NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
621464 |
5o2p   |
34142 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5o2p
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 1985
_Distance_constraint_stats_list.Viol_count 4240
_Distance_constraint_stats_list.Viol_total 8418.234
_Distance_constraint_stats_list.Viol_max 0.500
_Distance_constraint_stats_list.Viol_rms 0.0191
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0027
_Distance_constraint_stats_list.Viol_average_violations_only 0.0496
_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 4 LYS 0.032 0.032 31 0 "[ . 1 . 2 . 3 . 4]"
1 5 TYR 7.638 0.347 40 0 "[ . 1 . 2 . 3 . 4]"
1 6 LEU 2.275 0.108 38 0 "[ . 1 . 2 . 3 . 4]"
1 7 ASN 0.007 0.006 20 0 "[ . 1 . 2 . 3 . 4]"
1 8 VAL 13.081 0.347 40 0 "[ . 1 . 2 . 3 . 4]"
1 9 LEU 9.335 0.360 40 0 "[ . 1 . 2 . 3 . 4]"
1 10 ALA 2.980 0.204 2 0 "[ . 1 . 2 . 3 . 4]"
1 11 LYS 22.299 0.464 38 0 "[ . 1 . 2 . 3 . 4]"
1 12 ALA 9.070 0.271 12 0 "[ . 1 . 2 . 3 . 4]"
1 13 LEU 13.862 0.400 19 0 "[ . 1 . 2 . 3 . 4]"
1 14 TYR 1.394 0.145 26 0 "[ . 1 . 2 . 3 . 4]"
1 15 ASP 1.077 0.441 35 0 "[ . 1 . 2 . 3 . 4]"
1 16 ASN 2.106 0.352 40 0 "[ . 1 . 2 . 3 . 4]"
1 17 VAL 3.133 0.441 35 0 "[ . 1 . 2 . 3 . 4]"
1 18 ALA 1.972 0.101 39 0 "[ . 1 . 2 . 3 . 4]"
1 19 GLU 1.057 0.253 36 0 "[ . 1 . 2 . 3 . 4]"
1 20 SER 2.012 0.075 40 0 "[ . 1 . 2 . 3 . 4]"
1 21 PRO 1.158 0.075 40 0 "[ . 1 . 2 . 3 . 4]"
1 22 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 23 GLU 0.323 0.037 40 0 "[ . 1 . 2 . 3 . 4]"
1 24 LEU 16.600 0.372 39 0 "[ . 1 . 2 . 3 . 4]"
1 25 SER 2.180 0.204 39 0 "[ . 1 . 2 . 3 . 4]"
1 26 PHE 1.849 0.197 24 0 "[ . 1 . 2 . 3 . 4]"
1 27 ARG 1.997 0.352 40 0 "[ . 1 . 2 . 3 . 4]"
1 28 LYS 4.546 0.195 38 0 "[ . 1 . 2 . 3 . 4]"
1 29 GLY 3.251 0.195 38 0 "[ . 1 . 2 . 3 . 4]"
1 30 ASP 3.570 0.180 40 0 "[ . 1 . 2 . 3 . 4]"
1 31 ILE 9.112 0.171 22 0 "[ . 1 . 2 . 3 . 4]"
1 32 MET 8.592 0.458 40 0 "[ . 1 . 2 . 3 . 4]"
1 33 THR 3.121 0.158 40 0 "[ . 1 . 2 . 3 . 4]"
1 34 VAL 4.373 0.360 40 0 "[ . 1 . 2 . 3 . 4]"
1 35 LEU 21.828 0.500 13 0 "[ . 1 . 2 . 3 . 4]"
1 36 GLU 3.613 0.228 38 0 "[ . 1 . 2 . 3 . 4]"
1 37 ARG 1.913 0.160 40 0 "[ . 1 . 2 . 3 . 4]"
1 38 ASP 0.625 0.065 19 0 "[ . 1 . 2 . 3 . 4]"
1 39 THR 4.969 0.130 13 0 "[ . 1 . 2 . 3 . 4]"
1 40 GLN 1.721 0.119 33 0 "[ . 1 . 2 . 3 . 4]"
1 41 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 42 LEU 15.635 0.495 16 0 "[ . 1 . 2 . 3 . 4]"
1 43 ASP 1.467 0.140 39 0 "[ . 1 . 2 . 3 . 4]"
1 44 GLY 0.142 0.060 36 0 "[ . 1 . 2 . 3 . 4]"
1 45 TRP 7.711 0.181 40 0 "[ . 1 . 2 . 3 . 4]"
1 46 TRP 6.014 0.310 38 0 "[ . 1 . 2 . 3 . 4]"
1 47 LEU 27.281 0.500 13 0 "[ . 1 . 2 . 3 . 4]"
1 48 CYS 0.547 0.054 6 0 "[ . 1 . 2 . 3 . 4]"
1 49 SER 2.226 0.274 39 0 "[ . 1 . 2 . 3 . 4]"
1 50 LEU 4.506 0.158 40 0 "[ . 1 . 2 . 3 . 4]"
1 51 HIS 1.013 0.141 19 0 "[ . 1 . 2 . 3 . 4]"
1 52 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 53 ARG 3.732 0.162 36 0 "[ . 1 . 2 . 3 . 4]"
1 54 GLN 3.196 0.374 19 0 "[ . 1 . 2 . 3 . 4]"
1 55 GLY 8.666 0.400 40 0 "[ . 1 . 2 . 3 . 4]"
1 56 ILE 30.417 0.400 40 0 "[ . 1 . 2 . 3 . 4]"
1 57 VAL 14.712 0.372 39 0 "[ . 1 . 2 . 3 . 4]"
1 58 PRO 2.355 0.123 38 0 "[ . 1 . 2 . 3 . 4]"
1 59 GLY 0.033 0.013 26 0 "[ . 1 . 2 . 3 . 4]"
1 60 ASN 1.201 0.123 39 0 "[ . 1 . 2 . 3 . 4]"
1 61 ARG 0.653 0.125 38 0 "[ . 1 . 2 . 3 . 4]"
1 62 LEU 22.905 0.464 6 0 "[ . 1 . 2 . 3 . 4]"
1 63 LYS 20.859 0.464 38 0 "[ . 1 . 2 . 3 . 4]"
1 64 ILE 10.159 0.310 38 0 "[ . 1 . 2 . 3 . 4]"
1 65 LEU 7.417 0.382 39 0 "[ . 1 . 2 . 3 . 4]"
1 66 VAL 2.924 0.270 37 0 "[ . 1 . 2 . 3 . 4]"
1 67 GLY 0.745 0.222 23 0 "[ . 1 . 2 . 3 . 4]"
1 68 MET 0.437 0.128 38 0 "[ . 1 . 2 . 3 . 4]"
1 69 TYR 0.534 0.128 38 0 "[ . 1 . 2 . 3 . 4]"
1 71 LYS 0.038 0.038 3 0 "[ . 1 . 2 . 3 . 4]"
1 72 LYS 0.719 0.265 28 0 "[ . 1 . 2 . 3 . 4]"
1 73 PRO 0.705 0.265 28 0 "[ . 1 . 2 . 3 . 4]"
1 74 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 75 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 84 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 85 LYS 0.522 0.116 1 0 "[ . 1 . 2 . 3 . 4]"
1 86 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 87 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 88 SER 0.128 0.043 6 0 "[ . 1 . 2 . 3 . 4]"
1 89 PRO 0.683 0.145 26 0 "[ . 1 . 2 . 3 . 4]"
1 90 PRO 0.616 0.107 40 0 "[ . 1 . 2 . 3 . 4]"
1 91 PRO 0.441 0.107 40 0 "[ . 1 . 2 . 3 . 4]"
1 92 LYS 0.610 0.123 38 0 "[ . 1 . 2 . 3 . 4]"
1 93 PRO 0.687 0.079 17 0 "[ . 1 . 2 . 3 . 4]"
1 94 PRO 0.501 0.143 11 0 "[ . 1 . 2 . 3 . 4]"
1 95 ARG 2.084 0.402 39 0 "[ . 1 . 2 . 3 . 4]"
1 96 THR 4.889 0.309 6 0 "[ . 1 . 2 . 3 . 4]"
1 97 ARG 3.042 0.495 16 0 "[ . 1 . 2 . 3 . 4]"
1 99 CYS 0.067 0.024 14 0 "[ . 1 . 2 . 3 . 4]"
1 100 LEU 0.067 0.024 14 0 "[ . 1 . 2 . 3 . 4]"
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 4 LYS HA 1 4 LYS QD 4.340 . 4.340 3.188 2.033 4.301 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2 1 4 LYS HA 1 5 TYR H 3.340 . 3.340 2.377 2.097 3.187 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
3 1 4 LYS QD 1 5 TYR H 5.400 . 5.400 4.401 2.033 5.432 0.032 31 0 "[ . 1 . 2 . 3 . 4]" 1
4 1 4 LYS QE 1 4 LYS HG2 3.900 . 3.900 2.629 2.199 3.577 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
5 1 4 LYS QE 1 4 LYS HG3 3.900 . 3.900 2.633 2.320 3.354 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
6 1 5 TYR H 1 5 TYR HB2 3.620 . 3.620 2.673 2.256 3.600 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
7 1 5 TYR H 1 5 TYR HB3 3.960 . 3.960 3.737 3.548 4.077 0.117 37 0 "[ . 1 . 2 . 3 . 4]" 1
8 1 5 TYR H 1 5 TYR QD 4.090 . 4.090 3.584 3.147 3.966 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
9 1 5 TYR HA 1 5 TYR QD 2.980 . 2.980 2.103 1.951 2.278 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
10 1 5 TYR HA 1 5 TYR QE 4.770 . 4.770 4.334 4.273 4.401 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
11 1 5 TYR HA 1 6 LEU H 3.070 . 3.070 2.360 2.240 2.459 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
12 1 5 TYR HA 1 6 LEU HG 4.520 . 4.520 3.832 3.567 4.129 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
13 1 5 TYR HA 1 35 LEU QD 5.440 . 5.440 4.799 4.613 5.001 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
14 1 5 TYR HB2 1 6 LEU H 4.030 . 4.030 3.679 3.478 3.811 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
15 1 5 TYR HB2 1 7 ASN H 4.150 . 4.150 3.575 3.398 3.812 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
16 1 5 TYR HB2 1 7 ASN HD21 4.530 . 4.530 2.943 2.375 3.688 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
17 1 5 TYR HB2 1 7 ASN HD22 4.530 . 4.530 4.090 2.981 4.536 0.006 20 0 "[ . 1 . 2 . 3 . 4]" 1
18 1 5 TYR HB2 1 35 LEU HA 4.160 . 4.160 3.756 3.538 4.074 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
19 1 5 TYR HB2 1 35 LEU QD 4.150 . 4.150 3.252 2.843 3.586 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
20 1 5 TYR HB3 1 6 LEU H 3.720 . 3.720 2.335 2.066 2.513 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
21 1 5 TYR HB3 1 7 ASN H 4.340 . 4.340 2.542 2.390 2.701 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
22 1 5 TYR HB3 1 8 VAL MG2 5.500 . 5.500 5.659 5.572 5.847 0.347 40 0 "[ . 1 . 2 . 3 . 4]" 1
23 1 5 TYR HB3 1 35 LEU HA 3.780 . 3.780 2.278 2.132 2.407 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
24 1 5 TYR HB3 1 35 LEU HB3 4.470 . 4.470 2.997 2.645 3.288 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
25 1 5 TYR HB3 1 35 LEU QD 3.510 . 3.510 2.996 2.781 3.261 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
26 1 5 TYR HB3 1 47 LEU QD 5.440 . 5.440 5.152 4.812 5.533 0.093 37 0 "[ . 1 . 2 . 3 . 4]" 1
27 1 5 TYR QD 1 6 LEU H 4.090 . 4.090 3.339 3.107 3.505 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
28 1 5 TYR QD 1 6 LEU MD1 5.500 . 5.500 5.276 5.086 5.594 0.094 40 0 "[ . 1 . 2 . 3 . 4]" 1
29 1 5 TYR QD 1 6 LEU MD2 5.460 . 5.460 5.395 5.149 5.524 0.064 26 0 "[ . 1 . 2 . 3 . 4]" 1
30 1 5 TYR QD 1 6 LEU HG 4.690 . 4.690 4.479 4.234 4.701 0.011 40 0 "[ . 1 . 2 . 3 . 4]" 1
31 1 5 TYR QD 1 35 LEU HA 4.390 . 4.390 3.815 3.726 3.983 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
32 1 5 TYR QD 1 35 LEU HB2 4.640 . 4.640 4.069 3.889 4.291 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
33 1 5 TYR QD 1 35 LEU HB3 4.200 . 4.200 2.958 2.800 3.093 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
34 1 5 TYR QD 1 35 LEU MD1 4.750 . 4.750 3.508 3.171 3.900 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
35 1 5 TYR QD 1 35 LEU QD 3.760 . 3.760 2.634 2.297 2.807 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
36 1 5 TYR QD 1 35 LEU MD2 4.750 . 4.750 2.727 2.355 2.925 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
37 1 5 TYR QD 1 36 GLU HB2 4.560 . 4.560 3.284 2.442 4.253 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
38 1 5 TYR QD 1 36 GLU QB 3.920 . 3.920 2.472 2.146 2.846 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
39 1 5 TYR QD 1 36 GLU HB3 4.560 . 4.560 3.357 2.157 4.585 0.025 18 0 "[ . 1 . 2 . 3 . 4]" 1
40 1 5 TYR QD 1 36 GLU QG 4.480 . 4.480 4.014 3.619 4.549 0.069 40 0 "[ . 1 . 2 . 3 . 4]" 1
41 1 5 TYR QD 1 47 LEU QD 4.650 . 4.650 3.918 3.612 4.330 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
42 1 5 TYR QE 1 35 LEU HB2 4.940 . 4.940 4.183 3.972 4.328 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
43 1 5 TYR QE 1 35 LEU HB3 4.720 . 4.720 3.419 3.251 3.608 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
44 1 5 TYR QE 1 35 LEU MD1 4.890 . 4.890 3.038 2.662 3.461 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
45 1 5 TYR QE 1 35 LEU QD 4.270 . 4.270 2.910 2.594 3.200 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
46 1 5 TYR QE 1 35 LEU MD2 4.890 . 4.890 3.755 3.409 4.111 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
47 1 5 TYR QE 1 36 GLU HB2 4.850 . 4.850 3.647 2.572 4.852 0.002 4 0 "[ . 1 . 2 . 3 . 4]" 1
48 1 5 TYR QE 1 36 GLU QB 4.210 . 4.210 2.918 2.542 3.354 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
49 1 5 TYR QE 1 36 GLU HB3 4.850 . 4.850 3.554 2.858 4.355 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
50 1 5 TYR QE 1 36 GLU QG 4.820 . 4.820 3.633 2.958 4.432 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
51 1 5 TYR QE 1 47 LEU HB2 5.500 . 5.500 5.281 4.997 5.622 0.122 40 0 "[ . 1 . 2 . 3 . 4]" 1
52 1 5 TYR QE 1 47 LEU QD 3.700 . 3.700 2.859 2.596 3.239 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
53 1 6 LEU H 1 6 LEU HB2 3.370 . 3.370 2.484 2.412 2.542 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
54 1 6 LEU H 1 6 LEU HB3 3.890 . 3.890 3.587 3.547 3.622 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
55 1 6 LEU H 1 6 LEU MD1 4.170 . 4.170 3.528 3.427 3.786 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
56 1 6 LEU H 1 6 LEU MD2 3.930 . 3.930 3.386 3.266 3.515 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
57 1 6 LEU H 1 6 LEU HG 3.350 . 3.350 2.224 2.109 2.474 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
58 1 6 LEU H 1 7 ASN H 3.790 . 3.790 2.530 2.355 2.665 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
59 1 6 LEU H 1 35 LEU HA 3.890 . 3.890 3.290 3.069 3.489 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
60 1 6 LEU H 1 35 LEU QD 5.070 . 5.070 4.557 4.346 4.789 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
61 1 6 LEU HA 1 6 LEU MD1 4.060 . 4.060 3.938 3.896 3.957 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
62 1 6 LEU HA 1 6 LEU MD2 2.780 . 2.780 2.240 2.167 2.317 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
63 1 6 LEU HA 1 6 LEU HG 3.930 . 3.930 3.183 3.086 3.311 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
64 1 6 LEU HA 1 7 ASN H 3.570 . 3.570 3.533 3.494 3.550 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
65 1 6 LEU HA 1 8 VAL MG1 4.140 . 4.140 3.711 3.587 3.819 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
66 1 6 LEU HA 1 8 VAL MG2 4.670 . 4.670 4.287 4.233 4.369 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
67 1 6 LEU HB2 1 6 LEU MD1 3.070 . 3.070 2.265 2.218 2.337 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
68 1 6 LEU HB2 1 7 ASN H 3.700 . 3.700 2.522 2.426 2.724 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
69 1 6 LEU HB2 1 7 ASN HA 4.910 . 4.910 4.343 4.252 4.547 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
70 1 6 LEU HB2 1 8 VAL H 4.370 . 4.370 2.705 2.584 2.946 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
71 1 6 LEU HB2 1 8 VAL MG1 4.400 . 4.400 3.525 3.368 3.700 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
72 1 6 LEU HB2 1 8 VAL MG2 3.720 . 3.720 2.332 2.249 2.581 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
73 1 6 LEU HB2 1 34 VAL MG1 4.040 . 4.040 3.385 3.116 3.514 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
74 1 6 LEU HB2 1 35 LEU HA 4.590 . 4.590 3.754 3.503 4.062 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
75 1 6 LEU HB3 1 6 LEU MD1 3.120 . 3.120 2.410 2.333 2.458 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
76 1 6 LEU HB3 1 6 LEU MD2 3.400 . 3.400 2.374 2.338 2.423 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
77 1 6 LEU HB3 1 7 ASN H 4.040 . 4.040 3.651 3.513 3.814 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
78 1 6 LEU HB3 1 7 ASN HA 5.500 . 5.500 5.230 5.059 5.377 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
79 1 6 LEU HB3 1 8 VAL H 4.340 . 4.340 3.060 2.821 3.482 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
80 1 6 LEU HB3 1 8 VAL HB 4.740 . 4.740 4.670 4.570 4.782 0.042 39 0 "[ . 1 . 2 . 3 . 4]" 1
81 1 6 LEU HB3 1 8 VAL MG1 3.820 . 3.820 2.414 2.299 2.515 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
82 1 6 LEU HB3 1 8 VAL MG2 3.430 . 3.430 2.286 2.166 2.403 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
83 1 6 LEU HB3 1 34 VAL MG1 4.500 . 4.500 4.426 4.120 4.514 0.014 14 0 "[ . 1 . 2 . 3 . 4]" 1
84 1 6 LEU MD1 1 7 ASN H 4.840 . 4.840 4.337 4.198 4.504 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
85 1 6 LEU MD1 1 8 VAL H 4.690 . 4.690 4.091 3.943 4.234 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
86 1 6 LEU MD1 1 8 VAL MG2 3.160 . 3.160 2.515 2.427 2.603 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
87 1 6 LEU MD1 1 34 VAL HB 4.110 . 4.110 3.608 3.361 3.854 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
88 1 6 LEU MD1 1 34 VAL MG1 3.070 . 3.070 2.309 2.156 2.514 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
89 1 6 LEU MD1 1 35 LEU HA 5.210 . 5.210 4.618 4.415 4.921 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
90 1 6 LEU MD1 1 36 GLU H 5.110 . 5.110 4.032 3.735 4.322 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
91 1 6 LEU MD1 1 36 GLU HA 3.530 . 3.530 2.595 2.289 3.166 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
92 1 6 LEU MD1 1 37 ARG H 3.680 . 3.680 3.144 2.763 3.622 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
93 1 6 LEU MD1 1 37 ARG HB2 4.360 . 4.360 3.439 3.023 3.923 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
94 1 6 LEU MD1 1 37 ARG HD2 4.670 . 4.670 4.240 3.518 4.716 0.046 15 0 "[ . 1 . 2 . 3 . 4]" 1
95 1 6 LEU MD1 1 37 ARG QD 3.880 . 3.880 3.291 2.821 3.698 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
96 1 6 LEU MD1 1 37 ARG HD3 4.670 . 4.670 3.450 2.927 4.385 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
97 1 6 LEU MD1 1 37 ARG QG 4.090 . 4.090 2.336 2.095 2.676 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
98 1 6 LEU MD2 1 7 ASN H 5.170 . 5.170 4.704 4.610 4.769 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
99 1 6 LEU MD2 1 36 GLU HA 4.420 . 4.420 4.020 3.860 4.367 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
100 1 6 LEU MD2 1 37 ARG QG 4.920 . 4.920 4.415 4.147 4.783 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
101 1 6 LEU HG 1 8 VAL MG1 5.100 . 5.100 5.073 4.964 5.191 0.091 40 0 "[ . 1 . 2 . 3 . 4]" 1
102 1 6 LEU HG 1 8 VAL MG2 4.210 . 4.210 4.248 4.214 4.318 0.108 38 0 "[ . 1 . 2 . 3 . 4]" 1
103 1 6 LEU HG 1 36 GLU HA 4.260 . 4.260 2.679 2.442 3.026 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
104 1 6 LEU HG 1 36 GLU QB 5.340 . 5.340 4.143 3.615 4.854 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
105 1 6 LEU HG 1 37 ARG H 4.870 . 4.870 4.341 3.886 4.669 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
106 1 7 ASN H 1 7 ASN QB 3.690 . 3.690 3.358 3.245 3.467 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
107 1 7 ASN H 1 8 VAL H 3.590 . 3.590 2.732 2.676 2.845 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
108 1 7 ASN H 1 8 VAL MG1 4.690 . 4.690 4.335 4.256 4.461 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
109 1 7 ASN H 1 8 VAL MG2 4.280 . 4.280 3.733 3.640 3.884 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
110 1 7 ASN H 1 33 THR MG 4.380 . 4.380 4.079 3.903 4.349 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
111 1 7 ASN H 1 35 LEU HA 3.780 . 3.780 2.627 2.392 2.937 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
112 1 7 ASN H 1 35 LEU QD 4.480 . 4.480 3.577 3.255 3.834 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
113 1 7 ASN HA 1 8 VAL H 3.200 . 3.200 2.880 2.666 3.076 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
114 1 7 ASN HA 1 8 VAL MG2 4.790 . 4.790 4.347 4.244 4.554 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
115 1 7 ASN HA 1 33 THR MG 3.150 . 3.150 2.595 2.385 2.965 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
116 1 7 ASN HA 1 35 LEU QD 3.890 . 3.890 3.206 2.841 3.579 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
117 1 7 ASN QB 1 8 VAL H 4.220 . 4.220 3.832 3.737 3.957 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
118 1 7 ASN QB 1 8 VAL MG1 4.810 . 4.810 4.190 3.947 4.299 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
119 1 7 ASN QB 1 8 VAL MG2 5.340 . 5.340 4.942 4.896 5.009 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
120 1 7 ASN QB 1 33 THR MG 4.470 . 4.470 3.583 3.295 4.031 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
121 1 7 ASN HB2 1 8 VAL H 5.080 . 5.080 4.174 3.990 4.341 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
122 1 7 ASN HB3 1 8 VAL H 5.080 . 5.080 4.467 4.369 4.561 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
123 1 7 ASN QD 1 35 LEU QD 5.270 . 5.270 3.700 2.415 4.992 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
124 1 8 VAL H 1 8 VAL HB 3.670 . 3.670 3.676 3.641 3.715 0.045 13 0 "[ . 1 . 2 . 3 . 4]" 1
125 1 8 VAL H 1 8 VAL MG1 3.560 . 3.560 2.660 2.513 2.913 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
126 1 8 VAL H 1 8 VAL MG2 3.080 . 3.080 1.837 1.759 1.927 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
127 1 8 VAL H 1 9 LEU H 4.800 . 4.800 4.558 4.457 4.640 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
128 1 8 VAL H 1 33 THR MG 3.990 . 3.990 3.828 3.452 4.006 0.016 6 0 "[ . 1 . 2 . 3 . 4]" 1
129 1 8 VAL H 1 34 VAL H 4.750 . 4.750 3.848 3.572 4.229 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
130 1 8 VAL H 1 34 VAL HB 4.050 . 4.050 3.428 3.153 3.691 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
131 1 8 VAL H 1 34 VAL MG1 4.680 . 4.680 4.316 4.090 4.546 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
132 1 8 VAL H 1 35 LEU QD 5.440 . 5.440 4.889 4.549 5.113 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
133 1 8 VAL HA 1 8 VAL MG1 2.970 . 2.970 2.323 2.284 2.372 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
134 1 8 VAL HA 1 8 VAL MG2 3.250 . 3.250 3.257 3.224 3.270 0.020 14 0 "[ . 1 . 2 . 3 . 4]" 1
135 1 8 VAL HA 1 9 LEU H 2.900 . 2.900 2.508 2.329 2.702 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
136 1 8 VAL HA 1 9 LEU HB2 4.600 . 4.600 4.551 4.403 4.650 0.050 38 0 "[ . 1 . 2 . 3 . 4]" 1
137 1 8 VAL HA 1 9 LEU HG 5.220 . 5.220 4.716 4.039 5.242 0.022 11 0 "[ . 1 . 2 . 3 . 4]" 1
138 1 8 VAL HB 1 9 LEU H 3.470 . 3.470 2.465 2.211 2.756 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
139 1 8 VAL HB 1 34 VAL H 5.130 . 5.130 5.109 5.005 5.166 0.036 38 0 "[ . 1 . 2 . 3 . 4]" 1
140 1 8 VAL HB 1 34 VAL MG1 5.350 . 5.350 5.340 5.185 5.429 0.079 40 0 "[ . 1 . 2 . 3 . 4]" 1
141 1 8 VAL HB 1 64 ILE MD 4.800 . 4.800 4.308 3.979 4.730 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
142 1 8 VAL HB 1 64 ILE MG 3.640 . 3.640 2.883 2.608 3.325 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
143 1 8 VAL MG1 1 9 LEU H 3.710 . 3.710 3.713 3.652 3.808 0.098 38 0 "[ . 1 . 2 . 3 . 4]" 1
144 1 8 VAL MG1 1 9 LEU HA 5.500 . 5.500 5.567 5.529 5.623 0.123 39 0 "[ . 1 . 2 . 3 . 4]" 1
145 1 8 VAL MG1 1 34 VAL HB 4.680 . 4.680 4.607 4.529 4.709 0.029 11 0 "[ . 1 . 2 . 3 . 4]" 1
146 1 8 VAL MG1 1 66 VAL HA 4.500 . 4.500 3.005 2.543 3.595 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
147 1 8 VAL MG2 1 9 LEU H 3.780 . 3.780 3.476 3.151 3.802 0.022 11 0 "[ . 1 . 2 . 3 . 4]" 1
148 1 8 VAL MG2 1 9 LEU HA 4.920 . 4.920 4.086 3.837 4.375 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
149 1 8 VAL MG2 1 10 ALA MB 4.310 . 4.310 4.067 3.882 4.314 0.004 14 0 "[ . 1 . 2 . 3 . 4]" 1
150 1 8 VAL MG2 1 34 VAL H 4.000 . 4.000 3.385 3.279 3.457 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
151 1 8 VAL MG2 1 34 VAL HA 4.760 . 4.760 4.544 4.493 4.601 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
152 1 8 VAL MG2 1 34 VAL HB 3.100 . 3.100 1.993 1.945 2.046 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
153 1 8 VAL MG2 1 34 VAL MG1 3.390 . 3.390 2.908 2.826 3.014 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
154 1 8 VAL MG2 1 34 VAL MG2 3.390 . 3.390 2.862 2.646 3.104 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
155 1 8 VAL MG2 1 64 ILE HA 5.180 . 5.180 4.319 4.062 4.709 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
156 1 8 VAL MG2 1 64 ILE MG 2.970 . 2.970 2.476 2.303 2.794 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
157 1 8 VAL MG2 1 66 VAL HA 5.280 . 5.280 4.430 3.655 5.037 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
158 1 9 LEU H 1 9 LEU HB2 3.350 . 3.350 2.403 2.211 2.573 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
159 1 9 LEU H 1 9 LEU HB3 3.820 . 3.820 3.642 3.519 3.761 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
160 1 9 LEU H 1 9 LEU MD1 4.520 . 4.520 3.721 2.733 4.512 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
161 1 9 LEU H 1 9 LEU QD 3.740 . 3.740 2.722 2.434 2.963 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
162 1 9 LEU H 1 9 LEU MD2 4.520 . 4.520 3.438 2.451 4.536 0.016 24 0 "[ . 1 . 2 . 3 . 4]" 1
163 1 9 LEU H 1 9 LEU HG 3.690 . 3.690 3.629 3.394 3.768 0.078 33 0 "[ . 1 . 2 . 3 . 4]" 1
164 1 9 LEU H 1 10 ALA H 4.610 . 4.610 4.531 4.451 4.617 0.007 40 0 "[ . 1 . 2 . 3 . 4]" 1
165 1 9 LEU H 1 34 VAL H 5.340 . 5.340 4.542 4.338 4.727 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
166 1 9 LEU H 1 64 ILE MG 4.260 . 4.260 4.043 3.744 4.294 0.034 31 0 "[ . 1 . 2 . 3 . 4]" 1
167 1 9 LEU H 1 65 LEU MD1 5.390 . 5.390 4.918 4.628 5.302 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
168 1 9 LEU H 1 66 VAL H 5.500 . 5.500 5.348 5.082 5.516 0.016 23 0 "[ . 1 . 2 . 3 . 4]" 1
169 1 9 LEU HA 1 9 LEU MD1 3.950 . 3.950 3.063 2.392 3.588 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
170 1 9 LEU HA 1 9 LEU QD 2.790 . 2.790 2.444 2.034 2.913 0.123 36 0 "[ . 1 . 2 . 3 . 4]" 1
171 1 9 LEU HA 1 9 LEU MD2 3.950 . 3.950 2.586 2.062 3.108 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
172 1 9 LEU HA 1 9 LEU HG 3.930 . 3.930 3.168 2.200 3.863 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
173 1 9 LEU HA 1 10 ALA H 2.880 . 2.880 2.477 2.421 2.533 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
174 1 9 LEU HA 1 31 ILE MG 4.400 . 4.400 4.335 4.143 4.423 0.023 20 0 "[ . 1 . 2 . 3 . 4]" 1
175 1 9 LEU HA 1 33 THR MG 4.170 . 4.170 3.455 3.232 3.670 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
176 1 9 LEU HA 1 34 VAL H 3.990 . 3.990 2.576 2.150 2.906 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
177 1 9 LEU HA 1 34 VAL MG2 4.060 . 4.060 3.207 2.704 3.844 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
178 1 9 LEU HB2 1 9 LEU MD1 3.340 . 3.340 2.682 2.134 3.152 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
179 1 9 LEU HB2 1 9 LEU QD 2.800 . 2.800 2.419 2.081 2.661 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
180 1 9 LEU HB2 1 9 LEU MD2 3.340 . 3.340 2.900 2.720 3.097 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
181 1 9 LEU HB2 1 10 ALA H 4.230 . 4.230 3.628 3.427 3.799 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
182 1 9 LEU HB2 1 65 LEU HB2 4.080 . 4.080 2.481 2.190 3.066 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
183 1 9 LEU HB2 1 65 LEU MD1 3.800 . 3.800 3.260 2.869 3.658 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
184 1 9 LEU HB3 1 9 LEU MD1 3.340 . 3.340 2.472 2.049 3.037 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
185 1 9 LEU HB3 1 9 LEU QD 2.890 . 2.890 2.093 2.020 2.175 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
186 1 9 LEU HB3 1 9 LEU MD2 3.340 . 3.340 2.775 2.134 3.289 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
187 1 9 LEU HB3 1 10 ALA H 3.610 . 3.610 2.300 2.104 2.463 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
188 1 9 LEU HB3 1 31 ILE MG 3.360 . 3.360 2.781 2.535 3.101 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
189 1 9 LEU HB3 1 65 LEU HB2 4.390 . 4.390 3.236 2.869 3.812 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
190 1 9 LEU HB3 1 65 LEU MD1 3.640 . 3.640 2.928 2.570 3.561 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
191 1 9 LEU QD 1 10 ALA H 3.280 . 3.280 3.160 2.925 3.364 0.084 36 0 "[ . 1 . 2 . 3 . 4]" 1
192 1 9 LEU QD 1 10 ALA MB 4.900 . 4.900 4.621 4.391 4.836 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
193 1 9 LEU QD 1 31 ILE MG 2.770 . 2.770 2.112 1.967 2.201 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
194 1 9 LEU QD 1 32 MET HA 4.380 . 4.380 4.024 3.762 4.249 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
195 1 9 LEU QD 1 33 THR H 4.220 . 4.220 3.913 3.582 4.142 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
196 1 9 LEU QD 1 33 THR HA 3.220 . 3.220 2.547 2.163 2.807 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
197 1 9 LEU QD 1 33 THR HB 4.590 . 4.590 4.192 3.823 4.504 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
198 1 9 LEU QD 1 33 THR MG 3.730 . 3.730 2.569 2.175 3.168 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
199 1 9 LEU QD 1 34 VAL H 4.120 . 4.120 3.783 3.423 4.160 0.040 16 0 "[ . 1 . 2 . 3 . 4]" 1
200 1 9 LEU QD 1 65 LEU HB2 4.910 . 4.910 4.035 3.639 4.243 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
201 1 9 LEU MD1 1 10 ALA H 4.590 . 4.590 3.773 3.001 4.705 0.115 36 0 "[ . 1 . 2 . 3 . 4]" 1
202 1 9 LEU MD1 1 34 VAL H 4.780 . 4.780 4.769 4.230 5.140 0.360 40 0 "[ . 1 . 2 . 3 . 4]" 1
203 1 9 LEU MD2 1 10 ALA H 4.590 . 4.590 3.826 3.295 4.564 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
204 1 9 LEU MD2 1 34 VAL H 4.780 . 4.780 4.000 3.507 4.529 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
205 1 9 LEU HG 1 10 ALA H 4.930 . 4.930 4.556 4.012 5.010 0.080 40 0 "[ . 1 . 2 . 3 . 4]" 1
206 1 9 LEU HG 1 33 THR HA 5.220 . 5.220 4.089 2.347 5.244 0.024 11 0 "[ . 1 . 2 . 3 . 4]" 1
207 1 10 ALA H 1 10 ALA MB 3.160 . 3.160 2.682 2.625 2.731 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
208 1 10 ALA H 1 11 LYS H 4.400 . 4.400 4.377 4.305 4.404 0.004 13 0 "[ . 1 . 2 . 3 . 4]" 1
209 1 10 ALA H 1 31 ILE MD 4.390 . 4.390 4.357 4.098 4.424 0.034 14 0 "[ . 1 . 2 . 3 . 4]" 1
210 1 10 ALA H 1 31 ILE MG 3.400 . 3.400 3.096 2.898 3.205 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
211 1 10 ALA H 1 33 THR HA 4.300 . 4.300 3.664 3.474 3.781 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
212 1 10 ALA H 1 33 THR MG 5.500 . 5.500 5.301 5.089 5.441 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
213 1 10 ALA H 1 34 VAL H 4.570 . 4.570 4.220 3.852 4.396 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
214 1 10 ALA H 1 34 VAL MG2 3.870 . 3.870 3.396 3.091 3.753 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
