARG QG 1 52 ILE H 4.500 . 4.500 4.149 3.350 4.561 0.061 5 0 "[ . 1 . 2]" 1
1291 1 51 ARG QG 1 60 SER H 4.500 . 4.500 3.135 2.580 3.906 . 0 0 "[ . 1 . 2]" 1
1292 1 51 ARG QG 1 60 SER H 5.500 . 5.500 3.337 2.619 5.119 . 0 0 "[ . 1 . 2]" 1
1293 1 51 ARG QG 1 62 THR MG . . 3.500 2.069 1.799 2.372 0.001 7 0 "[ . 1 . 2]" 1
1294 1 51 ARG N 1 60 SER O 2.800 2.700 3.300 2.718 2.671 2.799 0.029 7 0 "[ . 1 . 2]" 1
1295 1 51 ARG O 1 60 SER H 1.900 . 2.300 1.755 1.721 1.783 0.079 6 0 "[ . 1 . 2]" 1
1296 1 51 ARG O 1 60 SER N 2.800 2.700 3.300 2.688 2.617 2.730 0.083 8 0 "[ . 1 . 2]" 1
1297 1 52 ILE H 1 52 ILE MD 4.500 . 4.500 4.487 4.398 4.627 0.127 13 0 "[ . 1 . 2]" 1
1298 1 52 ILE H 1 52 ILE HG12 4.500 . 4.500 4.511 4.457 4.538 0.038 5 0 "[ . 1 . 2]" 1
1299 1 52 ILE H 1 52 ILE MG 2.800 . 2.800 2.211 1.926 2.434 . 0 0 "[ . 1 . 2]" 1
1300 1 52 ILE H 1 60 SER H 5.500 . 5.500 4.541 4.299 4.753 . 0 0 "[ . 1 . 2]" 1
1301 1 52 ILE HA 1 52 ILE MD 4.500 . 4.500 3.726 3.577 3.797 . 0 0 "[ . 1 . 2]" 1
1302 1 52 ILE HA 1 52 ILE HG12 3.500 . 3.500 2.688 2.259 3.301 . 0 0 "[ . 1 . 2]" 1
1303 1 52 ILE HA 1 52 ILE HG13 2.800 . 2.800 2.575 2.363 2.836 0.036 18 0 "[ . 1 . 2]" 1
1304 1 52 ILE HA 1 53 ASN H . . 2.800 2.303 2.202 2.420 . 0 0 "[ . 1 . 2]" 1
1305 1 52 ILE HA 1 59 VAL HA . . 2.800 2.049 1.877 2.269 . 0 0 "[ . 1 . 2]" 1
1306 1 52 ILE HA 1 59 VAL MG2 4.500 . 4.500 3.835 3.490 4.070 . 0 0 "[ . 1 . 2]" 1
1307 1 52 ILE HA 1 60 SER H 3.500 . 3.500 2.732 2.355 3.078 . 0 0 "[ . 1 . 2]" 1
1308 1 52 ILE HB 1 52 ILE MD 2.800 . 2.800 2.523 2.232 2.802 0.002 18 0 "[ . 1 . 2]" 1
1309 1 52 ILE HB 1 53 ASN H 4.500 . 4.500 4.021 3.824 4.249 . 0 0 "[ . 1 . 2]" 1
1310 1 52 ILE MD 1 52 ILE MG 2.800 . 2.800 1.826 1.766 2.084 0.034 13 0 "[ . 1 . 2]" 1
1311 1 52 ILE MD 1 53 ASN H 3.500 . 3.500 3.562 3.440 3.631 0.131 10 0 "[ . 1 . 2]" 1
1312 1 52 ILE MD 1 54 GLU HA 5.500 . 5.500 4.122 3.183 4.701 . 0 0 "[ . 1 . 2]" 1
1313 1 52 ILE MD 1 57 GLY H 4.500 . 4.500 4.015 3.713 4.381 . 0 0 "[ . 1 . 2]" 1
1314 1 52 ILE MD 1 57 GLY QA . . 3.500 2.040 1.894 2.258 . 0 0 "[ . 1 . 2]" 1
1315 1 52 ILE MD 1 59 VAL HA 5.500 . 5.500 3.996 3.466 4.359 . 0 0 "[ . 1 . 2]" 1
1316 1 52 ILE MD 1 77 VAL HB 4.500 . 4.500 4.256 4.077 4.478 . 0 0 "[ . 1 . 2]" 1
1317 1 52 ILE MD 1 77 VAL MG1 2.800 . 2.800 2.205 2.059 2.464 . 0 0 "[ . 1 . 2]" 1
1318 1 52 ILE MD 1 77 VAL MG1 2.800 . 2.800 2.172 2.040 2.413 . 0 0 "[ . 1 . 2]" 1
1319 1 52 ILE HG12 1 53 ASN H 4.500 . 4.500 1.997 1.793 2.404 0.007 5 0 "[ . 1 . 2]" 1
1320 1 52 ILE HG12 1 57 GLY QA 4.500 . 4.500 2.550 2.199 3.002 . 0 0 "[ . 1 . 2]" 1
1321 1 52 ILE HG12 1 58 SER H 4.500 . 4.500 3.749 3.367 3.999 . 0 0 "[ . 1 . 2]" 1
1322 1 52 ILE HG12 1 59 VAL H 5.500 . 5.500 4.570 3.886 5.499 . 0 0 "[ . 1 . 2]" 1
1323 1 52 ILE HG12 1 59 VAL HA 5.500 . 5.500 3.519 2.849 4.423 . 0 0 "[ . 1 . 2]" 1
1324 1 52 ILE HG12 1 60 SER H 5.500 . 5.500 5.150 4.607 5.535 0.035 9 0 "[ . 1 . 2]" 1
1325 1 52 ILE HG13 1 52 ILE MG 3.500 . 3.500 3.188 3.140 3.221 . 0 0 "[ . 1 . 2]" 1
1326 1 52 ILE HG13 1 53 ASN H 4.500 . 4.500 3.032 1.986 3.845 . 0 0 "[ . 1 . 2]" 1
1327 1 52 ILE HG13 1 57 GLY QA 5.500 . 5.500 3.558 2.990 4.103 . 0 0 "[ . 1 . 2]" 1
1328 1 52 ILE HG13 1 59 VAL HA 5.500 . 5.500 2.542 2.167 2.957 . 0 0 "[ . 1 . 2]" 1
1329 1 52 ILE HG13 1 59 VAL MG2 4.500 . 4.500 2.240 1.999 3.163 . 0 0 "[ . 1 . 2]" 1
1330 1 52 ILE MG 1 53 ASN H 3.500 . 3.500 3.286 3.014 3.519 0.019 8 0 "[ . 1 . 2]" 1
1331 1 52 ILE MG 1 54 GLU HA 3.500 . 3.500 3.010 2.532 3.381 . 0 0 "[ . 1 . 2]" 1
1332 1 52 ILE MG 1 54 GLU QB 4.500 . 4.500 4.286 3.763 4.551 0.051 12 0 "[ . 1 . 2]" 1
1333 1 52 ILE MG 1 57 GLY H 5.500 . 5.500 4.608 4.294 5.186 . 0 0 "[ . 1 . 2]" 1
1334 1 52 ILE MG 1 59 VAL HA 5.500 . 5.500 4.496 4.318 4.643 . 0 0 "[ . 1 . 2]" 1
1335 1 53 ASN H 1 53 ASN HB2 3.500 . 3.500 2.749 2.222 3.040 . 0 0 "[ . 1 . 2]" 1
1336 1 53 ASN H 1 53 ASN HB3 3.500 . 3.500 2.549 2.403 3.503 0.003 8 0 "[ . 1 . 2]" 1
1337 1 53 ASN H 1 53 ASN HB3 3.500 . 3.500 2.510 2.360 3.267 . 0 0 "[ . 1 . 2]" 1
1338 1 53 ASN H 1 57 GLY H 4.500 . 4.500 3.183 2.602 3.427 . 0 0 "[ . 1 . 2]" 1
1339 1 53 ASN H 1 58 SER H . . 3.500 3.165 3.034 3.375 . 0 0 "[ . 1 . 2]" 1
1340 1 53 ASN H 1 58 SER HB2 5.500 . 5.500 3.592 3.120 4.912 . 0 0 "[ . 1 . 2]" 1
1341 1 53 ASN HB2 1 56 THR H 4.500 . 4.500 3.748 3.576 3.922 . 0 0 "[ . 1 . 2]" 1
1342 1 53 ASN HB2 1 57 GLY H 5.500 . 5.500 4.037 3.289 4.565 . 0 0 "[ . 1 . 2]" 1
1343 1 53 ASN HB2 1 57 GLY H 2.800 . 2.800 2.293 2.237 2.396 . 0 0 "[ . 1 . 2]" 1
1344 1 53 ASN HB2 1 58 SER H 2.800 . 2.800 2.700 1.887 2.818 0.018 10 0 "[ . 1 . 2]" 1
1345 1 53 ASN HB2 1 58 SER H 4.500 . 4.500 3.298 1.910 3.921 . 0 0 "[ . 1 . 2]" 1
1346 1 53 ASN HB2 1 58 SER QB 5.500 . 5.500 2.485 2.023 3.070 . 0 0 "[ . 1 . 2]" 1
1347 1 53 ASN HB3 1 55 ASN H 5.500 . 5.500 4.020 3.251 4.500 . 0 0 "[ . 1 . 2]" 1
1348 1 53 ASN HB3 1 56 THR H 5.500 . 5.500 2.979 2.606 3.426 . 0 0 "[ . 1 . 2]" 1
1349 1 53 ASN HB3 1 57 GLY H 4.500 . 4.500 2.399 1.928 3.014 . 0 0 "[ . 1 . 2]" 1
1350 1 53 ASN HB3 1 58 SER H 3.500 . 3.500 2.031 1.789 2.751 0.011 9 0 "[ . 1 . 2]" 1
1351 1 53 ASN HB3 1 58 SER HB2 5.500 . 5.500 2.899 2.082 4.746 . 0 0 "[ . 1 . 2]" 1
1352 1 53 ASN HB3 1 58 SER QB 4.500 . 4.500 2.703 2.071 3.014 . 0 0 "[ . 1 . 2]" 1
1353 1 53 ASN HB3 1 58 SER HB3 5.500 . 5.500 4.127 2.341 4.631 . 0 0 "[ . 1 . 2]" 1
1354 1 54 GLU H 1 54 GLU QB 3.500 . 3.500 1.947 1.750 2.382 0.050 11 0 "[ . 1 . 2]" 1
1355 1 54 GLU H 1 55 ASN H . . 4.500 3.079 2.677 3.476 . 0 0 "[ . 1 . 2]" 1
1356 1 54 GLU HA 1 54 GLU QB 2.800 . 2.800 2.235 2.142 2.424 . 0 0 "[ . 1 . 2]" 1
1357 1 54 GLU HA 1 55 ASN H 4.500 . 4.500 3.517 3.225 3.633 . 0 0 "[ . 1 . 2]" 1
1358 1 54 GLU QB 1 55 ASN H 3.500 . 3.500 2.722 1.877 3.508 0.008 14 0 "[ . 1 . 2]" 1
1359 1 54 GLU QB 1 55 ASN H 5.500 . 5.500 2.959 2.337 3.679 . 0 0 "[ . 1 . 2]" 1
1360 1 54 GLU QG 1 55 ASN H 4.500 . 4.500 3.663 1.884 4.540 0.040 13 0 "[ . 1 . 2]" 1
1361 1 55 ASN H 1 55 ASN HA 2.800 . 2.800 2.905 2.863 2.949 0.149 5 0 "[ . 1 . 2]" 1
1362 1 55 ASN H 1 55 ASN QB 2.800 . 2.800 2.335 2.105 2.847 0.047 15 0 "[ . 1 . 2]" 1
1363 1 55 ASN H 1 56 THR H 2.800 . 2.800 2.324 1.891 2.551 . 0 0 "[ . 1 . 2]" 1
1364 1 55 ASN H 1 56 THR HA 5.500 . 5.500 5.030 4.577 5.239 . 0 0 "[ . 1 . 2]" 1
1365 1 55 ASN H 1 56 THR MG 3.500 . 3.500 3.541 3.474 3.609 0.109 10 0 "[ . 1 . 2]" 1
1366 1 55 ASN H 1 57 GLY H 4.500 . 4.500 3.504 2.659 3.931 . 0 0 "[ . 1 . 2]" 1
1367 1 55 ASN HA 1 55 ASN QB 2.800 . 2.800 2.401 2.139 2.529 . 0 0 "[ . 1 . 2]" 1
1368 1 55 ASN HA 1 55 ASN HB3 2.800 . 2.800 2.817 2.258 2.964 0.164 6 0 "[ . 1 . 2]" 1
1369 1 55 ASN HA 1 56 THR H 3.500 . 3.500 3.506 3.372 3.529 0.029 19 0 "[ . 1 . 2]" 1
1370 1 55 ASN QB 1 56 THR H 3.500 . 3.500 2.585 2.213 3.024 . 0 0 "[ . 1 . 2]" 1
1371 1 55 ASN QB 1 56 THR MG 2.800 . 2.800 2.554 2.136 2.806 0.006 19 0 "[ . 1 . 2]" 1
1372 1 55 ASN QB 1 57 GLY H 4.500 . 4.500 4.471 4.190 4.602 0.102 10 0 "[ . 1 . 2]" 1
1373 1 56 THR H 1 56 THR MG 2.800 . 2.800 1.936 1.785 2.515 0.015 12 0 "[ . 1 . 2]" 1
1374 1 56 THR H 1 57 GLY H 3.500 . 3.500 2.258 1.787 2.476 0.013 10 0 "[ . 1 . 2]" 1
1375 1 56 THR H 1 57 GLY QA 5.500 . 5.500 4.251 3.786 4.440 . 0 0 "[ . 1 . 2]" 1
1376 1 56 THR H 1 58 SER H 4.500 . 4.500 3.769 3.480 3.971 . 0 0 "[ . 1 . 2]" 1
1377 1 56 THR HA 1 56 THR HB . . 2.800 2.381 2.339 2.446 . 0 0 "[ . 1 . 2]" 1
1378 1 56 THR HA 1 56 THR MG 2.800 . 2.800 2.516 2.377 2.673 . 0 0 "[ . 1 . 2]" 1
1379 1 56 THR HA 1 57 GLY H 4.500 . 4.500 3.434 3.308 3.510 . 0 0 "[ . 1 . 2]" 1
1380 1 56 THR HB 1 57 GLY H 4.500 . 4.500 4.016 3.390 4.258 . 0 0 "[ . 1 . 2]" 1
1381 1 56 THR HB 1 58 SER H 2.800 . 2.800 2.740 2.688 2.788 . 0 0 "[ . 1 . 2]" 1
1382 1 56 THR MG 1 57 GLY H 3.500 . 3.500 3.575 3.452 3.646 0.146 16 0 "[ . 1 . 2]" 1
1383 1 57 GLY H 1 57 GLY QA 2.800 . 2.800 2.308 2.257 2.430 . 0 0 "[ . 1 . 2]" 1
1384 1 57 GLY H 1 58 SER H 3.500 . 3.500 2.345 1.892 2.574 . 0 0 "[ . 1 . 2]" 1
1385 1 57 GLY H 1 58 SER QB 5.500 . 5.500 4.415 3.963 4.799 . 0 0 "[ . 1 . 2]" 1
1386 1 57 GLY QA 1 58 SER H 4.500 . 4.500 2.920 2.878 2.942 . 0 0 "[ . 1 . 2]" 1
1387 1 58 SER H 1 58 SER QB 2.800 . 2.800 2.521 2.058 2.741 . 0 0 "[ . 1 . 2]" 1
1388 1 58 SER H 1 59 VAL H 4.500 . 4.500 4.515 4.501 4.555 0.055 9 0 "[ . 1 . 2]" 1
1389 1 58 SER H 1 59 VAL MG2 5.500 . 5.500 4.920 4.751 5.167 . 0 0 "[ . 1 . 2]" 1
1390 1 58 SER HA 1 59 VAL H 2.800 . 2.800 2.158 2.128 2.199 . 0 0 "[ . 1 . 2]" 1
