NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
439614 |
2k6w   |
15894 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2k6w
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 1679
_Distance_constraint_stats_list.Viol_count 3986
_Distance_constraint_stats_list.Viol_total 4174.573
_Distance_constraint_stats_list.Viol_max 0.309
_Distance_constraint_stats_list.Viol_rms 0.0127
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0026
_Distance_constraint_stats_list.Viol_average_violations_only 0.0338
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 SER 0.203 0.039 18 0 "[ . 1 . 2 . 3 ]"
1 3 PHE 0.361 0.077 15 0 "[ . 1 . 2 . 3 ]"
1 4 THR 0.808 0.172 29 0 "[ . 1 . 2 . 3 ]"
1 5 GLU 1.616 0.172 29 0 "[ . 1 . 2 . 3 ]"
1 6 GLY 0.557 0.063 26 0 "[ . 1 . 2 . 3 ]"
1 7 TRP 2.199 0.112 5 0 "[ . 1 . 2 . 3 ]"
1 8 VAL 0.136 0.033 14 0 "[ . 1 . 2 . 3 ]"
1 9 ARG 0.083 0.029 21 0 "[ . 1 . 2 . 3 ]"
1 10 PHE 2.423 0.198 21 0 "[ . 1 . 2 . 3 ]"
1 11 SER 2.828 0.122 12 0 "[ . 1 . 2 . 3 ]"
1 12 PRO 0.234 0.085 15 0 "[ . 1 . 2 . 3 ]"
1 13 GLY 0.267 0.085 15 0 "[ . 1 . 2 . 3 ]"
1 14 PRO 0.061 0.020 28 0 "[ . 1 . 2 . 3 ]"
1 15 ASN 1.415 0.097 11 0 "[ . 1 . 2 . 3 ]"
1 16 ALA 0.989 0.097 11 0 "[ . 1 . 2 . 3 ]"
1 17 ALA 0.913 0.069 21 0 "[ . 1 . 2 . 3 ]"
1 18 ALA 0.091 0.033 14 0 "[ . 1 . 2 . 3 ]"
1 19 TYR 1.151 0.090 4 0 "[ . 1 . 2 . 3 ]"
1 20 LEU 0.207 0.040 14 0 "[ . 1 . 2 . 3 ]"
1 21 THR 1.766 0.140 10 0 "[ . 1 . 2 . 3 ]"
1 22 LEU 2.580 0.117 27 0 "[ . 1 . 2 . 3 ]"
1 23 GLU 1.054 0.125 20 0 "[ . 1 . 2 . 3 ]"
1 24 ASN 5.017 0.131 24 0 "[ . 1 . 2 . 3 ]"
1 25 PRO 2.135 0.086 28 0 "[ . 1 . 2 . 3 ]"
1 26 GLY 0.097 0.025 26 0 "[ . 1 . 2 . 3 ]"
1 27 ASP 0.006 0.006 3 0 "[ . 1 . 2 . 3 ]"
1 28 LEU 1.415 0.099 5 0 "[ . 1 . 2 . 3 ]"
1 29 PRO 2.923 0.099 5 0 "[ . 1 . 2 . 3 ]"
1 30 LEU 9.132 0.186 30 0 "[ . 1 . 2 . 3 ]"
1 31 ARG 4.393 0.186 30 0 "[ . 1 . 2 . 3 ]"
1 32 LEU 0.777 0.066 17 0 "[ . 1 . 2 . 3 ]"
1 33 VAL 0.643 0.035 3 0 "[ . 1 . 2 . 3 ]"
1 34 GLY 3.649 0.091 8 0 "[ . 1 . 2 . 3 ]"
1 35 ALA 1.583 0.102 21 0 "[ . 1 . 2 . 3 ]"
1 36 ARG 5.796 0.212 3 0 "[ . 1 . 2 . 3 ]"
1 37 THR 2.698 0.104 31 0 "[ . 1 . 2 . 3 ]"
1 38 PRO 3.032 0.137 4 0 "[ . 1 . 2 . 3 ]"
1 39 VAL 3.683 0.137 4 0 "[ . 1 . 2 . 3 ]"
1 40 ALA 0.296 0.039 3 0 "[ . 1 . 2 . 3 ]"
1 41 GLU 1.672 0.099 23 0 "[ . 1 . 2 . 3 ]"
1 42 ARG 0.921 0.047 29 0 "[ . 1 . 2 . 3 ]"
1 43 VAL 0.871 0.077 10 0 "[ . 1 . 2 . 3 ]"
1 44 GLU 0.619 0.153 27 0 "[ . 1 . 2 . 3 ]"
1 45 LEU 7.993 0.153 27 0 "[ . 1 . 2 . 3 ]"
1 46 HIS 8.339 0.183 27 0 "[ . 1 . 2 . 3 ]"
1 47 GLU 1.325 0.069 1 0 "[ . 1 . 2 . 3 ]"
1 48 THR 0.721 0.102 9 0 "[ . 1 . 2 . 3 ]"
1 49 PHE 1.612 0.055 16 0 "[ . 1 . 2 . 3 ]"
1 50 MET 1.038 0.096 24 0 "[ . 1 . 2 . 3 ]"
1 51 ARG 1.021 0.096 24 0 "[ . 1 . 2 . 3 ]"
1 52 GLU 5.174 0.309 13 0 "[ . 1 . 2 . 3 ]"
1 53 VAL 4.727 0.135 25 0 "[ . 1 . 2 . 3 ]"
1 54 GLU 2.064 0.130 29 0 "[ . 1 . 2 . 3 ]"
1 55 GLY 0.928 0.204 11 0 "[ . 1 . 2 . 3 ]"
1 56 LYS 3.414 0.141 23 0 "[ . 1 . 2 . 3 ]"
1 57 LYS 1.331 0.124 6 0 "[ . 1 . 2 . 3 ]"
1 58 VAL 0.745 0.045 5 0 "[ . 1 . 2 . 3 ]"
1 59 MET 0.767 0.079 30 0 "[ . 1 . 2 . 3 ]"
1 60 GLY 0.217 0.188 2 0 "[ . 1 . 2 . 3 ]"
1 61 MET 0.692 0.188 2 0 "[ . 1 . 2 . 3 ]"
1 62 ARG 0.863 0.055 16 0 "[ . 1 . 2 . 3 ]"
1 63 PRO 6.426 0.183 27 0 "[ . 1 . 2 . 3 ]"
1 64 VAL 0.970 0.035 26 0 "[ . 1 . 2 . 3 ]"
1 65 PRO 0.005 0.005 9 0 "[ . 1 . 2 . 3 ]"
1 66 PHE 2.719 0.140 21 0 "[ . 1 . 2 . 3 ]"
1 67 LEU 2.647 0.140 21 0 "[ . 1 . 2 . 3 ]"
1 68 GLU 3.614 0.097 21 0 "[ . 1 . 2 . 3 ]"
1 69 VAL 1.967 0.072 3 0 "[ . 1 . 2 . 3 ]"
1 70 PRO 0.821 0.044 9 0 "[ . 1 . 2 . 3 ]"
1 71 PRO 2.603 0.051 18 0 "[ . 1 . 2 . 3 ]"
1 72 LYS 4.490 0.244 12 0 "[ . 1 . 2 . 3 ]"
1 73 GLY 10.568 0.244 12 0 "[ . 1 . 2 . 3 ]"
1 74 ARG 6.207 0.170 17 0 "[ . 1 . 2 . 3 ]"
1 75 VAL 0.743 0.044 2 0 "[ . 1 . 2 . 3 ]"
1 76 GLU 0.853 0.078 21 0 "[ . 1 . 2 . 3 ]"
1 77 LEU 0.620 0.090 4 0 "[ . 1 . 2 . 3 ]"
1 78 LYS 1.534 0.087 12 0 "[ . 1 . 2 . 3 ]"
1 79 PRO 0.049 0.049 24 0 "[ . 1 . 2 . 3 ]"
1 80 GLY 0.031 0.014 26 0 "[ . 1 . 2 . 3 ]"
1 81 GLY 0.189 0.054 21 0 "[ . 1 . 2 . 3 ]"
1 82 TYR 3.373 0.087 12 0 "[ . 1 . 2 . 3 ]"
1 83 HIS 2.284 0.127 11 0 "[ . 1 . 2 . 3 ]"
1 84 PHE 3.774 0.104 21 0 "[ . 1 . 2 . 3 ]"
1 85 MET 2.271 0.127 11 0 "[ . 1 . 2 . 3 ]"
1 86 LEU 0.652 0.049 7 0 "[ . 1 . 2 . 3 ]"
1 87 LEU 0.938 0.052 17 0 "[ . 1 . 2 . 3 ]"
1 88 GLY 1.234 0.099 23 0 "[ . 1 . 2 . 3 ]"
1 89 LEU 1.013 0.058 14 0 "[ . 1 . 2 . 3 ]"
1 90 LYS 1.343 0.077 29 0 "[ . 1 . 2 . 3 ]"
1 91 ARG 0.403 0.080 3 0 "[ . 1 . 2 . 3 ]"
1 92 PRO 0.794 0.200 26 0 "[ . 1 . 2 . 3 ]"
1 93 LEU 1.745 0.200 26 0 "[ . 1 . 2 . 3 ]"
1 94 LYS 1.772 0.139 9 0 "[ . 1 . 2 . 3 ]"
1 95 ALA 1.406 0.102 2 0 "[ . 1 . 2 . 3 ]"
1 96 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 97 GLU 3.734 0.139 9 0 "[ . 1 . 2 . 3 ]"
1 98 GLU 1.160 0.099 10 0 "[ . 1 . 2 . 3 ]"
1 99 VAL 2.925 0.107 9 0 "[ . 1 . 2 . 3 ]"
1 100 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 101 LEU 8.721 0.204 21 0 "[ . 1 . 2 . 3 ]"
1 102 ASP 2.630 0.120 3 0 "[ . 1 . 2 . 3 ]"
1 103 LEU 2.255 0.091 18 0 "[ . 1 . 2 . 3 ]"
1 104 LEU 3.494 0.102 21 0 "[ . 1 . 2 . 3 ]"
1 105 PHE 8.007 0.127 19 0 "[ . 1 . 2 . 3 ]"
1 106 ALA 1.096 0.095 6 0 "[ . 1 . 2 . 3 ]"
1 108 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 109 LYS 5.184 0.127 19 0 "[ . 1 . 2 . 3 ]"
1 110 VAL 2.992 0.107 26 0 "[ . 1 . 2 . 3 ]"
1 111 LEU 1.234 0.086 13 0 "[ . 1 . 2 . 3 ]"
1 112 LYS 0.892 0.086 13 0 "[ . 1 . 2 . 3 ]"
1 113 VAL 0.186 0.070 16 0 "[ . 1 . 2 . 3 ]"
1 114 VAL 2.392 0.146 13 0 "[ . 1 . 2 . 3 ]"
1 115 LEU 1.400 0.112 5 0 "[ . 1 . 2 . 3 ]"
1 116 PRO 0.691 0.056 4 0 "[ . 1 . 2 . 3 ]"
1 117 VAL 2.946 0.133 16 0 "[ . 1 . 2 . 3 ]"
1 118 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 119 ALA 0.242 0.092 27 0 "[ . 1 . 2 . 3 ]"
1 120 ARG 0.772 0.101 31 0 "[ . 1 . 2 . 3 ]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 SER HA 1 2 SER QB . . 2.580 2.315 2.106 2.470 . 0 0 "[ . 1 . 2 . 3 ]" 1
2 1 2 SER HA 1 3 PHE QD . . 4.400 4.105 2.882 4.439 0.039 18 0 "[ . 1 . 2 . 3 ]" 1
3 1 3 PHE HA 1 3 PHE QD . . 3.870 2.994 2.398 3.786 . 0 0 "[ . 1 . 2 . 3 ]" 1
4 1 3 PHE HA 1 4 THR H . . 3.360 2.735 2.117 3.437 0.077 15 0 "[ . 1 . 2 . 3 ]" 1
5 1 3 PHE QB 1 4 THR H . . 4.160 3.298 1.968 4.091 . 0 0 "[ . 1 . 2 . 3 ]" 1
6 1 3 PHE QD 1 4 THR H . . 5.740 4.293 2.620 5.035 . 0 0 "[ . 1 . 2 . 3 ]" 1
7 1 4 THR H 1 4 THR MG . . 4.740 3.264 2.222 4.151 . 0 0 "[ . 1 . 2 . 3 ]" 1
8 1 4 THR HA 1 4 THR MG . . 3.490 2.380 2.145 3.247 . 0 0 "[ . 1 . 2 . 3 ]" 1
9 1 4 THR HA 1 5 GLU H . . 3.460 2.445 1.999 3.508 0.048 13 0 "[ . 1 . 2 . 3 ]" 1
10 1 4 THR HB 1 5 GLU H . . 3.800 3.246 2.073 3.972 0.172 29 0 "[ . 1 . 2 . 3 ]" 1
11 1 4 THR MG 1 5 GLU H . . 4.310 3.428 1.667 4.261 . 0 0 "[ . 1 . 2 . 3 ]" 1
12 1 5 GLU HB2 1 21 THR HB . . 5.500 4.553 2.121 5.516 0.016 7 0 "[ . 1 . 2 . 3 ]" 1
13 1 5 GLU HB3 1 21 THR HB . . 5.500 4.960 2.518 5.608 0.108 24 0 "[ . 1 . 2 . 3 ]" 1
14 1 5 GLU HG2 1 21 THR HB . . 5.500 4.493 2.303 5.640 0.140 10 0 "[ . 1 . 2 . 3 ]" 1
15 1 5 GLU HG3 1 21 THR HB . . 5.500 4.791 3.654 5.600 0.100 5 0 "[ . 1 . 2 . 3 ]" 1
16 1 6 GLY H 1 7 TRP HE3 . . 5.500 4.366 3.563 5.036 . 0 0 "[ . 1 . 2 . 3 ]" 1
17 1 6 GLY H 1 115 LEU HA . . 5.080 4.919 4.014 5.143 0.063 26 0 "[ . 1 . 2 . 3 ]" 1
18 1 6 GLY H 1 115 LEU MD2 . . 5.250 3.348 2.285 5.248 . 0 0 "[ . 1 . 2 . 3 ]" 1
19 1 6 GLY QA 1 20 LEU HA . . 3.510 1.938 1.788 2.143 . 0 0 "[ . 1 . 2 . 3 ]" 1
20 1 6 GLY QA 1 20 LEU HB2 . . 4.310 2.989 2.351 3.788 . 0 0 "[ . 1 . 2 . 3 ]" 1
21 1 6 GLY QA 1 20 LEU HB3 . . 4.180 2.919 2.228 3.730 . 0 0 "[ . 1 . 2 . 3 ]" 1
22 1 6 GLY QA 1 21 THR H . . 3.250 2.788 1.825 3.299 0.049 18 0 "[ . 1 . 2 . 3 ]" 1
23 1 6 GLY HA3 1 20 LEU HA . . 4.190 2.110 1.829 2.415 . 0 0 "[ . 1 . 2 . 3 ]" 1
24 1 6 GLY HA3 1 20 LEU HB2 . . 4.920 3.053 2.388 3.925 . 0 0 "[ . 1 . 2 . 3 ]" 1
25 1 6 GLY HA3 1 20 LEU HB3 . . 4.800 2.986 2.265 3.892 . 0 0 "[ . 1 . 2 . 3 ]" 1
26 1 7 TRP H 1 7 TRP HD1 . . 6.020 4.987 4.494 5.409 . 0 0 "[ . 1 . 2 . 3 ]" 1
27 1 7 TRP H 1 7 TRP HE3 . . 4.680 2.922 2.173 3.754 . 0 0 "[ . 1 . 2 . 3 ]" 1
28 1 7 TRP H 1 19 TYR H . . 4.620 3.558 3.067 4.621 0.001 14 0 "[ . 1 . 2 . 3 ]" 1
29 1 7 TRP H 1 19 TYR HB2 . . 5.500 3.030 2.407 4.037 . 0 0 "[ . 1 . 2 . 3 ]" 1
30 1 7 TRP H 1 19 TYR HB3 . . 5.500 4.522 3.862 5.502 0.002 22 0 "[ . 1 . 2 . 3 ]" 1
31 1 7 TRP H 1 20 LEU HB2 . . 5.500 5.025 4.436 5.540 0.040 14 0 "[ . 1 . 2 . 3 ]" 1
32 1 7 TRP H 1 20 LEU HB3 . . 5.500 4.047 3.479 5.255 . 0 0 "[ . 1 . 2 . 3 ]" 1
33 1 7 TRP H 1 115 LEU MD2 . . 5.500 3.675 2.464 4.960 . 0 0 "[ . 1 . 2 . 3 ]" 1
34 1 7 TRP HA 1 8 VAL H . . 3.570 2.279 2.142 2.454 . 0 0 "[ . 1 . 2 . 3 ]" 1
35 1 7 TRP HA 1 8 VAL MG2 . . 4.500 3.679 3.282 4.376 . 0 0 "[ . 1 . 2 . 3 ]" 1
36 1 7 TRP HA 1 115 LEU HB2 . . 4.270 4.025 2.334 4.382 0.112 5 0 "[ . 1 . 2 . 3 ]" 1
37 1 7 TRP HA 1 115 LEU HB3 . . 4.890 2.836 2.259 4.442 . 0 0 "[ . 1 . 2 . 3 ]" 1
38 1 7 TRP HA 1 115 LEU MD2 . . 4.910 3.938 3.238 4.940 0.030 28 0 "[ . 1 . 2 . 3 ]" 1
39 1 7 TRP HA 1 116 PRO HG2 . . 4.710 2.978 2.536 3.493 . 0 0 "[ . 1 . 2 . 3 ]" 1
40 1 7 TRP HA 1 116 PRO HG3 . . 4.710 4.567 4.042 4.731 0.021 8 0 "[ . 1 . 2 . 3 ]" 1
41 1 7 TRP HB2 1 8 VAL H . . 4.350 2.693 2.341 3.153 . 0 0 "[ . 1 . 2 . 3 ]" 1
42 1 7 TRP HB2 1 19 TYR QE . . 5.810 5.829 5.666 5.887 0.077 4 0 "[ . 1 . 2 . 3 ]" 1
43 1 7 TRP HB2 1 118 GLU H . . 5.680 3.512 2.410 4.367 . 0 0 "[ . 1 . 2 . 3 ]" 1
44 1 7 TRP HB3 1 8 VAL H . . 4.660 3.948 3.750 4.187 . 0 0 "[ . 1 . 2 . 3 ]" 1
45 1 7 TRP HB3 1 116 PRO QG . . 5.350 3.005 2.559 3.570 . 0 0 "[ . 1 . 2 . 3 ]" 1
46 1 7 TRP HD1 1 8 VAL H . . 5.500 3.946 3.116 4.681 . 0 0 "[ . 1 . 2 . 3 ]" 1
47 1 7 TRP HD1 1 9 ARG HA . . 4.180 3.185 2.201 3.914 . 0 0 "[ . 1 . 2 . 3 ]" 1
