NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
395514 |
1rsf   |
5516 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1rsf
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 1161
_Distance_constraint_stats_list.Viol_count 3523
_Distance_constraint_stats_list.Viol_total 8496.571
_Distance_constraint_stats_list.Viol_max 0.491
_Distance_constraint_stats_list.Viol_rms 0.0355
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0081
_Distance_constraint_stats_list.Viol_average_violations_only 0.0804
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 3 SER 0.085 0.068 8 0 "[ . 1 . 2 . 3]"
1 4 ILE 2.357 0.196 20 0 "[ . 1 . 2 . 3]"
1 5 THR 1.303 0.088 16 0 "[ . 1 . 2 . 3]"
1 6 THR 5.777 0.225 2 0 "[ . 1 . 2 . 3]"
1 7 PRO 5.093 0.222 30 0 "[ . 1 . 2 . 3]"
1 8 GLU 4.888 0.151 28 0 "[ . 1 . 2 . 3]"
1 9 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 10 MET 2.491 0.210 22 0 "[ . 1 . 2 . 3]"
1 11 ILE 2.245 0.210 22 0 "[ . 1 . 2 . 3]"
1 12 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 13 LYS 3.580 0.218 14 0 "[ . 1 . 2 . 3]"
1 14 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 15 LYS 1.030 0.138 2 0 "[ . 1 . 2 . 3]"
1 16 GLY 0.830 0.138 2 0 "[ . 1 . 2 . 3]"
1 17 GLU 0.595 0.113 9 0 "[ . 1 . 2 . 3]"
1 18 THR 4.698 0.411 9 0 "[ . 1 . 2 . 3]"
1 19 ALA 4.930 0.254 5 0 "[ . 1 . 2 . 3]"
1 20 TYR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 21 LEU 0.840 0.043 4 0 "[ . 1 . 2 . 3]"
1 22 PRO 1.957 0.164 6 0 "[ . 1 . 2 . 3]"
1 23 CYS 4.958 0.230 9 0 "[ . 1 . 2 . 3]"
1 24 LYS 6.170 0.230 9 0 "[ . 1 . 2 . 3]"
1 25 PHE 2.957 0.098 5 0 "[ . 1 . 2 . 3]"
1 26 THR 1.688 0.081 20 0 "[ . 1 . 2 . 3]"
1 27 LEU 0.621 0.074 5 0 "[ . 1 . 2 . 3]"
1 28 SER 2.172 0.134 8 0 "[ . 1 . 2 . 3]"
1 29 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 30 GLU 4.231 0.151 4 0 "[ . 1 . 2 . 3]"
1 31 ASP 8.250 0.152 10 0 "[ . 1 . 2 . 3]"
1 32 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 33 GLY 2.078 0.114 16 0 "[ . 1 . 2 . 3]"
1 34 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 35 LEU 1.587 0.150 18 0 "[ . 1 . 2 . 3]"
1 36 ASP 8.112 0.281 24 0 "[ . 1 . 2 . 3]"
1 37 ILE 14.414 0.341 3 0 "[ . 1 . 2 . 3]"
1 38 GLU 3.435 0.303 13 0 "[ . 1 . 2 . 3]"
1 39 TRP 4.429 0.126 18 0 "[ . 1 . 2 . 3]"
1 40 LEU 1.248 0.219 5 0 "[ . 1 . 2 . 3]"
1 41 ILE 2.397 0.110 23 0 "[ . 1 . 2 . 3]"
1 42 SER 0.297 0.068 30 0 "[ . 1 . 2 . 3]"
1 43 PRO 2.265 0.128 17 0 "[ . 1 . 2 . 3]"
1 44 ALA 1.791 0.093 16 0 "[ . 1 . 2 . 3]"
1 45 ASP 2.444 0.111 26 0 "[ . 1 . 2 . 3]"
1 46 ASN 1.140 0.128 17 0 "[ . 1 . 2 . 3]"
1 47 GLN 2.533 0.126 9 0 "[ . 1 . 2 . 3]"
1 48 LYS 3.406 0.126 9 0 "[ . 1 . 2 . 3]"
1 49 VAL 24.926 0.491 30 0 "[ . 1 . 2 . 3]"
1 50 ASP 18.530 0.491 30 0 "[ . 1 . 2 . 3]"
1 51 GLN 0.244 0.147 30 0 "[ . 1 . 2 . 3]"
1 52 VAL 10.282 0.277 28 0 "[ . 1 . 2 . 3]"
1 53 ILE 4.520 0.171 7 0 "[ . 1 . 2 . 3]"
1 54 ILE 7.729 0.287 8 0 "[ . 1 . 2 . 3]"
1 55 LEU 5.458 0.329 12 0 "[ . 1 . 2 . 3]"
1 56 TYR 5.102 0.256 1 0 "[ . 1 . 2 . 3]"
1 57 SER 3.338 0.179 24 0 "[ . 1 . 2 . 3]"
1 58 GLY 1.288 0.111 12 0 "[ . 1 . 2 . 3]"
1 59 ASP 1.288 0.111 12 0 "[ . 1 . 2 . 3]"
1 60 LYS 0.176 0.046 21 0 "[ . 1 . 2 . 3]"
1 61 ILE 12.694 0.343 4 0 "[ . 1 . 2 . 3]"
1 62 TYR 17.602 0.343 4 0 "[ . 1 . 2 . 3]"
1 63 ASP 1.558 0.062 30 0 "[ . 1 . 2 . 3]"
1 64 ASP 3.151 0.098 6 0 "[ . 1 . 2 . 3]"
1 65 TYR 4.674 0.220 23 0 "[ . 1 . 2 . 3]"
1 66 TYR 10.700 0.373 18 0 "[ . 1 . 2 . 3]"
1 67 PRO 1.918 0.109 17 0 "[ . 1 . 2 . 3]"
1 68 ASP 11.904 0.388 19 0 "[ . 1 . 2 . 3]"
1 69 LEU 5.208 0.388 19 0 "[ . 1 . 2 . 3]"
1 70 LYS 4.811 0.205 22 0 "[ . 1 . 2 . 3]"
1 71 GLY 0.105 0.017 18 0 "[ . 1 . 2 . 3]"
1 72 ARG 10.054 0.303 18 0 "[ . 1 . 2 . 3]"
1 73 VAL 6.132 0.210 13 0 "[ . 1 . 2 . 3]"
1 74 HIS 13.731 0.303 18 0 "[ . 1 . 2 . 3]"
1 75 PHE 10.561 0.191 7 0 "[ . 1 . 2 . 3]"
1 76 THR 2.782 0.071 25 0 "[ . 1 . 2 . 3]"
1 77 SER 4.433 0.136 17 0 "[ . 1 . 2 . 3]"
1 78 ASN 3.664 0.136 17 0 "[ . 1 . 2 . 3]"
1 79 ASP 3.020 0.122 21 0 "[ . 1 . 2 . 3]"
1 80 LEU 3.299 0.122 21 0 "[ . 1 . 2 . 3]"
1 81 LYS 10.148 0.343 19 0 "[ . 1 . 2 . 3]"
1 82 SER 9.012 0.343 19 0 "[ . 1 . 2 . 3]"
1 83 GLY 0.936 0.045 30 0 "[ . 1 . 2 . 3]"
1 84 ASP 2.456 0.098 5 0 "[ . 1 . 2 . 3]"
1 85 ALA 4.327 0.125 4 0 "[ . 1 . 2 . 3]"
1 86 SER 2.831 0.088 11 0 "[ . 1 . 2 . 3]"
1 87 ILE 7.796 0.191 7 0 "[ . 1 . 2 . 3]"
1 88 ASN 5.049 0.218 3 0 "[ . 1 . 2 . 3]"
1 89 VAL 12.598 0.419 5 0 "[ . 1 . 2 . 3]"
1 90 THR 13.607 0.419 5 0 "[ . 1 . 2 . 3]"
1 91 ASN 3.807 0.130 7 0 "[ . 1 . 2 . 3]"
1 92 LEU 11.883 0.411 9 0 "[ . 1 . 2 . 3]"
1 93 GLN 5.572 0.216 16 0 "[ . 1 . 2 . 3]"
1 94 LEU 1.629 0.070 16 0 "[ . 1 . 2 . 3]"
1 95 SER 3.474 0.111 26 0 "[ . 1 . 2 . 3]"
1 96 ASP 0.014 0.010 8 0 "[ . 1 . 2 . 3]"
1 97 ILE 2.711 0.187 26 0 "[ . 1 . 2 . 3]"
1 98 GLY 1.170 0.063 15 0 "[ . 1 . 2 . 3]"
1 99 THR 1.373 0.086 20 0 "[ . 1 . 2 . 3]"
1 100 TYR 1.060 0.079 15 0 "[ . 1 . 2 . 3]"
1 101 GLN 1.790 0.219 5 0 "[ . 1 . 2 . 3]"
1 102 CYS 0.064 0.026 12 0 "[ . 1 . 2 . 3]"
1 103 LYS 0.839 0.303 13 0 "[ . 1 . 2 . 3]"
1 104 VAL 0.459 0.119 3 0 "[ . 1 . 2 . 3]"
1 105 LYS 12.392 0.341 3 0 "[ . 1 . 2 . 3]"
1 106 LYS 2.332 0.150 18 0 "[ . 1 . 2 . 3]"
1 107 ALA 0.637 0.065 7 0 "[ . 1 . 2 . 3]"
1 108 PRO 0.228 0.088 24 0 "[ . 1 . 2 . 3]"
1 109 GLY 13.411 0.364 13 0 "[ . 1 . 2 . 3]"
1 110 VAL 11.412 0.364 13 0 "[ . 1 . 2 . 3]"
1 111 ALA 0.843 0.140 30 0 "[ . 1 . 2 . 3]"
1 112 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 113 LYS 5.698 0.222 30 0 "[ . 1 . 2 . 3]"
1 114 LYS 3.722 0.151 28 0 "[ . 1 . 2 . 3]"
1 115 ILE 1.389 0.079 15 0 "[ . 1 . 2 . 3]"
1 116 HIS 1.240 0.197 15 0 "[ . 1 . 2 . 3]"
1 117 LEU 3.151 0.197 15 0 "[ . 1 . 2 . 3]"
1 118 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 119 VAL 0.735 0.070 16 0 "[ . 1 . 2 . 3]"
1 120 LEU 0.842 0.050 23 0 "[ . 1 . 2 . 3]"
1 121 VAL 5.395 0.228 4 0 "[ . 1 . 2 . 3]"
1 122 LYS 4.175 0.228 4 0 "[ . 1 . 2 . 3]"
1 124 SER 1.239 0.068 2 0 "[ . 1 . 2 . 3]"
1 125 GLY 1.239 0.068 2 0 "[ . 1 . 2 . 3]"
1 126 ALA 1.107 0.184 11 0 "[ . 1 . 2 . 3]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 SER H 1 3 SER H 4.000 . 5.000 4.521 4.304 4.616 . 0 0 "[ . 1 . 2 . 3]" 1
2 1 2 SER HA 1 3 SER H 3.000 . 3.500 2.277 2.134 2.475 . 0 0 "[ . 1 . 2 . 3]" 1
3 1 3 SER H 1 3 SER HA 3.000 . 3.500 2.873 2.857 2.894 . 0 0 "[ . 1 . 2 . 3]" 1
4 1 3 SER HA 1 4 ILE H 3.000 . 3.500 2.265 2.124 2.448 . 0 0 "[ . 1 . 2 . 3]" 1
5 1 3 SER HA 1 4 ILE HA 4.000 . 6.000 4.431 4.344 4.493 . 0 0 "[ . 1 . 2 . 3]" 1
6 1 3 SER QB 1 4 ILE H 3.000 . 3.500 3.071 2.411 3.568 0.068 8 0 "[ . 1 . 2 . 3]" 1
7 1 4 ILE H 1 4 ILE HA 3.000 . 3.500 2.928 2.901 2.958 . 0 0 "[ . 1 . 2 . 3]" 1
8 1 4 ILE H 1 4 ILE HB 3.000 . 3.500 3.266 2.488 3.696 0.196 20 0 "[ . 1 . 2 . 3]" 1
9 1 4 ILE HA 1 4 ILE HB 3.000 . 3.500 2.696 2.452 3.027 . 0 0 "[ . 1 . 2 . 3]" 1
10 1 4 ILE HA 1 5 THR H 3.000 . 3.500 2.212 2.158 2.276 . 0 0 "[ . 1 . 2 . 3]" 1
11 1 4 ILE HA 1 24 LYS H 4.000 . 5.000 4.880 4.362 5.090 0.090 7 0 "[ . 1 . 2 . 3]" 1
12 1 4 ILE HA 1 25 PHE HA 4.000 . 6.000 2.664 1.956 3.482 . 0 0 "[ . 1 . 2 . 3]" 1
13 1 4 ILE HB 1 111 ALA MB 4.000 . 6.000 3.194 1.699 4.324 0.101 3 0 "[ . 1 . 2 . 3]" 1
14 1 4 ILE HB 1 113 LYS QB 4.000 . 6.000 4.093 2.688 5.258 . 0 0 "[ . 1 . 2 . 3]" 1
15 1 4 ILE MD 1 113 LYS QB 4.000 . 6.000 2.817 1.690 4.475 0.110 6 0 "[ . 1 . 2 . 3]" 1
16 1 4 ILE MG 1 5 THR H 4.000 . 5.000 3.220 2.050 3.963 . 0 0 "[ . 1 . 2 . 3]" 1
17 1 5 THR H 1 5 THR HA 3.000 . 3.500 2.924 2.907 2.941 . 0 0 "[ . 1 . 2 . 3]" 1
18 1 5 THR H 1 5 THR HB 4.000 . 5.000 3.522 3.341 3.682 . 0 0 "[ . 1 . 2 . 3]" 1
19 1 5 THR H 1 24 LYS H 4.000 . 5.000 3.612 3.219 3.968 . 0 0 "[ . 1 . 2 . 3]" 1
20 1 5 THR HA 1 5 THR HB 2.500 . 2.700 2.634 2.400 2.788 0.088 16 0 "[ . 1 . 2 . 3]" 1
21 1 5 THR HA 1 5 THR MG 3.000 . 3.800 2.186 1.990 2.440 . 0 0 "[ . 1 . 2 . 3]" 1
22 1 5 THR HA 1 6 THR H 2.500 . 2.900 2.217 2.092 2.299 . 0 0 "[ . 1 . 2 . 3]" 1
23 1 5 THR HA 1 7 PRO QD 3.000 . 3.800 3.539 3.509 3.581 . 0 0 "[ . 1 . 2 . 3]" 1
24 1 5 THR HB 1 6 THR H 4.000 . 5.000 2.764 2.398 3.289 . 0 0 "[ . 1 . 2 . 3]" 1
25 1 5 THR HB 1 24 LYS H 4.000 . 5.000 5.020 4.909 5.082 0.082 29 0 "[ . 1 . 2 . 3]" 1
26 1 6 THR H 1 6 THR HA 3.000 . 3.500 2.249 2.223 2.269 . 0 0 "[ . 1 . 2 . 3]" 1
27 1 6 THR H 1 6 THR HB 4.000 . 5.000 3.813 3.714 3.903 . 0 0 "[ . 1 . 2 . 3]" 1
28 1 6 THR H 1 6 THR MG 4.000 . 5.500 3.570 3.451 3.709 . 0 0 "[ . 1 . 2 . 3]" 1
29 1 6 THR HA 1 6 THR HB 2.500 . 2.700 2.892 2.865 2.925 0.225 2 0 "[ . 1 . 2 . 3]" 1
30 1 6 THR HA 1 6 THR MG 3.000 . 3.800 1.915 1.879 1.974 . 0 0 "[ . 1 . 2 . 3]" 1
31 1 6 THR HA 1 7 PRO QD 2.500 . 2.700 1.893 1.865 1.928 . 0 0 "[ . 1 . 2 . 3]" 1
32 1 6 THR HA 1 8 GLU H 4.000 . 5.000 4.417 3.142 5.007 0.007 21 0 "[ . 1 . 2 . 3]" 1
33 1 6 THR HB 1 9 GLU QB 4.000 . 5.000 3.911 3.203 4.472 . 0 0 "[ . 1 . 2 . 3]" 1
34 1 6 THR MG 1 7 PRO QD 3.000 . 3.800 2.900 2.886 2.907 . 0 0 "[ . 1 . 2 . 3]" 1
35 1 6 THR MG 1 8 GLU H 4.000 . 6.000 4.369 2.747 5.083 . 0 0 "[ . 1 . 2 . 3]" 1
36 1 6 THR MG 1 9 GLU QB 3.000 . 3.800 2.803 2.651 2.857 . 0 0 "[ . 1 . 2 . 3]" 1
37 1 7 PRO HA 1 8 GLU H 3.000 . 3.500 3.506 3.374 3.561 0.061 1 0 "[ . 1 . 2 . 3]" 1
38 1 7 PRO HA 1 113 LYS HA 3.000 . 3.300 2.772 2.032 3.238 . 0 0 "[ . 1 . 2 . 3]" 1
39 1 7 PRO HA 1 113 LYS QB 4.000 . 5.000 1.672 1.578 1.779 0.222 30 0 "[ . 1 . 2 . 3]" 1
40 1 7 PRO QB 1 8 GLU H 3.000 . 3.500 2.445 1.955 3.581 0.081 28 0 "[ . 1 . 2 . 3]" 1
41 1 7 PRO QB 1 113 LYS QB 3.000 . 3.800 3.111 3.055 3.178 . 0 0 "[ . 1 . 2 . 3]" 1
42 1 7 PRO QD 1 8 GLU H 4.000 . 5.000 2.973 2.456 3.316 . 0 0 "[ . 1 . 2 . 3]" 1
43 1 8 GLU H 1 8 GLU HA 3.000 . 3.500 2.886 2.868 2.921 . 0 0 "[ . 1 . 2 . 3]" 1
44 1 8 GLU H 1 8 GLU QB 3.000 . 3.500 2.435 2.284 2.738 . 0 0 "[ . 1 . 2 . 3]" 1
45 1 8 GLU HA 1 8 GLU QB . . 2.700 2.377 2.187 2.421 . 0 0 "[ . 1 . 2 . 3]" 1
46 1 8 GLU HA 1 9 GLU H 2.500 . 2.900 2.171 2.140 2.205 . 0 0 "[ . 1 . 2 . 3]" 1
47 1 8 GLU HA 1 114 LYS H 2.000 . 2.400 2.489 2.418 2.551 0.151 28 0 "[ . 1 . 2 . 3]" 1
48 1 8 GLU HA 1 114 LYS QB 4.000 . 5.000 1.787 1.744 1.837 0.056 2 0 "[ . 1 . 2 . 3]" 1
49 1 8 GLU HA 1 115 ILE HA 4.000 . 5.000 4.992 4.870 5.056 0.056 13 0 "[ . 1 . 2 . 3]" 1
50 1 8 GLU QB 1 9 GLU H 4.000 . 5.000 3.486 3.182 3.834 . 0 0 "[ . 1 . 2 . 3]" 1
51 1 9 GLU H 1 9 GLU HA 3.000 . 3.500 2.932 2.924 2.934 . 0 0 "[ . 1 . 2 . 3]" 1
52 1 9 GLU H 1 114 LYS H 4.000 2.800 4.500 3.700 3.577 3.794 . 0 0 "[ . 1 . 2 . 3]" 1
53 1 9 GLU H 1 115 ILE HA 3.000 . 3.500 3.098 3.004 3.204 . 0 0 "[ . 1 . 2 . 3]" 1
54 1 9 GLU HA 1 9 GLU QB 2.500 . 2.700 2.375 2.328 2.513 . 0 0 "[ . 1 . 2 . 3]" 1
55 1 9 GLU HA 1 9 GLU QG 3.000 . 3.800 2.534 2.177 2.998 . 0 0 "[ . 1 . 2 . 3]" 1
56 1 9 GLU HA 1 10 MET H 2.500 . 2.900 2.294 2.236 2.341 . 0 0 "[ . 1 . 2 . 3]" 1
57 1 9 GLU QB 1 10 MET H 3.000 . 3.500 3.270 2.842 3.380 . 0 0 "[ . 1 . 2 . 3]" 1
58 1 9 GLU QB 1 10 MET HA 4.000 . 5.000 4.308 3.883 4.455 . 0 0 "[ . 1 . 2 . 3]" 1
59 1 9 GLU QB 1 11 ILE MD 4.000 . 5.000 3.390 2.227 3.760 . 0 0 "[ . 1 . 2 . 3]" 1
60 1 9 GLU QB 1 11 ILE QG 4.000 . 5.000 3.902 3.331 4.091 . 0 0 "[ . 1 . 2 . 3]" 1
61 1 9 GLU QB 1 114 LYS QB 4.000 . 5.000 4.121 4.105 4.154 . 0 0 "[ . 1 . 2 . 3]" 1
62 1 9 GLU QG 1 10 MET H 4.000 . 5.000 2.089 1.899 3.485 . 0 0 "[ . 1 . 2 . 3]" 1
63 1 9 GLU QG 1 115 ILE QG 3.000 . 3.800 3.098 2.329 3.700 . 0 0 "[ . 1 . 2 . 3]" 1
64 1 10 MET H 1 10 MET HA 3.000 . 3.500 2.926 2.917 2.939 . 0 0 "[ . 1 . 2 . 3]" 1
65 1 10 MET H 1 10 MET QB 3.000 . 3.500 2.634 2.549 2.676 . 0 0 "[ . 1 . 2 . 3]" 1
66 1 10 MET H 1 11 ILE H 4.000 . 5.500 4.177 4.018 4.340 . 0 0 "[ . 1 . 2 . 3]" 1
67 1 10 MET H 1 116 HIS H 4.000 . 5.000 4.085 3.933 4.254 . 0 0 "[ . 1 . 2 . 3]" 1
68 1 10 MET HA 1 10 MET QB 2.500 . 2.700 2.437 2.339 2.501 . 0 0 "[ . 1 . 2 . 3]" 1
69 1 10 MET HA 1 10 MET QG 3.000 . 3.800 2.351 2.273 2.503 . 0 0 "[ . 1 . 2 . 3]" 1
70 1 10 MET HA 1 11 ILE H 2.500 . 2.900 2.162 2.104 2.204 . 0 0 "[ . 1 . 2 . 3]" 1
71 1 10 MET HA 1 115 ILE HA 4.000 . 5.000 3.790 3.554 4.047 . 0 0 "[ . 1 . 2 . 3]" 1
72 1 10 MET HA 1 115 ILE MG 4.000 . 5.000 3.871 3.491 4.194 . 0 0 "[ . 1 . 2 . 3]" 1
73 1 10 MET HA 1 116 HIS H 3.000 . 3.500 2.098 1.882 2.294 . 0 0 "[ . 1 . 2 . 3]" 1
74 1 10 MET HA 1 116 HIS QB 4.000 . 5.000 2.244 2.016 3.048 . 0 0 "[ . 1 . 2 . 3]" 1
75 1 10 MET HA 1 117 LEU HA 4.000 . 5.000 5.015 4.868 5.073 0.073 6 0 "[ . 1 . 2 . 3]" 1
76 1 10 MET QB 1 11 ILE H 3.000 . 3.500 3.484 3.165 3.710 0.210 22 0 "[ . 1 . 2 . 3]" 1
77 1 10 MET QB 1 116 HIS QB 4.000 . 5.000 3.271 2.756 3.984 . 0 0 "[ . 1 . 2 . 3]" 1
78 1 10 MET QG 1 118 VAL MG2 4.000 . 5.000 3.380 2.605 3.770 . 0 0 "[ . 1 . 2 . 3]" 1
79 1 11 ILE H 1 11 ILE HA 3.000 . 3.500 2.946 2.934 2.953 . 0 0 "[ . 1 . 2 . 3]" 1
80 1 11 ILE H 1 11 ILE HB 3.000 . 3.500 2.732 2.605 2.827 . 0 0 "[ . 1 . 2 . 3]" 1
81 1 11 ILE H 1 11 ILE MG 4.000 . 5.500 3.895 3.846 3.934 . 0 0 "[ . 1 . 2 . 3]" 1
82 1 11 ILE H 1 116 HIS H 4.000 . 5.000 3.213 3.012 3.383 . 0 0 "[ . 1 . 2 . 3]" 1
83 1 11 ILE H 1 116 HIS QB 4.000 . 5.000 3.284 3.071 3.578 . 0 0 "[ . 1 . 2 . 3]" 1
84 1 11 ILE H 1 117 LEU HA 3.000 . 3.500 3.247 3.093 3.340 . 0 0 "[ . 1 . 2 . 3]" 1
85 1 11 ILE H 1 118 VAL H 4.000 . 4.500 3.997 3.799 4.419 . 0 0 "[ . 1 . 2 . 3]" 1
86 1 11 ILE HA 1 11 ILE MD 2.500 . 3.200 2.269 1.840 3.321 0.121 30 0 "[ . 1 . 2 . 3]" 1