1391 1 58 SER HA 1 59 VAL HB 5.500 . 5.500 4.931 4.709 4.986 . 0 0 "[ . 1 . 2]" 1
1392 1 58 SER HA 1 59 VAL MG2 . . 4.500 3.464 3.370 3.611 . 0 0 "[ . 1 . 2]" 1
1393 1 58 SER QB 1 59 VAL H 4.500 . 4.500 3.354 3.229 3.754 . 0 0 "[ . 1 . 2]" 1
1394 1 59 VAL H 1 59 VAL HB 2.800 . 2.800 2.778 2.525 2.820 0.020 12 0 "[ . 1 . 2]" 1
1395 1 59 VAL H 1 59 VAL MG1 4.500 . 4.500 3.809 3.773 3.833 . 0 0 "[ . 1 . 2]" 1
1396 1 59 VAL H 1 59 VAL QG 2.800 . 2.800 2.103 1.975 2.248 . 0 0 "[ . 1 . 2]" 1
1397 1 59 VAL H 1 59 VAL MG2 3.500 . 3.500 2.113 1.981 2.264 . 0 0 "[ . 1 . 2]" 1
1398 1 59 VAL H 1 60 SER H 5.500 . 5.500 4.465 4.360 4.562 . 0 0 "[ . 1 . 2]" 1
1399 1 59 VAL H 1 60 SER H 4.500 . 4.500 3.973 3.935 4.013 . 0 0 "[ . 1 . 2]" 1
1400 1 59 VAL HA 1 59 VAL MG1 3.500 . 3.500 2.271 2.146 2.331 . 0 0 "[ . 1 . 2]" 1
1401 1 59 VAL HA 1 59 VAL QG 2.800 . 2.800 2.132 2.035 2.152 . 0 0 "[ . 1 . 2]" 1
1402 1 59 VAL HA 1 59 VAL MG2 2.800 . 2.800 2.588 2.466 2.670 . 0 0 "[ . 1 . 2]" 1
1403 1 59 VAL HA 1 60 SER H 2.800 . 2.800 2.186 2.135 2.228 . 0 0 "[ . 1 . 2]" 1
1404 1 59 VAL HA 1 60 SER HA 4.500 . 4.500 4.435 4.396 4.465 . 0 0 "[ . 1 . 2]" 1
1405 1 59 VAL MG1 1 75 LEU MD2 4.500 . 4.500 3.374 3.014 3.857 . 0 0 "[ . 1 . 2]" 1
1406 1 60 SER H 1 61 VAL H 5.500 . 5.500 4.456 4.394 4.505 . 0 0 "[ . 1 . 2]" 1
1407 1 60 SER HA 1 60 SER HB3 . . 2.800 2.254 2.219 2.289 . 0 0 "[ . 1 . 2]" 1
1408 1 60 SER HA 1 61 VAL H . . 2.800 2.267 2.161 2.367 . 0 0 "[ . 1 . 2]" 1
1409 1 60 SER HA 1 61 VAL MG1 4.500 . 4.500 3.813 3.523 3.984 . 0 0 "[ . 1 . 2]" 1
1410 1 60 SER HB2 1 61 VAL H 3.500 . 3.500 2.986 2.654 3.434 . 0 0 "[ . 1 . 2]" 1
1411 1 60 SER HB3 1 61 VAL H 3.500 . 3.500 3.393 3.216 3.548 0.048 8 0 "[ . 1 . 2]" 1
1412 1 61 VAL H 1 61 VAL MG1 2.800 . 2.800 2.000 1.907 2.099 . 0 0 "[ . 1 . 2]" 1
1413 1 61 VAL H 1 61 VAL MG2 4.500 . 4.500 3.854 3.773 3.929 . 0 0 "[ . 1 . 2]" 1
1414 1 61 VAL HA 1 61 VAL MG2 2.800 . 2.800 2.377 2.266 2.446 . 0 0 "[ . 1 . 2]" 1
1415 1 61 VAL HA 1 62 THR H 2.800 . 2.800 2.300 2.263 2.335 . 0 0 "[ . 1 . 2]" 1
1416 1 61 VAL HA 1 62 THR MG 4.500 . 4.500 3.604 3.257 4.028 . 0 0 "[ . 1 . 2]" 1
1417 1 61 VAL HA 1 63 ARG H 4.500 . 4.500 4.053 3.937 4.227 . 0 0 "[ . 1 . 2]" 1
1418 1 61 VAL HB 1 62 THR H 4.500 . 4.500 4.200 4.042 4.269 . 0 0 "[ . 1 . 2]" 1
1419 1 61 VAL HB 1 63 ARG H 5.500 . 5.500 4.777 4.542 5.034 . 0 0 "[ . 1 . 2]" 1
1420 1 61 VAL MG1 1 61 VAL MG2 2.800 . 2.800 2.058 2.026 2.079 . 0 0 "[ . 1 . 2]" 1
1421 1 61 VAL MG1 1 62 THR H 4.500 . 4.500 3.752 3.563 3.930 . 0 0 "[ . 1 . 2]" 1
1422 1 61 VAL MG1 1 63 ARG H 3.500 . 3.500 3.311 2.947 3.531 0.031 20 0 "[ . 1 . 2]" 1
1423 1 61 VAL MG1 1 63 ARG HA 4.500 . 4.500 4.026 3.777 4.229 . 0 0 "[ . 1 . 2]" 1
1424 1 61 VAL MG1 1 65 LEU MD2 4.500 . 4.500 3.918 3.585 4.504 0.004 1 0 "[ . 1 . 2]" 1
1425 1 61 VAL MG2 1 62 THR H 3.500 . 3.500 2.353 1.989 2.567 . 0 0 "[ . 1 . 2]" 1
1426 1 61 VAL MG2 1 62 THR H 2.800 . 2.800 2.156 1.922 2.383 . 0 0 "[ . 1 . 2]" 1
1427 1 61 VAL MG2 1 63 ARG H 2.800 . 2.800 1.920 1.787 2.201 0.013 9 0 "[ . 1 . 2]" 1
1428 1 61 VAL MG2 1 65 LEU MD2 2.800 . 2.800 2.002 1.893 2.292 . 0 0 "[ . 1 . 2]" 1
1429 1 61 VAL MG2 1 65 LEU HG 4.500 . 4.500 2.272 2.017 2.715 . 0 0 "[ . 1 . 2]" 1
1430 1 62 THR H 1 62 THR MG 2.800 . 2.800 2.557 2.143 2.890 0.090 5 0 "[ . 1 . 2]" 1
1431 1 62 THR H 1 63 ARG H 2.800 . 2.800 2.422 2.261 2.730 . 0 0 "[ . 1 . 2]" 1
1432 1 62 THR HA 1 62 THR HB 2.800 . 2.800 2.532 2.426 2.648 . 0 0 "[ . 1 . 2]" 1
1433 1 62 THR HA 1 62 THR MG 2.800 . 2.800 2.283 2.098 2.444 . 0 0 "[ . 1 . 2]" 1
1434 1 62 THR HA 1 63 ARG H . . 4.500 3.453 3.285 3.522 . 0 0 "[ . 1 . 2]" 1
1435 1 62 THR MG 1 63 ARG H 5.500 . 5.500 4.185 3.947 4.440 . 0 0 "[ . 1 . 2]" 1
1436 1 63 ARG H 1 63 ARG HB3 3.500 . 3.500 3.467 3.277 3.557 0.057 16 0 "[ . 1 . 2]" 1
1437 1 63 ARG H 1 63 ARG QD 5.500 . 5.500 3.982 2.558 4.788 . 0 0 "[ . 1 . 2]" 1
1438 1 63 ARG H 1 63 ARG QG 3.500 . 3.500 2.261 1.903 2.870 . 0 0 "[ . 1 . 2]" 1
1439 1 63 ARG H 1 64 THR H 5.500 . 5.500 4.358 4.208 4.447 . 0 0 "[ . 1 . 2]" 1
1440 1 63 ARG HA 1 63 ARG HB2 2.800 . 2.800 2.515 2.358 2.635 . 0 0 "[ . 1 . 2]" 1
1441 1 63 ARG HA 1 63 ARG HB3 2.800 . 2.800 2.408 2.312 2.630 . 0 0 "[ . 1 . 2]" 1
1442 1 63 ARG HA 1 64 THR H 2.800 . 2.800 2.504 2.255 2.815 0.015 1 0 "[ . 1 . 2]" 1
1443 1 63 ARG HB2 1 63 ARG QD . . 2.800 2.329 2.028 2.817 0.017 1 0 "[ . 1 . 2]" 1
1444 1 63 ARG HB2 1 64 THR H 2.800 . 2.800 2.157 1.939 2.474 . 0 0 "[ . 1 . 2]" 1
1445 1 63 ARG HB2 1 64 THR MG 4.500 . 4.500 3.257 2.964 3.756 . 0 0 "[ . 1 . 2]" 1
1446 1 63 ARG HB3 1 63 ARG QD 3.500 . 3.500 3.147 2.598 3.511 0.011 11 0 "[ . 1 . 2]" 1
1447 1 63 ARG HB3 1 64 THR H 3.500 . 3.500 3.507 3.323 3.581 0.081 5 0 "[ . 1 . 2]" 1
1448 1 63 ARG QD 1 64 THR H 3.500 . 3.500 3.459 3.074 3.580 0.080 1 0 "[ . 1 . 2]" 1
1449 1 63 ARG QD 1 65 LEU MD2 4.500 . 4.500 3.278 2.100 4.527 0.027 12 0 "[ . 1 . 2]" 1
1450 1 63 ARG QG 1 64 THR H 4.500 . 4.500 3.640 1.911 4.292 . 0 0 "[ . 1 . 2]" 1
1451 1 63 ARG QG 1 65 LEU MD2 3.500 . 3.500 2.914 2.371 3.226 . 0 0 "[ . 1 . 2]" 1
1452 1 64 THR H 1 64 THR HB 2.800 . 2.800 2.449 2.222 2.720 . 0 0 "[ . 1 . 2]" 1
1453 1 64 THR H 1 64 THR MG 2.800 . 2.800 2.312 2.082 2.659 . 0 0 "[ . 1 . 2]" 1
1454 1 64 THR H 1 65 LEU H 5.500 . 5.500 4.603 4.506 4.682 . 0 0 "[ . 1 . 2]" 1
1455 1 64 THR H 1 65 LEU MD2 5.500 . 5.500 5.024 4.576 5.507 0.007 5 0 "[ . 1 . 2]" 1
1456 1 64 THR HA 1 64 THR MG 3.500 . 3.500 3.225 3.194 3.262 . 0 0 "[ . 1 . 2]" 1
1457 1 64 THR HA 1 65 LEU H 3.500 . 3.500 2.316 2.192 2.607 . 0 0 "[ . 1 . 2]" 1
1458 1 64 THR HA 1 65 LEU HA 4.500 . 4.500 4.451 4.384 4.538 0.038 10 0 "[ . 1 . 2]" 1
1459 1 64 THR MG 1 65 LEU H 4.500 . 4.500 3.569 2.753 4.020 . 0 0 "[ . 1 . 2]" 1
1460 1 65 LEU H 1 65 LEU MD2 4.500 . 4.500 3.611 3.140 4.053 . 0 0 "[ . 1 . 2]" 1
1461 1 65 LEU H 1 65 LEU HG 5.500 . 5.500 2.520 2.127 3.001 . 0 0 "[ . 1 . 2]" 1
1462 1 65 LEU HA 1 65 LEU MD1 . . 4.500 3.847 3.704 3.941 . 0 0 "[ . 1 . 2]" 1
1463 1 65 LEU HA 1 65 LEU MD2 2.800 . 2.800 2.177 1.945 2.345 . 0 0 "[ . 1 . 2]" 1
1464 1 65 LEU HA 1 65 LEU HG 4.500 . 4.500 3.031 2.778 3.272 . 0 0 "[ . 1 . 2]" 1
1465 1 65 LEU QB 1 65 LEU MD1 2.800 . 2.800 2.129 2.103 2.165 . 0 0 "[ . 1 . 2]" 1
1466 1 65 LEU QB 1 66 ASP H 5.500 . 5.500 2.793 2.289 3.293 . 0 0 "[ . 1 . 2]" 1
1467 1 65 LEU QB 1 97 VAL MG2 . . 4.500 2.814 2.235 3.162 . 0 0 "[ . 1 . 2]" 1
1468 1 65 LEU HB2 1 97 VAL MG1 3.500 . 3.500 2.070 1.762 2.779 0.038 11 0 "[ . 1 . 2]" 1
1469 1 65 LEU HB2 1 97 VAL MG2 4.500 . 4.500 3.808 2.998 4.318 . 0 0 "[ . 1 . 2]" 1
1470 1 65 LEU HB3 1 73 TYR QE 5.500 . 5.500 3.016 2.561 4.121 . 0 0 "[ . 1 . 2]" 1
1471 1 65 LEU HB3 1 97 VAL MG1 2.800 . 2.800 2.325 1.960 2.641 . 0 0 "[ . 1 . 2]" 1
1472 1 65 LEU HB3 1 97 VAL MG2 3.500 . 3.500 2.855 2.301 3.160 . 0 0 "[ . 1 . 2]" 1
1473 1 65 LEU MD1 1 65 LEU MD2 2.800 . 2.800 2.023 1.949 2.077 . 0 0 "[ . 1 . 2]" 1
1474 1 65 LEU MD1 1 73 TYR QD 4.500 . 4.500 3.864 3.210 4.422 . 0 0 "[ . 1 . 2]" 1
1475 1 65 LEU MD1 1 73 TYR QE . . 3.500 2.831 2.087 3.430 . 0 0 "[ . 1 . 2]" 1
1476 1 65 LEU MD1 1 97 VAL HA 4.500 . 4.500 3.275 3.022 3.460 . 0 0 "[ . 1 . 2]" 1
1477 1 65 LEU MD1 1 97 VAL MG2 3.500 . 3.500 2.755 2.115 3.502 0.002 1 0 "[ . 1 . 2]" 1
1478 1 65 LEU MD2 1 66 ASP H 4.500 . 4.500 3.534 2.943 3.810 . 0 0 "[ . 1 . 2]" 1
1479 1 65 LEU MD2 1 73 TYR QE 4.500 . 4.500 2.756 2.246 3.002 . 0 0 "[ . 1 . 2]" 1
1480 1 65 LEU MD2 1 97 VAL MG2 3.500 . 3.500 2.963 2.749 3.188 . 0 0 "[ . 1 . 2]" 1
1481 1 66 ASP HA 1 67 ARG H 2.800 . 2.800 2.191 2.097 2.453 . 0 0 "[ . 1 . 2]" 1
1482 1 66 ASP HA 1 68 GLU H 4.500 . 4.500 3.506 3.266 4.176 . 0 0 "[ . 1 . 2]" 1
1483 1 66 ASP HA 1 97 VAL MG1 4.500 . 4.500 3.674 3.133 4.173 . 0 0 "[ . 1 . 2]" 1
1484 1 66 ASP QB 1 67 ARG H . . 3.500 3.327 2.451 3.578 0.078 8 0 "[ . 1 . 2]" 1
1485 1 66 ASP QB 1 68 GLU H 4.500 . 4.500 2.541 2.148 3.563 . 0 0 "[ . 1 . 2]" 1
1486 1 66 ASP QB 1 69 VAL HB 4.500 . 4.500 3.635 2.614 4.521 0.021 20 0 "[ . 1 . 2]" 1
1487 1 66 ASP QB 1 69 VAL MG2 3.500 . 3.500 2.251 1.793 3.531 0.031 20 0 "[ . 1 . 2]" 1
1488 1 67 ARG H 1 67 ARG QB 2.800 . 2.800 2.107 1.797 2.280 0.003 8 0 "[ . 1 . 2]" 1
1489 1 67 ARG H 1 67 ARG QG 4.500 . 4.500 3.008 1.815 4.014 . 0 0 "[ . 1 . 2]" 1
1490 1 67 ARG H 1 68 GLU H 3.500 . 3.500 2.647 2.405 2.873 . 0 0 "[ . 1 . 2]" 1