48 1 7 TRP HD1 1 118 GLU H . . 4.760 3.475 2.526 4.225 . 0 0 "[ . 1 . 2 . 3 ]" 1
49 1 7 TRP HD1 1 118 GLU QB . . 4.810 2.711 2.069 4.274 . 0 0 "[ . 1 . 2 . 3 ]" 1
50 1 7 TRP HD1 1 120 ARG H . . 5.540 4.349 3.145 5.585 0.045 25 0 "[ . 1 . 2 . 3 ]" 1
51 1 7 TRP HE1 1 9 ARG HA . . 4.980 4.291 3.123 5.009 0.029 21 0 "[ . 1 . 2 . 3 ]" 1
52 1 7 TRP HE1 1 9 ARG QB . . 5.500 4.173 2.970 5.375 . 0 0 "[ . 1 . 2 . 3 ]" 1
53 1 7 TRP HE1 1 19 TYR QE . . 6.340 2.623 2.106 3.304 . 0 0 "[ . 1 . 2 . 3 ]" 1
54 1 7 TRP HE1 1 120 ARG H . . 5.400 4.213 2.498 5.434 0.034 5 0 "[ . 1 . 2 . 3 ]" 1
55 1 7 TRP HE1 1 120 ARG HG2 . . 5.500 3.939 2.210 5.601 0.101 31 0 "[ . 1 . 2 . 3 ]" 1
56 1 7 TRP HE1 1 120 ARG HG3 . . 5.500 3.866 2.022 5.512 0.012 27 0 "[ . 1 . 2 . 3 ]" 1
57 1 7 TRP HZ2 1 79 PRO HD2 . . 6.600 4.691 3.140 6.649 0.049 24 0 "[ . 1 . 2 . 3 ]" 1
58 1 7 TRP HZ2 1 79 PRO QG . . 6.600 3.764 2.366 5.753 . 0 0 "[ . 1 . 2 . 3 ]" 1
59 1 8 VAL H 1 8 VAL HB . . 3.470 2.596 2.416 2.771 . 0 0 "[ . 1 . 2 . 3 ]" 1
60 1 8 VAL H 1 8 VAL MG2 . . 3.780 2.763 2.525 3.035 . 0 0 "[ . 1 . 2 . 3 ]" 1
61 1 8 VAL H 1 115 LEU HB2 . . 5.500 4.316 3.769 4.771 . 0 0 "[ . 1 . 2 . 3 ]" 1
62 1 8 VAL H 1 116 PRO QB . . 5.340 4.830 4.684 4.975 . 0 0 "[ . 1 . 2 . 3 ]" 1
63 1 8 VAL H 1 117 VAL HA . . 4.230 2.699 2.165 3.139 . 0 0 "[ . 1 . 2 . 3 ]" 1
64 1 8 VAL H 1 117 VAL MG2 . . 5.500 3.935 3.341 4.456 . 0 0 "[ . 1 . 2 . 3 ]" 1
65 1 8 VAL H 1 118 GLU H . . 5.500 3.556 3.128 4.156 . 0 0 "[ . 1 . 2 . 3 ]" 1
66 1 8 VAL HA 1 18 ALA HA . . 3.500 2.430 2.037 3.256 . 0 0 "[ . 1 . 2 . 3 ]" 1
67 1 8 VAL HA 1 18 ALA MB . . 4.470 3.023 2.246 3.820 . 0 0 "[ . 1 . 2 . 3 ]" 1
68 1 8 VAL HA 1 19 TYR H . . 4.330 3.089 2.576 3.743 . 0 0 "[ . 1 . 2 . 3 ]" 1
69 1 8 VAL HB 1 117 VAL HA . . 4.220 2.847 2.137 3.453 . 0 0 "[ . 1 . 2 . 3 ]" 1
70 1 8 VAL MG1 1 117 VAL HA . . 4.090 3.918 3.236 4.106 0.016 9 0 "[ . 1 . 2 . 3 ]" 1
71 1 8 VAL MG2 1 18 ALA HA . . 4.030 3.199 2.140 4.063 0.033 14 0 "[ . 1 . 2 . 3 ]" 1
72 1 8 VAL MG2 1 19 TYR H . . 5.500 3.559 2.591 4.288 . 0 0 "[ . 1 . 2 . 3 ]" 1
73 1 9 ARG H 1 18 ALA HA . . 4.390 2.963 2.409 3.751 . 0 0 "[ . 1 . 2 . 3 ]" 1
74 1 9 ARG H 1 19 TYR H . . 5.500 4.371 3.086 5.111 . 0 0 "[ . 1 . 2 . 3 ]" 1
75 1 9 ARG H 1 19 TYR QE . . 6.120 4.060 2.699 5.200 . 0 0 "[ . 1 . 2 . 3 ]" 1
76 1 9 ARG HA 1 118 GLU H . . 4.050 3.483 3.096 3.990 . 0 0 "[ . 1 . 2 . 3 ]" 1
77 1 9 ARG QB 1 10 PHE H . . 4.520 3.729 2.891 4.051 . 0 0 "[ . 1 . 2 . 3 ]" 1
78 1 9 ARG QB 1 17 ALA H . . 5.500 2.940 1.856 5.499 . 0 0 "[ . 1 . 2 . 3 ]" 1
79 1 9 ARG QB 1 19 TYR QE . . 4.980 2.431 2.123 3.412 . 0 0 "[ . 1 . 2 . 3 ]" 1
80 1 10 PHE H 1 10 PHE HB2 . . 4.050 2.912 2.411 3.530 . 0 0 "[ . 1 . 2 . 3 ]" 1
81 1 10 PHE H 1 10 PHE QB . . 3.520 2.306 2.069 3.098 . 0 0 "[ . 1 . 2 . 3 ]" 1
82 1 10 PHE H 1 10 PHE HB3 . . 4.050 2.450 2.108 3.505 . 0 0 "[ . 1 . 2 . 3 ]" 1
83 1 10 PHE H 1 10 PHE QD . . 5.500 4.147 2.064 4.666 . 0 0 "[ . 1 . 2 . 3 ]" 1
84 1 10 PHE H 1 11 SER H . . 5.030 4.461 3.472 4.711 . 0 0 "[ . 1 . 2 . 3 ]" 1
85 1 10 PHE H 1 93 LEU HB2 . . 5.170 4.896 3.918 5.368 0.198 21 0 "[ . 1 . 2 . 3 ]" 1
86 1 10 PHE H 1 93 LEU HB3 . . 5.170 4.644 3.085 5.207 0.037 10 0 "[ . 1 . 2 . 3 ]" 1
87 1 10 PHE H 1 117 VAL MG1 . . 5.500 3.068 2.226 3.795 . 0 0 "[ . 1 . 2 . 3 ]" 1
88 1 10 PHE H 1 118 GLU H . . 5.320 3.366 2.779 4.290 . 0 0 "[ . 1 . 2 . 3 ]" 1
89 1 10 PHE H 1 120 ARG H . . 5.360 4.124 2.720 5.425 0.065 28 0 "[ . 1 . 2 . 3 ]" 1
90 1 10 PHE HA 1 10 PHE QD . . 3.680 2.694 2.274 3.696 0.016 19 0 "[ . 1 . 2 . 3 ]" 1
91 1 10 PHE HA 1 10 PHE QE . . 6.120 4.796 4.508 5.539 . 0 0 "[ . 1 . 2 . 3 ]" 1
92 1 10 PHE HA 1 11 SER H . . 2.980 2.236 2.069 2.899 . 0 0 "[ . 1 . 2 . 3 ]" 1
93 1 10 PHE HA 1 117 VAL MG1 . . 4.050 3.114 2.127 3.928 . 0 0 "[ . 1 . 2 . 3 ]" 1
94 1 10 PHE QB 1 11 SER H . . 4.100 3.749 3.071 4.148 0.048 19 0 "[ . 1 . 2 . 3 ]" 1
95 1 10 PHE QB 1 119 ALA HA . . 3.240 2.450 2.012 3.123 . 0 0 "[ . 1 . 2 . 3 ]" 1
96 1 10 PHE QB 1 119 ALA MB . . 3.590 2.976 2.179 3.627 0.037 27 0 "[ . 1 . 2 . 3 ]" 1
97 1 10 PHE QB 1 120 ARG H . . 4.880 4.326 2.988 4.980 0.100 24 0 "[ . 1 . 2 . 3 ]" 1
98 1 10 PHE HB2 1 117 VAL MG1 . . 3.950 2.421 2.068 2.869 . 0 0 "[ . 1 . 2 . 3 ]" 1
99 1 10 PHE HB3 1 117 VAL MG1 . . 3.950 3.378 2.435 3.971 0.021 16 0 "[ . 1 . 2 . 3 ]" 1
100 1 10 PHE QD 1 11 SER H . . 4.420 2.867 2.037 4.011 . 0 0 "[ . 1 . 2 . 3 ]" 1
101 1 10 PHE QD 1 11 SER HA . . 4.760 3.759 3.273 4.069 . 0 0 "[ . 1 . 2 . 3 ]" 1
102 1 10 PHE QD 1 95 ALA H . . 5.290 3.643 2.076 4.600 . 0 0 "[ . 1 . 2 . 3 ]" 1
103 1 10 PHE QD 1 95 ALA HA . . 5.600 4.601 3.026 5.446 . 0 0 "[ . 1 . 2 . 3 ]" 1
104 1 10 PHE QD 1 95 ALA MB . . 4.960 3.396 2.327 4.588 . 0 0 "[ . 1 . 2 . 3 ]" 1
105 1 10 PHE QD 1 119 ALA HA . . 5.430 3.285 2.195 4.441 . 0 0 "[ . 1 . 2 . 3 ]" 1
106 1 10 PHE QD 1 119 ALA MB . . 4.110 2.715 2.133 3.723 . 0 0 "[ . 1 . 2 . 3 ]" 1
107 1 10 PHE QE 1 11 SER HA . . 4.060 3.954 3.487 4.117 0.057 25 0 "[ . 1 . 2 . 3 ]" 1
108 1 10 PHE QE 1 12 PRO QD . . 5.810 3.312 2.400 4.620 . 0 0 "[ . 1 . 2 . 3 ]" 1
109 1 10 PHE QE 1 95 ALA H . . 4.690 4.473 3.058 4.726 0.036 17 0 "[ . 1 . 2 . 3 ]" 1
110 1 10 PHE QE 1 95 ALA MB . . 6.360 4.309 2.949 5.226 . 0 0 "[ . 1 . 2 . 3 ]" 1
111 1 10 PHE QE 1 119 ALA MB . . 5.990 3.938 2.798 5.298 . 0 0 "[ . 1 . 2 . 3 ]" 1
112 1 10 PHE HZ 1 11 SER HA . . 4.850 4.810 4.253 4.899 0.049 30 0 "[ . 1 . 2 . 3 ]" 1
113 1 10 PHE HZ 1 95 ALA MB . . 6.430 5.711 3.574 6.441 0.011 18 0 "[ . 1 . 2 . 3 ]" 1
114 1 11 SER H 1 11 SER HB2 . . 3.730 3.150 2.797 3.852 0.122 12 0 "[ . 1 . 2 . 3 ]" 1
115 1 11 SER H 1 11 SER HB3 . . 3.730 3.599 2.717 3.843 0.113 23 0 "[ . 1 . 2 . 3 ]" 1
116 1 11 SER H 1 16 ALA MB . . 5.450 3.922 2.895 5.463 0.013 27 0 "[ . 1 . 2 . 3 ]" 1
117 1 11 SER H 1 93 LEU MD1 . . 5.220 4.401 2.518 5.249 0.029 12 0 "[ . 1 . 2 . 3 ]" 1
118 1 11 SER H 1 93 LEU MD2 . . 5.220 3.886 2.271 5.228 0.008 4 0 "[ . 1 . 2 . 3 ]" 1
119 1 11 SER HA 1 11 SER QB . . 2.550 2.421 2.172 2.554 0.004 5 0 "[ . 1 . 2 . 3 ]" 1
120 1 11 SER QB 1 16 ALA MB . . 3.730 2.770 1.995 3.746 0.016 26 0 "[ . 1 . 2 . 3 ]" 1
121 1 11 SER HB2 1 16 ALA MB . . 4.310 3.012 2.160 4.213 . 0 0 "[ . 1 . 2 . 3 ]" 1
122 1 11 SER HB3 1 16 ALA MB . . 4.310 3.636 2.114 4.333 0.023 12 0 "[ . 1 . 2 . 3 ]" 1
123 1 12 PRO QD 1 13 GLY H . . 4.280 3.651 2.266 4.365 0.085 15 0 "[ . 1 . 2 . 3 ]" 1
124 1 12 PRO QG 1 13 GLY H . . 4.530 3.925 2.627 4.551 0.021 13 0 "[ . 1 . 2 . 3 ]" 1
125 1 13 GLY QA 1 15 ASN H . . 3.780 3.140 2.717 3.802 0.022 29 0 "[ . 1 . 2 . 3 ]" 1
126 1 14 PRO QD 1 15 ASN H . . 4.050 2.660 2.356 3.072 . 0 0 "[ . 1 . 2 . 3 ]" 1
127 1 14 PRO HD2 1 15 ASN H . . 4.740 2.708 2.383 3.156 . 0 0 "[ . 1 . 2 . 3 ]" 1
128 1 14 PRO HD3 1 15 ASN H . . 4.740 3.909 3.697 4.212 . 0 0 "[ . 1 . 2 . 3 ]" 1
129 1 14 PRO HG2 1 15 ASN H . . 4.470 2.803 2.247 3.125 . 0 0 "[ . 1 . 2 . 3 ]" 1
130 1 14 PRO HG3 1 15 ASN H . . 4.470 4.260 3.794 4.490 0.020 28 0 "[ . 1 . 2 . 3 ]" 1
131 1 15 ASN H 1 15 ASN HB2 . . 3.920 3.638 2.450 3.976 0.056 15 0 "[ . 1 . 2 . 3 ]" 1
132 1 15 ASN H 1 15 ASN HB3 . . 4.200 3.288 2.323 3.794 . 0 0 "[ . 1 . 2 . 3 ]" 1
133 1 15 ASN H 1 15 ASN QD . . 4.690 4.218 3.224 4.737 0.047 11 0 "[ . 1 . 2 . 3 ]" 1
134 1 15 ASN H 1 16 ALA H . . 4.590 4.407 4.262 4.592 0.002 19 0 "[ . 1 . 2 . 3 ]" 1
135 1 15 ASN H 1 89 LEU MD2 . . 5.430 4.846 3.308 5.444 0.014 19 0 "[ . 1 . 2 . 3 ]" 1
136 1 15 ASN HA 1 16 ALA H . . 3.160 2.311 2.058 2.446 . 0 0 "[ . 1 . 2 . 3 ]" 1
137 1 15 ASN HA 1 16 ALA MB . . 4.690 3.887 3.641 4.160 . 0 0 "[ . 1 . 2 . 3 ]" 1
138 1 15 ASN HA 1 87 LEU HA . . 3.680 2.821 2.476 3.573 . 0 0 "[ . 1 . 2 . 3 ]" 1
139 1 15 ASN HA 1 87 LEU MD2 . . 4.460 4.103 2.780 4.512 0.052 17 0 "[ . 1 . 2 . 3 ]" 1
140 1 15 ASN HA 1 88 GLY H . . 3.980 3.522 3.019 4.036 0.056 2 0 "[ . 1 . 2 . 3 ]" 1
141 1 15 ASN HA 1 89 LEU MD1 . . 4.260 3.521 2.225 4.296 0.036 19 0 "[ . 1 . 2 . 3 ]" 1
142 1 15 ASN HA 1 89 LEU HG . . 4.150 3.267 2.187 4.178 0.028 27 0 "[ . 1 . 2 . 3 ]" 1
143 1 15 ASN HB2 1 16 ALA H . . 3.820 2.791 2.224 3.917 0.097 11 0 "[ . 1 . 2 . 3 ]" 1
144 1 15 ASN HB3 1 15 ASN QD . . 3.390 2.705 2.175 3.223 . 0 0 "[ . 1 . 2 . 3 ]" 1
145 1 15 ASN HB3 1 16 ALA H . . 4.110 3.659 2.548 4.115 0.005 11 0 "[ . 1 . 2 . 3 ]" 1
146 1 15 ASN HB3 1 87 LEU MD1 . . 5.840 3.370 2.114 5.742 . 0 0 "[ . 1 . 2 . 3 ]" 1
147 1 15 ASN HD21 1 87 LEU MD1 . . 5.500 3.707 1.814 5.327 . 0 0 "[ . 1 . 2 . 3 ]" 1
148 1 15 ASN HD22 1 87 LEU MD1 . . 5.500 4.538 2.475 5.526 0.026 24 0 "[ . 1 . 2 . 3 ]" 1
149 1 16 ALA H 1 85 MET ME . . 4.200 4.150 3.565 4.230 0.030 1 0 "[ . 1 . 2 . 3 ]" 1
150 1 16 ALA H 1 86 LEU H . . 4.280 3.015 2.647 3.417 . 0 0 "[ . 1 . 2 . 3 ]" 1
151 1 16 ALA H 1 86 LEU HB2 . . 4.920 2.832 2.128 3.514 . 0 0 "[ . 1 . 2 . 3 ]" 1
152 1 16 ALA H 1 86 LEU QB . . 4.160 2.784 2.112 3.428 . 0 0 "[ . 1 . 2 . 3 ]" 1
153 1 16 ALA H 1 86 LEU HB3 . . 4.920 4.165 3.574 4.934 0.014 27 0 "[ . 1 . 2 . 3 ]" 1
154 1 16 ALA HA 1 17 ALA H . . 3.380 2.673 2.293 3.048 . 0 0 "[ . 1 . 2 . 3 ]" 1
155 1 16 ALA HA 1 17 ALA MB . . 4.910 3.884 3.585 4.099 . 0 0 "[ . 1 . 2 . 3 ]" 1
156 1 16 ALA HA 1 85 MET ME . . 4.090 3.845 2.692 4.125 0.035 18 0 "[ . 1 . 2 . 3 ]" 1
157 1 16 ALA MB 1 17 ALA H . . 3.850 2.124 1.917 2.724 . 0 0 "[ . 1 . 2 . 3 ]" 1
158 1 16 ALA MB 1 86 LEU H . . 5.500 4.237 3.850 5.108 . 0 0 "[ . 1 . 2 . 3 ]" 1
159 1 16 ALA MB 1 86 LEU QB . . 5.340 2.798 2.215 4.654 . 0 0 "[ . 1 . 2 . 3 ]" 1
160 1 17 ALA H 1 85 MET ME . . 5.500 3.871 2.494 4.338 . 0 0 "[ . 1 . 2 . 3 ]" 1
161 1 17 ALA HA 1 18 ALA H . . 3.560 2.283 2.148 2.442 . 0 0 "[ . 1 . 2 . 3 ]" 1
162 1 17 ALA HA 1 83 HIS HD2 . . 4.290 3.874 2.688 4.322 0.032 7 0 "[ . 1 . 2 . 3 ]" 1
163 1 17 ALA HA 1 84 PHE QB . . 4.360 4.329 4.051 4.429 0.069 21 0 "[ . 1 . 2 . 3 ]" 1