87 1 11 ILE HA 1 12 GLU H 2.500 . 2.900 2.177 2.128 2.232 . 0 0 "[ . 1 . 2 . 3]" 1
88 1 11 ILE HB 1 12 GLU H 4.000 . 5.000 4.078 3.917 4.308 . 0 0 "[ . 1 . 2 . 3]" 1
89 1 11 ILE HB 1 21 LEU QD 4.000 . 5.000 3.219 2.693 3.740 . 0 0 "[ . 1 . 2 . 3]" 1
90 1 11 ILE HB 1 115 ILE MG 3.000 . 3.800 3.148 2.955 3.217 . 0 0 "[ . 1 . 2 . 3]" 1
91 1 11 ILE HB 1 117 LEU HA 3.000 . 3.300 2.763 2.200 3.138 . 0 0 "[ . 1 . 2 . 3]" 1
92 1 11 ILE HB 1 117 LEU QD 3.000 . 3.800 2.468 1.827 2.834 . 0 0 "[ . 1 . 2 . 3]" 1
93 1 11 ILE MD 1 115 ILE MD 4.000 . 5.000 4.106 2.938 5.028 0.028 1 0 "[ . 1 . 2 . 3]" 1
94 1 11 ILE QG 1 21 LEU HA 4.000 . 5.000 3.276 2.490 4.388 . 0 0 "[ . 1 . 2 . 3]" 1
95 1 11 ILE QG 1 21 LEU QD 3.000 . 3.800 2.667 1.894 3.703 . 0 0 "[ . 1 . 2 . 3]" 1
96 1 11 ILE QG 1 22 PRO QD 3.000 . 3.800 3.142 2.561 3.761 . 0 0 "[ . 1 . 2 . 3]" 1
97 1 11 ILE QG 1 115 ILE MG 3.000 . 3.800 2.200 1.779 3.405 0.021 15 0 "[ . 1 . 2 . 3]" 1
98 1 11 ILE MG 1 19 ALA MB 3.000 . 3.800 2.547 2.228 2.672 . 0 0 "[ . 1 . 2 . 3]" 1
99 1 11 ILE MG 1 117 LEU QD 4.000 . 5.000 2.577 2.068 3.088 . 0 0 "[ . 1 . 2 . 3]" 1
100 1 12 GLU H 1 12 GLU HA 3.000 . 3.500 2.944 2.924 2.955 . 0 0 "[ . 1 . 2 . 3]" 1
101 1 12 GLU H 1 12 GLU QB 3.000 . 3.500 2.727 2.471 3.102 . 0 0 "[ . 1 . 2 . 3]" 1
102 1 12 GLU HA 1 12 GLU QB 2.500 . 2.700 2.304 2.177 2.373 . 0 0 "[ . 1 . 2 . 3]" 1
103 1 12 GLU HA 1 13 LYS H 2.500 . 2.900 2.180 2.146 2.210 . 0 0 "[ . 1 . 2 . 3]" 1
104 1 12 GLU HA 1 117 LEU QD 4.000 . 5.000 3.576 3.204 3.740 . 0 0 "[ . 1 . 2 . 3]" 1
105 1 12 GLU HA 1 118 VAL H 3.000 . 3.500 2.537 2.169 2.773 . 0 0 "[ . 1 . 2 . 3]" 1
106 1 12 GLU HA 1 118 VAL HB 3.000 . 3.300 2.259 1.920 2.843 . 0 0 "[ . 1 . 2 . 3]" 1
107 1 12 GLU QB 1 13 LYS H 3.000 . 3.500 3.238 3.158 3.347 . 0 0 "[ . 1 . 2 . 3]" 1
108 1 12 GLU QB 1 118 VAL HB 3.000 . 3.300 2.683 1.887 2.976 . 0 0 "[ . 1 . 2 . 3]" 1
109 1 12 GLU QB 1 120 LEU HG 3.000 . 3.800 3.171 2.843 3.417 . 0 0 "[ . 1 . 2 . 3]" 1
110 1 13 LYS H 1 13 LYS HA 3.000 . 3.500 2.922 2.916 2.929 . 0 0 "[ . 1 . 2 . 3]" 1
111 1 13 LYS H 1 118 VAL H 4.000 . 5.000 3.709 3.477 4.074 . 0 0 "[ . 1 . 2 . 3]" 1
112 1 13 LYS H 1 119 VAL H 4.000 . 5.000 4.838 4.653 5.010 0.010 25 0 "[ . 1 . 2 . 3]" 1
113 1 13 LYS H 1 119 VAL HA 3.000 . 3.500 2.998 2.779 3.396 . 0 0 "[ . 1 . 2 . 3]" 1
114 1 13 LYS H 1 120 LEU H 3.000 . 3.500 3.527 3.503 3.550 0.050 23 0 "[ . 1 . 2 . 3]" 1
115 1 13 LYS HA 1 13 LYS QB 2.500 . 2.700 2.385 2.362 2.424 . 0 0 "[ . 1 . 2 . 3]" 1
116 1 13 LYS HA 1 13 LYS QD 2.500 . 2.700 2.068 1.932 2.202 . 0 0 "[ . 1 . 2 . 3]" 1
117 1 13 LYS HA 1 14 ALA H 3.000 . 3.500 2.361 2.278 2.418 . 0 0 "[ . 1 . 2 . 3]" 1
118 1 13 LYS QB 1 14 ALA H 3.000 . 3.500 2.834 2.368 3.450 . 0 0 "[ . 1 . 2 . 3]" 1
119 1 13 LYS QB 1 92 LEU QD 3.000 . 3.800 1.712 1.582 1.844 0.218 14 0 "[ . 1 . 2 . 3]" 1
120 1 14 ALA H 1 14 ALA HA 3.000 . 3.500 2.867 2.858 2.874 . 0 0 "[ . 1 . 2 . 3]" 1
121 1 14 ALA H 1 14 ALA MB 3.000 . 4.000 2.106 2.038 2.261 . 0 0 "[ . 1 . 2 . 3]" 1
122 1 14 ALA H 1 15 LYS H 4.000 . 5.000 4.597 4.549 4.620 . 0 0 "[ . 1 . 2 . 3]" 1
123 1 14 ALA H 1 120 LEU H 4.000 . 5.000 4.302 3.977 4.598 . 0 0 "[ . 1 . 2 . 3]" 1
124 1 14 ALA HA 1 15 LYS H 2.500 . 2.900 2.198 2.151 2.233 . 0 0 "[ . 1 . 2 . 3]" 1
125 1 14 ALA HA 1 119 VAL HA 4.000 . 5.000 4.238 3.948 4.639 . 0 0 "[ . 1 . 2 . 3]" 1
126 1 14 ALA MB 1 15 LYS H 3.000 . 4.000 2.945 2.786 3.095 . 0 0 "[ . 1 . 2 . 3]" 1
127 1 14 ALA MB 1 17 GLU QG 3.000 . 3.800 2.364 1.810 2.827 . 0 0 "[ . 1 . 2 . 3]" 1
128 1 14 ALA MB 1 120 LEU QB 4.000 . 5.000 2.696 2.323 3.073 . 0 0 "[ . 1 . 2 . 3]" 1
129 1 15 LYS H 1 15 LYS HA 3.000 . 3.500 2.733 2.706 2.749 . 0 0 "[ . 1 . 2 . 3]" 1
130 1 15 LYS H 1 15 LYS QB 3.000 . 3.500 2.278 2.067 2.500 . 0 0 "[ . 1 . 2 . 3]" 1
131 1 15 LYS H 1 16 GLY H 4.000 . 6.000 4.592 4.557 4.634 . 0 0 "[ . 1 . 2 . 3]" 1
132 1 15 LYS H 1 120 LEU H 3.000 . 3.500 3.314 2.934 3.512 0.012 2 0 "[ . 1 . 2 . 3]" 1
133 1 15 LYS H 1 121 VAL HA 4.000 . 5.000 4.225 3.894 4.745 . 0 0 "[ . 1 . 2 . 3]" 1
134 1 15 LYS H 1 122 LYS QG 3.000 . 3.500 2.727 2.200 3.504 0.004 21 0 "[ . 1 . 2 . 3]" 1
135 1 15 LYS HA 1 16 GLY H 3.000 . 3.500 2.185 2.152 2.310 . 0 0 "[ . 1 . 2 . 3]" 1
136 1 15 LYS HA 1 17 GLU H 3.000 . 3.500 3.455 3.404 3.512 0.012 29 0 "[ . 1 . 2 . 3]" 1
137 1 15 LYS HA 1 92 LEU QB 3.000 . 3.300 2.444 1.872 2.876 . 0 0 "[ . 1 . 2 . 3]" 1
138 1 15 LYS HA 1 119 VAL QG 4.000 . 5.000 2.124 1.851 2.826 . 0 0 "[ . 1 . 2 . 3]" 1
139 1 15 LYS QG 1 16 GLY H 3.000 . 3.500 2.901 2.241 3.638 0.138 2 0 "[ . 1 . 2 . 3]" 1
140 1 15 LYS QG 1 93 GLN HA 3.000 . 3.300 2.605 1.666 2.975 0.134 1 0 "[ . 1 . 2 . 3]" 1
141 1 16 GLY H 1 16 GLY HA2 3.000 . 3.500 2.323 2.288 2.350 . 0 0 "[ . 1 . 2 . 3]" 1
142 1 16 GLY H 1 16 GLY HA3 3.000 . 3.500 2.893 2.824 2.921 . 0 0 "[ . 1 . 2 . 3]" 1
143 1 16 GLY H 1 17 GLU H 3.000 . 3.500 2.877 2.700 3.163 . 0 0 "[ . 1 . 2 . 3]" 1
144 1 16 GLY H 1 91 ASN HA 4.000 . 5.000 3.990 3.664 4.413 . 0 0 "[ . 1 . 2 . 3]" 1
145 1 16 GLY H 1 92 LEU H 3.000 . 3.500 3.132 2.876 3.433 . 0 0 "[ . 1 . 2 . 3]" 1
146 1 16 GLY QA 1 17 GLU H 3.000 . 3.500 2.864 2.825 2.893 . 0 0 "[ . 1 . 2 . 3]" 1
147 1 16 GLY QA 1 91 ASN HA 2.500 . 2.700 2.154 1.813 2.607 . 0 0 "[ . 1 . 2 . 3]" 1
148 1 16 GLY QA 1 92 LEU H 3.000 . 3.300 2.984 2.953 3.024 . 0 0 "[ . 1 . 2 . 3]" 1
149 1 17 GLU H 1 17 GLU HA 3.000 . 3.500 2.883 2.876 2.889 . 0 0 "[ . 1 . 2 . 3]" 1
150 1 17 GLU H 1 18 THR H 4.000 . 5.000 4.596 4.185 4.623 . 0 0 "[ . 1 . 2 . 3]" 1
151 1 17 GLU H 1 92 LEU H 3.000 . 3.500 3.509 3.441 3.543 0.043 11 0 "[ . 1 . 2 . 3]" 1
152 1 17 GLU H 1 92 LEU QB 4.000 . 5.000 2.650 2.387 2.908 . 0 0 "[ . 1 . 2 . 3]" 1
153 1 17 GLU HA 1 18 THR H 2.500 . 2.900 2.429 2.362 3.013 0.113 9 0 "[ . 1 . 2 . 3]" 1
154 1 17 GLU HA 1 91 ASN HA 4.000 . 5.000 4.537 4.361 4.819 . 0 0 "[ . 1 . 2 . 3]" 1
155 1 17 GLU QB 1 18 THR H 2.500 . 2.900 2.511 1.787 2.626 0.013 9 0 "[ . 1 . 2 . 3]" 1
156 1 17 GLU QB 1 92 LEU QD 3.000 . 3.800 2.494 2.059 2.549 . 0 0 "[ . 1 . 2 . 3]" 1
157 1 18 THR H 1 18 THR HA 3.000 . 3.500 2.894 2.882 2.922 . 0 0 "[ . 1 . 2 . 3]" 1
158 1 18 THR H 1 18 THR HB 2.500 . 2.900 2.599 2.497 2.881 . 0 0 "[ . 1 . 2 . 3]" 1
159 1 18 THR H 1 18 THR MG 4.000 . 5.500 3.809 3.741 3.912 . 0 0 "[ . 1 . 2 . 3]" 1
160 1 18 THR H 1 19 ALA H 4.000 . 5.000 4.510 4.269 4.601 . 0 0 "[ . 1 . 2 . 3]" 1
161 1 18 THR HA 1 19 ALA H 2.500 . 2.900 2.191 2.160 2.289 . 0 0 "[ . 1 . 2 . 3]" 1
162 1 18 THR HA 1 90 THR HA 2.500 . 2.700 2.743 2.700 2.809 0.109 9 0 "[ . 1 . 2 . 3]" 1
163 1 18 THR HA 1 91 ASN H 3.000 . 3.500 3.573 3.530 3.630 0.130 7 0 "[ . 1 . 2 . 3]" 1
164 1 18 THR HA 1 92 LEU H 3.000 . 3.500 3.508 3.443 3.549 0.049 5 0 "[ . 1 . 2 . 3]" 1
165 1 18 THR HA 1 92 LEU HG 3.000 . 3.300 2.962 2.714 3.711 0.411 9 0 "[ . 1 . 2 . 3]" 1
166 1 18 THR HB 1 19 ALA H 4.000 . 5.000 4.124 3.835 4.223 . 0 0 "[ . 1 . 2 . 3]" 1
167 1 18 THR MG 1 19 ALA H 4.000 . 5.500 2.413 2.284 2.793 . 0 0 "[ . 1 . 2 . 3]" 1
168 1 18 THR MG 1 88 ASN QB 3.000 . 3.800 1.859 1.756 2.321 0.044 16 0 "[ . 1 . 2 . 3]" 1
169 1 18 THR MG 1 89 VAL H 3.000 . 4.000 2.505 2.318 2.975 . 0 0 "[ . 1 . 2 . 3]" 1
170 1 18 THR MG 1 89 VAL MG2 4.000 . 5.000 3.530 3.504 3.653 . 0 0 "[ . 1 . 2 . 3]" 1
171 1 18 THR MG 1 90 THR HA 4.000 . 5.500 2.495 1.663 2.773 0.137 5 0 "[ . 1 . 2 . 3]" 1
172 1 18 THR MG 1 90 THR MG 3.000 . 3.800 2.663 2.514 2.834 . 0 0 "[ . 1 . 2 . 3]" 1
173 1 18 THR MG 1 91 ASN H 4.000 . 5.500 4.255 3.485 4.448 . 0 0 "[ . 1 . 2 . 3]" 1
174 1 19 ALA H 1 19 ALA HA 3.000 . 3.500 2.934 2.923 2.949 . 0 0 "[ . 1 . 2 . 3]" 1
175 1 19 ALA H 1 19 ALA MB 3.000 . 4.000 2.259 2.184 2.390 . 0 0 "[ . 1 . 2 . 3]" 1
176 1 19 ALA H 1 88 ASN HA 4.000 . 5.000 4.558 4.313 4.723 . 0 0 "[ . 1 . 2 . 3]" 1
177 1 19 ALA H 1 89 VAL H 3.000 . 3.500 2.559 2.232 2.790 . 0 0 "[ . 1 . 2 . 3]" 1
178 1 19 ALA H 1 89 VAL HB 3.000 . 3.500 2.826 2.498 3.754 0.254 5 0 "[ . 1 . 2 . 3]" 1
179 1 19 ALA H 1 90 THR HA 4.000 . 5.000 4.333 4.278 4.430 . 0 0 "[ . 1 . 2 . 3]" 1
180 1 19 ALA H 1 92 LEU H 4.000 . 5.000 4.667 4.509 4.964 . 0 0 "[ . 1 . 2 . 3]" 1
181 1 19 ALA H 1 92 LEU HG 3.000 . 3.500 2.709 2.481 3.232 . 0 0 "[ . 1 . 2 . 3]" 1
182 1 19 ALA HA 1 20 TYR H 2.500 . 2.900 2.124 2.104 2.144 . 0 0 "[ . 1 . 2 . 3]" 1
183 1 19 ALA MB 1 20 TYR H 4.000 . 5.500 3.282 3.206 3.356 . 0 0 "[ . 1 . 2 . 3]" 1
184 1 19 ALA MB 1 21 LEU QD 4.000 . 5.000 2.514 2.224 2.899 . 0 0 "[ . 1 . 2 . 3]" 1
185 1 19 ALA MB 1 89 VAL H 3.000 . 4.000 3.134 2.696 3.383 . 0 0 "[ . 1 . 2 . 3]" 1
186 1 19 ALA MB 1 89 VAL HB 3.000 . 3.800 3.097 2.733 3.312 . 0 0 "[ . 1 . 2 . 3]" 1
187 1 19 ALA MB 1 92 LEU QD 3.000 . 3.800 1.710 1.554 2.387 0.246 28 0 "[ . 1 . 2 . 3]" 1
188 1 19 ALA MB 1 117 LEU QD 3.000 . 3.800 1.850 1.608 2.194 0.192 27 0 "[ . 1 . 2 . 3]" 1
189 1 20 TYR H 1 20 TYR HA 3.000 . 3.500 2.869 2.862 2.876 . 0 0 "[ . 1 . 2 . 3]" 1
190 1 20 TYR H 1 20 TYR QB 2.500 . 2.900 2.252 2.227 2.280 . 0 0 "[ . 1 . 2 . 3]" 1
191 1 20 TYR HA 1 20 TYR QD 4.000 . 5.000 2.817 2.297 3.159 . 0 0 "[ . 1 . 2 . 3]" 1
192 1 20 TYR HA 1 21 LEU H 2.500 . 2.900 2.143 2.126 2.171 . 0 0 "[ . 1 . 2 . 3]" 1
193 1 20 TYR HA 1 76 THR MG 4.000 . 5.500 3.805 3.484 4.466 . 0 0 "[ . 1 . 2 . 3]" 1
194 1 20 TYR HA 1 88 ASN HA 3.000 . 3.300 2.235 2.044 2.510 . 0 0 "[ . 1 . 2 . 3]" 1
195 1 20 TYR HA 1 88 ASN QB 3.000 . 3.300 2.187 1.947 2.997 . 0 0 "[ . 1 . 2 . 3]" 1
196 1 20 TYR HA 1 89 VAL H 4.000 . 5.000 3.691 3.545 3.973 . 0 0 "[ . 1 . 2 . 3]" 1
197 1 20 TYR QB 1 21 LEU H 4.000 . 5.000 3.826 3.694 3.896 . 0 0 "[ . 1 . 2 . 3]" 1
198 1 20 TYR QD 1 21 LEU H 4.000 . 5.000 3.536 3.075 3.830 . 0 0 "[ . 1 . 2 . 3]" 1
199 1 20 TYR QD 1 76 THR MG 3.000 . 3.800 2.105 1.806 3.389 . 0 0 "[ . 1 . 2 . 3]" 1
200 1 20 TYR QD 1 88 ASN HA 4.000 . 5.000 4.221 3.670 4.561 . 0 0 "[ . 1 . 2 . 3]" 1
201 1 20 TYR QD 1 88 ASN QB 4.000 . 5.000 2.432 1.973 3.025 . 0 0 "[ . 1 . 2 . 3]" 1
202 1 20 TYR QE 1 21 LEU H 4.000 . 5.000 4.657 4.172 4.930 . 0 0 "[ . 1 . 2 . 3]" 1
203 1 20 TYR QE 1 76 THR HB 3.000 . 3.500 3.013 2.512 3.192 . 0 0 "[ . 1 . 2 . 3]" 1
204 1 20 TYR QE 1 86 SER QB 3.000 . 3.500 2.756 2.321 2.851 . 0 0 "[ . 1 . 2 . 3]" 1
205 1 21 LEU H 1 21 LEU HA 3.000 . 3.500 2.944 2.934 2.952 . 0 0 "[ . 1 . 2 . 3]" 1
206 1 21 LEU H 1 21 LEU QB 3.000 . 3.500 2.630 2.518 2.762 . 0 0 "[ . 1 . 2 . 3]" 1
207 1 21 LEU H 1 21 LEU HG 3.000 . 3.500 2.649 2.457 3.526 0.026 7 0 "[ . 1 . 2 . 3]" 1
208 1 21 LEU H 1 86 SER QB 4.000 . 5.000 4.041 3.721 4.912 . 0 0 "[ . 1 . 2 . 3]" 1
209 1 21 LEU H 1 87 ILE H 3.000 . 3.500 3.493 3.415 3.529 0.029 27 0 "[ . 1 . 2 . 3]" 1
210 1 21 LEU H 1 88 ASN HA 4.000 . 5.000 2.411 2.196 2.758 . 0 0 "[ . 1 . 2 . 3]" 1
211 1 21 LEU HA 1 22 PRO QD 2.500 . 2.700 1.979 1.830 2.019 . 0 0 "[ . 1 . 2 . 3]" 1
212 1 21 LEU HA 1 115 ILE MD 4.000 . 5.500 3.146 2.388 4.582 . 0 0 "[ . 1 . 2 . 3]" 1
213 1 21 LEU QB 1 87 ILE H 4.000 . 5.000 2.661 2.491 2.884 . 0 0 "[ . 1 . 2 . 3]" 1
214 1 21 LEU QB 1 87 ILE MD 4.000 . 5.000 1.941 1.799 2.178 0.001 2 0 "[ . 1 . 2 . 3]" 1
215 1 21 LEU QB 1 115 ILE MD 4.000 . 5.000 2.172 1.840 3.385 . 0 0 "[ . 1 . 2 . 3]" 1
216 1 21 LEU QD 1 87 ILE MD . . 3.800 1.816 1.765 2.205 0.035 21 0 "[ . 1 . 2 . 3]" 1
217 1 21 LEU QD 1 87 ILE QG 3.000 . 3.800 3.580 3.440 3.767 . 0 0 "[ . 1 . 2 . 3]" 1
218 1 21 LEU QD 1 89 VAL H 4.000 . 5.000 3.702 2.794 4.036 . 0 0 "[ . 1 . 2 . 3]" 1
219 1 21 LEU QD 1 89 VAL QG 4.000 . 5.000 2.296 1.818 3.471 . 0 0 "[ . 1 . 2 . 3]" 1
220 1 21 LEU QD 1 100 TYR QD 4.000 . 5.500 2.531 2.196 3.027 . 0 0 "[ . 1 . 2 . 3]" 1
221 1 21 LEU QD 1 100 TYR QE 4.000 . 5.000 3.072 2.635 3.680 . 0 0 "[ . 1 . 2 . 3]" 1
222 1 21 LEU QD 1 115 ILE MD 4.000 . 5.000 2.832 1.871 3.809 . 0 0 "[ . 1 . 2 . 3]" 1
223 1 21 LEU QD 1 115 ILE MG 3.000 . 3.800 1.888 1.767 2.186 0.033 6 0 "[ . 1 . 2 . 3]" 1
224 1 21 LEU QD 1 117 LEU QD 3.000 . 3.800 2.412 1.757 2.994 0.043 4 0 "[ . 1 . 2 . 3]" 1
225 1 22 PRO HA 1 23 CYS H 2.500 . 2.900 2.118 2.071 2.212 . 0 0 "[ . 1 . 2 . 3]" 1
226 1 22 PRO HA 1 86 SER H 4.000 . 5.000 4.479 4.207 4.697 . 0 0 "[ . 1 . 2 . 3]" 1
227 1 22 PRO HA 1 86 SER HA 3.000 . 3.300 3.339 3.265 3.380 0.080 25 0 "[ . 1 . 2 . 3]" 1
228 1 22 PRO HA 1 86 SER QB 3.000 . 3.300 2.055 1.737 2.593 0.063 6 0 "[ . 1 . 2 . 3]" 1
229 1 22 PRO HA 1 87 ILE H 4.000 . 5.000 4.170 3.893 4.382 . 0 0 "[ . 1 . 2 . 3]" 1
230 1 22 PRO QB 1 23 CYS H 3.000 . 3.500 3.344 3.169 3.664 0.164 6 0 "[ . 1 . 2 . 3]" 1
231 1 22 PRO QD 1 115 ILE MD 3.000 . 3.800 2.470 1.899 3.800 . 21 0 "[ . 1 . 2 . 3]" 1
232 1 23 CYS H 1 23 CYS HA 3.000 . 3.500 2.921 2.903 2.945 . 0 0 "[ . 1 . 2 . 3]" 1
233 1 23 CYS H 1 24 LYS H 4.000 . 5.000 4.161 3.827 4.479 . 0 0 "[ . 1 . 2 . 3]" 1
234 1 23 CYS H 1 84 ASP HA 4.000 . 5.000 4.972 4.636 5.074 0.074 9 0 "[ . 1 . 2 . 3]" 1
235 1 23 CYS H 1 85 ALA H 4.000 . 5.000 4.010 3.669 4.217 . 0 0 "[ . 1 . 2 . 3]" 1
236 1 23 CYS H 1 86 SER H 4.000 . 5.000 3.214 2.961 3.425 . 0 0 "[ . 1 . 2 . 3]" 1
237 1 23 CYS H 1 86 SER HA 3.000 . 3.500 2.599 1.999 2.990 . 0 0 "[ . 1 . 2 . 3]" 1
238 1 23 CYS H 1 86 SER QB 3.000 . 3.500 2.488 1.798 3.127 0.002 22 0 "[ . 1 . 2 . 3]" 1
239 1 23 CYS HA 1 24 LYS H 2.500 . 2.900 2.161 2.091 2.218 . 0 0 "[ . 1 . 2 . 3]" 1
240 1 23 CYS HA 1 113 LYS QD 3.000 . 3.300 2.955 2.830 3.026 . 0 0 "[ . 1 . 2 . 3]" 1