1491 1 67 ARG H 1 97 VAL MG1 4.500 . 4.500 3.060 2.671 4.197 . 0 0 "[ . 1 . 2]" 1
1492 1 67 ARG HA 1 67 ARG QB 2.800 . 2.800 2.429 2.214 2.537 . 0 0 "[ . 1 . 2]" 1
1493 1 67 ARG HA 1 67 ARG QD 4.500 . 4.500 4.028 2.742 4.414 . 0 0 "[ . 1 . 2]" 1
1494 1 67 ARG HA 1 67 ARG QG 3.500 . 3.500 2.318 2.018 2.750 . 0 0 "[ . 1 . 2]" 1
1495 1 67 ARG HA 1 68 GLU H 3.500 . 3.500 3.336 2.914 3.499 . 0 0 "[ . 1 . 2]" 1
1496 1 67 ARG HA 1 70 ILE H 5.500 . 5.500 3.420 3.060 4.224 . 0 0 "[ . 1 . 2]" 1
1497 1 67 ARG HA 1 71 ALA HA 3.500 . 3.500 2.851 2.094 3.340 . 0 0 "[ . 1 . 2]" 1
1498 1 67 ARG HA 1 71 ALA MB 4.500 . 4.500 4.098 3.366 4.508 0.008 18 0 "[ . 1 . 2]" 1
1499 1 67 ARG HA 1 97 VAL HB 4.500 . 4.500 3.122 2.496 3.749 . 0 0 "[ . 1 . 2]" 1
1500 1 67 ARG HA 1 97 VAL MG1 3.500 . 3.500 2.737 2.346 3.184 . 0 0 "[ . 1 . 2]" 1
1501 1 67 ARG HA 1 97 VAL MG2 4.500 . 4.500 3.380 2.629 4.249 . 0 0 "[ . 1 . 2]" 1
1502 1 67 ARG QB 1 68 GLU H 3.500 . 3.500 3.272 3.015 3.615 0.115 15 0 "[ . 1 . 2]" 1
1503 1 67 ARG QB 1 71 ALA HA 5.500 . 5.500 3.674 2.574 4.923 . 0 0 "[ . 1 . 2]" 1
1504 1 67 ARG QB 1 97 VAL MG1 3.500 . 3.500 3.212 2.009 3.617 0.117 11 0 "[ . 1 . 2]" 1
1505 1 67 ARG QB 1 97 VAL MG2 5.500 . 5.500 4.576 3.807 5.448 . 0 0 "[ . 1 . 2]" 1
1506 1 67 ARG HB3 1 71 ALA HA 3.500 . 3.500 2.472 1.981 3.511 0.011 15 0 "[ . 1 . 2]" 1
1507 1 67 ARG QD 1 71 ALA MB 5.500 . 5.500 4.097 3.054 5.508 0.008 8 0 "[ . 1 . 2]" 1
1508 1 67 ARG QD 1 97 VAL MG1 4.500 . 4.500 3.465 2.038 4.550 0.050 1 0 "[ . 1 . 2]" 1
1509 1 67 ARG QG 1 68 GLU H 4.500 . 4.500 4.378 3.849 4.583 0.083 20 0 "[ . 1 . 2]" 1
1510 1 67 ARG QG 1 71 ALA HA 5.500 . 5.500 2.662 1.983 4.233 . 0 0 "[ . 1 . 2]" 1
1511 1 67 ARG QG 1 97 VAL HB 4.500 . 4.500 2.270 1.916 3.203 . 0 0 "[ . 1 . 2]" 1
1512 1 67 ARG QG 1 97 VAL HB 5.500 . 5.500 2.303 1.923 3.471 . 0 0 "[ . 1 . 2]" 1
1513 1 67 ARG QG 1 97 VAL MG1 4.500 . 4.500 2.311 1.832 3.703 . 0 0 "[ . 1 . 2]" 1
1514 1 67 ARG QG 1 97 VAL MG2 4.500 . 4.500 3.555 2.852 4.501 0.001 10 0 "[ . 1 . 2]" 1
1515 1 68 GLU H 1 68 GLU HA 2.800 . 2.800 2.877 2.851 2.950 0.150 15 0 "[ . 1 . 2]" 1
1516 1 68 GLU H 1 68 GLU QB 2.800 . 2.800 2.575 2.295 2.811 0.011 15 0 "[ . 1 . 2]" 1
1517 1 68 GLU H 1 68 GLU QG 2.800 . 2.800 2.117 1.796 2.790 0.004 12 0 "[ . 1 . 2]" 1
1518 1 68 GLU H 1 69 VAL H 2.800 . 2.800 2.284 1.986 2.450 . 0 0 "[ . 1 . 2]" 1
1519 1 68 GLU H 1 69 VAL HB 5.500 . 5.500 4.635 4.285 5.076 . 0 0 "[ . 1 . 2]" 1
1520 1 68 GLU H 1 69 VAL MG1 5.500 . 5.500 5.574 5.387 5.635 0.135 9 0 "[ . 1 . 2]" 1
1521 1 68 GLU H 1 69 VAL MG2 3.500 . 3.500 3.459 3.237 3.574 0.074 4 0 "[ . 1 . 2]" 1
1522 1 68 GLU H 1 70 ILE H 5.500 . 5.500 4.164 3.333 4.670 . 0 0 "[ . 1 . 2]" 1
1523 1 68 GLU HA 1 68 GLU QB 2.800 . 2.800 2.295 2.223 2.402 . 0 0 "[ . 1 . 2]" 1
1524 1 68 GLU HA 1 68 GLU QG . . 2.800 2.598 2.325 2.879 0.079 19 0 "[ . 1 . 2]" 1
1525 1 68 GLU HA 1 69 VAL H 2.800 . 2.800 2.788 2.765 2.804 0.004 12 0 "[ . 1 . 2]" 1
1526 1 68 GLU QB 1 69 VAL H 2.800 . 2.800 2.819 2.565 2.891 0.091 1 0 "[ . 1 . 2]" 1
1527 1 68 GLU QB 1 69 VAL MG2 3.500 . 3.500 2.615 2.066 3.210 . 0 0 "[ . 1 . 2]" 1
1528 1 68 GLU QG 1 69 VAL H 4.500 . 4.500 3.778 3.388 4.409 . 0 0 "[ . 1 . 2]" 1
1529 1 68 GLU QG 1 69 VAL H 2.800 . 2.800 2.539 2.416 2.729 . 0 0 "[ . 1 . 2]" 1
1530 1 68 GLU HG2 1 69 VAL MG2 5.500 . 5.500 4.895 4.518 5.429 . 0 0 "[ . 1 . 2]" 1
1531 1 69 VAL H 1 69 VAL HB 2.800 . 2.800 2.586 2.449 2.809 0.009 11 0 "[ . 1 . 2]" 1
1532 1 69 VAL H 1 69 VAL MG1 4.500 . 4.500 3.767 3.718 3.849 . 0 0 "[ . 1 . 2]" 1
1533 1 69 VAL H 1 69 VAL MG2 2.800 . 2.800 2.163 1.914 2.501 . 0 0 "[ . 1 . 2]" 1
1534 1 69 VAL H 1 70 ILE H 2.800 . 2.800 2.438 2.328 2.802 0.002 4 0 "[ . 1 . 2]" 1
1535 1 69 VAL H 1 70 ILE MG 5.500 . 5.500 5.554 5.511 5.610 0.110 11 0 "[ . 1 . 2]" 1
1536 1 69 VAL HA 1 69 VAL MG1 2.800 . 2.800 2.283 2.169 2.416 . 0 0 "[ . 1 . 2]" 1
1537 1 69 VAL HA 1 69 VAL MG2 2.800 . 2.800 2.500 2.383 2.640 . 0 0 "[ . 1 . 2]" 1
1538 1 69 VAL HA 1 70 ILE H 4.500 . 4.500 3.574 3.522 3.617 . 0 0 "[ . 1 . 2]" 1
1539 1 69 VAL HA 1 70 ILE H 2.800 . 2.800 2.819 2.799 2.846 0.046 20 0 "[ . 1 . 2]" 1
1540 1 69 VAL HB 1 70 ILE H 3.500 . 3.500 2.172 1.868 2.437 . 0 0 "[ . 1 . 2]" 1
1541 1 69 VAL MG1 1 70 ILE H 3.500 . 3.500 3.340 2.740 3.566 0.066 12 0 "[ . 1 . 2]" 1
1542 1 69 VAL MG1 1 70 ILE HB 4.500 . 4.500 3.456 2.896 4.110 . 0 0 "[ . 1 . 2]" 1
1543 1 69 VAL MG1 1 70 ILE HG12 4.500 . 4.500 3.872 2.916 4.305 . 0 0 "[ . 1 . 2]" 1
1544 1 69 VAL MG1 1 73 TYR QE 5.500 . 5.500 4.038 3.478 4.650 . 0 0 "[ . 1 . 2]" 1
1545 1 69 VAL MG1 1 70 ILE HG13 2.800 . 2.800 2.525 2.206 2.801 0.001 11 0 "[ . 1 . 2]" 1
1546 1 69 VAL MG1 1 70 ILE MG 5.500 . 5.500 4.522 4.152 4.806 . 0 0 "[ . 1 . 2]" 1
1547 1 69 VAL MG2 1 70 ILE H 4.500 . 4.500 3.511 3.130 3.723 . 0 0 "[ . 1 . 2]" 1
1548 1 69 VAL MG2 1 70 ILE H 3.500 . 3.500 3.332 3.053 3.501 0.001 20 0 "[ . 1 . 2]" 1
1549 1 70 ILE H 1 70 ILE HB 3.500 . 3.500 2.479 2.161 2.647 . 0 0 "[ . 1 . 2]" 1
1550 1 70 ILE H 1 70 ILE MD 4.500 . 4.500 4.503 4.235 4.591 0.091 1 0 "[ . 1 . 2]" 1
1551 1 70 ILE H 1 70 ILE HG13 5.500 . 5.500 3.635 3.041 3.814 . 0 0 "[ . 1 . 2]" 1
1552 1 70 ILE H 1 70 ILE MG 3.500 . 3.500 3.561 3.513 3.628 0.128 2 0 "[ . 1 . 2]" 1
1553 1 70 ILE H 1 71 ALA H 5.500 . 5.500 4.213 4.011 4.432 . 0 0 "[ . 1 . 2]" 1
1554 1 70 ILE HA 1 70 ILE MD 4.500 . 4.500 3.570 3.177 3.713 . 0 0 "[ . 1 . 2]" 1
1555 1 70 ILE HA 1 70 ILE HG12 3.500 . 3.500 2.204 2.084 2.347 . 0 0 "[ . 1 . 2]" 1
1556 1 70 ILE HA 1 70 ILE HG13 3.500 . 3.500 3.017 2.799 3.447 . 0 0 "[ . 1 . 2]" 1
1557 1 70 ILE HA 1 70 ILE HG13 3.500 . 3.500 2.929 2.746 3.276 . 0 0 "[ . 1 . 2]" 1
1558 1 70 ILE HA 1 70 ILE MG 3.500 . 3.500 2.621 2.464 2.703 . 0 0 "[ . 1 . 2]" 1
1559 1 70 ILE HA 1 71 ALA H 3.500 . 3.500 2.135 2.105 2.164 . 0 0 "[ . 1 . 2]" 1
1560 1 70 ILE HA 1 71 ALA MB 4.500 . 4.500 4.000 3.922 4.090 . 0 0 "[ . 1 . 2]" 1
1561 1 70 ILE HA 1 72 VAL H 3.500 . 3.500 3.563 3.477 3.623 0.123 16 0 "[ . 1 . 2]" 1
1562 1 70 ILE HB 1 70 ILE MD . . 2.800 2.558 2.410 2.865 0.065 2 0 "[ . 1 . 2]" 1
1563 1 70 ILE HB 1 71 ALA H 3.500 . 3.500 2.301 2.205 2.405 . 0 0 "[ . 1 . 2]" 1
1564 1 70 ILE HB 1 73 TYR QE 5.500 . 5.500 3.130 2.550 3.868 . 0 0 "[ . 1 . 2]" 1
1565 1 70 ILE MD 1 70 ILE MG 2.800 . 2.800 1.789 1.755 1.804 0.045 2 0 "[ . 1 . 2]" 1
1566 1 70 ILE MD 1 71 ALA H 4.500 . 4.500 4.518 4.451 4.564 0.064 16 0 "[ . 1 . 2]" 1
1567 1 70 ILE MD 1 72 VAL H 3.500 . 3.500 3.567 3.531 3.614 0.114 16 0 "[ . 1 . 2]" 1
1568 1 70 ILE MD 1 73 TYR HA 5.500 . 5.500 2.763 2.494 3.010 . 0 0 "[ . 1 . 2]" 1
1569 1 70 ILE MD 1 73 TYR QD 5.500 . 5.500 2.566 2.277 2.872 . 0 0 "[ . 1 . 2]" 1
1570 1 70 ILE MD 1 73 TYR QE 3.500 . 3.500 2.401 2.143 2.662 . 0 0 "[ . 1 . 2]" 1
1571 1 70 ILE HG12 1 70 ILE MG 3.500 . 3.500 2.597 2.403 2.919 . 0 0 "[ . 1 . 2]" 1
1572 1 70 ILE MG 1 71 ALA H 4.500 . 4.500 2.642 2.401 3.054 . 0 0 "[ . 1 . 2]" 1
1573 1 70 ILE MG 1 72 VAL H 2.800 . 2.800 1.965 1.814 2.468 . 0 0 "[ . 1 . 2]" 1
1574 1 70 ILE MG 1 72 VAL H 3.500 . 3.500 1.917 1.792 2.268 0.008 5 0 "[ . 1 . 2]" 1
1575 1 70 ILE MG 1 73 TYR HA 5.500 . 5.500 2.679 2.297 3.341 . 0 0 "[ . 1 . 2]" 1
1576 1 70 ILE MG 1 73 TYR QD 3.500 . 3.500 2.706 2.564 2.989 . 0 0 "[ . 1 . 2]" 1
1577 1 70 ILE MG 1 73 TYR QE . . 2.800 2.748 2.635 2.865 0.065 18 0 "[ . 1 . 2]" 1
1578 1 71 ALA H 1 71 ALA MB 2.800 . 2.800 2.310 2.212 2.418 . 0 0 "[ . 1 . 2]" 1
1579 1 71 ALA H 1 72 VAL H . . 2.800 2.126 1.967 2.304 . 0 0 "[ . 1 . 2]" 1
1580 1 71 ALA HA 1 72 VAL H 3.500 . 3.500 3.470 3.432 3.508 0.008 2 0 "[ . 1 . 2]" 1
1581 1 71 ALA HA 1 97 VAL H 2.800 . 2.800 2.168 2.115 2.201 . 0 0 "[ . 1 . 2]" 1
1582 1 71 ALA HA 1 97 VAL HB 4.500 . 4.500 2.489 2.199 3.261 . 0 0 "[ . 1 . 2]" 1
1583 1 71 ALA HA 1 97 VAL MG1 5.500 . 5.500 3.810 3.521 4.438 . 0 0 "[ . 1 . 2]" 1
1584 1 71 ALA HA 1 97 VAL MG2 4.500 . 4.500 3.026 2.270 3.297 . 0 0 "[ . 1 . 2]" 1
1585 1 71 ALA MB 1 72 VAL H 2.800 . 2.800 2.799 2.634 2.846 0.046 14 0 "[ . 1 . 2]" 1
1586 1 71 ALA MB 1 72 VAL MG1 2.800 . 2.800 2.530 2.271 2.818 0.018 11 0 "[ . 1 . 2]" 1
1587 1 71 ALA MB 1 72 VAL MG2 5.500 . 5.500 4.637 4.550 4.708 . 0 0 "[ . 1 . 2]" 1
1588 1 71 ALA MB 1 72 VAL MG2 4.500 . 4.500 3.637 3.383 3.964 . 0 0 "[ . 1 . 2]" 1
1589 1 71 ALA MB 1 97 VAL H 5.500 . 5.500 3.969 3.725 4.274 . 0 0 "[ . 1 . 2]" 1
1590 1 71 ALA MB 1 97 VAL HB 4.500 . 4.500 3.894 3.580 4.493 . 0 0 "[ . 1 . 2]" 1