164 1 17 ALA HA 1 85 MET ME . . 4.720 2.542 2.173 2.920 . 0 0 "[ . 1 . 2 . 3 ]" 1
165 1 17 ALA HA 1 86 LEU H . . 3.850 3.151 2.721 3.760 . 0 0 "[ . 1 . 2 . 3 ]" 1
166 1 17 ALA MB 1 18 ALA H . . 4.870 2.764 2.282 3.350 . 0 0 "[ . 1 . 2 . 3 ]" 1
167 1 17 ALA MB 1 19 TYR QE . . 5.210 2.904 2.202 3.625 . 0 0 "[ . 1 . 2 . 3 ]" 1
168 1 17 ALA MB 1 83 HIS HB2 . . 5.100 3.042 2.262 3.795 . 0 0 "[ . 1 . 2 . 3 ]" 1
169 1 17 ALA MB 1 83 HIS HB3 . . 5.500 4.191 3.184 4.995 . 0 0 "[ . 1 . 2 . 3 ]" 1
170 1 17 ALA MB 1 83 HIS HD2 . . 3.970 3.015 2.201 3.638 . 0 0 "[ . 1 . 2 . 3 ]" 1
171 1 17 ALA MB 1 85 MET HA . . 4.370 3.731 3.204 4.108 . 0 0 "[ . 1 . 2 . 3 ]" 1
172 1 17 ALA MB 1 86 LEU H . . 5.530 4.409 3.919 4.991 . 0 0 "[ . 1 . 2 . 3 ]" 1
173 1 18 ALA H 1 18 ALA MB . . 3.350 2.563 2.297 2.810 . 0 0 "[ . 1 . 2 . 3 ]" 1
174 1 18 ALA H 1 83 HIS HD2 . . 5.190 4.199 3.280 5.001 . 0 0 "[ . 1 . 2 . 3 ]" 1
175 1 18 ALA H 1 84 PHE H . . 4.260 2.893 2.625 3.159 . 0 0 "[ . 1 . 2 . 3 ]" 1
176 1 18 ALA H 1 84 PHE QB . . 4.980 2.910 2.681 3.182 . 0 0 "[ . 1 . 2 . 3 ]" 1
177 1 18 ALA H 1 84 PHE QD . . 6.020 4.598 4.056 5.048 . 0 0 "[ . 1 . 2 . 3 ]" 1
178 1 18 ALA H 1 85 MET HA . . 4.400 4.165 3.952 4.417 0.017 28 0 "[ . 1 . 2 . 3 ]" 1
179 1 18 ALA HA 1 19 TYR H . . 3.310 2.200 2.065 2.395 . 0 0 "[ . 1 . 2 . 3 ]" 1
180 1 18 ALA MB 1 19 TYR H . . 3.700 2.777 2.334 3.269 . 0 0 "[ . 1 . 2 . 3 ]" 1
181 1 18 ALA MB 1 84 PHE H . . 5.390 3.551 2.821 3.913 . 0 0 "[ . 1 . 2 . 3 ]" 1
182 1 18 ALA MB 1 84 PHE HB2 . . 3.850 2.231 2.038 2.592 . 0 0 "[ . 1 . 2 . 3 ]" 1
183 1 18 ALA MB 1 84 PHE QB . . 3.060 2.199 2.027 2.524 . 0 0 "[ . 1 . 2 . 3 ]" 1
184 1 18 ALA MB 1 84 PHE HB3 . . 3.850 3.399 2.858 3.749 . 0 0 "[ . 1 . 2 . 3 ]" 1
185 1 19 TYR H 1 19 TYR QE . . 5.530 4.612 4.287 4.915 . 0 0 "[ . 1 . 2 . 3 ]" 1
186 1 19 TYR HA 1 19 TYR QE . . 5.350 4.974 4.676 5.333 . 0 0 "[ . 1 . 2 . 3 ]" 1
187 1 19 TYR HA 1 20 LEU H . . 3.300 2.361 2.247 2.575 . 0 0 "[ . 1 . 2 . 3 ]" 1
188 1 19 TYR HA 1 20 LEU MD2 . . 4.730 3.587 2.529 4.744 0.014 5 0 "[ . 1 . 2 . 3 ]" 1
189 1 19 TYR HA 1 77 LEU HB2 . . 3.780 3.249 2.522 3.870 0.090 4 0 "[ . 1 . 2 . 3 ]" 1
190 1 19 TYR HA 1 77 LEU MD2 . . 4.340 3.774 2.754 4.345 0.005 10 0 "[ . 1 . 2 . 3 ]" 1
191 1 19 TYR QE 1 79 PRO HA . . 4.230 2.833 2.245 3.674 . 0 0 "[ . 1 . 2 . 3 ]" 1
192 1 19 TYR QE 1 79 PRO HB2 . . 5.810 4.082 3.772 5.171 . 0 0 "[ . 1 . 2 . 3 ]" 1
193 1 19 TYR QE 1 79 PRO HB3 . . 4.950 2.577 2.172 3.517 . 0 0 "[ . 1 . 2 . 3 ]" 1
194 1 19 TYR QE 1 79 PRO QG . . 5.450 4.024 3.556 4.781 . 0 0 "[ . 1 . 2 . 3 ]" 1
195 1 19 TYR QE 1 83 HIS HA . . 5.790 5.111 4.218 5.815 0.025 13 0 "[ . 1 . 2 . 3 ]" 1
196 1 19 TYR QE 1 83 HIS HB2 . . 4.780 3.375 2.681 4.252 . 0 0 "[ . 1 . 2 . 3 ]" 1
197 1 19 TYR QE 1 83 HIS HB3 . . 4.590 3.227 2.167 4.104 . 0 0 "[ . 1 . 2 . 3 ]" 1
198 1 19 TYR QE 1 83 HIS HD2 . . 5.320 4.771 3.760 5.340 0.020 11 0 "[ . 1 . 2 . 3 ]" 1
199 1 20 LEU H 1 20 LEU MD1 . . 5.030 4.300 3.457 4.778 . 0 0 "[ . 1 . 2 . 3 ]" 1
200 1 20 LEU H 1 20 LEU HG . . 4.050 3.302 2.615 3.960 . 0 0 "[ . 1 . 2 . 3 ]" 1
201 1 20 LEU H 1 77 LEU H . . 4.860 3.142 2.608 3.703 . 0 0 "[ . 1 . 2 . 3 ]" 1
202 1 20 LEU H 1 77 LEU HB2 . . 3.920 2.106 1.792 2.663 . 0 0 "[ . 1 . 2 . 3 ]" 1
203 1 20 LEU H 1 77 LEU HB3 . . 4.670 3.202 2.780 3.589 . 0 0 "[ . 1 . 2 . 3 ]" 1
204 1 20 LEU H 1 77 LEU MD1 . . 4.820 3.758 2.950 4.523 . 0 0 "[ . 1 . 2 . 3 ]" 1
205 1 20 LEU H 1 77 LEU MD2 . . 4.210 3.842 3.189 4.225 0.015 4 0 "[ . 1 . 2 . 3 ]" 1
206 1 20 LEU HA 1 20 LEU MD2 . . 4.490 3.815 3.617 4.099 . 0 0 "[ . 1 . 2 . 3 ]" 1
207 1 20 LEU HA 1 20 LEU HG . . 3.950 3.731 3.631 3.835 . 0 0 "[ . 1 . 2 . 3 ]" 1
208 1 20 LEU HB2 1 21 THR H . . 3.900 2.616 2.359 2.941 . 0 0 "[ . 1 . 2 . 3 ]" 1
209 1 20 LEU HB3 1 20 LEU MD2 . . 3.570 2.296 2.141 2.425 . 0 0 "[ . 1 . 2 . 3 ]" 1
210 1 20 LEU HB3 1 21 THR H . . 4.270 3.824 3.530 3.973 . 0 0 "[ . 1 . 2 . 3 ]" 1
211 1 20 LEU HB3 1 77 LEU MD2 . . 6.350 5.115 4.679 5.551 . 0 0 "[ . 1 . 2 . 3 ]" 1
212 1 20 LEU MD1 1 21 THR H . . 4.870 3.948 3.360 4.574 . 0 0 "[ . 1 . 2 . 3 ]" 1
213 1 20 LEU MD1 1 77 LEU MD2 . . 4.510 3.710 2.401 4.509 . 0 0 "[ . 1 . 2 . 3 ]" 1
214 1 20 LEU MD2 1 77 LEU MD2 . . 3.490 2.623 2.020 3.491 0.001 18 0 "[ . 1 . 2 . 3 ]" 1
215 1 20 LEU MD2 1 84 PHE QD . . 3.920 2.839 2.293 3.507 . 0 0 "[ . 1 . 2 . 3 ]" 1
216 1 20 LEU MD2 1 84 PHE QE . . 3.790 2.217 2.042 2.491 . 0 0 "[ . 1 . 2 . 3 ]" 1
217 1 20 LEU MD2 1 84 PHE HZ . . 4.530 4.125 3.575 4.531 0.001 16 0 "[ . 1 . 2 . 3 ]" 1
218 1 20 LEU HG 1 21 THR H . . 4.750 4.227 3.483 4.777 0.027 13 0 "[ . 1 . 2 . 3 ]" 1
219 1 20 LEU HG 1 77 LEU H . . 5.260 4.147 3.496 4.750 . 0 0 "[ . 1 . 2 . 3 ]" 1
220 1 20 LEU HG 1 77 LEU HB2 . . 4.810 3.279 2.196 4.455 . 0 0 "[ . 1 . 2 . 3 ]" 1
221 1 21 THR H 1 21 THR HB . . 3.220 2.537 2.223 3.253 0.033 24 0 "[ . 1 . 2 . 3 ]" 1
222 1 21 THR H 1 21 THR MG . . 4.550 3.784 3.339 3.923 . 0 0 "[ . 1 . 2 . 3 ]" 1
223 1 21 THR HA 1 21 THR MG . . 3.460 2.348 2.159 2.565 . 0 0 "[ . 1 . 2 . 3 ]" 1
224 1 21 THR HA 1 22 LEU H . . 3.100 2.164 2.040 2.274 . 0 0 "[ . 1 . 2 . 3 ]" 1
225 1 21 THR HA 1 75 VAL H . . 5.310 4.729 4.148 5.330 0.020 2 0 "[ . 1 . 2 . 3 ]" 1
226 1 21 THR HA 1 76 GLU HA . . 3.210 2.157 1.901 2.471 . 0 0 "[ . 1 . 2 . 3 ]" 1
227 1 21 THR HA 1 77 LEU H . . 4.150 3.341 3.007 3.784 . 0 0 "[ . 1 . 2 . 3 ]" 1
228 1 21 THR HB 1 22 LEU H . . 5.140 4.212 3.797 4.556 . 0 0 "[ . 1 . 2 . 3 ]" 1
229 1 21 THR MG 1 22 LEU H . . 3.810 2.802 2.129 3.795 . 0 0 "[ . 1 . 2 . 3 ]" 1
230 1 21 THR MG 1 22 LEU HA . . 5.360 3.907 3.170 5.294 . 0 0 "[ . 1 . 2 . 3 ]" 1
231 1 21 THR MG 1 74 ARG HA . . 5.650 4.535 3.464 5.668 0.018 24 0 "[ . 1 . 2 . 3 ]" 1
232 1 21 THR MG 1 74 ARG HD2 . . 4.030 3.301 1.947 4.088 0.058 18 0 "[ . 1 . 2 . 3 ]" 1
233 1 21 THR MG 1 74 ARG QD . . 3.510 2.571 1.902 3.274 . 0 0 "[ . 1 . 2 . 3 ]" 1
234 1 21 THR MG 1 74 ARG HD3 . . 4.030 3.043 2.003 4.064 0.034 19 0 "[ . 1 . 2 . 3 ]" 1
235 1 21 THR MG 1 76 GLU QG . . 3.260 2.787 2.152 3.305 0.045 15 0 "[ . 1 . 2 . 3 ]" 1
236 1 21 THR MG 1 77 LEU H . . 5.180 4.974 4.184 5.214 0.034 19 0 "[ . 1 . 2 . 3 ]" 1
237 1 22 LEU H 1 22 LEU HB2 . . 3.760 2.821 2.256 3.331 . 0 0 "[ . 1 . 2 . 3 ]" 1
238 1 22 LEU H 1 22 LEU MD1 . . 4.190 4.191 3.905 4.271 0.081 29 0 "[ . 1 . 2 . 3 ]" 1
239 1 22 LEU H 1 22 LEU MD2 . . 5.080 4.290 3.687 4.867 . 0 0 "[ . 1 . 2 . 3 ]" 1
240 1 22 LEU H 1 74 ARG HA . . 5.500 4.944 4.414 5.507 0.007 15 0 "[ . 1 . 2 . 3 ]" 1
241 1 22 LEU H 1 75 VAL H . . 5.180 3.301 2.887 3.871 . 0 0 "[ . 1 . 2 . 3 ]" 1
242 1 22 LEU H 1 76 GLU HA . . 4.370 3.107 2.121 3.794 . 0 0 "[ . 1 . 2 . 3 ]" 1
243 1 22 LEU H 1 76 GLU QB . . 4.880 4.650 3.793 4.937 0.057 3 0 "[ . 1 . 2 . 3 ]" 1
244 1 22 LEU H 1 76 GLU QG . . 5.320 4.407 3.378 5.340 0.020 27 0 "[ . 1 . 2 . 3 ]" 1
245 1 22 LEU H 1 77 LEU H . . 5.130 4.081 2.991 5.133 0.003 12 0 "[ . 1 . 2 . 3 ]" 1
246 1 22 LEU H 1 77 LEU MD1 . . 5.500 3.842 3.063 4.972 . 0 0 "[ . 1 . 2 . 3 ]" 1
247 1 22 LEU HA 1 22 LEU MD1 . . 3.650 2.989 2.104 3.690 0.040 24 0 "[ . 1 . 2 . 3 ]" 1
248 1 22 LEU HA 1 22 LEU MD2 . . 3.500 2.587 2.142 3.617 0.117 27 0 "[ . 1 . 2 . 3 ]" 1
249 1 22 LEU HA 1 23 GLU H . . 3.070 2.218 2.044 2.581 . 0 0 "[ . 1 . 2 . 3 ]" 1
250 1 22 LEU HB2 1 22 LEU MD1 . . 3.190 2.882 2.030 3.241 0.051 14 0 "[ . 1 . 2 . 3 ]" 1
251 1 22 LEU HB2 1 23 GLU H . . 4.400 4.282 3.852 4.453 0.053 6 0 "[ . 1 . 2 . 3 ]" 1
252 1 22 LEU HB3 1 23 GLU H . . 4.200 3.982 2.752 4.230 0.030 20 0 "[ . 1 . 2 . 3 ]" 1
253 1 22 LEU HB3 1 75 VAL H . . 4.580 3.774 3.259 4.496 . 0 0 "[ . 1 . 2 . 3 ]" 1
254 1 22 LEU MD1 1 23 GLU H . . 4.270 3.012 2.091 4.340 0.070 25 0 "[ . 1 . 2 . 3 ]" 1
255 1 22 LEU MD2 1 23 GLU H . . 3.800 2.768 1.904 3.810 0.010 11 0 "[ . 1 . 2 . 3 ]" 1
256 1 22 LEU HG 1 23 GLU H . . 5.190 4.030 1.846 4.970 . 0 0 "[ . 1 . 2 . 3 ]" 1
257 1 23 GLU H 1 23 GLU HB2 . . 4.040 3.861 3.434 4.045 0.005 22 0 "[ . 1 . 2 . 3 ]" 1
258 1 23 GLU H 1 23 GLU QB . . 3.310 3.123 2.849 3.317 0.007 26 0 "[ . 1 . 2 . 3 ]" 1
259 1 23 GLU H 1 23 GLU HB3 . . 4.040 3.311 2.964 3.689 . 0 0 "[ . 1 . 2 . 3 ]" 1
260 1 23 GLU H 1 23 GLU HG2 . . 3.720 2.574 2.057 3.389 . 0 0 "[ . 1 . 2 . 3 ]" 1
261 1 23 GLU H 1 23 GLU HG3 . . 3.720 3.453 2.133 3.754 0.034 31 0 "[ . 1 . 2 . 3 ]" 1
262 1 23 GLU HA 1 74 ARG HA . . 3.280 2.136 1.963 2.545 . 0 0 "[ . 1 . 2 . 3 ]" 1
263 1 23 GLU HA 1 75 VAL H . . 4.510 3.366 2.805 3.653 . 0 0 "[ . 1 . 2 . 3 ]" 1
264 1 23 GLU QB 1 24 ASN H . . 3.760 2.786 2.193 3.546 . 0 0 "[ . 1 . 2 . 3 ]" 1
265 1 23 GLU QB 1 74 ARG HA . . 3.630 2.886 2.077 3.671 0.041 4 0 "[ . 1 . 2 . 3 ]" 1
266 1 23 GLU HB2 1 74 ARG HA . . 4.440 3.506 2.435 4.565 0.125 20 0 "[ . 1 . 2 . 3 ]" 1
267 1 23 GLU HB3 1 74 ARG HA . . 4.440 3.105 2.167 4.147 . 0 0 "[ . 1 . 2 . 3 ]" 1
268 1 24 ASN H 1 24 ASN HB2 . . 3.850 2.854 2.643 3.307 . 0 0 "[ . 1 . 2 . 3 ]" 1
269 1 24 ASN H 1 24 ASN HB3 . . 3.670 2.525 2.378 2.878 . 0 0 "[ . 1 . 2 . 3 ]" 1
270 1 24 ASN H 1 24 ASN HD21 . . 5.500 4.901 4.684 5.351 . 0 0 "[ . 1 . 2 . 3 ]" 1
271 1 24 ASN H 1 69 VAL MG1 . . 4.570 3.121 2.521 4.089 . 0 0 "[ . 1 . 2 . 3 ]" 1
272 1 24 ASN H 1 73 GLY H . . 4.520 3.922 3.644 4.254 . 0 0 "[ . 1 . 2 . 3 ]" 1
273 1 24 ASN HA 1 25 PRO HD2 . . 3.170 2.129 2.105 2.170 . 0 0 "[ . 1 . 2 . 3 ]" 1
274 1 24 ASN HA 1 25 PRO HD3 . . 3.240 2.681 2.498 2.918 . 0 0 "[ . 1 . 2 . 3 ]" 1
275 1 24 ASN HA 1 25 PRO HG2 . . 4.300 4.339 4.300 4.386 0.086 28 0 "[ . 1 . 2 . 3 ]" 1
276 1 24 ASN HA 1 26 GLY H . . 3.880 3.404 3.195 3.651 . 0 0 "[ . 1 . 2 . 3 ]" 1
277 1 24 ASN HA 1 30 LEU MD1 . . 4.410 3.259 2.379 4.418 0.008 30 0 "[ . 1 . 2 . 3 ]" 1
278 1 24 ASN HA 1 30 LEU QD . . 3.860 2.602 2.204 3.229 . 0 0 "[ . 1 . 2 . 3 ]" 1
279 1 24 ASN HA 1 30 LEU MD2 . . 4.410 3.569 2.216 4.430 0.020 25 0 "[ . 1 . 2 . 3 ]" 1