215 1 10 ALA H 1 65 LEU MD1 4.200 . 4.200 3.653 3.421 4.021 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
216 1 10 ALA H 1 65 LEU HG 4.630 . 4.630 4.295 4.051 4.636 0.006 10 0 "[ . 1 . 2 . 3 . 4]" 1
217 1 10 ALA HA 1 11 LYS H 3.010 . 3.010 2.314 2.170 2.368 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
218 1 10 ALA HA 1 11 LYS QB 4.640 . 4.640 3.938 3.868 4.003 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
219 1 10 ALA HA 1 64 ILE HA 3.810 . 3.810 2.597 2.414 2.702 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
220 1 10 ALA HA 1 64 ILE MD 4.450 . 4.450 3.903 3.708 4.043 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
221 1 10 ALA HA 1 64 ILE MG 4.280 . 4.280 4.166 4.042 4.312 0.032 38 0 "[ . 1 . 2 . 3 . 4]" 1
222 1 10 ALA HA 1 65 LEU H 3.360 . 3.360 2.502 2.382 2.651 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
223 1 10 ALA HA 1 65 LEU MD1 4.160 . 4.160 3.386 3.242 3.545 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
224 1 10 ALA HA 1 65 LEU MD2 4.020 . 4.020 3.861 3.672 4.043 0.023 36 0 "[ . 1 . 2 . 3 . 4]" 1
225 1 10 ALA HA 1 65 LEU HG 3.780 . 3.780 2.286 2.092 2.472 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
226 1 10 ALA MB 1 11 LYS H 3.090 . 3.090 2.442 2.259 2.580 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
227 1 10 ALA MB 1 31 ILE HA 5.310 . 5.310 4.678 4.510 4.826 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
228 1 10 ALA MB 1 32 MET H 4.110 . 4.110 3.487 3.276 3.653 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
229 1 10 ALA MB 1 32 MET ME 4.670 . 4.670 4.102 3.850 4.362 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
230 1 10 ALA MB 1 32 MET HG2 4.050 . 4.050 2.600 2.226 3.012 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
231 1 10 ALA MB 1 32 MET HG3 4.050 . 4.050 3.063 2.382 3.890 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
232 1 10 ALA MB 1 34 VAL H 4.480 . 4.480 4.107 3.780 4.471 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
233 1 10 ALA MB 1 34 VAL HA 4.620 . 4.620 4.577 4.463 4.670 0.050 14 0 "[ . 1 . 2 . 3 . 4]" 1
234 1 10 ALA MB 1 34 VAL HB 4.390 . 4.390 4.026 3.739 4.205 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
235 1 10 ALA MB 1 34 VAL MG1 4.000 . 4.000 3.912 3.805 4.026 0.026 39 0 "[ . 1 . 2 . 3 . 4]" 1
236 1 10 ALA MB 1 34 VAL MG2 2.580 . 2.580 1.962 1.927 2.021 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
237 1 10 ALA MB 1 46 TRP HE3 4.450 . 4.450 3.483 3.178 3.746 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
238 1 10 ALA MB 1 46 TRP HZ3 3.930 . 3.930 3.293 2.702 3.759 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
239 1 10 ALA MB 1 62 LEU HA 5.500 . 5.500 4.392 4.105 4.630 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
240 1 10 ALA MB 1 62 LEU MD1 3.400 . 3.400 2.778 2.233 3.604 0.204 2 0 "[ . 1 . 2 . 3 . 4]" 1
241 1 10 ALA MB 1 62 LEU QD 2.880 . 2.880 2.138 1.986 2.506 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
242 1 10 ALA MB 1 62 LEU MD2 3.400 . 3.400 2.368 2.031 2.751 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
243 1 10 ALA MB 1 63 LYS H 3.660 . 3.660 3.205 3.036 3.433 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
244 1 10 ALA MB 1 64 ILE HA 3.130 . 3.130 2.531 2.358 2.694 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
245 1 10 ALA MB 1 64 ILE MD 3.120 . 3.120 2.370 2.157 2.600 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
246 1 10 ALA MB 1 64 ILE QG 4.180 . 4.180 4.033 3.813 4.191 0.011 9 0 "[ . 1 . 2 . 3 . 4]" 1
247 1 10 ALA MB 1 65 LEU H 3.690 . 3.690 3.452 3.318 3.610 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
248 1 10 ALA MB 1 65 LEU HG 4.360 . 4.360 3.946 3.807 4.098 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
249 1 11 LYS H 1 11 LYS HB2 3.640 . 3.640 3.080 2.919 3.213 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
250 1 11 LYS H 1 11 LYS QB 3.110 . 3.110 2.449 2.379 2.512 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
251 1 11 LYS H 1 11 LYS HB3 3.640 . 3.640 2.571 2.508 2.692 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
252 1 11 LYS H 1 11 LYS QD 4.640 . 4.640 4.636 4.416 4.732 0.092 39 0 "[ . 1 . 2 . 3 . 4]" 1
253 1 11 LYS H 1 11 LYS HG2 4.600 . 4.600 4.391 4.318 4.497 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
254 1 11 LYS H 1 12 ALA H 4.600 . 4.600 4.368 4.281 4.486 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
255 1 11 LYS H 1 31 ILE HA 5.500 . 5.500 4.999 4.954 5.164 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
256 1 11 LYS H 1 31 ILE MD 4.730 . 4.730 4.217 4.013 4.306 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
257 1 11 LYS H 1 34 VAL MG2 5.310 . 5.310 5.089 4.934 5.238 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
258 1 11 LYS H 1 62 LEU HA 5.500 . 5.500 4.657 4.404 4.849 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
259 1 11 LYS H 1 62 LEU MD1 5.500 . 5.500 4.229 3.106 5.468 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
260 1 11 LYS H 1 62 LEU QD 4.170 . 4.170 3.332 3.070 3.941 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
261 1 11 LYS H 1 62 LEU MD2 5.500 . 5.500 4.163 3.159 5.192 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
262 1 11 LYS H 1 63 LYS H 3.490 . 3.490 2.739 2.523 2.888 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
263 1 11 LYS H 1 63 LYS HB2 4.960 . 4.960 4.759 4.556 4.973 0.013 39 0 "[ . 1 . 2 . 3 . 4]" 1
264 1 11 LYS H 1 63 LYS HB3 4.480 . 4.480 3.202 2.972 3.398 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
265 1 11 LYS H 1 64 ILE HA 4.040 . 4.040 3.982 3.849 4.048 0.008 28 0 "[ . 1 . 2 . 3 . 4]" 1
266 1 11 LYS H 1 65 LEU H 4.560 . 4.560 4.484 4.331 4.567 0.007 16 0 "[ . 1 . 2 . 3 . 4]" 1
267 1 11 LYS H 1 65 LEU MD1 3.900 . 3.900 3.669 3.487 3.807 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
268 1 11 LYS H 1 65 LEU MD2 4.280 . 4.280 3.703 3.434 4.004 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
269 1 11 LYS H 1 65 LEU HG 3.710 . 3.710 2.928 2.784 3.081 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
270 1 11 LYS HA 1 11 LYS QD 4.480 . 4.480 4.223 4.098 4.254 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
271 1 11 LYS HA 1 11 LYS QE 5.170 . 5.170 4.198 3.920 5.030 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
272 1 11 LYS HA 1 11 LYS HG2 4.080 . 4.080 3.003 2.848 3.107 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
273 1 11 LYS HA 1 11 LYS HG3 3.780 . 3.780 2.712 2.627 2.864 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
274 1 11 LYS HA 1 12 ALA H 2.870 . 2.870 2.144 2.115 2.213 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
275 1 11 LYS HA 1 12 ALA MB 4.000 . 4.000 3.953 3.907 4.060 0.060 38 0 "[ . 1 . 2 . 3 . 4]" 1
276 1 11 LYS HA 1 31 ILE H 5.080 . 5.080 4.982 4.895 5.188 0.108 39 0 "[ . 1 . 2 . 3 . 4]" 1
277 1 11 LYS HA 1 31 ILE HA 4.500 . 4.500 2.595 2.512 2.843 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
278 1 11 LYS HA 1 31 ILE MD 3.540 . 3.540 2.157 1.966 2.228 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
279 1 11 LYS HA 1 31 ILE HG12 4.610 . 4.610 4.301 4.219 4.408 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
280 1 11 LYS HA 1 31 ILE HG13 5.160 . 5.160 5.150 4.953 5.194 0.034 13 0 "[ . 1 . 2 . 3 . 4]" 1
281 1 11 LYS HA 1 31 ILE MG 3.950 . 3.950 3.901 3.664 4.080 0.130 39 0 "[ . 1 . 2 . 3 . 4]" 1
282 1 11 LYS HA 1 32 MET H 3.930 . 3.930 3.783 3.648 3.961 0.031 39 0 "[ . 1 . 2 . 3 . 4]" 1
283 1 11 LYS HA 1 32 MET ME 4.720 . 4.720 4.274 3.981 4.797 0.077 39 0 "[ . 1 . 2 . 3 . 4]" 1
284 1 11 LYS HA 1 62 LEU QD 4.480 . 4.480 3.761 3.572 4.264 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
285 1 11 LYS HA 1 65 LEU MD1 4.220 . 4.220 3.733 3.597 3.839 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
286 1 11 LYS HA 1 65 LEU MD2 5.150 . 5.150 4.877 4.623 5.133 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
287 1 11 LYS QB 1 11 LYS QE 3.610 . 3.610 2.301 2.061 3.427 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
288 1 11 LYS QB 1 12 ALA H 3.900 . 3.900 3.738 3.687 3.815 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
289 1 11 LYS QB 1 31 ILE HA 4.850 . 4.850 4.174 4.040 4.549 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
290 1 11 LYS QB 1 31 ILE MD 3.370 . 3.370 2.372 2.274 2.631 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
291 1 11 LYS QB 1 65 LEU MD1 3.310 . 3.310 2.043 1.965 2.141 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
292 1 11 LYS QB 1 65 LEU MD2 4.080 . 4.080 2.593 2.382 2.835 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
293 1 11 LYS HB2 1 11 LYS QE 4.340 . 4.340 2.386 2.118 3.769 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
294 1 11 LYS HB2 1 12 ALA H 4.510 . 4.510 4.216 4.130 4.330 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
295 1 11 LYS HB2 1 31 ILE MD 3.840 . 3.840 2.400 2.296 2.678 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
296 1 11 LYS HB2 1 65 LEU MD1 4.010 . 4.010 2.062 1.987 2.157 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
297 1 11 LYS HB3 1 11 LYS QE 4.340 . 4.340 3.056 2.633 3.937 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
298 1 11 LYS HB3 1 12 ALA H 4.510 . 4.510 4.177 4.108 4.237 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
299 1 11 LYS HB3 1 31 ILE MD 3.840 . 3.840 3.720 3.623 3.856 0.016 39 0 "[ . 1 . 2 . 3 . 4]" 1
300 1 11 LYS HB3 1 65 LEU MD1 4.010 . 4.010 3.324 3.115 3.612 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
301 1 11 LYS QD 1 12 ALA H 4.580 . 4.580 4.605 4.418 4.665 0.085 19 0 "[ . 1 . 2 . 3 . 4]" 1
302 1 11 LYS QD 1 13 LEU HA 4.910 . 4.910 4.117 3.847 4.489 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
303 1 11 LYS QD 1 13 LEU MD2 3.760 . 3.760 2.780 2.562 3.033 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
304 1 11 LYS QD 1 29 GLY H 4.870 . 4.870 4.574 4.283 4.898 0.028 8 0 "[ . 1 . 2 . 3 . 4]" 1
305 1 11 LYS QD 1 29 GLY HA2 4.150 . 4.150 3.320 2.986 3.946 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
306 1 11 LYS QD 1 29 GLY HA3 5.500 . 5.500 4.840 4.466 5.488 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
307 1 11 LYS QD 1 31 ILE MD 3.860 . 3.860 3.778 3.627 3.900 0.040 22 0 "[ . 1 . 2 . 3 . 4]" 1
308 1 11 LYS QD 1 62 LEU QD 5.440 . 5.440 5.526 5.351 5.904 0.464 6 0 "[ . 1 . 2 . 3 . 4]" 1
309 1 11 LYS QD 1 63 LYS QE 3.970 . 3.970 3.353 2.453 4.434 0.464 38 0 "[ . 1 . 2 . 3 . 4]" 1
310 1 11 LYS QD 1 63 LYS HG2 4.440 . 4.440 4.500 4.343 4.615 0.175 38 0 "[ . 1 . 2 . 3 . 4]" 1
311 1 11 LYS QD 1 65 LEU MD1 4.430 . 4.430 4.015 3.448 4.406 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
312 1 11 LYS QD 1 65 LEU MD2 4.610 . 4.610 3.486 2.950 3.848 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
313 1 11 LYS QE 1 11 LYS HG2 3.670 . 3.670 3.335 2.852 3.532 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
314 1 11 LYS QE 1 11 LYS HG3 3.830 . 3.830 2.372 2.048 2.832 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
315 1 11 LYS QE 1 13 LEU MD2 4.250 . 4.250 4.438 4.249 4.650 0.400 19 0 "[ . 1 . 2 . 3 . 4]" 1
316 1 11 LYS QE 1 29 GLY HA2 5.500 . 5.500 4.374 2.848 4.968 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
317 1 11 LYS QE 1 31 ILE MD 3.650 . 3.650 2.519 2.010 3.528 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
318 1 11 LYS QE 1 63 LYS HB3 5.500 . 5.500 4.944 4.300 5.547 0.047 8 0 "[ . 1 . 2 . 3 . 4]" 1
319 1 11 LYS QE 1 63 LYS QD 5.500 . 5.500 5.090 3.542 5.805 0.305 30 0 "[ . 1 . 2 . 3 . 4]" 1
320 1 11 LYS QE 1 65 LEU MD1 4.280 . 4.280 2.776 2.318 4.359 0.079 17 0 "[ . 1 . 2 . 3 . 4]" 1
321 1 11 LYS QE 1 65 LEU MD2 4.280 . 4.280 2.927 2.371 4.113 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
322 1 11 LYS HG2 1 12 ALA H 3.820 . 3.820 2.879 2.627 2.985 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
323 1 11 LYS HG2 1 12 ALA MB 4.270 . 4.270 3.885 3.744 4.010 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
324 1 11 LYS HG2 1 29 GLY H 4.510 . 4.510 3.715 3.406 4.019 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
325 1 11 LYS HG2 1 29 GLY HA2 4.560 . 4.560 3.186 2.665 3.494 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
326 1 11 LYS HG2 1 29 GLY HA3 5.220 . 5.220 4.915 4.407 5.182 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
327 1 11 LYS HG2 1 31 ILE MD 4.460 . 4.460 3.623 3.398 3.825 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
328 1 11 LYS HG2 1 62 LEU QD 4.990 . 4.990 4.681 4.518 5.077 0.087 6 0 "[ . 1 . 2 . 3 . 4]" 1
329 1 11 LYS HG3 1 12 ALA H 3.980 . 3.980 3.301 3.063 3.661 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
330 1 11 LYS HG3 1 29 GLY HA2 4.520 . 4.520 3.130 2.869 3.532 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
331 1 11 LYS HG3 1 31 ILE HA 5.500 . 5.500 4.323 4.187 4.572 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
332 1 11 LYS HG3 1 31 ILE MD 3.960 . 3.960 2.325 2.162 2.529 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
333 1 11 LYS HG3 1 31 ILE HG12 3.980 . 3.980 3.994 3.958 4.070 0.090 40 0 "[ . 1 . 2 . 3 . 4]" 1
334 1 12 ALA H 1 12 ALA MB 2.830 . 2.830 2.174 2.118 2.289 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
335 1 12 ALA H 1 13 LEU H 4.620 . 4.620 4.590 4.506 4.630 0.010 17 0 "[ . 1 . 2 . 3 . 4]" 1
336 1 12 ALA H 1 30 ASP H 4.260 . 4.260 3.759 3.628 3.877 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
337 1 12 ALA H 1 31 ILE HA 3.890 . 3.890 3.626 3.537 3.705 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
338 1 12 ALA H 1 31 ILE MD 4.250 . 4.250 3.592 3.367 3.698 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
339 1 12 ALA H 1 31 ILE MG 5.410 . 5.410 5.353 5.211 5.412 0.002 10 0 "[ . 1 . 2 . 3 . 4]" 1
340 1 12 ALA H 1 32 MET ME 4.020 . 4.020 3.320 3.116 3.706 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
341 1 12 ALA H 1 62 LEU QD 3.820 . 3.820 3.295 3.132 3.570 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
342 1 12 ALA HA 1 13 LEU H 3.120 . 3.120 2.170 2.123 2.207 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
343 1 12 ALA HA 1 13 LEU MD1 5.150 . 5.150 5.119 4.998 5.193 0.043 26 0 "[ . 1 . 2 . 3 . 4]" 1
344 1 12 ALA HA 1 13 LEU MD2 4.570 . 4.570 4.405 4.105 4.655 0.085 40 0 "[ . 1 . 2 . 3 . 4]" 1
345 1 12 ALA HA 1 13 LEU HG 4.370 . 4.370 3.797 3.605 3.932 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
346 1 12 ALA HA 1 14 TYR H 3.770 . 3.770 3.613 3.405 3.779 0.009 35 0 "[ . 1 . 2 . 3 . 4]" 1
347 1 12 ALA HA 1 32 MET ME 3.940 . 3.940 3.722 3.561 3.950 0.010 39 0 "[ . 1 . 2 . 3 . 4]" 1
348 1 12 ALA HA 1 62 LEU H 5.500 . 5.500 5.412 5.252 5.537 0.037 24 0 "[ . 1 . 2 . 3 . 4]" 1
349 1 12 ALA HA 1 62 LEU QD 2.870 . 2.870 1.996 1.835 2.148 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
350 1 12 ALA HA 1 63 LYS H 4.180 . 4.180 3.824 3.616 4.075 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
351 1 12 ALA MB 1 13 LEU H 3.500 . 3.500 3.134 2.973 3.349 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
352 1 12 ALA MB 1 13 LEU MD2 5.280 . 5.280 4.791 4.517 5.074 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
353 1 12 ALA MB 1 14 TYR H 3.420 . 3.420 3.066 2.891 3.244 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
354 1 12 ALA MB 1 15 ASP HA 4.750 . 4.750 3.910 3.472 4.453 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
355 1 12 ALA MB 1 26 PHE HB2 4.230 . 4.230 3.436 3.175 4.015 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
356 1 12 ALA MB 1 26 PHE QD 3.350 . 3.350 2.233 2.122 2.735 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
357 1 12 ALA MB 1 26 PHE QE 3.110 . 3.110 2.352 2.157 2.904 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
358 1 12 ALA MB 1 26 PHE HZ 4.660 . 4.660 4.191 4.021 4.467 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
359 1 12 ALA MB 1 27 ARG H 4.490 . 4.490 4.130 3.907 4.458 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
360 1 12 ALA MB 1 27 ARG HA 4.770 . 4.770 4.574 4.213 4.800 0.030 22 0 "[ . 1 . 2 . 3 . 4]" 1
361 1 12 ALA MB 1 28 LYS H 4.640 . 4.640 4.376 4.055 4.649 0.009 4 0 "[ . 1 . 2 . 3 . 4]" 1
362 1 12 ALA MB 1 28 LYS HA 3.060 . 3.060 2.571 2.305 2.851 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
363 1 12 ALA MB 1 28 LYS QG 4.860 . 4.860 4.031 3.814 4.254 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
364 1 12 ALA MB 1 29 GLY H 3.060 . 3.060 2.353 2.178 2.618 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
365 1 12 ALA MB 1 29 GLY HA2 4.040 . 4.040 3.856 3.568 4.088 0.048 39 0 "[ . 1 . 2 . 3 . 4]" 1
366 1 12 ALA MB 1 30 ASP H 2.990 . 2.990 2.321 2.169 2.475 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
367 1 12 ALA MB 1 30 ASP HA 5.120 . 5.120 4.252 4.147 4.463 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
368 1 12 ALA MB 1 30 ASP HB2 3.650 . 3.650 2.518 2.399 2.758 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
369 1 12 ALA MB 1 30 ASP HB3 4.170 . 4.170 3.769 3.390 4.172 0.002 40 0 "[ . 1 . 2 . 3 . 4]" 1
370 1 12 ALA MB 1 31 ILE HA 4.670 . 4.670 4.721 4.643 4.774 0.104 36 0 "[ . 1 . 2 . 3 . 4]" 1
371 1 12 ALA MB 1 32 MET ME 2.780 . 2.780 2.197 2.014 2.506 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
372 1 12 ALA MB 1 50 LEU MD1 5.500 . 5.500 4.974 4.422 5.398 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
373 1 12 ALA MB 1 50 LEU MD2 5.500 . 5.500 4.843 4.511 5.460 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
374 1 12 ALA MB 1 57 VAL MG1 4.920 . 4.920 4.909 4.569 5.060 0.140 38 0 "[ . 1 . 2 . 3 . 4]" 1
375 1 12 ALA MB 1 62 LEU HA 4.930 . 4.930 4.296 4.133 4.483 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
376 1 12 ALA MB 1 62 LEU MD1 4.420 . 4.420 3.425 2.521 4.525 0.105 8 0 "[ . 1 . 2 . 3 . 4]" 1
377 1 12 ALA MB 1 62 LEU QD 3.050 . 3.050 2.721 2.508 2.829 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
378 1 12 ALA MB 1 62 LEU MD2 4.420 . 4.420 3.827 2.648 4.691 0.271 12 0 "[ . 1 . 2 . 3 . 4]" 1
379 1 12 ALA MB 1 62 LEU HG 5.490 . 5.490 4.726 3.822 5.489 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
380 1 13 LEU H 1 13 LEU HB2 3.940 . 3.940 2.495 2.401 2.560 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
381 1 13 LEU H 1 13 LEU QB 3.460 . 3.460 2.455 2.365 2.517 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
382 1 13 LEU H 1 13 LEU HB3 3.940 . 3.940 3.661 3.553 3.707 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
383 1 13 LEU H 1 13 LEU MD1 3.980 . 3.980 3.754 3.579 3.880 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
384 1 13 LEU H 1 13 LEU MD2 3.680 . 3.680 3.506 3.399 3.605 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
385 1 13 LEU H 1 13 LEU HG 3.430 . 3.430 2.516 2.366 2.644 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
386 1 13 LEU H 1 14 TYR H 3.100 . 3.100 2.154 2.066 2.301 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
387 1 13 LEU H 1 32 MET ME 5.500 . 5.500 5.502 5.353 5.693 0.193 39 0 "[ . 1 . 2 . 3 . 4]" 1
388 1 13 LEU H 1 62 LEU HA 3.790 . 3.790 2.744 2.602 3.005 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
389 1 13 LEU H 1 62 LEU QD 3.440 . 3.440 3.354 2.974 3.529 0.089 35 0 "[ . 1 . 2 . 3 . 4]" 1
390 1 13 LEU H 1 63 LYS H 4.620 . 4.620 4.261 4.009 4.513 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
391 1 13 LEU HA 1 13 LEU MD1 4.180 . 4.180 3.882 3.837 3.952 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
392 1 13 LEU HA 1 13 LEU MD2 2.700 . 2.700 2.187 2.116 2.280 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
393 1 13 LEU HA 1 13 LEU HG 3.790 . 3.790 3.209 3.142 3.266 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
394 1 13 LEU HA 1 28 LYS QE 5.340 . 5.340 3.852 3.167 4.861 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
395 1 13 LEU HA 1 28 LYS HG2 4.690 . 4.690 4.602 4.328 4.790 0.100 39 0 "[ . 1 . 2 . 3 . 4]" 1
396 1 13 LEU HA 1 28 LYS QG 4.090 . 4.090 3.255 2.858 3.812 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
397 1 13 LEU HA 1 28 LYS HG3 4.690 . 4.690 3.333 2.899 4.034 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
398 1 13 LEU HA 1 29 GLY H 4.830 . 4.830 3.916 3.615 4.278 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
399 1 13 LEU QB 1 13 LEU MD1 2.710 . 2.710 2.079 2.044 2.142 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
400 1 13 LEU QB 1 13 LEU MD2 3.090 . 3.090 2.332 2.261 2.398 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
401 1 13 LEU QB 1 14 TYR H 3.600 . 3.600 2.925 2.733 3.105 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
402 1 13 LEU QB 1 14 TYR QD 4.050 . 4.050 2.359 2.135 2.548 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
403 1 13 LEU QB 1 14 TYR QE 3.680 . 3.680 3.072 2.783 3.425 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
404 1 13 LEU HB2 1 13 LEU MD1 3.240 . 3.240 2.303 2.256 2.346 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
405 1 13 LEU HB2 1 14 TYR H 4.260 . 4.260 3.006 2.802 3.206 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
406 1 13 LEU HB2 1 14 TYR QD 4.670 . 4.670 2.410 2.165 2.605 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
407 1 13 LEU HB2 1 14 TYR QE 4.210 . 4.210 3.447 3.086 3.975 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
408 1 13 LEU HB3 1 13 LEU MD1 3.240 . 3.240 2.367 2.304 2.473 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
409 1 13 LEU HB3 1 14 TYR H 4.260 . 4.260 4.004 3.793 4.155 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
410 1 13 LEU HB3 1 14 TYR QD 4.670 . 4.670 3.375 3.170 3.664 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
411 1 13 LEU HB3 1 14 TYR QE 4.210 . 4.210 3.456 3.165 3.739 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
412 1 13 LEU MD1 1 14 TYR H 5.010 . 5.010 4.786 4.567 4.959 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
413 1 13 LEU MD1 1 14 TYR QD 4.380 . 4.380 3.751 3.525 3.983 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
414 1 13 LEU MD1 1 14 TYR QE 3.870 . 3.870 3.486 3.000 3.966 0.096 26 0 "[ . 1 . 2 . 3 . 4]" 1
415 1 13 LEU MD1 1 61 ARG HA 3.830 . 3.830 3.033 2.626 3.863 0.033 31 0 "[ . 1 . 2 . 3 . 4]" 1
416 1 13 LEU MD1 1 62 LEU H 4.190 . 4.190 3.550 3.217 4.158 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
417 1 13 LEU MD1 1 62 LEU HA 4.100 . 4.100 3.662 3.467 3.997 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
418 1 13 LEU MD1 1 62 LEU QD 4.830 . 4.830 4.679 4.560 4.891 0.061 31 0 "[ . 1 . 2 . 3 . 4]" 1
419 1 13 LEU MD1 1 63 LYS H 4.300 . 4.300 3.909 3.742 4.037 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
420 1 13 LEU MD1 1 63 LYS HA 4.360 . 4.360 3.588 3.395 3.822 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
421 1 13 LEU MD1 1 63 LYS HB2 3.070 . 3.070 2.227 2.096 2.421 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
422 1 13 LEU MD1 1 63 LYS HB3 4.060 . 4.060 3.501 3.368 3.819 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
423 1 13 LEU MD1 1 63 LYS QD 4.540 . 4.540 3.608 3.172 4.435 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
424 1 13 LEU MD1 1 63 LYS QE 4.250 . 4.250 3.476 2.510 4.389 0.139 31 0 "[ . 1 . 2 . 3 . 4]" 1
425 1 13 LEU MD2 1 14 TYR H 4.670 . 4.670 4.685 4.633 4.748 0.078 39 0 "[ . 1 . 2 . 3 . 4]" 1
426 1 13 LEU MD2 1 14 TYR QE 5.470 . 5.470 5.029 4.664 5.316 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
427 1 13 LEU MD2 1 62 LEU HA 4.420 . 4.420 4.178 3.983 4.413 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
428 1 13 LEU MD2 1 62 LEU QD 4.610 . 4.610 4.591 4.342 4.893 0.283 1 0 "[ . 1 . 2 . 3 . 4]" 1
429 1 13 LEU MD2 1 63 LYS H 3.970 . 3.970 3.773 3.630 4.102 0.132 40 0 "[ . 1 . 2 . 3 . 4]" 1
430 1 13 LEU MD2 1 63 LYS HA 4.280 . 4.280 4.305 4.165 4.374 0.094 17 0 "[ . 1 . 2 . 3 . 4]" 1
431 1 13 LEU MD2 1 63 LYS HB2 2.970 . 2.970 2.221 2.153 2.330 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
432 1 13 LEU MD2 1 63 LYS HB3 3.120 . 3.120 2.480 2.327 2.872 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
433 1 13 LEU MD2 1 63 LYS QD 3.570 . 3.570 2.979 2.207 3.595 0.025 23 0 "[ . 1 . 2 . 3 . 4]" 1
434 1 13 LEU MD2 1 63 LYS QE 3.830 . 3.830 2.166 1.980 3.862 0.032 31 0 "[ . 1 . 2 . 3 . 4]" 1
435 1 13 LEU MD2 1 63 LYS HG2 4.450 . 4.450 4.026 3.741 4.307 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
436 1 13 LEU MD2 1 63 LYS HG3 4.470 . 4.470 4.294 3.879 4.474 0.004 23 0 "[ . 1 . 2 . 3 . 4]" 1
437 1 13 LEU HG 1 61 ARG HA 5.220 . 5.220 4.471 4.179 4.777 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
438 1 13 LEU HG 1 62 LEU HA 4.070 . 4.070 2.711 2.550 3.016 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
439 1 13 LEU HG 1 62 LEU QD 4.160 . 4.160 3.996 3.843 4.181 0.021 1 0 "[ . 1 . 2 . 3 . 4]" 1
440 1 13 LEU HG 1 63 LYS H 3.710 . 3.710 3.140 2.994 3.361 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
441 1 13 LEU HG 1 63 LYS HA 5.500 . 5.500 4.502 4.315 4.782 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
442 1 14 TYR H 1 14 TYR HB2 3.970 . 3.970 2.773 2.674 2.851 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
443 1 14 TYR H 1 14 TYR QB 3.430 . 3.430 2.714 2.621 2.778 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
444 1 14 TYR H 1 14 TYR HB3 3.970 . 3.970 3.850 3.770 3.895 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
445 1 14 TYR H 1 14 TYR QD 3.970 . 3.970 3.210 2.987 3.371 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
446 1 14 TYR H 1 15 ASP H 4.440 . 4.440 4.371 4.319 4.435 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
447 1 14 TYR H 1 15 ASP HA 5.280 . 5.280 4.759 4.477 4.951 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
448 1 14 TYR H 1 28 LYS HA 4.130 . 4.130 3.592 3.305 3.960 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
449 1 14 TYR H 1 28 LYS QG 4.460 . 4.460 3.874 3.680 4.121 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
450 1 14 TYR H 1 61 ARG HB2 4.560 . 4.560 3.199 2.640 4.495 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
451 1 14 TYR H 1 61 ARG HB3 5.500 . 5.500 4.687 2.926 5.138 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
452 1 14 TYR H 1 61 ARG QG 5.340 . 5.340 4.129 3.622 5.392 0.052 17 0 "[ . 1 . 2 . 3 . 4]" 1
453 1 14 TYR H 1 62 LEU QD 4.960 . 4.960 4.666 4.061 4.909 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
454 1 14 TYR HA 1 15 ASP H 3.230 . 3.230 2.503 2.373 2.656 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
455 1 14 TYR HA 1 28 LYS HA 4.980 . 4.980 3.637 3.209 3.995 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
456 1 14 TYR HA 1 28 LYS HB2 4.490 . 4.490 2.558 2.323 2.863 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
457 1 14 TYR HA 1 28 LYS HB3 4.490 . 4.490 4.225 4.016 4.493 0.003 10 0 "[ . 1 . 2 . 3 . 4]" 1
458 1 14 TYR HA 1 28 LYS QD 4.010 . 4.010 2.719 2.360 3.266 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
459 1 14 TYR QB 1 15 ASP H 3.170 . 3.170 2.327 2.170 2.627 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
460 1 14 TYR QB 1 61 ARG HB2 4.610 . 4.610 2.326 2.031 3.891 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
461 1 14 TYR QB 1 61 ARG QD 3.890 . 3.890 2.324 2.059 3.054 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
462 1 14 TYR QB 1 89 PRO QB 3.840 . 3.840 2.159 1.960 2.732 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
463 1 14 TYR HB2 1 15 ASP H 3.990 . 3.990 3.513 3.337 3.846 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
464 1 14 TYR HB2 1 61 ARG HD2 5.500 . 5.500 3.890 2.518 4.257 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
465 1 14 TYR HB2 1 61 ARG HD3 5.500 . 5.500 2.570 2.095 4.567 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
466 1 14 TYR HB2 1 89 PRO QB 4.420 . 4.420 2.872 2.462 3.600 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
467 1 14 TYR HB3 1 15 ASP H 3.990 . 3.990 2.362 2.195 2.674 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
468 1 14 TYR HB3 1 61 ARG HD2 5.500 . 5.500 4.972 3.322 5.428 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
469 1 14 TYR HB3 1 61 ARG HD3 5.500 . 5.500 3.700 3.125 5.534 0.034 17 0 "[ . 1 . 2 . 3 . 4]" 1