1591 1 72 VAL H 1 72 VAL HB 3.500 . 3.500 3.507 3.448 3.531 0.031 6 0 "[ . 1 . 2]" 1
1592 1 72 VAL H 1 72 VAL MG1 2.800 . 2.800 2.337 2.175 2.463 . 0 0 "[ . 1 . 2]" 1
1593 1 72 VAL H 1 72 VAL MG2 4.500 . 4.500 3.904 3.790 3.977 . 0 0 "[ . 1 . 2]" 1
1594 1 72 VAL H 1 97 VAL MG2 5.500 . 5.500 3.536 3.176 3.815 . 0 0 "[ . 1 . 2]" 1
1595 1 72 VAL HA 1 72 VAL MG1 3.500 . 3.500 3.218 3.199 3.240 . 0 0 "[ . 1 . 2]" 1
1596 1 72 VAL HA 1 72 VAL MG2 3.500 . 3.500 2.503 2.424 2.568 . 0 0 "[ . 1 . 2]" 1
1597 1 72 VAL HA 1 73 TYR HA 5.500 . 5.500 4.468 4.432 4.500 . 0 0 "[ . 1 . 2]" 1
1598 1 72 VAL HA 1 73 TYR QD 5.500 . 5.500 3.315 3.099 3.599 . 0 0 "[ . 1 . 2]" 1
1599 1 72 VAL HA 1 95 VAL H 5.500 . 5.500 4.543 4.175 4.693 . 0 0 "[ . 1 . 2]" 1
1600 1 72 VAL HA 1 96 ILE HA . . 3.500 2.135 1.946 2.310 . 0 0 "[ . 1 . 2]" 1
1601 1 72 VAL HA 1 96 ILE MG 5.500 . 5.500 3.806 3.391 4.106 . 0 0 "[ . 1 . 2]" 1
1602 1 72 VAL MG1 1 74 GLN QE 5.500 . 5.500 5.009 3.748 5.527 0.027 16 0 "[ . 1 . 2]" 1
1603 1 72 VAL MG1 1 95 VAL H 5.500 . 5.500 5.325 5.083 5.519 0.019 19 0 "[ . 1 . 2]" 1
1604 1 72 VAL MG1 1 96 ILE HA 4.500 . 4.500 4.024 3.844 4.496 . 0 0 "[ . 1 . 2]" 1
1605 1 72 VAL MG2 1 73 TYR HA 5.500 . 5.500 3.290 3.046 3.459 . 0 0 "[ . 1 . 2]" 1
1606 1 72 VAL MG2 1 74 GLN H 4.500 . 4.500 3.946 3.432 4.356 . 0 0 "[ . 1 . 2]" 1
1607 1 72 VAL MG2 1 74 GLN QE 4.500 . 4.500 3.960 3.029 4.541 0.041 1 0 "[ . 1 . 2]" 1
1608 1 72 VAL MG2 1 94 GLU QB 3.500 . 3.500 2.466 2.124 2.764 . 0 0 "[ . 1 . 2]" 1
1609 1 72 VAL MG2 1 94 GLU QB 2.800 . 2.800 2.169 1.994 2.300 . 0 0 "[ . 1 . 2]" 1
1610 1 72 VAL MG2 1 94 GLU QG 3.500 . 3.500 3.426 2.626 3.517 0.017 20 0 "[ . 1 . 2]" 1
1611 1 72 VAL MG2 1 95 VAL H 3.500 . 3.500 2.832 2.578 3.030 . 0 0 "[ . 1 . 2]" 1
1612 1 72 VAL MG2 1 96 ILE HA 5.500 . 5.500 2.646 2.410 3.575 . 0 0 "[ . 1 . 2]" 1
1613 1 72 VAL MG2 1 96 ILE HG13 4.500 . 4.500 2.410 2.065 3.896 . 0 0 "[ . 1 . 2]" 1
1614 1 73 TYR H 1 95 VAL O 1.900 . 2.300 1.749 1.734 1.789 0.066 2 0 "[ . 1 . 2]" 1
1615 1 73 TYR HA 1 73 TYR QD 3.500 . 3.500 3.071 2.928 3.166 . 0 0 "[ . 1 . 2]" 1
1616 1 73 TYR HA 1 74 GLN H 2.800 . 2.800 2.118 2.048 2.199 . 0 0 "[ . 1 . 2]" 1
1617 1 73 TYR HA 1 95 VAL H 4.500 . 4.500 3.504 3.209 3.696 . 0 0 "[ . 1 . 2]" 1
1618 1 73 TYR HA 1 75 LEU MD1 5.500 . 5.500 3.898 3.601 4.150 . 0 0 "[ . 1 . 2]" 1
1619 1 73 TYR HA 1 95 VAL HB 5.500 . 5.500 4.582 4.408 4.776 . 0 0 "[ . 1 . 2]" 1
1620 1 73 TYR HB2 1 73 TYR QD . . 2.800 2.535 2.472 2.591 . 0 0 "[ . 1 . 2]" 1
1621 1 73 TYR HB2 1 74 GLN H 4.500 . 4.500 4.190 3.945 4.364 . 0 0 "[ . 1 . 2]" 1
1622 1 73 TYR HB2 1 74 GLN HA 5.500 . 5.500 4.882 4.687 5.103 . 0 0 "[ . 1 . 2]" 1
1623 1 73 TYR HB2 1 75 LEU MD1 4.500 . 4.500 3.228 3.068 3.432 . 0 0 "[ . 1 . 2]" 1
1624 1 73 TYR HB2 1 75 LEU MD1 4.500 . 4.500 2.889 2.643 3.130 . 0 0 "[ . 1 . 2]" 1
1625 1 73 TYR HB2 1 75 LEU MD2 4.500 . 4.500 2.201 1.984 2.369 . 0 0 "[ . 1 . 2]" 1
1626 1 73 TYR HB2 1 75 LEU HG 5.500 . 5.500 4.811 4.475 5.174 . 0 0 "[ . 1 . 2]" 1
1627 1 73 TYR HB2 1 95 VAL H 4.500 . 4.500 3.243 3.068 3.470 . 0 0 "[ . 1 . 2]" 1
1628 1 73 TYR HB2 1 95 VAL HB 3.500 . 3.500 1.938 1.859 2.128 . 0 0 "[ . 1 . 2]" 1
1629 1 73 TYR HB2 1 95 VAL MG1 4.500 . 4.500 3.279 2.833 3.622 . 0 0 "[ . 1 . 2]" 1
1630 1 73 TYR HB2 1 95 VAL MG2 4.500 . 4.500 3.103 2.776 3.507 . 0 0 "[ . 1 . 2]" 1
1631 1 73 TYR HB3 1 73 TYR QD . . 2.800 2.336 2.308 2.371 . 0 0 "[ . 1 . 2]" 1
1632 1 73 TYR HB3 1 74 GLN H 3.500 . 3.500 3.375 2.955 3.547 0.047 1 0 "[ . 1 . 2]" 1
1633 1 73 TYR HB3 1 75 LEU MD1 3.500 . 3.500 2.308 2.139 2.483 . 0 0 "[ . 1 . 2]" 1
1634 1 73 TYR HB3 1 75 LEU MD1 4.500 . 4.500 2.302 2.135 2.474 . 0 0 "[ . 1 . 2]" 1
1635 1 73 TYR HB3 1 75 LEU MD2 5.500 . 5.500 2.572 2.246 2.846 . 0 0 "[ . 1 . 2]" 1
1636 1 73 TYR HB3 1 75 LEU MD2 4.500 . 4.500 2.549 2.228 2.817 . 0 0 "[ . 1 . 2]" 1
1637 1 73 TYR HB3 1 95 VAL H 5.500 . 5.500 4.516 4.217 4.734 . 0 0 "[ . 1 . 2]" 1
1638 1 73 TYR HB3 1 95 VAL HB 4.500 . 4.500 3.659 3.546 3.845 . 0 0 "[ . 1 . 2]" 1
1639 1 73 TYR HB3 1 95 VAL MG1 5.500 . 5.500 4.639 4.223 4.981 . 0 0 "[ . 1 . 2]" 1
1640 1 73 TYR HB3 1 95 VAL MG2 5.500 . 5.500 4.221 3.706 4.709 . 0 0 "[ . 1 . 2]" 1
1641 1 73 TYR QD 1 74 GLN H 4.500 . 4.500 4.461 4.232 4.559 0.059 15 0 "[ . 1 . 2]" 1
1642 1 73 TYR QD 1 75 LEU MD1 5.500 . 5.500 3.428 3.062 3.704 . 0 0 "[ . 1 . 2]" 1
1643 1 73 TYR QD 1 75 LEU MD1 2.800 . 2.800 2.383 1.987 2.814 0.014 11 0 "[ . 1 . 2]" 1
1644 1 73 TYR QD 1 95 VAL H 4.500 . 4.500 4.383 4.109 4.538 0.038 17 0 "[ . 1 . 2]" 1
1645 1 73 TYR QD 1 95 VAL HB . . 3.500 2.729 2.389 3.194 . 0 0 "[ . 1 . 2]" 1
1646 1 73 TYR QD 1 95 VAL MG1 4.500 . 4.500 2.457 1.997 3.280 . 0 0 "[ . 1 . 2]" 1
1647 1 73 TYR QD 1 95 VAL MG2 5.500 . 5.500 4.136 3.857 4.382 . 0 0 "[ . 1 . 2]" 1
1648 1 73 TYR QD 1 97 VAL MG2 . . 3.500 2.722 2.521 2.981 . 0 0 "[ . 1 . 2]" 1
1649 1 73 TYR QE 1 95 VAL MG1 5.500 . 5.500 3.698 3.379 4.568 . 0 0 "[ . 1 . 2]" 1
1650 1 73 TYR QE 1 97 VAL MG2 . . 2.800 1.907 1.821 2.099 . 0 0 "[ . 1 . 2]" 1
1651 1 73 TYR N 1 95 VAL O 2.800 2.700 3.300 2.679 2.668 2.691 0.032 6 0 "[ . 1 . 2]" 1
1652 1 73 TYR O 1 95 VAL H 1.900 . 2.300 1.860 1.754 1.988 0.046 12 0 "[ . 1 . 2]" 1
1653 1 73 TYR O 1 95 VAL N 2.800 2.700 3.300 2.834 2.725 2.967 . 0 0 "[ . 1 . 2]" 1
1654 1 74 GLN H 1 74 GLN HB2 3.500 . 3.500 2.616 2.029 3.214 . 0 0 "[ . 1 . 2]" 1
1655 1 74 GLN H 1 74 GLN HB3 3.500 . 3.500 2.840 2.398 3.559 0.059 1 0 "[ . 1 . 2]" 1
1656 1 74 GLN H 1 74 GLN HB3 2.800 . 2.800 2.629 2.097 2.958 0.158 18 0 "[ . 1 . 2]" 1
1657 1 74 GLN H 1 75 LEU H 4.500 . 4.500 4.000 3.871 4.160 . 0 0 "[ . 1 . 2]" 1
1658 1 74 GLN H 1 75 LEU MD1 4.500 . 4.500 3.474 3.284 3.637 . 0 0 "[ . 1 . 2]" 1
1659 1 74 GLN H 1 75 LEU MD2 4.500 . 4.500 4.261 3.941 4.513 0.013 7 0 "[ . 1 . 2]" 1
1660 1 74 GLN HA 1 74 GLN HB2 . . 2.800 2.662 2.454 2.966 0.166 19 0 "[ . 1 . 2]" 1
1661 1 74 GLN HA 1 74 GLN HB3 2.800 . 2.800 2.387 2.066 2.637 . 0 0 "[ . 1 . 2]" 1
1662 1 74 GLN HA 1 74 GLN QE . . 3.500 2.732 1.799 3.525 0.025 6 0 "[ . 1 . 2]" 1
1663 1 74 GLN HA 1 74 GLN QG 2.800 . 2.800 2.482 2.113 2.781 . 0 0 "[ . 1 . 2]" 1
1664 1 74 GLN HA 1 75 LEU H 2.800 . 2.800 2.306 2.191 2.385 . 0 0 "[ . 1 . 2]" 1
1665 1 74 GLN HA 1 93 LEU H 2.800 . 2.800 2.231 2.149 2.311 . 0 0 "[ . 1 . 2]" 1
1666 1 74 GLN HA 1 94 GLU HA 2.800 . 2.800 2.651 2.295 2.828 0.028 20 0 "[ . 1 . 2]" 1
1667 1 74 GLN HA 1 94 GLU QB 4.500 . 4.500 4.328 3.953 4.520 0.020 17 0 "[ . 1 . 2]" 1
1668 1 74 GLN HA 1 94 GLU QG 4.500 . 4.500 3.403 2.841 3.846 . 0 0 "[ . 1 . 2]" 1
1669 1 74 GLN QB 1 76 PHE HZ 3.500 . 3.500 2.977 2.357 3.523 0.023 10 0 "[ . 1 . 2]" 1
1670 1 74 GLN QB 1 75 LEU H 4.500 . 4.500 3.979 3.670 4.075 . 0 0 "[ . 1 . 2]" 1
1671 1 74 GLN HB3 1 74 GLN QE 2.800 . 2.800 2.338 1.806 2.679 . 0 0 "[ . 1 . 2]" 1
1672 1 74 GLN HB3 1 75 LEU H 5.500 . 5.500 4.353 4.114 4.493 . 0 0 "[ . 1 . 2]" 1
1673 1 74 GLN HB3 1 76 PHE HZ 5.500 . 5.500 4.425 3.604 5.318 . 0 0 "[ . 1 . 2]" 1
1674 1 74 GLN QG 1 76 PHE HZ 5.500 . 5.500 3.391 2.395 5.234 . 0 0 "[ . 1 . 2]" 1
1675 1 75 LEU H 1 75 LEU HB2 3.500 . 3.500 2.368 2.314 2.459 . 0 0 "[ . 1 . 2]" 1
1676 1 75 LEU H 1 75 LEU HB3 3.500 . 3.500 3.572 3.555 3.593 0.093 16 0 "[ . 1 . 2]" 1
1677 1 75 LEU H 1 75 LEU MD1 2.800 . 2.800 2.815 2.772 2.841 0.041 17 0 "[ . 1 . 2]" 1
1678 1 75 LEU H 1 75 LEU MD2 3.500 . 3.500 2.294 1.923 2.825 . 0 0 "[ . 1 . 2]" 1
1679 1 75 LEU H 1 75 LEU HG 4.500 . 4.500 4.224 4.020 4.428 . 0 0 "[ . 1 . 2]" 1
1680 1 75 LEU H 1 76 PHE H 5.500 . 5.500 4.420 4.369 4.454 . 0 0 "[ . 1 . 2]" 1
1681 1 75 LEU H 1 93 LEU H 4.500 . 4.500 3.371 3.001 3.702 . 0 0 "[ . 1 . 2]" 1
1682 1 75 LEU H 1 93 LEU H 4.500 . 4.500 3.225 2.943 3.460 . 0 0 "[ . 1 . 2]" 1
1683 1 75 LEU H 1 93 LEU HG 5.500 . 5.500 3.030 2.920 3.189 . 0 0 "[ . 1 . 2]" 1
1684 1 75 LEU H 1 93 LEU O 1.900 . 2.300 1.875 1.758 2.226 0.042 7 0 "[ . 1 . 2]" 1
1685 1 75 LEU HA 1 75 LEU MD1 2.800 . 2.800 1.919 1.885 1.972 . 0 0 "[ . 1 . 2]" 1
1686 1 75 LEU HA 1 75 LEU HG . . 4.500 3.403 3.241 3.558 . 0 0 "[ . 1 . 2]" 1
1687 1 75 LEU HA 1 76 PHE H 2.800 . 2.800 2.348 2.327 2.381 . 0 0 "[ . 1 . 2]" 1
1688 1 75 LEU HA 1 76 PHE QD 5.500 . 5.500 3.314 2.825 4.066 . 0 0 "[ . 1 . 2]" 1
1689 1 75 LEU HB2 1 75 LEU MD1 . . 3.500 3.141 3.064 3.202 . 0 0 "[ . 1 . 2]" 1
1690 1 75 LEU HB2 1 75 LEU MD2 . . 3.500 2.142 2.101 2.169 . 0 0 "[ . 1 . 2]" 1
1691 1 75 LEU HB2 1 76 PHE H 3.500 . 3.500 3.447 3.342 3.511 0.011 14 0 "[ . 1 . 2]" 1