280 1 24 ASN HB2 1 30 LEU QD . . 4.670 2.535 2.156 3.065 . 0 0 "[ . 1 . 2 . 3 ]" 1
281 1 24 ASN HB2 1 69 VAL MG1 . . 3.720 2.883 2.324 3.367 . 0 0 "[ . 1 . 2 . 3 ]" 1
282 1 24 ASN HB2 1 73 GLY H . . 4.400 4.471 4.430 4.531 0.131 24 0 "[ . 1 . 2 . 3 ]" 1
283 1 24 ASN HB3 1 26 GLY H . . 5.500 4.304 4.109 4.515 . 0 0 "[ . 1 . 2 . 3 ]" 1
284 1 24 ASN HB3 1 30 LEU MD1 . . 5.070 4.290 3.663 5.087 0.017 29 0 "[ . 1 . 2 . 3 ]" 1
285 1 24 ASN HB3 1 30 LEU QD . . 4.310 3.810 3.586 4.175 . 0 0 "[ . 1 . 2 . 3 ]" 1
286 1 24 ASN HB3 1 30 LEU MD2 . . 5.070 4.667 3.781 5.146 0.076 20 0 "[ . 1 . 2 . 3 ]" 1
287 1 24 ASN HB3 1 69 VAL MG1 . . 3.470 2.976 2.639 3.414 . 0 0 "[ . 1 . 2 . 3 ]" 1
288 1 24 ASN HB3 1 69 VAL MG2 . . 4.980 4.918 4.553 5.003 0.023 31 0 "[ . 1 . 2 . 3 ]" 1
289 1 24 ASN HB3 1 72 LYS H . . 4.820 3.183 2.760 3.668 . 0 0 "[ . 1 . 2 . 3 ]" 1
290 1 24 ASN HB3 1 73 GLY H . . 4.560 2.815 2.707 2.978 . 0 0 "[ . 1 . 2 . 3 ]" 1
291 1 24 ASN HD21 1 29 PRO HA . . 3.880 2.710 2.277 3.340 . 0 0 "[ . 1 . 2 . 3 ]" 1
292 1 24 ASN HD21 1 30 LEU H . . 4.380 2.872 2.328 3.342 . 0 0 "[ . 1 . 2 . 3 ]" 1
293 1 24 ASN HD21 1 30 LEU HB3 . . 5.530 4.833 3.509 5.544 0.014 7 0 "[ . 1 . 2 . 3 ]" 1
294 1 24 ASN HD21 1 30 LEU MD1 . . 6.080 3.753 3.006 4.448 . 0 0 "[ . 1 . 2 . 3 ]" 1
295 1 24 ASN HD21 1 30 LEU QD . . 5.300 3.410 2.826 3.785 . 0 0 "[ . 1 . 2 . 3 ]" 1
296 1 24 ASN HD21 1 30 LEU MD2 . . 6.080 3.933 3.432 4.387 . 0 0 "[ . 1 . 2 . 3 ]" 1
297 1 24 ASN HD21 1 30 LEU HG . . 5.140 3.886 2.826 5.192 0.052 2 0 "[ . 1 . 2 . 3 ]" 1
298 1 24 ASN HD21 1 69 VAL MG1 . . 5.240 3.625 3.291 4.076 . 0 0 "[ . 1 . 2 . 3 ]" 1
299 1 24 ASN HD21 1 69 VAL MG2 . . 6.310 5.030 4.567 5.481 . 0 0 "[ . 1 . 2 . 3 ]" 1
300 1 24 ASN HD21 1 70 PRO HA . . 5.930 4.001 3.413 4.535 . 0 0 "[ . 1 . 2 . 3 ]" 1
301 1 24 ASN HD21 1 71 PRO HA . . 3.730 2.580 2.203 3.120 . 0 0 "[ . 1 . 2 . 3 ]" 1
302 1 24 ASN HD21 1 71 PRO HD2 . . 6.510 4.953 4.551 5.333 . 0 0 "[ . 1 . 2 . 3 ]" 1
303 1 24 ASN HD21 1 72 LYS H . . 5.090 4.154 3.600 4.779 . 0 0 "[ . 1 . 2 . 3 ]" 1
304 1 24 ASN HD21 1 73 GLY H . . 5.220 4.265 3.504 5.028 . 0 0 "[ . 1 . 2 . 3 ]" 1
305 1 24 ASN HD22 1 29 PRO HA . . 3.690 2.715 2.283 3.228 . 0 0 "[ . 1 . 2 . 3 ]" 1
306 1 24 ASN HD22 1 30 LEU H . . 4.370 3.529 3.035 3.990 . 0 0 "[ . 1 . 2 . 3 ]" 1
307 1 24 ASN HD22 1 30 LEU MD1 . . 6.210 3.518 2.227 4.481 . 0 0 "[ . 1 . 2 . 3 ]" 1
308 1 24 ASN HD22 1 30 LEU QD . . 5.400 2.980 2.203 3.479 . 0 0 "[ . 1 . 2 . 3 ]" 1
309 1 24 ASN HD22 1 30 LEU MD2 . . 6.210 3.580 3.229 4.018 . 0 0 "[ . 1 . 2 . 3 ]" 1
310 1 24 ASN HD22 1 30 LEU HG . . 5.470 3.860 2.787 5.485 0.015 29 0 "[ . 1 . 2 . 3 ]" 1
311 1 24 ASN HD22 1 69 VAL MG1 . . 5.500 5.104 4.812 5.504 0.004 29 0 "[ . 1 . 2 . 3 ]" 1
312 1 24 ASN HD22 1 71 PRO HA . . 3.680 2.630 2.350 2.972 . 0 0 "[ . 1 . 2 . 3 ]" 1
313 1 25 PRO HA 1 72 LYS H . . 3.900 3.929 3.906 3.948 0.048 14 0 "[ . 1 . 2 . 3 ]" 1
314 1 25 PRO HA 1 72 LYS HA . . 3.790 3.163 2.693 3.550 . 0 0 "[ . 1 . 2 . 3 ]" 1
315 1 25 PRO HA 1 72 LYS QD . . 3.700 3.185 2.568 3.698 . 0 0 "[ . 1 . 2 . 3 ]" 1
316 1 25 PRO HD2 1 26 GLY H . . 4.590 2.816 2.643 2.965 . 0 0 "[ . 1 . 2 . 3 ]" 1
317 1 25 PRO HD3 1 26 GLY H . . 4.370 3.993 3.890 4.063 . 0 0 "[ . 1 . 2 . 3 ]" 1
318 1 25 PRO QG 1 26 GLY H . . 4.560 2.973 2.808 3.116 . 0 0 "[ . 1 . 2 . 3 ]" 1
319 1 25 PRO HG2 1 26 GLY H . . 4.220 3.019 2.845 3.172 . 0 0 "[ . 1 . 2 . 3 ]" 1
320 1 25 PRO HG3 1 26 GLY H . . 4.560 4.447 4.316 4.571 0.011 19 0 "[ . 1 . 2 . 3 ]" 1
321 1 26 GLY H 1 27 ASP H . . 4.620 4.525 4.396 4.609 . 0 0 "[ . 1 . 2 . 3 ]" 1
322 1 26 GLY H 1 28 LEU QD . . 5.500 5.397 4.917 5.525 0.025 26 0 "[ . 1 . 2 . 3 ]" 1
323 1 26 GLY H 1 72 LYS H . . 4.380 3.787 3.536 4.127 . 0 0 "[ . 1 . 2 . 3 ]" 1
324 1 26 GLY QA 1 28 LEU H . . 4.130 3.132 2.921 3.364 . 0 0 "[ . 1 . 2 . 3 ]" 1
325 1 26 GLY HA3 1 27 ASP H . . 3.470 2.634 2.408 2.870 . 0 0 "[ . 1 . 2 . 3 ]" 1
326 1 26 GLY HA3 1 28 LEU H . . 4.730 3.236 2.994 3.535 . 0 0 "[ . 1 . 2 . 3 ]" 1
327 1 27 ASP H 1 27 ASP HB2 . . 3.780 2.434 2.188 3.547 . 0 0 "[ . 1 . 2 . 3 ]" 1
328 1 27 ASP H 1 27 ASP HB3 . . 3.690 3.499 2.596 3.659 . 0 0 "[ . 1 . 2 . 3 ]" 1
329 1 27 ASP H 1 28 LEU H . . 3.320 2.516 2.267 2.793 . 0 0 "[ . 1 . 2 . 3 ]" 1
330 1 27 ASP H 1 28 LEU QB . . 4.820 4.637 4.320 4.826 0.006 3 0 "[ . 1 . 2 . 3 ]" 1
331 1 27 ASP H 1 28 LEU QD . . 5.440 4.186 2.661 4.557 . 0 0 "[ . 1 . 2 . 3 ]" 1
332 1 27 ASP HB2 1 28 LEU H . . 4.610 3.696 3.440 4.098 . 0 0 "[ . 1 . 2 . 3 ]" 1
333 1 27 ASP HB3 1 28 LEU H . . 4.600 4.269 3.495 4.454 . 0 0 "[ . 1 . 2 . 3 ]" 1
334 1 28 LEU H 1 28 LEU HB2 . . 3.830 3.684 2.767 3.850 0.020 16 0 "[ . 1 . 2 . 3 ]" 1
335 1 28 LEU H 1 28 LEU QB . . 3.060 2.937 2.683 3.040 . 0 0 "[ . 1 . 2 . 3 ]" 1
336 1 28 LEU H 1 28 LEU HB3 . . 3.830 3.187 2.760 3.819 . 0 0 "[ . 1 . 2 . 3 ]" 1
337 1 28 LEU H 1 28 LEU QD . . 4.120 3.063 2.262 3.225 . 0 0 "[ . 1 . 2 . 3 ]" 1
338 1 28 LEU H 1 71 PRO HB3 . . 4.850 2.967 2.487 3.782 . 0 0 "[ . 1 . 2 . 3 ]" 1
339 1 28 LEU HA 1 28 LEU MD1 . . 4.220 3.615 2.426 4.050 . 0 0 "[ . 1 . 2 . 3 ]" 1
340 1 28 LEU HA 1 28 LEU QD . . 3.650 3.299 2.387 3.438 . 0 0 "[ . 1 . 2 . 3 ]" 1
341 1 28 LEU HA 1 28 LEU MD2 . . 4.220 3.965 2.495 4.111 . 0 0 "[ . 1 . 2 . 3 ]" 1
342 1 28 LEU HA 1 28 LEU HG . . 3.800 3.784 3.447 3.836 0.036 20 0 "[ . 1 . 2 . 3 ]" 1
343 1 28 LEU HA 1 29 PRO HD2 . . 3.150 2.940 2.855 2.989 . 0 0 "[ . 1 . 2 . 3 ]" 1
344 1 28 LEU HA 1 29 PRO QD . . 3.720 2.220 2.140 2.281 . 0 0 "[ . 1 . 2 . 3 ]" 1
345 1 28 LEU HA 1 29 PRO HD3 . . 3.330 2.297 2.210 2.366 . 0 0 "[ . 1 . 2 . 3 ]" 1
346 1 28 LEU QB 1 28 LEU QD . . 2.850 1.922 1.903 2.059 . 0 0 "[ . 1 . 2 . 3 ]" 1
347 1 28 LEU QB 1 29 PRO QD . . 4.260 2.040 1.961 2.179 . 0 0 "[ . 1 . 2 . 3 ]" 1
348 1 28 LEU QB 1 29 PRO HD3 . . 3.570 2.959 2.901 3.088 . 0 0 "[ . 1 . 2 . 3 ]" 1
349 1 28 LEU HB2 1 29 PRO HD2 . . 4.190 2.241 2.000 3.383 . 0 0 "[ . 1 . 2 . 3 ]" 1
350 1 28 LEU HB2 1 29 PRO QD . . 4.900 2.195 1.973 3.248 . 0 0 "[ . 1 . 2 . 3 ]" 1
351 1 28 LEU HB2 1 29 PRO HD3 . . 4.090 3.177 2.976 4.189 0.099 5 0 "[ . 1 . 2 . 3 ]" 1
352 1 28 LEU HB3 1 29 PRO HD2 . . 4.190 3.522 2.148 3.813 . 0 0 "[ . 1 . 2 . 3 ]" 1
353 1 28 LEU HB3 1 29 PRO QD . . 4.900 3.283 2.105 3.507 . 0 0 "[ . 1 . 2 . 3 ]" 1
354 1 28 LEU HB3 1 29 PRO HD3 . . 4.090 3.961 2.992 4.101 0.011 31 0 "[ . 1 . 2 . 3 ]" 1
355 1 28 LEU QD 1 29 PRO HD2 . . 3.830 2.870 2.722 3.751 . 0 0 "[ . 1 . 2 . 3 ]" 1
356 1 28 LEU QD 1 29 PRO QD . . 4.080 2.777 2.670 3.345 . 0 0 "[ . 1 . 2 . 3 ]" 1
357 1 28 LEU QD 1 29 PRO HD3 . . 3.850 3.857 3.643 3.881 0.031 28 0 "[ . 1 . 2 . 3 ]" 1
358 1 28 LEU HG 1 29 PRO QD . . 5.470 4.416 4.133 4.709 . 0 0 "[ . 1 . 2 . 3 ]" 1
359 1 29 PRO HA 1 30 LEU H . . 3.070 2.378 2.231 2.454 . 0 0 "[ . 1 . 2 . 3 ]" 1
360 1 29 PRO HA 1 70 PRO HA . . 5.200 3.041 2.889 3.189 . 0 0 "[ . 1 . 2 . 3 ]" 1
361 1 29 PRO HA 1 71 PRO HD2 . . 3.880 3.908 3.878 3.931 0.051 18 0 "[ . 1 . 2 . 3 ]" 1
362 1 29 PRO HA 1 71 PRO HG3 . . 4.110 4.140 4.123 4.153 0.043 18 0 "[ . 1 . 2 . 3 ]" 1
363 1 29 PRO HB2 1 30 LEU H . . 4.300 2.863 2.634 3.099 . 0 0 "[ . 1 . 2 . 3 ]" 1
364 1 29 PRO HB3 1 30 LEU H . . 3.750 3.702 3.542 3.777 0.027 26 0 "[ . 1 . 2 . 3 ]" 1
365 1 29 PRO HB3 1 71 PRO HD2 . . 4.630 3.546 3.328 4.326 . 0 0 "[ . 1 . 2 . 3 ]" 1
366 1 30 LEU H 1 30 LEU HB2 . . 3.700 2.529 2.235 2.642 . 0 0 "[ . 1 . 2 . 3 ]" 1
367 1 30 LEU H 1 30 LEU HB3 . . 4.040 3.571 3.105 3.794 . 0 0 "[ . 1 . 2 . 3 ]" 1
368 1 30 LEU H 1 30 LEU MD1 . . 5.550 3.924 3.341 4.272 . 0 0 "[ . 1 . 2 . 3 ]" 1
369 1 30 LEU H 1 30 LEU MD2 . . 5.550 3.962 3.404 4.616 . 0 0 "[ . 1 . 2 . 3 ]" 1
370 1 30 LEU H 1 31 ARG H . . 5.470 4.332 3.883 4.471 . 0 0 "[ . 1 . 2 . 3 ]" 1
371 1 30 LEU H 1 68 GLU HA . . 4.980 5.009 4.988 5.029 0.049 17 0 "[ . 1 . 2 . 3 ]" 1
372 1 30 LEU H 1 69 VAL H . . 4.100 3.093 3.046 3.171 . 0 0 "[ . 1 . 2 . 3 ]" 1
373 1 30 LEU H 1 69 VAL MG2 . . 5.380 4.465 3.875 4.853 . 0 0 "[ . 1 . 2 . 3 ]" 1
374 1 30 LEU H 1 70 PRO HA . . 5.790 3.896 3.659 4.109 . 0 0 "[ . 1 . 2 . 3 ]" 1
375 1 30 LEU H 1 71 PRO HD2 . . 6.160 5.718 5.580 5.845 . 0 0 "[ . 1 . 2 . 3 ]" 1
376 1 30 LEU HA 1 30 LEU MD1 . . 3.690 3.069 2.057 3.763 0.073 7 0 "[ . 1 . 2 . 3 ]" 1
377 1 30 LEU HA 1 30 LEU MD2 . . 3.690 2.809 2.100 3.755 0.065 16 0 "[ . 1 . 2 . 3 ]" 1
378 1 30 LEU HA 1 31 ARG H . . 3.010 2.130 2.009 2.228 . 0 0 "[ . 1 . 2 . 3 ]" 1
379 1 30 LEU HB2 1 31 ARG H . . 4.330 4.028 3.567 4.516 0.186 30 0 "[ . 1 . 2 . 3 ]" 1
380 1 30 LEU HB2 1 69 VAL H . . 5.410 3.707 3.269 4.496 . 0 0 "[ . 1 . 2 . 3 ]" 1
381 1 30 LEU HB2 1 69 VAL HB . . 3.930 2.637 2.185 3.770 . 0 0 "[ . 1 . 2 . 3 ]" 1
382 1 30 LEU HB2 1 105 PHE QE . . 4.410 3.852 3.420 4.461 0.051 9 0 "[ . 1 . 2 . 3 ]" 1
383 1 30 LEU HB3 1 31 ARG H . . 4.080 3.037 2.403 4.064 . 0 0 "[ . 1 . 2 . 3 ]" 1
384 1 30 LEU HB3 1 69 VAL H . . 5.500 4.177 3.253 4.769 . 0 0 "[ . 1 . 2 . 3 ]" 1
385 1 30 LEU HB3 1 69 VAL HB . . 4.030 3.664 2.570 4.062 0.032 20 0 "[ . 1 . 2 . 3 ]" 1
386 1 30 LEU HB3 1 105 PHE QD . . 3.880 2.893 2.314 3.797 . 0 0 "[ . 1 . 2 . 3 ]" 1
387 1 30 LEU HB3 1 105 PHE QE . . 3.660 2.707 2.172 3.362 . 0 0 "[ . 1 . 2 . 3 ]" 1
388 1 30 LEU QD 1 31 ARG H . . 4.120 3.467 3.234 3.860 . 0 0 "[ . 1 . 2 . 3 ]" 1
389 1 30 LEU QD 1 69 VAL H . . 5.750 4.815 4.592 5.066 . 0 0 "[ . 1 . 2 . 3 ]" 1
390 1 30 LEU QD 1 105 PHE QD . . 4.110 3.243 2.969 3.683 . 0 0 "[ . 1 . 2 . 3 ]" 1
391 1 30 LEU QD 1 105 PHE QE . . 3.550 2.535 2.210 2.830 . 0 0 "[ . 1 . 2 . 3 ]" 1
392 1 30 LEU QD 1 109 LYS QE . . 4.560 3.805 1.976 4.523 . 0 0 "[ . 1 . 2 . 3 ]" 1
393 1 30 LEU MD1 1 31 ARG H . . 5.140 4.116 3.394 4.636 . 0 0 "[ . 1 . 2 . 3 ]" 1
394 1 30 LEU MD1 1 69 VAL H . . 6.550 5.385 5.038 5.795 . 0 0 "[ . 1 . 2 . 3 ]" 1
395 1 30 LEU MD1 1 105 PHE QD . . 4.800 3.708 3.205 4.253 . 0 0 "[ . 1 . 2 . 3 ]" 1