241 1 23 CYS QB 1 24 LYS H 3.000 . 3.500 3.620 3.459 3.730 0.230 9 0 "[ . 1 . 2 . 3]" 1
242 1 23 CYS QB 1 85 ALA MB 4.000 . 5.000 2.344 1.743 2.978 0.057 25 0 "[ . 1 . 2 . 3]" 1
243 1 23 CYS QB 1 86 SER HA 3.000 . 3.300 2.720 2.474 2.889 . 0 0 "[ . 1 . 2 . 3]" 1
244 1 24 LYS H 1 24 LYS HA 3.000 . 3.500 2.925 2.915 2.946 . 0 0 "[ . 1 . 2 . 3]" 1
245 1 24 LYS H 1 24 LYS QB 3.000 . 3.500 2.661 2.351 2.822 . 0 0 "[ . 1 . 2 . 3]" 1
246 1 24 LYS H 1 25 PHE H 4.000 . 5.000 4.276 3.909 4.515 . 0 0 "[ . 1 . 2 . 3]" 1
247 1 24 LYS HA 1 25 PHE H 2.500 . 2.900 2.190 2.074 2.299 . 0 0 "[ . 1 . 2 . 3]" 1
248 1 24 LYS HA 1 84 ASP HA 3.000 . 3.300 2.731 2.465 3.110 . 0 0 "[ . 1 . 2 . 3]" 1
249 1 24 LYS HA 1 85 ALA H 3.000 . 3.500 2.850 2.379 3.431 . 0 0 "[ . 1 . 2 . 3]" 1
250 1 24 LYS HA 1 86 SER H 4.000 . 5.000 4.823 4.483 5.032 0.032 6 0 "[ . 1 . 2 . 3]" 1
251 1 24 LYS QB 1 25 PHE H 4.000 . 5.000 3.171 2.593 3.938 . 0 0 "[ . 1 . 2 . 3]" 1
252 1 24 LYS QD 1 85 ALA H 4.000 . 5.000 4.504 3.008 5.097 0.097 21 0 "[ . 1 . 2 . 3]" 1
253 1 25 PHE H 1 25 PHE HA 3.000 . 3.500 2.928 2.909 2.939 . 0 0 "[ . 1 . 2 . 3]" 1
254 1 25 PHE H 1 25 PHE QB 3.000 . 3.500 3.007 2.760 3.147 . 0 0 "[ . 1 . 2 . 3]" 1
255 1 25 PHE H 1 25 PHE QD 3.000 . 3.500 2.631 2.019 3.146 . 0 0 "[ . 1 . 2 . 3]" 1
256 1 25 PHE H 1 25 PHE QE 4.000 . 5.000 4.028 3.682 4.331 . 0 0 "[ . 1 . 2 . 3]" 1
257 1 25 PHE H 1 83 GLY HA2 3.000 . 3.500 3.345 3.100 3.538 0.038 1 0 "[ . 1 . 2 . 3]" 1
258 1 25 PHE H 1 83 GLY HA3 4.000 . 5.000 3.701 3.268 4.141 . 0 0 "[ . 1 . 2 . 3]" 1
259 1 25 PHE H 1 84 ASP H 4.000 . 5.000 4.983 4.780 5.098 0.098 5 0 "[ . 1 . 2 . 3]" 1
260 1 25 PHE H 1 84 ASP HA 4.000 . 5.000 3.921 3.784 4.102 . 0 0 "[ . 1 . 2 . 3]" 1
261 1 25 PHE H 1 85 ALA H 4.000 . 5.000 4.184 3.686 4.574 . 0 0 "[ . 1 . 2 . 3]" 1
262 1 25 PHE HA 1 26 THR H 2.500 . 2.900 2.213 2.156 2.304 . 0 0 "[ . 1 . 2 . 3]" 1
263 1 25 PHE QB 1 26 THR H 2.500 . 2.900 2.880 2.649 2.962 0.062 23 0 "[ . 1 . 2 . 3]" 1
264 1 25 PHE QD 1 26 THR H 4.000 . 5.000 3.977 3.600 4.205 . 0 0 "[ . 1 . 2 . 3]" 1
265 1 25 PHE QD 1 27 LEU H 4.000 . 5.500 4.799 4.127 5.294 . 0 0 "[ . 1 . 2 . 3]" 1
266 1 25 PHE QD 1 27 LEU QD 4.000 . 5.500 2.896 1.912 4.621 . 0 0 "[ . 1 . 2 . 3]" 1
267 1 25 PHE QD 1 83 GLY QA 4.000 . 5.000 3.145 2.986 3.315 . 0 0 "[ . 1 . 2 . 3]" 1
268 1 25 PHE QD 1 85 ALA H 3.000 . 3.500 3.539 3.363 3.590 0.090 18 0 "[ . 1 . 2 . 3]" 1
269 1 25 PHE QD 1 85 ALA MB . . 3.300 2.429 2.005 2.509 . 0 0 "[ . 1 . 2 . 3]" 1
270 1 25 PHE QD 1 104 VAL QG 4.000 . 5.000 2.143 1.898 2.556 . 0 0 "[ . 1 . 2 . 3]" 1
271 1 25 PHE QE 1 37 ILE MD 3.000 . 3.500 2.553 2.153 2.640 . 0 0 "[ . 1 . 2 . 3]" 1
272 1 25 PHE QE 1 83 GLY QA 4.000 . 5.000 2.704 2.372 2.833 . 0 0 "[ . 1 . 2 . 3]" 1
273 1 25 PHE QE 1 85 ALA H 3.000 . 3.500 3.410 3.232 3.534 0.034 11 0 "[ . 1 . 2 . 3]" 1
274 1 25 PHE QE 1 85 ALA MB 3.000 . 3.500 2.002 1.821 2.181 . 0 0 "[ . 1 . 2 . 3]" 1
275 1 25 PHE HZ 1 35 LEU QD 3.000 . 3.500 2.204 1.785 2.602 0.015 22 0 "[ . 1 . 2 . 3]" 1
276 1 25 PHE HZ 1 37 ILE MD 4.000 . 5.000 3.748 3.192 4.168 . 0 0 "[ . 1 . 2 . 3]" 1
277 1 25 PHE HZ 1 81 LYS HA 3.000 . 3.300 2.898 2.372 3.360 0.060 19 0 "[ . 1 . 2 . 3]" 1
278 1 25 PHE HZ 1 83 GLY QA 3.000 . 3.300 2.949 2.829 2.989 . 0 0 "[ . 1 . 2 . 3]" 1
279 1 26 THR H 1 26 THR HA 3.000 . 3.500 2.891 2.866 2.919 . 0 0 "[ . 1 . 2 . 3]" 1
280 1 26 THR H 1 26 THR HB 3.000 . 3.500 3.156 2.553 3.581 0.081 20 0 "[ . 1 . 2 . 3]" 1
281 1 26 THR H 1 26 THR MG 4.000 . 5.500 3.145 1.967 3.791 . 0 0 "[ . 1 . 2 . 3]" 1
282 1 26 THR H 1 27 LEU H 4.000 . 5.000 4.569 4.495 4.614 . 0 0 "[ . 1 . 2 . 3]" 1
283 1 26 THR HA 1 27 LEU H 2.500 . 2.900 2.271 2.128 2.470 . 0 0 "[ . 1 . 2 . 3]" 1
284 1 26 THR HB 1 27 LEU H 3.000 . 3.500 3.292 2.339 3.574 0.074 5 0 "[ . 1 . 2 . 3]" 1
285 1 26 THR MG 1 27 LEU H 3.000 . 4.000 3.012 1.889 3.751 . 0 0 "[ . 1 . 2 . 3]" 1
286 1 27 LEU H 1 27 LEU HA 3.000 . 3.500 2.926 2.905 2.940 . 0 0 "[ . 1 . 2 . 3]" 1
287 1 27 LEU H 1 27 LEU QB 2.500 . 2.900 2.468 2.287 2.749 . 0 0 "[ . 1 . 2 . 3]" 1
288 1 27 LEU H 1 27 LEU QD 4.000 . 5.500 3.478 2.326 3.995 . 0 0 "[ . 1 . 2 . 3]" 1
289 1 27 LEU H 1 28 SER H 4.000 . 5.000 4.403 3.852 4.605 . 0 0 "[ . 1 . 2 . 3]" 1
290 1 27 LEU HA 1 28 SER H 2.500 . 2.900 2.201 2.147 2.296 . 0 0 "[ . 1 . 2 . 3]" 1
291 1 27 LEU QB 1 28 SER H 3.000 . 4.000 3.241 2.674 3.975 . 0 0 "[ . 1 . 2 . 3]" 1
292 1 27 LEU QD 1 28 SER H 4.000 . 5.500 3.194 1.955 4.259 . 0 0 "[ . 1 . 2 . 3]" 1
293 1 27 LEU QD 1 35 LEU QD 4.000 . 5.000 2.871 1.781 4.168 0.019 9 0 "[ . 1 . 2 . 3]" 1
294 1 27 LEU QD 1 106 LYS QD 3.000 . 3.800 2.813 1.985 3.857 0.057 25 0 "[ . 1 . 2 . 3]" 1
295 1 28 SER H 1 28 SER HA 3.000 . 4.000 2.882 2.861 2.898 . 0 0 "[ . 1 . 2 . 3]" 1
296 1 28 SER H 1 28 SER QB 3.000 . 4.000 2.758 2.269 3.296 . 0 0 "[ . 1 . 2 . 3]" 1
297 1 28 SER H 1 31 ASP H 3.000 . 3.500 3.565 3.332 3.634 0.134 8 0 "[ . 1 . 2 . 3]" 1
298 1 28 SER H 1 31 ASP QB 3.000 . 4.000 2.904 1.791 3.856 0.009 30 0 "[ . 1 . 2 . 3]" 1
299 1 28 SER HA 1 30 GLU H 4.000 . 5.000 4.009 3.895 4.371 . 0 0 "[ . 1 . 2 . 3]" 1
300 1 28 SER HA 1 31 ASP H 4.000 . 5.000 4.524 4.146 4.875 . 0 0 "[ . 1 . 2 . 3]" 1
301 1 28 SER QB 1 30 GLU H 3.000 . 3.500 2.713 2.269 3.369 . 0 0 "[ . 1 . 2 . 3]" 1
302 1 28 SER QB 1 31 ASP H 4.000 . 5.000 2.777 2.051 4.076 . 0 0 "[ . 1 . 2 . 3]" 1
303 1 29 PRO HA 1 30 GLU H 4.000 . 5.000 3.501 3.466 3.557 . 0 0 "[ . 1 . 2 . 3]" 1
304 1 29 PRO HA 1 31 ASP H 4.000 . 5.000 4.501 4.080 4.816 . 0 0 "[ . 1 . 2 . 3]" 1
305 1 29 PRO QB 1 30 GLU H 3.000 . 3.500 3.008 2.310 3.431 . 0 0 "[ . 1 . 2 . 3]" 1
306 1 30 GLU H 1 30 GLU HA 3.000 . 3.500 2.857 2.842 2.910 . 0 0 "[ . 1 . 2 . 3]" 1
307 1 30 GLU H 1 30 GLU QB 2.500 . 2.900 2.384 2.171 2.719 . 0 0 "[ . 1 . 2 . 3]" 1
308 1 30 GLU H 1 31 ASP H 3.000 . 3.500 2.496 2.305 2.573 . 0 0 "[ . 1 . 2 . 3]" 1
309 1 30 GLU H 1 31 ASP HA 4.000 . 5.000 5.073 4.156 5.151 0.151 4 0 "[ . 1 . 2 . 3]" 1
310 1 30 GLU HA 1 31 ASP H 3.000 . 3.500 3.517 2.896 3.556 0.056 6 0 "[ . 1 . 2 . 3]" 1
311 1 30 GLU HA 1 32 GLN QG 3.000 . 3.300 2.993 2.952 3.020 . 0 0 "[ . 1 . 2 . 3]" 1
312 1 30 GLU QB 1 31 ASP H 4.000 . 5.000 2.946 2.401 3.868 . 0 0 "[ . 1 . 2 . 3]" 1
313 1 30 GLU QG 1 108 PRO QD 3.000 . 3.800 2.425 1.880 3.888 0.088 24 0 "[ . 1 . 2 . 3]" 1
314 1 31 ASP H 1 31 ASP HA 3.000 . 3.500 2.840 2.808 2.857 . 0 0 "[ . 1 . 2 . 3]" 1
315 1 31 ASP H 1 31 ASP QB 2.500 . 2.900 2.574 2.109 2.902 0.002 29 0 "[ . 1 . 2 . 3]" 1
316 1 31 ASP H 1 32 GLN H 4.000 . 5.000 3.869 3.653 4.011 . 0 0 "[ . 1 . 2 . 3]" 1
317 1 31 ASP HA 1 32 GLN H 2.500 . 2.900 2.333 2.257 2.451 . 0 0 "[ . 1 . 2 . 3]" 1
318 1 31 ASP HA 1 33 GLY H 4.000 . 5.000 3.169 3.042 3.447 . 0 0 "[ . 1 . 2 . 3]" 1
319 1 31 ASP HA 1 109 GLY H 4.000 . 5.000 3.974 3.527 4.353 . 0 0 "[ . 1 . 2 . 3]" 1
320 1 31 ASP HB2 1 109 GLY H 4.000 . 5.000 4.912 3.773 5.152 0.152 10 0 "[ . 1 . 2 . 3]" 1
321 1 31 ASP HB3 1 109 GLY H 4.000 . 5.000 4.220 3.341 5.106 0.106 9 0 "[ . 1 . 2 . 3]" 1
322 1 32 GLN H 1 32 GLN HA 3.000 . 3.500 2.914 2.891 2.931 . 0 0 "[ . 1 . 2 . 3]" 1
323 1 32 GLN H 1 32 GLN QB 3.000 . 3.500 2.466 2.369 3.179 . 0 0 "[ . 1 . 2 . 3]" 1
324 1 32 GLN H 1 33 GLY H 2.500 . 2.900 2.381 2.291 2.464 . 0 0 "[ . 1 . 2 . 3]" 1
325 1 32 GLN H 1 33 GLY HA2 4.000 2.800 5.000 4.794 4.371 4.945 . 0 0 "[ . 1 . 2 . 3]" 1
326 1 32 GLN H 1 33 GLY HA3 4.000 2.800 5.000 4.568 4.158 4.667 . 0 0 "[ . 1 . 2 . 3]" 1
327 1 32 GLN H 1 108 PRO HD2 4.000 . 5.000 3.862 3.627 4.245 . 0 0 "[ . 1 . 2 . 3]" 1
328 1 32 GLN H 1 108 PRO QD 4.000 . 5.000 2.651 2.083 3.021 . 0 0 "[ . 1 . 2 . 3]" 1
329 1 32 GLN H 1 108 PRO HD3 3.000 . 3.700 2.705 2.095 3.116 . 0 0 "[ . 1 . 2 . 3]" 1
330 1 32 GLN HA 1 33 GLY H 3.000 . 3.500 3.320 2.899 3.433 . 0 0 "[ . 1 . 2 . 3]" 1
331 1 32 GLN QB 1 33 GLY H 4.000 . 5.000 3.364 3.098 4.027 . 0 0 "[ . 1 . 2 . 3]" 1
332 1 33 GLY H 1 33 GLY QA 2.500 . 2.900 2.219 2.204 2.279 . 0 0 "[ . 1 . 2 . 3]" 1
333 1 33 GLY H 1 107 ALA H 4.000 . 5.000 3.705 3.149 4.385 . 0 0 "[ . 1 . 2 . 3]" 1
334 1 33 GLY H 1 107 ALA MB 4.000 . 5.500 2.809 2.464 3.390 . 0 0 "[ . 1 . 2 . 3]" 1
335 1 33 GLY H 1 109 GLY H 4.000 . 5.000 5.044 4.904 5.114 0.114 16 0 "[ . 1 . 2 . 3]" 1
336 1 33 GLY QA 1 34 PRO QD 3.000 . 3.300 2.007 1.919 2.087 . 0 0 "[ . 1 . 2 . 3]" 1
337 1 33 GLY QA 1 107 ALA MB 3.000 . 3.800 1.832 1.735 2.109 0.065 7 0 "[ . 1 . 2 . 3]" 1
338 1 33 GLY HA2 1 107 ALA H 4.000 . 5.000 4.126 3.731 4.702 . 0 0 "[ . 1 . 2 . 3]" 1
339 1 34 PRO HA 1 35 LEU H 2.500 . 2.900 2.201 2.144 2.278 . 0 0 "[ . 1 . 2 . 3]" 1
340 1 34 PRO QB 1 35 LEU H 4.000 . 5.000 3.158 2.903 3.560 . 0 0 "[ . 1 . 2 . 3]" 1
341 1 35 LEU H 1 35 LEU HA 3.000 . 3.500 2.869 2.861 2.876 . 0 0 "[ . 1 . 2 . 3]" 1
342 1 35 LEU H 1 35 LEU QB 3.000 . 3.500 2.281 2.095 2.954 . 0 0 "[ . 1 . 2 . 3]" 1
343 1 35 LEU H 1 36 ASP H 4.000 . 5.000 4.481 4.323 4.568 . 0 0 "[ . 1 . 2 . 3]" 1
344 1 35 LEU H 1 106 LYS HA 4.000 . 6.000 4.891 4.319 5.329 . 0 0 "[ . 1 . 2 . 3]" 1
345 1 35 LEU HA 1 36 ASP H 2.500 . 2.900 2.184 2.141 2.231 . 0 0 "[ . 1 . 2 . 3]" 1
346 1 35 LEU HA 1 106 LYS HA 3.000 . 3.300 3.087 2.460 3.372 0.072 8 0 "[ . 1 . 2 . 3]" 1
347 1 35 LEU QB 1 36 ASP H 4.000 . 5.000 3.544 3.001 3.907 . 0 0 "[ . 1 . 2 . 3]" 1
348 1 35 LEU QB 1 56 TYR QD 4.000 . 5.000 3.760 2.975 4.036 . 0 0 "[ . 1 . 2 . 3]" 1
349 1 35 LEU QB 1 106 LYS QD 3.000 . 3.800 3.418 2.159 3.950 0.150 18 0 "[ . 1 . 2 . 3]" 1
350 1 35 LEU QD 1 36 ASP H 3.000 . 4.000 3.352 2.275 4.079 0.079 11 0 "[ . 1 . 2 . 3]" 1
351 1 35 LEU QD 1 56 TYR QE 3.000 . 3.800 2.619 1.793 3.833 0.033 20 0 "[ . 1 . 2 . 3]" 1
352 1 35 LEU QD 1 81 LYS HA 3.000 . 3.800 2.343 1.710 2.834 0.090 19 0 "[ . 1 . 2 . 3]" 1
353 1 35 LEU QD 1 81 LYS QG 3.000 . 3.800 2.659 1.791 3.569 0.009 8 0 "[ . 1 . 2 . 3]" 1
354 1 35 LEU QD 1 104 VAL QG 4.000 . 5.000 2.578 1.746 3.739 0.054 27 0 "[ . 1 . 2 . 3]" 1
355 1 36 ASP H 1 36 ASP HA 3.000 . 3.500 2.924 2.909 2.938 . 0 0 "[ . 1 . 2 . 3]" 1
356 1 36 ASP H 1 36 ASP HB2 3.000 . 3.500 2.703 2.459 3.636 0.136 30 0 "[ . 1 . 2 . 3]" 1
357 1 36 ASP H 1 36 ASP HB3 3.000 . 3.500 3.491 2.819 3.685 0.185 10 0 "[ . 1 . 2 . 3]" 1
358 1 36 ASP H 1 37 ILE H 4.000 . 5.000 4.107 3.813 4.376 . 0 0 "[ . 1 . 2 . 3]" 1
359 1 36 ASP H 1 105 LYS H 3.000 . 3.500 2.975 2.302 3.527 0.027 1 0 "[ . 1 . 2 . 3]" 1
360 1 36 ASP HA 1 37 ILE H . . 2.900 2.159 2.083 2.326 . 0 0 "[ . 1 . 2 . 3]" 1
361 1 36 ASP HA 1 56 TYR QD 4.000 . 5.000 3.490 2.456 4.333 . 0 0 "[ . 1 . 2 . 3]" 1
362 1 36 ASP HA 1 57 SER H 4.000 . 5.000 4.945 4.778 5.064 0.064 9 0 "[ . 1 . 2 . 3]" 1
363 1 36 ASP HA 1 57 SER HA 3.000 . 3.300 2.866 2.469 3.098 . 0 0 "[ . 1 . 2 . 3]" 1
364 1 36 ASP HA 1 105 LYS H 4.000 . 5.000 4.094 3.957 4.187 . 0 0 "[ . 1 . 2 . 3]" 1
365 1 36 ASP QB 1 37 ILE H 3.000 . 3.500 3.329 2.478 3.638 0.138 26 0 "[ . 1 . 2 . 3]" 1
366 1 36 ASP QB 1 105 LYS QB 4.000 . 5.000 1.774 1.519 2.958 0.281 24 0 "[ . 1 . 2 . 3]" 1
367 1 37 ILE H 1 37 ILE HA 3.000 . 4.000 2.901 2.888 2.912 . 0 0 "[ . 1 . 2 . 3]" 1
368 1 37 ILE H 1 37 ILE HB 3.000 . 4.000 2.681 2.482 2.913 . 0 0 "[ . 1 . 2 . 3]" 1
369 1 37 ILE H 1 38 GLU HA 4.000 . 5.000 4.893 4.456 5.094 0.094 11 0 "[ . 1 . 2 . 3]" 1
370 1 37 ILE H 1 55 LEU QD 4.000 . 5.000 3.556 2.688 5.014 0.014 29 0 "[ . 1 . 2 . 3]" 1
371 1 37 ILE H 1 56 TYR H 3.000 . 3.500 2.994 2.649 3.323 . 0 0 "[ . 1 . 2 . 3]" 1
372 1 37 ILE H 1 56 TYR HB3 4.000 . 5.000 3.143 2.852 3.520 . 0 0 "[ . 1 . 2 . 3]" 1
373 1 37 ILE H 1 56 TYR QD . . 3.500 3.211 2.569 3.521 0.021 24 0 "[ . 1 . 2 . 3]" 1
374 1 37 ILE H 1 57 SER HA 4.000 . 5.000 4.070 3.593 4.450 . 0 0 "[ . 1 . 2 . 3]" 1
375 1 37 ILE H 1 105 LYS H 3.000 . 3.500 3.794 3.757 3.841 0.341 3 0 "[ . 1 . 2 . 3]" 1
376 1 37 ILE HA 1 38 GLU H 2.500 . 2.900 2.223 2.164 2.287 . 0 0 "[ . 1 . 2 . 3]" 1
377 1 37 ILE HA 1 104 VAL HA 3.000 . 3.300 1.865 1.746 2.048 0.054 27 0 "[ . 1 . 2 . 3]" 1
378 1 37 ILE HA 1 105 LYS H 4.000 . 5.000 2.850 2.574 3.096 . 0 0 "[ . 1 . 2 . 3]" 1
379 1 37 ILE HB 1 56 TYR H 4.000 . 5.000 2.939 2.405 3.423 . 0 0 "[ . 1 . 2 . 3]" 1
380 1 37 ILE HB 1 56 TYR QB 3.000 . 3.500 2.040 1.544 2.682 0.256 1 0 "[ . 1 . 2 . 3]" 1
381 1 37 ILE HB 1 56 TYR QD 3.000 . 4.000 3.419 2.910 3.654 . 0 0 "[ . 1 . 2 . 3]" 1
382 1 37 ILE MD 1 56 TYR QD 4.000 . 5.000 2.167 1.784 3.213 0.016 8 0 "[ . 1 . 2 . 3]" 1
383 1 37 ILE MD 1 56 TYR QE 4.000 . 5.000 3.417 2.945 4.191 . 0 0 "[ . 1 . 2 . 3]" 1
384 1 37 ILE MD 1 80 LEU QB 4.000 . 5.000 3.211 2.503 4.262 . 0 0 "[ . 1 . 2 . 3]" 1
385 1 37 ILE MD 1 80 LEU QD 3.000 . 3.800 2.228 1.754 3.796 0.046 17 0 "[ . 1 . 2 . 3]" 1
386 1 37 ILE MD 1 85 ALA MB 4.000 . 5.000 1.775 1.675 2.011 0.125 4 0 "[ . 1 . 2 . 3]" 1
387 1 37 ILE MD 1 104 VAL QG 4.000 . 5.000 2.565 1.681 3.373 0.119 3 0 "[ . 1 . 2 . 3]" 1
388 1 37 ILE MG 1 38 GLU H 3.000 . 4.000 2.632 2.003 3.190 . 0 0 "[ . 1 . 2 . 3]" 1
389 1 37 ILE MG 1 85 ALA MB 4.000 . 5.000 2.157 1.738 2.871 0.062 1 0 "[ . 1 . 2 . 3]" 1
390 1 38 GLU H 1 38 GLU HA 3.000 . 3.500 2.934 2.913 2.948 . 0 0 "[ . 1 . 2 . 3]" 1
391 1 38 GLU H 1 38 GLU QB 3.000 . 3.500 2.547 2.322 2.749 . 0 0 "[ . 1 . 2 . 3]" 1
392 1 38 GLU H 1 103 LYS H 3.000 . 3.500 2.524 2.179 2.932 . 0 0 "[ . 1 . 2 . 3]" 1
393 1 38 GLU H 1 103 LYS QB 3.000 . 3.500 2.728 2.330 3.375 . 0 0 "[ . 1 . 2 . 3]" 1
394 1 38 GLU H 1 104 VAL HA 4.000 . 5.000 3.579 3.237 3.786 . 0 0 "[ . 1 . 2 . 3]" 1