1692 1 75 LEU HB2 1 93 LEU MD2 4.500 . 4.500 2.447 2.214 2.971 . 0 0 "[ . 1 . 2]" 1
1693 1 75 LEU HB3 1 75 LEU MD1 . . 3.500 2.868 2.701 3.001 . 0 0 "[ . 1 . 2]" 1
1694 1 75 LEU HB3 1 75 LEU MD2 3.500 . 3.500 3.015 2.924 3.085 . 0 0 "[ . 1 . 2]" 1
1695 1 75 LEU HB3 1 76 PHE H 3.500 . 3.500 2.157 2.120 2.179 . 0 0 "[ . 1 . 2]" 1
1696 1 75 LEU HB3 1 93 LEU HB2 5.500 . 5.500 4.721 4.404 5.089 . 0 0 "[ . 1 . 2]" 1
1697 1 75 LEU HB3 1 93 LEU HB3 3.500 . 3.500 3.125 2.853 3.434 . 0 0 "[ . 1 . 2]" 1
1698 1 75 LEU HB3 1 93 LEU MD1 5.500 . 5.500 5.315 5.116 5.519 0.019 1 0 "[ . 1 . 2]" 1
1699 1 75 LEU HB3 1 93 LEU MD2 4.500 . 4.500 3.135 2.824 3.543 . 0 0 "[ . 1 . 2]" 1
1700 1 75 LEU MD1 1 75 LEU MD2 2.800 . 2.800 2.053 2.038 2.067 . 0 0 "[ . 1 . 2]" 1
1701 1 75 LEU MD1 1 76 PHE H 3.500 . 3.500 3.434 3.353 3.503 0.003 13 0 "[ . 1 . 2]" 1
1702 1 75 LEU MD2 1 76 PHE H 4.500 . 4.500 4.589 4.575 4.600 0.100 12 0 "[ . 1 . 2]" 1
1703 1 75 LEU MD2 1 93 LEU HB2 5.500 . 5.500 4.791 4.408 5.189 . 0 0 "[ . 1 . 2]" 1
1704 1 75 LEU MD2 1 93 LEU HB3 4.500 . 4.500 3.705 3.351 4.146 . 0 0 "[ . 1 . 2]" 1
1705 1 75 LEU MD2 1 93 LEU HB3 4.500 . 4.500 2.615 2.181 3.080 . 0 0 "[ . 1 . 2]" 1
1706 1 75 LEU MD2 1 93 LEU MD1 3.500 . 3.500 2.612 2.336 3.327 . 0 0 "[ . 1 . 2]" 1
1707 1 75 LEU MD2 1 93 LEU MD2 . . 3.500 2.343 2.077 2.993 . 0 0 "[ . 1 . 2]" 1
1708 1 75 LEU MD2 1 93 LEU HG 4.500 . 4.500 2.142 1.940 2.508 . 0 0 "[ . 1 . 2]" 1
1709 1 75 LEU HG 1 95 VAL MG2 4.500 . 4.500 3.891 3.612 4.038 . 0 0 "[ . 1 . 2]" 1
1710 1 75 LEU N 1 93 LEU O 2.800 2.700 3.300 2.670 2.590 2.828 0.110 1 0 "[ . 1 . 2]" 1
1711 1 75 LEU O 1 93 LEU H 1.900 . 2.300 1.762 1.727 1.799 0.073 16 0 "[ . 1 . 2]" 1
1712 1 75 LEU O 1 93 LEU N 2.800 2.700 3.300 2.654 2.616 2.694 0.084 17 0 "[ . 1 . 2]" 1
1713 1 76 PHE H 1 76 PHE QD 3.500 . 3.500 3.179 2.825 3.506 0.006 8 0 "[ . 1 . 2]" 1
1714 1 76 PHE H 1 77 VAL H 4.500 . 4.500 4.191 4.100 4.286 . 0 0 "[ . 1 . 2]" 1
1715 1 76 PHE H 1 93 LEU HB3 5.500 . 5.500 4.123 3.901 4.384 . 0 0 "[ . 1 . 2]" 1
1716 1 76 PHE HA 1 76 PHE QD 3.500 . 3.500 2.791 2.345 3.071 . 0 0 "[ . 1 . 2]" 1
1717 1 76 PHE HA 1 77 VAL H 2.800 . 2.800 2.165 2.132 2.221 . 0 0 "[ . 1 . 2]" 1
1718 1 76 PHE HA 1 77 VAL MG2 4.500 . 4.500 3.097 2.980 3.252 . 0 0 "[ . 1 . 2]" 1
1719 1 76 PHE HA 1 90 PRO HB3 5.500 . 5.500 4.923 4.561 5.506 0.006 2 0 "[ . 1 . 2]" 1
1720 1 76 PHE HA 1 92 PRO HA 3.500 . 3.500 2.261 2.081 2.395 . 0 0 "[ . 1 . 2]" 1
1721 1 76 PHE HA 1 93 LEU H 3.500 . 3.500 3.084 2.858 3.364 . 0 0 "[ . 1 . 2]" 1
1722 1 76 PHE HB2 1 76 PHE QD . . 2.800 2.435 2.330 2.543 . 0 0 "[ . 1 . 2]" 1
1723 1 76 PHE HB2 1 77 VAL H 4.500 . 4.500 4.175 3.984 4.324 . 0 0 "[ . 1 . 2]" 1
1724 1 76 PHE HB2 1 90 PRO HA 5.500 . 5.500 5.113 4.834 5.523 0.023 17 0 "[ . 1 . 2]" 1
1725 1 76 PHE HB2 1 90 PRO HB2 4.500 . 4.500 4.009 3.446 4.500 . 0 0 "[ . 1 . 2]" 1
1726 1 76 PHE HB2 1 90 PRO HB3 4.500 . 4.500 3.684 3.212 4.386 . 0 0 "[ . 1 . 2]" 1
1727 1 76 PHE HB3 1 77 VAL H 4.500 . 4.500 3.229 3.010 3.467 . 0 0 "[ . 1 . 2]" 1
1728 1 76 PHE HB3 1 90 PRO HA 5.500 . 5.500 3.687 3.353 4.105 . 0 0 "[ . 1 . 2]" 1
1729 1 76 PHE HB3 1 90 PRO HB2 3.500 . 3.500 2.581 2.005 3.139 . 0 0 "[ . 1 . 2]" 1
1730 1 76 PHE HB3 1 90 PRO HB3 3.500 . 3.500 2.609 2.254 3.241 . 0 0 "[ . 1 . 2]" 1
1731 1 76 PHE HB3 1 91 VAL H 5.500 . 5.500 4.303 3.869 4.603 . 0 0 "[ . 1 . 2]" 1
1732 1 76 PHE QD 1 77 VAL H 4.500 . 4.500 3.949 3.681 4.330 . 0 0 "[ . 1 . 2]" 1
1733 1 76 PHE QD 1 90 PRO HA 5.500 . 5.500 4.759 4.322 5.255 . 0 0 "[ . 1 . 2]" 1
1734 1 76 PHE QD 1 90 PRO HB2 . . 3.500 3.063 2.602 3.528 0.028 19 0 "[ . 1 . 2]" 1
1735 1 76 PHE QD 1 90 PRO HB3 4.500 . 4.500 4.126 3.652 4.384 . 0 0 "[ . 1 . 2]" 1
1736 1 76 PHE QD 1 92 PRO HA . . 3.500 2.662 2.250 2.941 . 0 0 "[ . 1 . 2]" 1
1737 1 76 PHE QD 1 92 PRO HB3 . . 3.500 3.395 3.121 3.523 0.023 15 0 "[ . 1 . 2]" 1
1738 1 76 PHE QD 1 93 LEU H 4.500 . 4.500 4.381 4.137 4.521 0.021 5 0 "[ . 1 . 2]" 1
1739 1 76 PHE QE 1 90 PRO HB2 5.500 . 5.500 4.842 4.444 5.235 . 0 0 "[ . 1 . 2]" 1
1740 1 76 PHE QE 1 92 PRO HA 5.500 . 5.500 3.532 3.308 4.034 . 0 0 "[ . 1 . 2]" 1
1741 1 76 PHE QE 1 92 PRO HB3 5.500 . 5.500 2.638 2.299 3.368 . 0 0 "[ . 1 . 2]" 1
1742 1 76 PHE QE 1 92 PRO HB3 3.500 . 3.500 2.576 2.266 3.279 . 0 0 "[ . 1 . 2]" 1
1743 1 76 PHE QE 1 92 PRO QG 4.500 . 4.500 3.648 3.058 4.511 0.011 18 0 "[ . 1 . 2]" 1
1744 1 76 PHE QE 1 93 LEU H 5.500 . 5.500 4.901 4.624 5.189 . 0 0 "[ . 1 . 2]" 1
1745 1 77 VAL H 1 77 VAL HB 3.500 . 3.500 3.100 3.058 3.152 . 0 0 "[ . 1 . 2]" 1
1746 1 77 VAL H 1 77 VAL QG 2.800 . 2.800 2.025 1.963 2.109 . 0 0 "[ . 1 . 2]" 1
1747 1 77 VAL H 1 78 GLU H 4.500 . 4.500 4.521 4.484 4.546 0.046 5 0 "[ . 1 . 2]" 1
1748 1 77 VAL H 1 78 GLU QG 5.500 . 5.500 4.307 4.059 4.521 . 0 0 "[ . 1 . 2]" 1
1749 1 77 VAL H 1 90 PRO HA 4.500 . 4.500 3.987 3.809 4.275 . 0 0 "[ . 1 . 2]" 1
1750 1 77 VAL H 1 91 VAL H 4.500 . 4.500 3.065 2.815 3.313 . 0 0 "[ . 1 . 2]" 1
1751 1 77 VAL H 1 91 VAL HB 4.500 . 4.500 4.253 3.989 4.381 . 0 0 "[ . 1 . 2]" 1
1752 1 77 VAL H 1 91 VAL O 1.900 . 2.300 1.746 1.700 1.781 0.100 14 0 "[ . 1 . 2]" 1
1753 1 77 VAL H 1 92 PRO HA 3.500 . 3.500 3.577 3.545 3.628 0.128 14 0 "[ . 1 . 2]" 1
1754 1 77 VAL HA 1 77 VAL HB 2.800 . 2.800 2.901 2.893 2.906 0.106 15 0 "[ . 1 . 2]" 1
1755 1 77 VAL HA 1 77 VAL MG1 2.800 . 2.800 2.098 2.003 2.167 . 0 0 "[ . 1 . 2]" 1
1756 1 77 VAL HA 1 77 VAL QG 2.800 . 2.800 2.046 1.964 2.103 . 0 0 "[ . 1 . 2]" 1
1757 1 77 VAL HA 1 77 VAL MG2 3.500 . 3.500 2.841 2.798 2.872 . 0 0 "[ . 1 . 2]" 1
1758 1 77 VAL HA 1 78 GLU H 2.800 . 2.800 2.248 2.169 2.318 . 0 0 "[ . 1 . 2]" 1
1759 1 77 VAL HA 1 78 GLU QB 4.500 . 4.500 3.453 2.952 3.644 . 0 0 "[ . 1 . 2]" 1
1760 1 77 VAL HB 1 78 GLU H 3.500 . 3.500 3.316 3.021 3.515 0.015 14 0 "[ . 1 . 2]" 1
1761 1 77 VAL HB 1 91 VAL HB 4.500 . 4.500 4.550 4.518 4.571 0.071 4 0 "[ . 1 . 2]" 1
1762 1 77 VAL HB 1 93 LEU HB2 5.500 . 5.500 4.601 4.472 4.746 . 0 0 "[ . 1 . 2]" 1
1763 1 77 VAL HB 1 93 LEU HB3 5.500 . 5.500 5.481 5.265 5.543 0.043 6 0 "[ . 1 . 2]" 1
1764 1 77 VAL QG 1 78 GLU H 2.800 . 2.800 2.471 2.177 2.721 . 0 0 "[ . 1 . 2]" 1
1765 1 77 VAL QG 1 93 LEU MD2 2.800 . 2.800 2.570 2.324 2.750 . 0 0 "[ . 1 . 2]" 1
1766 1 77 VAL MG1 1 78 GLU H 2.800 . 2.800 2.487 2.185 2.748 . 0 0 "[ . 1 . 2]" 1
1767 1 77 VAL MG1 1 78 GLU HA 5.500 . 5.500 4.482 4.370 4.616 . 0 0 "[ . 1 . 2]" 1
1768 1 77 VAL MG1 1 78 GLU HA 3.500 . 3.500 3.089 2.833 3.374 . 0 0 "[ . 1 . 2]" 1
1769 1 77 VAL MG2 1 78 GLU H 5.500 . 5.500 4.288 4.160 4.377 . 0 0 "[ . 1 . 2]" 1
1770 1 77 VAL MG2 1 91 VAL HB 3.500 . 3.500 3.529 3.519 3.549 0.049 20 0 "[ . 1 . 2]" 1
1771 1 77 VAL MG2 1 93 LEU HB2 4.500 . 4.500 2.190 2.032 2.361 . 0 0 "[ . 1 . 2]" 1
1772 1 77 VAL N 1 91 VAL O 2.800 2.700 3.300 2.638 2.615 2.664 0.085 20 0 "[ . 1 . 2]" 1
1773 1 77 VAL O 1 91 VAL H 1.900 . 2.300 1.763 1.701 1.845 0.099 3 0 "[ . 1 . 2]" 1
1774 1 77 VAL O 1 91 VAL N 2.800 2.700 3.300 2.662 2.625 2.702 0.075 4 0 "[ . 1 . 2]" 1
1775 1 78 GLU H 1 78 GLU QB 2.800 . 2.800 2.505 2.337 2.618 . 0 0 "[ . 1 . 2]" 1
1776 1 78 GLU H 1 79 THR H 4.500 . 4.500 4.333 4.278 4.404 . 0 0 "[ . 1 . 2]" 1
1777 1 78 GLU HA 1 79 THR H 2.800 . 2.800 2.240 2.151 2.298 . 0 0 "[ . 1 . 2]" 1
1778 1 78 GLU HA 1 79 THR H 2.800 . 2.800 2.178 2.104 2.226 . 0 0 "[ . 1 . 2]" 1
1779 1 78 GLU HA 1 86 THR MG 5.500 . 5.500 3.015 2.791 3.235 . 0 0 "[ . 1 . 2]" 1
1780 1 78 GLU HA 1 89 GLY H 4.500 . 4.500 4.477 4.205 4.564 0.064 15 0 "[ . 1 . 2]" 1
1781 1 78 GLU HA 1 89 GLY QA 4.500 . 4.500 2.083 1.923 2.351 . 0 0 "[ . 1 . 2]" 1
1782 1 78 GLU HA 1 89 GLY QA 3.500 . 3.500 2.052 1.911 2.257 . 0 0 "[ . 1 . 2]" 1
1783 1 78 GLU HA 1 91 VAL H 5.500 . 5.500 3.410 3.309 3.652 . 0 0 "[ . 1 . 2]" 1
1784 1 78 GLU QB 1 79 THR H 2.800 . 2.800 2.854 2.806 2.903 0.103 3 0 "[ . 1 . 2]" 1
1785 1 78 GLU QB 1 86 THR MG 2.800 . 2.800 1.811 1.773 1.932 0.027 18 0 "[ . 1 . 2]" 1
1786 1 78 GLU QB 1 89 GLY QA 5.500 . 5.500 2.460 2.083 2.787 . 0 0 "[ . 1 . 2]" 1
1787 1 78 GLU QB 1 90 PRO HA 3.500 . 3.500 1.901 1.836 2.078 . 0 0 "[ . 1 . 2]" 1
1788 1 78 GLU QB 1 79 THR H 4.500 . 4.500 2.910 2.871 2.950 . 0 0 "[ . 1 . 2]" 1
1789 1 78 GLU QB 1 80 THR MG . . 3.500 2.537 2.124 2.781 . 0 0 "[ . 1 . 2]" 1
1790 1 78 GLU QB 1 86 THR MG 4.500 . 4.500 1.903 1.786 2.035 0.014 1 0 "[ . 1 . 2]" 1
1791 1 78 GLU QB 1 90 PRO HA 4.500 . 4.500 3.683 3.004 3.957 . 0 0 "[ . 1 . 2]" 1