396 1 30 LEU MD1 1 105 PHE QE . . 4.210 3.347 2.428 4.275 0.065 15 0 "[ . 1 . 2 . 3 ]" 1
397 1 30 LEU MD1 1 109 LYS HE2 . . 6.600 5.499 3.140 6.638 0.038 23 0 "[ . 1 . 2 . 3 ]" 1
398 1 30 LEU MD1 1 109 LYS HE3 . . 6.600 5.426 3.239 6.616 0.016 24 0 "[ . 1 . 2 . 3 ]" 1
399 1 30 LEU MD2 1 31 ARG H . . 5.140 4.027 3.335 5.141 0.001 19 0 "[ . 1 . 2 . 3 ]" 1
400 1 30 LEU MD2 1 69 VAL H . . 6.550 5.484 4.911 5.819 . 0 0 "[ . 1 . 2 . 3 ]" 1
401 1 30 LEU MD2 1 105 PHE QD . . 4.800 3.637 3.210 4.038 . 0 0 "[ . 1 . 2 . 3 ]" 1
402 1 30 LEU MD2 1 105 PHE QE . . 4.210 3.400 2.217 4.235 0.025 31 0 "[ . 1 . 2 . 3 ]" 1
403 1 30 LEU MD2 1 109 LYS HE2 . . 6.600 5.088 2.030 6.661 0.061 30 0 "[ . 1 . 2 . 3 ]" 1
404 1 30 LEU MD2 1 109 LYS HE3 . . 6.600 4.966 2.613 6.642 0.042 26 0 "[ . 1 . 2 . 3 ]" 1
405 1 30 LEU HG 1 31 ARG H . . 4.720 4.267 3.057 4.864 0.144 20 0 "[ . 1 . 2 . 3 ]" 1
406 1 31 ARG H 1 31 ARG HB2 . . 3.850 3.162 2.801 3.493 . 0 0 "[ . 1 . 2 . 3 ]" 1
407 1 31 ARG H 1 31 ARG QB . . 3.280 2.632 2.420 2.812 . 0 0 "[ . 1 . 2 . 3 ]" 1
408 1 31 ARG H 1 31 ARG HB3 . . 3.850 2.822 2.520 3.040 . 0 0 "[ . 1 . 2 . 3 ]" 1
409 1 31 ARG H 1 31 ARG QD . . 5.340 5.159 4.879 5.378 0.038 27 0 "[ . 1 . 2 . 3 ]" 1
410 1 31 ARG H 1 32 LEU H . . 5.230 4.150 3.880 4.414 . 0 0 "[ . 1 . 2 . 3 ]" 1
411 1 31 ARG H 1 105 PHE HB2 . . 5.920 5.206 4.706 5.874 . 0 0 "[ . 1 . 2 . 3 ]" 1
412 1 31 ARG H 1 105 PHE HB3 . . 6.120 3.483 2.990 4.165 . 0 0 "[ . 1 . 2 . 3 ]" 1
413 1 31 ARG H 1 105 PHE QD . . 4.660 2.805 2.212 3.201 . 0 0 "[ . 1 . 2 . 3 ]" 1
414 1 31 ARG H 1 105 PHE QE . . 6.270 4.537 3.916 5.102 . 0 0 "[ . 1 . 2 . 3 ]" 1
415 1 31 ARG HA 1 32 LEU H . . 3.260 2.100 2.041 2.177 . 0 0 "[ . 1 . 2 . 3 ]" 1
416 1 31 ARG HA 1 32 LEU HB3 . . 4.710 4.303 4.060 4.472 . 0 0 "[ . 1 . 2 . 3 ]" 1
417 1 31 ARG HA 1 66 PHE QD . . 5.220 4.508 4.220 5.010 . 0 0 "[ . 1 . 2 . 3 ]" 1
418 1 31 ARG HA 1 105 PHE QD . . 5.960 4.168 3.787 4.461 . 0 0 "[ . 1 . 2 . 3 ]" 1
419 1 31 ARG QB 1 31 ARG QD . . 3.320 2.376 2.040 2.545 . 0 0 "[ . 1 . 2 . 3 ]" 1
420 1 31 ARG QB 1 32 LEU H . . 3.900 3.868 3.789 3.929 0.029 23 0 "[ . 1 . 2 . 3 ]" 1
421 1 31 ARG QB 1 66 PHE QD . . 5.180 4.710 4.347 5.153 . 0 0 "[ . 1 . 2 . 3 ]" 1
422 1 31 ARG QB 1 69 VAL H . . 5.340 4.622 3.957 4.997 . 0 0 "[ . 1 . 2 . 3 ]" 1
423 1 31 ARG QB 1 105 PHE HA . . 4.610 4.627 4.464 4.657 0.047 29 0 "[ . 1 . 2 . 3 ]" 1
424 1 31 ARG QB 1 106 ALA H . . 5.070 3.191 2.933 3.837 . 0 0 "[ . 1 . 2 . 3 ]" 1
425 1 31 ARG HB2 1 32 LEU H . . 4.700 4.368 4.245 4.463 . 0 0 "[ . 1 . 2 . 3 ]" 1
426 1 31 ARG HB3 1 32 LEU H . . 4.700 4.318 4.193 4.471 . 0 0 "[ . 1 . 2 . 3 ]" 1
427 1 31 ARG QD 1 66 PHE QD . . 4.390 3.160 2.699 4.404 0.014 23 0 "[ . 1 . 2 . 3 ]" 1
428 1 31 ARG QD 1 66 PHE QE . . 5.580 3.337 2.617 5.035 . 0 0 "[ . 1 . 2 . 3 ]" 1
429 1 31 ARG QD 1 106 ALA MB . . 3.990 3.559 2.379 4.029 0.039 24 0 "[ . 1 . 2 . 3 ]" 1
430 1 31 ARG HD2 1 66 PHE QD . . 5.120 4.079 2.993 4.960 . 0 0 "[ . 1 . 2 . 3 ]" 1
431 1 31 ARG HD2 1 66 PHE QE . . 6.430 4.284 3.141 5.583 . 0 0 "[ . 1 . 2 . 3 ]" 1
432 1 31 ARG HD3 1 66 PHE QD . . 5.120 3.440 3.069 5.134 0.014 17 0 "[ . 1 . 2 . 3 ]" 1
433 1 31 ARG HD3 1 66 PHE QE . . 6.430 3.581 2.762 5.727 . 0 0 "[ . 1 . 2 . 3 ]" 1
434 1 31 ARG QG 1 32 LEU H . . 4.620 3.025 2.803 3.294 . 0 0 "[ . 1 . 2 . 3 ]" 1
435 1 31 ARG QG 1 66 PHE QB . . 3.470 2.503 2.188 3.171 . 0 0 "[ . 1 . 2 . 3 ]" 1
436 1 31 ARG QG 1 66 PHE QD . . 3.850 2.753 2.408 3.275 . 0 0 "[ . 1 . 2 . 3 ]" 1
437 1 31 ARG QG 1 66 PHE QE . . 5.190 3.929 3.493 4.573 . 0 0 "[ . 1 . 2 . 3 ]" 1
438 1 31 ARG QG 1 68 GLU QB . . 3.710 2.359 2.046 3.033 . 0 0 "[ . 1 . 2 . 3 ]" 1
439 1 31 ARG HG2 1 66 PHE HB2 . . 4.850 3.011 2.576 3.925 . 0 0 "[ . 1 . 2 . 3 ]" 1
440 1 31 ARG HG2 1 66 PHE HB3 . . 4.850 3.658 3.125 4.756 . 0 0 "[ . 1 . 2 . 3 ]" 1
441 1 31 ARG HG2 1 66 PHE QD . . 4.520 3.819 3.452 4.352 . 0 0 "[ . 1 . 2 . 3 ]" 1
442 1 31 ARG HG3 1 66 PHE HB2 . . 4.850 2.880 2.487 3.496 . 0 0 "[ . 1 . 2 . 3 ]" 1
443 1 31 ARG HG3 1 66 PHE HB3 . . 4.850 4.132 3.705 4.853 0.003 17 0 "[ . 1 . 2 . 3 ]" 1
444 1 31 ARG HG3 1 66 PHE QD . . 4.520 2.828 2.441 3.432 . 0 0 "[ . 1 . 2 . 3 ]" 1
445 1 32 LEU H 1 32 LEU HB2 . . 3.680 2.801 2.589 3.037 . 0 0 "[ . 1 . 2 . 3 ]" 1
446 1 32 LEU H 1 32 LEU HB3 . . 3.820 2.299 2.207 2.382 . 0 0 "[ . 1 . 2 . 3 ]" 1
447 1 32 LEU H 1 32 LEU MD1 . . 5.500 4.329 4.218 4.395 . 0 0 "[ . 1 . 2 . 3 ]" 1
448 1 32 LEU H 1 32 LEU MD2 . . 5.500 4.178 4.073 4.255 . 0 0 "[ . 1 . 2 . 3 ]" 1
449 1 32 LEU H 1 32 LEU HG . . 5.590 4.340 4.194 4.484 . 0 0 "[ . 1 . 2 . 3 ]" 1
450 1 32 LEU H 1 33 VAL H . . 5.500 4.380 4.260 4.514 . 0 0 "[ . 1 . 2 . 3 ]" 1
451 1 32 LEU H 1 33 VAL MG1 . . 5.500 4.226 3.955 4.639 . 0 0 "[ . 1 . 2 . 3 ]" 1
452 1 32 LEU H 1 66 PHE QB . . 5.340 3.694 3.399 4.009 . 0 0 "[ . 1 . 2 . 3 ]" 1
453 1 32 LEU H 1 66 PHE QD . . 5.620 4.494 4.163 4.986 . 0 0 "[ . 1 . 2 . 3 ]" 1
454 1 32 LEU H 1 67 LEU H . . 4.410 3.349 3.068 3.557 . 0 0 "[ . 1 . 2 . 3 ]" 1
455 1 32 LEU H 1 105 PHE QD . . 4.880 3.857 3.518 4.287 . 0 0 "[ . 1 . 2 . 3 ]" 1
456 1 32 LEU H 1 105 PHE QE . . 5.360 4.457 4.150 4.834 . 0 0 "[ . 1 . 2 . 3 ]" 1
457 1 32 LEU HA 1 32 LEU MD1 . . 4.670 2.334 2.233 3.614 . 0 0 "[ . 1 . 2 . 3 ]" 1
458 1 32 LEU HA 1 32 LEU QD . . 3.460 2.302 2.222 3.047 . 0 0 "[ . 1 . 2 . 3 ]" 1
459 1 32 LEU HA 1 32 LEU MD2 . . 4.670 3.936 3.282 3.998 . 0 0 "[ . 1 . 2 . 3 ]" 1
460 1 32 LEU HA 1 32 LEU HG . . 3.940 3.143 2.434 3.435 . 0 0 "[ . 1 . 2 . 3 ]" 1
461 1 32 LEU HA 1 33 VAL H . . 3.290 2.172 2.131 2.242 . 0 0 "[ . 1 . 2 . 3 ]" 1
462 1 32 LEU HA 1 34 GLY H . . 4.200 3.730 3.518 3.911 . 0 0 "[ . 1 . 2 . 3 ]" 1
463 1 32 LEU HA 1 105 PHE HA . . 3.390 2.520 2.312 2.627 . 0 0 "[ . 1 . 2 . 3 ]" 1
464 1 32 LEU HA 1 105 PHE HB2 . . 5.120 4.979 4.720 5.131 0.011 6 0 "[ . 1 . 2 . 3 ]" 1
465 1 32 LEU HA 1 105 PHE HB3 . . 5.190 4.270 3.898 4.574 . 0 0 "[ . 1 . 2 . 3 ]" 1
466 1 32 LEU HA 1 105 PHE QD . . 4.740 2.832 2.528 3.176 . 0 0 "[ . 1 . 2 . 3 ]" 1
467 1 32 LEU HA 1 105 PHE QE . . 3.870 3.780 3.491 3.874 0.004 4 0 "[ . 1 . 2 . 3 ]" 1
468 1 32 LEU HB2 1 33 VAL H . . 5.000 4.372 4.245 4.463 . 0 0 "[ . 1 . 2 . 3 ]" 1
469 1 32 LEU HB2 1 105 PHE HA . . 4.730 4.710 4.484 4.765 0.035 1 0 "[ . 1 . 2 . 3 ]" 1
470 1 32 LEU HB2 1 105 PHE QD . . 4.970 3.354 2.841 3.662 . 0 0 "[ . 1 . 2 . 3 ]" 1
471 1 32 LEU HB2 1 105 PHE QE . . 4.220 2.644 2.352 2.843 . 0 0 "[ . 1 . 2 . 3 ]" 1
472 1 32 LEU HB3 1 32 LEU MD1 . . 3.450 3.215 2.614 3.252 . 0 0 "[ . 1 . 2 . 3 ]" 1
473 1 32 LEU HB3 1 32 LEU QD . . 3.000 2.219 2.150 2.283 . 0 0 "[ . 1 . 2 . 3 ]" 1
474 1 32 LEU HB3 1 32 LEU MD2 . . 3.450 2.263 2.213 2.333 . 0 0 "[ . 1 . 2 . 3 ]" 1
475 1 32 LEU HB3 1 33 VAL H . . 5.160 4.403 4.184 4.515 . 0 0 "[ . 1 . 2 . 3 ]" 1
476 1 32 LEU HB3 1 34 GLY H . . 5.500 5.121 4.954 5.484 . 0 0 "[ . 1 . 2 . 3 ]" 1
477 1 32 LEU HB3 1 67 LEU H . . 4.660 3.215 2.987 3.706 . 0 0 "[ . 1 . 2 . 3 ]" 1
478 1 32 LEU HB3 1 67 LEU QB . . 3.900 2.640 2.334 3.966 0.066 17 0 "[ . 1 . 2 . 3 ]" 1
479 1 32 LEU HB3 1 67 LEU MD2 . . 5.700 4.892 4.019 5.465 . 0 0 "[ . 1 . 2 . 3 ]" 1
480 1 32 LEU HB3 1 105 PHE QE . . 4.340 4.309 4.030 4.372 0.032 19 0 "[ . 1 . 2 . 3 ]" 1
481 1 32 LEU QD 1 67 LEU QB . . 3.850 2.617 2.334 3.881 0.031 17 0 "[ . 1 . 2 . 3 ]" 1
482 1 32 LEU QD 1 84 PHE QD . . 6.040 4.533 4.218 5.165 . 0 0 "[ . 1 . 2 . 3 ]" 1
483 1 32 LEU QD 1 84 PHE QE . . 4.190 3.013 2.471 3.679 . 0 0 "[ . 1 . 2 . 3 ]" 1
484 1 32 LEU QD 1 84 PHE HZ . . 3.420 2.267 2.037 2.995 . 0 0 "[ . 1 . 2 . 3 ]" 1
485 1 32 LEU QD 1 105 PHE HA . . 4.950 3.719 3.458 4.617 . 0 0 "[ . 1 . 2 . 3 ]" 1
486 1 32 LEU QD 1 105 PHE QD . . 4.190 3.468 3.128 4.019 . 0 0 "[ . 1 . 2 . 3 ]" 1
487 1 32 LEU QD 1 105 PHE QE . . 3.590 2.884 2.472 3.215 . 0 0 "[ . 1 . 2 . 3 ]" 1
488 1 32 LEU MD1 1 34 GLY H . . 5.510 2.983 2.324 4.793 . 0 0 "[ . 1 . 2 . 3 ]" 1
489 1 32 LEU MD1 1 84 PHE HZ . . 3.930 2.639 2.261 3.482 . 0 0 "[ . 1 . 2 . 3 ]" 1
490 1 32 LEU MD1 1 105 PHE QD . . 5.110 3.538 3.185 4.198 . 0 0 "[ . 1 . 2 . 3 ]" 1
491 1 32 LEU MD1 1 105 PHE QE . . 4.780 2.972 2.535 3.440 . 0 0 "[ . 1 . 2 . 3 ]" 1
492 1 32 LEU MD2 1 34 GLY H . . 5.510 4.507 2.716 4.979 . 0 0 "[ . 1 . 2 . 3 ]" 1
493 1 32 LEU MD2 1 84 PHE HZ . . 3.930 2.517 2.242 3.341 . 0 0 "[ . 1 . 2 . 3 ]" 1
494 1 32 LEU MD2 1 105 PHE QD . . 5.110 5.024 4.578 5.137 0.027 11 0 "[ . 1 . 2 . 3 ]" 1
495 1 32 LEU MD2 1 105 PHE QE . . 4.780 3.947 3.430 4.759 . 0 0 "[ . 1 . 2 . 3 ]" 1
496 1 32 LEU HG 1 33 VAL H . . 5.180 3.508 2.740 3.966 . 0 0 "[ . 1 . 2 . 3 ]" 1
497 1 32 LEU HG 1 34 GLY H . . 4.260 3.131 2.537 3.744 . 0 0 "[ . 1 . 2 . 3 ]" 1
498 1 32 LEU HG 1 84 PHE QE . . 5.360 4.126 3.588 5.130 . 0 0 "[ . 1 . 2 . 3 ]" 1
499 1 32 LEU HG 1 84 PHE HZ . . 4.120 3.342 2.590 4.129 0.009 17 0 "[ . 1 . 2 . 3 ]" 1
500 1 33 VAL H 1 33 VAL HB . . 4.000 3.790 3.715 3.875 . 0 0 "[ . 1 . 2 . 3 ]" 1
501 1 33 VAL H 1 33 VAL MG2 . . 3.390 2.187 2.073 2.284 . 0 0 "[ . 1 . 2 . 3 ]" 1
502 1 33 VAL H 1 34 GLY H . . 3.380 2.196 2.049 2.292 . 0 0 "[ . 1 . 2 . 3 ]" 1
503 1 33 VAL H 1 104 LEU H . . 5.500 4.374 4.184 4.578 . 0 0 "[ . 1 . 2 . 3 ]" 1
504 1 33 VAL H 1 104 LEU HB2 . . 4.740 3.463 3.346 3.635 . 0 0 "[ . 1 . 2 . 3 ]" 1
505 1 33 VAL H 1 105 PHE HA . . 4.140 2.729 2.525 2.924 . 0 0 "[ . 1 . 2 . 3 ]" 1
506 1 33 VAL H 1 105 PHE HB3 . . 5.500 5.199 4.963 5.376 . 0 0 "[ . 1 . 2 . 3 ]" 1
507 1 33 VAL H 1 105 PHE QD . . 5.500 4.499 4.326 4.780 . 0 0 "[ . 1 . 2 . 3 ]" 1
508 1 33 VAL HA 1 33 VAL HB . . 2.960 2.454 2.418 2.602 . 0 0 "[ . 1 . 2 . 3 ]" 1
509 1 33 VAL HA 1 33 VAL MG1 . . 3.150 2.357 2.228 2.423 . 0 0 "[ . 1 . 2 . 3 ]" 1
510 1 33 VAL HA 1 45 LEU MD2 . . 5.420 5.359 3.268 5.455 0.035 3 0 "[ . 1 . 2 . 3 ]" 1
511 1 33 VAL HA 1 66 PHE H . . 5.260 4.993 4.621 5.253 . 0 0 "[ . 1 . 2 . 3 ]" 1