470 1 14 TYR HB3 1 89 PRO QB 4.420 . 4.420 2.247 1.992 2.878 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
471 1 14 TYR QD 1 61 ARG HB2 4.610 . 4.610 2.337 2.047 4.484 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
472 1 14 TYR QD 1 61 ARG HB3 4.560 . 4.560 3.018 2.270 3.387 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
473 1 14 TYR QD 1 61 ARG QG 4.780 . 4.780 4.112 2.806 4.470 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
474 1 14 TYR QD 1 89 PRO HA 4.480 . 4.480 3.339 2.747 4.135 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
475 1 14 TYR QD 1 89 PRO QB 4.430 . 4.430 2.812 2.395 3.208 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
476 1 14 TYR QE 1 61 ARG HB3 5.370 . 5.370 4.596 3.435 5.338 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
477 1 14 TYR QE 1 89 PRO HA 4.180 . 4.180 3.443 2.882 3.922 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
478 1 14 TYR QE 1 89 PRO QB 4.320 . 4.320 4.085 3.454 4.465 0.145 26 0 "[ . 1 . 2 . 3 . 4]" 1
479 1 14 TYR QE 1 90 PRO HD2 4.370 . 4.370 3.501 3.123 3.952 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
480 1 14 TYR QE 1 90 PRO QD 3.750 . 3.750 3.035 2.715 3.631 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
481 1 14 TYR QE 1 90 PRO HD3 4.370 . 4.370 3.371 2.942 4.376 0.006 4 0 "[ . 1 . 2 . 3 . 4]" 1
482 1 14 TYR QE 1 90 PRO HG2 5.500 . 5.500 4.598 4.051 5.406 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
483 1 14 TYR QE 1 90 PRO QG 4.620 . 4.620 3.556 3.006 4.628 0.008 4 0 "[ . 1 . 2 . 3 . 4]" 1
484 1 14 TYR QE 1 90 PRO HG3 5.500 . 5.500 3.709 3.099 5.031 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
485 1 15 ASP H 1 15 ASP HB2 3.660 . 3.660 2.966 2.195 3.668 0.008 31 0 "[ . 1 . 2 . 3 . 4]" 1
486 1 15 ASP H 1 15 ASP QB 3.020 . 3.020 2.489 2.174 2.676 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
487 1 15 ASP H 1 15 ASP HB3 3.660 . 3.660 3.165 2.555 3.611 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
488 1 15 ASP H 1 28 LYS H 4.250 . 4.250 3.994 3.792 4.248 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
489 1 15 ASP H 1 28 LYS HB2 4.770 . 4.770 3.021 2.722 3.391 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
490 1 15 ASP H 1 28 LYS QB 4.040 . 4.040 2.980 2.698 3.327 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
491 1 15 ASP H 1 28 LYS HB3 4.770 . 4.770 4.585 4.373 4.823 0.053 38 0 "[ . 1 . 2 . 3 . 4]" 1
492 1 15 ASP H 1 28 LYS QD 4.680 . 4.680 4.110 3.608 4.699 0.019 38 0 "[ . 1 . 2 . 3 . 4]" 1
493 1 15 ASP HA 1 16 ASN H 2.930 . 2.930 2.481 2.315 2.652 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
494 1 15 ASP HA 1 27 ARG H 5.430 . 5.430 4.624 4.353 4.908 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
495 1 15 ASP HA 1 27 ARG HA 4.840 . 4.840 2.382 2.012 2.772 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
496 1 15 ASP HA 1 28 LYS H 3.410 . 3.410 2.823 2.255 3.159 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
497 1 15 ASP HA 1 28 LYS HA 4.710 . 4.710 3.631 3.178 4.173 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
498 1 15 ASP QB 1 16 ASN H 3.200 . 3.200 2.360 1.997 2.718 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
499 1 15 ASP QB 1 17 VAL QG 4.440 . 4.440 4.199 3.794 4.881 0.441 35 0 "[ . 1 . 2 . 3 . 4]" 1
500 1 15 ASP QB 1 27 ARG HA 4.210 . 4.210 2.695 1.989 3.643 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
501 1 15 ASP QB 1 28 LYS H 4.400 . 4.400 3.030 2.029 4.012 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
502 1 15 ASP HB2 1 16 ASN H 3.880 . 3.880 3.013 2.007 3.899 0.019 37 0 "[ . 1 . 2 . 3 . 4]" 1
503 1 15 ASP HB2 1 27 ARG HA 4.900 . 4.900 3.542 2.096 4.759 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
504 1 15 ASP HB2 1 28 LYS H 5.040 . 5.040 4.020 3.232 4.676 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
505 1 15 ASP HB3 1 16 ASN H 3.880 . 3.880 3.050 2.230 3.824 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
506 1 15 ASP HB3 1 27 ARG HA 4.900 . 4.900 2.940 2.472 3.809 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
507 1 15 ASP HB3 1 28 LYS H 5.040 . 5.040 3.174 2.049 4.416 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
508 1 16 ASN H 1 16 ASN HB2 3.790 . 3.790 3.372 2.926 3.859 0.069 23 0 "[ . 1 . 2 . 3 . 4]" 1
509 1 16 ASN H 1 16 ASN QB 3.320 . 3.320 2.758 2.622 2.848 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
510 1 16 ASN H 1 16 ASN HB3 3.790 . 3.790 2.949 2.712 3.074 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
511 1 16 ASN H 1 27 ARG HA 3.710 . 3.710 3.111 2.519 3.468 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
512 1 16 ASN H 1 27 ARG QD 5.120 . 5.120 4.297 3.130 5.472 0.352 40 0 "[ . 1 . 2 . 3 . 4]" 1
513 1 16 ASN H 1 28 LYS H 4.860 . 4.860 4.792 4.206 5.004 0.144 39 0 "[ . 1 . 2 . 3 . 4]" 1
514 1 16 ASN HA 1 17 VAL H 3.080 . 3.080 2.257 2.125 2.449 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
515 1 16 ASN HA 1 17 VAL QG 4.170 . 4.170 3.583 3.366 3.733 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
516 1 16 ASN HA 1 26 PHE H 5.500 . 5.500 4.839 4.536 5.271 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
517 1 16 ASN QB 1 17 VAL H 4.210 . 4.210 3.451 2.857 3.722 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
518 1 16 ASN QB 1 26 PHE H 3.710 . 3.710 2.712 2.010 3.379 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
519 1 16 ASN QB 1 26 PHE HZ 4.120 . 4.120 2.762 2.357 3.092 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
520 1 16 ASN HB2 1 26 PHE H 4.510 . 4.510 4.261 3.428 4.561 0.051 23 0 "[ . 1 . 2 . 3 . 4]" 1
521 1 16 ASN HB2 1 26 PHE HZ 4.710 . 4.710 2.876 2.410 3.567 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
522 1 16 ASN HB3 1 26 PHE H 4.510 . 4.510 2.746 2.024 3.483 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
523 1 16 ASN HB3 1 26 PHE HZ 4.710 . 4.710 3.705 3.036 4.499 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
524 1 16 ASN QD 1 17 VAL HA 5.340 . 5.340 4.503 4.271 4.669 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
525 1 16 ASN QD 1 18 ALA HA 4.900 . 4.900 3.218 2.724 3.748 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
526 1 16 ASN QD 1 18 ALA MB 4.160 . 4.160 3.574 2.989 4.024 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
527 1 16 ASN QD 1 23 GLU QG 3.850 . 3.850 2.539 2.186 2.728 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
528 1 16 ASN QD 1 24 LEU H 5.100 . 5.100 4.264 3.789 4.727 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
529 1 16 ASN QD 1 25 SER HA 4.590 . 4.590 3.051 2.708 3.697 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
530 1 16 ASN QD 1 26 PHE H 3.960 . 3.960 3.777 2.963 3.990 0.030 24 0 "[ . 1 . 2 . 3 . 4]" 1
531 1 16 ASN QD 1 57 VAL HA 4.800 . 4.800 3.898 3.648 4.454 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
532 1 16 ASN QD 1 57 VAL MG1 3.880 . 3.880 3.489 3.257 3.908 0.028 21 0 "[ . 1 . 2 . 3 . 4]" 1
533 1 16 ASN QD 1 58 PRO HD2 4.510 . 4.510 3.313 2.933 3.907 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
534 1 16 ASN QD 1 58 PRO HD3 5.340 . 5.340 3.024 2.678 3.611 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
535 1 16 ASN HD21 1 18 ALA MB 4.770 . 4.770 4.047 3.030 4.599 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
536 1 16 ASN HD21 1 57 VAL MG1 4.570 . 4.570 4.390 3.996 4.658 0.088 24 0 "[ . 1 . 2 . 3 . 4]" 1
537 1 16 ASN HD22 1 18 ALA MB 4.770 . 4.770 4.140 3.516 4.841 0.071 35 0 "[ . 1 . 2 . 3 . 4]" 1
538 1 16 ASN HD22 1 57 VAL MG1 4.570 . 4.570 3.710 3.393 4.520 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
539 1 17 VAL H 1 17 VAL HB 3.280 . 3.280 2.667 2.478 3.322 0.042 35 0 "[ . 1 . 2 . 3 . 4]" 1
540 1 17 VAL H 1 17 VAL QG 3.360 . 3.360 2.713 2.206 2.934 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
541 1 17 VAL H 1 18 ALA H 4.230 . 4.230 4.251 4.136 4.331 0.101 39 0 "[ . 1 . 2 . 3 . 4]" 1
542 1 17 VAL HA 1 17 VAL QG 2.640 . 2.640 2.170 2.126 2.367 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
543 1 17 VAL HA 1 18 ALA H 2.660 . 2.660 2.157 2.068 2.270 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
544 1 17 VAL HA 1 18 ALA HA 4.870 . 4.870 4.404 4.327 4.467 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
545 1 17 VAL HA 1 18 ALA MB 4.420 . 4.420 3.985 3.898 4.071 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
546 1 17 VAL HA 1 25 SER HA 4.640 . 4.640 3.661 3.075 4.239 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
547 1 17 VAL HB 1 18 ALA H 4.470 . 4.470 4.212 4.035 4.297 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
548 1 17 VAL QG 1 18 ALA H 3.230 . 3.230 2.727 2.478 2.890 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
549 1 17 VAL QG 1 18 ALA HA 4.480 . 4.480 4.064 3.864 4.192 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
550 1 17 VAL QG 1 18 ALA MB 4.190 . 4.190 3.784 3.632 3.935 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
551 1 17 VAL QG 1 19 GLU HA 4.520 . 4.520 4.033 3.727 4.319 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
552 1 17 VAL QG 1 19 GLU QG 4.400 . 4.400 3.217 2.413 4.653 0.253 36 0 "[ . 1 . 2 . 3 . 4]" 1
553 1 17 VAL QG 1 25 SER HA 5.010 . 5.010 4.696 4.273 5.073 0.063 23 0 "[ . 1 . 2 . 3 . 4]" 1
554 1 17 VAL QG 1 25 SER QB 4.820 . 4.820 3.956 3.407 4.663 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
555 1 18 ALA H 1 18 ALA MB 2.780 . 2.780 2.241 2.141 2.366 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
556 1 18 ALA H 1 19 GLU H 4.590 . 4.590 4.541 4.439 4.598 0.008 6 0 "[ . 1 . 2 . 3 . 4]" 1
557 1 18 ALA H 1 25 SER HA 3.850 . 3.850 3.205 2.728 3.641 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
558 1 18 ALA H 1 25 SER HB2 4.830 . 4.830 3.389 1.976 4.834 0.004 14 0 "[ . 1 . 2 . 3 . 4]" 1
559 1 18 ALA H 1 25 SER QB 3.970 . 3.970 2.484 1.898 3.393 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
560 1 18 ALA H 1 25 SER HB3 4.830 . 4.830 3.088 1.906 4.780 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
561 1 18 ALA HA 1 19 GLU H 2.960 . 2.960 2.171 2.127 2.240 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
562 1 18 ALA HA 1 19 GLU QB 4.790 . 4.790 4.353 4.210 4.596 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
563 1 18 ALA HA 1 19 GLU QG 4.600 . 4.600 3.742 3.523 3.949 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
564 1 18 ALA HA 1 20 SER H 3.820 . 3.820 3.507 3.269 3.793 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
565 1 18 ALA HA 1 23 GLU HB2 4.570 . 4.570 4.201 3.979 4.458 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
566 1 18 ALA HA 1 23 GLU QB 3.930 . 3.930 2.856 2.582 3.155 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
567 1 18 ALA HA 1 23 GLU HB3 4.570 . 4.570 2.907 2.613 3.227 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
568 1 18 ALA HA 1 23 GLU HG2 4.590 . 4.590 2.762 2.446 3.139 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
569 1 18 ALA HA 1 23 GLU QG 3.920 . 3.920 2.723 2.423 3.075 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
570 1 18 ALA HA 1 23 GLU HG3 4.590 . 4.590 4.138 3.917 4.396 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
571 1 18 ALA HA 1 24 LEU H 5.490 . 5.490 5.328 4.947 5.533 0.043 19 0 "[ . 1 . 2 . 3 . 4]" 1
572 1 18 ALA HA 1 25 SER QB 5.330 . 5.330 4.444 4.015 5.354 0.024 10 0 "[ . 1 . 2 . 3 . 4]" 1
573 1 18 ALA MB 1 19 GLU H 3.420 . 3.420 3.072 2.801 3.385 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
574 1 18 ALA MB 1 19 GLU HA 4.500 . 4.500 4.193 4.029 4.338 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
575 1 18 ALA MB 1 19 GLU QB 5.320 . 5.320 4.805 4.652 4.987 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
576 1 18 ALA MB 1 19 GLU QG 4.750 . 4.750 4.552 4.287 4.774 0.024 27 0 "[ . 1 . 2 . 3 . 4]" 1
577 1 18 ALA MB 1 20 SER H 3.500 . 3.500 2.854 2.517 3.482 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
578 1 18 ALA MB 1 23 GLU H 4.110 . 4.110 3.701 3.535 4.023 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
579 1 18 ALA MB 1 23 GLU HA 4.710 . 4.710 4.261 4.023 4.398 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
580 1 18 ALA MB 1 23 GLU QB 3.250 . 3.250 2.258 2.121 2.448 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
581 1 18 ALA MB 1 23 GLU HG2 4.270 . 4.270 2.788 2.394 2.970 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
582 1 18 ALA MB 1 23 GLU QG 3.570 . 3.570 2.748 2.372 2.919 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
583 1 18 ALA MB 1 23 GLU HG3 4.270 . 4.270 4.163 3.863 4.301 0.031 2 0 "[ . 1 . 2 . 3 . 4]" 1
584 1 18 ALA MB 1 24 LEU H 4.310 . 4.310 4.029 3.594 4.345 0.035 23 0 "[ . 1 . 2 . 3 . 4]" 1
585 1 18 ALA MB 1 25 SER H 3.720 . 3.720 2.990 2.708 3.282 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
586 1 18 ALA MB 1 25 SER HA 3.750 . 3.750 2.873 2.303 3.245 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
587 1 18 ALA MB 1 25 SER QB 3.360 . 3.360 2.423 2.093 3.418 0.058 3 0 "[ . 1 . 2 . 3 . 4]" 1
588 1 19 GLU H 1 19 GLU HB2 3.930 . 3.930 2.593 2.408 3.780 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
589 1 19 GLU H 1 19 GLU QB 3.320 . 3.320 2.505 2.377 3.056 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
590 1 19 GLU H 1 19 GLU HB3 3.930 . 3.930 3.675 3.105 3.801 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
591 1 19 GLU H 1 19 GLU QG 3.620 . 3.620 2.739 1.988 3.138 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
592 1 19 GLU H 1 20 SER H 2.910 . 2.910 2.115 1.789 2.446 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
593 1 19 GLU H 1 23 GLU H 5.230 . 5.230 5.105 4.883 5.251 0.021 38 0 "[ . 1 . 2 . 3 . 4]" 1
594 1 19 GLU H 1 23 GLU HB2 4.360 . 4.360 3.824 3.592 4.248 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
595 1 19 GLU H 1 23 GLU QB 3.680 . 3.680 2.865 2.699 3.121 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
596 1 19 GLU H 1 23 GLU HB3 4.360 . 4.360 2.961 2.783 3.211 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
597 1 19 GLU H 1 23 GLU QG 4.510 . 4.510 3.826 3.642 4.200 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
598 1 19 GLU HA 1 19 GLU QG 3.400 . 3.400 2.620 2.384 3.361 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
599 1 19 GLU HB2 1 20 SER H 4.350 . 4.350 3.574 2.671 4.252 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
600 1 19 GLU HB3 1 20 SER H 4.350 . 4.350 4.266 3.782 4.390 0.040 36 0 "[ . 1 . 2 . 3 . 4]" 1
601 1 19 GLU QG 1 20 SER H 4.750 . 4.750 4.236 2.460 4.590 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
602 1 20 SER H 1 20 SER HB2 3.810 . 3.810 2.989 2.228 3.847 0.037 4 0 "[ . 1 . 2 . 3 . 4]" 1
603 1 20 SER H 1 20 SER QB 3.320 . 3.320 2.644 2.197 3.176 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
604 1 20 SER H 1 20 SER HB3 3.810 . 3.810 3.343 2.404 3.863 0.053 15 0 "[ . 1 . 2 . 3 . 4]" 1
605 1 20 SER H 1 23 GLU HB2 3.830 . 3.830 3.448 2.875 3.829 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
606 1 20 SER H 1 23 GLU QB 3.250 . 3.250 2.493 2.289 2.681 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
607 1 20 SER H 1 23 GLU HB3 3.830 . 3.830 2.562 2.345 2.751 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
608 1 20 SER HA 1 21 PRO HD2 3.510 . 3.510 2.581 2.455 3.156 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
609 1 20 SER HA 1 21 PRO QD 3.000 . 3.000 2.282 2.064 2.373 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
610 1 20 SER HA 1 21 PRO HD3 3.510 . 3.510 2.575 2.092 2.666 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
611 1 20 SER HA 1 21 PRO HG2 4.730 . 4.730 4.646 4.587 4.711 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
612 1 20 SER HA 1 21 PRO QG 4.150 . 4.150 4.159 3.842 4.225 0.075 40 0 "[ . 1 . 2 . 3 . 4]" 1
613 1 20 SER HA 1 21 PRO HG3 4.730 . 4.730 4.701 4.078 4.776 0.046 40 0 "[ . 1 . 2 . 3 . 4]" 1
614 1 20 SER HA 1 23 GLU H 4.820 . 4.820 4.563 4.277 4.745 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
615 1 20 SER QB 1 22 ASP H 3.740 . 3.740 2.864 2.392 3.434 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
616 1 20 SER QB 1 23 GLU H 3.970 . 3.970 2.832 2.202 3.686 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
617 1 20 SER HB2 1 23 GLU H 4.550 . 4.550 3.550 2.233 4.587 0.037 40 0 "[ . 1 . 2 . 3 . 4]" 1
618 1 20 SER HB3 1 23 GLU H 4.550 . 4.550 3.365 2.618 4.562 0.012 4 0 "[ . 1 . 2 . 3 . 4]" 1
619 1 21 PRO HA 1 23 GLU H 4.370 . 4.370 3.752 3.588 3.872 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
620 1 21 PRO QB 1 22 ASP H 3.780 . 3.780 3.415 2.731 3.586 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
621 1 21 PRO HB2 1 22 ASP H 4.650 . 4.650 3.593 2.774 3.797 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
622 1 21 PRO HB3 1 22 ASP H 4.650 . 4.650 4.286 4.091 4.466 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
623 1 21 PRO QD 1 22 ASP H 3.870 . 3.870 2.723 2.479 2.991 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
624 1 21 PRO HD2 1 22 ASP H 4.740 . 4.740 2.777 2.514 3.065 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
625 1 21 PRO HD3 1 22 ASP H 4.740 . 4.740 3.932 3.780 4.165 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
626 1 21 PRO QG 1 22 ASP H 4.190 . 4.190 2.591 2.400 3.910 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
627 1 22 ASP H 1 22 ASP HB2 3.910 . 3.910 2.613 2.296 3.641 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
628 1 22 ASP H 1 22 ASP HB3 3.910 . 3.910 3.481 2.504 3.700 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
629 1 22 ASP H 1 23 GLU H 3.040 . 3.040 2.444 2.293 2.578 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
630 1 22 ASP H 1 23 GLU QB 4.690 . 4.690 4.111 3.935 4.369 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
631 1 22 ASP QB 1 23 GLU H 4.190 . 4.190 3.099 2.905 3.681 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
632 1 22 ASP QB 1 56 ILE MD 4.110 . 4.110 3.016 2.598 3.542 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
633 1 22 ASP QB 1 56 ILE MG 4.350 . 4.350 3.385 2.895 4.124 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
634 1 22 ASP HB2 1 23 GLU H 4.790 . 4.790 3.266 2.970 4.162 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
635 1 22 ASP HB2 1 56 ILE MD 4.820 . 4.820 3.346 2.654 4.526 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
636 1 22 ASP HB3 1 23 GLU H 4.790 . 4.790 4.123 3.116 4.431 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
637 1 22 ASP HB3 1 56 ILE MD 4.820 . 4.820 3.597 2.995 4.755 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
638 1 23 GLU H 1 23 GLU HB2 3.280 . 3.280 2.639 2.509 2.769 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
639 1 23 GLU H 1 23 GLU HB3 3.280 . 3.280 2.548 2.464 2.625 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
640 1 23 GLU H 1 23 GLU HG2 4.740 . 4.740 4.496 4.461 4.551 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
641 1 23 GLU H 1 23 GLU QG 4.130 . 4.130 4.016 3.959 4.073 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
642 1 23 GLU H 1 23 GLU HG3 4.740 . 4.740 4.521 4.402 4.612 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
643 1 23 GLU H 1 24 LEU H 4.800 . 4.800 4.567 4.505 4.629 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
644 1 23 GLU H 1 56 ILE HG12 4.980 . 4.980 4.295 4.013 4.605 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
645 1 23 GLU HA 1 24 LEU H 3.050 . 3.050 2.171 2.117 2.274 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
646 1 23 GLU HA 1 56 ILE H 3.430 . 3.430 2.636 2.370 2.909 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
647 1 23 GLU HA 1 56 ILE MD 4.010 . 4.010 3.568 3.451 3.716 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
648 1 23 GLU HA 1 56 ILE HG12 4.320 . 4.320 2.548 2.250 3.077 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
649 1 23 GLU HA 1 56 ILE HG13 4.030 . 4.030 2.527 2.274 2.903 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
650 1 23 GLU HA 1 56 ILE MG 4.770 . 4.770 4.365 4.108 4.709 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
651 1 23 GLU QB 1 24 LEU H 4.370 . 4.370 3.647 3.563 3.763 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
652 1 23 GLU QB 1 56 ILE MD 4.550 . 4.550 3.393 2.994 3.824 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
653 1 23 GLU QB 1 56 ILE HG13 4.790 . 4.790 3.524 3.116 3.859 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
654 1 23 GLU QG 1 45 TRP HZ3 3.950 . 3.950 2.314 2.085 2.980 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
655 1 23 GLU QG 1 56 ILE MD 5.340 . 5.340 3.751 3.390 4.108 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
656 1 23 GLU QG 1 56 ILE HG13 4.910 . 4.910 2.843 2.502 3.302 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
657 1 23 GLU HG2 1 24 LEU H 3.760 . 3.760 2.796 2.575 3.194 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
658 1 23 GLU HG2 1 45 TRP HZ3 4.660 . 4.660 3.823 3.514 4.480 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
659 1 23 GLU HG3 1 24 LEU H 3.760 . 3.760 2.938 2.793 3.191 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
660 1 23 GLU HG3 1 45 TRP HZ3 4.660 . 4.660 2.334 2.097 3.025 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
661 1 24 LEU H 1 24 LEU HB2 3.380 . 3.380 2.255 2.157 2.441 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
662 1 24 LEU H 1 24 LEU HB3 3.760 . 3.760 3.566 3.500 3.646 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
663 1 24 LEU H 1 24 LEU MD1 4.550 . 4.550 3.549 3.409 3.765 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
664 1 24 LEU H 1 24 LEU MD2 4.290 . 4.290 3.936 3.854 4.035 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
665 1 24 LEU H 1 24 LEU HG 3.950 . 3.950 2.788 2.585 2.961 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
666 1 24 LEU H 1 26 PHE QD 5.500 . 5.500 4.788 4.580 5.029 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
667 1 24 LEU H 1 45 TRP HZ3 5.500 . 5.500 4.508 4.107 4.791 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
668 1 24 LEU H 1 55 GLY HA2 5.500 . 5.500 5.485 5.406 5.524 0.024 5 0 "[ . 1 . 2 . 3 . 4]" 1
669 1 24 LEU H 1 55 GLY HA3 4.480 . 4.480 4.090 3.972 4.363 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
670 1 24 LEU H 1 56 ILE H 3.810 . 3.810 3.145 2.930 3.429 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
671 1 24 LEU H 1 56 ILE MD 5.020 . 5.020 5.030 4.911 5.168 0.148 19 0 "[ . 1 . 2 . 3 . 4]" 1
672 1 24 LEU H 1 56 ILE HG12 4.910 . 4.910 4.153 3.910 4.558 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
673 1 24 LEU H 1 56 ILE HG13 4.560 . 4.560 3.708 3.542 3.898 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
674 1 24 LEU H 1 57 VAL HA 4.630 . 4.630 3.645 3.503 3.865 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
675 1 24 LEU H 1 57 VAL MG1 3.780 . 3.780 3.011 2.832 3.163 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
676 1 24 LEU HA 1 24 LEU MD1 3.910 . 3.910 3.868 3.812 3.902 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
677 1 24 LEU HA 1 24 LEU MD2 2.860 . 2.860 2.150 2.083 2.208 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
678 1 24 LEU HA 1 24 LEU HG 4.080 . 4.080 2.834 2.787 2.914 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
679 1 24 LEU HA 1 25 SER H 2.710 . 2.710 2.116 2.052 2.187 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
680 1 24 LEU HA 1 53 ARG QD 4.870 . 4.870 4.460 3.671 4.978 0.108 11 0 "[ . 1 . 2 . 3 . 4]" 1
681 1 24 LEU HB2 1 24 LEU MD1 2.960 . 2.960 2.265 2.226 2.315 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
682 1 24 LEU HB2 1 25 SER H 4.530 . 4.530 4.243 4.099 4.325 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
683 1 24 LEU HB2 1 26 PHE QD 4.610 . 4.610 3.428 3.183 3.596 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
684 1 24 LEU HB2 1 57 VAL H 5.500 . 5.500 5.072 4.899 5.416 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
685 1 24 LEU HB2 1 57 VAL MG1 3.260 . 3.260 1.919 1.889 1.961 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
686 1 24 LEU HB2 1 57 VAL MG2 3.990 . 3.990 3.915 3.826 4.097 0.107 40 0 "[ . 1 . 2 . 3 . 4]" 1
687 1 24 LEU HB3 1 24 LEU MD1 3.370 . 3.370 2.432 2.293 2.534 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
688 1 24 LEU HB3 1 24 LEU MD2 3.600 . 3.600 2.342 2.281 2.430 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
689 1 24 LEU HB3 1 25 SER H 3.640 . 3.640 3.292 3.125 3.407 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
690 1 24 LEU HB3 1 26 PHE HB3 4.620 . 4.620 3.916 3.619 4.193 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
691 1 24 LEU HB3 1 26 PHE QD 4.690 . 4.690 3.292 2.850 3.634 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
692 1 24 LEU HB3 1 50 LEU MD1 5.500 . 5.500 4.707 2.537 5.440 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
693 1 24 LEU HB3 1 50 LEU QD 4.100 . 4.100 2.537 2.232 2.945 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
694 1 24 LEU HB3 1 50 LEU MD2 5.500 . 5.500 2.840 2.240 5.208 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
695 1 24 LEU HB3 1 57 VAL MG1 3.680 . 3.680 2.958 2.829 3.209 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
696 1 24 LEU HB3 1 57 VAL MG2 4.820 . 4.820 4.944 4.877 5.192 0.372 39 0 "[ . 1 . 2 . 3 . 4]" 1
697 1 24 LEU MD1 1 25 SER H 5.110 . 5.110 5.062 4.874 5.129 0.019 36 0 "[ . 1 . 2 . 3 . 4]" 1
698 1 24 LEU MD1 1 26 PHE QD 5.280 . 5.280 4.460 4.138 4.622 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
699 1 24 LEU MD1 1 48 CYS H 4.030 . 4.030 3.003 2.864 3.167 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
700 1 24 LEU MD1 1 48 CYS HB2 3.500 . 3.500 2.397 2.225 2.718 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
701 1 24 LEU MD1 1 48 CYS HB3 4.330 . 4.330 3.338 3.155 3.711 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
702 1 24 LEU MD1 1 49 SER H 4.680 . 4.680 4.201 3.958 4.455 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
703 1 24 LEU MD1 1 49 SER HA 3.850 . 3.850 3.321 3.028 3.550 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
704 1 24 LEU MD1 1 50 LEU H 3.590 . 3.590 3.230 2.913 3.463 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
705 1 24 LEU MD1 1 50 LEU HA 4.800 . 4.800 4.638 4.388 4.826 0.026 14 0 "[ . 1 . 2 . 3 . 4]" 1
706 1 24 LEU MD1 1 50 LEU HB2 3.640 . 3.640 2.883 2.552 3.119 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
707 1 24 LEU MD1 1 50 LEU QB 3.130 . 3.130 2.366 2.189 2.599 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
708 1 24 LEU MD1 1 50 LEU HB3 3.640 . 3.640 2.524 2.319 2.882 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
709 1 24 LEU MD1 1 50 LEU QD 4.130 . 4.130 3.090 2.777 3.542 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
710 1 24 LEU MD1 1 50 LEU HG 5.040 . 5.040 4.560 3.593 4.999 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
711 1 24 LEU MD1 1 53 ARG H 5.460 . 5.460 5.259 4.921 5.467 0.007 20 0 "[ . 1 . 2 . 3 . 4]" 1
712 1 24 LEU MD1 1 53 ARG QD 5.500 . 5.500 5.084 4.506 5.533 0.033 35 0 "[ . 1 . 2 . 3 . 4]" 1
713 1 24 LEU MD1 1 54 GLN HA 3.670 . 3.670 3.009 2.790 3.351 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
714 1 24 LEU MD1 1 55 GLY H 3.200 . 3.200 2.432 2.213 2.881 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
715 1 24 LEU MD1 1 55 GLY HA2 4.540 . 4.540 4.038 3.834 4.145 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
716 1 24 LEU MD1 1 55 GLY HA3 3.950 . 3.950 3.060 2.735 3.206 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
717 1 24 LEU MD1 1 56 ILE H 3.520 . 3.520 3.596 3.538 3.855 0.335 38 0 "[ . 1 . 2 . 3 . 4]" 1
718 1 24 LEU MD1 1 56 ILE HA 4.980 . 4.980 3.541 3.339 3.786 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
719 1 24 LEU MD1 1 57 VAL H 4.810 . 4.810 4.277 4.092 4.398 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
720 1 24 LEU MD1 1 57 VAL HB 5.210 . 5.210 4.784 4.651 4.950 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
721 1 24 LEU MD1 1 57 VAL MG1 3.120 . 3.120 2.186 2.065 2.315 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
722 1 24 LEU MD1 1 57 VAL MG2 3.110 . 3.110 2.987 2.750 3.160 0.050 6 0 "[ . 1 . 2 . 3 . 4]" 1