395 1 38 GLU HA 1 39 TRP H 2.500 . 2.900 2.173 2.120 2.304 . 0 0 "[ . 1 . 2 . 3]" 1
396 1 38 GLU HA 1 55 LEU HA 2.500 . 2.700 2.613 2.217 2.772 0.072 12 0 "[ . 1 . 2 . 3]" 1
397 1 38 GLU HA 1 55 LEU QD 3.000 . 3.800 2.175 1.534 2.836 0.266 9 0 "[ . 1 . 2 . 3]" 1
398 1 38 GLU HA 1 56 TYR H 4.000 . 5.000 3.678 3.269 3.909 . 0 0 "[ . 1 . 2 . 3]" 1
399 1 38 GLU QB 1 39 TRP H 4.000 . 5.000 3.540 2.675 3.909 . 0 0 "[ . 1 . 2 . 3]" 1
400 1 38 GLU QB 1 55 LEU QD 3.000 . 3.800 2.167 1.791 2.563 0.009 30 0 "[ . 1 . 2 . 3]" 1
401 1 38 GLU QB 1 103 LYS H 3.000 . 3.800 3.298 2.582 3.462 . 0 0 "[ . 1 . 2 . 3]" 1
402 1 38 GLU QB 1 103 LYS QB 4.000 . 5.000 2.035 1.497 2.558 0.303 13 0 "[ . 1 . 2 . 3]" 1
403 1 38 GLU QG 1 52 VAL QG 3.000 . 3.800 3.201 2.138 3.911 0.111 2 0 "[ . 1 . 2 . 3]" 1
404 1 39 TRP H 1 39 TRP HA 3.000 . 3.500 2.921 2.902 2.931 . 0 0 "[ . 1 . 2 . 3]" 1
405 1 39 TRP H 1 39 TRP HD1 3.000 . 3.500 3.013 2.795 3.544 0.044 13 0 "[ . 1 . 2 . 3]" 1
406 1 39 TRP H 1 52 VAL HA 4.000 . 5.000 4.952 4.306 5.126 0.126 18 0 "[ . 1 . 2 . 3]" 1
407 1 39 TRP H 1 54 ILE H 3.000 . 3.500 3.540 3.449 3.609 0.109 13 0 "[ . 1 . 2 . 3]" 1
408 1 39 TRP HA 1 40 LEU H 2.500 . 2.900 2.155 2.118 2.186 . 0 0 "[ . 1 . 2 . 3]" 1
409 1 39 TRP HA 1 101 GLN H 4.000 . 5.000 3.835 3.571 4.123 . 0 0 "[ . 1 . 2 . 3]" 1
410 1 39 TRP HA 1 102 CYS HA 3.000 . 4.000 2.379 2.137 2.809 . 0 0 "[ . 1 . 2 . 3]" 1
411 1 39 TRP HA 1 103 LYS H 4.000 . 5.000 3.438 3.318 3.610 . 0 0 "[ . 1 . 2 . 3]" 1
412 1 39 TRP QB 1 40 LEU H 3.000 . 3.500 3.320 3.103 3.410 . 0 0 "[ . 1 . 2 . 3]" 1
413 1 39 TRP QB 1 53 ILE MD . . 3.800 2.898 2.867 2.939 . 0 0 "[ . 1 . 2 . 3]" 1
414 1 39 TRP QB 1 54 ILE H 4.000 . 5.000 2.376 1.934 2.651 . 0 0 "[ . 1 . 2 . 3]" 1
415 1 39 TRP QB 1 87 ILE MD 3.000 . 4.500 3.044 2.918 3.302 . 0 0 "[ . 1 . 2 . 3]" 1
416 1 39 TRP HD1 1 54 ILE MG 3.000 . 3.300 2.187 1.992 2.758 . 0 0 "[ . 1 . 2 . 3]" 1
417 1 39 TRP HD1 1 75 PHE QE 3.000 . 3.500 3.211 3.180 3.258 . 0 0 "[ . 1 . 2 . 3]" 1
418 1 39 TRP HD1 1 75 PHE HZ 3.000 . 3.300 2.983 2.588 3.187 . 0 0 "[ . 1 . 2 . 3]" 1
419 1 39 TRP HE3 1 40 LEU H 4.000 . 5.000 3.953 3.594 4.196 . 0 0 "[ . 1 . 2 . 3]" 1
420 1 39 TRP HE3 1 87 ILE MD 4.000 . 5.000 3.054 2.901 3.233 . 0 0 "[ . 1 . 2 . 3]" 1
421 1 39 TRP HE3 1 100 TYR QB 3.000 . 3.500 2.238 1.937 2.526 . 0 0 "[ . 1 . 2 . 3]" 1
422 1 39 TRP HE3 1 101 GLN H 3.000 . 3.500 3.514 3.282 3.587 0.087 11 0 "[ . 1 . 2 . 3]" 1
423 1 39 TRP HE3 1 102 CYS HA 4.000 . 5.000 3.921 3.739 4.109 . 0 0 "[ . 1 . 2 . 3]" 1
424 1 39 TRP HH2 1 102 CYS QB 4.000 . 5.000 2.983 2.813 3.203 . 0 0 "[ . 1 . 2 . 3]" 1
425 1 39 TRP HH2 1 115 ILE MD 3.000 . 3.500 1.805 1.747 1.972 0.053 5 0 "[ . 1 . 2 . 3]" 1
426 1 39 TRP HZ2 1 86 SER HA 2.500 . 2.700 2.686 2.376 2.788 0.088 11 0 "[ . 1 . 2 . 3]" 1
427 1 39 TRP HZ2 1 87 ILE H 3.000 . 3.500 3.161 2.927 3.403 . 0 0 "[ . 1 . 2 . 3]" 1
428 1 39 TRP HZ2 1 102 CYS QB 3.000 . 3.500 3.078 2.862 3.147 . 0 0 "[ . 1 . 2 . 3]" 1
429 1 39 TRP HZ3 1 87 ILE MD 4.000 . 5.000 3.206 3.028 3.511 . 0 0 "[ . 1 . 2 . 3]" 1
430 1 39 TRP HZ3 1 100 TYR QB 3.000 . 3.500 2.583 2.407 2.875 . 0 0 "[ . 1 . 2 . 3]" 1
431 1 39 TRP HZ3 1 115 ILE MD 4.000 . 5.000 1.959 1.825 2.284 . 0 0 "[ . 1 . 2 . 3]" 1
432 1 40 LEU H 1 40 LEU HA 3.000 . 3.500 2.946 2.941 2.952 . 0 0 "[ . 1 . 2 . 3]" 1
433 1 40 LEU H 1 40 LEU QB 3.000 . 3.500 2.510 2.425 2.582 . 0 0 "[ . 1 . 2 . 3]" 1
434 1 40 LEU H 1 40 LEU QD 4.000 . 5.000 3.343 2.326 3.474 . 0 0 "[ . 1 . 2 . 3]" 1
435 1 40 LEU H 1 101 GLN H 3.000 . 3.500 2.357 2.160 2.769 . 0 0 "[ . 1 . 2 . 3]" 1
436 1 40 LEU H 1 101 GLN QB 3.000 . 3.500 2.713 2.184 2.981 . 0 0 "[ . 1 . 2 . 3]" 1
437 1 40 LEU H 1 103 LYS H 4.000 . 5.000 4.735 4.463 4.956 . 0 0 "[ . 1 . 2 . 3]" 1
438 1 40 LEU HA 1 41 ILE H 2.500 . 2.900 2.237 2.148 2.297 . 0 0 "[ . 1 . 2 . 3]" 1
439 1 40 LEU HA 1 51 GLN H 4.000 . 5.000 4.612 3.635 4.897 . 0 0 "[ . 1 . 2 . 3]" 1
440 1 40 LEU HA 1 52 VAL HA 2.500 . 2.700 2.698 2.507 2.779 0.079 30 0 "[ . 1 . 2 . 3]" 1
441 1 40 LEU HA 1 53 ILE H 4.000 . 5.000 3.352 2.938 3.671 . 0 0 "[ . 1 . 2 . 3]" 1
442 1 40 LEU HA 1 53 ILE MG 4.000 . 5.500 3.075 2.423 4.073 . 0 0 "[ . 1 . 2 . 3]" 1
443 1 40 LEU HA 1 54 ILE H 4.000 . 5.000 4.766 4.609 4.961 . 0 0 "[ . 1 . 2 . 3]" 1
444 1 40 LEU QB 1 50 ASP H 4.000 . 5.000 4.650 4.319 4.922 . 0 0 "[ . 1 . 2 . 3]" 1
445 1 40 LEU QB 1 50 ASP HA 3.000 . 3.300 2.615 2.272 2.947 . 0 0 "[ . 1 . 2 . 3]" 1
446 1 40 LEU QB 1 50 ASP QB 4.000 . 5.000 3.350 1.934 3.798 . 0 0 "[ . 1 . 2 . 3]" 1
447 1 40 LEU QB 1 52 VAL HA 4.000 . 5.000 4.302 4.118 4.430 . 0 0 "[ . 1 . 2 . 3]" 1
448 1 40 LEU QB 1 101 GLN H 4.000 . 5.000 3.076 2.885 3.359 . 0 0 "[ . 1 . 2 . 3]" 1
449 1 40 LEU QB 1 101 GLN QB 3.000 . 3.800 1.917 1.581 2.363 0.219 5 0 "[ . 1 . 2 . 3]" 1
450 1 40 LEU QD 1 50 ASP HA 4.000 . 5.000 3.461 3.136 3.728 . 0 0 "[ . 1 . 2 . 3]" 1
451 1 40 LEU QD 1 50 ASP QB 4.000 . 5.000 2.873 2.252 3.307 . 0 0 "[ . 1 . 2 . 3]" 1
452 1 40 LEU QD 1 52 VAL H 4.000 . 5.500 3.281 2.892 3.612 . 0 0 "[ . 1 . 2 . 3]" 1
453 1 40 LEU QD 1 52 VAL HA 4.000 . 5.500 2.186 1.865 2.516 . 0 0 "[ . 1 . 2 . 3]" 1
454 1 40 LEU QD 1 52 VAL QG 3.000 . 3.800 2.101 1.780 2.831 0.020 13 0 "[ . 1 . 2 . 3]" 1
455 1 40 LEU QD 1 101 GLN QB 4.000 . 5.000 2.884 2.538 3.220 . 0 0 "[ . 1 . 2 . 3]" 1
456 1 40 LEU HG 1 103 LYS QD 3.000 . 3.800 3.655 3.339 3.823 0.023 5 0 "[ . 1 . 2 . 3]" 1
457 1 41 ILE H 1 41 ILE HA 3.000 . 3.500 2.946 2.938 2.951 . 0 0 "[ . 1 . 2 . 3]" 1
458 1 41 ILE H 1 41 ILE HB 4.000 . 5.000 3.112 2.864 3.203 . 0 0 "[ . 1 . 2 . 3]" 1
459 1 41 ILE H 1 41 ILE MG 3.000 . 4.000 2.091 1.922 2.268 . 0 0 "[ . 1 . 2 . 3]" 1
460 1 41 ILE H 1 50 ASP HA 4.000 . 5.000 3.599 2.969 4.168 . 0 0 "[ . 1 . 2 . 3]" 1
461 1 41 ILE H 1 51 GLN H 3.000 . 3.500 3.034 2.114 3.511 0.011 8 0 "[ . 1 . 2 . 3]" 1
462 1 41 ILE H 1 52 VAL H 4.000 . 5.000 4.927 4.754 5.025 0.025 27 0 "[ . 1 . 2 . 3]" 1
463 1 41 ILE H 1 52 VAL HA 4.000 . 5.000 3.918 3.629 4.192 . 0 0 "[ . 1 . 2 . 3]" 1
464 1 41 ILE HA 1 42 SER H 2.500 . 2.900 2.136 2.104 2.172 . 0 0 "[ . 1 . 2 . 3]" 1
465 1 41 ILE HA 1 51 GLN H 4.000 . 5.000 4.837 4.340 5.032 0.032 5 0 "[ . 1 . 2 . 3]" 1
466 1 41 ILE HA 1 99 THR H 4.000 . 5.000 5.036 4.887 5.086 0.086 20 0 "[ . 1 . 2 . 3]" 1
467 1 41 ILE HA 1 100 TYR HA 2.500 . 2.700 2.506 2.339 2.628 . 0 0 "[ . 1 . 2 . 3]" 1
468 1 41 ILE HA 1 101 GLN H 4.000 . 5.000 3.798 3.545 4.026 . 0 0 "[ . 1 . 2 . 3]" 1
469 1 41 ILE HB 1 42 SER H 4.000 . 5.000 4.160 4.007 4.254 . 0 0 "[ . 1 . 2 . 3]" 1
470 1 41 ILE HB 1 100 TYR QD 4.000 . 6.000 3.619 3.311 4.024 . 0 0 "[ . 1 . 2 . 3]" 1
471 1 41 ILE MD 1 43 PRO QB 4.000 . 5.000 3.469 3.053 3.713 . 0 0 "[ . 1 . 2 . 3]" 1
472 1 41 ILE MD 1 53 ILE MD 4.000 . 5.000 4.158 3.800 4.554 . 0 0 "[ . 1 . 2 . 3]" 1
473 1 41 ILE MD 1 69 LEU QD 4.000 . 6.000 2.048 1.771 2.616 0.029 8 0 "[ . 1 . 2 . 3]" 1
474 1 41 ILE MD 1 100 TYR QD 4.000 . 5.000 3.865 3.484 4.091 . 0 0 "[ . 1 . 2 . 3]" 1
475 1 41 ILE MD 1 100 TYR QE 4.000 . 5.000 2.576 2.119 2.838 . 0 0 "[ . 1 . 2 . 3]" 1
476 1 41 ILE QG 1 42 SER H 3.000 . 3.500 2.543 2.285 2.802 . 0 0 "[ . 1 . 2 . 3]" 1
477 1 41 ILE MG 1 53 ILE MG 3.000 . 3.800 2.027 1.690 2.791 0.110 23 0 "[ . 1 . 2 . 3]" 1
478 1 41 ILE MG 1 68 ASP QB 4.000 . 5.000 3.143 2.435 3.752 . 0 0 "[ . 1 . 2 . 3]" 1
479 1 42 SER H 1 42 SER HA 3.000 . 3.500 2.944 2.924 2.949 . 0 0 "[ . 1 . 2 . 3]" 1
480 1 42 SER H 1 43 PRO QD 4.000 . 5.000 3.787 3.708 3.900 . 0 0 "[ . 1 . 2 . 3]" 1
481 1 42 SER H 1 49 VAL HA 4.000 . 5.000 4.854 4.599 5.056 0.056 30 0 "[ . 1 . 2 . 3]" 1
482 1 42 SER H 1 50 ASP H 4.000 . 5.000 4.057 3.608 5.068 0.068 30 0 "[ . 1 . 2 . 3]" 1
483 1 42 SER H 1 99 THR H 4.000 . 5.000 3.285 3.117 3.379 . 0 0 "[ . 1 . 2 . 3]" 1
484 1 42 SER H 1 99 THR HB 4.000 . 5.000 3.197 3.009 3.409 . 0 0 "[ . 1 . 2 . 3]" 1
485 1 42 SER H 1 100 TYR HA 4.000 . 5.000 3.882 3.756 4.067 . 0 0 "[ . 1 . 2 . 3]" 1
486 1 42 SER HA 1 43 PRO QD 2.500 . 2.700 1.928 1.855 1.982 . 0 0 "[ . 1 . 2 . 3]" 1
487 1 42 SER HA 1 49 VAL H 4.000 . 5.000 4.279 3.893 4.486 . 0 0 "[ . 1 . 2 . 3]" 1
488 1 42 SER HA 1 49 VAL HA 2.500 . 2.700 2.125 1.781 2.412 0.019 24 0 "[ . 1 . 2 . 3]" 1
489 1 42 SER HA 1 50 ASP H 3.000 . 3.500 2.338 1.927 3.504 0.004 30 0 "[ . 1 . 2 . 3]" 1
490 1 42 SER HA 1 51 GLN H 4.000 . 5.000 3.608 3.309 4.179 . 0 0 "[ . 1 . 2 . 3]" 1
491 1 42 SER HA 1 99 THR H 4.000 . 5.000 4.965 4.807 5.016 0.016 14 0 "[ . 1 . 2 . 3]" 1
492 1 42 SER QB 1 49 VAL HA 4.000 . 5.000 2.452 1.929 2.971 . 0 0 "[ . 1 . 2 . 3]" 1
493 1 42 SER QB 1 49 VAL HB 4.000 . 5.000 3.408 1.972 4.149 . 0 0 "[ . 1 . 2 . 3]" 1
494 1 42 SER QB 1 49 VAL QG 3.000 . 3.800 2.437 1.970 2.549 . 0 0 "[ . 1 . 2 . 3]" 1
495 1 42 SER QB 1 50 ASP H 4.000 . 5.000 2.462 1.789 2.982 0.011 10 0 "[ . 1 . 2 . 3]" 1
496 1 42 SER QB 1 99 THR H 4.000 . 5.000 3.013 2.740 3.904 . 0 0 "[ . 1 . 2 . 3]" 1
497 1 42 SER QB 1 99 THR HB 3.000 . 3.300 2.256 1.970 2.811 . 0 0 "[ . 1 . 2 . 3]" 1
498 1 42 SER QB 1 99 THR MG 4.000 . 5.000 3.643 3.418 3.728 . 0 0 "[ . 1 . 2 . 3]" 1
499 1 43 PRO HA 1 44 ALA H 2.500 . 2.900 2.132 2.118 2.147 . 0 0 "[ . 1 . 2 . 3]" 1
500 1 43 PRO HA 1 44 ALA HA 4.000 . 5.000 4.414 4.387 4.439 . 0 0 "[ . 1 . 2 . 3]" 1
501 1 43 PRO HA 1 45 ASP H 4.000 . 5.000 3.691 3.451 3.840 . 0 0 "[ . 1 . 2 . 3]" 1
502 1 43 PRO HA 1 45 ASP QB 4.000 . 6.500 5.065 4.762 5.697 . 0 0 "[ . 1 . 2 . 3]" 1
503 1 43 PRO HA 1 96 ASP HA 4.000 . 6.000 5.628 5.207 6.010 0.010 8 0 "[ . 1 . 2 . 3]" 1
504 1 43 PRO HA 1 98 GLY QA 2.500 . 2.700 2.017 1.879 2.257 . 0 0 "[ . 1 . 2 . 3]" 1
505 1 43 PRO HA 1 99 THR H 4.000 . 5.000 4.323 4.158 4.518 . 0 0 "[ . 1 . 2 . 3]" 1
506 1 43 PRO QB 1 44 ALA H 3.000 . 3.500 3.516 3.429 3.593 0.093 16 0 "[ . 1 . 2 . 3]" 1
507 1 43 PRO QB 1 45 ASP H 3.000 . 4.000 3.335 2.999 3.540 . 0 0 "[ . 1 . 2 . 3]" 1
508 1 43 PRO QB 1 46 ASN QB 3.000 . 3.800 1.871 1.672 2.440 0.128 17 0 "[ . 1 . 2 . 3]" 1
509 1 43 PRO QB 1 48 LYS QD 4.000 . 5.000 4.024 3.976 4.064 . 0 0 "[ . 1 . 2 . 3]" 1
510 1 43 PRO HB2 1 46 ASN H 4.000 . 5.000 2.455 1.985 3.104 . 0 0 "[ . 1 . 2 . 3]" 1
511 1 43 PRO HB3 1 46 ASN H 4.000 . 5.000 3.988 3.173 4.821 . 0 0 "[ . 1 . 2 . 3]" 1
512 1 43 PRO QD 1 46 ASN QB 4.000 . 5.000 3.497 2.907 3.839 . 0 0 "[ . 1 . 2 . 3]" 1
513 1 43 PRO QD 1 48 LYS QB 4.000 . 5.000 2.274 1.891 2.719 . 0 0 "[ . 1 . 2 . 3]" 1
514 1 43 PRO QD 1 49 VAL HA 4.000 . 5.500 2.651 2.161 3.291 . 0 0 "[ . 1 . 2 . 3]" 1
515 1 43 PRO QG 1 46 ASN QB 4.000 . 5.000 2.041 1.788 2.565 0.012 27 0 "[ . 1 . 2 . 3]" 1
516 1 43 PRO QG 1 48 LYS QB 4.000 . 5.000 1.889 1.682 2.848 0.118 16 0 "[ . 1 . 2 . 3]" 1
517 1 44 ALA H 1 44 ALA HA 3.000 . 3.500 2.799 2.789 2.806 . 0 0 "[ . 1 . 2 . 3]" 1
518 1 44 ALA H 1 44 ALA MB 3.000 . 4.000 2.127 2.027 2.231 . 0 0 "[ . 1 . 2 . 3]" 1
519 1 44 ALA H 1 45 ASP H 3.000 . 3.500 2.668 2.603 2.722 . 0 0 "[ . 1 . 2 . 3]" 1
520 1 44 ALA H 1 46 ASN H 4.000 . 5.000 4.162 4.097 4.228 . 0 0 "[ . 1 . 2 . 3]" 1
521 1 44 ALA H 1 97 ILE HA 4.000 . 6.000 5.392 5.204 5.602 . 0 0 "[ . 1 . 2 . 3]" 1
522 1 44 ALA H 1 97 ILE HB 4.000 . 5.000 5.001 4.633 5.068 0.068 5 0 "[ . 1 . 2 . 3]" 1
523 1 44 ALA H 1 98 GLY H 4.000 . 5.000 4.354 4.219 4.517 . 0 0 "[ . 1 . 2 . 3]" 1
524 1 44 ALA H 1 98 GLY QA 3.000 . 3.500 2.460 2.258 2.626 . 0 0 "[ . 1 . 2 . 3]" 1
525 1 44 ALA H 1 99 THR H 4.000 . 5.000 4.289 4.045 4.506 . 0 0 "[ . 1 . 2 . 3]" 1
526 1 44 ALA HA 1 45 ASP H 3.000 . 3.500 3.513 3.474 3.528 0.028 15 0 "[ . 1 . 2 . 3]" 1
527 1 44 ALA HA 1 46 ASN H 4.000 . 5.000 4.158 3.507 4.679 . 0 0 "[ . 1 . 2 . 3]" 1
528 1 44 ALA MB 1 45 ASP H 3.000 . 4.000 2.667 2.553 2.887 . 0 0 "[ . 1 . 2 . 3]" 1
529 1 44 ALA MB 1 97 ILE MG 4.000 . 5.000 2.421 2.133 2.838 . 0 0 "[ . 1 . 2 . 3]" 1
530 1 45 ASP H 1 45 ASP HA 3.000 . 3.500 2.870 2.848 2.898 . 0 0 "[ . 1 . 2 . 3]" 1
531 1 45 ASP H 1 45 ASP QB 3.000 . 3.500 2.296 2.199 2.535 . 0 0 "[ . 1 . 2 . 3]" 1
532 1 45 ASP H 1 46 ASN H 3.000 . 3.500 2.636 2.500 2.855 . 0 0 "[ . 1 . 2 . 3]" 1
533 1 45 ASP H 1 95 SER HA 4.000 . 5.000 5.049 4.963 5.111 0.111 26 0 "[ . 1 . 2 . 3]" 1
534 1 45 ASP HA 1 45 ASP QB 2.500 . 2.700 2.381 2.181 2.451 . 0 0 "[ . 1 . 2 . 3]" 1
535 1 45 ASP HA 1 46 ASN H 3.000 . 3.500 3.356 3.070 3.536 0.036 25 0 "[ . 1 . 2 . 3]" 1
536 1 45 ASP QB 1 46 ASN H 4.000 . 5.000 3.153 2.564 4.034 . 0 0 "[ . 1 . 2 . 3]" 1
537 1 45 ASP QB 1 95 SER HA 4.000 . 5.000 3.274 2.810 4.121 . 0 0 "[ . 1 . 2 . 3]" 1
538 1 45 ASP QB 1 97 ILE HB 4.000 . 5.500 3.859 3.341 4.591 . 0 0 "[ . 1 . 2 . 3]" 1
539 1 45 ASP QB 1 97 ILE MG 3.000 . 3.800 2.858 2.842 2.873 . 0 0 "[ . 1 . 2 . 3]" 1
540 1 46 ASN H 1 46 ASN HA 3.000 . 3.500 2.897 2.882 2.915 . 0 0 "[ . 1 . 2 . 3]" 1
541 1 46 ASN H 1 46 ASN QB 2.500 . 2.900 2.555 2.114 2.837 . 0 0 "[ . 1 . 2 . 3]" 1
542 1 46 ASN H 1 47 GLN H 4.000 . 5.000 4.499 4.382 4.592 . 0 0 "[ . 1 . 2 . 3]" 1
543 1 46 ASN H 1 48 LYS H 4.000 . 5.000 4.790 4.617 4.985 . 0 0 "[ . 1 . 2 . 3]" 1
544 1 46 ASN HA 1 47 GLN H 3.000 . 3.500 2.333 2.274 2.367 . 0 0 "[ . 1 . 2 . 3]" 1
545 1 46 ASN HA 1 47 GLN HA 4.000 . 5.000 4.311 4.296 4.325 . 0 0 "[ . 1 . 2 . 3]" 1
546 1 46 ASN HA 1 47 GLN QG 4.000 . 5.000 3.791 3.656 3.837 . 0 0 "[ . 1 . 2 . 3]" 1
547 1 46 ASN HA 1 48 LYS H 4.000 . 5.000 4.009 3.863 4.110 . 0 0 "[ . 1 . 2 . 3]" 1
548 1 46 ASN QB 1 47 GLN H 3.000 . 3.500 2.585 2.354 3.271 . 0 0 "[ . 1 . 2 . 3]" 1