512 1 33 VAL HA 1 66 PHE HA . . 3.230 2.449 2.164 2.747 . 0 0 "[ . 1 . 2 . 3 ]" 1
513 1 33 VAL HA 1 66 PHE HB2 . . 4.030 3.128 2.812 3.400 . 0 0 "[ . 1 . 2 . 3 ]" 1
514 1 33 VAL HA 1 66 PHE QB . . 3.400 2.563 2.285 2.841 . 0 0 "[ . 1 . 2 . 3 ]" 1
515 1 33 VAL HA 1 66 PHE HB3 . . 4.030 2.727 2.382 3.086 . 0 0 "[ . 1 . 2 . 3 ]" 1
516 1 33 VAL HA 1 66 PHE QD . . 5.010 4.655 4.353 4.939 . 0 0 "[ . 1 . 2 . 3 ]" 1
517 1 33 VAL HB 1 34 GLY H . . 5.060 4.250 4.053 4.372 . 0 0 "[ . 1 . 2 . 3 ]" 1
518 1 33 VAL MG1 1 34 GLY H . . 5.500 4.256 4.160 4.429 . 0 0 "[ . 1 . 2 . 3 ]" 1
519 1 33 VAL MG1 1 66 PHE HA . . 3.730 3.706 3.504 3.751 0.021 1 0 "[ . 1 . 2 . 3 ]" 1
520 1 33 VAL MG1 1 66 PHE HB2 . . 4.280 2.847 2.243 3.150 . 0 0 "[ . 1 . 2 . 3 ]" 1
521 1 33 VAL MG1 1 66 PHE QB . . 3.620 2.138 1.946 2.400 . 0 0 "[ . 1 . 2 . 3 ]" 1
522 1 33 VAL MG1 1 66 PHE HB3 . . 4.280 2.216 2.100 2.526 . 0 0 "[ . 1 . 2 . 3 ]" 1
523 1 33 VAL MG1 1 66 PHE QD . . 4.280 3.630 3.095 4.122 . 0 0 "[ . 1 . 2 . 3 ]" 1
524 1 33 VAL MG1 1 105 PHE HA . . 4.860 3.266 2.981 4.260 . 0 0 "[ . 1 . 2 . 3 ]" 1
525 1 33 VAL MG1 1 106 ALA H . . 4.120 2.477 1.930 3.380 . 0 0 "[ . 1 . 2 . 3 ]" 1
526 1 33 VAL MG1 1 106 ALA HA . . 3.870 2.775 2.100 3.780 . 0 0 "[ . 1 . 2 . 3 ]" 1
527 1 33 VAL MG2 1 34 GLY H . . 3.900 2.908 2.713 3.079 . 0 0 "[ . 1 . 2 . 3 ]" 1
528 1 33 VAL MG2 1 34 GLY HA3 . . 5.160 3.605 3.380 4.006 . 0 0 "[ . 1 . 2 . 3 ]" 1
529 1 33 VAL MG2 1 66 PHE QB . . 5.930 4.426 4.206 4.687 . 0 0 "[ . 1 . 2 . 3 ]" 1
530 1 33 VAL MG2 1 104 LEU H . . 5.550 4.431 4.306 4.629 . 0 0 "[ . 1 . 2 . 3 ]" 1
531 1 33 VAL MG2 1 105 PHE H . . 4.780 3.620 3.321 4.007 . 0 0 "[ . 1 . 2 . 3 ]" 1
532 1 33 VAL MG2 1 105 PHE HA . . 3.950 2.783 2.574 3.161 . 0 0 "[ . 1 . 2 . 3 ]" 1
533 1 33 VAL MG2 1 105 PHE HB3 . . 6.320 4.844 4.645 5.191 . 0 0 "[ . 1 . 2 . 3 ]" 1
534 1 33 VAL MG2 1 105 PHE QD . . 6.210 4.882 4.740 5.141 . 0 0 "[ . 1 . 2 . 3 ]" 1
535 1 33 VAL MG2 1 106 ALA HA . . 3.670 3.352 2.747 3.682 0.012 24 0 "[ . 1 . 2 . 3 ]" 1
536 1 34 GLY H 1 35 ALA H . . 4.750 4.338 4.275 4.390 . 0 0 "[ . 1 . 2 . 3 ]" 1
537 1 34 GLY H 1 45 LEU MD2 . . 6.100 6.074 4.367 6.150 0.050 8 0 "[ . 1 . 2 . 3 ]" 1
538 1 34 GLY H 1 84 PHE QE . . 5.500 4.220 3.579 4.826 . 0 0 "[ . 1 . 2 . 3 ]" 1
539 1 34 GLY H 1 84 PHE HZ . . 6.050 4.458 3.620 4.930 . 0 0 "[ . 1 . 2 . 3 ]" 1
540 1 34 GLY H 1 104 LEU H . . 4.660 3.308 3.132 3.484 . 0 0 "[ . 1 . 2 . 3 ]" 1
541 1 34 GLY H 1 104 LEU HB2 . . 4.150 2.518 2.323 2.723 . 0 0 "[ . 1 . 2 . 3 ]" 1
542 1 34 GLY H 1 104 LEU HB3 . . 5.250 4.145 3.892 4.385 . 0 0 "[ . 1 . 2 . 3 ]" 1
543 1 34 GLY H 1 104 LEU HG . . 4.120 4.177 4.150 4.211 0.091 8 0 "[ . 1 . 2 . 3 ]" 1
544 1 34 GLY H 1 105 PHE HA . . 4.580 4.608 4.500 4.638 0.058 12 0 "[ . 1 . 2 . 3 ]" 1
545 1 34 GLY HA3 1 35 ALA H . . 3.330 2.397 2.304 2.500 . 0 0 "[ . 1 . 2 . 3 ]" 1
546 1 34 GLY HA3 1 84 PHE QD . . 6.180 5.582 4.984 5.978 . 0 0 "[ . 1 . 2 . 3 ]" 1
547 1 34 GLY HA3 1 84 PHE QE . . 4.530 3.938 3.675 4.319 . 0 0 "[ . 1 . 2 . 3 ]" 1
548 1 34 GLY HA3 1 104 LEU HB2 . . 4.600 3.052 2.759 3.323 . 0 0 "[ . 1 . 2 . 3 ]" 1
549 1 34 GLY HA3 1 104 LEU QD . . 4.180 2.439 2.192 2.711 . 0 0 "[ . 1 . 2 . 3 ]" 1
550 1 35 ALA H 1 43 VAL MG2 . . 5.200 3.107 2.109 4.556 . 0 0 "[ . 1 . 2 . 3 ]" 1
551 1 35 ALA H 1 84 PHE QE . . 5.150 3.427 3.056 3.926 . 0 0 "[ . 1 . 2 . 3 ]" 1
552 1 35 ALA H 1 104 LEU HG . . 5.100 3.326 3.106 3.706 . 0 0 "[ . 1 . 2 . 3 ]" 1
553 1 35 ALA HA 1 36 ARG H . . 2.920 2.639 2.260 2.822 . 0 0 "[ . 1 . 2 . 3 ]" 1
554 1 35 ALA HA 1 103 LEU HA . . 3.570 2.577 2.336 2.836 . 0 0 "[ . 1 . 2 . 3 ]" 1
555 1 35 ALA HA 1 104 LEU H . . 3.620 2.502 2.255 2.698 . 0 0 "[ . 1 . 2 . 3 ]" 1
556 1 35 ALA HA 1 104 LEU HB2 . . 4.690 3.879 3.761 3.955 . 0 0 "[ . 1 . 2 . 3 ]" 1
557 1 35 ALA HA 1 104 LEU HB3 . . 4.890 4.940 4.892 4.992 0.102 21 0 "[ . 1 . 2 . 3 ]" 1
558 1 35 ALA HA 1 104 LEU HG . . 3.390 2.095 2.017 2.175 . 0 0 "[ . 1 . 2 . 3 ]" 1
559 1 35 ALA MB 1 36 ARG H . . 3.520 2.275 2.103 2.777 . 0 0 "[ . 1 . 2 . 3 ]" 1
560 1 35 ALA MB 1 84 PHE QD . . 4.150 3.414 2.802 3.921 . 0 0 "[ . 1 . 2 . 3 ]" 1
561 1 35 ALA MB 1 84 PHE QE . . 3.770 2.760 2.629 2.862 . 0 0 "[ . 1 . 2 . 3 ]" 1
562 1 35 ALA MB 1 101 LEU MD1 . . 3.650 3.056 1.873 3.657 0.007 15 0 "[ . 1 . 2 . 3 ]" 1
563 1 35 ALA MB 1 101 LEU MD2 . . 3.650 2.048 1.870 3.656 0.006 3 0 "[ . 1 . 2 . 3 ]" 1
564 1 35 ALA MB 1 103 LEU HA . . 3.360 2.671 2.206 3.245 . 0 0 "[ . 1 . 2 . 3 ]" 1
565 1 35 ALA MB 1 104 LEU H . . 3.960 3.433 3.134 3.814 . 0 0 "[ . 1 . 2 . 3 ]" 1
566 1 36 ARG H 1 36 ARG QD . . 5.500 4.552 3.528 5.241 . 0 0 "[ . 1 . 2 . 3 ]" 1
567 1 36 ARG H 1 36 ARG QG . . 3.810 3.501 2.697 4.022 0.212 3 0 "[ . 1 . 2 . 3 ]" 1
568 1 36 ARG H 1 37 THR H . . 5.500 4.281 4.077 4.521 . 0 0 "[ . 1 . 2 . 3 ]" 1
569 1 36 ARG H 1 101 LEU QB . . 4.390 4.491 4.427 4.594 0.204 21 0 "[ . 1 . 2 . 3 ]" 1
570 1 36 ARG H 1 101 LEU MD1 . . 5.500 4.381 2.176 5.519 0.019 28 0 "[ . 1 . 2 . 3 ]" 1
571 1 36 ARG H 1 101 LEU QD . . 4.690 2.332 2.037 2.825 . 0 0 "[ . 1 . 2 . 3 ]" 1
572 1 36 ARG H 1 101 LEU MD2 . . 5.500 2.485 2.044 4.708 . 0 0 "[ . 1 . 2 . 3 ]" 1
573 1 36 ARG H 1 101 LEU HG . . 5.500 4.283 2.585 5.523 0.023 16 0 "[ . 1 . 2 . 3 ]" 1
574 1 36 ARG H 1 102 ASP H . . 4.160 2.729 2.152 3.109 . 0 0 "[ . 1 . 2 . 3 ]" 1
575 1 36 ARG H 1 102 ASP HB2 . . 4.880 3.139 2.692 3.786 . 0 0 "[ . 1 . 2 . 3 ]" 1
576 1 36 ARG H 1 102 ASP HB3 . . 4.090 4.065 3.751 4.168 0.078 8 0 "[ . 1 . 2 . 3 ]" 1
577 1 36 ARG H 1 103 LEU HA . . 4.800 4.077 3.657 4.408 . 0 0 "[ . 1 . 2 . 3 ]" 1
578 1 36 ARG H 1 103 LEU QD . . 5.440 4.294 3.773 4.764 . 0 0 "[ . 1 . 2 . 3 ]" 1
579 1 36 ARG HA 1 36 ARG QD . . 4.770 3.313 1.990 4.505 . 0 0 "[ . 1 . 2 . 3 ]" 1
580 1 36 ARG HA 1 37 THR H . . 3.100 2.270 2.101 2.677 . 0 0 "[ . 1 . 2 . 3 ]" 1
581 1 36 ARG HA 1 37 THR MG . . 4.330 3.465 3.133 3.758 . 0 0 "[ . 1 . 2 . 3 ]" 1
582 1 36 ARG QB 1 37 THR H . . 4.520 3.200 2.235 3.894 . 0 0 "[ . 1 . 2 . 3 ]" 1
583 1 36 ARG QG 1 37 THR H . . 5.500 3.782 2.331 4.672 . 0 0 "[ . 1 . 2 . 3 ]" 1
584 1 36 ARG QG 1 102 ASP H . . 4.930 4.050 2.939 5.046 0.116 3 0 "[ . 1 . 2 . 3 ]" 1
585 1 36 ARG QG 1 102 ASP HB2 . . 4.000 2.934 1.986 4.060 0.060 7 0 "[ . 1 . 2 . 3 ]" 1
586 1 36 ARG QG 1 102 ASP HB3 . . 4.140 3.714 2.177 4.260 0.120 3 0 "[ . 1 . 2 . 3 ]" 1
587 1 37 THR H 1 40 ALA H . . 5.500 4.448 4.004 5.018 . 0 0 "[ . 1 . 2 . 3 ]" 1
588 1 37 THR H 1 43 VAL MG1 . . 5.500 3.955 3.112 5.520 0.020 7 0 "[ . 1 . 2 . 3 ]" 1
589 1 37 THR HA 1 37 THR HG1 . . 3.750 2.509 2.278 2.775 . 0 0 "[ . 1 . 2 . 3 ]" 1
590 1 37 THR HA 1 38 PRO HD2 . . 3.290 2.367 2.200 2.584 . 0 0 "[ . 1 . 2 . 3 ]" 1
591 1 37 THR HA 1 38 PRO HD3 . . 3.030 2.691 2.458 2.932 . 0 0 "[ . 1 . 2 . 3 ]" 1
592 1 37 THR HA 1 39 VAL H . . 4.520 3.944 3.722 4.258 . 0 0 "[ . 1 . 2 . 3 ]" 1
593 1 37 THR HA 1 99 VAL MG1 . . 4.890 4.068 3.637 4.474 . 0 0 "[ . 1 . 2 . 3 ]" 1
594 1 37 THR HA 1 101 LEU MD1 . . 4.810 4.802 4.410 4.914 0.104 31 0 "[ . 1 . 2 . 3 ]" 1
595 1 37 THR HA 1 101 LEU QD . . 4.220 3.725 3.180 4.265 0.045 13 0 "[ . 1 . 2 . 3 ]" 1
596 1 37 THR HA 1 101 LEU MD2 . . 4.810 3.995 3.221 4.857 0.047 5 0 "[ . 1 . 2 . 3 ]" 1
597 1 37 THR HB 1 38 PRO HD2 . . 4.030 3.657 3.425 3.882 . 0 0 "[ . 1 . 2 . 3 ]" 1
598 1 37 THR HB 1 39 VAL H . . 4.820 4.181 3.818 4.627 . 0 0 "[ . 1 . 2 . 3 ]" 1
599 1 37 THR HB 1 40 ALA MB . . 4.980 4.610 4.313 4.884 . 0 0 "[ . 1 . 2 . 3 ]" 1
600 1 37 THR HB 1 99 VAL MG1 . . 4.090 3.212 2.807 3.653 . 0 0 "[ . 1 . 2 . 3 ]" 1
601 1 37 THR HB 1 101 LEU HA . . 3.650 3.007 2.397 3.385 . 0 0 "[ . 1 . 2 . 3 ]" 1
602 1 37 THR HB 1 101 LEU QB . . 4.760 3.470 2.196 4.260 . 0 0 "[ . 1 . 2 . 3 ]" 1
603 1 37 THR HB 1 101 LEU MD1 . . 4.280 3.239 2.508 4.245 . 0 0 "[ . 1 . 2 . 3 ]" 1
604 1 37 THR HB 1 101 LEU QD . . 3.660 2.398 2.030 2.958 . 0 0 "[ . 1 . 2 . 3 ]" 1
605 1 37 THR HB 1 101 LEU MD2 . . 4.280 2.856 2.035 4.273 . 0 0 "[ . 1 . 2 . 3 ]" 1
606 1 37 THR HB 1 102 ASP H . . 4.340 4.318 3.740 4.395 0.055 11 0 "[ . 1 . 2 . 3 ]" 1
607 1 37 THR HG1 1 38 PRO HD2 . . 3.590 2.085 1.963 2.410 . 0 0 "[ . 1 . 2 . 3 ]" 1
608 1 37 THR HG1 1 38 PRO HD3 . . 3.870 3.695 3.335 3.899 0.029 28 0 "[ . 1 . 2 . 3 ]" 1
609 1 37 THR HG1 1 39 VAL H . . 4.560 3.006 2.666 3.468 . 0 0 "[ . 1 . 2 . 3 ]" 1
610 1 37 THR HG1 1 39 VAL MG1 . . 3.610 3.273 2.791 3.632 0.022 2 0 "[ . 1 . 2 . 3 ]" 1
611 1 37 THR HG1 1 40 ALA H . . 5.500 5.110 4.622 5.506 0.006 15 0 "[ . 1 . 2 . 3 ]" 1
612 1 37 THR HG1 1 99 VAL MG1 . . 3.880 2.066 1.781 2.350 . 0 0 "[ . 1 . 2 . 3 ]" 1
613 1 37 THR HG1 1 100 GLU H . . 6.600 3.976 3.467 4.935 . 0 0 "[ . 1 . 2 . 3 ]" 1
614 1 37 THR HG1 1 101 LEU QD . . 5.260 3.572 3.108 4.050 . 0 0 "[ . 1 . 2 . 3 ]" 1
615 1 37 THR MG 1 39 VAL H . . 3.720 2.796 2.538 3.001 . 0 0 "[ . 1 . 2 . 3 ]" 1
616 1 37 THR MG 1 40 ALA H . . 3.260 2.281 1.863 2.716 . 0 0 "[ . 1 . 2 . 3 ]" 1
617 1 37 THR MG 1 101 LEU QD . . 4.900 2.929 2.603 3.488 . 0 0 "[ . 1 . 2 . 3 ]" 1
618 1 38 PRO HA 1 40 ALA H . . 4.400 3.908 3.353 4.325 . 0 0 "[ . 1 . 2 . 3 ]" 1
619 1 38 PRO HB3 1 39 VAL H . . 4.210 4.298 4.231 4.347 0.137 4 0 "[ . 1 . 2 . 3 ]" 1
620 1 38 PRO HD2 1 39 VAL H . . 4.070 2.851 2.479 3.066 . 0 0 "[ . 1 . 2 . 3 ]" 1
621 1 38 PRO HD2 1 39 VAL MG1 . . 4.290 3.357 2.834 3.582 . 0 0 "[ . 1 . 2 . 3 ]" 1
622 1 38 PRO HD2 1 99 VAL MG1 . . 5.390 3.252 2.424 3.781 . 0 0 "[ . 1 . 2 . 3 ]" 1
623 1 38 PRO HD3 1 39 VAL H . . 4.290 3.970 3.778 4.089 . 0 0 "[ . 1 . 2 . 3 ]" 1
624 1 38 PRO HD3 1 39 VAL MG1 . . 4.670 4.618 4.272 4.695 0.025 10 0 "[ . 1 . 2 . 3 ]" 1
625 1 38 PRO HD3 1 39 VAL MG2 . . 5.880 5.520 5.222 5.819 . 0 0 "[ . 1 . 2 . 3 ]" 1
626 1 38 PRO HD3 1 99 VAL MG1 . . 5.260 4.739 3.891 5.270 0.010 3 0 "[ . 1 . 2 . 3 ]" 1