723 1 24 LEU MD2 1 25 SER H 3.400 . 3.400 3.408 3.150 3.604 0.204 39 0 "[ . 1 . 2 . 3 . 4]" 1
724 1 24 LEU MD2 1 49 SER HA 4.560 . 4.560 4.069 3.635 4.479 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
725 1 24 LEU MD2 1 50 LEU H 4.210 . 4.210 3.185 2.795 3.522 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
726 1 24 LEU MD2 1 50 LEU HB2 3.810 . 3.810 3.740 3.438 3.853 0.043 39 0 "[ . 1 . 2 . 3 . 4]" 1
727 1 24 LEU MD2 1 50 LEU QB 3.260 . 3.260 2.276 2.094 2.457 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
728 1 24 LEU MD2 1 50 LEU HB3 3.810 . 3.810 2.296 2.106 2.487 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
729 1 24 LEU MD2 1 50 LEU QD 3.550 . 3.550 2.814 2.439 3.067 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
730 1 24 LEU MD2 1 50 LEU HG 5.310 . 5.310 4.017 3.570 4.421 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
731 1 24 LEU MD2 1 53 ARG H 4.270 . 4.270 4.047 3.686 4.319 0.049 26 0 "[ . 1 . 2 . 3 . 4]" 1
732 1 24 LEU MD2 1 53 ARG HB2 4.480 . 4.480 3.580 2.273 4.468 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
733 1 24 LEU MD2 1 53 ARG HB3 4.480 . 4.480 4.038 2.570 4.642 0.162 36 0 "[ . 1 . 2 . 3 . 4]" 1
734 1 24 LEU MD2 1 53 ARG QD 3.550 . 3.550 2.820 2.200 3.331 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
735 1 24 LEU MD2 1 53 ARG QG 4.910 . 4.910 2.604 1.987 4.096 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
736 1 24 LEU MD2 1 54 GLN HA 4.110 . 4.110 3.382 2.974 3.717 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
737 1 24 LEU MD2 1 55 GLY H 4.670 . 4.670 3.556 3.263 3.801 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
738 1 24 LEU MD2 1 55 GLY HA3 3.570 . 3.570 3.039 2.641 3.235 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
739 1 24 LEU MD2 1 56 ILE H 4.420 . 4.420 4.479 4.311 4.605 0.185 38 0 "[ . 1 . 2 . 3 . 4]" 1
740 1 24 LEU HG 1 25 SER H 4.820 . 4.820 4.837 4.736 4.870 0.050 38 0 "[ . 1 . 2 . 3 . 4]" 1
741 1 24 LEU HG 1 55 GLY H 4.210 . 4.210 3.695 3.496 3.982 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
742 1 24 LEU HG 1 55 GLY HA2 4.050 . 4.050 3.877 3.662 3.990 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
743 1 24 LEU HG 1 55 GLY HA3 3.750 . 3.750 2.170 2.010 2.277 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
744 1 24 LEU HG 1 56 ILE H 4.320 . 4.320 3.030 2.870 3.204 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
745 1 24 LEU HG 1 56 ILE HA 5.500 . 5.500 4.682 4.454 4.835 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
746 1 24 LEU HG 1 57 VAL MG1 4.190 . 4.190 3.619 3.451 3.680 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
747 1 24 LEU HG 1 57 VAL MG2 5.290 . 5.290 4.974 4.758 5.136 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
748 1 25 SER H 1 25 SER HB2 3.730 . 3.730 3.083 2.269 3.629 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
749 1 25 SER H 1 25 SER QB 3.230 . 3.230 2.641 2.211 2.964 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
750 1 25 SER H 1 25 SER HB3 3.730 . 3.730 2.972 2.439 3.649 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
751 1 25 SER H 1 26 PHE H 5.080 . 5.080 4.560 4.273 4.610 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
752 1 25 SER H 1 50 LEU QD 4.640 . 4.640 3.931 3.325 4.281 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
753 1 25 SER HA 1 26 PHE H 2.900 . 2.900 2.266 2.181 2.327 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
754 1 25 SER QB 1 26 PHE H 3.990 . 3.990 3.323 2.864 3.840 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
755 1 25 SER HB2 1 26 PHE H 4.760 . 4.760 3.727 2.950 4.528 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
756 1 25 SER HB3 1 26 PHE H 4.760 . 4.760 3.904 2.934 4.487 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
757 1 26 PHE H 1 26 PHE QD 4.650 . 4.650 3.222 2.726 3.374 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
758 1 26 PHE H 1 27 ARG H 4.700 . 4.700 4.406 4.358 4.504 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
759 1 26 PHE H 1 32 MET ME 5.500 . 5.500 5.435 5.048 5.592 0.092 12 0 "[ . 1 . 2 . 3 . 4]" 1
760 1 26 PHE H 1 50 LEU QD 4.650 . 4.650 4.456 3.760 4.660 0.010 15 0 "[ . 1 . 2 . 3 . 4]" 1
761 1 26 PHE HA 1 27 ARG H 3.440 . 3.440 2.412 2.315 2.562 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
762 1 26 PHE HA 1 32 MET ME 5.000 . 5.000 4.669 4.466 4.975 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
763 1 26 PHE HA 1 50 LEU MD1 4.880 . 4.880 4.307 2.778 4.837 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
764 1 26 PHE HA 1 50 LEU QD 3.690 . 3.690 2.942 2.675 3.121 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
765 1 26 PHE HA 1 50 LEU MD2 4.880 . 4.880 3.184 2.750 4.597 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
766 1 26 PHE HB2 1 27 ARG H 3.260 . 3.260 2.370 2.222 2.492 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
767 1 26 PHE HB2 1 30 ASP HB2 4.490 . 4.490 2.603 2.417 2.876 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
768 1 26 PHE HB2 1 30 ASP HB3 4.950 . 4.950 3.322 3.028 3.474 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
769 1 26 PHE HB2 1 32 MET ME 3.590 . 3.590 2.837 2.624 3.105 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
770 1 26 PHE HB2 1 50 LEU MD1 4.410 . 4.410 3.768 2.841 4.214 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
771 1 26 PHE HB2 1 50 LEU QD 3.370 . 3.370 2.846 2.617 3.013 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
772 1 26 PHE HB2 1 50 LEU MD2 4.410 . 4.410 3.030 2.652 3.765 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
773 1 26 PHE HB3 1 27 ARG H 3.850 . 3.850 3.727 3.621 3.848 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
774 1 26 PHE HB3 1 32 MET ME 3.530 . 3.530 2.969 2.734 3.273 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
775 1 26 PHE HB3 1 50 LEU MD1 4.390 . 4.390 3.571 2.215 4.190 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
776 1 26 PHE HB3 1 50 LEU QD 3.210 . 3.210 2.102 1.953 2.320 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
777 1 26 PHE HB3 1 50 LEU MD2 4.390 . 4.390 2.290 1.968 3.810 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
778 1 26 PHE QD 1 27 ARG H 4.240 . 4.240 3.248 2.937 3.574 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
779 1 26 PHE QD 1 32 MET ME 3.690 . 3.690 3.016 2.924 3.102 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
780 1 26 PHE QD 1 50 LEU QD 4.480 . 4.480 3.286 2.939 3.615 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
781 1 26 PHE QD 1 57 VAL HB 4.910 . 4.910 4.329 4.046 4.846 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
782 1 26 PHE QD 1 57 VAL MG1 3.930 . 3.930 2.435 2.293 2.751 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
783 1 26 PHE QD 1 57 VAL MG2 5.310 . 5.310 4.727 4.544 4.996 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
784 1 26 PHE QD 1 58 PRO HD2 5.090 . 5.090 4.487 4.282 5.132 0.042 26 0 "[ . 1 . 2 . 3 . 4]" 1
785 1 26 PHE QD 1 62 LEU QD 4.880 . 4.880 4.124 3.722 4.658 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
786 1 26 PHE QE 1 28 LYS HA 5.200 . 5.200 4.454 4.157 4.721 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
787 1 26 PHE QE 1 32 MET ME 3.840 . 3.840 3.647 3.331 3.787 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
788 1 26 PHE QE 1 57 VAL HB 3.790 . 3.790 2.713 2.471 3.097 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
789 1 26 PHE QE 1 57 VAL MG1 3.200 . 3.200 2.067 1.911 2.173 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
790 1 26 PHE QE 1 58 PRO HD2 4.690 . 4.690 2.127 1.923 2.810 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
791 1 26 PHE QE 1 62 LEU MD1 4.700 . 4.700 3.733 2.874 4.545 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
792 1 26 PHE QE 1 62 LEU QD 3.860 . 3.860 3.433 2.846 3.980 0.120 24 0 "[ . 1 . 2 . 3 . 4]" 1
793 1 26 PHE QE 1 62 LEU MD2 4.700 . 4.700 4.207 3.562 4.708 0.008 34 0 "[ . 1 . 2 . 3 . 4]" 1
794 1 26 PHE HZ 1 32 MET ME 4.590 . 4.590 4.429 3.940 4.649 0.059 21 0 "[ . 1 . 2 . 3 . 4]" 1
795 1 26 PHE HZ 1 57 VAL HB 4.280 . 4.280 3.622 3.345 3.846 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
796 1 26 PHE HZ 1 57 VAL MG1 4.000 . 4.000 3.920 3.636 4.039 0.039 38 0 "[ . 1 . 2 . 3 . 4]" 1
797 1 26 PHE HZ 1 58 PRO HD2 4.350 . 4.350 2.720 2.415 2.914 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
798 1 26 PHE HZ 1 58 PRO HG2 4.860 . 4.860 2.939 2.653 3.665 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
799 1 26 PHE HZ 1 61 ARG HB2 5.480 . 5.480 4.587 2.454 5.492 0.012 26 0 "[ . 1 . 2 . 3 . 4]" 1
800 1 26 PHE HZ 1 61 ARG HD2 4.960 . 4.960 2.918 2.290 5.049 0.089 17 0 "[ . 1 . 2 . 3 . 4]" 1
801 1 26 PHE HZ 1 61 ARG QD 4.330 . 4.330 2.719 2.257 4.235 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
802 1 26 PHE HZ 1 61 ARG HD3 4.960 . 4.960 3.721 2.985 4.548 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
803 1 26 PHE HZ 1 61 ARG QG 4.730 . 4.730 2.744 2.164 4.431 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
804 1 26 PHE HZ 1 62 LEU MD1 4.740 . 4.740 3.812 2.766 4.682 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
805 1 26 PHE HZ 1 62 LEU QD 4.010 . 4.010 3.542 2.747 4.207 0.197 24 0 "[ . 1 . 2 . 3 . 4]" 1
806 1 26 PHE HZ 1 62 LEU MD2 4.740 . 4.740 4.383 3.757 4.794 0.054 17 0 "[ . 1 . 2 . 3 . 4]" 1
807 1 27 ARG H 1 27 ARG HB2 3.870 . 3.870 2.482 2.278 2.937 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
808 1 27 ARG H 1 27 ARG QB 3.180 . 3.180 2.389 2.246 2.589 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
809 1 27 ARG H 1 27 ARG HB3 3.870 . 3.870 3.352 2.597 3.777 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
810 1 27 ARG H 1 27 ARG QD 5.000 . 5.000 4.098 3.069 5.006 0.006 24 0 "[ . 1 . 2 . 3 . 4]" 1
811 1 27 ARG H 1 27 ARG HG2 5.050 . 5.050 4.214 2.831 4.926 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
812 1 27 ARG H 1 27 ARG QG 4.320 . 4.320 3.751 2.779 4.223 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
813 1 27 ARG H 1 27 ARG HG3 5.050 . 5.050 4.347 3.461 4.669 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
814 1 27 ARG H 1 28 LYS H 4.680 . 4.680 4.504 4.419 4.544 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
815 1 27 ARG H 1 30 ASP H 4.250 . 4.250 4.032 3.870 4.207 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
816 1 27 ARG H 1 30 ASP HA 5.500 . 5.500 5.064 4.877 5.219 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
817 1 27 ARG H 1 30 ASP HB2 4.070 . 4.070 3.079 2.815 3.281 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
818 1 27 ARG H 1 30 ASP HB3 4.390 . 4.390 3.968 3.739 4.170 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
819 1 27 ARG H 1 32 MET ME 4.690 . 4.690 4.601 4.379 4.735 0.045 40 0 "[ . 1 . 2 . 3 . 4]" 1
820 1 27 ARG H 1 50 LEU MD1 5.140 . 5.140 4.788 3.971 5.179 0.039 14 0 "[ . 1 . 2 . 3 . 4]" 1
821 1 27 ARG H 1 50 LEU QD 4.120 . 4.120 3.969 3.686 4.188 0.068 24 0 "[ . 1 . 2 . 3 . 4]" 1
822 1 27 ARG H 1 50 LEU MD2 5.140 . 5.140 4.292 3.841 4.839 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
823 1 27 ARG HA 1 27 ARG QD 3.930 . 3.930 2.653 1.963 3.945 0.015 10 0 "[ . 1 . 2 . 3 . 4]" 1
824 1 27 ARG HA 1 27 ARG HG2 4.020 . 4.020 3.148 2.043 3.809 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
825 1 27 ARG HA 1 27 ARG QG 3.480 . 3.480 2.445 2.018 2.951 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
826 1 27 ARG HA 1 27 ARG HG3 4.020 . 4.020 2.897 2.173 3.831 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
827 1 27 ARG HA 1 28 LYS H 2.960 . 2.960 2.369 2.263 2.478 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
828 1 27 ARG HA 1 28 LYS HA 4.750 . 4.750 4.320 4.207 4.471 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
829 1 27 ARG HA 1 28 LYS HB2 5.280 . 5.280 4.622 4.518 4.774 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
830 1 27 ARG HA 1 28 LYS HB3 5.280 . 5.280 4.795 4.545 4.905 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
831 1 27 ARG QB 1 28 LYS H 3.520 . 3.520 2.674 2.150 3.431 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
832 1 27 ARG QB 1 30 ASP H 4.790 . 4.790 3.995 3.520 4.386 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
833 1 27 ARG HB2 1 27 ARG QD 3.890 . 3.890 2.741 2.164 3.552 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
834 1 27 ARG HB2 1 28 LYS H 4.070 . 4.070 3.901 3.541 4.104 0.034 16 0 "[ . 1 . 2 . 3 . 4]" 1
835 1 27 ARG HB3 1 27 ARG QD 3.890 . 3.890 2.894 2.012 3.553 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
836 1 27 ARG HB3 1 28 LYS H 4.070 . 4.070 2.740 2.164 3.699 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
837 1 27 ARG QD 1 28 LYS H 4.420 . 4.420 3.662 1.640 4.581 0.161 26 0 "[ . 1 . 2 . 3 . 4]" 1
838 1 27 ARG HG2 1 28 LYS H 4.730 . 4.730 3.932 1.922 4.759 0.029 17 0 "[ . 1 . 2 . 3 . 4]" 1
839 1 27 ARG HG3 1 28 LYS H 4.730 . 4.730 3.486 1.984 4.764 0.034 11 0 "[ . 1 . 2 . 3 . 4]" 1
840 1 28 LYS H 1 28 LYS HB2 3.260 . 3.260 2.528 2.429 2.623 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
841 1 28 LYS H 1 28 LYS QB 2.850 . 2.850 2.205 2.121 2.265 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
842 1 28 LYS H 1 28 LYS HB3 3.260 . 3.260 2.432 2.311 2.527 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
843 1 28 LYS H 1 28 LYS QD 4.540 . 4.540 4.305 4.112 4.443 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
844 1 28 LYS H 1 28 LYS HG2 4.710 . 4.710 4.424 4.366 4.493 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
845 1 28 LYS H 1 28 LYS QG 4.110 . 4.110 3.961 3.923 4.032 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
846 1 28 LYS H 1 28 LYS HG3 4.710 . 4.710 4.469 4.410 4.560 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
847 1 28 LYS HA 1 28 LYS QD 4.140 . 4.140 3.986 3.890 4.088 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
848 1 28 LYS HA 1 28 LYS HG2 3.830 . 3.830 3.229 3.031 3.339 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
849 1 28 LYS HA 1 28 LYS QG 3.310 . 3.310 2.497 2.418 2.583 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
850 1 28 LYS HA 1 28 LYS HG3 3.830 . 3.830 2.601 2.494 2.731 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
851 1 28 LYS HA 1 29 GLY H 2.880 . 2.880 2.162 2.127 2.232 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
852 1 28 LYS HA 1 29 GLY HA3 4.440 . 4.440 4.422 4.382 4.459 0.019 15 0 "[ . 1 . 2 . 3 . 4]" 1
853 1 28 LYS HA 1 30 ASP H 3.980 . 3.980 3.547 3.437 3.632 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
854 1 28 LYS QB 1 28 LYS QE 4.360 . 4.360 3.519 3.454 3.619 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
855 1 28 LYS QB 1 29 GLY H 4.140 . 4.140 3.760 3.697 3.812 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
856 1 28 LYS HB2 1 29 GLY H 4.810 . 4.810 4.216 4.130 4.312 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
857 1 28 LYS HB3 1 29 GLY H 4.810 . 4.810 4.226 4.157 4.288 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
858 1 28 LYS QD 1 29 GLY H 5.500 . 5.500 4.817 4.701 4.924 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
859 1 28 LYS QD 1 29 GLY HA3 5.500 . 5.500 5.439 5.235 5.517 0.017 5 0 "[ . 1 . 2 . 3 . 4]" 1
860 1 28 LYS QE 1 28 LYS QG 2.990 . 2.990 2.122 2.072 2.245 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
861 1 28 LYS QE 1 29 GLY H 5.220 . 5.220 4.674 4.393 4.929 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
862 1 28 LYS QE 1 29 GLY HA2 5.340 . 5.340 5.031 4.722 5.374 0.034 5 0 "[ . 1 . 2 . 3 . 4]" 1
863 1 28 LYS QE 1 29 GLY HA3 5.040 . 5.040 5.114 4.991 5.235 0.195 38 0 "[ . 1 . 2 . 3 . 4]" 1
864 1 28 LYS HE2 1 28 LYS HG2 4.060 . 4.060 2.603 2.377 3.630 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
865 1 28 LYS HE2 1 28 LYS HG3 4.060 . 4.060 3.167 2.956 3.815 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
866 1 28 LYS HE3 1 28 LYS HG2 4.060 . 4.060 2.928 2.336 3.267 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
867 1 28 LYS HE3 1 28 LYS HG3 4.060 . 4.060 2.530 2.313 3.024 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
868 1 28 LYS QG 1 29 GLY H 3.390 . 3.390 2.762 2.633 2.919 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
869 1 28 LYS QG 1 29 GLY HA2 4.810 . 4.810 3.649 3.432 3.823 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
870 1 28 LYS QG 1 29 GLY HA3 4.440 . 4.440 3.485 3.424 3.573 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
871 1 28 LYS QG 1 30 ASP H 5.340 . 5.340 4.707 4.536 4.811 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
872 1 28 LYS HG2 1 29 GLY H 3.910 . 3.910 3.182 2.995 3.400 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
873 1 28 LYS HG3 1 29 GLY H 3.910 . 3.910 3.043 2.860 3.381 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
874 1 29 GLY H 1 30 ASP H 3.340 . 3.340 2.737 2.596 2.833 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
875 1 30 ASP H 1 30 ASP HB2 3.200 . 3.200 2.363 2.174 2.453 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
876 1 30 ASP H 1 30 ASP HB3 3.790 . 3.790 3.577 3.473 3.627 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
877 1 30 ASP H 1 31 ILE H 4.540 . 4.540 4.586 4.555 4.612 0.072 19 0 "[ . 1 . 2 . 3 . 4]" 1
878 1 30 ASP H 1 31 ILE MD 5.500 . 5.500 5.263 5.008 5.440 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
879 1 30 ASP H 1 32 MET ME 4.570 . 4.570 4.527 4.237 4.750 0.180 40 0 "[ . 1 . 2 . 3 . 4]" 1
880 1 30 ASP H 1 50 LEU QD 5.440 . 5.440 5.244 5.008 5.448 0.008 25 0 "[ . 1 . 2 . 3 . 4]" 1
881 1 30 ASP HA 1 31 ILE H 2.740 . 2.740 2.166 2.112 2.274 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
882 1 30 ASP HA 1 31 ILE HB 4.800 . 4.800 4.469 4.319 4.591 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
883 1 30 ASP HA 1 31 ILE MD 5.030 . 5.030 4.498 4.366 4.677 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
884 1 30 ASP HA 1 31 ILE HG12 4.570 . 4.570 3.511 3.299 3.787 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
885 1 30 ASP HA 1 32 MET ME 4.820 . 4.820 4.774 4.562 4.928 0.108 38 0 "[ . 1 . 2 . 3 . 4]" 1
886 1 30 ASP HA 1 50 LEU QD 4.650 . 4.650 4.336 4.095 4.603 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
887 1 30 ASP HB2 1 31 ILE H 4.620 . 4.620 4.004 3.764 4.239 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
888 1 30 ASP HB2 1 32 MET ME 3.620 . 3.620 2.890 2.605 3.213 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
889 1 30 ASP HB2 1 50 LEU MD1 4.580 . 4.580 4.008 3.208 4.621 0.041 13 0 "[ . 1 . 2 . 3 . 4]" 1
890 1 30 ASP HB2 1 50 LEU QD 3.760 . 3.760 3.589 3.154 3.766 0.006 25 0 "[ . 1 . 2 . 3 . 4]" 1
891 1 30 ASP HB2 1 50 LEU MD2 4.580 . 4.580 4.168 3.606 4.652 0.072 40 0 "[ . 1 . 2 . 3 . 4]" 1
892 1 30 ASP HB3 1 31 ILE H 3.820 . 3.820 2.791 2.429 3.203 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
893 1 30 ASP HB3 1 32 MET ME 3.640 . 3.640 2.942 2.448 3.350 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
894 1 30 ASP HB3 1 50 LEU MD1 4.160 . 4.160 2.873 2.266 4.068 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
895 1 30 ASP HB3 1 50 LEU QD 3.230 . 3.230 2.613 2.256 2.909 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
896 1 30 ASP HB3 1 50 LEU MD2 4.160 . 4.160 3.523 2.315 4.176 0.016 40 0 "[ . 1 . 2 . 3 . 4]" 1
897 1 31 ILE H 1 31 ILE HB 3.040 . 3.040 2.536 2.461 2.592 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
898 1 31 ILE H 1 31 ILE MD 3.850 . 3.850 3.811 3.659 3.878 0.028 21 0 "[ . 1 . 2 . 3 . 4]" 1
899 1 31 ILE H 1 31 ILE HG12 3.640 . 3.640 2.716 2.637 2.761 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
900 1 31 ILE H 1 31 ILE HG13 3.940 . 3.940 3.962 3.939 3.993 0.053 37 0 "[ . 1 . 2 . 3 . 4]" 1
901 1 31 ILE H 1 31 ILE MG 3.910 . 3.910 3.844 3.783 3.867 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
902 1 31 ILE H 1 32 MET H 4.720 . 4.720 4.419 4.338 4.470 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
903 1 31 ILE H 1 32 MET ME 4.880 . 4.880 4.454 4.098 4.826 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
904 1 31 ILE H 1 50 LEU QD 4.310 . 4.310 3.722 3.449 4.129 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
905 1 31 ILE HA 1 31 ILE MD 3.330 . 3.330 2.166 2.122 2.264 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
906 1 31 ILE HA 1 31 ILE HG12 3.910 . 3.910 3.043 2.987 3.108 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
907 1 31 ILE HA 1 31 ILE HG13 3.760 . 3.760 3.781 3.748 3.806 0.046 40 0 "[ . 1 . 2 . 3 . 4]" 1
908 1 31 ILE HA 1 31 ILE MG 3.010 . 3.010 2.425 2.383 2.469 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
909 1 31 ILE HA 1 32 MET H 2.790 . 2.790 2.180 2.083 2.236 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
910 1 31 ILE HA 1 32 MET ME 4.430 . 4.430 4.008 3.847 4.276 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
911 1 31 ILE HA 1 32 MET QG 4.600 . 4.600 4.044 3.492 4.667 0.067 39 0 "[ . 1 . 2 . 3 . 4]" 1
912 1 31 ILE HA 1 65 LEU MD1 4.690 . 4.690 4.317 4.091 4.486 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
913 1 31 ILE HB 1 31 ILE MD 3.280 . 3.280 3.284 3.271 3.297 0.017 36 0 "[ . 1 . 2 . 3 . 4]" 1
914 1 31 ILE MD 1 32 MET H 4.540 . 4.540 3.773 3.670 3.857 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
915 1 31 ILE MD 1 62 LEU QD 5.140 . 5.140 4.981 4.843 5.311 0.171 22 0 "[ . 1 . 2 . 3 . 4]" 1
916 1 31 ILE HG12 1 31 ILE MG 3.300 . 3.300 3.253 3.226 3.294 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
917 1 31 ILE HG12 1 32 MET H 5.100 . 5.100 5.085 5.030 5.151 0.051 40 0 "[ . 1 . 2 . 3 . 4]" 1
918 1 31 ILE HG13 1 31 ILE MG 3.240 . 3.240 2.413 2.357 2.453 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
919 1 31 ILE HG13 1 32 MET H 5.500 . 5.500 5.458 5.368 5.568 0.068 39 0 "[ . 1 . 2 . 3 . 4]" 1
920 1 31 ILE MG 1 32 MET H 3.190 . 3.190 2.670 2.571 2.924 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
921 1 31 ILE MG 1 33 THR H 5.120 . 5.120 4.791 4.619 4.995 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
922 1 31 ILE MG 1 65 LEU HB2 5.500 . 5.500 4.708 4.486 4.987 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
923 1 31 ILE MG 1 65 LEU HG 5.500 . 5.500 4.803 4.459 5.065 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
924 1 32 MET H 1 32 MET HB3 3.790 . 3.790 3.295 3.152 3.394 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
925 1 32 MET H 1 32 MET ME 3.850 . 3.850 3.701 3.533 3.874 0.024 17 0 "[ . 1 . 2 . 3 . 4]" 1
926 1 32 MET H 1 32 MET HG2 4.140 . 4.140 2.494 2.032 2.993 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
927 1 32 MET H 1 32 MET QG 3.300 . 3.300 2.450 2.012 2.925 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
928 1 32 MET H 1 32 MET HG3 4.140 . 4.140 3.617 3.176 4.123 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
929 1 32 MET H 1 33 THR H 4.600 . 4.600 4.462 4.430 4.501 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
930 1 32 MET H 1 50 LEU QD 4.470 . 4.470 4.267 4.045 4.488 0.018 31 0 "[ . 1 . 2 . 3 . 4]" 1
931 1 32 MET H 1 62 LEU MD1 5.500 . 5.500 5.030 4.195 5.958 0.458 40 0 "[ . 1 . 2 . 3 . 4]" 1
932 1 32 MET H 1 62 LEU QD 4.530 . 4.530 4.254 4.067 4.548 0.018 29 0 "[ . 1 . 2 . 3 . 4]" 1
933 1 32 MET H 1 62 LEU MD2 5.500 . 5.500 4.945 4.223 5.554 0.054 27 0 "[ . 1 . 2 . 3 . 4]" 1
934 1 32 MET HA 1 32 MET ME 4.900 . 4.900 4.235 4.053 4.391 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
935 1 32 MET HA 1 33 THR H 2.920 . 2.920 2.346 2.254 2.458 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
936 1 32 MET HA 1 49 SER H 5.140 . 5.140 4.828 4.659 5.143 0.003 9 0 "[ . 1 . 2 . 3 . 4]" 1
937 1 32 MET HA 1 50 LEU QB 5.000 . 5.000 3.843 3.504 4.176 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
938 1 32 MET HA 1 50 LEU QD 3.430 . 3.430 3.005 2.727 3.278 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
939 1 32 MET HB2 1 32 MET ME 3.980 . 3.980 3.511 3.442 3.612 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
940 1 32 MET HB2 1 33 THR H 3.380 . 3.380 2.679 2.427 2.912 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
941 1 32 MET HB2 1 48 CYS HB2 4.960 . 4.960 3.779 3.457 4.031 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
942 1 32 MET HB2 1 48 CYS HB3 4.550 . 4.550 2.392 2.110 2.647 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
943 1 32 MET HB2 1 49 SER H 4.420 . 4.420 3.412 3.228 3.720 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
944 1 32 MET HB2 1 50 LEU H 5.440 . 5.440 4.896 4.702 5.186 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
945 1 32 MET HB2 1 50 LEU QB 4.370 . 4.370 2.704 2.485 3.112 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
946 1 32 MET HB2 1 50 LEU QD 3.520 . 3.520 3.229 3.074 3.438 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
947 1 32 MET HB2 1 57 VAL MG2 5.500 . 5.500 4.721 4.481 5.022 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
948 1 32 MET HB3 1 32 MET ME 3.070 . 3.070 2.244 2.133 2.331 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
949 1 32 MET HB3 1 33 THR H 4.170 . 4.170 3.895 3.753 4.001 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
950 1 32 MET HB3 1 48 CYS HB3 4.810 . 4.810 3.909 3.641 4.178 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
951 1 32 MET HB3 1 50 LEU QB 4.240 . 4.240 2.615 2.372 3.034 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
952 1 32 MET HB3 1 50 LEU MD1 4.570 . 4.570 2.386 1.981 4.318 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
953 1 32 MET HB3 1 50 LEU QD 3.180 . 3.180 2.104 1.969 2.246 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
954 1 32 MET HB3 1 50 LEU MD2 4.570 . 4.570 3.149 2.139 4.343 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
955 1 32 MET HB3 1 62 LEU QD 5.370 . 5.370 4.475 4.308 4.758 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
956 1 32 MET ME 1 32 MET HG2 3.570 . 3.570 2.884 2.346 3.494 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
957 1 32 MET ME 1 32 MET HG3 3.570 . 3.570 3.020 2.465 3.493 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
958 1 32 MET ME 1 48 CYS HB3 4.820 . 4.820 4.610 4.378 4.828 0.008 9 0 "[ . 1 . 2 . 3 . 4]" 1
959 1 32 MET ME 1 48 CYS HG 4.430 . 4.430 4.101 3.808 4.335 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
960 1 32 MET ME 1 50 LEU HA 5.410 . 5.410 5.151 4.873 5.444 0.034 7 0 "[ . 1 . 2 . 3 . 4]" 1
961 1 32 MET ME 1 50 LEU QB 4.250 . 4.250 3.447 3.192 3.664 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
962 1 32 MET ME 1 50 LEU MD1 4.060 . 4.060 2.586 2.005 3.522 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
963 1 32 MET ME 1 50 LEU QD 2.930 . 2.930 2.192 1.968 2.683 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
964 1 32 MET ME 1 50 LEU MD2 4.060 . 4.060 2.527 2.098 3.507 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
965 1 32 MET ME 1 50 LEU HG 4.750 . 4.750 4.403 2.268 4.849 0.099 26 0 "[ . 1 . 2 . 3 . 4]" 1
966 1 32 MET ME 1 57 VAL MG1 3.390 . 3.390 2.782 2.484 3.052 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
967 1 32 MET ME 1 57 VAL MG2 3.830 . 3.830 3.651 3.318 3.841 0.011 7 0 "[ . 1 . 2 . 3 . 4]" 1
968 1 32 MET ME 1 62 LEU MD1 3.480 . 3.480 2.818 2.339 3.577 0.097 24 0 "[ . 1 . 2 . 3 . 4]" 1
969 1 32 MET ME 1 62 LEU QD 2.640 . 2.640 2.383 2.112 2.701 0.061 17 0 "[ . 1 . 2 . 3 . 4]" 1
970 1 32 MET ME 1 62 LEU MD2 3.480 . 3.480 3.006 2.138 3.572 0.092 34 0 "[ . 1 . 2 . 3 . 4]" 1
971 1 32 MET ME 1 62 LEU HG 5.170 . 5.170 4.515 3.915 5.191 0.021 17 0 "[ . 1 . 2 . 3 . 4]" 1
972 1 32 MET QG 1 33 THR H 4.270 . 4.270 3.820 3.563 4.048 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
973 1 32 MET QG 1 48 CYS HB2 4.430 . 4.430 3.647 2.980 4.202 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
974 1 32 MET QG 1 48 CYS HB3 4.310 . 4.310 2.782 2.465 3.166 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
975 1 32 MET QG 1 50 LEU QD 4.310 . 4.310 3.686 3.440 3.981 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
976 1 32 MET QG 1 62 LEU QD 3.240 . 3.240 2.700 2.467 3.020 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
977 1 32 MET HG2 1 33 THR H 5.090 . 5.090 4.450 3.832 4.944 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