549 1 46 ASN QB 1 48 LYS H 3.000 . 3.500 2.433 2.195 2.778 . 0 0 "[ . 1 . 2 . 3]" 1
550 1 46 ASN QB 1 48 LYS QB 4.000 . 5.000 2.897 2.577 3.243 . 0 0 "[ . 1 . 2 . 3]" 1
551 1 47 GLN H 1 47 GLN HA 3.000 . 3.500 2.835 2.820 2.845 . 0 0 "[ . 1 . 2 . 3]" 1
552 1 47 GLN H 1 47 GLN QB 3.000 . 3.500 2.309 2.287 2.419 . 0 0 "[ . 1 . 2 . 3]" 1
553 1 47 GLN H 1 47 GLN QG 3.000 . 3.500 2.362 2.158 2.398 . 0 0 "[ . 1 . 2 . 3]" 1
554 1 47 GLN H 1 48 LYS H 2.500 . 2.900 2.563 2.504 2.625 . 0 0 "[ . 1 . 2 . 3]" 1
555 1 47 GLN HA 1 48 LYS H 3.000 . 3.500 3.411 3.371 3.453 . 0 0 "[ . 1 . 2 . 3]" 1
556 1 47 GLN QB 1 48 LYS H . . 2.900 2.984 2.941 3.026 0.126 9 0 "[ . 1 . 2 . 3]" 1
557 1 47 GLN QB 1 48 LYS HA 4.000 . 5.000 3.946 3.915 3.966 . 0 0 "[ . 1 . 2 . 3]" 1
558 1 48 LYS H 1 48 LYS HA 3.000 . 3.500 2.828 2.808 2.857 . 0 0 "[ . 1 . 2 . 3]" 1
559 1 48 LYS H 1 49 VAL H 4.000 . 5.000 4.643 4.615 4.662 . 0 0 "[ . 1 . 2 . 3]" 1
560 1 48 LYS HA 1 48 LYS QD 4.000 . 5.000 4.039 3.636 4.218 . 0 0 "[ . 1 . 2 . 3]" 1
561 1 48 LYS HA 1 48 LYS QG 3.000 . 3.300 2.498 2.417 2.680 . 0 0 "[ . 1 . 2 . 3]" 1
562 1 48 LYS HA 1 49 VAL H 2.500 . 2.900 2.307 2.216 2.473 . 0 0 "[ . 1 . 2 . 3]" 1
563 1 48 LYS HA 1 49 VAL QG 4.000 . 5.000 3.122 2.840 3.187 . 0 0 "[ . 1 . 2 . 3]" 1
564 1 48 LYS QB 1 49 VAL H 4.000 . 5.000 2.742 2.265 3.612 . 0 0 "[ . 1 . 2 . 3]" 1
565 1 48 LYS QB 1 49 VAL HA 4.000 . 5.000 3.897 3.823 4.449 . 0 0 "[ . 1 . 2 . 3]" 1
566 1 48 LYS QB 1 51 GLN QG 4.000 . 5.000 2.641 1.822 3.588 . 0 0 "[ . 1 . 2 . 3]" 1
567 1 49 VAL H 1 49 VAL HA 3.000 . 3.500 2.816 2.786 2.889 . 0 0 "[ . 1 . 2 . 3]" 1
568 1 49 VAL H 1 49 VAL HB 3.000 . 3.500 3.701 3.014 3.849 0.349 24 0 "[ . 1 . 2 . 3]" 1
569 1 49 VAL H 1 49 VAL QG 3.000 . 4.000 2.329 2.246 2.553 . 0 0 "[ . 1 . 2 . 3]" 1
570 1 49 VAL H 1 50 ASP H 3.000 . 3.500 3.922 3.881 3.991 0.491 30 0 "[ . 1 . 2 . 3]" 1
571 1 49 VAL H 1 51 GLN QG 4.000 . 5.000 2.493 2.112 4.555 . 0 0 "[ . 1 . 2 . 3]" 1
572 1 49 VAL HA 1 50 ASP H 2.500 . 2.900 2.040 1.959 2.859 . 0 0 "[ . 1 . 2 . 3]" 1
573 1 49 VAL HA 1 51 GLN H 4.000 . 5.000 3.923 3.673 4.962 . 0 0 "[ . 1 . 2 . 3]" 1
574 1 49 VAL HB 1 50 ASP H 2.500 . 2.900 3.059 2.076 3.188 0.288 21 0 "[ . 1 . 2 . 3]" 1
575 1 49 VAL HB 1 50 ASP HA 4.000 . 5.000 4.750 4.525 5.039 0.039 24 0 "[ . 1 . 2 . 3]" 1
576 1 49 VAL QG 1 50 ASP H 4.000 . 5.000 3.190 1.879 3.396 . 0 0 "[ . 1 . 2 . 3]" 1
577 1 49 VAL QG 1 50 ASP QB 4.000 . 5.000 3.303 2.517 3.363 . 0 0 "[ . 1 . 2 . 3]" 1
578 1 50 ASP H 1 50 ASP HA 3.000 . 3.500 2.303 2.268 2.801 . 0 0 "[ . 1 . 2 . 3]" 1
579 1 50 ASP H 1 50 ASP QB 3.000 . 3.500 3.128 2.339 3.271 . 0 0 "[ . 1 . 2 . 3]" 1
580 1 50 ASP H 1 51 GLN H 3.000 . 3.500 2.915 2.721 3.647 0.147 30 0 "[ . 1 . 2 . 3]" 1
581 1 50 ASP HA 1 50 ASP QB 2.500 . 2.700 2.382 2.167 2.463 . 0 0 "[ . 1 . 2 . 3]" 1
582 1 50 ASP HA 1 51 GLN H 2.500 . 2.900 2.767 2.282 2.882 . 0 0 "[ . 1 . 2 . 3]" 1
583 1 50 ASP QB 1 51 GLN H 4.000 . 5.000 3.889 3.787 4.089 . 0 0 "[ . 1 . 2 . 3]" 1
584 1 51 GLN H 1 51 GLN HA 3.000 . 3.500 2.917 2.902 2.930 . 0 0 "[ . 1 . 2 . 3]" 1
585 1 51 GLN H 1 51 GLN QB 3.000 . 3.500 2.418 2.333 3.193 . 0 0 "[ . 1 . 2 . 3]" 1
586 1 51 GLN HA 1 51 GLN QB 2.500 . 2.700 2.392 2.179 2.422 . 0 0 "[ . 1 . 2 . 3]" 1
587 1 51 GLN HA 1 52 VAL H 2.500 . 2.900 2.251 2.184 2.381 . 0 0 "[ . 1 . 2 . 3]" 1
588 1 51 GLN QB 1 52 VAL H 4.000 . 5.000 2.854 2.583 3.051 . 0 0 "[ . 1 . 2 . 3]" 1
589 1 51 GLN QB 1 68 ASP QB 4.000 . 5.000 3.968 3.749 4.038 . 0 0 "[ . 1 . 2 . 3]" 1
590 1 52 VAL H 1 52 VAL HA 3.000 . 3.500 2.836 2.823 2.851 . 0 0 "[ . 1 . 2 . 3]" 1
591 1 52 VAL H 1 52 VAL HB 2.500 . 2.900 2.591 2.345 2.733 . 0 0 "[ . 1 . 2 . 3]" 1
592 1 52 VAL H 1 52 VAL QG 4.000 . 5.500 2.103 1.948 2.362 . 0 0 "[ . 1 . 2 . 3]" 1
593 1 52 VAL HA 1 52 VAL HB 2.500 . 2.700 2.944 2.584 2.977 0.277 28 0 "[ . 1 . 2 . 3]" 1
594 1 52 VAL HA 1 53 ILE H 2.500 . 2.900 2.174 2.100 2.305 . 0 0 "[ . 1 . 2 . 3]" 1
595 1 52 VAL HA 1 54 ILE H 4.000 . 5.000 4.181 3.861 4.609 . 0 0 "[ . 1 . 2 . 3]" 1
596 1 52 VAL HB 1 53 ILE H 4.000 . 5.000 4.036 3.832 4.227 . 0 0 "[ . 1 . 2 . 3]" 1
597 1 52 VAL HB 1 66 TYR QD 4.000 . 5.000 4.081 3.554 4.587 . 0 0 "[ . 1 . 2 . 3]" 1
598 1 52 VAL HB 1 66 TYR QE 4.000 . 5.000 2.571 1.974 3.440 . 0 0 "[ . 1 . 2 . 3]" 1
599 1 52 VAL QG 1 66 TYR QD 4.000 . 5.000 3.221 1.783 3.365 0.017 24 0 "[ . 1 . 2 . 3]" 1
600 1 52 VAL QG 1 66 TYR QE 4.000 . 5.000 2.428 1.631 2.575 0.169 18 0 "[ . 1 . 2 . 3]" 1
601 1 53 ILE H 1 53 ILE HA 3.000 . 3.500 2.937 2.899 2.945 . 0 0 "[ . 1 . 2 . 3]" 1
602 1 53 ILE H 1 53 ILE HB 4.000 . 5.000 3.483 3.089 3.950 . 0 0 "[ . 1 . 2 . 3]" 1
603 1 53 ILE H 1 54 ILE H 2.500 . 2.900 2.155 1.930 2.559 . 0 0 "[ . 1 . 2 . 3]" 1
604 1 53 ILE HA 1 54 ILE H 3.000 . 3.500 3.547 3.521 3.567 0.067 3 0 "[ . 1 . 2 . 3]" 1
605 1 53 ILE HA 1 66 TYR QB 3.000 . 3.300 3.005 2.790 3.074 . 0 0 "[ . 1 . 2 . 3]" 1
606 1 53 ILE HA 1 66 TYR QD 4.000 . 5.000 3.519 3.048 3.820 . 0 0 "[ . 1 . 2 . 3]" 1
607 1 53 ILE HA 1 68 ASP QB 4.000 . 5.000 1.735 1.629 1.840 0.171 7 0 "[ . 1 . 2 . 3]" 1
608 1 53 ILE HB 1 54 ILE H 4.000 . 5.000 3.915 3.763 3.976 . 0 0 "[ . 1 . 2 . 3]" 1
609 1 53 ILE HB 1 68 ASP QB 4.000 . 5.000 2.324 1.993 2.880 . 0 0 "[ . 1 . 2 . 3]" 1
610 1 53 ILE HB 1 69 LEU QB 4.000 . 5.000 3.334 1.729 4.246 0.071 16 0 "[ . 1 . 2 . 3]" 1
611 1 53 ILE MD 1 63 ASP HA 3.000 . 3.800 3.401 3.332 3.482 . 0 0 "[ . 1 . 2 . 3]" 1
612 1 53 ILE MD 1 87 ILE MD 3.000 . 3.800 3.546 3.235 3.791 . 0 0 "[ . 1 . 2 . 3]" 1
613 1 53 ILE QG 1 54 ILE H 4.000 . 5.500 3.091 1.794 3.838 0.006 24 0 "[ . 1 . 2 . 3]" 1
614 1 53 ILE QG 1 73 VAL QG 3.000 . 3.800 2.988 2.415 3.191 . 0 0 "[ . 1 . 2 . 3]" 1
615 1 53 ILE MG 1 69 LEU QD 4.000 . 6.000 2.734 1.772 3.261 0.028 23 0 "[ . 1 . 2 . 3]" 1
616 1 54 ILE H 1 54 ILE HA 3.000 . 3.500 2.929 2.918 2.937 . 0 0 "[ . 1 . 2 . 3]" 1
617 1 54 ILE H 1 54 ILE HB 3.000 . 3.500 3.244 3.207 3.362 . 0 0 "[ . 1 . 2 . 3]" 1
618 1 54 ILE H 1 54 ILE MG 4.000 . 5.500 2.433 2.057 2.571 . 0 0 "[ . 1 . 2 . 3]" 1
619 1 54 ILE HA 1 55 LEU H 2.500 . 2.900 2.139 2.103 2.205 . 0 0 "[ . 1 . 2 . 3]" 1
620 1 54 ILE HA 1 63 ASP HA 2.500 . 2.700 2.463 2.234 2.664 . 0 0 "[ . 1 . 2 . 3]" 1
621 1 54 ILE HA 1 66 TYR QD 3.000 . 3.300 2.990 2.945 3.067 . 0 0 "[ . 1 . 2 . 3]" 1
622 1 54 ILE HB 1 55 LEU H 4.000 . 5.000 4.328 4.268 4.451 . 0 0 "[ . 1 . 2 . 3]" 1
623 1 54 ILE HB 1 63 ASP HA 3.000 . 3.300 3.059 2.780 3.309 0.009 25 0 "[ . 1 . 2 . 3]" 1
624 1 54 ILE HB 1 72 ARG QG 4.000 . 5.000 5.118 4.988 5.287 0.287 8 0 "[ . 1 . 2 . 3]" 1
625 1 54 ILE MD 1 61 ILE MG 4.000 . 5.000 3.890 2.747 5.065 0.065 11 0 "[ . 1 . 2 . 3]" 1
626 1 54 ILE MD 1 63 ASP QB 4.000 . 5.000 2.771 2.623 2.983 . 0 0 "[ . 1 . 2 . 3]" 1
627 1 54 ILE MD 1 73 VAL QG 4.000 . 5.000 2.743 2.641 3.349 . 0 0 "[ . 1 . 2 . 3]" 1
628 1 54 ILE MD 1 74 HIS HA 4.000 . 5.000 4.475 4.145 4.651 . 0 0 "[ . 1 . 2 . 3]" 1
629 1 54 ILE MD 1 75 PHE H 3.000 . 4.000 4.018 3.791 4.091 0.091 11 0 "[ . 1 . 2 . 3]" 1
630 1 54 ILE MD 1 75 PHE QD 4.000 . 5.500 3.221 3.098 3.334 . 0 0 "[ . 1 . 2 . 3]" 1
631 1 54 ILE MD 1 87 ILE MG 4.000 . 5.000 1.868 1.757 1.995 0.043 27 0 "[ . 1 . 2 . 3]" 1
632 1 54 ILE MG 1 87 ILE MD 4.000 . 5.000 2.027 1.813 2.274 . 0 0 "[ . 1 . 2 . 3]" 1
633 1 55 LEU H 1 55 LEU HA 3.000 . 3.500 2.937 2.925 2.947 . 0 0 "[ . 1 . 2 . 3]" 1
634 1 55 LEU H 1 55 LEU QB 3.000 . 3.500 2.579 2.315 2.942 . 0 0 "[ . 1 . 2 . 3]" 1
635 1 55 LEU HA 1 56 TYR H 2.500 . 2.900 2.351 2.291 2.432 . 0 0 "[ . 1 . 2 . 3]" 1
636 1 55 LEU HA 1 75 PHE HZ 4.000 . 6.000 3.446 3.153 3.827 . 0 0 "[ . 1 . 2 . 3]" 1
637 1 55 LEU QB 1 62 TYR QB 4.000 . 5.000 2.506 2.139 3.033 . 0 0 "[ . 1 . 2 . 3]" 1
638 1 55 LEU QB 1 62 TYR QD 3.000 . 3.300 1.737 1.471 2.489 0.329 12 0 "[ . 1 . 2 . 3]" 1
639 1 55 LEU QB 1 66 TYR QE 3.000 . 3.300 1.982 1.786 2.657 0.014 27 0 "[ . 1 . 2 . 3]" 1
640 1 55 LEU QD 1 56 TYR H 4.000 . 5.500 2.511 1.889 3.559 . 0 0 "[ . 1 . 2 . 3]" 1
641 1 55 LEU QD 1 57 SER QB 4.000 . 5.000 2.570 1.854 3.395 . 0 0 "[ . 1 . 2 . 3]" 1
642 1 56 TYR H 1 56 TYR HA 3.000 . 3.500 2.926 2.889 2.949 . 0 0 "[ . 1 . 2 . 3]" 1
643 1 56 TYR H 1 56 TYR QD 4.000 . 5.000 4.211 4.025 4.316 . 0 0 "[ . 1 . 2 . 3]" 1
644 1 56 TYR H 1 62 TYR QD 3.000 . 3.500 3.270 3.185 3.337 . 0 0 "[ . 1 . 2 . 3]" 1
645 1 56 TYR H 1 75 PHE HZ 3.000 . 3.500 3.609 3.560 3.658 0.158 26 0 "[ . 1 . 2 . 3]" 1
646 1 56 TYR HA 1 56 TYR QD 3.000 . 4.000 2.865 2.498 3.202 . 0 0 "[ . 1 . 2 . 3]" 1
647 1 56 TYR HA 1 57 SER H 2.500 . 2.900 2.154 2.079 2.213 . 0 0 "[ . 1 . 2 . 3]" 1
648 1 56 TYR HA 1 57 SER HA 4.000 . 5.000 4.369 4.345 4.394 . 0 0 "[ . 1 . 2 . 3]" 1
649 1 56 TYR HA 1 60 LYS H 4.000 . 5.000 4.801 4.244 4.998 . 0 0 "[ . 1 . 2 . 3]" 1
650 1 56 TYR HA 1 61 ILE HA 2.500 . 2.700 2.198 1.869 2.471 . 0 0 "[ . 1 . 2 . 3]" 1
651 1 56 TYR HA 1 61 ILE MG 4.000 . 5.500 3.869 3.072 4.695 . 0 0 "[ . 1 . 2 . 3]" 1
652 1 56 TYR HA 1 62 TYR H 3.000 . 4.000 2.520 2.210 2.889 . 0 0 "[ . 1 . 2 . 3]" 1
653 1 56 TYR HA 1 62 TYR QD 4.000 . 5.000 3.014 2.849 3.121 . 0 0 "[ . 1 . 2 . 3]" 1
654 1 56 TYR HA 1 75 PHE HZ 4.000 . 6.000 4.299 4.020 4.535 . 0 0 "[ . 1 . 2 . 3]" 1
655 1 56 TYR QB 1 80 LEU QD 4.000 . 5.500 2.718 2.342 3.339 . 0 0 "[ . 1 . 2 . 3]" 1
656 1 56 TYR HB2 1 57 SER H 4.000 . 5.000 4.360 4.174 4.499 . 0 0 "[ . 1 . 2 . 3]" 1
657 1 56 TYR HB3 1 57 SER H 4.000 . 5.000 4.458 4.377 4.521 . 0 0 "[ . 1 . 2 . 3]" 1
658 1 56 TYR QD 1 57 SER H 4.000 . 5.000 3.775 3.471 3.912 . 0 0 "[ . 1 . 2 . 3]" 1
659 1 56 TYR QD 1 57 SER HA 4.000 . 5.000 3.935 3.144 4.422 . 0 0 "[ . 1 . 2 . 3]" 1
660 1 56 TYR QD 1 61 ILE H 4.000 . 5.000 3.635 2.611 4.243 . 0 0 "[ . 1 . 2 . 3]" 1
661 1 56 TYR QD 1 61 ILE HA 4.000 . 5.000 2.286 1.810 2.723 . 0 0 "[ . 1 . 2 . 3]" 1
662 1 56 TYR QD 1 61 ILE QG 3.000 . 4.000 3.232 3.024 3.371 . 0 0 "[ . 1 . 2 . 3]" 1
663 1 56 TYR QD 1 80 LEU QD 4.000 . 6.000 2.683 2.101 3.201 . 0 0 "[ . 1 . 2 . 3]" 1
664 1 56 TYR QE 1 59 ASP H 4.000 . 5.000 3.861 3.381 4.195 . 0 0 "[ . 1 . 2 . 3]" 1
665 1 56 TYR QE 1 59 ASP HA 3.000 . 3.300 2.803 2.482 2.978 . 0 0 "[ . 1 . 2 . 3]" 1
666 1 56 TYR QE 1 61 ILE H 4.000 . 6.000 4.126 3.339 4.838 . 0 0 "[ . 1 . 2 . 3]" 1
667 1 57 SER H 1 57 SER HA 3.000 . 3.500 2.930 2.922 2.938 . 0 0 "[ . 1 . 2 . 3]" 1
668 1 57 SER H 1 57 SER QB 3.000 . 3.500 2.751 2.704 2.989 . 0 0 "[ . 1 . 2 . 3]" 1
669 1 57 SER H 1 58 GLY H 4.000 . 6.000 4.446 4.428 4.462 . 0 0 "[ . 1 . 2 . 3]" 1
670 1 57 SER H 1 59 ASP H 4.000 . 5.000 4.416 4.235 4.735 . 0 0 "[ . 1 . 2 . 3]" 1
671 1 57 SER H 1 60 LYS H 3.000 . 3.500 3.408 3.075 3.516 0.016 3 0 "[ . 1 . 2 . 3]" 1
672 1 57 SER H 1 61 ILE HA 3.000 . 3.500 3.598 3.402 3.679 0.179 24 0 "[ . 1 . 2 . 3]" 1
673 1 57 SER H 1 62 TYR QD 3.000 . 3.500 3.163 3.134 3.189 . 0 0 "[ . 1 . 2 . 3]" 1
674 1 57 SER H 1 62 TYR QE 4.000 . 5.000 2.082 1.955 2.234 . 0 0 "[ . 1 . 2 . 3]" 1
675 1 57 SER HA 1 58 GLY H 2.500 . 2.900 2.353 2.320 2.380 . 0 0 "[ . 1 . 2 . 3]" 1
676 1 57 SER HA 1 58 GLY QA 4.000 . 5.000 4.036 4.017 4.052 . 0 0 "[ . 1 . 2 . 3]" 1
677 1 57 SER QB 1 58 GLY H 4.000 . 5.000 3.211 2.477 3.412 . 0 0 "[ . 1 . 2 . 3]" 1
678 1 57 SER QB 1 62 TYR QD 4.000 . 5.000 3.759 3.571 3.994 . 0 0 "[ . 1 . 2 . 3]" 1
679 1 58 GLY H 1 58 GLY QA 2.500 . 2.900 2.188 2.179 2.197 . 0 0 "[ . 1 . 2 . 3]" 1
680 1 58 GLY H 1 59 ASP H 3.000 . 3.500 2.812 2.665 2.911 . 0 0 "[ . 1 . 2 . 3]" 1
681 1 58 GLY H 1 59 ASP QB 4.000 . 5.000 5.042 4.962 5.111 0.111 12 0 "[ . 1 . 2 . 3]" 1
682 1 58 GLY QA 1 59 ASP H 3.000 . 3.500 2.782 2.716 2.822 . 0 0 "[ . 1 . 2 . 3]" 1
683 1 59 ASP H 1 59 ASP HA 2.500 . 2.900 2.275 2.265 2.280 . 0 0 "[ . 1 . 2 . 3]" 1
684 1 59 ASP H 1 60 LYS H 3.000 . 3.500 2.634 2.577 2.678 . 0 0 "[ . 1 . 2 . 3]" 1
685 1 59 ASP HA 1 60 LYS H 3.000 . 3.500 3.199 2.913 3.283 . 0 0 "[ . 1 . 2 . 3]" 1
686 1 60 LYS H 1 60 LYS HA 3.000 . 3.500 2.936 2.930 2.947 . 0 0 "[ . 1 . 2 . 3]" 1
687 1 60 LYS H 1 60 LYS QB 3.000 . 3.500 2.418 2.294 3.136 . 0 0 "[ . 1 . 2 . 3]" 1
688 1 60 LYS H 1 61 ILE H 4.000 . 5.000 4.273 4.045 4.363 . 0 0 "[ . 1 . 2 . 3]" 1
689 1 60 LYS HA 1 61 ILE H 2.500 . 2.900 2.170 2.145 2.188 . 0 0 "[ . 1 . 2 . 3]" 1
690 1 60 LYS HA 1 62 TYR QD 4.000 . 6.000 5.068 4.996 5.199 . 0 0 "[ . 1 . 2 . 3]" 1
691 1 60 LYS QB 1 61 ILE H 3.000 . 3.500 3.449 3.327 3.546 0.046 21 0 "[ . 1 . 2 . 3]" 1
692 1 60 LYS QB 1 62 TYR QD 3.000 . 3.300 2.807 2.754 2.863 . 0 0 "[ . 1 . 2 . 3]" 1
693 1 60 LYS QB 1 62 TYR QE 4.000 . 5.000 1.854 1.804 1.975 . 0 0 "[ . 1 . 2 . 3]" 1
694 1 61 ILE H 1 61 ILE HA 3.000 . 3.500 2.889 2.873 2.899 . 0 0 "[ . 1 . 2 . 3]" 1
695 1 61 ILE H 1 61 ILE HB 3.000 . 3.500 3.178 2.718 3.609 0.109 16 0 "[ . 1 . 2 . 3]" 1
696 1 61 ILE H 1 61 ILE MD 3.000 . 4.000 3.599 3.231 4.135 0.135 22 0 "[ . 1 . 2 . 3]" 1
697 1 61 ILE H 1 62 TYR QE 4.000 . 6.000 5.224 5.077 5.501 . 0 0 "[ . 1 . 2 . 3]" 1
698 1 61 ILE HA 1 62 TYR H 2.500 . 2.900 2.055 1.933 2.111 . 0 0 "[ . 1 . 2 . 3]" 1
699 1 61 ILE HA 1 62 TYR QD 4.000 . 5.000 4.091 3.935 4.199 . 0 0 "[ . 1 . 2 . 3]" 1
700 1 61 ILE HB 1 62 TYR H 3.000 . 3.500 3.663 3.354 3.843 0.343 4 0 "[ . 1 . 2 . 3]" 1
701 1 61 ILE MD 1 62 TYR H 3.000 . 4.000 3.787 2.198 4.207 0.207 29 0 "[ . 1 . 2 . 3]" 1
702 1 61 ILE MD 1 75 PHE QB 4.000 . 5.000 3.438 3.177 3.833 . 0 0 "[ . 1 . 2 . 3]" 1