1792 1 78 GLU QG 1 79 THR H 5.500 . 5.500 4.148 3.921 4.510 . 0 0 "[ . 1 . 2]" 1
1793 1 78 GLU QG 1 86 THR MG 4.500 . 4.500 2.481 2.085 3.480 . 0 0 "[ . 1 . 2]" 1
1794 1 78 GLU QG 1 89 GLY QA 4.500 . 4.500 2.634 2.184 3.271 . 0 0 "[ . 1 . 2]" 1
1795 1 78 GLU QG 1 89 GLY QA 4.500 . 4.500 1.857 1.789 2.025 0.011 2 0 "[ . 1 . 2]" 1
1796 1 78 GLU QG 1 91 VAL H 3.500 . 3.500 3.494 3.213 3.594 0.094 15 0 "[ . 1 . 2]" 1
1797 1 79 THR H 1 86 THR MG 4.500 . 4.500 2.786 2.584 3.096 . 0 0 "[ . 1 . 2]" 1
1798 1 79 THR H 1 87 LEU H 4.500 . 4.500 3.683 3.347 3.876 . 0 0 "[ . 1 . 2]" 1
1799 1 79 THR H 1 86 THR MG 3.500 . 3.500 2.873 2.630 3.296 . 0 0 "[ . 1 . 2]" 1
1800 1 79 THR H 1 87 LEU H 5.500 . 5.500 3.945 3.453 4.313 . 0 0 "[ . 1 . 2]" 1
1801 1 79 THR H 1 87 LEU MD2 5.500 . 5.500 4.138 3.545 4.726 . 0 0 "[ . 1 . 2]" 1
1802 1 79 THR H 1 88 GLU H 3.500 . 3.500 2.743 2.474 3.022 . 0 0 "[ . 1 . 2]" 1
1803 1 79 THR H 1 88 GLU H 3.500 . 3.500 2.713 2.461 2.974 . 0 0 "[ . 1 . 2]" 1
1804 1 79 THR H 1 88 GLU QB 4.500 . 4.500 2.969 2.595 3.259 . 0 0 "[ . 1 . 2]" 1
1805 1 79 THR H 1 89 GLY QA 4.500 . 4.500 3.465 3.173 3.768 . 0 0 "[ . 1 . 2]" 1
1806 1 79 THR HA 1 79 THR HB . . 2.800 2.857 2.728 2.919 0.119 20 0 "[ . 1 . 2]" 1
1807 1 79 THR HA 1 79 THR MG 3.500 . 3.500 2.090 2.004 2.216 . 0 0 "[ . 1 . 2]" 1
1808 1 79 THR HA 1 80 THR H 2.800 . 2.800 2.179 2.110 2.291 . 0 0 "[ . 1 . 2]" 1
1809 1 79 THR HA 1 80 THR H 2.800 . 2.800 2.127 2.065 2.218 . 0 0 "[ . 1 . 2]" 1
1810 1 79 THR HA 1 88 GLU H 4.500 . 4.500 4.116 3.899 4.376 . 0 0 "[ . 1 . 2]" 1
1811 1 79 THR HA 1 87 LEU MD2 5.500 . 5.500 3.876 3.580 4.650 . 0 0 "[ . 1 . 2]" 1
1812 1 79 THR HB 1 80 THR H . . 3.500 3.514 3.134 3.604 0.104 1 0 "[ . 1 . 2]" 1
1813 1 79 THR HB 1 87 LEU HB2 4.500 . 4.500 2.801 1.950 3.614 . 0 0 "[ . 1 . 2]" 1
1814 1 79 THR HB 1 87 LEU MD2 3.500 . 3.500 2.277 1.855 3.490 . 0 0 "[ . 1 . 2]" 1
1815 1 79 THR HB 1 88 GLU H 4.500 . 4.500 3.204 2.733 3.980 . 0 0 "[ . 1 . 2]" 1
1816 1 79 THR HB 1 88 GLU QB 4.500 . 4.500 3.250 2.543 4.002 . 0 0 "[ . 1 . 2]" 1
1817 1 79 THR MG 1 80 THR H 3.500 . 3.500 3.007 2.650 3.390 . 0 0 "[ . 1 . 2]" 1
1818 1 80 THR H 1 80 THR MG 3.500 . 3.500 3.118 2.769 3.379 . 0 0 "[ . 1 . 2]" 1
1819 1 80 THR H 1 87 LEU MD2 4.500 . 4.500 3.170 2.829 3.859 . 0 0 "[ . 1 . 2]" 1
1820 1 80 THR HA 1 80 THR HB 2.800 . 2.800 2.560 2.440 2.742 . 0 0 "[ . 1 . 2]" 1
1821 1 80 THR HA 1 80 THR MG . . 2.800 2.211 2.032 2.379 . 0 0 "[ . 1 . 2]" 1
1822 1 80 THR HA 1 81 ASP H 2.800 . 2.800 2.290 2.138 2.487 . 0 0 "[ . 1 . 2]" 1
1823 1 80 THR HA 1 84 GLY H 5.500 . 5.500 5.324 4.977 5.534 0.034 11 0 "[ . 1 . 2]" 1
1824 1 80 THR HA 1 85 LYS H 5.500 . 5.500 4.438 4.159 4.861 . 0 0 "[ . 1 . 2]" 1
1825 1 80 THR HA 1 86 THR H 5.500 . 5.500 4.611 4.381 4.910 . 0 0 "[ . 1 . 2]" 1
1826 1 80 THR HA 1 86 THR HA 3.500 . 3.500 2.400 2.000 2.714 . 0 0 "[ . 1 . 2]" 1
1827 1 80 THR HA 1 87 LEU H 3.500 . 3.500 2.714 2.310 3.076 . 0 0 "[ . 1 . 2]" 1
1828 1 80 THR HA 1 87 LEU HG 4.500 . 4.500 4.532 4.307 4.598 0.098 12 0 "[ . 1 . 2]" 1
1829 1 80 THR HB 1 81 ASP H 2.800 . 2.800 2.599 2.294 2.812 0.012 20 0 "[ . 1 . 2]" 1
1830 1 80 THR HB 1 81 ASP HA 4.500 . 4.500 4.508 4.250 4.607 0.107 7 0 "[ . 1 . 2]" 1
1831 1 80 THR HB 1 84 GLY H 3.500 . 3.500 3.274 3.051 3.531 0.031 4 0 "[ . 1 . 2]" 1
1832 1 80 THR HB 1 84 GLY QA 4.500 . 4.500 2.695 2.102 3.566 . 0 0 "[ . 1 . 2]" 1
1833 1 80 THR HB 1 85 LYS H 4.500 . 4.500 3.877 3.437 4.334 . 0 0 "[ . 1 . 2]" 1
1834 1 80 THR MG 1 81 ASP H 2.800 . 2.800 2.614 2.226 2.884 0.084 13 0 "[ . 1 . 2]" 1
1835 1 80 THR MG 1 84 GLY H 4.500 . 4.500 4.438 4.130 4.569 0.069 11 0 "[ . 1 . 2]" 1
1836 1 80 THR MG 1 84 GLY QA . . 4.500 3.340 2.537 4.513 0.013 11 0 "[ . 1 . 2]" 1
1837 1 80 THR MG 1 85 LYS H 3.500 . 3.500 3.569 3.419 3.666 0.166 7 0 "[ . 1 . 2]" 1
1838 1 80 THR MG 1 86 THR H 4.500 . 4.500 3.404 3.088 3.850 . 0 0 "[ . 1 . 2]" 1
1839 1 80 THR MG 1 86 THR HA 2.800 . 2.800 2.214 1.855 2.812 0.012 2 0 "[ . 1 . 2]" 1
1840 1 80 THR MG 1 86 THR HB 5.500 . 5.500 4.338 3.789 4.976 . 0 0 "[ . 1 . 2]" 1
1841 1 80 THR MG 1 87 LEU H 3.500 . 3.500 2.511 1.896 3.514 0.014 2 0 "[ . 1 . 2]" 1
1842 1 81 ASP H 1 81 ASP HB2 3.500 . 3.500 2.888 2.345 3.606 0.106 4 0 "[ . 1 . 2]" 1
1843 1 81 ASP H 1 81 ASP HB3 3.500 . 3.500 2.634 2.183 3.088 . 0 0 "[ . 1 . 2]" 1
1844 1 81 ASP H 1 82 VAL QG 5.500 . 5.500 4.946 4.551 5.125 . 0 0 "[ . 1 . 2]" 1
1845 1 81 ASP H 1 83 ASN H 5.500 . 5.500 4.184 3.677 4.538 . 0 0 "[ . 1 . 2]" 1
1846 1 81 ASP H 1 84 GLY H 5.500 . 5.500 3.399 3.116 3.669 . 0 0 "[ . 1 . 2]" 1
1847 1 81 ASP H 1 84 GLY QA 4.500 . 4.500 3.734 3.441 4.355 . 0 0 "[ . 1 . 2]" 1
1848 1 81 ASP H 1 85 LYS H 4.500 . 4.500 2.736 2.387 3.172 . 0 0 "[ . 1 . 2]" 1
1849 1 81 ASP H 1 85 LYS QB 4.500 . 4.500 3.671 2.941 4.561 0.061 11 0 "[ . 1 . 2]" 1
1850 1 81 ASP H 1 87 LEU H 4.500 . 4.500 4.289 3.918 4.537 0.037 8 0 "[ . 1 . 2]" 1
1851 1 81 ASP H 1 87 LEU MD2 3.500 . 3.500 2.641 2.164 3.188 . 0 0 "[ . 1 . 2]" 1
1852 1 81 ASP H 1 87 LEU HG 5.500 . 5.500 4.571 4.174 4.928 . 0 0 "[ . 1 . 2]" 1
1853 1 81 ASP HA 1 81 ASP HB2 . . 2.800 2.578 2.318 2.812 0.012 20 0 "[ . 1 . 2]" 1
1854 1 81 ASP HA 1 81 ASP HB3 . . 2.800 2.907 2.478 2.959 0.159 1 0 "[ . 1 . 2]" 1
1855 1 81 ASP HA 1 83 ASN H 5.500 . 5.500 4.063 3.773 4.535 . 0 0 "[ . 1 . 2]" 1
1856 1 81 ASP HA 1 87 LEU MD1 5.500 . 5.500 3.994 3.270 4.822 . 0 0 "[ . 1 . 2]" 1
1857 1 81 ASP HA 1 87 LEU MD2 3.500 . 3.500 3.066 2.549 3.509 0.009 9 0 "[ . 1 . 2]" 1
1858 1 81 ASP HB2 1 82 VAL H 4.500 . 4.500 3.657 2.116 3.932 . 0 0 "[ . 1 . 2]" 1
1859 1 81 ASP HB2 1 85 LYS H 5.500 . 5.500 4.240 2.995 5.507 0.007 9 0 "[ . 1 . 2]" 1
1860 1 81 ASP HB2 1 87 LEU MD1 3.500 . 3.500 2.441 1.942 3.518 0.018 4 0 "[ . 1 . 2]" 1
1861 1 81 ASP HB2 1 87 LEU MD2 4.500 . 4.500 2.774 1.877 4.093 . 0 0 "[ . 1 . 2]" 1
1862 1 81 ASP HB3 1 82 VAL H 4.500 . 4.500 3.163 2.643 3.754 . 0 0 "[ . 1 . 2]" 1
1863 1 81 ASP HB3 1 82 VAL MG1 4.500 . 4.500 4.473 3.474 4.662 0.162 2 0 "[ . 1 . 2]" 1
1864 1 81 ASP HB3 1 87 LEU MD1 . . 4.500 3.265 1.966 4.507 0.007 5 0 "[ . 1 . 2]" 1
1865 1 81 ASP HB3 1 87 LEU MD2 4.500 . 4.500 3.751 2.745 4.387 . 0 0 "[ . 1 . 2]" 1
1866 1 82 VAL H 1 82 VAL HB 3.500 . 3.500 3.547 3.507 3.586 0.086 9 0 "[ . 1 . 2]" 1
1867 1 82 VAL H 1 82 VAL QG 2.800 . 2.800 1.791 1.731 1.920 0.069 16 0 "[ . 1 . 2]" 1
1868 1 82 VAL H 1 82 VAL MG2 3.500 . 3.500 2.390 1.936 2.889 . 0 0 "[ . 1 . 2]" 1
1869 1 82 VAL H 1 83 ASN H 5.500 . 5.500 2.770 2.411 3.388 . 0 0 "[ . 1 . 2]" 1
1870 1 82 VAL H 1 83 ASN H 3.500 . 3.500 2.662 2.367 3.087 . 0 0 "[ . 1 . 2]" 1
1871 1 82 VAL HA 1 82 VAL HB . . 2.800 2.388 2.310 2.493 . 0 0 "[ . 1 . 2]" 1
1872 1 82 VAL HA 1 82 VAL MG1 2.800 . 2.800 2.449 2.243 2.676 . 0 0 "[ . 1 . 2]" 1
1873 1 82 VAL HA 1 82 VAL QG 2.800 . 2.800 2.373 2.203 2.546 . 0 0 "[ . 1 . 2]" 1
1874 1 82 VAL HA 1 83 ASN H 4.500 . 4.500 3.473 3.357 3.615 . 0 0 "[ . 1 . 2]" 1
1875 1 82 VAL HB 1 83 ASN H 5.500 . 5.500 4.086 3.707 4.392 . 0 0 "[ . 1 . 2]" 1
1876 1 82 VAL QG 1 84 GLY H 4.500 . 4.500 3.959 3.781 4.263 . 0 0 "[ . 1 . 2]" 1
1877 1 82 VAL MG2 1 83 ASN H 3.500 . 3.500 2.311 1.954 2.867 . 0 0 "[ . 1 . 2]" 1
1878 1 82 VAL MG2 1 83 ASN H 3.500 . 3.500 2.285 1.952 2.754 . 0 0 "[ . 1 . 2]" 1
1879 1 82 VAL MG2 1 83 ASN HA 3.500 . 3.500 3.313 2.912 3.525 0.025 6 0 "[ . 1 . 2]" 1
1880 1 82 VAL MG2 1 83 ASN QD 4.500 . 4.500 3.993 3.032 4.545 0.045 16 0 "[ . 1 . 2]" 1
1881 1 83 ASN H 1 83 ASN HB2 2.800 . 2.800 2.420 2.177 2.740 . 0 0 "[ . 1 . 2]" 1
1882 1 83 ASN H 1 83 ASN HB3 3.500 . 3.500 2.787 2.328 3.341 . 0 0 "[ . 1 . 2]" 1
1883 1 83 ASN H 1 83 ASN QD 5.500 . 5.500 4.294 3.684 4.785 . 0 0 "[ . 1 . 2]" 1
1884 1 83 ASN H 1 84 GLY H 2.800 . 2.800 2.451 2.055 2.589 . 0 0 "[ . 1 . 2]" 1
1885 1 83 ASN H 1 84 GLY H 2.800 . 2.800 2.457 2.056 2.608 . 0 0 "[ . 1 . 2]" 1
1886 1 83 ASN H 1 84 GLY QA 4.500 . 4.500 4.402 4.088 4.510 0.010 3 0 "[ . 1 . 2]" 1
1887 1 83 ASN H 1 85 LYS H 3.500 . 3.500 3.508 3.333 3.580 0.080 1 0 "[ . 1 . 2]" 1
1888 1 83 ASN HA 1 83 ASN HB3 . . 2.800 2.933 2.815 2.973 0.173 20 0 "[ . 1 . 2]" 1
1889 1 83 ASN HA 1 83 ASN QD . . 4.500 2.638 1.893 3.814 . 0 0 "[ . 1 . 2]" 1
1890 1 83 ASN HA 1 84 GLY H 4.500 . 4.500 3.337 3.252 3.492 . 0 0 "[ . 1 . 2]" 1
1891 1 83 ASN HA 1 85 LYS H 5.500 . 5.500 4.493 4.139 4.943 . 0 0 "[ . 1 . 2]" 1
1892 1 83 ASN HB2 1 84 GLY H 4.500 . 4.500 4.051 3.107 4.384 . 0 0 "[ . 1 . 2]" 1