978 1 32 MET HG2 1 62 LEU MD1 4.230 . 4.230 3.642 2.704 4.326 0.096 40 0 "[ . 1 . 2 . 3 . 4]" 1
979 1 32 MET HG2 1 62 LEU MD2 4.230 . 4.230 3.438 2.905 3.905 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
980 1 32 MET HG3 1 33 THR H 5.090 . 5.090 4.331 3.714 4.925 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
981 1 32 MET HG3 1 62 LEU MD1 4.230 . 4.230 3.631 3.313 4.255 0.025 29 0 "[ . 1 . 2 . 3 . 4]" 1
982 1 32 MET HG3 1 62 LEU MD2 4.230 . 4.230 3.398 2.774 3.894 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
983 1 33 THR H 1 33 THR HB 3.070 . 3.070 2.598 2.532 2.656 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
984 1 33 THR H 1 33 THR MG 3.930 . 3.930 3.840 3.758 3.874 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
985 1 33 THR H 1 34 VAL H 5.500 . 5.500 4.518 4.395 4.582 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
986 1 33 THR H 1 35 LEU QD 5.440 . 5.440 5.139 4.953 5.385 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
987 1 33 THR H 1 48 CYS HB3 4.530 . 4.530 3.826 3.492 4.035 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
988 1 33 THR H 1 49 SER H 3.510 . 3.510 2.993 2.744 3.143 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
989 1 33 THR H 1 49 SER QB 3.990 . 3.990 3.398 3.165 3.582 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
990 1 33 THR H 1 50 LEU QD 4.510 . 4.510 4.451 4.230 4.668 0.158 40 0 "[ . 1 . 2 . 3 . 4]" 1
991 1 33 THR HA 1 33 THR MG 3.150 . 3.150 2.343 2.298 2.394 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
992 1 33 THR HA 1 34 VAL H 3.320 . 3.320 2.205 2.156 2.263 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
993 1 33 THR HA 1 34 VAL MG2 3.960 . 3.960 3.653 3.504 3.778 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
994 1 33 THR HB 1 35 LEU MD1 4.890 . 4.890 4.922 4.462 4.993 0.103 24 0 "[ . 1 . 2 . 3 . 4]" 1
995 1 33 THR HB 1 35 LEU QD 3.780 . 3.780 3.406 3.278 3.737 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
996 1 33 THR HB 1 35 LEU MD2 4.890 . 4.890 3.475 3.328 3.877 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
997 1 33 THR HB 1 49 SER H 3.720 . 3.720 3.117 2.842 3.323 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
998 1 33 THR HB 1 49 SER QB 3.320 . 3.320 2.412 2.137 2.729 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
999 1 33 THR MG 1 34 VAL H 3.140 . 3.140 2.775 2.667 2.987 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1000 1 33 THR MG 1 34 VAL HA 4.380 . 4.380 4.137 4.050 4.314 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1001 1 33 THR MG 1 34 VAL HB 4.690 . 4.690 4.466 4.346 4.568 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1002 1 33 THR MG 1 35 LEU H 4.670 . 4.670 4.425 4.205 4.622 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1003 1 33 THR MG 1 35 LEU HA 4.150 . 4.150 3.828 3.681 4.056 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1004 1 33 THR MG 1 35 LEU QD 2.790 . 2.790 2.496 2.303 2.712 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1005 1 33 THR MG 1 35 LEU HG 4.330 . 4.330 3.894 3.477 4.158 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1006 1 33 THR MG 1 49 SER H 4.440 . 4.440 4.256 4.124 4.358 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1007 1 33 THR MG 1 49 SER HB2 4.950 . 4.950 4.718 4.437 4.924 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1008 1 33 THR MG 1 49 SER QB 4.110 . 4.110 3.730 3.523 3.933 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1009 1 33 THR MG 1 49 SER HB3 4.950 . 4.950 3.909 3.677 4.139 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1010 1 34 VAL H 1 34 VAL HB 3.420 . 3.420 2.527 2.462 2.623 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1011 1 34 VAL H 1 34 VAL MG1 3.800 . 3.800 3.828 3.799 3.861 0.061 24 0 "[ . 1 . 2 . 3 . 4]" 1
1012 1 34 VAL H 1 34 VAL MG2 3.050 . 3.050 2.344 2.051 2.460 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1013 1 34 VAL H 1 35 LEU H 4.860 . 4.860 4.450 4.390 4.573 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1014 1 34 VAL H 1 35 LEU QD 5.380 . 5.380 4.580 4.420 4.865 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1015 1 34 VAL HA 1 34 VAL MG1 3.080 . 3.080 2.379 2.336 2.428 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1016 1 34 VAL HA 1 34 VAL MG2 3.120 . 3.120 2.435 2.393 2.492 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1017 1 34 VAL HA 1 35 LEU H 3.080 . 3.080 2.127 2.072 2.180 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1018 1 34 VAL HA 1 35 LEU QD 5.040 . 5.040 4.161 4.072 4.393 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1019 1 34 VAL HA 1 35 LEU HG 5.460 . 5.460 3.806 3.617 3.983 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1020 1 34 VAL HA 1 36 GLU H 4.230 . 4.230 3.943 3.784 4.157 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1021 1 34 VAL HA 1 48 CYS H 5.070 . 5.070 4.947 4.841 5.033 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1022 1 34 VAL HA 1 48 CYS HA 3.850 . 3.850 2.440 2.341 2.617 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1023 1 34 VAL HA 1 49 SER H 4.560 . 4.560 3.896 3.759 4.086 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1024 1 34 VAL HB 1 35 LEU H 4.790 . 4.790 4.183 4.056 4.288 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1025 1 34 VAL HB 1 64 ILE MD 4.480 . 4.480 3.392 3.067 3.633 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1026 1 34 VAL MG1 1 35 LEU H 3.320 . 3.320 2.772 2.662 2.928 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1027 1 34 VAL MG1 1 35 LEU HA 4.340 . 4.340 4.001 3.868 4.074 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1028 1 34 VAL MG1 1 35 LEU HB2 5.240 . 5.240 4.422 4.344 4.579 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1029 1 34 VAL MG1 1 36 GLU H 3.340 . 3.340 2.785 2.670 2.900 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1030 1 34 VAL MG1 1 36 GLU HA 4.070 . 4.070 3.481 3.158 3.801 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1031 1 34 VAL MG1 1 37 ARG H 4.430 . 4.430 4.329 4.116 4.472 0.042 19 0 "[ . 1 . 2 . 3 . 4]" 1
1032 1 34 VAL MG1 1 37 ARG HA 4.330 . 4.330 3.795 3.540 4.061 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1033 1 34 VAL MG1 1 37 ARG HB2 5.500 . 5.500 4.729 4.480 5.000 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1034 1 34 VAL MG1 1 37 ARG HD2 4.840 . 4.840 4.433 3.529 4.907 0.067 27 0 "[ . 1 . 2 . 3 . 4]" 1
1035 1 34 VAL MG1 1 37 ARG QD 4.150 . 4.150 3.495 3.054 4.143 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1036 1 34 VAL MG1 1 37 ARG HD3 4.840 . 4.840 3.763 3.127 4.838 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1037 1 34 VAL MG1 1 37 ARG HG2 4.300 . 4.300 2.899 2.545 3.461 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1038 1 34 VAL MG1 1 37 ARG QG 3.740 . 3.740 2.527 2.332 2.859 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1039 1 34 VAL MG1 1 37 ARG HG3 4.300 . 4.300 2.804 2.540 3.202 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1040 1 34 VAL MG1 1 46 TRP HA 4.690 . 4.690 4.106 3.856 4.299 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1041 1 34 VAL MG1 1 46 TRP HB2 4.110 . 4.110 3.614 3.425 3.785 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1042 1 34 VAL MG1 1 46 TRP HB3 3.560 . 3.560 2.368 2.187 2.550 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1043 1 34 VAL MG1 1 46 TRP HE3 3.720 . 3.720 3.428 3.127 3.595 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1044 1 34 VAL MG1 1 46 TRP HZ3 5.020 . 5.020 4.881 4.582 5.028 0.008 4 0 "[ . 1 . 2 . 3 . 4]" 1
1045 1 34 VAL MG1 1 47 LEU H 4.290 . 4.290 3.575 3.358 3.739 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1046 1 34 VAL MG1 1 48 CYS HA 4.350 . 4.350 3.984 3.830 4.246 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1047 1 34 VAL MG1 1 48 CYS HG 4.680 . 4.680 4.309 3.912 4.597 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1048 1 34 VAL MG1 1 64 ILE MD 3.370 . 3.370 2.601 2.392 2.839 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1049 1 34 VAL MG2 1 35 LEU H 4.210 . 4.210 4.095 3.982 4.160 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1050 1 34 VAL MG2 1 46 TRP HB2 4.610 . 4.610 4.045 3.657 4.373 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1051 1 34 VAL MG2 1 46 TRP HB3 4.510 . 4.510 3.616 3.174 3.884 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1052 1 34 VAL MG2 1 46 TRP HE3 3.280 . 3.280 2.933 2.544 3.176 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1053 1 34 VAL MG2 1 46 TRP HZ3 4.130 . 4.130 3.940 3.539 4.169 0.039 20 0 "[ . 1 . 2 . 3 . 4]" 1
1054 1 34 VAL MG2 1 48 CYS HA 4.330 . 4.330 4.090 3.963 4.339 0.009 38 0 "[ . 1 . 2 . 3 . 4]" 1
1055 1 34 VAL MG2 1 48 CYS HG 3.830 . 3.830 3.123 3.015 3.235 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1056 1 34 VAL MG2 1 64 ILE MD 2.840 . 2.840 2.132 2.056 2.272 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1057 1 35 LEU H 1 35 LEU HB2 3.800 . 3.800 2.454 2.359 2.516 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1058 1 35 LEU H 1 35 LEU HB3 3.950 . 3.950 3.624 3.590 3.657 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1059 1 35 LEU H 1 35 LEU MD1 3.850 . 3.850 3.748 3.589 3.839 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1060 1 35 LEU H 1 35 LEU MD2 3.850 . 3.850 3.478 3.383 3.717 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1061 1 35 LEU H 1 35 LEU HG 4.040 . 4.040 2.500 2.408 2.637 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1062 1 35 LEU H 1 36 GLU H 3.040 . 3.040 2.272 2.159 2.365 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1063 1 35 LEU H 1 47 LEU HB3 5.150 . 5.150 3.279 3.114 3.562 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1064 1 35 LEU H 1 47 LEU MD1 4.960 . 4.960 4.496 4.204 5.329 0.369 39 0 "[ . 1 . 2 . 3 . 4]" 1
1065 1 35 LEU H 1 47 LEU MD2 4.960 . 4.960 3.902 3.686 4.383 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1066 1 35 LEU H 1 48 CYS HA 3.560 . 3.560 2.621 2.474 2.762 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1067 1 35 LEU H 1 48 CYS HB3 5.300 . 5.300 4.912 4.616 5.076 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1068 1 35 LEU H 1 49 SER H 4.860 . 4.860 4.427 4.232 4.679 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1069 1 35 LEU HA 1 35 LEU QD 2.850 . 2.850 2.176 2.116 2.243 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1070 1 35 LEU HA 1 35 LEU HG 3.970 . 3.970 3.231 3.062 3.301 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1071 1 35 LEU HB2 1 35 LEU MD1 3.550 . 3.550 2.272 2.202 2.317 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1072 1 35 LEU HB2 1 35 LEU QD 2.970 . 2.970 2.230 2.168 2.270 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1073 1 35 LEU HB2 1 35 LEU MD2 3.550 . 3.550 3.243 3.191 3.267 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1074 1 35 LEU HB2 1 36 GLU H 3.510 . 3.510 2.452 2.299 2.637 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1075 1 35 LEU HB2 1 36 GLU QB 5.340 . 5.340 3.688 3.159 4.163 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1076 1 35 LEU HB2 1 47 LEU HB2 4.810 . 4.810 3.922 3.731 4.294 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1077 1 35 LEU HB2 1 47 LEU HB3 5.080 . 5.080 2.285 2.086 2.789 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1078 1 35 LEU HB2 1 47 LEU QD 3.690 . 3.690 2.207 2.062 2.471 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1079 1 35 LEU HB3 1 35 LEU MD1 3.610 . 3.610 2.367 2.310 2.425 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1080 1 35 LEU HB3 1 35 LEU QD 3.090 . 3.090 2.136 2.104 2.159 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1081 1 35 LEU HB3 1 35 LEU MD2 3.610 . 3.610 2.434 2.357 2.483 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1082 1 35 LEU HB3 1 36 GLU H 4.260 . 4.260 3.601 3.507 3.682 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1083 1 35 LEU HB3 1 36 GLU QB 5.340 . 5.340 3.808 3.502 4.096 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1084 1 35 LEU HB3 1 47 LEU HB3 5.500 . 5.500 3.845 3.664 4.216 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1085 1 35 LEU QD 1 36 GLU H 3.950 . 3.950 3.989 3.851 4.110 0.160 40 0 "[ . 1 . 2 . 3 . 4]" 1
1086 1 35 LEU QD 1 47 LEU HA 4.820 . 4.820 4.747 4.464 4.972 0.152 39 0 "[ . 1 . 2 . 3 . 4]" 1
1087 1 35 LEU QD 1 47 LEU HB2 4.710 . 4.710 4.518 4.304 4.890 0.180 39 0 "[ . 1 . 2 . 3 . 4]" 1
1088 1 35 LEU QD 1 47 LEU HB3 4.040 . 4.040 3.404 3.055 3.945 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1089 1 35 LEU QD 1 47 LEU QD 2.770 . 2.770 1.919 1.776 2.586 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1090 1 35 LEU QD 1 47 LEU HG 3.580 . 3.580 3.745 2.261 4.080 0.500 13 0 "[ . 1 . 2 . 3 . 4]" 1
1091 1 35 LEU QD 1 48 CYS H 4.660 . 4.660 4.382 4.005 4.526 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1092 1 35 LEU QD 1 48 CYS HA 3.690 . 3.690 3.622 3.363 3.735 0.045 24 0 "[ . 1 . 2 . 3 . 4]" 1
1093 1 35 LEU QD 1 49 SER H 3.890 . 3.890 3.747 3.506 3.925 0.035 27 0 "[ . 1 . 2 . 3 . 4]" 1
1094 1 35 LEU QD 1 49 SER HA 4.370 . 4.370 4.078 3.833 4.325 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1095 1 35 LEU QD 1 49 SER QB 2.980 . 2.980 2.534 2.353 2.765 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1096 1 35 LEU QD 1 54 GLN HA 4.330 . 4.330 4.248 3.963 4.423 0.093 30 0 "[ . 1 . 2 . 3 . 4]" 1
1097 1 35 LEU QD 1 54 GLN HB2 5.250 . 5.250 4.380 4.187 4.539 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1098 1 35 LEU QD 1 54 GLN HB3 4.070 . 4.070 3.446 3.256 3.652 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1099 1 35 LEU QD 1 54 GLN QE 3.550 . 3.550 2.587 1.793 3.154 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1100 1 35 LEU QD 1 54 GLN HG2 3.660 . 3.660 2.379 2.189 2.661 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1101 1 35 LEU QD 1 54 GLN HG3 4.020 . 4.020 3.618 3.266 3.843 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1102 1 35 LEU QD 1 55 GLY H 5.150 . 5.150 4.565 4.291 4.739 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1103 1 35 LEU MD1 1 36 GLU H 4.950 . 4.950 4.340 4.127 4.525 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1104 1 35 LEU MD1 1 48 CYS HA 4.900 . 4.900 3.914 3.595 4.104 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1105 1 35 LEU MD1 1 49 SER H 4.670 . 4.670 4.210 3.830 4.430 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1106 1 35 LEU MD1 1 49 SER HB2 4.250 . 4.250 2.760 2.461 3.046 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1107 1 35 LEU MD1 1 49 SER HB3 4.250 . 4.250 4.070 3.741 4.271 0.021 16 0 "[ . 1 . 2 . 3 . 4]" 1
1108 1 35 LEU MD2 1 36 GLU H 4.950 . 4.950 4.655 4.610 4.767 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1109 1 35 LEU MD2 1 48 CYS HA 4.900 . 4.900 4.291 4.045 4.566 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1110 1 35 LEU MD2 1 49 SER H 4.670 . 4.670 4.216 3.943 4.656 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1111 1 35 LEU MD2 1 49 SER HB2 4.250 . 4.250 3.262 2.986 3.739 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1112 1 35 LEU MD2 1 49 SER HB3 4.250 . 4.250 3.685 3.385 4.150 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1113 1 35 LEU HG 1 36 GLU H 4.960 . 4.960 4.166 4.018 4.357 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1114 1 35 LEU HG 1 48 CYS HA 4.680 . 4.680 2.890 2.575 3.056 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1115 1 35 LEU HG 1 49 SER H 4.350 . 4.350 3.539 3.250 3.818 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1116 1 35 LEU HG 1 49 SER HB2 5.060 . 5.060 3.607 3.358 3.878 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1117 1 35 LEU HG 1 49 SER QB 4.380 . 4.380 3.421 3.186 3.657 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1118 1 35 LEU HG 1 49 SER HB3 5.060 . 5.060 4.258 3.962 4.529 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1119 1 36 GLU H 1 36 GLU HB2 4.200 . 4.200 3.588 2.993 4.021 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1120 1 36 GLU H 1 36 GLU QB 3.530 . 3.530 2.927 2.527 3.249 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1121 1 36 GLU H 1 36 GLU HB3 4.200 . 4.200 3.110 2.633 3.434 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1122 1 36 GLU H 1 36 GLU HG2 5.120 . 5.120 3.852 2.536 5.106 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1123 1 36 GLU H 1 36 GLU QG 4.310 . 4.310 3.442 2.471 4.327 0.017 20 0 "[ . 1 . 2 . 3 . 4]" 1
1124 1 36 GLU H 1 36 GLU HG3 5.120 . 5.120 4.064 3.317 4.766 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1125 1 36 GLU H 1 37 ARG H 4.580 . 4.580 4.408 4.374 4.466 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1126 1 36 GLU H 1 37 ARG HA 5.450 . 5.450 4.651 4.572 4.752 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1127 1 36 GLU H 1 39 THR HB 5.310 . 5.310 4.619 4.293 4.833 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1128 1 36 GLU H 1 47 LEU H 3.520 . 3.520 3.030 2.903 3.131 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1129 1 36 GLU H 1 47 LEU HB2 3.860 . 3.860 3.506 3.260 3.866 0.006 9 0 "[ . 1 . 2 . 3 . 4]" 1
1130 1 36 GLU H 1 47 LEU HB3 4.580 . 4.580 2.250 2.041 2.443 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1131 1 36 GLU H 1 47 LEU MD1 4.830 . 4.830 3.868 3.492 4.953 0.123 39 0 "[ . 1 . 2 . 3 . 4]" 1
1132 1 36 GLU H 1 47 LEU QD 3.690 . 3.690 3.426 3.215 3.601 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1133 1 36 GLU H 1 47 LEU MD2 4.830 . 4.830 4.062 3.264 4.486 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1134 1 36 GLU H 1 47 LEU HG 5.360 . 5.360 5.025 3.826 5.375 0.015 36 0 "[ . 1 . 2 . 3 . 4]" 1
1135 1 36 GLU H 1 48 CYS HA 4.780 . 4.780 4.481 4.245 4.698 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1136 1 36 GLU HA 1 36 GLU HG2 4.110 . 4.110 3.716 3.076 3.818 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1137 1 36 GLU HA 1 36 GLU HG3 4.110 . 4.110 3.368 2.572 3.779 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1138 1 36 GLU HA 1 37 ARG H 2.830 . 2.830 2.453 2.308 2.604 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1139 1 36 GLU QB 1 37 ARG H 3.900 . 3.900 2.893 2.174 3.626 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1140 1 36 GLU QB 1 39 THR HA 5.320 . 5.320 4.275 3.700 4.653 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1141 1 36 GLU QB 1 47 LEU HB2 4.430 . 4.430 3.360 2.161 4.475 0.045 4 0 "[ . 1 . 2 . 3 . 4]" 1
1142 1 36 GLU QB 1 47 LEU HB3 4.280 . 4.280 3.237 2.055 4.300 0.020 34 0 "[ . 1 . 2 . 3 . 4]" 1
1143 1 36 GLU QB 1 47 LEU QD 3.790 . 3.790 3.080 2.333 3.837 0.047 19 0 "[ . 1 . 2 . 3 . 4]" 1
1144 1 36 GLU HB2 1 37 ARG H 4.490 . 4.490 3.224 2.190 4.150 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1145 1 36 GLU HB2 1 39 THR HB 5.070 . 5.070 4.462 4.042 4.795 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1146 1 36 GLU HB2 1 47 LEU H 5.500 . 5.500 4.921 4.491 5.156 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1147 1 36 GLU HB3 1 37 ARG H 4.490 . 4.490 3.741 3.299 4.090 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1148 1 36 GLU HB3 1 39 THR HB 5.070 . 5.070 3.840 2.424 5.098 0.028 17 0 "[ . 1 . 2 . 3 . 4]" 1
1149 1 36 GLU HB3 1 47 LEU H 5.500 . 5.500 4.262 2.912 5.382 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1150 1 36 GLU QG 1 37 ARG H 3.890 . 3.890 2.746 1.959 3.506 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1151 1 36 GLU QG 1 39 THR H 4.660 . 4.660 3.827 3.476 4.652 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1152 1 36 GLU QG 1 39 THR HA 4.000 . 4.000 3.083 2.644 3.607 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1153 1 36 GLU QG 1 39 THR HB 5.090 . 5.090 2.585 2.060 3.594 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1154 1 36 GLU QG 1 47 LEU H 4.630 . 4.630 3.648 2.879 4.646 0.016 25 0 "[ . 1 . 2 . 3 . 4]" 1
1155 1 36 GLU QG 1 47 LEU HB2 4.300 . 4.300 3.150 2.174 4.363 0.063 40 0 "[ . 1 . 2 . 3 . 4]" 1
1156 1 36 GLU QG 1 47 LEU HB3 4.740 . 4.740 3.336 2.088 4.513 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1157 1 36 GLU QG 1 47 LEU QD 3.980 . 3.980 3.028 2.197 4.083 0.103 38 0 "[ . 1 . 2 . 3 . 4]" 1
1158 1 36 GLU HG2 1 37 ARG H 4.710 . 4.710 4.006 2.406 4.621 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1159 1 36 GLU HG2 1 39 THR H 5.500 . 5.500 5.146 3.536 5.513 0.013 6 0 "[ . 1 . 2 . 3 . 4]" 1
1160 1 36 GLU HG2 1 47 LEU H 5.500 . 5.500 4.418 3.349 5.524 0.024 13 0 "[ . 1 . 2 . 3 . 4]" 1
1161 1 36 GLU HG2 1 47 LEU HB2 4.960 . 4.960 3.473 2.304 4.932 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1162 1 36 GLU HG3 1 37 ARG H 4.710 . 4.710 2.832 1.967 3.632 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1163 1 36 GLU HG3 1 39 THR H 5.500 . 5.500 4.104 3.655 5.506 0.006 11 0 "[ . 1 . 2 . 3 . 4]" 1
1164 1 36 GLU HG3 1 47 LEU H 5.500 . 5.500 3.985 3.033 5.503 0.003 31 0 "[ . 1 . 2 . 3 . 4]" 1
1165 1 36 GLU HG3 1 47 LEU HB2 4.960 . 4.960 3.695 2.640 5.188 0.228 38 0 "[ . 1 . 2 . 3 . 4]" 1
1166 1 37 ARG H 1 37 ARG HB2 3.390 . 3.390 2.560 2.289 2.662 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1167 1 37 ARG H 1 37 ARG HB3 3.750 . 3.750 3.734 3.516 3.787 0.037 36 0 "[ . 1 . 2 . 3 . 4]" 1
1168 1 37 ARG H 1 37 ARG HD2 5.500 . 5.500 5.318 4.569 5.526 0.026 35 0 "[ . 1 . 2 . 3 . 4]" 1
1169 1 37 ARG H 1 37 ARG HD3 5.500 . 5.500 5.267 4.529 5.660 0.160 40 0 "[ . 1 . 2 . 3 . 4]" 1
1170 1 37 ARG H 1 37 ARG HG2 4.250 . 4.250 4.125 3.913 4.261 0.011 37 0 "[ . 1 . 2 . 3 . 4]" 1
1171 1 37 ARG H 1 37 ARG QG 3.710 . 3.710 3.048 2.834 3.208 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1172 1 37 ARG H 1 37 ARG HG3 4.250 . 4.250 3.141 2.901 3.322 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1173 1 37 ARG H 1 47 LEU H 4.850 . 4.850 4.661 4.465 4.839 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1174 1 37 ARG HA 1 37 ARG HD2 4.790 . 4.790 4.390 4.162 4.865 0.075 38 0 "[ . 1 . 2 . 3 . 4]" 1
1175 1 37 ARG HA 1 37 ARG QD 4.200 . 4.200 4.042 3.919 4.246 0.046 38 0 "[ . 1 . 2 . 3 . 4]" 1
1176 1 37 ARG HA 1 37 ARG HD3 4.790 . 4.790 4.755 4.453 4.812 0.022 24 0 "[ . 1 . 2 . 3 . 4]" 1
1177 1 37 ARG HA 1 37 ARG HG2 4.100 . 4.100 2.518 2.393 2.660 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1178 1 37 ARG HA 1 37 ARG QG 3.580 . 3.580 2.410 2.299 2.538 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1179 1 37 ARG HA 1 37 ARG HG3 4.100 . 4.100 3.086 2.946 3.248 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1180 1 37 ARG HA 1 38 ASP H 3.090 . 3.090 2.265 2.210 2.339 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1181 1 37 ARG HA 1 38 ASP HA 4.820 . 4.820 4.402 4.332 4.487 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1182 1 37 ARG HA 1 39 THR H 4.310 . 4.310 3.444 3.279 3.618 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1183 1 37 ARG HA 1 39 THR MG 5.310 . 5.310 4.380 4.117 4.606 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1184 1 37 ARG HA 1 46 TRP HA 3.970 . 3.970 2.187 2.054 2.379 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1185 1 37 ARG HA 1 46 TRP HB2 4.990 . 4.990 4.390 4.224 4.623 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1186 1 37 ARG HA 1 46 TRP HB3 4.910 . 4.910 3.110 2.878 3.431 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1187 1 37 ARG HA 1 46 TRP HD1 3.830 . 3.830 2.646 2.470 2.840 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1188 1 37 ARG HA 1 47 LEU H 4.420 . 4.420 3.161 2.939 3.469 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1189 1 37 ARG HB2 1 37 ARG HD2 3.910 . 3.910 3.171 2.295 3.773 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1190 1 37 ARG HB2 1 37 ARG HD3 3.910 . 3.910 3.510 2.463 3.875 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1191 1 37 ARG HB2 1 38 ASP H 4.240 . 4.240 3.840 3.676 3.998 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1192 1 37 ARG HB2 1 46 TRP HD1 5.110 . 5.110 4.645 4.398 4.984 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1193 1 37 ARG HB2 1 46 TRP HE1 5.500 . 5.500 4.915 4.653 5.424 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1194 1 37 ARG HB3 1 37 ARG HD2 3.940 . 3.940 2.691 2.335 3.745 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1195 1 37 ARG HB3 1 37 ARG QD 3.430 . 3.430 2.528 2.278 3.050 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1196 1 37 ARG HB3 1 37 ARG HD3 3.940 . 3.940 3.540 2.793 3.738 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1197 1 37 ARG HB3 1 38 ASP H 3.740 . 3.740 2.674 2.526 2.819 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1198 1 37 ARG HB3 1 46 TRP HD1 4.500 . 4.500 3.109 2.823 3.513 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1199 1 37 ARG HB3 1 46 TRP HE1 4.160 . 4.160 3.194 2.909 3.749 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1200 1 37 ARG QD 1 38 ASP H 5.340 . 5.340 4.801 4.500 5.283 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1201 1 37 ARG QD 1 46 TRP HE1 4.630 . 4.630 3.607 2.933 4.543 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1202 1 37 ARG QD 1 64 ILE MD 3.800 . 3.800 2.542 2.244 3.161 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1203 1 37 ARG HD2 1 46 TRP HE1 5.400 . 5.400 3.756 2.968 4.929 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1204 1 37 ARG HD2 1 64 ILE MD 4.660 . 4.660 3.483 2.335 4.502 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1205 1 37 ARG HD3 1 46 TRP HE1 5.400 . 5.400 4.940 3.448 5.395 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1206 1 37 ARG HD3 1 64 ILE MD 4.660 . 4.660 2.858 2.281 4.280 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1207 1 37 ARG QG 1 46 TRP HE1 4.600 . 4.600 3.824 3.405 4.092 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1208 1 37 ARG QG 1 64 ILE MD 4.030 . 4.030 3.099 2.837 3.355 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1209 1 37 ARG HG2 1 38 ASP H 4.920 . 4.920 4.036 3.632 4.323 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1210 1 37 ARG HG3 1 38 ASP H 4.920 . 4.920 4.904 4.717 4.985 0.065 19 0 "[ . 1 . 2 . 3 . 4]" 1
1211 1 38 ASP H 1 39 THR H 3.460 . 3.460 2.585 2.493 2.732 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1212 1 38 ASP H 1 39 THR MG 4.490 . 4.490 4.046 3.810 4.269 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1213 1 38 ASP H 1 44 GLY H 4.810 . 4.810 4.342 3.971 4.654 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1214 1 38 ASP H 1 45 TRP H 4.620 . 4.620 3.917 3.739 4.136 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1215 1 38 ASP H 1 46 TRP HA 3.760 . 3.760 2.824 2.564 3.150 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1216 1 38 ASP H 1 46 TRP HD1 3.120 . 3.120 1.909 1.606 2.358 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1217 1 38 ASP H 1 46 TRP HE1 4.060 . 4.060 3.586 3.325 4.033 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1218 1 38 ASP HA 1 39 THR H 3.220 . 3.220 2.668 2.574 2.778 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1219 1 38 ASP HA 1 39 THR MG 4.310 . 4.310 4.075 3.877 4.174 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1220 1 38 ASP HA 1 42 LEU H 4.610 . 4.610 4.201 3.826 4.514 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1221 1 38 ASP HA 1 44 GLY H 4.050 . 4.050 3.269 3.016 3.440 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1222 1 38 ASP HA 1 45 TRP H 3.630 . 3.630 2.943 2.813 3.342 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1223 1 38 ASP HA 1 46 TRP HD1 4.470 . 4.470 3.643 3.225 4.268 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1224 1 38 ASP QB 1 43 ASP HA 3.850 . 3.850 3.369 3.011 3.866 0.016 38 0 "[ . 1 . 2 . 3 . 4]" 1
1225 1 38 ASP QB 1 44 GLY H 4.560 . 4.560 3.684 3.505 3.979 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1226 1 38 ASP HB2 1 44 GLY H 5.370 . 5.370 4.843 3.815 5.109 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1227 1 38 ASP HB3 1 44 GLY H 5.370 . 5.370 3.916 3.607 5.430 0.060 36 0 "[ . 1 . 2 . 3 . 4]" 1