703 1 61 ILE MD 1 75 PHE QD 3.000 . 3.300 2.446 2.164 2.516 . 0 0 "[ . 1 . 2 . 3]" 1
704 1 61 ILE MD 1 80 LEU QD 4.000 . 5.000 3.202 1.849 4.785 . 0 0 "[ . 1 . 2 . 3]" 1
705 1 62 TYR H 1 62 TYR HA 3.000 . 3.500 2.916 2.901 2.930 . 0 0 "[ . 1 . 2 . 3]" 1
706 1 62 TYR H 1 62 TYR QB 3.000 . 3.500 2.713 2.632 2.817 . 0 0 "[ . 1 . 2 . 3]" 1
707 1 62 TYR H 1 62 TYR QD 2.500 . 2.900 2.954 2.685 3.090 0.190 24 0 "[ . 1 . 2 . 3]" 1
708 1 62 TYR H 1 62 TYR QE 4.000 . 5.000 4.412 4.211 4.555 . 0 0 "[ . 1 . 2 . 3]" 1
709 1 62 TYR H 1 66 TYR QE 4.000 . 5.000 5.085 5.041 5.142 0.142 25 0 "[ . 1 . 2 . 3]" 1
710 1 62 TYR H 1 75 PHE QE 4.000 . 5.000 3.151 2.807 3.493 . 0 0 "[ . 1 . 2 . 3]" 1
711 1 62 TYR HA 1 62 TYR QD 3.000 . 3.300 2.809 2.706 2.928 . 0 0 "[ . 1 . 2 . 3]" 1
712 1 62 TYR HA 1 63 ASP H 2.500 . 2.900 2.099 2.047 2.170 . 0 0 "[ . 1 . 2 . 3]" 1
713 1 62 TYR HA 1 64 ASP H 4.000 . 5.000 3.871 3.699 4.036 . 0 0 "[ . 1 . 2 . 3]" 1
714 1 62 TYR HA 1 65 TYR H 4.000 . 5.000 3.359 3.171 3.613 . 0 0 "[ . 1 . 2 . 3]" 1
715 1 62 TYR HA 1 65 TYR QB 4.000 . 5.000 2.775 2.347 3.344 . 0 0 "[ . 1 . 2 . 3]" 1
716 1 62 TYR HA 1 66 TYR H 4.000 . 5.000 4.112 3.806 4.559 . 0 0 "[ . 1 . 2 . 3]" 1
717 1 62 TYR QB 1 62 TYR QD 2.500 . 2.700 2.158 2.124 2.171 . 0 0 "[ . 1 . 2 . 3]" 1
718 1 62 TYR QB 1 63 ASP H 3.000 . 3.500 3.172 2.890 3.340 . 0 0 "[ . 1 . 2 . 3]" 1
719 1 62 TYR QB 1 64 ASP H 4.000 . 5.000 5.021 4.771 5.079 0.079 9 0 "[ . 1 . 2 . 3]" 1
720 1 62 TYR QB 1 65 TYR QB 3.000 . 3.800 2.823 2.425 3.045 . 0 0 "[ . 1 . 2 . 3]" 1
721 1 62 TYR QB 1 66 TYR QD 4.000 . 5.000 1.883 1.764 2.023 0.036 26 0 "[ . 1 . 2 . 3]" 1
722 1 62 TYR QB 1 66 TYR QE 4.000 . 5.000 2.382 2.192 2.725 . 0 0 "[ . 1 . 2 . 3]" 1
723 1 62 TYR QD 1 65 TYR QB 4.000 . 5.000 3.193 2.888 3.511 . 0 0 "[ . 1 . 2 . 3]" 1
724 1 63 ASP H 1 63 ASP HA 3.000 . 3.500 2.885 2.872 2.899 . 0 0 "[ . 1 . 2 . 3]" 1
725 1 63 ASP H 1 63 ASP QB 3.000 . 3.500 3.315 3.273 3.361 . 0 0 "[ . 1 . 2 . 3]" 1
726 1 63 ASP H 1 64 ASP H 3.000 . 3.500 2.082 1.922 2.223 . 0 0 "[ . 1 . 2 . 3]" 1
727 1 63 ASP H 1 65 TYR H 4.000 . 5.000 2.072 1.946 2.222 . 0 0 "[ . 1 . 2 . 3]" 1
728 1 63 ASP HA 1 64 ASP H 3.000 . 3.500 3.548 3.532 3.562 0.062 30 0 "[ . 1 . 2 . 3]" 1
729 1 63 ASP HA 1 65 TYR H 4.000 . 5.000 4.283 4.085 4.501 . 0 0 "[ . 1 . 2 . 3]" 1
730 1 63 ASP HA 1 66 TYR QD 4.000 . 5.000 3.643 3.468 3.814 . 0 0 "[ . 1 . 2 . 3]" 1
731 1 63 ASP QB 1 64 ASP H 3.000 . 3.500 3.085 2.873 3.209 . 0 0 "[ . 1 . 2 . 3]" 1
732 1 63 ASP QB 1 73 VAL QG 4.000 . 6.000 1.930 1.773 3.614 0.027 8 0 "[ . 1 . 2 . 3]" 1
733 1 64 ASP H 1 64 ASP HA 2.500 . 2.900 2.888 2.879 2.898 . 0 0 "[ . 1 . 2 . 3]" 1
734 1 64 ASP H 1 64 ASP QB 3.000 . 3.500 2.402 2.288 2.706 . 0 0 "[ . 1 . 2 . 3]" 1
735 1 64 ASP H 1 65 TYR H 3.000 . 3.500 2.247 2.184 2.306 . 0 0 "[ . 1 . 2 . 3]" 1
736 1 64 ASP H 1 65 TYR HA 4.000 . 5.000 4.934 4.878 4.987 . 0 0 "[ . 1 . 2 . 3]" 1
737 1 64 ASP HA 1 65 TYR H 3.000 . 3.500 3.431 3.397 3.471 . 0 0 "[ . 1 . 2 . 3]" 1
738 1 64 ASP HA 1 66 TYR H 4.000 . 5.000 3.956 3.861 4.067 . 0 0 "[ . 1 . 2 . 3]" 1
739 1 64 ASP HA 1 70 LYS HA 3.000 . 3.300 2.081 1.834 3.115 . 0 0 "[ . 1 . 2 . 3]" 1
740 1 64 ASP HA 1 70 LYS QB 3.000 . 3.300 2.112 1.851 2.629 . 0 0 "[ . 1 . 2 . 3]" 1
741 1 64 ASP HA 1 71 GLY H 3.000 . 4.000 1.850 1.783 2.280 0.017 18 0 "[ . 1 . 2 . 3]" 1
742 1 64 ASP QB 1 65 TYR H 3.000 . 3.500 3.032 2.659 3.598 0.098 6 0 "[ . 1 . 2 . 3]" 1
743 1 64 ASP QB 1 71 GLY H 3.000 . 4.000 2.902 2.360 3.576 . 0 0 "[ . 1 . 2 . 3]" 1
744 1 65 TYR H 1 65 TYR HA 3.000 . 3.500 2.875 2.861 2.889 . 0 0 "[ . 1 . 2 . 3]" 1
745 1 65 TYR H 1 65 TYR QB 3.000 . 3.500 2.284 2.038 2.591 . 0 0 "[ . 1 . 2 . 3]" 1
746 1 65 TYR H 1 65 TYR QD . . 3.500 2.876 2.014 3.720 0.220 23 0 "[ . 1 . 2 . 3]" 1
747 1 65 TYR H 1 66 TYR H 3.000 . 3.500 2.241 2.174 2.296 . 0 0 "[ . 1 . 2 . 3]" 1
748 1 65 TYR H 1 66 TYR QB 4.000 . 6.000 3.969 3.876 4.080 . 0 0 "[ . 1 . 2 . 3]" 1
749 1 65 TYR HA 1 65 TYR QD 3.000 . 3.300 3.010 2.983 3.040 . 0 0 "[ . 1 . 2 . 3]" 1
750 1 65 TYR HA 1 66 TYR H 4.000 . 5.000 3.458 3.439 3.472 . 0 0 "[ . 1 . 2 . 3]" 1
751 1 65 TYR QB 1 66 TYR H 3.000 . 3.500 2.817 2.661 2.976 . 0 0 "[ . 1 . 2 . 3]" 1
752 1 65 TYR QB 1 66 TYR QD 4.000 . 5.000 3.994 3.912 4.029 . 0 0 "[ . 1 . 2 . 3]" 1
753 1 65 TYR QD 1 66 TYR H 3.000 . 3.500 3.377 3.053 3.608 0.108 12 0 "[ . 1 . 2 . 3]" 1
754 1 66 TYR H 1 66 TYR HA 3.000 . 3.500 2.888 2.879 2.895 . 0 0 "[ . 1 . 2 . 3]" 1
755 1 66 TYR H 1 66 TYR QB 3.000 . 3.500 2.108 2.055 2.163 . 0 0 "[ . 1 . 2 . 3]" 1
756 1 66 TYR H 1 66 TYR QD . . 3.500 3.397 3.263 3.510 0.010 13 0 "[ . 1 . 2 . 3]" 1
757 1 66 TYR HA 1 66 TYR QD 3.000 . 3.300 2.634 2.420 2.815 . 0 0 "[ . 1 . 2 . 3]" 1
758 1 66 TYR HA 1 67 PRO QD 2.500 . 2.800 1.920 1.814 2.027 . 0 0 "[ . 1 . 2 . 3]" 1
759 1 66 TYR QB 1 68 ASP H 3.000 . 3.800 3.041 2.892 3.326 . 0 0 "[ . 1 . 2 . 3]" 1
760 1 66 TYR QB 1 68 ASP QB 4.000 . 5.000 3.155 2.952 3.314 . 0 0 "[ . 1 . 2 . 3]" 1
761 1 66 TYR QD 1 67 PRO QD 4.000 . 5.000 2.584 2.258 2.960 . 0 0 "[ . 1 . 2 . 3]" 1
762 1 66 TYR QD 1 68 ASP H 4.000 . 5.000 3.086 3.015 3.231 . 0 0 "[ . 1 . 2 . 3]" 1
763 1 66 TYR QE 1 68 ASP H 4.000 . 5.000 5.212 5.137 5.373 0.373 18 0 "[ . 1 . 2 . 3]" 1
764 1 67 PRO HA 1 68 ASP H 4.000 . 5.000 3.559 3.549 3.584 . 0 0 "[ . 1 . 2 . 3]" 1
765 1 67 PRO HA 1 69 LEU H 4.000 . 5.000 4.796 3.783 5.109 0.109 17 0 "[ . 1 . 2 . 3]" 1
766 1 67 PRO HA 1 70 LYS H 4.000 . 5.000 3.559 2.758 3.845 . 0 0 "[ . 1 . 2 . 3]" 1
767 1 67 PRO HA 1 70 LYS QB 3.000 . 3.800 2.707 1.981 3.123 . 0 0 "[ . 1 . 2 . 3]" 1
768 1 67 PRO HA 1 70 LYS QD 3.000 . 3.800 1.987 1.827 2.165 . 0 0 "[ . 1 . 2 . 3]" 1
769 1 67 PRO HA 1 70 LYS QG 4.000 . 5.000 2.914 2.141 3.472 . 0 0 "[ . 1 . 2 . 3]" 1
770 1 67 PRO QB 1 70 LYS QD 4.000 . 5.000 3.430 2.588 3.787 . 0 0 "[ . 1 . 2 . 3]" 1
771 1 67 PRO QD 1 68 ASP H 3.000 . 3.500 2.866 2.311 3.121 . 0 0 "[ . 1 . 2 . 3]" 1
772 1 68 ASP H 1 68 ASP HA 3.000 . 3.500 2.813 2.710 2.862 . 0 0 "[ . 1 . 2 . 3]" 1
773 1 68 ASP H 1 68 ASP HB2 4.000 . 5.000 2.277 2.144 2.503 . 0 0 "[ . 1 . 2 . 3]" 1
774 1 68 ASP H 1 68 ASP HB3 3.000 . 3.500 3.449 2.590 3.579 0.079 25 0 "[ . 1 . 2 . 3]" 1
775 1 68 ASP H 1 69 LEU H 4.000 . 5.000 3.960 2.759 4.342 . 0 0 "[ . 1 . 2 . 3]" 1
776 1 68 ASP H 1 70 LYS H 4.000 . 6.000 4.319 3.965 4.505 . 0 0 "[ . 1 . 2 . 3]" 1
777 1 68 ASP HA 1 69 LEU H 2.500 . 3.000 2.411 2.089 3.388 0.388 19 0 "[ . 1 . 2 . 3]" 1
778 1 68 ASP HA 1 70 LYS H 4.000 . 5.000 4.046 3.836 4.627 . 0 0 "[ . 1 . 2 . 3]" 1
779 1 68 ASP QB 1 69 LEU H 4.000 . 5.000 3.424 2.626 3.915 . 0 0 "[ . 1 . 2 . 3]" 1
780 1 69 LEU H 1 69 LEU HA 3.000 . 3.500 2.403 2.250 2.893 . 0 0 "[ . 1 . 2 . 3]" 1
781 1 69 LEU H 1 69 LEU QB 3.000 . 3.500 3.230 2.745 3.424 . 0 0 "[ . 1 . 2 . 3]" 1
782 1 69 LEU H 1 70 LYS H 3.000 . 3.500 2.562 2.060 2.793 . 0 0 "[ . 1 . 2 . 3]" 1
783 1 69 LEU HA 1 70 LYS H 3.000 . 3.500 2.996 2.790 3.102 . 0 0 "[ . 1 . 2 . 3]" 1
784 1 69 LEU HA 1 72 ARG QG 4.000 . 5.000 2.872 2.692 3.331 . 0 0 "[ . 1 . 2 . 3]" 1
785 1 69 LEU QB 1 73 VAL H 4.000 . 5.000 2.912 2.492 3.288 . 0 0 "[ . 1 . 2 . 3]" 1
786 1 69 LEU QB 1 73 VAL HB 3.000 . 3.300 2.802 2.257 3.310 0.010 17 0 "[ . 1 . 2 . 3]" 1
787 1 69 LEU QB 1 73 VAL QG 4.000 . 6.000 2.200 1.612 2.469 0.188 17 0 "[ . 1 . 2 . 3]" 1
788 1 69 LEU QB 1 89 VAL QG 4.000 . 5.000 3.055 2.762 3.415 . 0 0 "[ . 1 . 2 . 3]" 1
789 1 69 LEU QD 1 73 VAL QG 4.000 . 6.000 2.718 1.812 3.628 . 0 0 "[ . 1 . 2 . 3]" 1
790 1 69 LEU QD 1 89 VAL QG 3.000 . 3.800 2.194 1.703 3.208 0.097 25 0 "[ . 1 . 2 . 3]" 1
791 1 69 LEU QD 1 100 TYR QE 4.000 . 6.000 2.123 1.855 3.474 . 0 0 "[ . 1 . 2 . 3]" 1
792 1 70 LYS H 1 70 LYS HA 3.000 . 3.500 2.808 2.780 2.823 . 0 0 "[ . 1 . 2 . 3]" 1
793 1 70 LYS H 1 70 LYS QB 3.000 . 3.500 2.509 2.366 2.633 . 0 0 "[ . 1 . 2 . 3]" 1
794 1 70 LYS H 1 70 LYS QG 3.000 . 3.500 2.166 1.963 2.505 . 0 0 "[ . 1 . 2 . 3]" 1
795 1 70 LYS H 1 71 GLY H 4.000 . 5.000 4.580 4.553 4.629 . 0 0 "[ . 1 . 2 . 3]" 1
796 1 70 LYS H 1 72 ARG H 4.000 . 6.000 5.080 4.914 5.170 . 0 0 "[ . 1 . 2 . 3]" 1
797 1 70 LYS HA 1 70 LYS QD 4.000 . 5.000 4.270 4.260 4.279 . 0 0 "[ . 1 . 2 . 3]" 1
798 1 70 LYS HA 1 71 GLY H 2.500 . 2.900 2.134 2.097 2.235 . 0 0 "[ . 1 . 2 . 3]" 1
799 1 70 LYS HA 1 73 VAL H 4.000 . 5.000 4.525 3.824 4.593 . 0 0 "[ . 1 . 2 . 3]" 1
800 1 70 LYS HA 1 73 VAL QG 4.000 . 5.000 3.763 3.724 3.906 . 0 0 "[ . 1 . 2 . 3]" 1
801 1 70 LYS HA 1 74 HIS HE1 4.000 . 5.000 5.160 5.123 5.205 0.205 22 0 "[ . 1 . 2 . 3]" 1
802 1 70 LYS QB 1 71 GLY H 4.000 . 5.000 3.064 2.728 3.175 . 0 0 "[ . 1 . 2 . 3]" 1
803 1 71 GLY H 1 71 GLY QA 2.500 . 2.900 2.237 2.202 2.268 . 0 0 "[ . 1 . 2 . 3]" 1
804 1 71 GLY H 1 72 ARG H 3.000 . 3.500 2.506 2.383 2.640 . 0 0 "[ . 1 . 2 . 3]" 1
805 1 71 GLY H 1 73 VAL H 4.000 . 5.000 4.260 4.091 4.572 . 0 0 "[ . 1 . 2 . 3]" 1
806 1 71 GLY QA 1 72 ARG H 3.000 . 3.500 2.945 2.918 2.965 . 0 0 "[ . 1 . 2 . 3]" 1
807 1 71 GLY QA 1 72 ARG QG 4.000 . 5.000 4.032 3.995 4.064 . 0 0 "[ . 1 . 2 . 3]" 1
808 1 72 ARG H 1 72 ARG QB 3.000 . 3.500 3.131 3.088 3.161 . 0 0 "[ . 1 . 2 . 3]" 1
809 1 72 ARG H 1 72 ARG QG 4.000 . 5.000 2.266 2.080 2.391 . 0 0 "[ . 1 . 2 . 3]" 1
810 1 72 ARG H 1 73 VAL H 2.500 . 2.900 2.145 1.974 2.292 . 0 0 "[ . 1 . 2 . 3]" 1
811 1 72 ARG HA 1 73 VAL H 3.000 . 3.500 3.517 3.503 3.532 0.032 25 0 "[ . 1 . 2 . 3]" 1
812 1 72 ARG HA 1 74 HIS QB 3.000 . 3.800 3.985 3.892 4.103 0.303 18 0 "[ . 1 . 2 . 3]" 1
813 1 72 ARG HA 1 74 HIS HE1 4.000 . 5.000 3.692 3.493 3.884 . 0 0 "[ . 1 . 2 . 3]" 1
814 1 72 ARG QB 1 73 VAL H 4.000 . 5.000 3.174 3.005 3.329 . 0 0 "[ . 1 . 2 . 3]" 1
815 1 72 ARG QB 1 89 VAL QG 4.000 . 5.000 2.183 1.786 2.452 0.014 5 0 "[ . 1 . 2 . 3]" 1
816 1 72 ARG QB 1 90 THR H 3.000 . 3.500 1.793 1.755 1.863 0.045 28 0 "[ . 1 . 2 . 3]" 1
817 1 73 VAL H 1 73 VAL HA 3.000 . 3.500 2.855 2.844 2.877 . 0 0 "[ . 1 . 2 . 3]" 1
818 1 73 VAL H 1 73 VAL HB 3.000 . 3.500 2.627 2.562 2.808 . 0 0 "[ . 1 . 2 . 3]" 1
819 1 73 VAL H 1 73 VAL QG 3.000 . 4.500 1.788 1.739 1.958 0.061 22 0 "[ . 1 . 2 . 3]" 1
820 1 73 VAL H 1 74 HIS H 4.000 . 5.000 3.794 3.769 3.856 . 0 0 "[ . 1 . 2 . 3]" 1
821 1 73 VAL HA 1 74 HIS H 2.500 . 2.900 2.168 2.037 2.204 . 0 0 "[ . 1 . 2 . 3]" 1
822 1 73 VAL HA 1 89 VAL HA 3.000 . 3.300 2.139 2.008 2.312 . 0 0 "[ . 1 . 2 . 3]" 1
823 1 73 VAL HA 1 90 THR H 3.000 . 3.500 3.639 3.566 3.710 0.210 13 0 "[ . 1 . 2 . 3]" 1
824 1 73 VAL HB 1 74 HIS H 4.000 . 5.000 4.429 4.294 4.465 . 0 0 "[ . 1 . 2 . 3]" 1
825 1 73 VAL HB 1 89 VAL QG 4.000 . 5.000 2.445 1.972 3.801 . 0 0 "[ . 1 . 2 . 3]" 1
826 1 73 VAL QG 1 87 ILE MD 3.000 . 3.800 1.882 1.668 2.064 0.132 17 0 "[ . 1 . 2 . 3]" 1
827 1 73 VAL QG 1 88 ASN HA 4.000 . 5.500 4.195 4.143 4.240 . 0 0 "[ . 1 . 2 . 3]" 1
828 1 73 VAL QG 1 89 VAL QG 4.000 . 6.000 2.775 1.636 3.769 0.164 17 0 "[ . 1 . 2 . 3]" 1
829 1 73 VAL MG2 1 87 ILE MD 4.000 . 5.000 1.950 1.774 3.603 0.026 11 0 "[ . 1 . 2 . 3]" 1
830 1 74 HIS H 1 74 HIS HA 3.000 . 3.500 2.903 2.892 2.923 . 0 0 "[ . 1 . 2 . 3]" 1
831 1 74 HIS H 1 74 HIS QB 3.000 . 3.500 1.987 1.954 2.053 . 0 0 "[ . 1 . 2 . 3]" 1
832 1 74 HIS H 1 87 ILE HB 4.000 . 5.000 3.879 3.440 4.066 . 0 0 "[ . 1 . 2 . 3]" 1
833 1 74 HIS H 1 88 ASN H 3.000 . 3.500 3.112 3.010 3.195 . 0 0 "[ . 1 . 2 . 3]" 1
834 1 74 HIS H 1 89 VAL HA 4.000 . 5.000 3.222 3.108 3.337 . 0 0 "[ . 1 . 2 . 3]" 1
835 1 74 HIS HA 1 75 PHE H 2.500 . 2.900 2.254 2.227 2.286 . 0 0 "[ . 1 . 2 . 3]" 1
836 1 74 HIS QB 1 74 HIS HD2 3.000 . 3.300 2.772 2.712 2.823 . 0 0 "[ . 1 . 2 . 3]" 1
837 1 74 HIS QB 1 75 PHE H 3.000 . 3.500 3.465 3.388 3.518 0.018 26 0 "[ . 1 . 2 . 3]" 1
838 1 74 HIS QB 1 88 ASN H 3.000 . 3.500 3.611 3.567 3.645 0.145 13 0 "[ . 1 . 2 . 3]" 1
839 1 74 HIS HE1 1 90 THR MG 3.000 . 4.000 3.475 3.442 3.514 . 0 0 "[ . 1 . 2 . 3]" 1
840 1 75 PHE H 1 75 PHE HA 3.000 . 3.500 2.851 2.833 2.865 . 0 0 "[ . 1 . 2 . 3]" 1
841 1 75 PHE H 1 75 PHE QB 2.500 . 2.900 2.495 2.428 2.557 . 0 0 "[ . 1 . 2 . 3]" 1
842 1 75 PHE H 1 75 PHE QD . . 3.500 2.964 2.802 3.133 . 0 0 "[ . 1 . 2 . 3]" 1
843 1 75 PHE H 1 76 THR H 4.000 . 5.000 4.464 4.413 4.502 . 0 0 "[ . 1 . 2 . 3]" 1
844 1 75 PHE H 1 77 SER H 4.000 . 5.000 4.939 4.747 5.113 0.113 6 0 "[ . 1 . 2 . 3]" 1
845 1 75 PHE HA 1 75 PHE QD 3.000 . 3.300 2.700 2.591 2.788 . 0 0 "[ . 1 . 2 . 3]" 1
846 1 75 PHE HA 1 76 THR H 2.500 . 2.900 2.085 2.027 2.108 . 0 0 "[ . 1 . 2 . 3]" 1
847 1 75 PHE HA 1 77 SER H 4.000 . 5.000 3.675 3.344 4.069 . 0 0 "[ . 1 . 2 . 3]" 1
848 1 75 PHE HA 1 87 ILE HA 2.500 . 2.700 1.653 1.609 1.690 0.191 7 0 "[ . 1 . 2 . 3]" 1
849 1 75 PHE HA 1 88 ASN H 4.000 . 5.000 3.262 3.148 3.368 . 0 0 "[ . 1 . 2 . 3]" 1
850 1 75 PHE QB 1 76 THR H 3.000 . 3.500 3.185 3.113 3.252 . 0 0 "[ . 1 . 2 . 3]" 1
851 1 75 PHE QB 1 77 SER H 4.000 . 5.000 2.537 2.306 2.903 . 0 0 "[ . 1 . 2 . 3]" 1
852 1 75 PHE QB 1 80 LEU QD 4.000 . 5.000 2.362 1.979 3.484 . 0 0 "[ . 1 . 2 . 3]" 1
853 1 75 PHE QD 1 76 THR H 4.000 . 5.500 4.020 3.831 4.162 . 0 0 "[ . 1 . 2 . 3]" 1
854 1 75 PHE QD 1 80 LEU QD 4.000 . 5.500 2.624 2.253 3.522 . 0 0 "[ . 1 . 2 . 3]" 1
855 1 75 PHE QD 1 85 ALA HA 4.000 . 5.000 3.659 3.488 3.821 . 0 0 "[ . 1 . 2 . 3]" 1
856 1 75 PHE QD 1 85 ALA MB 4.000 . 6.500 3.880 3.613 4.047 . 0 0 "[ . 1 . 2 . 3]" 1
857 1 75 PHE QD 1 86 SER HA 3.000 . 3.300 3.321 3.280 3.349 0.049 25 0 "[ . 1 . 2 . 3]" 1