1893 1 83 ASN HB2 1 85 LYS H 4.500 . 4.500 4.148 3.586 4.505 0.005 8 0 "[ . 1 . 2]" 1
1894 1 83 ASN HB3 1 84 GLY H 3.500 . 3.500 3.386 3.108 3.534 0.034 16 0 "[ . 1 . 2]" 1
1895 1 83 ASN HB3 1 85 LYS H 4.500 . 4.500 2.755 2.341 3.465 . 0 0 "[ . 1 . 2]" 1
1896 1 84 GLY H 1 84 GLY QA 2.800 . 2.800 2.263 2.205 2.396 . 0 0 "[ . 1 . 2]" 1
1897 1 84 GLY H 1 85 LYS H 2.800 . 2.800 2.405 1.804 2.617 . 0 0 "[ . 1 . 2]" 1
1898 1 84 GLY QA 1 85 LYS H 3.500 . 3.500 2.889 2.770 2.990 . 0 0 "[ . 1 . 2]" 1
1899 1 84 GLY QA 1 85 LYS H 2.800 . 2.800 2.589 2.549 2.619 . 0 0 "[ . 1 . 2]" 1
1900 1 85 LYS H 1 85 LYS QB 2.800 . 2.800 2.212 2.016 2.830 0.030 5 0 "[ . 1 . 2]" 1
1901 1 85 LYS H 1 85 LYS QG . . 3.500 3.167 2.078 3.610 0.110 17 0 "[ . 1 . 2]" 1
1902 1 85 LYS H 1 86 THR H 4.500 . 4.500 4.521 4.446 4.567 0.067 20 0 "[ . 1 . 2]" 1
1903 1 85 LYS HA 1 85 LYS HB2 2.800 . 2.800 2.765 2.260 2.953 0.153 6 0 "[ . 1 . 2]" 1
1904 1 85 LYS HA 1 85 LYS QB 2.800 . 2.800 2.419 2.178 2.537 . 0 0 "[ . 1 . 2]" 1
1905 1 85 LYS HA 1 85 LYS HB3 2.800 . 2.800 2.723 2.465 2.876 0.076 15 0 "[ . 1 . 2]" 1
1906 1 85 LYS HA 1 85 LYS QD 4.500 . 4.500 3.663 1.863 4.288 . 0 0 "[ . 1 . 2]" 1
1907 1 85 LYS HA 1 85 LYS QG 3.500 . 3.500 2.486 2.069 3.375 . 0 0 "[ . 1 . 2]" 1
1908 1 85 LYS HA 1 86 THR H 2.800 . 2.800 2.295 2.227 2.487 . 0 0 "[ . 1 . 2]" 1
1909 1 85 LYS QB 1 86 THR H 3.500 . 3.500 2.912 2.402 3.294 . 0 0 "[ . 1 . 2]" 1
1910 1 85 LYS QB 1 87 LEU MD1 3.500 . 3.500 2.633 2.021 3.142 . 0 0 "[ . 1 . 2]" 1
1911 1 85 LYS QD 1 86 THR H 5.500 . 5.500 4.364 2.032 5.330 . 0 0 "[ . 1 . 2]" 1
1912 1 85 LYS QG 1 86 THR H 3.500 . 3.500 3.270 2.177 3.550 0.050 3 0 "[ . 1 . 2]" 1
1913 1 86 THR H 1 86 THR HB 2.800 . 2.800 2.587 2.393 2.839 0.039 6 0 "[ . 1 . 2]" 1
1914 1 86 THR H 1 86 THR MG 4.500 . 4.500 3.779 3.739 3.856 . 0 0 "[ . 1 . 2]" 1
1915 1 86 THR H 1 87 LEU H 5.500 . 5.500 4.450 4.361 4.572 . 0 0 "[ . 1 . 2]" 1
1916 1 86 THR HA 1 87 LEU H 3.500 . 3.500 2.193 2.107 2.285 . 0 0 "[ . 1 . 2]" 1
1917 1 86 THR HA 1 86 THR MG 2.800 . 2.800 2.203 2.108 2.308 . 0 0 "[ . 1 . 2]" 1
1918 1 86 THR HA 1 87 LEU H 2.800 . 2.800 2.200 2.113 2.297 . 0 0 "[ . 1 . 2]" 1
1919 1 86 THR HA 1 88 GLU H 3.500 . 3.500 3.509 3.277 3.599 0.099 13 0 "[ . 1 . 2]" 1
1920 1 86 THR MG 1 87 LEU H 2.800 . 2.800 2.838 2.739 2.882 0.082 7 0 "[ . 1 . 2]" 1
1921 1 86 THR MG 1 88 GLU H 2.800 . 2.800 2.421 2.211 2.675 . 0 0 "[ . 1 . 2]" 1
1922 1 86 THR MG 1 88 GLU HA . . 4.500 3.622 3.200 4.319 . 0 0 "[ . 1 . 2]" 1
1923 1 86 THR MG 1 89 GLY QA 3.500 . 3.500 3.023 2.747 3.445 . 0 0 "[ . 1 . 2]" 1
1924 1 86 THR MG 1 90 PRO QD . . 4.500 3.259 2.491 4.504 0.004 6 0 "[ . 1 . 2]" 1
1925 1 87 LEU H 1 87 LEU MD2 3.500 . 3.500 1.823 1.676 2.229 0.124 8 0 "[ . 1 . 2]" 1
1926 1 87 LEU H 1 87 LEU HG 3.500 . 3.500 3.651 3.569 3.718 0.218 9 0 "[ . 1 . 2]" 1
1927 1 87 LEU H 1 88 GLU H . . 2.800 2.172 2.018 2.310 . 0 0 "[ . 1 . 2]" 1
1928 1 87 LEU HA 1 87 LEU MD1 2.800 . 2.800 2.185 2.005 2.272 . 0 0 "[ . 1 . 2]" 1
1929 1 87 LEU HA 1 87 LEU MD2 4.500 . 4.500 3.453 2.380 3.922 . 0 0 "[ . 1 . 2]" 1
1930 1 87 LEU HA 1 87 LEU HG 4.500 . 4.500 3.755 3.522 3.883 . 0 0 "[ . 1 . 2]" 1
1931 1 87 LEU HB2 1 87 LEU MD1 3.500 . 3.500 3.236 3.142 3.284 . 0 0 "[ . 1 . 2]" 1
1932 1 87 LEU HB2 1 87 LEU MD2 3.500 . 3.500 2.203 2.095 2.617 . 0 0 "[ . 1 . 2]" 1
1933 1 87 LEU HB2 1 88 GLU H 3.500 . 3.500 2.944 2.188 3.395 . 0 0 "[ . 1 . 2]" 1
1934 1 87 LEU HB3 1 87 LEU MD1 2.800 . 2.800 2.619 2.179 2.833 0.033 9 0 "[ . 1 . 2]" 1
1935 1 87 LEU HB3 1 87 LEU MD2 3.500 . 3.500 3.142 3.016 3.223 . 0 0 "[ . 1 . 2]" 1
1936 1 87 LEU HB3 1 88 GLU H 4.500 . 4.500 4.068 3.258 4.394 . 0 0 "[ . 1 . 2]" 1
1937 1 87 LEU MD1 1 87 LEU MD2 2.800 . 2.800 1.971 1.867 2.075 . 0 0 "[ . 1 . 2]" 1
1938 1 87 LEU MD1 1 88 GLU H 4.500 . 4.500 4.119 3.781 4.543 0.043 2 0 "[ . 1 . 2]" 1
1939 1 87 LEU MD2 1 88 GLU H 3.500 . 3.500 3.172 2.684 3.539 0.039 2 0 "[ . 1 . 2]" 1
1940 1 87 LEU HG 1 88 GLU H 5.500 . 5.500 4.992 4.406 5.321 . 0 0 "[ . 1 . 2]" 1
1941 1 88 GLU H 1 88 GLU QB 3.500 . 3.500 2.736 2.562 2.923 . 0 0 "[ . 1 . 2]" 1
1942 1 88 GLU H 1 88 GLU QG 4.500 . 4.500 4.213 3.831 4.445 . 0 0 "[ . 1 . 2]" 1
1943 1 88 GLU H 1 89 GLY H 4.500 . 4.500 4.353 4.217 4.462 . 0 0 "[ . 1 . 2]" 1
1944 1 88 GLU HA 1 88 GLU QB 2.800 . 2.800 2.469 2.238 2.547 . 0 0 "[ . 1 . 2]" 1
1945 1 88 GLU HA 1 88 GLU HB3 2.800 . 2.800 2.916 2.843 2.975 0.175 8 0 "[ . 1 . 2]" 1
1946 1 88 GLU HA 1 88 GLU QG 3.500 . 3.500 2.452 1.986 3.218 . 0 0 "[ . 1 . 2]" 1
1947 1 88 GLU HA 1 89 GLY H 2.800 . 2.800 2.359 2.238 2.516 . 0 0 "[ . 1 . 2]" 1
1948 1 88 GLU HA 1 89 GLY QA 4.500 . 4.500 4.050 3.965 4.142 . 0 0 "[ . 1 . 2]" 1
1949 1 88 GLU QB 1 89 GLY H 3.500 . 3.500 3.097 2.619 3.370 . 0 0 "[ . 1 . 2]" 1
1950 1 88 GLU QG 1 89 GLY H 2.800 . 2.800 2.363 1.798 2.895 0.095 18 0 "[ . 1 . 2]" 1
1951 1 88 GLU QG 1 91 VAL MG1 . . 4.500 3.090 2.349 4.204 . 0 0 "[ . 1 . 2]" 1
1952 1 89 GLY H 1 89 GLY QA . . 2.800 2.265 2.217 2.348 . 0 0 "[ . 1 . 2]" 1
1953 1 89 GLY H 1 91 VAL H 5.500 . 5.500 4.441 4.277 4.913 . 0 0 "[ . 1 . 2]" 1
1954 1 89 GLY H 1 91 VAL MG1 4.500 . 4.500 2.905 2.819 2.942 . 0 0 "[ . 1 . 2]" 1
1955 1 89 GLY H 1 91 VAL QG 2.800 . 2.800 2.861 2.794 2.899 0.099 4 0 "[ . 1 . 2]" 1
1956 1 89 GLY H 1 91 VAL MG2 5.500 . 5.500 4.323 3.939 4.582 . 0 0 "[ . 1 . 2]" 1
1957 1 89 GLY QA 1 90 PRO HA 4.500 . 4.500 2.225 2.114 2.367 . 0 0 "[ . 1 . 2]" 1
1958 1 89 GLY QA 1 91 VAL H 3.500 . 3.500 1.881 1.798 2.070 0.002 15 0 "[ . 1 . 2]" 1
1959 1 89 GLY QA 1 91 VAL HA 5.500 . 5.500 3.173 2.937 3.528 . 0 0 "[ . 1 . 2]" 1
1960 1 89 GLY QA 1 91 VAL HB 5.500 . 5.500 4.137 4.023 4.357 . 0 0 "[ . 1 . 2]" 1
1961 1 89 GLY QA 1 91 VAL MG1 3.500 . 3.500 2.026 1.934 2.258 . 0 0 "[ . 1 . 2]" 1
1962 1 89 GLY QA 1 91 VAL MG2 5.500 . 5.500 2.619 2.306 2.847 . 0 0 "[ . 1 . 2]" 1
1963 1 89 GLY QA 1 91 VAL H 4.500 . 4.500 2.040 1.885 2.501 . 0 0 "[ . 1 . 2]" 1
1964 1 89 GLY QA 1 91 VAL MG1 3.500 . 3.500 2.030 1.937 2.263 . 0 0 "[ . 1 . 2]" 1
1965 1 89 GLY QA 1 91 VAL QG 2.800 . 2.800 1.968 1.882 2.074 . 0 0 "[ . 1 . 2]" 1
1966 1 89 GLY QA 1 91 VAL MG2 4.500 . 4.500 2.702 2.343 2.990 . 0 0 "[ . 1 . 2]" 1
1967 1 90 PRO HA 1 90 PRO HB3 2.800 . 2.800 2.254 2.236 2.273 . 0 0 "[ . 1 . 2]" 1
1968 1 90 PRO HA 1 91 VAL QG 5.500 . 5.500 3.372 3.317 3.445 . 0 0 "[ . 1 . 2]" 1
1969 1 90 PRO HB2 1 91 VAL H 5.500 . 5.500 4.067 3.579 4.190 . 0 0 "[ . 1 . 2]" 1
1970 1 90 PRO HB3 1 91 VAL H 4.500 . 4.500 4.098 3.854 4.356 . 0 0 "[ . 1 . 2]" 1
1971 1 91 VAL H 1 91 VAL HB 3.500 . 3.500 3.532 3.509 3.546 0.046 11 0 "[ . 1 . 2]" 1
1972 1 91 VAL H 1 91 VAL QG 2.800 . 2.800 1.837 1.773 1.894 0.027 13 0 "[ . 1 . 2]" 1
1973 1 91 VAL H 1 92 PRO QD 5.500 . 5.500 4.404 4.326 4.432 . 0 0 "[ . 1 . 2]" 1
1974 1 91 VAL HA 1 91 VAL MG1 3.500 . 3.500 2.280 2.231 2.337 . 0 0 "[ . 1 . 2]" 1
1975 1 91 VAL HA 1 91 VAL QG 2.800 . 2.800 2.232 2.190 2.282 . 0 0 "[ . 1 . 2]" 1
1976 1 91 VAL HA 1 91 VAL MG2 3.500 . 3.500 3.179 3.163 3.195 . 0 0 "[ . 1 . 2]" 1
1977 1 91 VAL HA 1 92 PRO QD 2.800 . 2.800 1.993 1.938 2.111 . 0 0 "[ . 1 . 2]" 1
1978 1 91 VAL HA 1 92 PRO QG . . 4.500 3.813 3.653 4.019 . 0 0 "[ . 1 . 2]" 1
1979 1 91 VAL HB 1 92 PRO QD . . 3.500 2.273 2.128 2.394 . 0 0 "[ . 1 . 2]" 1
1980 1 91 VAL MG1 1 92 PRO QD 4.500 . 4.500 3.054 2.796 3.276 . 0 0 "[ . 1 . 2]" 1
1981 1 91 VAL MG2 1 92 PRO QD . . 3.500 3.527 3.510 3.547 0.047 1 0 "[ . 1 . 2]" 1
1982 1 91 VAL MG2 1 92 PRO QG 5.500 . 5.500 5.032 4.993 5.087 . 0 0 "[ . 1 . 2]" 1
1983 1 92 PRO HA 1 92 PRO HB3 2.800 . 2.800 2.235 2.211 2.259 . 0 0 "[ . 1 . 2]" 1
1984 1 92 PRO HA 1 92 PRO HB3 2.800 . 2.800 2.209 2.186 2.233 . 0 0 "[ . 1 . 2]" 1
1985 1 92 PRO HB2 1 93 LEU H 3.500 . 3.500 3.018 2.805 3.210 . 0 0 "[ . 1 . 2]" 1
1986 1 92 PRO HB3 1 93 LEU H 3.500 . 3.500 3.557 3.531 3.593 0.093 14 0 "[ . 1 . 2]" 1
1987 1 92 PRO QD 1 93 LEU H 5.500 . 5.500 4.711 4.657 4.773 . 0 0 "[ . 1 . 2]" 1
1988 1 93 LEU H 1 93 LEU HB2 3.500 . 3.500 3.520 3.457 3.554 0.054 20 0 "[ . 1 . 2]" 1
1989 1 93 LEU H 1 93 LEU HB3 3.500 . 3.500 2.659 2.575 2.769 . 0 0 "[ . 1 . 2]" 1
1990 1 93 LEU H 1 93 LEU MD1 4.500 . 4.500 4.357 4.293 4.528 0.028 6 0 "[ . 1 . 2]" 1
1991 1 93 LEU H 1 93 LEU MD2 5.500 . 5.500 4.583 4.511 4.688 . 0 0 "[ . 1 . 2]" 1
1992 1 93 LEU H 1 93 LEU HG 5.500 . 5.500 4.141 4.029 4.299 . 0 0 "[ . 1 . 2]" 1
1993 1 93 LEU HA 1 93 LEU MD1 . . 2.800 2.141 1.969 2.331 . 0 0 "[ . 1 . 2]" 1