1228 1 39 THR H 1 39 THR HB 3.560 . 3.560 2.508 2.439 2.592 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1229 1 39 THR H 1 39 THR MG 2.790 . 2.790 2.122 2.025 2.246 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1230 1 39 THR H 1 40 GLN H 4.690 . 4.690 4.633 4.560 4.687 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1231 1 39 THR H 1 42 LEU H 4.620 . 4.620 4.456 4.220 4.585 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1232 1 39 THR H 1 42 LEU QD 5.420 . 5.420 5.082 4.733 5.425 0.005 9 0 "[ . 1 . 2 . 3 . 4]" 1
1233 1 39 THR H 1 45 TRP H 5.290 . 5.290 4.397 4.204 4.606 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1234 1 39 THR H 1 45 TRP HB2 4.950 . 4.950 4.031 3.829 4.202 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1235 1 39 THR H 1 46 TRP HA 3.780 . 3.780 3.068 2.924 3.282 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1236 1 39 THR H 1 46 TRP HD1 4.580 . 4.580 3.847 3.657 4.121 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1237 1 39 THR H 1 47 LEU H 4.110 . 4.110 3.837 3.705 4.049 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1238 1 39 THR H 1 47 LEU HB2 4.840 . 4.840 4.416 4.279 4.749 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1239 1 39 THR H 1 56 ILE MG 4.840 . 4.840 4.880 4.819 4.956 0.116 17 0 "[ . 1 . 2 . 3 . 4]" 1
1240 1 39 THR HA 1 40 GLN H 2.820 . 2.820 2.270 2.182 2.365 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1241 1 39 THR HA 1 40 GLN HA 4.620 . 4.620 4.436 4.360 4.508 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1242 1 39 THR HA 1 40 GLN HB2 5.500 . 5.500 4.897 4.807 4.958 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1243 1 39 THR HA 1 41 GLY H 3.790 . 3.790 3.281 3.048 3.421 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1244 1 39 THR HB 1 40 GLN H 4.870 . 4.870 3.965 3.888 4.106 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1245 1 39 THR HB 1 46 TRP HA 4.810 . 4.810 3.700 3.552 3.919 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1246 1 39 THR HB 1 47 LEU H 3.700 . 3.700 2.823 2.659 3.126 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1247 1 39 THR HB 1 47 LEU HB2 4.240 . 4.240 2.130 2.011 2.654 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1248 1 39 THR HB 1 47 LEU HB3 4.570 . 4.570 3.600 3.194 3.756 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1249 1 39 THR HB 1 47 LEU MD1 4.760 . 4.760 3.638 3.421 4.437 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1250 1 39 THR HB 1 47 LEU QD 4.040 . 4.040 3.479 3.355 3.770 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1251 1 39 THR HB 1 47 LEU MD2 4.760 . 4.760 4.678 3.792 4.890 0.130 13 0 "[ . 1 . 2 . 3 . 4]" 1
1252 1 39 THR HB 1 56 ILE MG 4.750 . 4.750 4.266 4.020 4.408 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1253 1 39 THR MG 1 40 GLN H 3.860 . 3.860 3.526 3.322 3.747 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1254 1 39 THR MG 1 40 GLN HA 5.500 . 5.500 4.592 4.364 4.850 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1255 1 39 THR MG 1 40 GLN HB2 3.670 . 3.670 3.073 2.880 3.265 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1256 1 39 THR MG 1 40 GLN HB3 4.920 . 4.920 4.456 4.244 4.685 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1257 1 39 THR MG 1 40 GLN QE 4.110 . 4.110 3.542 2.539 4.229 0.119 33 0 "[ . 1 . 2 . 3 . 4]" 1
1258 1 39 THR MG 1 40 GLN QG 3.620 . 3.620 2.495 2.167 3.037 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1259 1 39 THR MG 1 42 LEU H 4.390 . 4.390 4.067 3.959 4.165 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1260 1 39 THR MG 1 42 LEU HB2 4.010 . 4.010 3.507 3.293 3.747 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1261 1 39 THR MG 1 42 LEU HB3 5.450 . 5.450 4.856 4.619 5.134 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1262 1 39 THR MG 1 42 LEU QD 3.840 . 3.840 3.157 2.727 3.579 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1263 1 39 THR MG 1 45 TRP H 5.500 . 5.500 4.501 4.252 4.761 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1264 1 39 THR MG 1 45 TRP HB2 4.060 . 4.060 3.149 2.866 3.480 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1265 1 39 THR MG 1 45 TRP HB3 3.660 . 3.660 3.026 2.775 3.277 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1266 1 39 THR MG 1 45 TRP HE3 5.350 . 5.350 4.809 4.528 5.048 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1267 1 39 THR MG 1 46 TRP H 4.720 . 4.720 3.990 3.741 4.191 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1268 1 39 THR MG 1 46 TRP HA 3.720 . 3.720 3.123 2.989 3.261 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1269 1 39 THR MG 1 46 TRP HD1 5.500 . 5.500 4.486 4.298 4.655 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1270 1 39 THR MG 1 47 LEU H 3.510 . 3.510 3.027 2.892 3.121 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1271 1 39 THR MG 1 47 LEU HA 3.830 . 3.830 2.690 2.586 2.839 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1272 1 39 THR MG 1 47 LEU HB2 3.400 . 3.400 2.493 2.119 2.617 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1273 1 39 THR MG 1 47 LEU HB3 3.940 . 3.940 3.892 3.534 3.993 0.053 28 0 "[ . 1 . 2 . 3 . 4]" 1
1274 1 39 THR MG 1 47 LEU QD 3.770 . 3.770 3.305 2.432 3.522 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1275 1 39 THR MG 1 48 CYS H 5.000 . 5.000 4.641 4.528 4.833 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1276 1 39 THR MG 1 56 ILE HA 4.140 . 4.140 3.585 3.328 3.916 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1277 1 39 THR MG 1 56 ILE HB 4.220 . 4.220 3.296 2.956 3.527 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1278 1 39 THR MG 1 56 ILE MD 4.180 . 4.180 3.816 3.393 4.006 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1279 1 39 THR MG 1 56 ILE HG13 5.500 . 5.500 5.213 4.881 5.391 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1280 1 39 THR MG 1 56 ILE MG 2.680 . 2.680 2.006 1.944 2.077 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1281 1 40 GLN H 1 40 GLN HA 2.810 . 2.810 2.278 2.258 2.288 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1282 1 40 GLN H 1 40 GLN HB2 4.140 . 4.140 3.615 3.560 3.673 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1283 1 40 GLN H 1 40 GLN HG2 3.850 . 3.850 3.468 3.284 3.586 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1284 1 40 GLN H 1 40 GLN QG 3.360 . 3.360 2.781 2.715 2.870 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1285 1 40 GLN H 1 40 GLN HG3 3.850 . 3.850 2.930 2.818 3.034 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1286 1 40 GLN H 1 41 GLY H 3.330 . 3.330 2.840 2.681 2.900 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1287 1 40 GLN H 1 42 LEU H 4.350 . 4.350 4.344 4.303 4.389 0.039 34 0 "[ . 1 . 2 . 3 . 4]" 1
1288 1 40 GLN HA 1 40 GLN HG2 3.800 . 3.800 2.582 2.492 2.657 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1289 1 40 GLN HA 1 40 GLN QG 3.310 . 3.310 2.469 2.387 2.518 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1290 1 40 GLN HA 1 40 GLN HG3 3.800 . 3.800 3.146 3.033 3.260 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1291 1 40 GLN HA 1 41 GLY H 3.300 . 3.300 3.188 3.038 3.252 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1292 1 40 GLN HB2 1 42 LEU H 4.410 . 4.410 3.271 3.132 3.421 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1293 1 40 GLN HB2 1 42 LEU QD 3.370 . 3.370 2.647 2.323 2.923 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1294 1 40 GLN HB2 1 42 LEU HG 4.240 . 4.240 2.223 2.057 2.458 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1295 1 40 GLN HB2 1 56 ILE MD 4.740 . 4.740 4.616 4.226 4.857 0.117 40 0 "[ . 1 . 2 . 3 . 4]" 1
1296 1 40 GLN HB2 1 56 ILE MG 4.770 . 4.770 3.940 3.569 4.206 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1297 1 40 GLN HB3 1 41 GLY H 5.410 . 5.410 4.447 4.390 4.489 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1298 1 40 GLN HB3 1 42 LEU H 4.350 . 4.350 4.352 4.231 4.420 0.070 38 0 "[ . 1 . 2 . 3 . 4]" 1
1299 1 40 GLN HB3 1 42 LEU MD1 4.820 . 4.820 3.646 3.379 3.947 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1300 1 40 GLN HB3 1 42 LEU QD 3.480 . 3.480 3.387 3.209 3.560 0.080 38 0 "[ . 1 . 2 . 3 . 4]" 1
1301 1 40 GLN HB3 1 42 LEU MD2 4.820 . 4.820 4.053 3.568 4.402 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1302 1 40 GLN HB3 1 42 LEU HG 4.680 . 4.680 3.120 2.950 3.343 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1303 1 40 GLN QE 1 56 ILE MD 4.620 . 4.620 3.604 2.769 4.176 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1304 1 40 GLN QE 1 56 ILE HG12 5.340 . 5.340 4.517 4.093 4.892 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1305 1 40 GLN QE 1 56 ILE MG 4.010 . 4.010 2.710 2.215 3.181 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1306 1 40 GLN HE21 1 56 ILE MG 4.610 . 4.610 3.011 2.656 3.353 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1307 1 40 GLN HE22 1 56 ILE MG 4.610 . 4.610 3.159 2.286 4.019 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1308 1 40 GLN QG 1 56 ILE MD 5.340 . 5.340 4.796 4.295 5.256 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1309 1 40 GLN QG 1 56 ILE MG 4.730 . 4.730 3.381 3.021 3.884 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1310 1 42 LEU H 1 42 LEU HB2 3.180 . 3.180 2.459 2.396 2.565 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1311 1 42 LEU H 1 42 LEU HB3 3.790 . 3.790 3.638 3.597 3.719 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1312 1 42 LEU H 1 42 LEU MD1 3.980 . 3.980 3.789 3.563 3.970 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1313 1 42 LEU H 1 42 LEU QD 3.440 . 3.440 3.260 3.132 3.372 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1314 1 42 LEU H 1 42 LEU MD2 3.980 . 3.980 3.567 3.357 3.830 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1315 1 42 LEU H 1 42 LEU HG 3.110 . 3.110 2.628 2.383 2.807 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1316 1 42 LEU H 1 45 TRP H 5.500 . 5.500 5.053 4.931 5.267 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1317 1 42 LEU H 1 45 TRP HB2 4.690 . 4.690 4.268 4.155 4.498 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1318 1 42 LEU H 1 45 TRP HD1 5.500 . 5.500 5.185 4.997 5.437 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1319 1 42 LEU HA 1 42 LEU QD 2.710 . 2.710 2.198 2.103 2.381 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1320 1 42 LEU HA 1 42 LEU HG 3.970 . 3.970 3.225 3.036 3.340 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1321 1 42 LEU HA 1 43 ASP H 2.660 . 2.660 2.145 2.079 2.231 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1322 1 42 LEU HA 1 43 ASP QB 4.210 . 4.210 4.078 3.920 4.260 0.050 24 0 "[ . 1 . 2 . 3 . 4]" 1
1323 1 42 LEU HB2 1 42 LEU MD1 3.510 . 3.510 2.295 2.215 2.385 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1324 1 42 LEU HB2 1 42 LEU QD 2.930 . 2.930 2.246 2.175 2.321 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1325 1 42 LEU HB2 1 42 LEU MD2 3.510 . 3.510 3.198 3.170 3.243 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1326 1 42 LEU HB2 1 43 ASP H 4.580 . 4.580 4.246 4.007 4.415 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1327 1 42 LEU HB2 1 45 TRP HB2 3.820 . 3.820 2.117 2.022 2.223 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1328 1 42 LEU HB2 1 45 TRP HB3 4.110 . 4.110 3.558 3.449 3.710 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1329 1 42 LEU HB2 1 45 TRP HD1 4.130 . 4.130 3.102 2.976 3.239 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1330 1 42 LEU HB3 1 42 LEU MD1 3.500 . 3.500 2.345 2.265 2.454 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1331 1 42 LEU HB3 1 42 LEU QD 2.880 . 2.880 2.085 2.052 2.142 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1332 1 42 LEU HB3 1 42 LEU MD2 3.500 . 3.500 2.339 2.249 2.458 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1333 1 42 LEU HB3 1 43 ASP H 4.080 . 4.080 3.440 3.067 3.813 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1334 1 42 LEU HB3 1 45 TRP H 4.350 . 4.350 3.827 3.664 3.946 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1335 1 42 LEU HB3 1 45 TRP HB2 4.100 . 4.100 2.804 2.551 2.959 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1336 1 42 LEU HB3 1 45 TRP HB3 4.460 . 4.460 4.171 3.856 4.374 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1337 1 42 LEU HB3 1 45 TRP HD1 3.670 . 3.670 1.990 1.905 2.169 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1338 1 42 LEU QD 1 43 ASP H 3.790 . 3.790 3.703 3.527 3.901 0.111 28 0 "[ . 1 . 2 . 3 . 4]" 1
1339 1 42 LEU QD 1 45 TRP HB2 3.830 . 3.830 2.897 2.485 3.233 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1340 1 42 LEU QD 1 45 TRP HB3 4.810 . 4.810 3.186 2.817 3.581 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1341 1 42 LEU QD 1 45 TRP HD1 3.780 . 3.780 3.089 2.831 3.394 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1342 1 42 LEU QD 1 56 ILE HB 4.310 . 4.310 3.813 3.291 4.125 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1343 1 42 LEU QD 1 56 ILE MD 3.160 . 3.160 2.294 2.109 2.457 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1344 1 42 LEU QD 1 56 ILE MG 3.550 . 3.550 2.841 2.346 3.358 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1345 1 42 LEU QD 1 95 ARG H 5.170 . 5.170 4.419 4.165 4.741 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1346 1 42 LEU QD 1 95 ARG HA 4.260 . 4.260 2.210 1.956 2.725 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1347 1 42 LEU QD 1 95 ARG QB 3.450 . 3.450 2.846 2.061 3.483 0.033 11 0 "[ . 1 . 2 . 3 . 4]" 1
1348 1 42 LEU QD 1 95 ARG HG2 3.980 . 3.980 2.828 2.308 3.634 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1349 1 42 LEU QD 1 95 ARG HG3 5.280 . 5.280 3.998 2.876 4.688 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1350 1 42 LEU QD 1 96 THR H 4.530 . 4.530 3.569 2.482 4.487 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1351 1 42 LEU QD 1 96 THR HA 4.160 . 4.160 3.728 2.706 4.426 0.266 38 0 "[ . 1 . 2 . 3 . 4]" 1
1352 1 42 LEU QD 1 96 THR MG 3.840 . 3.840 3.201 2.074 4.149 0.309 6 0 "[ . 1 . 2 . 3 . 4]" 1
1353 1 42 LEU QD 1 97 ARG QD 4.750 . 4.750 4.280 2.525 5.245 0.495 16 0 "[ . 1 . 2 . 3 . 4]" 1
1354 1 42 LEU QD 1 97 ARG QG 4.950 . 4.950 4.035 2.442 5.191 0.241 34 0 "[ . 1 . 2 . 3 . 4]" 1
1355 1 42 LEU MD1 1 45 TRP H 5.500 . 5.500 4.781 4.435 5.112 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1356 1 42 LEU MD1 1 45 TRP HB2 4.610 . 4.610 2.933 2.497 3.302 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1357 1 42 LEU MD1 1 45 TRP HD1 4.350 . 4.350 3.319 2.967 3.715 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1358 1 42 LEU MD1 1 56 ILE MD 4.280 . 4.280 2.305 2.122 2.469 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1359 1 42 LEU MD1 1 95 ARG QD 5.010 . 5.010 4.012 3.165 4.819 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1360 1 42 LEU MD1 1 95 ARG HG2 5.180 . 5.180 2.940 2.335 3.900 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1361 1 42 LEU MD1 1 96 THR MG 5.250 . 5.250 4.815 3.695 5.440 0.190 1 0 "[ . 1 . 2 . 3 . 4]" 1
1362 1 42 LEU MD2 1 45 TRP H 5.500 . 5.500 5.561 5.442 5.641 0.141 39 0 "[ . 1 . 2 . 3 . 4]" 1
1363 1 42 LEU MD2 1 45 TRP HB2 4.610 . 4.610 4.536 4.257 4.671 0.061 36 0 "[ . 1 . 2 . 3 . 4]" 1
1364 1 42 LEU MD2 1 45 TRP HD1 4.350 . 4.350 3.714 3.427 4.105 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1365 1 42 LEU MD2 1 56 ILE MD 4.280 . 4.280 4.208 3.674 4.462 0.182 17 0 "[ . 1 . 2 . 3 . 4]" 1
1366 1 42 LEU MD2 1 95 ARG QD 5.010 . 5.010 4.821 3.966 5.412 0.402 39 0 "[ . 1 . 2 . 3 . 4]" 1
1367 1 42 LEU MD2 1 95 ARG HG2 5.180 . 5.180 3.839 3.233 4.653 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1368 1 42 LEU MD2 1 96 THR MG 5.250 . 5.250 3.291 2.077 4.356 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1369 1 42 LEU HG 1 43 ASP H 5.350 . 5.350 5.236 5.120 5.351 0.001 24 0 "[ . 1 . 2 . 3 . 4]" 1
1370 1 42 LEU HG 1 45 TRP HD1 4.930 . 4.930 4.928 4.798 5.008 0.078 40 0 "[ . 1 . 2 . 3 . 4]" 1
1371 1 42 LEU HG 1 56 ILE MG 4.960 . 4.960 4.812 4.336 5.058 0.098 6 0 "[ . 1 . 2 . 3 . 4]" 1
1372 1 43 ASP H 1 43 ASP QB 2.770 . 2.770 2.240 2.158 2.428 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1373 1 43 ASP H 1 44 GLY H 4.660 . 4.660 4.564 4.481 4.599 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1374 1 43 ASP H 1 45 TRP H 4.600 . 4.600 4.567 4.426 4.624 0.024 36 0 "[ . 1 . 2 . 3 . 4]" 1
1375 1 43 ASP H 1 45 TRP HD1 4.870 . 4.870 3.850 3.681 3.974 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1376 1 43 ASP H 1 45 TRP HE1 5.500 . 5.500 5.483 5.084 5.640 0.140 39 0 "[ . 1 . 2 . 3 . 4]" 1
1377 1 43 ASP HA 1 44 GLY H 2.890 . 2.890 2.166 2.092 2.257 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1378 1 43 ASP HA 1 45 TRP H 4.030 . 4.030 3.721 3.547 3.882 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1379 1 43 ASP QB 1 44 GLY H 4.010 . 4.010 3.737 3.247 4.029 0.019 38 0 "[ . 1 . 2 . 3 . 4]" 1
1380 1 44 GLY H 1 45 TRP H 3.360 . 3.360 2.824 2.656 2.950 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1381 1 44 GLY H 1 46 TRP HD1 4.980 . 4.980 4.633 4.406 4.895 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1382 1 44 GLY HA2 1 46 TRP HE1 4.150 . 4.150 3.035 2.749 3.438 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1383 1 44 GLY HA2 1 93 PRO HG2 5.450 . 5.450 5.159 4.880 5.435 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1384 1 44 GLY HA2 1 93 PRO HG3 4.410 . 4.410 3.950 3.784 4.293 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1385 1 44 GLY HA3 1 46 TRP HE1 5.270 . 5.270 4.692 4.400 5.108 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1386 1 44 GLY HA3 1 93 PRO HB3 4.720 . 4.720 3.516 3.178 3.833 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1387 1 44 GLY HA3 1 93 PRO HG2 4.290 . 4.290 3.631 3.370 3.948 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1388 1 44 GLY HA3 1 93 PRO HG3 4.070 . 4.070 2.443 2.146 2.913 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1389 1 45 TRP H 1 45 TRP HB2 3.320 . 3.320 2.405 2.354 2.447 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1390 1 45 TRP H 1 45 TRP HB3 3.880 . 3.880 3.657 3.621 3.677 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1391 1 45 TRP H 1 45 TRP HD1 3.730 . 3.730 2.900 2.569 3.081 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1392 1 45 TRP H 1 46 TRP H 4.620 . 4.620 4.550 4.520 4.587 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1393 1 45 TRP H 1 46 TRP HD1 4.610 . 4.610 3.861 3.706 4.098 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1394 1 45 TRP H 1 59 GLY H 5.240 . 5.240 4.845 4.749 4.950 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1395 1 45 TRP H 1 93 PRO HG2 5.000 . 5.000 4.483 4.227 4.788 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1396 1 45 TRP HA 1 45 TRP HE3 4.500 . 4.500 3.128 2.947 3.378 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1397 1 45 TRP HA 1 46 TRP H 3.050 . 3.050 2.200 2.158 2.270 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1398 1 45 TRP HA 1 58 PRO HA 3.800 . 3.800 2.798 2.538 2.943 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1399 1 45 TRP HA 1 59 GLY H 3.610 . 3.610 2.925 2.735 3.173 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1400 1 45 TRP HB2 1 46 TRP H 4.590 . 4.590 4.218 4.015 4.280 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1401 1 45 TRP HB2 1 56 ILE HB 4.770 . 4.770 4.025 3.837 4.171 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1402 1 45 TRP HB2 1 56 ILE MD 4.310 . 4.310 3.856 3.572 4.124 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1403 1 45 TRP HB2 1 56 ILE MG 4.780 . 4.780 4.154 3.951 4.366 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1404 1 45 TRP HB3 1 45 TRP HE3 4.030 . 4.030 2.595 2.538 2.664 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1405 1 45 TRP HB3 1 46 TRP H 4.130 . 4.130 3.179 2.893 3.265 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1406 1 45 TRP HB3 1 56 ILE HB 4.170 . 4.170 2.380 2.247 2.501 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1407 1 45 TRP HB3 1 56 ILE MD 3.800 . 3.800 2.963 2.594 3.379 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1408 1 45 TRP HB3 1 56 ILE HG13 5.110 . 5.110 4.335 4.011 4.637 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1409 1 45 TRP HB3 1 56 ILE MG 4.190 . 4.190 3.290 3.162 3.454 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1410 1 45 TRP HB3 1 57 VAL H 4.960 . 4.960 3.729 3.443 3.913 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1411 1 45 TRP HD1 1 93 PRO HB2 4.250 . 4.250 3.969 3.696 4.266 0.016 16 0 "[ . 1 . 2 . 3 . 4]" 1
1412 1 45 TRP HD1 1 93 PRO HG2 4.330 . 4.330 3.272 3.083 3.583 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1413 1 45 TRP HD1 1 93 PRO HG3 5.220 . 5.220 4.366 4.117 4.619 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1414 1 45 TRP HE1 1 93 PRO HB2 3.510 . 3.510 3.423 3.151 3.547 0.037 38 0 "[ . 1 . 2 . 3 . 4]" 1
1415 1 45 TRP HE1 1 93 PRO HB3 4.950 . 4.950 4.885 4.692 4.971 0.021 28 0 "[ . 1 . 2 . 3 . 4]" 1
1416 1 45 TRP HE1 1 93 PRO HD2 4.730 . 4.730 4.145 3.863 4.429 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1417 1 45 TRP HE1 1 93 PRO HG2 3.760 . 3.760 2.615 2.498 2.841 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1418 1 45 TRP HE1 1 93 PRO HG3 4.580 . 4.580 4.333 4.150 4.526 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1419 1 45 TRP HE1 1 94 PRO QB 5.340 . 5.340 4.594 4.399 4.891 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1420 1 45 TRP HE1 1 95 ARG HA 3.630 . 3.630 2.955 2.181 3.356 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1421 1 45 TRP HE1 1 95 ARG QB 4.760 . 4.760 4.358 3.998 4.603 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1422 1 45 TRP HE1 1 95 ARG QD 5.320 . 5.320 4.659 4.262 5.331 0.011 26 0 "[ . 1 . 2 . 3 . 4]" 1
1423 1 45 TRP HE1 1 95 ARG HG2 4.120 . 4.120 3.167 2.569 4.122 0.002 11 0 "[ . 1 . 2 . 3 . 4]" 1
1424 1 45 TRP HE1 1 95 ARG HG3 3.910 . 3.910 3.180 2.480 3.852 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1425 1 45 TRP HE3 1 46 TRP H 4.330 . 4.330 3.572 3.370 3.794 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1426 1 45 TRP HE3 1 56 ILE HA 4.620 . 4.620 4.108 4.001 4.276 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1427 1 45 TRP HE3 1 56 ILE HB 3.740 . 3.740 2.388 2.258 2.567 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1428 1 45 TRP HE3 1 56 ILE MD 3.620 . 3.620 2.818 2.633 2.997 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1429 1 45 TRP HE3 1 56 ILE HG13 4.400 . 4.400 2.804 2.565 3.312 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1430 1 45 TRP HE3 1 56 ILE MG 4.320 . 4.320 4.056 3.953 4.226 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1431 1 45 TRP HE3 1 57 VAL H 4.000 . 4.000 2.826 2.695 2.948 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1432 1 45 TRP HE3 1 57 VAL HA 4.670 . 4.670 3.249 2.988 3.352 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1433 1 45 TRP HH2 1 58 PRO HG3 5.500 . 5.500 4.097 3.811 4.333 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1434 1 45 TRP HH2 1 92 LYS QD 4.140 . 4.140 2.248 2.019 4.092 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1435 1 45 TRP HH2 1 95 ARG HG3 5.500 . 5.500 4.278 3.920 4.943 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1436 1 45 TRP HZ2 1 56 ILE MD 4.520 . 4.520 4.590 4.454 4.701 0.181 40 0 "[ . 1 . 2 . 3 . 4]" 1
1437 1 45 TRP HZ2 1 58 PRO HB3 5.500 . 5.500 4.118 3.811 4.447 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1438 1 45 TRP HZ2 1 92 LYS QB 4.150 . 4.150 2.772 2.255 3.476 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1439 1 45 TRP HZ2 1 92 LYS QD 4.730 . 4.730 3.302 2.712 4.673 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1440 1 45 TRP HZ2 1 92 LYS QG 5.340 . 5.340 4.160 3.211 5.034 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1441 1 45 TRP HZ2 1 93 PRO HD2 4.470 . 4.470 3.676 3.390 4.093 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1442 1 45 TRP HZ2 1 93 PRO HG2 4.720 . 4.720 3.863 3.648 4.007 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1443 1 45 TRP HZ2 1 93 PRO HG3 5.500 . 5.500 5.477 5.271 5.570 0.070 38 0 "[ . 1 . 2 . 3 . 4]" 1
1444 1 45 TRP HZ2 1 95 ARG QD 4.080 . 4.080 3.339 2.496 4.230 0.150 40 0 "[ . 1 . 2 . 3 . 4]" 1
1445 1 45 TRP HZ2 1 95 ARG HG2 4.360 . 4.360 3.146 2.551 4.382 0.022 11 0 "[ . 1 . 2 . 3 . 4]" 1
1446 1 45 TRP HZ2 1 95 ARG HG3 4.360 . 4.360 2.528 2.240 3.036 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1447 1 45 TRP HZ3 1 56 ILE HB 4.790 . 4.790 4.308 4.103 4.549 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1448 1 45 TRP HZ3 1 56 ILE MD 4.830 . 4.830 3.579 3.364 3.788 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1449 1 45 TRP HZ3 1 56 ILE HG12 5.500 . 5.500 4.665 4.430 5.309 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1450 1 45 TRP HZ3 1 56 ILE HG13 4.440 . 4.440 2.944 2.754 3.555 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1451 1 45 TRP HZ3 1 57 VAL H 5.030 . 5.030 4.392 4.211 4.607 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1452 1 45 TRP HZ3 1 57 VAL HA 4.160 . 4.160 2.725 2.436 3.076 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1453 1 45 TRP HZ3 1 57 VAL MG1 5.050 . 5.050 4.392 4.045 4.682 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1454 1 45 TRP HZ3 1 57 VAL MG2 5.500 . 5.500 5.163 4.966 5.392 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1455 1 45 TRP HZ3 1 58 PRO HA 5.330 . 5.330 4.217 3.986 4.421 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1456 1 45 TRP HZ3 1 58 PRO HD2 5.330 . 5.330 3.854 3.730 3.968 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1457 1 45 TRP HZ3 1 58 PRO HD3 4.040 . 4.040 2.249 2.140 2.353 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1458 1 46 TRP H 1 46 TRP HB2 3.690 . 3.690 2.572 2.509 2.666 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1459 1 46 TRP H 1 46 TRP HB3 3.850 . 3.850 3.747 3.711 3.811 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1460 1 46 TRP H 1 46 TRP HD1 4.370 . 4.370 3.412 3.298 3.553 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1461 1 46 TRP H 1 56 ILE HA 4.640 . 4.640 4.286 4.044 4.415 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1462 1 46 TRP H 1 56 ILE HB 4.670 . 4.670 3.884 3.674 4.075 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1463 1 46 TRP H 1 56 ILE MD 5.500 . 5.500 5.301 4.983 5.514 0.014 30 0 "[ . 1 . 2 . 3 . 4]" 1
1464 1 46 TRP H 1 57 VAL H 3.580 . 3.580 2.630 2.491 2.763 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1465 1 46 TRP H 1 57 VAL HB 4.920 . 4.920 4.808 4.722 4.962 0.042 39 0 "[ . 1 . 2 . 3 . 4]" 1
1466 1 46 TRP H 1 57 VAL MG2 3.950 . 3.950 2.899 2.718 3.141 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1467 1 46 TRP H 1 58 PRO HA 4.310 . 4.310 3.909 3.610 4.119 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1468 1 46 TRP H 1 59 GLY H 4.310 . 4.310 3.712 3.503 4.084 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1469 1 46 TRP H 1 59 GLY HA3 5.220 . 5.220 4.768 4.474 5.036 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1470 1 46 TRP HA 1 46 TRP HD1 3.940 . 3.940 2.395 2.334 2.531 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1471 1 46 TRP HA 1 47 LEU H 3.170 . 3.170 2.222 2.180 2.273 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1472 1 46 TRP HB2 1 47 LEU H 4.270 . 4.270 4.011 3.895 4.084 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1473 1 46 TRP HB2 1 48 CYS HG 4.250 . 4.250 3.796 3.486 4.044 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1474 1 46 TRP HB2 1 57 VAL H 4.590 . 4.590 3.838 3.698 3.976 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1475 1 46 TRP HB2 1 57 VAL HB 5.130 . 5.130 4.764 4.583 4.891 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1476 1 46 TRP HB2 1 57 VAL MG2 3.630 . 3.630 2.339 2.191 2.474 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1477 1 46 TRP HB2 1 62 LEU QD 4.220 . 4.220 3.108 2.737 3.338 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1478 1 46 TRP HB3 1 46 TRP HE3 4.150 . 4.150 3.162 3.094 3.226 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1479 1 46 TRP HB3 1 47 LEU H 3.730 . 3.730 3.008 2.851 3.103 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1480 1 46 TRP HB3 1 48 CYS HG 4.690 . 4.690 4.513 4.049 4.705 0.015 5 0 "[ . 1 . 2 . 3 . 4]" 1