858 1 75 PHE QD 1 87 ILE HA 4.000 . 6.000 3.165 3.040 3.323 . 0 0 "[ . 1 . 2 . 3]" 1
859 1 75 PHE QD 1 87 ILE MG 4.000 . 5.000 2.360 2.281 2.401 . 0 0 "[ . 1 . 2 . 3]" 1
860 1 76 THR H 1 76 THR HA 3.000 . 3.500 2.846 2.831 2.859 . 0 0 "[ . 1 . 2 . 3]" 1
861 1 76 THR H 1 76 THR HB 3.000 . 3.500 3.462 2.819 3.567 0.067 29 0 "[ . 1 . 2 . 3]" 1
862 1 76 THR H 1 76 THR MG 4.000 . 5.500 1.967 1.765 2.123 0.035 14 0 "[ . 1 . 2 . 3]" 1
863 1 76 THR H 1 77 SER H 3.000 . 3.500 2.913 2.500 3.357 . 0 0 "[ . 1 . 2 . 3]" 1
864 1 76 THR H 1 87 ILE MG 4.000 . 5.500 3.818 3.536 4.098 . 0 0 "[ . 1 . 2 . 3]" 1
865 1 76 THR H 1 88 ASN H 3.000 . 3.500 3.520 3.453 3.571 0.071 25 0 "[ . 1 . 2 . 3]" 1
866 1 76 THR HA 1 77 SER H 4.000 . 5.000 3.104 2.875 3.374 . 0 0 "[ . 1 . 2 . 3]" 1
867 1 76 THR HA 1 88 ASN H 4.000 . 5.000 5.004 4.868 5.045 0.045 26 0 "[ . 1 . 2 . 3]" 1
868 1 76 THR HB 1 77 SER H 4.000 . 5.000 4.450 4.223 4.702 . 0 0 "[ . 1 . 2 . 3]" 1
869 1 76 THR MG 1 87 ILE HA 3.000 . 3.800 3.201 3.153 3.237 . 0 0 "[ . 1 . 2 . 3]" 1
870 1 76 THR MG 1 88 ASN H 3.000 . 4.000 2.878 2.586 3.900 . 0 0 "[ . 1 . 2 . 3]" 1
871 1 76 THR MG 1 88 ASN HA 4.000 . 5.500 4.031 3.824 4.639 . 0 0 "[ . 1 . 2 . 3]" 1
872 1 76 THR MG 1 88 ASN QB 4.000 . 6.000 2.435 2.055 3.553 . 0 0 "[ . 1 . 2 . 3]" 1
873 1 77 SER H 1 77 SER QB 2.500 . 2.900 2.640 2.263 2.904 0.004 7 0 "[ . 1 . 2 . 3]" 1
874 1 77 SER H 1 78 ASN HA 4.000 . 5.000 4.818 4.524 5.136 0.136 17 0 "[ . 1 . 2 . 3]" 1
875 1 77 SER H 1 78 ASN QB 4.000 . 5.500 5.504 5.212 5.627 0.127 5 0 "[ . 1 . 2 . 3]" 1
876 1 77 SER HA 1 78 ASN H 2.500 . 2.900 2.137 2.114 2.176 . 0 0 "[ . 1 . 2 . 3]" 1
877 1 77 SER HA 1 79 ASP H 4.000 . 5.000 3.416 3.183 3.614 . 0 0 "[ . 1 . 2 . 3]" 1
878 1 77 SER QB 1 78 ASN H 3.000 . 3.500 3.292 3.000 3.561 0.061 5 0 "[ . 1 . 2 . 3]" 1
879 1 77 SER QB 1 79 ASP H 3.000 . 3.500 2.570 2.309 3.056 . 0 0 "[ . 1 . 2 . 3]" 1
880 1 77 SER QB 1 80 LEU HA 3.000 . 3.300 2.880 2.432 2.994 . 0 0 "[ . 1 . 2 . 3]" 1
881 1 77 SER QB 1 84 ASP QB 3.000 . 3.800 2.688 1.762 3.024 0.038 17 0 "[ . 1 . 2 . 3]" 1
882 1 78 ASN H 1 78 ASN HA 3.000 . 3.500 2.907 2.896 2.920 . 0 0 "[ . 1 . 2 . 3]" 1
883 1 78 ASN H 1 78 ASN QB 2.500 . 2.900 2.397 2.186 2.730 . 0 0 "[ . 1 . 2 . 3]" 1
884 1 78 ASN H 1 79 ASP H 2.500 . 2.900 2.414 2.329 2.498 . 0 0 "[ . 1 . 2 . 3]" 1
885 1 78 ASN H 1 79 ASP HA 4.000 . 5.000 5.017 4.994 5.038 0.038 7 0 "[ . 1 . 2 . 3]" 1
886 1 78 ASN HA 1 79 ASP H 3.000 . 3.500 3.193 3.112 3.257 . 0 0 "[ . 1 . 2 . 3]" 1
887 1 78 ASN QB 1 79 ASP H 4.000 . 5.000 3.577 3.378 3.904 . 0 0 "[ . 1 . 2 . 3]" 1
888 1 79 ASP H 1 79 ASP HA 3.000 . 3.500 2.898 2.889 2.904 . 0 0 "[ . 1 . 2 . 3]" 1
889 1 79 ASP H 1 79 ASP QB 3.000 . 3.500 2.765 2.702 3.166 . 0 0 "[ . 1 . 2 . 3]" 1
890 1 79 ASP H 1 80 LEU H 2.500 . 2.900 2.981 2.945 3.022 0.122 21 0 "[ . 1 . 2 . 3]" 1
891 1 79 ASP HA 1 81 LYS H 3.000 . 3.500 3.369 3.214 3.525 0.025 17 0 "[ . 1 . 2 . 3]" 1
892 1 79 ASP QB 1 82 SER QB 3.000 . 3.800 2.831 2.323 3.027 . 0 0 "[ . 1 . 2 . 3]" 1
893 1 80 LEU H 1 81 LYS H 2.500 . 2.900 2.756 2.704 2.818 . 0 0 "[ . 1 . 2 . 3]" 1
894 1 80 LEU HA 1 81 LYS H 3.000 . 3.500 3.502 3.462 3.534 0.034 29 0 "[ . 1 . 2 . 3]" 1
895 1 80 LEU HA 1 82 SER H 4.000 . 5.000 3.337 3.236 3.501 . 0 0 "[ . 1 . 2 . 3]" 1
896 1 80 LEU HA 1 83 GLY H 4.000 . 5.000 3.994 3.761 4.261 . 0 0 "[ . 1 . 2 . 3]" 1
897 1 80 LEU HA 1 84 ASP H 3.000 . 3.500 3.374 2.916 3.558 0.058 8 0 "[ . 1 . 2 . 3]" 1
898 1 80 LEU QB 1 81 LYS H 3.000 . 3.500 2.788 2.618 2.994 . 0 0 "[ . 1 . 2 . 3]" 1
899 1 80 LEU HG 1 85 ALA HA 3.000 . 3.300 2.642 1.996 3.378 0.078 8 0 "[ . 1 . 2 . 3]" 1
900 1 81 LYS H 1 81 LYS HA 3.000 . 3.500 2.796 2.774 2.814 . 0 0 "[ . 1 . 2 . 3]" 1
901 1 81 LYS H 1 81 LYS QB 2.500 . 2.900 2.398 2.361 2.482 . 0 0 "[ . 1 . 2 . 3]" 1
902 1 81 LYS H 1 81 LYS QG 2.500 . 2.900 2.333 2.194 2.420 . 0 0 "[ . 1 . 2 . 3]" 1
903 1 81 LYS H 1 82 SER H 3.000 . 3.500 2.712 2.600 2.801 . 0 0 "[ . 1 . 2 . 3]" 1
904 1 81 LYS HA 1 82 SER H 2.500 . 2.900 3.189 3.147 3.243 0.343 19 0 "[ . 1 . 2 . 3]" 1
905 1 81 LYS HA 1 83 GLY H 3.000 . 3.300 3.303 3.229 3.345 0.045 30 0 "[ . 1 . 2 . 3]" 1
906 1 81 LYS QB 1 82 SER H 3.000 . 3.500 3.388 3.240 3.679 0.179 25 0 "[ . 1 . 2 . 3]" 1
907 1 82 SER H 1 82 SER HA 3.000 . 3.500 2.901 2.882 2.912 . 0 0 "[ . 1 . 2 . 3]" 1
908 1 82 SER H 1 82 SER QB 3.000 . 3.500 2.391 2.179 2.679 . 0 0 "[ . 1 . 2 . 3]" 1
909 1 82 SER H 1 84 ASP H 4.000 . 5.000 3.423 3.251 3.647 . 0 0 "[ . 1 . 2 . 3]" 1
910 1 82 SER HA 1 83 GLY H 3.000 . 3.500 3.279 3.172 3.335 . 0 0 "[ . 1 . 2 . 3]" 1
911 1 82 SER QB 1 83 GLY H 4.000 . 5.000 3.492 3.292 3.896 . 0 0 "[ . 1 . 2 . 3]" 1
912 1 83 GLY H 1 83 GLY QA 2.500 . 2.900 2.309 2.274 2.340 . 0 0 "[ . 1 . 2 . 3]" 1
913 1 83 GLY H 1 84 ASP H 2.500 . 2.900 2.450 2.242 2.628 . 0 0 "[ . 1 . 2 . 3]" 1
914 1 83 GLY QA 1 84 ASP H 2.500 . 2.900 2.908 2.868 2.936 0.036 8 0 "[ . 1 . 2 . 3]" 1
915 1 84 ASP H 1 84 ASP HA 3.000 . 3.500 2.930 2.916 2.946 . 0 0 "[ . 1 . 2 . 3]" 1
916 1 84 ASP HA 1 85 ALA H 2.500 . 2.900 2.148 2.111 2.170 . 0 0 "[ . 1 . 2 . 3]" 1
917 1 84 ASP HA 1 86 SER H 4.000 . 5.000 3.478 3.325 3.644 . 0 0 "[ . 1 . 2 . 3]" 1
918 1 84 ASP QB 1 85 ALA H 3.000 . 3.500 3.488 3.342 3.556 0.056 29 0 "[ . 1 . 2 . 3]" 1
919 1 84 ASP QB 1 86 SER H 4.000 . 5.000 3.128 3.001 3.285 . 0 0 "[ . 1 . 2 . 3]" 1
920 1 85 ALA H 1 85 ALA HA 3.000 . 3.500 2.949 2.945 2.955 . 0 0 "[ . 1 . 2 . 3]" 1
921 1 85 ALA H 1 85 ALA MB 3.000 . 4.000 2.329 2.232 2.433 . 0 0 "[ . 1 . 2 . 3]" 1
922 1 85 ALA H 1 86 SER H 3.000 . 3.500 2.431 2.117 2.622 . 0 0 "[ . 1 . 2 . 3]" 1
923 1 85 ALA HA 1 86 SER H 3.000 . 3.500 3.107 2.994 3.241 . 0 0 "[ . 1 . 2 . 3]" 1
924 1 85 ALA MB 1 86 SER H 4.000 . 5.500 3.500 3.342 3.613 . 0 0 "[ . 1 . 2 . 3]" 1
925 1 85 ALA MB 1 104 VAL QG 4.000 . 5.000 2.452 1.913 3.359 . 0 0 "[ . 1 . 2 . 3]" 1
926 1 86 SER H 1 86 SER HA 3.000 . 3.500 2.772 2.758 2.796 . 0 0 "[ . 1 . 2 . 3]" 1
927 1 86 SER H 1 86 SER QB 3.000 . 3.500 2.537 2.302 2.763 . 0 0 "[ . 1 . 2 . 3]" 1
928 1 86 SER H 1 87 ILE H 4.000 . 6.000 4.599 4.569 4.626 . 0 0 "[ . 1 . 2 . 3]" 1
929 1 86 SER HA 1 87 ILE H 2.500 . 2.900 2.135 2.080 2.247 . 0 0 "[ . 1 . 2 . 3]" 1
930 1 86 SER QB 1 87 ILE H 3.000 . 3.500 2.780 2.532 3.423 . 0 0 "[ . 1 . 2 . 3]" 1
931 1 87 ILE H 1 87 ILE HA 3.000 . 3.500 2.927 2.917 2.937 . 0 0 "[ . 1 . 2 . 3]" 1
932 1 87 ILE H 1 87 ILE HB 3.000 . 3.500 3.579 3.530 3.628 0.128 17 0 "[ . 1 . 2 . 3]" 1
933 1 87 ILE H 1 87 ILE MG 4.000 . 5.000 3.648 3.573 3.704 . 0 0 "[ . 1 . 2 . 3]" 1
934 1 87 ILE HA 1 88 ASN H 2.500 . 2.900 2.153 2.134 2.190 . 0 0 "[ . 1 . 2 . 3]" 1
935 1 87 ILE MD 1 100 TYR QB 4.000 . 5.000 4.063 3.759 4.301 . 0 0 "[ . 1 . 2 . 3]" 1
936 1 87 ILE MD 1 100 TYR QD 4.000 . 5.000 3.521 3.246 3.707 . 0 0 "[ . 1 . 2 . 3]" 1
937 1 88 ASN H 1 88 ASN HA 3.000 . 3.500 2.933 2.926 2.940 . 0 0 "[ . 1 . 2 . 3]" 1
938 1 88 ASN H 1 88 ASN QB 3.000 . 3.500 2.855 2.403 3.092 . 0 0 "[ . 1 . 2 . 3]" 1
939 1 88 ASN HA 1 89 VAL H 2.500 . 2.900 2.288 2.244 2.358 . 0 0 "[ . 1 . 2 . 3]" 1
940 1 88 ASN QB 1 89 VAL H 2.500 . 2.900 2.831 2.613 3.118 0.218 3 0 "[ . 1 . 2 . 3]" 1
941 1 89 VAL H 1 89 VAL HA 3.000 . 3.500 2.912 2.904 2.933 . 0 0 "[ . 1 . 2 . 3]" 1
942 1 89 VAL H 1 89 VAL HB 2.500 . 2.900 3.084 2.903 3.153 0.253 22 0 "[ . 1 . 2 . 3]" 1
943 1 89 VAL H 1 89 VAL QG 4.000 . 5.500 1.808 1.768 1.953 0.032 6 0 "[ . 1 . 2 . 3]" 1
944 1 89 VAL HA 1 90 THR H 2.500 . 2.900 2.083 1.951 2.107 . 0 0 "[ . 1 . 2 . 3]" 1
945 1 89 VAL HB 1 90 THR H 3.000 . 3.500 3.700 3.638 3.919 0.419 5 0 "[ . 1 . 2 . 3]" 1
946 1 89 VAL QG 1 90 THR H 3.000 . 4.500 2.916 2.431 3.074 . 0 0 "[ . 1 . 2 . 3]" 1
947 1 89 VAL QG 1 92 LEU QD 3.000 . 3.800 2.246 1.827 2.955 . 0 0 "[ . 1 . 2 . 3]" 1
948 1 89 VAL QG 1 117 LEU QD 4.000 . 5.000 2.253 1.815 3.055 . 0 0 "[ . 1 . 2 . 3]" 1
949 1 90 THR H 1 90 THR HA 3.000 . 3.500 2.895 2.882 2.917 . 0 0 "[ . 1 . 2 . 3]" 1
950 1 90 THR H 1 90 THR HB 4.000 . 5.000 3.660 3.635 3.698 . 0 0 "[ . 1 . 2 . 3]" 1
951 1 90 THR H 1 90 THR MG 3.000 . 4.000 2.022 1.917 2.125 . 0 0 "[ . 1 . 2 . 3]" 1
952 1 90 THR H 1 91 ASN H 4.000 . 5.000 4.582 4.555 4.596 . 0 0 "[ . 1 . 2 . 3]" 1
953 1 90 THR HA 1 91 ASN H 2.500 . 2.900 2.222 2.174 2.244 . 0 0 "[ . 1 . 2 . 3]" 1
954 1 90 THR HB 1 91 ASN H 2.500 . 2.900 2.953 2.916 3.001 0.101 7 0 "[ . 1 . 2 . 3]" 1
955 1 90 THR MG 1 91 ASN H 4.000 . 5.500 4.185 4.153 4.234 . 0 0 "[ . 1 . 2 . 3]" 1
956 1 91 ASN H 1 91 ASN HA 2.500 . 2.900 2.289 2.276 2.298 . 0 0 "[ . 1 . 2 . 3]" 1
957 1 91 ASN H 1 91 ASN QB 3.000 . 3.500 3.220 2.819 3.378 . 0 0 "[ . 1 . 2 . 3]" 1
958 1 91 ASN HA 1 92 LEU H 2.500 . 2.900 2.568 2.513 2.633 . 0 0 "[ . 1 . 2 . 3]" 1
959 1 91 ASN QB 1 92 LEU H 4.000 . 5.000 3.916 3.894 4.029 . 0 0 "[ . 1 . 2 . 3]" 1
960 1 92 LEU H 1 92 LEU HA 3.000 . 3.500 2.722 2.697 2.770 . 0 0 "[ . 1 . 2 . 3]" 1
961 1 92 LEU H 1 92 LEU QB 2.500 . 2.900 2.299 2.185 2.407 . 0 0 "[ . 1 . 2 . 3]" 1
962 1 92 LEU HA 1 93 GLN H 2.500 . 2.900 2.333 2.193 2.553 . 0 0 "[ . 1 . 2 . 3]" 1
963 1 92 LEU QB 1 93 GLN H 3.000 . 3.500 3.093 2.087 3.716 0.216 16 0 "[ . 1 . 2 . 3]" 1
964 1 92 LEU QB 1 119 VAL QG 4.000 . 5.000 2.335 1.980 2.944 . 0 0 "[ . 1 . 2 . 3]" 1
965 1 92 LEU QD 1 117 LEU QD 3.000 . 3.800 1.948 1.719 3.113 0.081 24 0 "[ . 1 . 2 . 3]" 1
966 1 92 LEU QD 1 119 VAL QG 3.000 . 3.800 2.482 1.928 3.004 . 0 0 "[ . 1 . 2 . 3]" 1
967 1 93 GLN H 1 93 GLN HA 3.000 . 3.500 2.801 2.764 2.818 . 0 0 "[ . 1 . 2 . 3]" 1
968 1 93 GLN H 1 93 GLN QB 3.000 . 3.500 2.661 2.187 3.408 . 0 0 "[ . 1 . 2 . 3]" 1
969 1 93 GLN H 1 96 ASP H 4.000 . 5.000 4.153 3.620 4.515 . 0 0 "[ . 1 . 2 . 3]" 1
970 1 93 GLN H 1 126 ALA HA 4.000 . 5.000 5.016 4.836 5.184 0.184 11 0 "[ . 1 . 2 . 3]" 1
971 1 93 GLN HA 1 94 LEU H 2.500 . 2.900 2.325 2.215 2.472 . 0 0 "[ . 1 . 2 . 3]" 1
972 1 93 GLN QB 1 94 LEU H 3.000 . 3.500 3.032 2.262 3.564 0.064 10 0 "[ . 1 . 2 . 3]" 1
973 1 93 GLN QG 1 95 SER H 3.000 . 4.050 2.604 1.751 4.141 0.091 7 0 "[ . 1 . 2 . 3]" 1
974 1 94 LEU H 1 94 LEU HA 3.000 . 3.500 2.803 2.781 2.817 . 0 0 "[ . 1 . 2 . 3]" 1
975 1 94 LEU H 1 94 LEU QB 2.500 . 2.900 2.304 2.125 2.408 . 0 0 "[ . 1 . 2 . 3]" 1
976 1 94 LEU H 1 94 LEU QD 4.000 . 5.500 3.392 1.951 3.714 . 0 0 "[ . 1 . 2 . 3]" 1
977 1 94 LEU H 1 95 SER H 3.000 . 3.500 2.692 2.553 2.795 . 0 0 "[ . 1 . 2 . 3]" 1
978 1 94 LEU HA 1 95 SER H 3.000 . 3.500 3.513 3.471 3.534 0.034 1 0 "[ . 1 . 2 . 3]" 1
979 1 94 LEU HA 1 96 ASP H 3.000 . 4.000 3.785 3.548 3.990 . 0 0 "[ . 1 . 2 . 3]" 1
980 1 94 LEU HA 1 97 ILE H 4.000 . 5.000 3.926 3.632 4.150 . 0 0 "[ . 1 . 2 . 3]" 1
981 1 94 LEU HA 1 97 ILE MD 3.000 . 3.800 2.997 2.311 3.188 . 0 0 "[ . 1 . 2 . 3]" 1
982 1 94 LEU HA 1 119 VAL H 4.000 . 5.000 4.990 4.764 5.070 0.070 16 0 "[ . 1 . 2 . 3]" 1
983 1 94 LEU HA 1 119 VAL HB 3.000 . 3.800 2.759 2.454 3.773 . 0 0 "[ . 1 . 2 . 3]" 1
984 1 94 LEU HA 1 119 VAL QG 4.000 . 5.000 2.225 1.835 3.076 . 0 0 "[ . 1 . 2 . 3]" 1
985 1 94 LEU QB 1 95 SER H 3.000 . 3.500 2.656 2.558 2.846 . 0 0 "[ . 1 . 2 . 3]" 1
986 1 94 LEU QB 1 97 ILE MD 4.000 . 5.000 3.903 3.081 4.426 . 0 0 "[ . 1 . 2 . 3]" 1
987 1 94 LEU QD 1 97 ILE MD 4.000 . 5.000 2.453 1.807 3.881 . 0 0 "[ . 1 . 2 . 3]" 1
988 1 94 LEU QD 1 121 VAL QG 3.000 . 3.800 3.390 2.557 3.852 0.052 2 0 "[ . 1 . 2 . 3]" 1
989 1 95 SER H 1 95 SER HA 2.500 . 2.900 2.854 2.837 2.873 . 0 0 "[ . 1 . 2 . 3]" 1
990 1 95 SER H 1 95 SER QB 3.000 . 3.500 2.406 2.108 2.637 . 0 0 "[ . 1 . 2 . 3]" 1
991 1 95 SER HA 1 96 ASP H 3.000 . 3.500 3.385 3.337 3.436 . 0 0 "[ . 1 . 2 . 3]" 1
992 1 95 SER HA 1 97 ILE H 3.000 . 3.500 3.512 3.401 3.608 0.108 29 0 "[ . 1 . 2 . 3]" 1
993 1 95 SER QB 1 96 ASP H 4.000 . 5.000 3.467 3.075 3.834 . 0 0 "[ . 1 . 2 . 3]" 1
994 1 96 ASP H 1 96 ASP HA 3.000 . 3.500 2.857 2.849 2.870 . 0 0 "[ . 1 . 2 . 3]" 1
995 1 96 ASP H 1 96 ASP QB 2.500 . 2.900 2.337 2.150 2.534 . 0 0 "[ . 1 . 2 . 3]" 1
996 1 96 ASP H 1 97 ILE H 2.500 . 2.900 2.458 2.405 2.506 . 0 0 "[ . 1 . 2 . 3]" 1
997 1 96 ASP HA 1 97 ILE H 3.000 . 3.500 3.418 3.392 3.453 . 0 0 "[ . 1 . 2 . 3]" 1
998 1 96 ASP QB 1 97 ILE H 4.000 . 5.000 3.097 2.933 3.746 . 0 0 "[ . 1 . 2 . 3]" 1
999 1 96 ASP QB 1 119 VAL QG 4.000 . 5.000 2.865 2.257 3.793 . 0 0 "[ . 1 . 2 . 3]" 1
1000 1 97 ILE H 1 97 ILE HA 3.000 . 3.500 2.726 2.708 2.759 . 0 0 "[ . 1 . 2 . 3]" 1
1001 1 97 ILE H 1 97 ILE HB 2.500 . 2.900 2.117 2.071 2.307 . 0 0 "[ . 1 . 2 . 3]" 1
1002 1 97 ILE H 1 97 ILE QG 3.000 . 3.500 3.152 2.321 3.574 0.074 29 0 "[ . 1 . 2 . 3]" 1
1003 1 97 ILE H 1 97 ILE MG 3.000 . 3.500 3.474 3.111 3.687 0.187 26 0 "[ . 1 . 2 . 3]" 1
1004 1 97 ILE H 1 119 VAL HB 4.000 . 5.000 4.446 4.084 4.789 . 0 0 "[ . 1 . 2 . 3]" 1
1005 1 97 ILE HA 1 98 GLY H 2.500 . 2.900 2.256 2.211 2.289 . 0 0 "[ . 1 . 2 . 3]" 1
1006 1 97 ILE HA 1 117 LEU QB 3.000 . 3.800 3.247 3.023 3.402 . 0 0 "[ . 1 . 2 . 3]" 1
1007 1 97 ILE HA 1 119 VAL H 4.000 . 5.000 3.855 3.557 4.069 . 0 0 "[ . 1 . 2 . 3]" 1
1008 1 97 ILE HB 1 98 GLY H 4.000 . 5.000 4.339 4.243 4.430 . 0 0 "[ . 1 . 2 . 3]" 1
1009 1 97 ILE QG 1 119 VAL H 3.000 . 4.000 1.986 1.786 2.553 0.014 17 0 "[ . 1 . 2 . 3]" 1
1010 1 97 ILE QG 1 119 VAL QG 3.000 . 3.800 2.136 1.800 3.233 . 16 0 "[ . 1 . 2 . 3]" 1
1011 1 97 ILE MG 1 98 GLY H 3.000 . 4.000 2.646 2.274 3.168 . 0 0 "[ . 1 . 2 . 3]" 1