627 1 38 PRO QG 1 39 VAL H . . 4.290 2.651 2.413 3.032 . 0 0 "[ . 1 . 2 . 3 ]" 1
628 1 39 VAL H 1 39 VAL HB . . 3.910 3.743 3.628 3.820 . 0 0 "[ . 1 . 2 . 3 ]" 1
629 1 39 VAL H 1 39 VAL MG1 . . 3.100 2.192 1.986 2.395 . 0 0 "[ . 1 . 2 . 3 ]" 1
630 1 39 VAL H 1 39 VAL MG2 . . 4.190 2.475 2.262 2.717 . 0 0 "[ . 1 . 2 . 3 ]" 1
631 1 39 VAL H 1 40 ALA H . . 3.510 2.874 2.617 3.114 . 0 0 "[ . 1 . 2 . 3 ]" 1
632 1 39 VAL H 1 99 VAL MG1 . . 5.530 3.640 3.174 4.173 . 0 0 "[ . 1 . 2 . 3 ]" 1
633 1 39 VAL HA 1 39 VAL MG2 . . 3.350 3.257 3.229 3.284 . 0 0 "[ . 1 . 2 . 3 ]" 1
634 1 39 VAL HA 1 90 LYS QG . . 3.970 3.823 2.936 4.019 0.049 26 0 "[ . 1 . 2 . 3 ]" 1
635 1 39 VAL HB 1 40 ALA H . . 4.890 4.500 4.248 4.609 . 0 0 "[ . 1 . 2 . 3 ]" 1
636 1 39 VAL MG1 1 100 GLU H . . 5.500 3.938 3.205 4.782 . 0 0 "[ . 1 . 2 . 3 ]" 1
637 1 39 VAL MG2 1 40 ALA H . . 4.010 3.336 2.740 3.929 . 0 0 "[ . 1 . 2 . 3 ]" 1
638 1 40 ALA H 1 41 GLU H . . 4.740 4.416 4.230 4.555 . 0 0 "[ . 1 . 2 . 3 ]" 1
639 1 40 ALA H 1 90 LYS H . . 5.340 4.070 3.093 5.169 . 0 0 "[ . 1 . 2 . 3 ]" 1
640 1 40 ALA H 1 90 LYS QD . . 5.310 3.798 2.630 5.332 0.022 27 0 "[ . 1 . 2 . 3 ]" 1
641 1 40 ALA H 1 90 LYS QE . . 5.340 4.020 3.192 5.348 0.008 16 0 "[ . 1 . 2 . 3 ]" 1
642 1 40 ALA H 1 90 LYS QG . . 5.180 3.407 2.855 4.478 . 0 0 "[ . 1 . 2 . 3 ]" 1
643 1 40 ALA HA 1 41 GLU H . . 3.490 2.347 2.170 2.695 . 0 0 "[ . 1 . 2 . 3 ]" 1
644 1 40 ALA HA 1 42 ARG H . . 5.500 4.979 4.038 5.514 0.014 22 0 "[ . 1 . 2 . 3 ]" 1
645 1 40 ALA HA 1 89 LEU HA . . 3.490 2.281 1.945 2.807 . 0 0 "[ . 1 . 2 . 3 ]" 1
646 1 40 ALA HA 1 90 LYS H . . 4.420 2.704 2.186 3.729 . 0 0 "[ . 1 . 2 . 3 ]" 1
647 1 40 ALA HA 1 90 LYS QG . . 3.910 2.911 2.324 3.921 0.011 2 0 "[ . 1 . 2 . 3 ]" 1
648 1 40 ALA MB 1 41 GLU H . . 3.690 2.471 1.928 2.932 . 0 0 "[ . 1 . 2 . 3 ]" 1
649 1 40 ALA MB 1 42 ARG H . . 4.160 3.868 2.798 4.199 0.039 3 0 "[ . 1 . 2 . 3 ]" 1
650 1 41 GLU H 1 41 GLU HB2 . . 3.190 2.644 2.239 3.151 . 0 0 "[ . 1 . 2 . 3 ]" 1
651 1 41 GLU H 1 41 GLU HB3 . . 3.190 2.619 2.168 2.795 . 0 0 "[ . 1 . 2 . 3 ]" 1
652 1 41 GLU H 1 41 GLU QG . . 4.880 4.103 3.939 4.236 . 0 0 "[ . 1 . 2 . 3 ]" 1
653 1 41 GLU H 1 88 GLY QA . . 3.630 3.411 2.781 3.678 0.048 19 0 "[ . 1 . 2 . 3 ]" 1
654 1 41 GLU H 1 89 LEU HA . . 5.450 3.783 3.239 4.514 . 0 0 "[ . 1 . 2 . 3 ]" 1
655 1 41 GLU H 1 90 LYS QG . . 4.550 3.807 3.217 4.593 0.043 29 0 "[ . 1 . 2 . 3 ]" 1
656 1 41 GLU HA 1 41 GLU QB . . 2.590 2.418 2.249 2.503 . 0 0 "[ . 1 . 2 . 3 ]" 1
657 1 41 GLU HA 1 41 GLU HG2 . . 3.740 3.603 2.512 3.768 0.028 2 0 "[ . 1 . 2 . 3 ]" 1
658 1 41 GLU HA 1 41 GLU HG3 . . 3.740 2.929 2.324 3.642 . 0 0 "[ . 1 . 2 . 3 ]" 1
659 1 41 GLU HA 1 90 LYS QE . . 3.640 2.712 1.993 3.685 0.045 22 0 "[ . 1 . 2 . 3 ]" 1
660 1 41 GLU QB 1 42 ARG H . . 3.940 2.057 1.787 2.486 . 0 0 "[ . 1 . 2 . 3 ]" 1
661 1 41 GLU QB 1 88 GLY QA . . 3.200 2.517 2.101 2.737 . 0 0 "[ . 1 . 2 . 3 ]" 1
662 1 41 GLU QG 1 42 ARG H . . 3.760 3.237 2.498 3.796 0.036 26 0 "[ . 1 . 2 . 3 ]" 1
663 1 41 GLU QG 1 88 GLY QA . . 3.990 3.942 3.462 4.089 0.099 23 0 "[ . 1 . 2 . 3 ]" 1
664 1 42 ARG H 1 42 ARG QD . . 5.160 4.448 2.430 4.959 . 0 0 "[ . 1 . 2 . 3 ]" 1
665 1 42 ARG H 1 42 ARG QG . . 4.290 3.672 2.223 4.184 . 0 0 "[ . 1 . 2 . 3 ]" 1
666 1 42 ARG H 1 43 VAL H . . 4.550 4.329 3.779 4.563 0.013 31 0 "[ . 1 . 2 . 3 ]" 1
667 1 42 ARG H 1 87 LEU H . . 4.710 3.621 3.003 4.345 . 0 0 "[ . 1 . 2 . 3 ]" 1
668 1 42 ARG H 1 87 LEU HB2 . . 4.640 3.864 2.653 4.668 0.028 23 0 "[ . 1 . 2 . 3 ]" 1
669 1 42 ARG H 1 87 LEU QB . . 4.020 3.457 2.619 3.861 . 0 0 "[ . 1 . 2 . 3 ]" 1
670 1 42 ARG H 1 87 LEU HB3 . . 4.640 4.137 3.514 4.674 0.034 10 0 "[ . 1 . 2 . 3 ]" 1
671 1 42 ARG H 1 87 LEU MD2 . . 5.500 5.162 3.878 5.546 0.046 1 0 "[ . 1 . 2 . 3 ]" 1
672 1 42 ARG H 1 88 GLY QA . . 5.340 3.763 3.429 4.349 . 0 0 "[ . 1 . 2 . 3 ]" 1
673 1 42 ARG HA 1 42 ARG QD . . 4.700 4.100 3.741 4.546 . 0 0 "[ . 1 . 2 . 3 ]" 1
674 1 42 ARG HA 1 43 VAL H . . 2.850 2.201 2.036 2.594 . 0 0 "[ . 1 . 2 . 3 ]" 1
675 1 42 ARG QB 1 42 ARG QD . . 3.200 2.244 2.043 2.873 . 0 0 "[ . 1 . 2 . 3 ]" 1
676 1 42 ARG HB2 1 42 ARG QD . . 3.860 2.755 2.173 3.564 . 0 0 "[ . 1 . 2 . 3 ]" 1
677 1 42 ARG HB3 1 42 ARG QD . . 3.860 2.445 2.149 3.031 . 0 0 "[ . 1 . 2 . 3 ]" 1
678 1 42 ARG QD 1 43 VAL H . . 5.240 4.749 3.628 5.284 0.044 9 0 "[ . 1 . 2 . 3 ]" 1
679 1 42 ARG QD 1 87 LEU MD2 . . 4.370 3.763 2.380 4.397 0.027 17 0 "[ . 1 . 2 . 3 ]" 1
680 1 42 ARG QG 1 43 VAL H . . 3.890 3.098 2.085 3.757 . 0 0 "[ . 1 . 2 . 3 ]" 1
681 1 42 ARG HG2 1 43 VAL H . . 4.660 3.460 2.111 4.537 . 0 0 "[ . 1 . 2 . 3 ]" 1
682 1 42 ARG HG3 1 43 VAL H . . 4.660 3.815 2.728 4.707 0.047 29 0 "[ . 1 . 2 . 3 ]" 1
683 1 43 VAL H 1 43 VAL HB . . 4.110 3.201 2.533 3.860 . 0 0 "[ . 1 . 2 . 3 ]" 1
684 1 43 VAL H 1 43 VAL MG1 . . 4.660 2.253 1.779 3.012 . 0 0 "[ . 1 . 2 . 3 ]" 1
685 1 43 VAL H 1 43 VAL MG2 . . 4.410 3.921 3.814 4.110 . 0 0 "[ . 1 . 2 . 3 ]" 1
686 1 43 VAL HA 1 43 VAL MG1 . . 3.390 3.257 3.211 3.289 . 0 0 "[ . 1 . 2 . 3 ]" 1
687 1 43 VAL HA 1 43 VAL MG2 . . 3.340 2.412 2.216 2.639 . 0 0 "[ . 1 . 2 . 3 ]" 1
688 1 43 VAL HA 1 44 GLU H . . 3.100 2.175 2.065 2.283 . 0 0 "[ . 1 . 2 . 3 ]" 1
689 1 43 VAL HA 1 86 LEU HA . . 3.670 2.803 2.510 3.192 . 0 0 "[ . 1 . 2 . 3 ]" 1
690 1 43 VAL HA 1 86 LEU QB . . 5.190 4.705 4.466 5.016 . 0 0 "[ . 1 . 2 . 3 ]" 1
691 1 43 VAL HA 1 86 LEU MD2 . . 4.010 3.263 2.506 4.051 0.041 28 0 "[ . 1 . 2 . 3 ]" 1
692 1 43 VAL HB 1 44 GLU H . . 4.730 4.102 3.798 4.377 . 0 0 "[ . 1 . 2 . 3 ]" 1
693 1 43 VAL MG1 1 44 GLU H . . 4.120 4.076 3.793 4.197 0.077 10 0 "[ . 1 . 2 . 3 ]" 1
694 1 43 VAL MG2 1 44 GLU H . . 3.590 2.588 2.415 3.626 0.036 10 0 "[ . 1 . 2 . 3 ]" 1
695 1 43 VAL MG2 1 84 PHE QB . . 3.520 2.379 2.019 2.970 . 0 0 "[ . 1 . 2 . 3 ]" 1
696 1 43 VAL MG2 1 84 PHE QD . . 3.750 2.582 2.204 3.096 . 0 0 "[ . 1 . 2 . 3 ]" 1
697 1 43 VAL MG2 1 84 PHE QE . . 4.650 3.523 2.719 4.072 . 0 0 "[ . 1 . 2 . 3 ]" 1
698 1 43 VAL MG2 1 84 PHE HZ . . 5.710 4.939 4.206 5.493 . 0 0 "[ . 1 . 2 . 3 ]" 1
699 1 43 VAL MG2 1 85 MET H . . 5.500 3.988 3.120 4.482 . 0 0 "[ . 1 . 2 . 3 ]" 1
700 1 43 VAL MG2 1 86 LEU HA . . 4.170 3.730 2.630 4.200 0.030 8 0 "[ . 1 . 2 . 3 ]" 1
701 1 44 GLU HA 1 44 GLU QG . . 3.290 2.533 2.342 3.311 0.021 27 0 "[ . 1 . 2 . 3 ]" 1
702 1 44 GLU HA 1 45 LEU H . . 3.270 2.329 2.142 2.458 . 0 0 "[ . 1 . 2 . 3 ]" 1
703 1 44 GLU HA 1 46 HIS HD2 . . 4.920 4.509 4.196 4.955 0.035 27 0 "[ . 1 . 2 . 3 ]" 1
704 1 44 GLU QB 1 45 LEU H . . 4.230 3.282 2.930 3.564 . 0 0 "[ . 1 . 2 . 3 ]" 1
705 1 44 GLU QB 1 46 HIS HD2 . . 3.480 2.472 2.293 3.110 . 0 0 "[ . 1 . 2 . 3 ]" 1
706 1 44 GLU HB2 1 46 HIS HD2 . . 4.060 3.156 2.706 4.077 0.017 10 0 "[ . 1 . 2 . 3 ]" 1
707 1 44 GLU HB3 1 46 HIS HD2 . . 4.060 2.615 2.344 3.823 . 0 0 "[ . 1 . 2 . 3 ]" 1
708 1 44 GLU QG 1 45 LEU H . . 4.530 4.367 4.110 4.683 0.153 27 0 "[ . 1 . 2 . 3 ]" 1
709 1 44 GLU QG 1 46 HIS HD2 . . 5.210 4.561 4.359 4.968 . 0 0 "[ . 1 . 2 . 3 ]" 1
710 1 44 GLU HG2 1 46 HIS HD2 . . 6.000 4.978 4.641 5.507 . 0 0 "[ . 1 . 2 . 3 ]" 1
711 1 44 GLU HG3 1 46 HIS HD2 . . 6.000 5.314 4.727 5.743 . 0 0 "[ . 1 . 2 . 3 ]" 1
712 1 45 LEU H 1 45 LEU HB2 . . 3.970 2.481 2.380 2.548 . 0 0 "[ . 1 . 2 . 3 ]" 1
713 1 45 LEU H 1 45 LEU QB . . 3.460 2.256 2.162 2.308 . 0 0 "[ . 1 . 2 . 3 ]" 1
714 1 45 LEU H 1 45 LEU HB3 . . 3.970 2.598 2.344 2.701 . 0 0 "[ . 1 . 2 . 3 ]" 1
715 1 45 LEU H 1 45 LEU MD1 . . 4.170 4.238 4.208 4.258 0.088 27 0 "[ . 1 . 2 . 3 ]" 1
716 1 45 LEU H 1 45 LEU MD2 . . 4.940 4.251 4.108 4.345 . 0 0 "[ . 1 . 2 . 3 ]" 1
717 1 45 LEU H 1 45 LEU HG . . 4.380 4.395 4.378 4.409 0.029 6 0 "[ . 1 . 2 . 3 ]" 1
718 1 45 LEU H 1 84 PHE QE . . 5.380 3.975 3.445 4.430 . 0 0 "[ . 1 . 2 . 3 ]" 1
719 1 45 LEU HA 1 45 LEU MD1 . . 3.880 3.444 2.279 3.558 . 0 0 "[ . 1 . 2 . 3 ]" 1
720 1 45 LEU HA 1 45 LEU HG . . 4.010 2.242 2.170 2.925 . 0 0 "[ . 1 . 2 . 3 ]" 1
721 1 45 LEU HA 1 46 HIS H . . 3.380 2.052 2.012 2.233 . 0 0 "[ . 1 . 2 . 3 ]" 1
722 1 45 LEU HA 1 46 HIS HD2 . . 5.340 3.996 3.760 4.308 . 0 0 "[ . 1 . 2 . 3 ]" 1
723 1 45 LEU HA 1 84 PHE HA . . 4.240 2.386 2.162 2.623 . 0 0 "[ . 1 . 2 . 3 ]" 1
724 1 45 LEU HA 1 84 PHE QD . . 4.100 2.640 2.354 2.905 . 0 0 "[ . 1 . 2 . 3 ]" 1
725 1 45 LEU HA 1 84 PHE QE . . 5.000 3.880 3.400 4.278 . 0 0 "[ . 1 . 2 . 3 ]" 1
726 1 45 LEU HA 1 85 MET H . . 5.200 3.474 3.188 3.736 . 0 0 "[ . 1 . 2 . 3 ]" 1
727 1 45 LEU QB 1 46 HIS HA . . 5.250 4.710 4.626 4.810 . 0 0 "[ . 1 . 2 . 3 ]" 1
728 1 45 LEU QB 1 64 VAL H . . 4.820 3.846 3.520 3.967 . 0 0 "[ . 1 . 2 . 3 ]" 1
729 1 45 LEU QB 1 84 PHE QD . . 4.320 2.925 2.622 3.141 . 0 0 "[ . 1 . 2 . 3 ]" 1
730 1 45 LEU QB 1 84 PHE QE . . 3.850 2.295 2.138 2.494 . 0 0 "[ . 1 . 2 . 3 ]" 1
731 1 45 LEU HB2 1 84 PHE QD . . 4.940 2.967 2.648 3.201 . 0 0 "[ . 1 . 2 . 3 ]" 1
732 1 45 LEU HB2 1 84 PHE QE . . 4.450 2.309 2.148 2.513 . 0 0 "[ . 1 . 2 . 3 ]" 1
733 1 45 LEU HB3 1 84 PHE QD . . 4.940 4.456 4.215 4.590 . 0 0 "[ . 1 . 2 . 3 ]" 1
734 1 45 LEU HB3 1 84 PHE QE . . 4.450 4.002 3.860 4.211 . 0 0 "[ . 1 . 2 . 3 ]" 1
735 1 45 LEU MD1 1 46 HIS H . . 4.490 4.467 3.538 4.532 0.042 13 0 "[ . 1 . 2 . 3 ]" 1
736 1 45 LEU MD1 1 66 PHE HA . . 4.440 3.871 3.320 4.473 0.033 21 0 "[ . 1 . 2 . 3 ]" 1
737 1 45 LEU MD1 1 67 LEU H . . 6.060 3.515 2.961 4.387 . 0 0 "[ . 1 . 2 . 3 ]" 1
738 1 45 LEU MD1 1 82 TYR HA . . 5.610 5.645 5.604 5.679 0.069 9 0 "[ . 1 . 2 . 3 ]" 1
739 1 45 LEU MD1 1 82 TYR QB . . 4.500 3.830 3.687 3.997 . 0 0 "[ . 1 . 2 . 3 ]" 1
740 1 45 LEU MD1 1 82 TYR QD . . 4.890 4.845 4.623 4.902 0.012 6 0 "[ . 1 . 2 . 3 ]" 1
741 1 45 LEU MD1 1 83 HIS H . . 4.690 4.697 4.336 4.730 0.040 13 0 "[ . 1 . 2 . 3 ]" 1
742 1 45 LEU MD1 1 84 PHE HA . . 5.260 4.596 3.691 4.917 . 0 0 "[ . 1 . 2 . 3 ]" 1
743 1 45 LEU MD1 1 84 PHE QD . . 4.180 3.560 3.123 3.736 . 0 0 "[ . 1 . 2 . 3 ]" 1