1994 1 93 LEU HA 1 93 LEU HG 4.500 . 4.500 3.344 2.958 3.450 . 0 0 "[ . 1 . 2]" 1
1995 1 93 LEU HA 1 94 GLU H 2.800 . 2.800 2.176 2.095 2.235 . 0 0 "[ . 1 . 2]" 1
1996 1 93 LEU HB2 1 93 LEU MD1 3.500 . 3.500 2.442 2.187 2.522 . 0 0 "[ . 1 . 2]" 1
1997 1 93 LEU HB2 1 93 LEU MD2 3.500 . 3.500 2.378 2.303 2.583 . 0 0 "[ . 1 . 2]" 1
1998 1 93 LEU HB2 1 94 GLU H 4.500 . 4.500 4.113 4.042 4.261 . 0 0 "[ . 1 . 2]" 1
1999 1 93 LEU HB3 1 93 LEU MD2 3.500 . 3.500 2.390 2.245 2.445 . 0 0 "[ . 1 . 2]" 1
2000 1 93 LEU HB3 1 94 GLU H 3.500 . 3.500 3.256 3.079 3.357 . 0 0 "[ . 1 . 2]" 1
2001 1 93 LEU HB3 1 95 VAL MG2 4.500 . 4.500 2.268 2.065 2.607 . 0 0 "[ . 1 . 2]" 1
2002 1 93 LEU MD1 1 93 LEU MD2 2.800 . 2.800 2.026 1.922 2.059 . 0 0 "[ . 1 . 2]" 1
2003 1 93 LEU MD1 1 94 GLU QB 4.500 . 4.500 3.961 3.712 4.514 0.014 6 0 "[ . 1 . 2]" 1
2004 1 93 LEU MD1 1 95 VAL H 3.500 . 3.500 3.510 3.365 3.566 0.066 14 0 "[ . 1 . 2]" 1
2005 1 93 LEU MD2 1 94 GLU H 4.500 . 4.500 4.546 4.514 4.617 0.117 6 0 "[ . 1 . 2]" 1
2006 1 94 GLU H 1 94 GLU QB 2.800 . 2.800 2.525 2.442 2.606 . 0 0 "[ . 1 . 2]" 1
2007 1 94 GLU H 1 94 GLU QG 2.800 . 2.800 2.576 2.363 2.813 0.013 1 0 "[ . 1 . 2]" 1
2008 1 94 GLU HA 1 95 VAL H 2.800 . 2.800 2.118 2.079 2.164 . 0 0 "[ . 1 . 2]" 1
2009 1 94 GLU QB 1 95 VAL H 2.800 . 2.800 2.400 2.216 2.628 . 0 0 "[ . 1 . 2]" 1
2010 1 94 GLU QB 1 96 ILE HG12 4.500 . 4.500 4.069 2.507 4.502 0.002 16 0 "[ . 1 . 2]" 1
2011 1 94 GLU QG 1 95 VAL H 4.500 . 4.500 4.293 4.029 4.440 . 0 0 "[ . 1 . 2]" 1
2012 1 94 GLU QG 1 96 ILE HG13 5.500 . 5.500 5.234 4.763 5.511 0.011 20 0 "[ . 1 . 2]" 1
2013 1 95 VAL H 1 95 VAL MG2 3.500 . 3.500 2.594 2.212 2.924 . 0 0 "[ . 1 . 2]" 1
2014 1 95 VAL H 1 96 ILE H 5.500 . 5.500 4.115 3.920 4.257 . 0 0 "[ . 1 . 2]" 1
2015 1 95 VAL HA 1 95 VAL MG1 . . 2.800 2.354 2.141 2.539 . 0 0 "[ . 1 . 2]" 1
2016 1 95 VAL HA 1 95 VAL MG2 . . 2.800 2.366 2.289 2.507 . 0 0 "[ . 1 . 2]" 1
2017 1 95 VAL HA 1 96 ILE H 5.500 . 5.500 2.201 2.168 2.260 . 0 0 "[ . 1 . 2]" 1
2018 1 95 VAL HB 1 96 ILE H 2.800 . 2.800 2.499 2.335 2.708 . 0 0 "[ . 1 . 2]" 1
2019 1 95 VAL MG1 1 95 VAL MG2 2.800 . 2.800 2.042 2.004 2.070 . 0 0 "[ . 1 . 2]" 1
2020 1 95 VAL MG1 1 96 ILE H 3.500 . 3.500 3.241 3.032 3.454 . 0 0 "[ . 1 . 2]" 1
2021 1 95 VAL MG1 1 97 VAL H 5.500 . 5.500 4.586 4.207 4.913 . 0 0 "[ . 1 . 2]" 1
2022 1 95 VAL MG1 1 97 VAL MG2 4.500 . 4.500 3.197 2.933 3.574 . 0 0 "[ . 1 . 2]" 1
2023 1 95 VAL MG2 1 96 ILE H 4.500 . 4.500 4.189 4.019 4.322 . 0 0 "[ . 1 . 2]" 1
2024 1 96 ILE H 1 96 ILE HB 3.500 . 3.500 2.514 2.344 2.733 . 0 0 "[ . 1 . 2]" 1
2025 1 96 ILE H 1 96 ILE MD 4.500 . 4.500 2.107 1.771 3.783 0.029 2 0 "[ . 1 . 2]" 1
2026 1 96 ILE H 1 96 ILE HG12 4.500 . 4.500 3.856 2.448 4.212 . 0 0 "[ . 1 . 2]" 1
2027 1 96 ILE H 1 96 ILE HG13 4.500 . 4.500 2.987 2.125 3.405 . 0 0 "[ . 1 . 2]" 1
2028 1 96 ILE H 1 96 ILE MG 4.500 . 4.500 3.779 3.699 3.845 . 0 0 "[ . 1 . 2]" 1
2029 1 96 ILE HA 1 96 ILE MD 4.500 . 4.500 3.474 3.324 3.682 . 0 0 "[ . 1 . 2]" 1
2030 1 96 ILE HA 1 96 ILE HG12 4.500 . 4.500 3.391 2.579 3.627 . 0 0 "[ . 1 . 2]" 1
2031 1 96 ILE HA 1 96 ILE HG13 4.500 . 4.500 2.499 2.235 3.620 . 0 0 "[ . 1 . 2]" 1
2032 1 96 ILE HA 1 96 ILE MG 2.800 . 2.800 2.390 2.149 2.563 . 0 0 "[ . 1 . 2]" 1
2033 1 96 ILE HB 1 96 ILE MD 2.800 . 2.800 2.213 2.097 2.682 . 0 0 "[ . 1 . 2]" 1
2034 1 96 ILE HB 1 97 VAL H 4.500 . 4.500 4.106 3.935 4.314 . 0 0 "[ . 1 . 2]" 1
2035 1 96 ILE HG12 1 96 ILE MG 2.800 . 2.800 2.164 2.012 2.649 . 0 0 "[ . 1 . 2]" 1
2036 1 96 ILE HG12 1 97 VAL H 5.500 . 5.500 5.021 4.683 5.278 . 0 0 "[ . 1 . 2]" 1
2037 1 96 ILE HG13 1 96 ILE MG 2.800 . 2.800 2.763 2.635 3.045 0.245 7 0 "[ . 1 . 2]" 1
2038 1 96 ILE HG13 1 97 VAL H 5.500 . 5.500 4.508 4.230 5.459 . 0 0 "[ . 1 . 2]" 1
2039 1 96 ILE MG 1 97 VAL H 2.800 . 2.800 2.599 2.348 2.803 0.003 6 0 "[ . 1 . 2]" 1
2040 1 96 ILE MG 1 98 ILE HA 4.500 . 4.500 3.676 2.998 4.290 . 0 0 "[ . 1 . 2]" 1
2041 1 97 VAL H 1 97 VAL HB 3.500 . 3.500 2.587 2.474 2.856 . 0 0 "[ . 1 . 2]" 1
2042 1 97 VAL H 1 97 VAL HB 3.500 . 3.500 2.567 2.461 2.810 . 0 0 "[ . 1 . 2]" 1
2043 1 97 VAL H 1 97 VAL MG2 3.500 . 3.500 2.177 1.989 2.425 . 0 0 "[ . 1 . 2]" 1
2044 1 97 VAL H 1 97 VAL MG2 2.800 . 2.800 2.170 1.986 2.412 . 0 0 "[ . 1 . 2]" 1
2045 1 97 VAL HA 1 97 VAL MG1 2.800 . 2.800 2.327 2.243 2.446 . 0 0 "[ . 1 . 2]" 1
2046 1 97 VAL HA 1 97 VAL MG2 . . 2.800 2.451 2.331 2.627 . 0 0 "[ . 1 . 2]" 1
2047 1 97 VAL HA 1 98 ILE H 2.800 . 2.800 2.222 2.157 2.287 . 0 0 "[ . 1 . 2]" 1
2048 1 97 VAL HA 1 98 ILE MG 5.500 . 5.500 3.666 3.477 3.817 . 0 0 "[ . 1 . 2]" 1
2049 1 97 VAL MG1 1 97 VAL MG2 2.800 . 2.800 2.059 2.010 2.081 . 0 0 "[ . 1 . 2]" 1
2050 1 97 VAL MG1 1 98 ILE H 3.500 . 3.500 3.188 2.857 3.512 0.012 11 0 "[ . 1 . 2]" 1
2051 1 97 VAL MG2 1 98 ILE H 4.500 . 4.500 4.298 4.173 4.439 . 0 0 "[ . 1 . 2]" 1
2052 1 98 ILE H 1 98 ILE MD 4.500 . 4.500 3.704 3.457 4.063 . 0 0 "[ . 1 . 2]" 1
2053 1 98 ILE H 1 98 ILE MD 2.800 . 2.800 2.257 2.034 2.448 . 0 0 "[ . 1 . 2]" 1
2054 1 98 ILE H 1 98 ILE HG12 4.500 . 4.500 2.213 1.968 2.681 . 0 0 "[ . 1 . 2]" 1
2055 1 98 ILE H 1 98 ILE HG13 4.500 . 4.500 3.362 2.886 3.563 . 0 0 "[ . 1 . 2]" 1
2056 1 98 ILE H 1 98 ILE MG 3.500 . 3.500 2.279 2.044 2.476 . 0 0 "[ . 1 . 2]" 1
2057 1 98 ILE HA 1 98 ILE MD 4.500 . 4.500 4.132 4.056 4.150 . 0 0 "[ . 1 . 2]" 1
2058 1 98 ILE HA 1 99 ASP H 2.800 . 2.800 2.519 2.468 2.559 . 0 0 "[ . 1 . 2]" 1
2059 1 98 ILE HB 1 98 ILE MD 2.800 . 2.800 2.357 2.287 2.441 . 0 0 "[ . 1 . 2]" 1
2060 1 98 ILE HB 1 99 ASP H 3.500 . 3.500 2.446 2.340 2.556 . 0 0 "[ . 1 . 2]" 1
2061 1 98 ILE MD 1 99 ASP H 3.500 . 3.500 3.501 3.303 3.547 0.047 16 0 "[ . 1 . 2]" 1
2062 1 98 ILE MD 1 99 ASP H 5.500 . 5.500 3.989 3.517 4.195 . 0 0 "[ . 1 . 2]" 1
2063 1 98 ILE HG12 1 99 ASP H 4.500 . 4.500 4.334 4.161 4.545 0.045 8 0 "[ . 1 . 2]" 1
2064 1 98 ILE HG13 1 99 ASP H 5.500 . 5.500 3.154 2.829 3.404 . 0 0 "[ . 1 . 2]" 1
2065 1 98 ILE MG 1 99 ASP H 4.500 . 4.500 3.893 3.791 4.007 . 0 0 "[ . 1 . 2]" 1
2066 1 99 ASP H 1 99 ASP HB2 2.800 . 2.800 2.480 2.268 2.830 0.030 17 0 "[ . 1 . 2]" 1
2067 1 99 ASP H 1 99 ASP HB3 3.500 . 3.500 3.576 3.533 3.650 0.150 16 0 "[ . 1 . 2]" 1
2068 1 99 ASP H 1 100 GLN H 4.500 . 4.500 4.479 4.409 4.538 0.038 20 0 "[ . 1 . 2]" 1
2069 1 99 ASP HA 1 99 ASP HB3 . . 2.800 2.486 2.263 2.686 . 0 0 "[ . 1 . 2]" 1
2070 1 99 ASP HA 1 100 GLN H 2.800 . 2.800 2.416 2.229 2.722 . 0 0 "[ . 1 . 2]" 1
2071 1 99 ASP HB2 1 100 GLN H 3.500 . 3.500 3.446 2.802 3.589 0.089 1 0 "[ . 1 . 2]" 1
2072 1 99 ASP HB3 1 100 GLN H 3.500 . 3.500 2.366 1.853 3.213 . 0 0 "[ . 1 . 2]" 1
2073 1 100 GLN H 1 100 GLN QB 2.800 . 2.800 2.670 2.174 3.018 0.218 1 0 "[ . 1 . 2]" 1
2074 1 100 GLN H 1 100 GLN QG 3.500 . 3.500 2.523 1.817 3.575 0.075 19 0 "[ . 1 . 2]" 1
2075 1 100 GLN H 1 101 ASN H 5.500 . 5.500 3.976 2.879 4.659 . 0 0 "[ . 1 . 2]" 1
2076 1 100 GLN HA 1 100 GLN QB 2.800 . 2.800 2.314 2.164 2.552 . 0 0 "[ . 1 . 2]" 1
2077 1 100 GLN HA 1 100 GLN QG 3.500 . 3.500 2.816 2.134 3.425 . 0 0 "[ . 1 . 2]" 1
2078 1 100 GLN HA 1 101 ASN H 3.500 . 3.500 2.343 2.136 2.502 . 0 0 "[ . 1 . 2]" 1
2079 1 100 GLN HA 1 101 ASN HA 5.500 . 5.500 4.528 4.400 4.687 . 0 0 "[ . 1 . 2]" 1
2080 1 100 GLN QB 1 101 ASN H 4.500 . 4.500 3.562 2.578 3.937 . 0 0 "[ . 1 . 2]" 1
2081 1 101 ASN H 1 101 ASN QB 3.500 . 3.500 2.600 2.198 3.099 . 0 0 "[ . 1 . 2]" 1
2082 1 101 ASN HA 1 103 ASN H 5.500 . 5.500 4.556 3.238 5.734 0.234 2 0 "[ . 1 . 2]" 1
2083 1 102 ASP QB 1 104 ARG HA 4.500 . 4.500 4.279 3.231 4.564 0.064 11 0 "[ . 1 . 2]" 1
2084 1 103 ASN H 1 104 ARG HA 5.500 . 5.500 4.864 3.706 5.372 . 0 0 "[ . 1 . 2]" 1
2085 1 103 ASN HA 1 103 ASN HB3 2.800 . 2.800 2.811 2.341 2.979 0.179 7 0 "[ . 1 . 2]" 1
2086 1 103 ASN HA 1 104 ARG H 3.500 . 3.500 3.099 2.183 3.522 0.022 10 0 "[ . 1 . 2]" 1
2087 1 104 ARG H 1 104 ARG HB2 3.500 . 3.500 3.023 2.262 3.593 0.093 20 0 "[ . 1 . 2]" 1
2088 1 104 ARG H 1 104 ARG QG 4.500 . 4.500 2.901 2.238 3.757 . 0 0 "[ . 1 . 2]" 1
2089 1 104 ARG H 1 105 PRO HA 5.500 . 5.500 5.092 4.086 5.565 0.065 12 0 "[ . 1 . 2]" 1
2090 1 104 ARG HA 1 104 ARG HB3 . . 2.800 2.563 2.406 2.792 . 0 0 "[ . 1 . 2]" 1
2091 1 104 ARG HA 1 104 ARG QG . . 3.500 2.440 2.109 3.024 . 0 0 "[ . 1 . 2]" 1
2092 1 104 ARG HA 1 105 PRO QD 2.800 . 2.800 2.104 1.903 2.415 . 0 0 "[ . 1 . 2]" 1
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