1012 1 97 ILE MG 1 119 VAL H 4.000 . 5.500 4.342 3.478 5.124 . 0 0 "[ . 1 . 2 . 3]" 1
1013 1 98 GLY H 1 99 THR H 4.000 . 5.000 4.216 4.077 4.307 . 0 0 "[ . 1 . 2 . 3]" 1
1014 1 98 GLY H 1 100 TYR QD 4.000 . 5.000 4.451 4.230 4.680 . 0 0 "[ . 1 . 2 . 3]" 1
1015 1 98 GLY H 1 116 HIS HA 4.000 . 5.000 5.013 4.890 5.063 0.063 15 0 "[ . 1 . 2 . 3]" 1
1016 1 98 GLY H 1 117 LEU H 3.000 . 3.500 3.496 2.975 3.538 0.038 4 0 "[ . 1 . 2 . 3]" 1
1017 1 98 GLY H 1 117 LEU QB 4.000 . 5.000 3.078 2.827 3.356 . 0 0 "[ . 1 . 2 . 3]" 1
1018 1 98 GLY QA 1 100 TYR H 4.000 . 6.000 5.384 5.291 5.471 . 0 0 "[ . 1 . 2 . 3]" 1
1019 1 99 THR H 1 99 THR HB 3.000 . 3.500 2.477 2.409 2.534 . 0 0 "[ . 1 . 2 . 3]" 1
1020 1 99 THR HA 1 100 TYR H . . 2.900 2.163 2.135 2.201 . 0 0 "[ . 1 . 2 . 3]" 1
1021 1 99 THR HA 1 100 TYR QD 4.000 . 6.000 3.349 3.139 3.504 . 0 0 "[ . 1 . 2 . 3]" 1
1022 1 99 THR HA 1 116 HIS HA 3.000 . 3.300 2.211 1.934 2.425 . 0 0 "[ . 1 . 2 . 3]" 1
1023 1 99 THR HA 1 117 LEU H 3.000 . 3.500 3.291 3.088 3.459 . 0 0 "[ . 1 . 2 . 3]" 1
1024 1 99 THR MG 1 100 TYR H 3.000 . 4.000 2.371 2.144 2.691 . 0 0 "[ . 1 . 2 . 3]" 1
1025 1 99 THR MG 1 114 LYS QD 3.000 . 3.800 3.457 2.361 3.830 0.030 22 0 "[ . 1 . 2 . 3]" 1
1026 1 99 THR MG 1 115 ILE H 4.000 . 5.500 3.400 3.157 3.578 . 0 0 "[ . 1 . 2 . 3]" 1
1027 1 99 THR MG 1 116 HIS HE1 4.000 . 5.000 4.020 3.639 4.190 . 0 0 "[ . 1 . 2 . 3]" 1
1028 1 100 TYR H 1 100 TYR HA 3.000 . 3.500 2.945 2.940 2.953 . 0 0 "[ . 1 . 2 . 3]" 1
1029 1 100 TYR H 1 100 TYR QD 3.000 . 3.300 2.760 2.667 2.839 . 0 0 "[ . 1 . 2 . 3]" 1
1030 1 100 TYR H 1 100 TYR QE 4.000 . 5.000 5.020 4.930 5.063 0.063 7 0 "[ . 1 . 2 . 3]" 1
1031 1 100 TYR H 1 115 ILE H 3.000 . 3.500 3.114 2.820 3.351 . 0 0 "[ . 1 . 2 . 3]" 1
1032 1 100 TYR HA 1 100 TYR QD 4.000 . 5.000 3.115 3.066 3.163 . 0 0 "[ . 1 . 2 . 3]" 1
1033 1 100 TYR HA 1 101 GLN H 2.500 . 2.900 2.197 2.157 2.229 . 0 0 "[ . 1 . 2 . 3]" 1
1034 1 100 TYR QB 1 101 GLN H 3.000 . 3.500 3.117 2.923 3.322 . 0 0 "[ . 1 . 2 . 3]" 1
1035 1 100 TYR QB 1 115 ILE H 3.000 . 3.500 3.446 3.197 3.579 0.079 15 0 "[ . 1 . 2 . 3]" 1
1036 1 100 TYR QB 1 115 ILE HB 3.000 . 3.300 2.223 1.983 2.545 . 0 0 "[ . 1 . 2 . 3]" 1
1037 1 100 TYR QD 1 117 LEU H 3.000 . 3.500 2.359 2.206 3.219 . 0 0 "[ . 1 . 2 . 3]" 1
1038 1 100 TYR QD 1 117 LEU QB 3.000 . 3.300 2.563 2.279 2.642 . 0 0 "[ . 1 . 2 . 3]" 1
1039 1 100 TYR QE 1 117 LEU H 4.000 . 5.000 3.352 3.033 3.743 . 0 0 "[ . 1 . 2 . 3]" 1
1040 1 100 TYR QE 1 117 LEU QD 4.000 . 5.000 2.542 1.985 3.557 . 0 0 "[ . 1 . 2 . 3]" 1
1041 1 101 GLN H 1 101 GLN HA 3.000 . 3.500 2.949 2.944 2.955 . 0 0 "[ . 1 . 2 . 3]" 1
1042 1 101 GLN H 1 101 GLN HB3 3.000 . 3.500 2.714 2.549 3.541 0.041 19 0 "[ . 1 . 2 . 3]" 1
1043 1 101 GLN HA 1 114 LYS HA 2.500 . 2.700 2.691 2.570 2.782 0.082 17 0 "[ . 1 . 2 . 3]" 1
1044 1 101 GLN HA 1 115 ILE H 3.000 . 3.500 3.309 3.067 3.500 0.000 29 0 "[ . 1 . 2 . 3]" 1
1045 1 101 GLN QG 1 103 LYS QG 3.000 . 3.800 2.354 2.014 3.855 0.055 19 0 "[ . 1 . 2 . 3]" 1
1046 1 101 GLN QG 1 113 LYS H 4.000 . 5.000 3.391 2.936 4.456 . 0 0 "[ . 1 . 2 . 3]" 1
1047 1 102 CYS H 1 103 LYS H 4.000 . 5.000 4.350 4.220 4.425 . 0 0 "[ . 1 . 2 . 3]" 1
1048 1 102 CYS H 1 113 LYS H 3.000 . 3.500 3.037 2.798 3.451 . 0 0 "[ . 1 . 2 . 3]" 1
1049 1 102 CYS H 1 114 LYS HA 3.000 . 4.000 3.778 3.344 4.026 0.026 12 0 "[ . 1 . 2 . 3]" 1
1050 1 102 CYS HA 1 103 LYS H 2.500 . 2.900 2.155 2.106 2.187 . 0 0 "[ . 1 . 2 . 3]" 1
1051 1 103 LYS H 1 103 LYS HA 3.000 . 3.500 2.946 2.942 2.953 . 0 0 "[ . 1 . 2 . 3]" 1
1052 1 103 LYS H 1 103 LYS QB 3.000 . 3.500 2.486 2.412 2.623 . 0 0 "[ . 1 . 2 . 3]" 1
1053 1 103 LYS H 1 103 LYS QG 3.000 . 3.500 2.894 2.428 3.053 . 0 0 "[ . 1 . 2 . 3]" 1
1054 1 103 LYS H 1 104 VAL H 4.000 . 5.000 4.164 4.109 4.265 . 0 0 "[ . 1 . 2 . 3]" 1
1055 1 103 LYS HA 1 104 VAL H 2.500 . 2.900 2.192 2.167 2.209 . 0 0 "[ . 1 . 2 . 3]" 1
1056 1 103 LYS HA 1 112 ASN HA 3.000 . 3.300 2.100 1.881 2.518 . 0 0 "[ . 1 . 2 . 3]" 1
1057 1 103 LYS QB 1 104 VAL H 4.000 . 5.000 3.548 3.470 3.599 . 0 0 "[ . 1 . 2 . 3]" 1
1058 1 104 VAL H 1 104 VAL HA 3.000 . 3.500 2.919 2.908 2.930 . 0 0 "[ . 1 . 2 . 3]" 1
1059 1 104 VAL H 1 104 VAL HB 2.500 . 2.900 2.614 2.505 2.847 . 0 0 "[ . 1 . 2 . 3]" 1
1060 1 104 VAL H 1 104 VAL QG 3.000 . 4.500 2.339 1.813 2.564 . 0 0 "[ . 1 . 2 . 3]" 1
1061 1 104 VAL H 1 111 ALA H 3.000 . 3.500 3.409 3.133 3.537 0.037 11 0 "[ . 1 . 2 . 3]" 1
1062 1 104 VAL H 1 112 ASN HA 3.000 . 3.500 3.278 2.996 3.490 . 0 0 "[ . 1 . 2 . 3]" 1
1063 1 104 VAL HA 1 105 LYS H 2.500 . 2.900 2.179 2.132 2.218 . 0 0 "[ . 1 . 2 . 3]" 1
1064 1 104 VAL QG 1 105 LYS H 4.000 . 5.500 2.892 2.733 3.052 . 0 0 "[ . 1 . 2 . 3]" 1
1065 1 105 LYS H 1 105 LYS HA 3.000 . 3.500 2.941 2.921 2.966 . 0 0 "[ . 1 . 2 . 3]" 1
1066 1 105 LYS H 1 105 LYS QB 3.000 . 3.500 2.343 2.268 2.399 . 0 0 "[ . 1 . 2 . 3]" 1
1067 1 105 LYS H 1 106 LYS H 4.000 . 5.000 4.446 4.353 4.519 . 0 0 "[ . 1 . 2 . 3]" 1
1068 1 105 LYS HA 1 106 LYS H 2.500 . 2.900 2.152 2.088 2.193 . 0 0 "[ . 1 . 2 . 3]" 1
1069 1 105 LYS HA 1 110 VAL H 4.000 . 5.000 4.922 4.707 5.022 0.022 10 0 "[ . 1 . 2 . 3]" 1
1070 1 105 LYS HA 1 110 VAL HA 2.500 . 2.700 2.203 1.975 2.391 . 0 0 "[ . 1 . 2 . 3]" 1
1071 1 105 LYS HA 1 111 ALA H 4.000 . 5.000 3.061 2.693 3.475 . 0 0 "[ . 1 . 2 . 3]" 1
1072 1 105 LYS QG 1 106 LYS H 3.000 . 3.500 3.097 2.880 3.650 0.150 18 0 "[ . 1 . 2 . 3]" 1
1073 1 105 LYS QG 1 110 VAL QG 3.000 . 3.800 1.952 1.790 3.079 0.010 1 0 "[ . 1 . 2 . 3]" 1
1074 1 106 LYS H 1 106 LYS HA 3.000 . 3.500 2.921 2.908 2.938 . 0 0 "[ . 1 . 2 . 3]" 1
1075 1 106 LYS H 1 106 LYS QB 3.000 . 3.500 2.767 2.611 3.269 . 0 0 "[ . 1 . 2 . 3]" 1
1076 1 106 LYS H 1 106 LYS QG 4.000 . 5.000 3.823 2.333 4.254 . 0 0 "[ . 1 . 2 . 3]" 1
1077 1 106 LYS H 1 107 ALA H 4.000 . 5.000 3.787 3.753 3.843 . 0 0 "[ . 1 . 2 . 3]" 1
1078 1 106 LYS H 1 109 GLY HA2 4.000 . 5.000 5.028 4.972 5.056 0.056 10 0 "[ . 1 . 2 . 3]" 1
1079 1 106 LYS H 1 109 GLY HA3 4.000 . 5.000 4.713 4.602 4.786 . 0 0 "[ . 1 . 2 . 3]" 1
1080 1 106 LYS H 1 110 VAL H 4.000 . 5.000 4.340 4.101 4.514 . 0 0 "[ . 1 . 2 . 3]" 1
1081 1 106 LYS H 1 110 VAL HA 4.000 . 5.000 2.462 2.076 2.812 . 0 0 "[ . 1 . 2 . 3]" 1
1082 1 106 LYS HA 1 107 ALA H 2.500 . 2.900 2.168 2.126 2.214 . 0 0 "[ . 1 . 2 . 3]" 1
1083 1 106 LYS QB 1 107 ALA H 4.000 . 5.000 3.843 3.565 3.971 . 0 0 "[ . 1 . 2 . 3]" 1
1084 1 106 LYS QG 1 107 ALA H 4.000 . 5.000 3.727 3.328 4.461 . 0 0 "[ . 1 . 2 . 3]" 1
1085 1 107 ALA H 1 107 ALA HA 3.000 . 3.500 2.740 2.711 2.763 . 0 0 "[ . 1 . 2 . 3]" 1
1086 1 107 ALA H 1 107 ALA MB 2.500 . 3.400 2.077 2.037 2.162 . 0 0 "[ . 1 . 2 . 3]" 1
1087 1 107 ALA HA 1 108 PRO HA 2.500 . 2.700 1.805 1.774 1.853 0.026 30 0 "[ . 1 . 2 . 3]" 1
1088 1 107 ALA HA 1 109 GLY H 2.500 . 2.900 2.372 2.191 2.642 . 0 0 "[ . 1 . 2 . 3]" 1
1089 1 107 ALA MB 1 108 PRO HA 3.000 . 3.300 2.625 2.523 2.753 . 0 0 "[ . 1 . 2 . 3]" 1
1090 1 108 PRO HA 1 109 GLY H 4.000 . 5.000 2.863 2.800 2.980 . 0 0 "[ . 1 . 2 . 3]" 1
1091 1 108 PRO QD 1 109 GLY H 3.000 . 3.500 3.283 3.015 3.408 . 0 0 "[ . 1 . 2 . 3]" 1
1092 1 109 GLY H 1 109 GLY QA 2.500 . 2.900 2.417 2.369 2.436 . 0 0 "[ . 1 . 2 . 3]" 1
1093 1 109 GLY H 1 110 VAL H 3.000 . 3.500 3.801 3.774 3.864 0.364 13 0 "[ . 1 . 2 . 3]" 1
1094 1 109 GLY QA 1 110 VAL H 2.500 . 2.900 2.057 2.023 2.074 . 0 0 "[ . 1 . 2 . 3]" 1
1095 1 110 VAL H 1 110 VAL HA 3.000 . 3.500 2.907 2.879 2.921 . 0 0 "[ . 1 . 2 . 3]" 1
1096 1 110 VAL H 1 110 VAL HB 3.000 . 3.500 3.336 2.782 3.612 0.112 18 0 "[ . 1 . 2 . 3]" 1
1097 1 110 VAL H 1 110 VAL QG 3.000 . 4.000 1.957 1.873 2.228 . 0 0 "[ . 1 . 2 . 3]" 1
1098 1 110 VAL HA 1 111 ALA H 2.500 . 2.900 2.273 2.159 2.378 . 0 0 "[ . 1 . 2 . 3]" 1
1099 1 110 VAL HB 1 111 ALA H 3.000 . 3.500 3.301 2.634 3.640 0.140 30 0 "[ . 1 . 2 . 3]" 1
1100 1 110 VAL QG 1 111 ALA H 4.000 . 5.500 2.927 1.855 3.588 . 0 0 "[ . 1 . 2 . 3]" 1
1101 1 111 ALA H 1 111 ALA HA 3.000 . 3.500 2.935 2.922 2.952 . 0 0 "[ . 1 . 2 . 3]" 1
1102 1 111 ALA H 1 112 ASN H 4.000 . 5.000 4.438 4.317 4.594 . 0 0 "[ . 1 . 2 . 3]" 1
1103 1 111 ALA HA 1 112 ASN H 2.500 . 2.900 2.260 2.207 2.309 . 0 0 "[ . 1 . 2 . 3]" 1
1104 1 111 ALA MB 1 112 ASN H 3.000 . 4.000 2.826 2.654 3.054 . 0 0 "[ . 1 . 2 . 3]" 1
1105 1 112 ASN H 1 112 ASN HA 3.000 . 3.500 2.916 2.906 2.932 . 0 0 "[ . 1 . 2 . 3]" 1
1106 1 112 ASN H 1 112 ASN QB 3.000 . 3.500 3.026 2.609 3.173 . 0 0 "[ . 1 . 2 . 3]" 1
1107 1 112 ASN H 1 113 LYS H 4.000 . 5.000 4.352 4.235 4.441 . 0 0 "[ . 1 . 2 . 3]" 1
1108 1 113 LYS H 1 113 LYS HA 3.000 . 3.500 2.914 2.906 2.932 . 0 0 "[ . 1 . 2 . 3]" 1
1109 1 113 LYS H 1 113 LYS QB 3.000 . 3.500 3.176 2.607 3.289 . 0 0 "[ . 1 . 2 . 3]" 1
1110 1 113 LYS H 1 113 LYS QD 3.000 . 3.500 3.459 2.660 3.666 0.166 30 0 "[ . 1 . 2 . 3]" 1
1111 1 114 LYS H 1 114 LYS HA 3.000 . 3.500 2.935 2.920 2.950 . 0 0 "[ . 1 . 2 . 3]" 1
1112 1 114 LYS H 1 114 LYS QB 3.000 . 3.500 2.377 2.203 2.519 . 0 0 "[ . 1 . 2 . 3]" 1
1113 1 114 LYS HA 1 114 LYS QG 3.000 . 3.500 2.401 2.175 2.916 . 0 0 "[ . 1 . 2 . 3]" 1
1114 1 114 LYS HA 1 115 ILE H 2.500 . 2.900 2.163 2.143 2.202 . 0 0 "[ . 1 . 2 . 3]" 1
1115 1 114 LYS QB 1 115 ILE H 3.000 . 3.500 2.958 2.680 3.479 . 0 0 "[ . 1 . 2 . 3]" 1
1116 1 115 ILE H 1 115 ILE HA 3.000 . 3.500 2.910 2.900 2.918 . 0 0 "[ . 1 . 2 . 3]" 1
1117 1 115 ILE H 1 115 ILE HB 3.000 . 3.500 2.837 2.739 2.893 . 0 0 "[ . 1 . 2 . 3]" 1
1118 1 115 ILE HA 1 116 HIS H 2.500 . 2.900 2.199 2.176 2.224 . 0 0 "[ . 1 . 2 . 3]" 1
1119 1 115 ILE MG 1 116 HIS H 3.000 . 4.000 2.878 2.521 3.048 . 0 0 "[ . 1 . 2 . 3]" 1
1120 1 115 ILE MG 1 117 LEU H 4.000 . 5.000 4.020 3.816 4.971 . 0 0 "[ . 1 . 2 . 3]" 1
1121 1 115 ILE MG 1 117 LEU QD 4.000 . 5.000 3.626 2.764 4.132 . 0 0 "[ . 1 . 2 . 3]" 1
1122 1 116 HIS H 1 116 HIS HA 3.000 . 3.500 2.936 2.924 2.946 . 0 0 "[ . 1 . 2 . 3]" 1
1123 1 116 HIS H 1 116 HIS QB 2.500 . 2.900 2.436 2.271 2.947 0.047 15 0 "[ . 1 . 2 . 3]" 1
1124 1 116 HIS H 1 116 HIS HD2 3.000 . 3.500 3.424 2.912 3.543 0.043 20 0 "[ . 1 . 2 . 3]" 1
1125 1 116 HIS H 1 117 LEU H 4.000 . 5.000 4.377 4.287 4.494 . 0 0 "[ . 1 . 2 . 3]" 1
1126 1 116 HIS HA 1 117 LEU H 2.500 . 2.900 2.149 2.116 2.511 . 0 0 "[ . 1 . 2 . 3]" 1
1127 1 116 HIS QB 1 117 LEU H 3.000 . 3.500 3.348 2.313 3.496 . 0 0 "[ . 1 . 2 . 3]" 1
1128 1 116 HIS HD2 1 117 LEU H 4.000 . 5.000 4.534 4.338 5.197 0.197 15 0 "[ . 1 . 2 . 3]" 1
1129 1 117 LEU H 1 117 LEU HA 3.000 . 3.500 2.907 2.897 2.924 . 0 0 "[ . 1 . 2 . 3]" 1
1130 1 117 LEU H 1 117 LEU QB 3.000 . 3.500 2.295 2.199 2.644 . 0 0 "[ . 1 . 2 . 3]" 1
1131 1 117 LEU HA 1 118 VAL H 2.500 . 2.900 2.116 2.093 2.144 . 0 0 "[ . 1 . 2 . 3]" 1
1132 1 117 LEU QD 1 118 VAL H 4.000 . 5.000 2.457 1.933 3.052 . 0 0 "[ . 1 . 2 . 3]" 1
1133 1 117 LEU QD 1 119 VAL QG 4.000 . 5.000 2.734 1.808 3.897 . 0 0 "[ . 1 . 2 . 3]" 1
1134 1 118 VAL H 1 118 VAL HA 3.000 . 3.500 2.948 2.941 2.950 . 0 0 "[ . 1 . 2 . 3]" 1
1135 1 118 VAL H 1 118 VAL HB 3.000 . 3.500 2.679 2.606 2.752 . 0 0 "[ . 1 . 2 . 3]" 1
1136 1 118 VAL HA 1 119 VAL H 2.500 . 2.900 2.175 2.151 2.199 . 0 0 "[ . 1 . 2 . 3]" 1
1137 1 118 VAL HB 1 119 VAL H 4.000 . 5.000 4.188 4.105 4.279 . 0 0 "[ . 1 . 2 . 3]" 1
1138 1 118 VAL QG 1 119 VAL H 3.000 . 4.000 2.596 2.323 2.847 . 0 0 "[ . 1 . 2 . 3]" 1
1139 1 119 VAL H 1 119 VAL HA 3.000 . 3.500 2.921 2.907 2.943 . 0 0 "[ . 1 . 2 . 3]" 1
1140 1 119 VAL H 1 119 VAL HB 4.000 . 5.000 2.631 2.550 2.792 . 0 0 "[ . 1 . 2 . 3]" 1
1141 1 119 VAL H 1 119 VAL QG 3.000 . 4.000 2.314 2.043 2.623 . 0 0 "[ . 1 . 2 . 3]" 1
1142 1 119 VAL H 1 120 LEU H 4.000 . 5.000 4.438 4.375 4.524 . 0 0 "[ . 1 . 2 . 3]" 1
1143 1 119 VAL HA 1 120 LEU H 2.500 . 2.900 2.132 2.107 2.166 . 0 0 "[ . 1 . 2 . 3]" 1
1144 1 119 VAL HB 1 120 LEU H 4.000 . 5.000 4.156 4.007 4.218 . 0 0 "[ . 1 . 2 . 3]" 1
1145 1 119 VAL QG 1 120 LEU H 4.000 . 5.500 2.532 2.200 2.768 . 0 0 "[ . 1 . 2 . 3]" 1
1146 1 120 LEU H 1 120 LEU HA 3.000 . 3.500 2.901 2.888 2.913 . 0 0 "[ . 1 . 2 . 3]" 1
1147 1 120 LEU H 1 120 LEU QB 3.000 . 3.500 2.423 2.340 2.491 . 0 0 "[ . 1 . 2 . 3]" 1
1148 1 120 LEU H 1 120 LEU HG 2.500 . 2.900 2.514 2.407 2.687 . 0 0 "[ . 1 . 2 . 3]" 1
1149 1 120 LEU H 1 121 VAL H 4.000 . 5.000 4.606 4.579 4.629 . 0 0 "[ . 1 . 2 . 3]" 1
1150 1 120 LEU HA 1 121 VAL H 2.500 . 2.900 2.425 2.283 2.567 . 0 0 "[ . 1 . 2 . 3]" 1
1151 1 121 VAL H 1 121 VAL HA 3.000 . 3.500 2.861 2.821 2.878 . 0 0 "[ . 1 . 2 . 3]" 1
1152 1 121 VAL H 1 121 VAL HB 2.500 . 2.900 2.930 2.729 2.956 0.056 14 0 "[ . 1 . 2 . 3]" 1
1153 1 121 VAL H 1 121 VAL QG 3.000 . 4.500 1.917 1.884 1.978 . 0 0 "[ . 1 . 2 . 3]" 1
1154 1 121 VAL H 1 122 LYS H 4.000 . 5.000 4.535 4.479 4.569 . 0 0 "[ . 1 . 2 . 3]" 1
1155 1 121 VAL HA 1 122 LYS H 2.500 . 2.900 2.115 2.034 2.179 . 0 0 "[ . 1 . 2 . 3]" 1
1156 1 121 VAL HB 1 122 LYS H 3.000 . 3.500 3.639 3.582 3.728 0.228 4 0 "[ . 1 . 2 . 3]" 1
1157 1 121 VAL QG 1 122 LYS H 4.000 . 5.500 2.298 1.934 2.530 . 0 0 "[ . 1 . 2 . 3]" 1
1158 1 122 LYS H 1 122 LYS HA 3.000 . 3.500 2.858 2.838 2.881 . 0 0 "[ . 1 . 2 . 3]" 1
1159 1 122 LYS H 1 122 LYS QB 3.000 . 3.500 2.949 2.759 3.311 . 0 0 "[ . 1 . 2 . 3]" 1
1160 1 124 SER HA 1 125 GLY H 3.000 . 3.500 3.520 2.871 3.568 0.068 2 0 "[ . 1 . 2 . 3]" 1
1161 1 125 GLY H 1 125 GLY QA 2.500 . 2.900 2.236 2.181 2.459 . 0 0 "[ . 1 . 2 . 3]" 1
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