1481 1 46 TRP HB3 1 57 VAL MG2 3.990 . 3.990 3.700 3.538 3.851 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1482 1 46 TRP HB3 1 62 LEU QD 4.360 . 4.360 4.101 3.700 4.389 0.029 30 0 "[ . 1 . 2 . 3 . 4]" 1
1483 1 46 TRP HD1 1 47 LEU H 5.010 . 5.010 4.557 4.459 4.734 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1484 1 46 TRP HD1 1 59 GLY H 5.170 . 5.170 4.644 4.393 4.841 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1485 1 46 TRP HD1 1 59 GLY HA3 5.020 . 5.020 4.485 4.234 4.776 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1486 1 46 TRP HE1 1 59 GLY H 4.860 . 4.860 4.631 4.336 4.789 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1487 1 46 TRP HE1 1 59 GLY HA2 5.240 . 5.240 5.025 4.626 5.247 0.007 29 0 "[ . 1 . 2 . 3 . 4]" 1
1488 1 46 TRP HE1 1 59 GLY HA3 4.210 . 4.210 3.554 3.172 3.817 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1489 1 46 TRP HE3 1 48 CYS HG 5.140 . 5.140 4.284 3.916 4.636 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1490 1 46 TRP HE3 1 57 VAL MG2 4.540 . 4.540 3.797 3.622 4.153 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1491 1 46 TRP HE3 1 59 GLY HA3 5.500 . 5.500 4.444 4.131 4.982 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1492 1 46 TRP HE3 1 62 LEU HB3 5.480 . 5.480 3.506 3.249 3.854 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1493 1 46 TRP HE3 1 62 LEU QD 3.210 . 3.210 2.196 2.018 2.538 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1494 1 46 TRP HE3 1 64 ILE MD 4.510 . 4.510 2.786 2.641 3.091 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1495 1 46 TRP HE3 1 64 ILE MG 5.500 . 5.500 5.598 5.521 5.810 0.310 38 0 "[ . 1 . 2 . 3 . 4]" 1
1496 1 46 TRP HH2 1 62 LEU HB3 4.800 . 4.800 3.977 3.425 4.394 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1497 1 46 TRP HH2 1 64 ILE H 4.810 . 4.810 3.737 3.320 4.169 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1498 1 46 TRP HH2 1 64 ILE HB 5.010 . 5.010 5.010 4.928 5.074 0.064 39 0 "[ . 1 . 2 . 3 . 4]" 1
1499 1 46 TRP HH2 1 64 ILE MD 3.710 . 3.710 3.530 3.104 3.705 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1500 1 46 TRP HH2 1 64 ILE HG12 4.230 . 4.230 2.793 2.571 2.880 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1501 1 46 TRP HH2 1 64 ILE QG 3.670 . 3.670 2.744 2.530 2.822 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1502 1 46 TRP HH2 1 64 ILE HG13 4.230 . 4.230 4.035 3.722 4.227 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1503 1 46 TRP HH2 1 64 ILE MG 5.500 . 5.500 5.489 5.293 5.559 0.059 34 0 "[ . 1 . 2 . 3 . 4]" 1
1504 1 46 TRP HZ2 1 64 ILE MD 4.940 . 4.940 4.384 3.967 4.687 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1505 1 46 TRP HZ3 1 62 LEU HB2 4.680 . 4.680 3.810 2.787 4.685 0.005 17 0 "[ . 1 . 2 . 3 . 4]" 1
1506 1 46 TRP HZ3 1 62 LEU HB3 4.770 . 4.770 2.534 2.029 3.085 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1507 1 46 TRP HZ3 1 62 LEU MD1 4.790 . 4.790 3.971 3.090 4.818 0.028 1 0 "[ . 1 . 2 . 3 . 4]" 1
1508 1 46 TRP HZ3 1 62 LEU QD 3.710 . 3.710 3.001 2.470 3.234 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1509 1 46 TRP HZ3 1 62 LEU MD2 4.790 . 4.790 3.352 2.478 4.150 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1510 1 46 TRP HZ3 1 64 ILE MD 3.630 . 3.630 2.442 2.280 2.600 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1511 1 46 TRP HZ3 1 64 ILE HG12 4.670 . 4.670 2.764 2.423 3.123 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1512 1 46 TRP HZ3 1 64 ILE QG 4.040 . 4.040 2.728 2.399 3.069 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1513 1 46 TRP HZ3 1 64 ILE HG13 4.670 . 4.670 4.201 3.848 4.520 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1514 1 46 TRP HZ3 1 64 ILE MG 4.890 . 4.890 4.886 4.773 4.951 0.061 36 0 "[ . 1 . 2 . 3 . 4]" 1
1515 1 47 LEU H 1 47 LEU HB2 3.680 . 3.680 2.413 2.284 2.700 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1516 1 47 LEU H 1 47 LEU HB3 3.450 . 3.450 2.706 2.426 2.811 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1517 1 47 LEU H 1 47 LEU MD1 4.470 . 4.470 4.256 4.151 4.325 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1518 1 47 LEU H 1 47 LEU MD2 4.470 . 4.470 4.309 4.265 4.398 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1519 1 47 LEU H 1 47 LEU HG 4.730 . 4.730 4.417 4.329 4.492 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1520 1 47 LEU H 1 48 CYS H 4.670 . 4.670 4.476 4.431 4.522 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1521 1 47 LEU HA 1 47 LEU MD1 4.070 . 4.070 3.605 2.078 3.944 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1522 1 47 LEU HA 1 47 LEU QD 2.850 . 2.850 2.346 2.070 2.490 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1523 1 47 LEU HA 1 47 LEU MD2 4.070 . 4.070 2.683 2.334 3.944 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1524 1 47 LEU HA 1 47 LEU HG 4.210 . 4.210 2.847 2.746 3.027 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1525 1 47 LEU HA 1 48 CYS H 3.010 . 3.010 2.204 2.179 2.264 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1526 1 47 LEU HA 1 55 GLY H 4.650 . 4.650 4.247 4.062 4.375 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1527 1 47 LEU HA 1 56 ILE HA 3.640 . 3.640 2.698 2.500 2.837 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1528 1 47 LEU HA 1 56 ILE HB 4.870 . 4.870 4.387 3.911 4.684 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1529 1 47 LEU HA 1 56 ILE MG 3.360 . 3.360 2.781 2.278 3.094 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1530 1 47 LEU HA 1 57 VAL H 4.360 . 4.360 4.155 4.006 4.283 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1531 1 47 LEU HB2 1 47 LEU MD1 3.280 . 3.280 2.415 2.321 2.470 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1532 1 47 LEU HB2 1 47 LEU QD 2.810 . 2.810 2.321 2.111 2.393 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1533 1 47 LEU HB2 1 47 LEU MD2 3.280 . 3.280 3.089 2.425 3.247 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1534 1 47 LEU HB2 1 48 CYS H 4.660 . 4.660 4.504 4.377 4.557 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1535 1 47 LEU HB2 1 56 ILE MG 5.360 . 5.360 3.957 3.242 4.259 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1536 1 47 LEU HB3 1 47 LEU QD 2.950 . 2.950 2.135 2.101 2.247 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1537 1 47 LEU HB3 1 48 CYS H 4.410 . 4.410 4.082 3.946 4.276 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1538 1 47 LEU QD 1 48 CYS H 3.030 . 3.030 2.493 2.370 2.859 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1539 1 47 LEU QD 1 48 CYS HA 4.470 . 4.470 3.574 3.327 4.410 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1540 1 47 LEU QD 1 49 SER H 5.200 . 5.200 4.644 4.360 5.474 0.274 39 0 "[ . 1 . 2 . 3 . 4]" 1
1541 1 47 LEU QD 1 54 GLN HA 4.100 . 4.100 3.747 3.454 4.253 0.153 39 0 "[ . 1 . 2 . 3 . 4]" 1
1542 1 47 LEU QD 1 54 GLN HB2 4.050 . 4.050 3.731 3.414 4.064 0.014 4 0 "[ . 1 . 2 . 3 . 4]" 1
1543 1 47 LEU QD 1 54 GLN HB3 3.400 . 3.400 2.396 2.071 2.773 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1544 1 47 LEU QD 1 54 GLN QE 3.660 . 3.660 2.638 2.201 4.034 0.374 19 0 "[ . 1 . 2 . 3 . 4]" 1
1545 1 47 LEU QD 1 54 GLN HG2 3.700 . 3.700 3.301 2.959 3.724 0.024 39 0 "[ . 1 . 2 . 3 . 4]" 1
1546 1 47 LEU QD 1 54 GLN HG3 4.590 . 4.590 4.414 4.050 4.740 0.150 39 0 "[ . 1 . 2 . 3 . 4]" 1
1547 1 47 LEU QD 1 55 GLY H 3.400 . 3.400 2.628 2.266 3.005 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1548 1 47 LEU QD 1 55 GLY HA3 4.910 . 4.910 4.375 4.173 4.539 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1549 1 47 LEU QD 1 56 ILE H 5.050 . 5.050 4.696 4.120 4.909 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1550 1 47 LEU QD 1 56 ILE HA 3.940 . 3.940 3.848 3.259 4.035 0.095 30 0 "[ . 1 . 2 . 3 . 4]" 1
1551 1 47 LEU MD1 1 54 GLN HE21 5.940 . 5.940 4.201 3.629 5.160 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1552 1 47 LEU MD1 1 54 GLN HE22 5.940 . 5.940 3.729 2.654 5.846 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1553 1 47 LEU MD2 1 54 GLN HE21 5.940 . 5.940 3.783 3.212 4.788 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1554 1 47 LEU MD2 1 54 GLN HE22 5.940 . 5.940 2.861 2.261 4.914 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1555 1 47 LEU HG 1 48 CYS H 4.330 . 4.330 4.069 2.934 4.342 0.012 12 0 "[ . 1 . 2 . 3 . 4]" 1
1556 1 47 LEU HG 1 56 ILE HA 5.500 . 5.500 4.946 4.707 5.374 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1557 1 47 LEU HG 1 56 ILE MG 4.320 . 4.320 3.616 3.208 4.699 0.379 38 0 "[ . 1 . 2 . 3 . 4]" 1
1558 1 48 CYS H 1 48 CYS HB2 3.630 . 3.630 2.668 2.613 2.814 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1559 1 48 CYS H 1 48 CYS HB3 4.000 . 4.000 3.808 3.781 3.856 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1560 1 48 CYS H 1 48 CYS HG 4.520 . 4.520 4.513 4.306 4.543 0.023 38 0 "[ . 1 . 2 . 3 . 4]" 1
1561 1 48 CYS H 1 49 SER H 4.830 . 4.830 4.464 4.428 4.487 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1562 1 48 CYS H 1 55 GLY H 3.730 . 3.730 2.929 2.813 2.996 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1563 1 48 CYS H 1 56 ILE H 5.350 . 5.350 4.883 4.758 5.068 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1564 1 48 CYS H 1 56 ILE HA 4.020 . 4.020 3.121 2.844 3.311 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1565 1 48 CYS H 1 56 ILE MG 4.750 . 4.750 4.140 3.762 4.384 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1566 1 48 CYS H 1 57 VAL H 5.320 . 5.320 4.473 4.321 4.627 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1567 1 48 CYS H 1 57 VAL MG1 4.970 . 4.970 4.422 4.270 4.623 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1568 1 48 CYS H 1 57 VAL MG2 4.100 . 4.100 3.453 3.265 3.603 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1569 1 48 CYS HA 1 49 SER H 3.110 . 3.110 2.316 2.244 2.381 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1570 1 48 CYS HB2 1 49 SER H 4.000 . 4.000 3.697 3.539 3.809 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1571 1 48 CYS HB2 1 55 GLY H 5.200 . 5.200 4.414 4.312 4.747 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1572 1 48 CYS HB2 1 57 VAL MG1 4.080 . 4.080 3.073 2.884 3.359 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1573 1 48 CYS HB2 1 57 VAL MG2 3.510 . 3.510 2.462 2.296 2.823 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1574 1 48 CYS HB2 1 62 LEU QD 4.880 . 4.880 4.419 4.205 4.601 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1575 1 48 CYS HB3 1 49 SER H 3.360 . 3.360 2.426 2.320 2.574 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1576 1 48 CYS HB3 1 57 VAL MG1 5.190 . 5.190 4.232 3.994 4.512 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1577 1 48 CYS HB3 1 57 VAL MG2 4.050 . 4.050 3.560 3.440 3.852 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1578 1 48 CYS HG 1 57 VAL H 5.500 . 5.500 4.921 4.570 5.216 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1579 1 48 CYS HG 1 57 VAL HB 4.550 . 4.550 4.187 4.057 4.472 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1580 1 48 CYS HG 1 57 VAL MG2 2.990 . 2.990 1.763 1.639 2.072 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1581 1 48 CYS HG 1 62 LEU MD1 4.200 . 4.200 3.535 2.607 4.254 0.054 6 0 "[ . 1 . 2 . 3 . 4]" 1
1582 1 48 CYS HG 1 62 LEU QD 3.270 . 3.270 2.613 2.273 2.965 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1583 1 48 CYS HG 1 62 LEU MD2 4.200 . 4.200 3.105 2.292 4.145 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1584 1 49 SER H 1 49 SER HB2 3.770 . 3.770 3.079 2.931 3.150 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1585 1 49 SER H 1 49 SER QB 3.270 . 3.270 2.488 2.408 2.556 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1586 1 49 SER H 1 49 SER HB3 3.770 . 3.770 2.627 2.513 2.728 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1587 1 49 SER H 1 50 LEU QD 5.390 . 5.390 5.294 5.141 5.480 0.090 39 0 "[ . 1 . 2 . 3 . 4]" 1
1588 1 49 SER HA 1 50 LEU H 2.840 . 2.840 2.138 2.098 2.172 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1589 1 49 SER HA 1 50 LEU HB2 5.240 . 5.240 4.492 4.291 4.606 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1590 1 49 SER HA 1 50 LEU QB 4.560 . 4.560 3.969 3.886 4.074 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1591 1 49 SER HA 1 50 LEU HB3 5.240 . 5.240 4.425 4.309 4.544 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1592 1 49 SER HA 1 53 ARG H 4.530 . 4.530 4.495 4.104 4.552 0.022 19 0 "[ . 1 . 2 . 3 . 4]" 1
1593 1 49 SER HA 1 54 GLN H 4.920 . 4.920 4.662 4.479 4.827 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1594 1 49 SER HA 1 54 GLN HA 3.500 . 3.500 2.257 2.121 2.478 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1595 1 49 SER HA 1 54 GLN HB2 5.180 . 5.180 4.889 4.768 5.039 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1596 1 49 SER HA 1 54 GLN HB3 5.500 . 5.500 4.315 4.154 4.588 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1597 1 49 SER HA 1 54 GLN HG2 4.610 . 4.610 2.964 2.588 3.578 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1598 1 49 SER HA 1 54 GLN HG3 4.770 . 4.770 3.460 3.156 3.779 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1599 1 49 SER HA 1 55 GLY H 4.100 . 4.100 3.859 3.631 4.094 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1600 1 49 SER QB 1 54 GLN HA 4.200 . 4.200 3.745 3.431 4.068 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1601 1 49 SER QB 1 54 GLN HG2 3.810 . 3.810 2.427 2.189 2.827 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1602 1 49 SER QB 1 54 GLN HG3 4.050 . 4.050 3.203 2.890 3.332 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1603 1 49 SER HB2 1 50 LEU H 4.680 . 4.680 4.312 4.212 4.411 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1604 1 49 SER HB2 1 54 GLN HG2 4.660 . 4.660 2.443 2.200 2.854 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1605 1 49 SER HB2 1 54 GLN HG3 4.800 . 4.800 3.253 2.924 3.397 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1606 1 49 SER HB3 1 50 LEU H 4.680 . 4.680 4.255 4.181 4.362 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1607 1 49 SER HB3 1 54 GLN HG2 4.660 . 4.660 4.168 3.930 4.597 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1608 1 49 SER HB3 1 54 GLN HG3 4.800 . 4.800 4.796 4.523 4.859 0.059 38 0 "[ . 1 . 2 . 3 . 4]" 1
1609 1 50 LEU H 1 50 LEU HB2 3.620 . 3.620 3.270 3.070 3.378 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1610 1 50 LEU H 1 50 LEU QB 3.140 . 3.140 2.599 2.469 2.675 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1611 1 50 LEU H 1 50 LEU HB3 3.620 . 3.620 2.730 2.569 2.813 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1612 1 50 LEU H 1 50 LEU MD1 4.510 . 4.510 4.491 4.167 4.605 0.095 12 0 "[ . 1 . 2 . 3 . 4]" 1
1613 1 50 LEU H 1 50 LEU MD2 4.510 . 4.510 4.493 4.251 4.579 0.069 6 0 "[ . 1 . 2 . 3 . 4]" 1
1614 1 50 LEU H 1 50 LEU HG 4.920 . 4.920 4.510 4.372 4.966 0.046 8 0 "[ . 1 . 2 . 3 . 4]" 1
1615 1 50 LEU H 1 53 ARG H 3.700 . 3.700 3.047 2.704 3.159 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1616 1 50 LEU H 1 53 ARG QB 5.340 . 5.340 4.547 3.579 5.064 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1617 1 50 LEU H 1 54 GLN HA 3.920 . 3.920 3.398 3.253 3.550 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1618 1 50 LEU HA 1 50 LEU MD1 4.110 . 4.110 2.418 2.173 3.505 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1619 1 50 LEU HA 1 50 LEU QD 3.010 . 3.010 2.251 2.162 2.542 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1620 1 50 LEU HA 1 50 LEU MD2 4.110 . 4.110 3.707 2.210 3.951 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1621 1 50 LEU QB 1 50 LEU QD 2.510 . 2.510 1.938 1.860 2.058 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1622 1 50 LEU HB2 1 50 LEU MD1 3.370 . 3.370 2.475 2.125 3.157 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1623 1 50 LEU HB2 1 50 LEU MD2 3.370 . 3.370 2.470 2.341 2.722 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1624 1 50 LEU HB3 1 50 LEU MD1 3.370 . 3.370 3.098 2.181 3.286 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1625 1 50 LEU HB3 1 50 LEU MD2 3.370 . 3.370 2.342 2.116 3.236 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1626 1 50 LEU QD 1 51 HIS QB 3.910 . 3.910 3.387 2.018 3.965 0.055 3 0 "[ . 1 . 2 . 3 . 4]" 1
1627 1 50 LEU QD 1 51 HIS HD2 3.830 . 3.830 2.737 1.924 3.895 0.065 35 0 "[ . 1 . 2 . 3 . 4]" 1
1628 1 50 LEU QD 1 53 ARG H 5.440 . 5.440 5.026 4.450 5.282 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1629 1 50 LEU MD1 1 51 HIS QB 4.680 . 4.680 3.932 2.027 4.716 0.036 40 0 "[ . 1 . 2 . 3 . 4]" 1
1630 1 50 LEU MD1 1 51 HIS HD2 4.370 . 4.370 3.170 2.015 4.334 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1631 1 50 LEU MD2 1 51 HIS QB 4.680 . 4.680 3.890 2.983 4.395 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1632 1 50 LEU MD2 1 51 HIS HD2 4.370 . 4.370 3.540 2.089 4.511 0.141 19 0 "[ . 1 . 2 . 3 . 4]" 1
1633 1 50 LEU HG 1 51 HIS QB 5.130 . 5.130 3.251 2.149 5.122 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1634 1 50 LEU HG 1 51 HIS HD2 5.250 . 5.250 3.085 1.872 5.252 0.002 32 0 "[ . 1 . 2 . 3 . 4]" 1
1635 1 51 HIS HA 1 51 HIS HD2 4.530 . 4.530 3.663 2.379 4.564 0.034 34 0 "[ . 1 . 2 . 3 . 4]" 1
1636 1 51 HIS HA 1 53 ARG H 4.510 . 4.510 4.459 4.347 4.580 0.070 40 0 "[ . 1 . 2 . 3 . 4]" 1
1637 1 51 HIS QB 1 52 GLY H 4.780 . 4.780 3.836 3.791 3.877 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1638 1 51 HIS QB 1 53 ARG H 4.000 . 4.000 3.490 3.299 3.685 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1639 1 52 GLY H 1 53 ARG H 3.420 . 3.420 2.696 2.483 2.841 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1640 1 52 GLY H 1 53 ARG QG 5.340 . 5.340 4.679 4.172 5.167 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1641 1 53 ARG H 1 53 ARG QB 2.920 . 2.920 2.788 2.388 3.056 0.136 40 0 "[ . 1 . 2 . 3 . 4]" 1
1642 1 53 ARG H 1 53 ARG QD 4.970 . 4.970 4.282 3.765 4.555 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1643 1 53 ARG H 1 53 ARG HG2 4.440 . 4.440 2.881 2.167 4.157 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1644 1 53 ARG H 1 53 ARG QG 3.760 . 3.760 2.538 2.094 3.070 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1645 1 53 ARG H 1 53 ARG HG3 4.440 . 4.440 3.272 2.747 4.017 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1646 1 53 ARG H 1 54 GLN H 4.480 . 4.480 4.481 4.390 4.515 0.035 39 0 "[ . 1 . 2 . 3 . 4]" 1
1647 1 53 ARG H 1 54 GLN HA 5.080 . 5.080 4.862 4.750 5.069 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1648 1 53 ARG HA 1 53 ARG HG2 4.000 . 4.000 3.476 2.415 3.958 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1649 1 53 ARG HA 1 53 ARG HG3 4.000 . 4.000 3.573 2.995 3.838 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1650 1 53 ARG HA 1 54 GLN H 2.720 . 2.720 2.342 2.157 2.459 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1651 1 53 ARG QB 1 54 GLN H 3.500 . 3.500 2.632 2.413 2.973 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1652 1 53 ARG HB2 1 53 ARG QD 3.750 . 3.750 2.468 2.225 3.072 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1653 1 53 ARG HB3 1 53 ARG QD 3.750 . 3.750 2.527 2.217 3.054 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1654 1 53 ARG QD 1 54 GLN H 5.340 . 5.340 4.610 3.968 5.294 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1655 1 53 ARG QG 1 54 GLN H 4.180 . 4.180 3.566 2.901 4.096 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1656 1 54 GLN H 1 54 GLN HB2 3.180 . 3.180 2.437 2.241 2.544 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1657 1 54 GLN H 1 54 GLN HB3 3.800 . 3.800 3.661 3.552 3.711 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1658 1 54 GLN H 1 54 GLN HG2 4.500 . 4.500 4.215 3.997 4.427 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1659 1 54 GLN H 1 54 GLN HG3 3.700 . 3.700 3.100 2.859 3.461 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1660 1 54 GLN HA 1 54 GLN HG2 4.030 . 4.030 2.572 2.445 2.823 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1661 1 54 GLN HA 1 55 GLY H 2.870 . 2.870 2.295 2.229 2.384 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1662 1 54 GLN HB2 1 54 GLN QE 4.280 . 4.280 2.656 2.019 3.948 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1663 1 54 GLN HB2 1 55 GLY H 4.580 . 4.580 3.978 3.799 4.211 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1664 1 54 GLN HB3 1 55 GLY H 3.840 . 3.840 2.769 2.546 3.127 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1665 1 54 GLN HG2 1 55 GLY H 4.370 . 4.370 3.948 3.702 4.160 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1666 1 54 GLN HG3 1 55 GLY H 4.800 . 4.800 4.771 4.584 4.824 0.024 30 0 "[ . 1 . 2 . 3 . 4]" 1
1667 1 55 GLY H 1 56 ILE H 4.110 . 4.110 4.182 4.137 4.314 0.204 40 0 "[ . 1 . 2 . 3 . 4]" 1
1668 1 55 GLY H 1 56 ILE MG 4.900 . 4.900 4.564 4.351 4.730 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1669 1 55 GLY HA2 1 56 ILE H 3.450 . 3.450 2.790 2.534 2.895 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1670 1 55 GLY HA2 1 56 ILE HG12 5.230 . 5.230 4.296 4.006 4.480 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1671 1 55 GLY HA2 1 56 ILE MG 4.290 . 4.290 3.289 3.145 3.412 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1672 1 55 GLY HA3 1 56 ILE H 3.420 . 3.420 2.320 2.243 2.513 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1673 1 55 GLY HA3 1 56 ILE MD 5.500 . 5.500 5.636 5.577 5.900 0.400 40 0 "[ . 1 . 2 . 3 . 4]" 1
1674 1 55 GLY HA3 1 56 ILE MG 5.010 . 5.010 4.100 3.977 4.278 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1675 1 56 ILE H 1 56 ILE MD 4.280 . 4.280 3.872 3.773 3.957 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1676 1 56 ILE H 1 56 ILE HG12 4.220 . 4.220 2.218 2.079 2.327 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1677 1 56 ILE H 1 56 ILE HG13 3.710 . 3.710 3.032 2.759 3.193 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1678 1 56 ILE H 1 56 ILE MG 3.440 . 3.440 2.785 2.626 2.893 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1679 1 56 ILE H 1 57 VAL H 4.630 . 4.630 4.508 4.449 4.621 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1680 1 56 ILE H 1 57 VAL MG1 4.720 . 4.720 4.401 4.267 4.520 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1681 1 56 ILE H 1 57 VAL MG2 4.860 . 4.860 4.981 4.897 5.064 0.204 39 0 "[ . 1 . 2 . 3 . 4]" 1
1682 1 56 ILE HA 1 56 ILE MD 4.310 . 4.310 4.236 4.196 4.262 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1683 1 56 ILE HA 1 56 ILE MG 2.970 . 2.970 2.347 2.161 2.406 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1684 1 56 ILE HA 1 57 VAL H 3.020 . 3.020 2.218 2.169 2.289 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1685 1 56 ILE HA 1 57 VAL HB 5.500 . 5.500 5.524 5.419 5.586 0.086 39 0 "[ . 1 . 2 . 3 . 4]" 1
1686 1 56 ILE HA 1 57 VAL MG1 4.490 . 4.490 3.868 3.591 3.980 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1687 1 56 ILE HA 1 57 VAL MG2 3.890 . 3.890 3.122 2.996 3.229 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1688 1 56 ILE HB 1 56 ILE MD 3.140 . 3.140 2.419 2.343 2.466 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1689 1 56 ILE HB 1 57 VAL H 3.500 . 3.500 2.643 2.456 2.783 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1690 1 56 ILE MD 1 56 ILE MG 2.720 . 2.720 2.184 2.125 2.355 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1691 1 56 ILE MD 1 57 VAL H 4.780 . 4.780 4.454 4.264 4.580 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1692 1 56 ILE MD 1 58 PRO HD3 5.500 . 5.500 5.421 5.226 5.552 0.052 38 0 "[ . 1 . 2 . 3 . 4]" 1
1693 1 56 ILE MD 1 95 ARG HA 5.230 . 5.230 4.693 4.011 5.079 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1694 1 56 ILE MD 1 95 ARG QD 3.990 . 3.990 3.008 2.125 4.086 0.096 25 0 "[ . 1 . 2 . 3 . 4]" 1
1695 1 56 ILE MD 1 95 ARG HG2 4.520 . 4.520 3.216 2.825 3.841 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1696 1 56 ILE MD 1 95 ARG HG3 5.060 . 5.060 4.453 3.439 5.072 0.012 12 0 "[ . 1 . 2 . 3 . 4]" 1
1697 1 56 ILE HG12 1 57 VAL H 5.500 . 5.500 4.822 4.702 5.028 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1698 1 56 ILE HG13 1 56 ILE MG 3.620 . 3.620 3.247 3.190 3.288 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1699 1 56 ILE HG13 1 57 VAL H 4.770 . 4.770 3.852 3.659 4.047 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1700 1 56 ILE MG 1 57 VAL H 3.900 . 3.900 3.768 3.461 3.864 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1701 1 57 VAL H 1 57 VAL HB 3.810 . 3.810 3.767 3.736 3.811 0.001 24 0 "[ . 1 . 2 . 3 . 4]" 1
1702 1 57 VAL H 1 57 VAL MG1 3.700 . 3.700 3.352 3.258 3.422 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1703 1 57 VAL H 1 57 VAL MG2 3.180 . 3.180 2.201 2.141 2.259 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1704 1 57 VAL H 1 58 PRO HA 5.500 . 5.500 4.753 4.631 4.830 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1705 1 57 VAL H 1 58 PRO HD2 5.500 . 5.500 5.017 4.971 5.083 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1706 1 57 VAL H 1 62 LEU QD 4.760 . 4.760 4.590 4.418 4.840 0.080 22 0 "[ . 1 . 2 . 3 . 4]" 1
1707 1 57 VAL HA 1 57 VAL MG1 3.250 . 3.250 2.204 2.169 2.295 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1708 1 57 VAL HA 1 57 VAL MG2 3.440 . 3.440 3.195 3.175 3.226 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1709 1 57 VAL HA 1 58 PRO HD2 3.660 . 3.660 2.523 2.444 2.643 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1710 1 57 VAL HA 1 58 PRO HD3 3.950 . 3.950 2.386 2.309 2.465 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1711 1 57 VAL HA 1 58 PRO HG2 4.780 . 4.780 4.598 4.533 4.711 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1712 1 57 VAL HA 1 58 PRO HG3 4.910 . 4.910 4.572 4.476 4.626 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1713 1 57 VAL HB 1 58 PRO HD2 3.820 . 3.820 2.567 2.406 2.666 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1714 1 57 VAL HB 1 58 PRO HD3 4.250 . 4.250 3.848 3.688 3.937 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1715 1 57 VAL HB 1 62 LEU MD1 4.500 . 4.500 3.146 2.215 4.153 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1716 1 57 VAL HB 1 62 LEU QD 3.640 . 3.640 2.516 2.206 2.802 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1717 1 57 VAL HB 1 62 LEU MD2 4.500 . 4.500 3.318 2.441 4.277 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1718 1 57 VAL MG1 1 58 PRO HD2 3.460 . 3.460 3.070 2.940 3.255 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1719 1 57 VAL MG1 1 58 PRO HD3 3.830 . 3.830 3.762 3.594 3.846 0.016 29 0 "[ . 1 . 2 . 3 . 4]" 1
1720 1 57 VAL MG1 1 62 LEU QD 3.480 . 3.480 3.120 2.833 3.332 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1721 1 57 VAL MG2 1 58 PRO HD2 4.060 . 4.060 4.106 3.981 4.170 0.110 37 0 "[ . 1 . 2 . 3 . 4]" 1
1722 1 57 VAL MG2 1 58 PRO HD3 4.880 . 4.880 4.788 4.664 4.841 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1723 1 57 VAL MG2 1 62 LEU MD1 3.840 . 3.840 2.894 1.970 3.653 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1724 1 57 VAL MG2 1 62 LEU QD 2.850 . 2.850 2.095 1.962 2.268 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1725 1 57 VAL MG2 1 62 LEU MD2 3.840 . 3.840 2.737 2.036 3.692 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1726 1 58 PRO HA 1 59 GLY H 2.930 . 2.930 2.187 2.151 2.252 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1727 1 58 PRO HA 1 59 GLY HA2 4.880 . 4.880 4.423 4.343 4.469 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1728 1 58 PRO HA 1 59 GLY HA3 4.630 . 4.630 4.405 4.352 4.428 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1729 1 58 PRO HA 1 60 ASN H 4.240 . 4.240 3.684 3.529 3.978 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1730 1 58 PRO HA 1 93 PRO HD2 4.490 . 4.490 3.161 2.919 3.494 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1731 1 58 PRO HB2 1 59 GLY H 4.020 . 4.020 3.762 3.630 3.887 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1732 1 58 PRO HB2 1 60 ASN H 4.330 . 4.330 3.017 2.745 3.398 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1733 1 58 PRO HB2 1 61 ARG H 4.420 . 4.420 3.637 3.300 3.934 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1734 1 58 PRO HB2 1 92 LYS HA 4.580 . 4.580 2.992 2.718 3.492 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1735 1 58 PRO HB2 1 92 LYS QG 5.340 . 5.340 4.169 3.279 5.374 0.034 1 0 "[ . 1 . 2 . 3 . 4]" 1
1736 1 58 PRO HB2 1 93 PRO HD2 4.050 . 4.050 2.823 2.538 3.184 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1737 1 58 PRO HB2 1 93 PRO HD3 4.190 . 4.190 3.045 2.743 3.702 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1738 1 58 PRO HB2 1 93 PRO HG3 5.500 . 5.500 4.403 3.881 4.989 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1739 1 58 PRO HB3 1 92 LYS QG 4.650 . 4.650 3.588 2.710 4.602 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1740 1 58 PRO HB3 1 93 PRO HD2 3.860 . 3.860 2.169 2.039 2.519 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1741 1 58 PRO HB3 1 93 PRO HD3 4.400 . 4.400 3.402 2.952 4.045 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1742 1 58 PRO HD2 1 61 ARG QD 5.340 . 5.340 3.898 3.626 4.720 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1743 1 58 PRO HG2 1 61 ARG H 4.880 . 4.880 3.805 3.333 4.082 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1744 1 58 PRO HG2 1 61 ARG QD 3.840 . 3.840 2.610 2.114 3.380 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1745 1 58 PRO HG2 1 61 ARG HE 4.810 . 4.810 3.761 2.481 4.735 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1746 1 58 PRO HG2 1 61 ARG QG 4.220 . 4.220 2.258 2.072 2.951 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1747 1 58 PRO HG2 1 92 LYS QE 5.250 . 5.250 4.727 4.029 5.373 0.123 38 0 "[ . 1 . 2 . 3 . 4]" 1
1748 1 58 PRO HG3 1 61 ARG QD 4.350 . 4.350 3.230 2.883 4.281 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1749 1 58 PRO HG3 1 92 LYS HA 5.340 . 5.340 3.962 3.579 4.482 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1750 1 58 PRO HG3 1 92 LYS QE 4.420 . 4.420 3.211 2.519 3.903 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1751 1 58 PRO HG3 1 92 LYS QG 5.320 . 5.320 3.202 2.194 4.942 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1752 1 59 GLY H 1 60 ASN H 3.220 . 3.220 2.692 2.583 2.848 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1753 1 59 GLY H 1 93 PRO HG2 5.120 . 5.120 4.621 4.147 5.133 0.013 26 0 "[ . 1 . 2 . 3 . 4]" 1
1754 1 59 GLY HA2 1 60 ASN H 3.530 . 3.530 3.432 3.379 3.521 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1755 1 59 GLY HA2 1 61 ARG H 4.840 . 4.840 3.608 3.341 4.010 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1756 1 59 GLY HA2 1 62 LEU H 4.020 . 4.020 3.456 3.187 3.764 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1757 1 59 GLY HA2 1 62 LEU QD 3.550 . 3.550 2.634 2.241 3.242 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1758 1 59 GLY HA3 1 61 ARG H 5.160 . 5.160 4.433 4.191 4.683 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1759 1 59 GLY HA3 1 62 LEU H 4.930 . 4.930 4.493 4.302 4.684 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1760 1 59 GLY HA3 1 62 LEU QD 4.610 . 4.610 3.936 3.653 4.520 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1761 1 60 ASN H 1 60 ASN HB2 3.640 . 3.640 2.565 2.049 3.621 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1762 1 60 ASN H 1 60 ASN QB 3.120 . 3.120 2.182 2.020 2.469 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1763 1 60 ASN H 1 60 ASN HB3 3.640 . 3.640 2.704 2.180 3.061 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1764 1 60 ASN H 1 60 ASN QD 4.780 . 4.780 4.477 4.172 4.614 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1765 1 60 ASN H 1 61 ARG H 3.250 . 3.250 2.736 2.614 2.864 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1766 1 60 ASN H 1 62 LEU H 4.220 . 4.220 4.249 4.205 4.343 0.123 39 0 "[ . 1 . 2 . 3 . 4]" 1
1767 1 60 ASN HA 1 62 LEU H 4.420 . 4.420 3.891 3.562 4.096 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1768 1 60 ASN QB 1 61 ARG H 4.110 . 4.110 3.258 2.884 3.894 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1769 1 60 ASN QB 1 90 PRO QG 4.480 . 4.480 3.387 2.207 4.143 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1770 1 60 ASN HB2 1 61 ARG H 4.860 . 4.860 4.084 3.725 4.407 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1771 1 60 ASN HB3 1 61 ARG H 4.860 . 4.860 3.446 2.958 4.341 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1772 1 60 ASN QD 1 90 PRO QB 3.590 . 3.590 2.377 2.077 2.892 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1773 1 60 ASN QD 1 90 PRO QG 3.850 . 3.850 2.810 2.065 3.539 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1774 1 60 ASN HD21 1 90 PRO HG2 4.990 . 4.990 3.719 2.271 4.499 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1775 1 60 ASN HD21 1 90 PRO HG3 4.990 . 4.990 4.060 3.111 4.644 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1776 1 60 ASN HD22 1 90 PRO HG2 4.990 . 4.990 3.321 2.388 4.173 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1777 1 60 ASN HD22 1 90 PRO HG3 4.990 . 4.990 3.899 2.557 4.983 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1778 1 61 ARG H 1 61 ARG HB2 3.930 . 3.930 3.729 2.512 3.904 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1779 1 61 ARG H 1 61 ARG QD 4.560 . 4.560 4.326 3.928 4.480 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1780 1 61 ARG H 1 61 ARG HE 5.000 . 5.000 4.433 3.772 5.125 0.125 38 0 "[ . 1 . 2 . 3 . 4]" 1
1781 1 61 ARG H 1 61 ARG HG2 3.940 . 3.940 2.538 2.086 3.815 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1782 1 61 ARG H 1 61 ARG QG 3.300 . 3.300 2.270 1.816 2.727 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1783 1 61 ARG H 1 61 ARG HG3 3.940 . 3.940 2.961 1.833 3.343 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1784 1 61 ARG H 1 62 LEU H 3.040 . 3.040 2.353 2.115 2.584 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1785 1 61 ARG H 1 62 LEU HB2 4.390 . 4.390 3.563 3.189 3.931 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1786 1 61 ARG H 1 62 LEU QD 5.440 . 5.440 4.303 3.923 4.773 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1787 1 61 ARG HB2 1 62 LEU QD 5.440 . 5.440 5.033 3.448 5.415 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1788 1 61 ARG HB3 1 61 ARG HE 5.190 . 5.190 2.736 2.194 4.467 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1789 1 62 LEU H 1 62 LEU HB2 3.300 . 3.300 2.677 2.412 2.966 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1790 1 62 LEU H 1 62 LEU HB3 3.670 . 3.670 3.114 2.603 3.679 0.009 39 0 "[ . 1 . 2 . 3 . 4]" 1
1791 1 62 LEU H 1 62 LEU MD1 4.470 . 4.470 4.180 3.714 4.393 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1792 1 62 LEU H 1 62 LEU QD 3.930 . 3.930 3.812 3.545 3.936 0.006 13 0 "[ . 1 . 2 . 3 . 4]" 1
1793 1 62 LEU H 1 62 LEU MD2 4.470 . 4.470 4.416 4.277 4.547 0.077 2 0 "[ . 1 . 2 . 3 . 4]" 1
1794 1 62 LEU H 1 62 LEU HG 4.590 . 4.590 4.222 3.371 4.662 0.072 12 0 "[ . 1 . 2 . 3 . 4]" 1
1795 1 62 LEU H 1 63 LYS H 4.590 . 4.590 4.466 4.392 4.544 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1796 1 62 LEU HA 1 62 LEU MD1 3.830 . 3.830 2.801 2.001 3.843 0.013 24 0 "[ . 1 . 2 . 3 . 4]" 1
1797 1 62 LEU HA 1 62 LEU QD 2.880 . 2.880 2.099 1.994 2.251 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1798 1 62 LEU HA 1 62 LEU MD2 3.830 . 3.830 3.126 2.008 3.870 0.040 10 0 "[ . 1 . 2 . 3 . 4]" 1
1799 1 62 LEU HA 1 62 LEU HG 3.970 . 3.970 2.860 2.372 3.270 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1800 1 62 LEU HA 1 63 LYS H 2.990 . 2.990 2.252 2.134 2.316 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1801 1 62 LEU HA 1 63 LYS HB2 4.950 . 4.950 4.543 4.365 4.751 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1802 1 62 LEU HA 1 63 LYS HB3 4.960 . 4.960 4.367 4.235 4.484 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1803 1 62 LEU HB2 1 62 LEU MD1 3.440 . 3.440 2.345 2.116 2.486 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1804 1 62 LEU HB2 1 62 LEU QD 2.900 . 2.900 2.156 2.074 2.264 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1805 1 62 LEU HB2 1 62 LEU MD2 3.440 . 3.440 2.694 2.286 3.233 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1806 1 62 LEU HB2 1 63 LYS H 4.100 . 4.100 4.067 3.828 4.161 0.061 12 0 "[ . 1 . 2 . 3 . 4]" 1
1807 1 62 LEU HB3 1 62 LEU MD1 3.340 . 3.340 2.903 2.403 3.225 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1808 1 62 LEU HB3 1 62 LEU QD 2.800 . 2.800 2.191 2.104 2.276 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1809 1 62 LEU HB3 1 62 LEU MD2 3.340 . 3.340 2.303 2.221 2.374 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1810 1 62 LEU HB3 1 63 LYS H 3.790 . 3.790 3.248 2.489 3.840 0.050 17 0 "[ . 1 . 2 . 3 . 4]" 1
1811 1 62 LEU QD 1 63 LYS H 3.420 . 3.420 2.597 2.263 3.291 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1812 1 62 LEU QD 1 63 LYS HA 5.080 . 5.080 4.684 4.523 4.849 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1813 1 62 LEU QD 1 63 LYS HB2 5.440 . 5.440 5.167 4.927 5.559 0.119 1 0 "[ . 1 . 2 . 3 . 4]" 1
1814 1 62 LEU QD 1 64 ILE MD 4.720 . 4.720 3.654 3.186 4.133 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1815 1 62 LEU MD1 1 63 LYS H 4.360 . 4.360 3.379 2.271 4.517 0.157 38 0 "[ . 1 . 2 . 3 . 4]" 1
1816 1 62 LEU MD2 1 63 LYS H 4.360 . 4.360 3.517 2.449 4.346 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1817 1 62 LEU HG 1 63 LYS H 4.340 . 4.340 3.328 2.209 4.422 0.082 38 0 "[ . 1 . 2 . 3 . 4]" 1
1818 1 63 LYS H 1 63 LYS HB2 3.500 . 3.500 3.269 3.084 3.486 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1819 1 63 LYS H 1 63 LYS HB3 3.380 . 3.380 2.581 2.479 2.695 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1820 1 63 LYS H 1 63 LYS HG2 4.760 . 4.760 4.377 4.170 4.604 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1821 1 63 LYS H 1 63 LYS HG3 4.770 . 4.770 4.628 4.473 4.755 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1822 1 63 LYS H 1 64 ILE H 4.470 . 4.470 4.301 4.139 4.400 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1823 1 63 LYS HA 1 63 LYS QD 4.460 . 4.460 3.868 3.120 4.383 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1824 1 63 LYS HA 1 64 ILE H 3.120 . 3.120 2.130 2.068 2.165 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1825 1 63 LYS HA 1 64 ILE HB 4.810 . 4.810 4.602 4.508 4.676 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1826 1 63 LYS HA 1 64 ILE MD 4.610 . 4.610 4.672 4.623 4.802 0.192 39 0 "[ . 1 . 2 . 3 . 4]" 1
1827 1 63 LYS HA 1 64 ILE MG 5.500 . 5.500 5.502 5.457 5.537 0.037 2 0 "[ . 1 . 2 . 3 . 4]" 1
1828 1 63 LYS HA 1 65 LEU MD2 5.000 . 5.000 5.061 4.989 5.382 0.382 39 0 "[ . 1 . 2 . 3 . 4]" 1
1829 1 63 LYS HB2 1 63 LYS QE 5.000 . 5.000 2.609 2.106 3.855 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1830 1 63 LYS HB2 1 64 ILE H 4.330 . 4.330 4.217 4.120 4.383 0.053 40 0 "[ . 1 . 2 . 3 . 4]" 1
1831 1 63 LYS HB3 1 63 LYS QE 4.720 . 4.720 2.751 2.333 4.142 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1832 1 63 LYS HB3 1 64 ILE H 4.480 . 4.480 4.371 4.279 4.416 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1833 1 63 LYS QD 1 64 ILE H 4.820 . 4.820 4.665 3.917 4.963 0.143 38 0 "[ . 1 . 2 . 3 . 4]" 1
1834 1 63 LYS QD 1 65 LEU MD2 3.960 . 3.960 3.291 2.319 4.244 0.284 40 0 "[ . 1 . 2 . 3 . 4]" 1
1835 1 63 LYS QE 1 63 LYS HG2 3.420 . 3.420 2.652 2.236 3.513 0.093 36 0 "[ . 1 . 2 . 3 . 4]" 1
1836 1 63 LYS QE 1 63 LYS HG3 3.580 . 3.580 3.007 2.140 3.382 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1837 1 63 LYS QE 1 65 LEU MD2 3.900 . 3.900 3.271 2.359 4.258 0.358 34 0 "[ . 1 . 2 . 3 . 4]" 1
1838 1 63 LYS HG2 1 64 ILE H 4.170 . 4.170 3.816 3.223 4.206 0.036 23 0 "[ . 1 . 2 . 3 . 4]" 1
1839 1 63 LYS HG2 1 65 LEU MD2 4.180 . 4.180 2.309 2.143 2.657 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1840 1 63 LYS HG3 1 64 ILE H 3.990 . 3.990 2.936 2.622 3.313 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1841 1 63 LYS HG3 1 65 LEU MD2 4.430 . 4.430 3.543 3.257 4.035 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1842 1 64 ILE H 1 64 ILE HB 2.970 . 2.970 2.512 2.449 2.596 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1843 1 64 ILE H 1 64 ILE MD 3.790 . 3.790 3.419 3.310 3.587 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1844 1 64 ILE H 1 64 ILE HG12 4.020 . 4.020 2.232 2.092 2.393 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1845 1 64 ILE H 1 64 ILE QG 3.360 . 3.360 2.213 2.076 2.367 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1846 1 64 ILE H 1 64 ILE HG13 4.020 . 4.020 3.641 3.491 3.766 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1847 1 64 ILE H 1 64 ILE MG 3.820 . 3.820 3.806 3.780 3.827 0.007 30 0 "[ . 1 . 2 . 3 . 4]" 1
1848 1 64 ILE H 1 65 LEU H 4.590 . 4.590 4.597 4.577 4.678 0.088 40 0 "[ . 1 . 2 . 3 . 4]" 1
1849 1 64 ILE HA 1 64 ILE MD 3.470 . 3.470 2.216 2.165 2.333 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1850 1 64 ILE HA 1 64 ILE HG12 3.950 . 3.950 3.124 3.025 3.176 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1851 1 64 ILE HA 1 64 ILE QG 3.440 . 3.440 2.993 2.927 3.046 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1852 1 64 ILE HA 1 64 ILE HG13 3.950 . 3.950 3.831 3.782 3.915 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1853 1 64 ILE HA 1 64 ILE MG 3.130 . 3.130 2.416 2.384 2.467 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1854 1 64 ILE HA 1 65 LEU H 2.950 . 2.950 2.166 2.134 2.238 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1855 1 64 ILE HA 1 65 LEU MD1 5.170 . 5.170 5.155 5.078 5.215 0.045 27 0 "[ . 1 . 2 . 3 . 4]" 1
1856 1 64 ILE HA 1 65 LEU HG 4.180 . 4.180 3.847 3.734 3.948 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1857 1 64 ILE HB 1 64 ILE MD 3.290 . 3.290 3.294 3.281 3.315 0.025 40 0 "[ . 1 . 2 . 3 . 4]" 1
1858 1 64 ILE HB 1 65 LEU H 4.350 . 4.350 4.117 4.046 4.246 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1859 1 64 ILE MD 1 64 ILE MG 2.640 . 2.640 2.055 2.018 2.137 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1860 1 64 ILE MD 1 65 LEU H 4.010 . 4.010 3.723 3.603 3.949 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1861 1 64 ILE QG 1 65 LEU H 5.340 . 5.340 4.639 4.576 4.781 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1862 1 64 ILE HG12 1 64 ILE MG 3.400 . 3.400 3.224 3.210 3.244 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1863 1 64 ILE HG13 1 64 ILE MG 3.400 . 3.400 2.347 2.302 2.465 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1864 1 64 ILE MG 1 65 LEU H 3.200 . 3.200 2.510 2.423 2.650 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1865 1 64 ILE MG 1 65 LEU HA 4.280 . 4.280 3.654 3.557 3.807 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1866 1 64 ILE MG 1 65 LEU HB2 5.040 . 5.040 4.487 4.414 4.556 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1867 1 64 ILE MG 1 65 LEU HG 5.380 . 5.380 4.816 4.710 4.892 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1868 1 64 ILE MG 1 66 VAL H 4.040 . 4.040 3.098 2.477 3.611 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1869 1 64 ILE MG 1 66 VAL HA 4.360 . 4.360 3.518 2.790 3.958 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1870 1 65 LEU H 1 65 LEU HB2 3.590 . 3.590 2.611 2.517 2.662 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1871 1 65 LEU H 1 65 LEU HB3 3.840 . 3.840 3.751 3.672 3.791 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1872 1 65 LEU H 1 65 LEU MD1 3.970 . 3.970 3.987 3.802 4.028 0.058 5 0 "[ . 1 . 2 . 3 . 4]" 1
1873 1 65 LEU H 1 65 LEU MD2 3.830 . 3.830 3.700 3.605 3.786 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1874 1 65 LEU H 1 65 LEU HG 3.660 . 3.660 2.870 2.667 2.963 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1875 1 65 LEU H 1 66 VAL H 4.180 . 4.180 3.964 3.571 4.199 0.019 1 0 "[ . 1 . 2 . 3 . 4]" 1
1876 1 65 LEU HA 1 65 LEU MD2 2.800 . 2.800 2.295 2.101 2.381 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1877 1 65 LEU HA 1 65 LEU HG 4.020 . 4.020 3.324 3.237 3.368 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1878 1 65 LEU HA 1 66 VAL H 3.060 . 3.060 2.250 2.160 2.391 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1879 1 65 LEU HA 1 66 VAL QG 4.220 . 4.220 3.523 3.312 3.883 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1880 1 65 LEU HB2 1 65 LEU MD1 2.910 . 2.910 2.273 2.215 2.300 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1881 1 65 LEU HB3 1 65 LEU MD1 3.200 . 3.200 2.291 2.220 2.363 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1882 1 65 LEU HB3 1 65 LEU MD2 3.140 . 3.140 2.463 2.434 2.499 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1883 1 65 LEU HB3 1 66 VAL H 4.200 . 4.200 3.928 3.587 4.240 0.040 40 0 "[ . 1 . 2 . 3 . 4]" 1
1884 1 65 LEU MD2 1 66 VAL H 4.400 . 4.400 4.182 4.076 4.301 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1885 1 66 VAL H 1 66 VAL HB 3.790 . 3.790 3.426 2.319 3.714 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1886 1 66 VAL H 1 66 VAL MG1 3.500 . 3.500 2.776 1.905 3.770 0.270 37 0 "[ . 1 . 2 . 3 . 4]" 1
1887 1 66 VAL H 1 66 VAL QG 3.040 . 3.040 1.917 1.736 2.215 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1888 1 66 VAL H 1 66 VAL MG2 3.500 . 3.500 2.084 1.740 3.765 0.265 5 0 "[ . 1 . 2 . 3 . 4]" 1
1889 1 66 VAL HA 1 66 VAL MG1 3.240 . 3.240 2.372 2.172 3.259 0.019 35 0 "[ . 1 . 2 . 3 . 4]" 1
1890 1 66 VAL HA 1 66 VAL MG2 3.240 . 3.240 3.081 2.245 3.280 0.040 36 0 "[ . 1 . 2 . 3 . 4]" 1
1891 1 66 VAL QG 1 67 GLY H 4.670 . 4.670 3.122 2.316 3.786 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1892 1 66 VAL QG 1 67 GLY QA 4.010 . 4.010 3.695 2.944 4.232 0.222 23 0 "[ . 1 . 2 . 3 . 4]" 1
1893 1 68 MET ME 1 69 TYR QD 4.780 . 4.780 3.831 2.335 4.826 0.046 20 0 "[ . 1 . 2 . 3 . 4]" 1
1894 1 68 MET ME 1 69 TYR QE 4.650 . 4.650 3.500 2.118 4.778 0.128 38 0 "[ . 1 . 2 . 3 . 4]" 1
1895 1 69 TYR HA 1 69 TYR QD 3.760 . 3.760 2.941 2.185 3.780 0.020 34 0 "[ . 1 . 2 . 3 . 4]" 1
1896 1 71 LYS HA 1 71 LYS QD 4.400 . 4.400 3.721 2.086 4.438 0.038 3 0 "[ . 1 . 2 . 3 . 4]" 1
1897 1 71 LYS HB2 1 72 LYS H 5.210 . 5.210 3.857 2.362 4.566 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1898 1 71 LYS HB3 1 72 LYS H 5.210 . 5.210 3.784 2.250 4.558 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1899 1 72 LYS HA 1 72 LYS QD 4.320 . 4.320 3.903 2.097 4.330 0.010 40 0 "[ . 1 . 2 . 3 . 4]" 1
1900 1 72 LYS HA 1 72 LYS HG2 4.210 . 4.210 2.935 2.336 3.814 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1901 1 72 LYS HA 1 72 LYS HG3 4.210 . 4.210 3.170 2.240 3.886 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1902 1 72 LYS HA 1 73 PRO HD2 3.250 . 3.250 2.508 2.090 2.863 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1903 1 72 LYS HA 1 73 PRO HD3 3.250 . 3.250 2.591 2.337 2.999 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1904 1 72 LYS QB 1 73 PRO QD 3.490 . 3.490 2.620 2.051 3.755 0.265 28 0 "[ . 1 . 2 . 3 . 4]" 1
1905 1 72 LYS QG 1 73 PRO QD 4.630 . 4.630 3.463 2.103 4.447 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1906 1 74 ALA MB 1 75 GLY QA 4.360 . 4.360 3.786 3.450 4.141 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1907 1 84 GLU HA 1 84 GLU HG2 4.250 . 4.250 3.088 2.294 3.952 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1908 1 84 GLU HA 1 84 GLU HG3 4.250 . 4.250 3.179 2.336 3.852 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1909 1 85 LYS HA 1 85 LYS QD 4.080 . 4.080 3.608 2.153 4.196 0.116 1 0 "[ . 1 . 2 . 3 . 4]" 1
1910 1 86 GLN HA 1 86 GLN QG 3.470 . 3.470 2.612 2.232 3.440 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1911 1 86 GLN QB 1 86 GLN QE 4.040 . 4.040 3.138 1.851 3.755 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1912 1 86 GLN QB 1 86 GLN HE22 4.860 . 4.860 3.333 1.863 4.049 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1913 1 86 GLN QB 1 87 ASP H 4.410 . 4.410 3.065 1.787 4.072 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1914 1 87 ASP H 1 87 ASP QB 3.430 . 3.430 2.565 2.085 3.391 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1915 1 88 SER HA 1 89 PRO HD2 3.320 . 3.320 2.485 2.172 3.100 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1916 1 88 SER HA 1 89 PRO QD 2.900 . 2.900 2.164 1.956 2.310 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1917 1 88 SER HA 1 89 PRO HD3 3.320 . 3.320 2.551 1.982 2.969 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1918 1 88 SER HA 1 89 PRO HG2 4.810 . 4.810 4.520 4.273 4.727 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1919 1 88 SER HA 1 89 PRO QG 4.160 . 4.160 4.039 3.757 4.203 0.043 6 0 "[ . 1 . 2 . 3 . 4]" 1
1920 1 88 SER HA 1 89 PRO HG3 4.810 . 4.810 4.584 4.008 4.770 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1921 1 89 PRO HA 1 90 PRO HD2 3.360 . 3.360 2.494 2.304 2.596 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1922 1 89 PRO HA 1 90 PRO HD3 3.360 . 3.360 2.616 2.448 2.707 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1923 1 89 PRO HA 1 90 PRO HG2 4.780 . 4.780 4.615 4.470 4.683 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1924 1 89 PRO HA 1 90 PRO QG 4.200 . 4.200 4.160 4.043 4.229 0.029 40 0 "[ . 1 . 2 . 3 . 4]" 1
1925 1 89 PRO HA 1 90 PRO HG3 4.780 . 4.780 4.730 4.585 4.822 0.042 40 0 "[ . 1 . 2 . 3 . 4]" 1
1926 1 89 PRO QB 1 90 PRO HD2 4.090 . 4.090 2.486 2.299 2.773 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1927 1 89 PRO QB 1 90 PRO QD 3.440 . 3.440 2.450 2.273 2.712 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1928 1 89 PRO QB 1 90 PRO HD3 4.090 . 4.090 3.705 3.589 3.832 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1929 1 90 PRO HA 1 91 PRO HD2 3.350 . 3.350 2.664 2.473 3.128 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1930 1 90 PRO HA 1 91 PRO HD3 3.350 . 3.350 2.450 2.015 2.704 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1931 1 90 PRO HA 1 91 PRO QG 4.270 . 4.270 4.129 3.806 4.278 0.008 32 0 "[ . 1 . 2 . 3 . 4]" 1
1932 1 90 PRO QB 1 91 PRO QD 3.180 . 3.180 2.469 2.197 2.786 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1933 1 90 PRO HB2 1 91 PRO HD2 4.220 . 4.220 2.627 2.269 3.117 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1934 1 90 PRO HB2 1 91 PRO HD3 4.220 . 4.220 3.881 3.448 4.151 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1935 1 90 PRO HB3 1 91 PRO HD2 4.220 . 4.220 3.312 3.133 3.857 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1936 1 90 PRO HB3 1 91 PRO HD3 4.220 . 4.220 4.152 3.616 4.327 0.107 40 0 "[ . 1 . 2 . 3 . 4]" 1
1937 1 91 PRO HA 1 92 LYS H 2.920 . 2.920 2.309 2.172 2.489 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1938 1 91 PRO QB 1 92 LYS H 3.560 . 3.560 2.746 2.412 2.968 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1939 1 91 PRO HB2 1 92 LYS H 4.120 . 4.120 2.936 2.469 3.644 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1940 1 91 PRO HB3 1 92 LYS H 4.120 . 4.120 3.498 2.906 3.703 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1941 1 91 PRO QG 1 92 LYS H 4.800 . 4.800 4.288 4.015 4.497 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1942 1 92 LYS H 1 92 LYS QB 3.320 . 3.320 2.571 2.390 2.952 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1943 1 92 LYS H 1 92 LYS QD 4.100 . 4.100 3.929 3.523 4.174 0.074 15 0 "[ . 1 . 2 . 3 . 4]" 1
1944 1 92 LYS H 1 92 LYS HE2 5.500 . 5.500 5.006 4.007 5.584 0.084 24 0 "[ . 1 . 2 . 3 . 4]" 1
1945 1 92 LYS H 1 92 LYS HE3 5.500 . 5.500 4.514 3.632 5.151 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1946 1 92 LYS H 1 92 LYS HG2 4.140 . 4.140 2.968 1.913 3.820 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1947 1 92 LYS H 1 92 LYS QG 3.320 . 3.320 2.167 1.890 2.624 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1948 1 92 LYS H 1 92 LYS HG3 4.140 . 4.140 2.551 2.072 3.314 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1949 1 92 LYS H 1 93 PRO HD3 5.500 . 5.500 5.154 5.000 5.306 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1950 1 92 LYS HA 1 93 PRO HD2 3.590 . 3.590 2.483 2.262 2.579 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1951 1 92 LYS HA 1 93 PRO HD3 3.470 . 3.470 2.503 2.369 2.661 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1952 1 92 LYS QB 1 93 PRO HD2 3.770 . 3.770 2.588 2.242 2.848 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1953 1 92 LYS QB 1 93 PRO HD3 4.430 . 4.430 3.777 3.516 3.967 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1954 1 92 LYS HB2 1 93 PRO HD2 4.630 . 4.630 3.549 2.264 4.292 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1955 1 92 LYS HB3 1 93 PRO HD2 4.630 . 4.630 3.055 2.464 4.003 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1956 1 92 LYS QG 1 93 PRO HD2 4.790 . 4.790 3.961 3.601 4.304 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1957 1 93 PRO HA 1 94 PRO HD2 3.640 . 3.640 3.180 2.756 3.406 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1958 1 93 PRO HA 1 94 PRO QD 3.140 . 3.140 2.138 2.053 2.358 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1959 1 93 PRO HA 1 94 PRO HD3 3.640 . 3.640 2.179 2.080 2.562 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1960 1 93 PRO HA 1 94 PRO HG2 4.810 . 4.810 4.755 4.684 4.847 0.037 40 0 "[ . 1 . 2 . 3 . 4]" 1
1961 1 93 PRO HA 1 94 PRO QG 4.190 . 4.190 3.911 3.823 4.269 0.079 17 0 "[ . 1 . 2 . 3 . 4]" 1
1962 1 93 PRO HA 1 94 PRO HG3 4.810 . 4.810 4.167 4.045 4.782 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1963 1 93 PRO HB2 1 94 PRO HD2 4.140 . 4.140 2.669 2.311 2.948 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1964 1 93 PRO HB2 1 94 PRO QD 3.560 . 3.560 2.566 2.288 2.808 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1965 1 93 PRO HB2 1 94 PRO HD3 4.140 . 4.140 3.357 3.085 3.693 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1966 1 93 PRO HB3 1 94 PRO HD2 4.030 . 4.030 3.654 3.079 3.867 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1967 1 93 PRO HB3 1 94 PRO QD 3.490 . 3.490 3.232 2.975 3.408 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1968 1 93 PRO HB3 1 94 PRO HD3 4.030 . 4.030 3.635 3.405 4.057 0.027 17 0 "[ . 1 . 2 . 3 . 4]" 1
1969 1 94 PRO QB 1 95 ARG HG3 5.340 . 5.340 5.132 4.784 5.483 0.143 11 0 "[ . 1 . 2 . 3 . 4]" 1
1970 1 94 PRO QB 1 96 THR H 4.420 . 4.420 2.947 2.444 4.489 0.069 16 0 "[ . 1 . 2 . 3 . 4]" 1
1971 1 94 PRO HB2 1 96 THR H 5.290 . 5.290 3.199 2.563 5.035 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1972 1 94 PRO HB3 1 96 THR H 5.290 . 5.290 3.627 2.966 5.042 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1973 1 95 ARG H 1 95 ARG HG2 5.080 . 5.080 3.988 3.592 4.604 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1974 1 95 ARG H 1 95 ARG HG3 5.160 . 5.160 2.912 2.388 3.904 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1975 1 95 ARG H 1 96 THR H 4.970 . 4.970 2.667 2.083 3.751 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1976 1 95 ARG HA 1 95 ARG QD 4.480 . 4.480 4.072 3.858 4.246 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1977 1 95 ARG HA 1 95 ARG HG2 3.910 . 3.910 2.523 2.358 2.987 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1978 1 95 ARG HA 1 95 ARG HG3 4.040 . 4.040 2.979 2.277 3.317 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1979 1 95 ARG HB2 1 95 ARG QD 3.680 . 3.680 2.583 2.209 3.070 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1980 1 95 ARG HB3 1 95 ARG QD 3.680 . 3.680 2.594 2.303 3.029 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1981 1 96 THR H 1 96 THR MG 4.460 . 4.460 2.896 1.832 4.182 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1982 1 96 THR HA 1 96 THR MG 3.140 . 3.140 2.453 2.209 3.231 0.091 18 0 "[ . 1 . 2 . 3 . 4]" 1
1983 1 97 ARG HA 1 97 ARG QG 3.730 . 3.730 2.864 2.275 3.476 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1984 1 99 CYS HA 1 100 LEU H 3.540 . 3.540 2.642 2.106 3.564 0.024 14 0 "[ . 1 . 2 . 3 . 4]" 1
1985 1 99 CYS QB 1 100 LEU H 4.880 . 4.880 3.136 1.842 4.060 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
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