744 1 45 LEU MD1 1 84 PHE QE . . 4.170 2.418 2.169 2.693 . 0 0 "[ . 1 . 2 . 3 ]" 1
745 1 45 LEU MD1 1 84 PHE HZ . . 4.800 2.646 2.203 2.798 . 0 0 "[ . 1 . 2 . 3 ]" 1
746 1 45 LEU MD2 1 46 HIS H . . 5.160 3.063 2.824 4.967 . 0 0 "[ . 1 . 2 . 3 ]" 1
747 1 45 LEU MD2 1 64 VAL H . . 6.070 3.672 3.506 3.958 . 0 0 "[ . 1 . 2 . 3 ]" 1
748 1 45 LEU MD2 1 66 PHE H . . 5.180 4.263 3.207 4.532 . 0 0 "[ . 1 . 2 . 3 ]" 1
749 1 45 LEU MD2 1 66 PHE HA . . 3.980 3.860 2.296 4.013 0.033 17 0 "[ . 1 . 2 . 3 ]" 1
750 1 45 LEU MD2 1 67 LEU H . . 4.860 3.834 2.796 4.708 . 0 0 "[ . 1 . 2 . 3 ]" 1
751 1 45 LEU MD2 1 67 LEU QB . . 5.180 2.910 2.581 3.929 . 0 0 "[ . 1 . 2 . 3 ]" 1
752 1 45 LEU MD2 1 82 TYR QD . . 5.460 3.091 2.802 5.034 . 0 0 "[ . 1 . 2 . 3 ]" 1
753 1 45 LEU MD2 1 82 TYR QE . . 5.850 4.648 4.338 5.877 0.027 21 0 "[ . 1 . 2 . 3 ]" 1
754 1 45 LEU MD2 1 84 PHE QD . . 4.770 4.805 4.781 4.854 0.084 21 0 "[ . 1 . 2 . 3 ]" 1
755 1 45 LEU MD2 1 84 PHE QE . . 4.670 4.543 3.536 4.669 . 0 0 "[ . 1 . 2 . 3 ]" 1
756 1 45 LEU MD2 1 84 PHE HZ . . 5.320 5.276 3.875 5.372 0.052 31 0 "[ . 1 . 2 . 3 ]" 1
757 1 45 LEU HG 1 84 PHE HZ . . 5.050 4.750 4.330 5.154 0.104 21 0 "[ . 1 . 2 . 3 ]" 1
758 1 46 HIS H 1 46 HIS HB2 . . 4.160 2.408 2.325 2.467 . 0 0 "[ . 1 . 2 . 3 ]" 1
759 1 46 HIS H 1 46 HIS HD2 . . 4.800 3.371 3.215 3.540 . 0 0 "[ . 1 . 2 . 3 ]" 1
760 1 46 HIS H 1 82 TYR HA . . 6.370 4.968 4.662 5.290 . 0 0 "[ . 1 . 2 . 3 ]" 1
761 1 46 HIS H 1 83 HIS H . . 4.850 3.157 2.880 3.360 . 0 0 "[ . 1 . 2 . 3 ]" 1
762 1 46 HIS H 1 83 HIS HD2 . . 5.950 4.587 4.060 5.094 . 0 0 "[ . 1 . 2 . 3 ]" 1
763 1 46 HIS H 1 84 PHE HA . . 4.510 3.048 2.724 3.392 . 0 0 "[ . 1 . 2 . 3 ]" 1
764 1 46 HIS H 1 84 PHE QD . . 5.090 4.420 4.066 4.818 . 0 0 "[ . 1 . 2 . 3 ]" 1
765 1 46 HIS HA 1 46 HIS HD2 . . 4.020 2.872 2.694 3.139 . 0 0 "[ . 1 . 2 . 3 ]" 1
766 1 46 HIS HA 1 47 GLU H . . 3.270 2.208 2.125 2.302 . 0 0 "[ . 1 . 2 . 3 ]" 1
767 1 46 HIS HA 1 62 ARG H . . 4.540 4.113 3.862 4.281 . 0 0 "[ . 1 . 2 . 3 ]" 1
768 1 46 HIS HA 1 63 PRO HB2 . . 4.630 4.670 4.625 4.700 0.070 29 0 "[ . 1 . 2 . 3 ]" 1
769 1 46 HIS HA 1 64 VAL H . . 3.750 2.927 2.752 3.126 . 0 0 "[ . 1 . 2 . 3 ]" 1
770 1 46 HIS HA 1 64 VAL MG2 . . 4.340 2.832 2.506 3.216 . 0 0 "[ . 1 . 2 . 3 ]" 1
771 1 46 HIS HA 1 83 HIS HE1 . . 6.600 5.891 5.216 6.641 0.041 24 0 "[ . 1 . 2 . 3 ]" 1
772 1 46 HIS HB2 1 47 GLU H . . 3.830 3.865 3.848 3.899 0.069 1 0 "[ . 1 . 2 . 3 ]" 1
773 1 46 HIS HB2 1 83 HIS H . . 4.950 3.742 3.361 3.980 . 0 0 "[ . 1 . 2 . 3 ]" 1
774 1 46 HIS HB2 1 83 HIS HD2 . . 4.670 3.498 2.879 3.919 . 0 0 "[ . 1 . 2 . 3 ]" 1
775 1 46 HIS HB2 1 83 HIS HE1 . . 4.510 3.820 3.330 4.578 0.068 6 0 "[ . 1 . 2 . 3 ]" 1
776 1 46 HIS HB3 1 47 GLU H . . 4.550 2.599 2.531 2.683 . 0 0 "[ . 1 . 2 . 3 ]" 1
777 1 46 HIS HB3 1 61 MET HA . . 6.090 4.352 4.034 4.730 . 0 0 "[ . 1 . 2 . 3 ]" 1
778 1 46 HIS HB3 1 62 ARG H . . 5.200 2.906 2.435 3.580 . 0 0 "[ . 1 . 2 . 3 ]" 1
779 1 46 HIS HB3 1 83 HIS H . . 4.600 4.565 4.342 4.643 0.043 17 0 "[ . 1 . 2 . 3 ]" 1
780 1 46 HIS HB3 1 83 HIS HD2 . . 5.240 4.890 4.316 5.267 0.027 1 0 "[ . 1 . 2 . 3 ]" 1
781 1 46 HIS HD2 1 47 GLU H . . 5.500 4.915 4.767 5.153 . 0 0 "[ . 1 . 2 . 3 ]" 1
782 1 46 HIS HD2 1 62 ARG H . . 5.960 5.770 5.328 5.981 0.021 21 0 "[ . 1 . 2 . 3 ]" 1
783 1 46 HIS HD2 1 62 ARG HA . . 6.600 5.578 5.279 5.917 . 0 0 "[ . 1 . 2 . 3 ]" 1
784 1 46 HIS HD2 1 63 PRO QD . . 5.520 3.950 3.615 4.428 . 0 0 "[ . 1 . 2 . 3 ]" 1
785 1 46 HIS HD2 1 63 PRO HG2 . . 4.750 4.894 4.873 4.933 0.183 27 0 "[ . 1 . 2 . 3 ]" 1
786 1 46 HIS HD2 1 63 PRO QG . . 4.090 3.830 3.537 3.994 . 0 0 "[ . 1 . 2 . 3 ]" 1
787 1 46 HIS HD2 1 63 PRO HG3 . . 4.750 4.010 3.629 4.230 . 0 0 "[ . 1 . 2 . 3 ]" 1
788 1 46 HIS HD2 1 64 VAL H . . 4.840 3.837 3.641 4.103 . 0 0 "[ . 1 . 2 . 3 ]" 1
789 1 46 HIS HD2 1 64 VAL MG2 . . 5.550 4.721 4.376 4.951 . 0 0 "[ . 1 . 2 . 3 ]" 1
790 1 46 HIS HD2 1 85 MET H . . 4.560 4.099 3.439 4.543 . 0 0 "[ . 1 . 2 . 3 ]" 1
791 1 46 HIS HD2 1 85 MET HB2 . . 5.550 3.666 3.123 4.392 . 0 0 "[ . 1 . 2 . 3 ]" 1
792 1 46 HIS HD2 1 85 MET QB . . 4.730 3.559 3.078 3.917 . 0 0 "[ . 1 . 2 . 3 ]" 1
793 1 46 HIS HD2 1 85 MET HB3 . . 5.550 5.049 3.920 5.560 0.010 27 0 "[ . 1 . 2 . 3 ]" 1
794 1 46 HIS HE1 1 63 PRO HB3 . . 4.600 4.612 4.584 4.630 0.030 8 0 "[ . 1 . 2 . 3 ]" 1
795 1 46 HIS HE1 1 63 PRO QD . . 4.610 2.921 2.697 3.153 . 0 0 "[ . 1 . 2 . 3 ]" 1
796 1 46 HIS HE1 1 63 PRO QG . . 4.330 3.923 3.194 4.339 0.009 21 0 "[ . 1 . 2 . 3 ]" 1
797 1 46 HIS HE1 1 85 MET QB . . 4.820 3.869 3.371 4.513 . 0 0 "[ . 1 . 2 . 3 ]" 1
798 1 47 GLU H 1 47 GLU QB . . 3.400 2.921 2.568 3.072 . 0 0 "[ . 1 . 2 . 3 ]" 1
799 1 47 GLU H 1 47 GLU HG2 . . 4.760 2.340 2.046 3.753 . 0 0 "[ . 1 . 2 . 3 ]" 1
800 1 47 GLU H 1 47 GLU QG . . 3.930 2.193 1.997 2.626 . 0 0 "[ . 1 . 2 . 3 ]" 1
801 1 47 GLU H 1 47 GLU HG3 . . 4.760 2.853 2.269 3.972 . 0 0 "[ . 1 . 2 . 3 ]" 1
802 1 47 GLU H 1 48 THR H . . 5.100 4.476 4.284 4.563 . 0 0 "[ . 1 . 2 . 3 ]" 1
803 1 47 GLU H 1 61 MET HA . . 5.450 4.462 4.203 4.785 . 0 0 "[ . 1 . 2 . 3 ]" 1
804 1 47 GLU H 1 62 ARG H . . 4.500 2.843 2.614 3.103 . 0 0 "[ . 1 . 2 . 3 ]" 1
805 1 47 GLU H 1 64 VAL MG2 . . 4.590 3.246 2.730 3.619 . 0 0 "[ . 1 . 2 . 3 ]" 1
806 1 47 GLU H 1 82 TYR QD . . 6.160 4.557 4.319 4.751 . 0 0 "[ . 1 . 2 . 3 ]" 1
807 1 47 GLU H 1 83 HIS HE1 . . 5.900 5.161 4.370 5.883 . 0 0 "[ . 1 . 2 . 3 ]" 1
808 1 47 GLU HA 1 48 THR H . . 3.290 2.481 2.249 2.783 . 0 0 "[ . 1 . 2 . 3 ]" 1
809 1 47 GLU HA 1 82 TYR H . . 5.790 4.763 4.342 5.387 . 0 0 "[ . 1 . 2 . 3 ]" 1
810 1 47 GLU HA 1 82 TYR HA . . 3.450 2.258 1.955 2.911 . 0 0 "[ . 1 . 2 . 3 ]" 1
811 1 47 GLU HA 1 82 TYR QD . . 3.980 2.452 2.186 2.825 . 0 0 "[ . 1 . 2 . 3 ]" 1
812 1 47 GLU HA 1 82 TYR QE . . 4.810 3.738 3.167 4.347 . 0 0 "[ . 1 . 2 . 3 ]" 1
813 1 47 GLU HA 1 83 HIS H . . 4.600 3.789 3.427 4.433 . 0 0 "[ . 1 . 2 . 3 ]" 1
814 1 47 GLU HA 1 83 HIS HE1 . . 5.610 5.166 4.243 5.628 0.018 30 0 "[ . 1 . 2 . 3 ]" 1
815 1 47 GLU QB 1 48 THR H . . 3.640 2.268 1.741 2.982 . 0 0 "[ . 1 . 2 . 3 ]" 1
816 1 47 GLU QB 1 82 TYR HA . . 4.750 3.977 3.489 4.674 . 0 0 "[ . 1 . 2 . 3 ]" 1
817 1 47 GLU QB 1 82 TYR QD . . 3.870 2.670 2.250 3.255 . 0 0 "[ . 1 . 2 . 3 ]" 1
818 1 47 GLU HB2 1 82 TYR QD . . 4.410 3.500 3.025 4.086 . 0 0 "[ . 1 . 2 . 3 ]" 1
819 1 47 GLU HB2 1 82 TYR QE . . 3.990 3.011 2.401 3.806 . 0 0 "[ . 1 . 2 . 3 ]" 1
820 1 47 GLU HB3 1 82 TYR QD . . 4.410 2.789 2.293 3.805 . 0 0 "[ . 1 . 2 . 3 ]" 1
821 1 47 GLU HB3 1 82 TYR QE . . 3.990 2.741 2.397 3.532 . 0 0 "[ . 1 . 2 . 3 ]" 1
822 1 47 GLU QG 1 48 THR H . . 5.270 3.441 3.010 4.335 . 0 0 "[ . 1 . 2 . 3 ]" 1
823 1 47 GLU QG 1 49 PHE QD . . 5.180 2.608 2.125 4.251 . 0 0 "[ . 1 . 2 . 3 ]" 1
824 1 47 GLU QG 1 82 TYR QD . . 4.950 4.552 4.091 4.959 0.009 16 0 "[ . 1 . 2 . 3 ]" 1
825 1 47 GLU QG 1 82 TYR QE . . 4.620 4.473 3.753 4.660 0.040 6 0 "[ . 1 . 2 . 3 ]" 1
826 1 48 THR H 1 48 THR HB . . 3.450 2.862 2.686 3.050 . 0 0 "[ . 1 . 2 . 3 ]" 1
827 1 48 THR H 1 48 THR MG . . 4.470 3.969 3.916 4.040 . 0 0 "[ . 1 . 2 . 3 ]" 1
828 1 48 THR H 1 49 PHE H . . 4.790 3.937 3.316 4.493 . 0 0 "[ . 1 . 2 . 3 ]" 1
829 1 48 THR H 1 82 TYR HA . . 4.360 3.727 2.931 4.148 . 0 0 "[ . 1 . 2 . 3 ]" 1
830 1 48 THR H 1 82 TYR QD . . 5.360 4.180 3.857 4.413 . 0 0 "[ . 1 . 2 . 3 ]" 1
831 1 48 THR H 1 82 TYR QE . . 5.190 4.352 3.786 5.149 . 0 0 "[ . 1 . 2 . 3 ]" 1
832 1 48 THR H 1 83 HIS H . . 5.980 5.679 4.764 6.019 0.039 20 0 "[ . 1 . 2 . 3 ]" 1
833 1 48 THR H 1 83 HIS HE1 . . 6.210 5.344 4.482 5.977 . 0 0 "[ . 1 . 2 . 3 ]" 1
834 1 48 THR HA 1 48 THR MG . . 3.530 2.340 2.226 2.435 . 0 0 "[ . 1 . 2 . 3 ]" 1
835 1 48 THR HA 1 49 PHE H . . 3.190 2.162 2.052 2.428 . 0 0 "[ . 1 . 2 . 3 ]" 1
836 1 48 THR HA 1 49 PHE QD . . 4.390 3.574 2.863 4.071 . 0 0 "[ . 1 . 2 . 3 ]" 1
837 1 48 THR HA 1 49 PHE QE . . 6.100 4.855 3.932 5.294 . 0 0 "[ . 1 . 2 . 3 ]" 1
838 1 48 THR HA 1 60 GLY H . . 4.950 4.376 3.848 4.868 . 0 0 "[ . 1 . 2 . 3 ]" 1
839 1 48 THR HA 1 61 MET HA . . 3.430 2.428 2.226 2.726 . 0 0 "[ . 1 . 2 . 3 ]" 1
840 1 48 THR HA 1 61 MET QB . . 4.800 3.978 2.055 4.353 . 0 0 "[ . 1 . 2 . 3 ]" 1
841 1 48 THR HA 1 61 MET ME . . 4.690 4.033 3.684 4.523 . 0 0 "[ . 1 . 2 . 3 ]" 1
842 1 48 THR HA 1 61 MET HG2 . . 4.650 4.196 2.423 4.735 0.085 9 0 "[ . 1 . 2 . 3 ]" 1
843 1 48 THR HA 1 61 MET QG . . 3.850 2.784 2.280 3.952 0.102 9 0 "[ . 1 . 2 . 3 ]" 1
844 1 48 THR HA 1 61 MET HG3 . . 4.650 2.967 2.299 4.233 . 0 0 "[ . 1 . 2 . 3 ]" 1
845 1 48 THR HA 1 62 ARG H . . 5.140 4.114 3.848 4.325 . 0 0 "[ . 1 . 2 . 3 ]" 1
846 1 48 THR HA 1 83 HIS HE1 . . 4.910 4.430 3.526 4.924 0.014 31 0 "[ . 1 . 2 . 3 ]" 1
847 1 48 THR HB 1 49 PHE H . . 4.440 4.304 3.649 4.461 0.021 22 0 "[ . 1 . 2 . 3 ]" 1
848 1 48 THR HB 1 61 MET ME . . 5.500 4.220 3.856 5.039 . 0 0 "[ . 1 . 2 . 3 ]" 1
849 1 48 THR HB 1 82 TYR H . . 6.070 4.620 3.972 5.371 . 0 0 "[ . 1 . 2 . 3 ]" 1
850 1 48 THR HB 1 83 HIS HE1 . . 5.930 4.896 4.410 5.943 0.013 29 0 "[ . 1 . 2 . 3 ]" 1
851 1 48 THR MG 1 49 PHE H . . 3.680 3.084 2.312 3.700 0.020 2 0 "[ . 1 . 2 . 3 ]" 1
852 1 48 THR MG 1 59 MET QG . . 4.680 3.578 2.102 4.721 0.041 9 0 "[ . 1 . 2 . 3 ]" 1
853 1 48 THR MG 1 60 GLY H . . 5.090 3.566 2.926 4.418 . 0 0 "[ . 1 . 2 . 3 ]" 1
854 1 48 THR MG 1 61 MET HA . . 4.970 3.688 3.292 4.002 . 0 0 "[ . 1 . 2 . 3 ]" 1
855 1 48 THR MG 1 61 MET HG2 . . 4.720 3.673 2.361 4.760 0.040 9 0 "[ . 1 . 2 . 3 ]" 1
856 1 48 THR MG 1 61 MET HG3 . . 4.720 2.661 2.191 3.843 . 0 0 "[ . 1 . 2 . 3 ]" 1
857 1 48 THR MG 1 80 GLY HA3 . . 4.250 3.819 3.109 4.264 0.014 26 0 "[ . 1 . 2 . 3 ]" 1
858 1 48 THR MG 1 83 HIS HE1 . . 5.360 4.175 3.253 5.124 . 0 0 "[ . 1 . 2 . 3 ]" 1
859 1 49 PHE H 1 49 PHE QD . . 3.890 2.557 2.024 3.212 . 0 0 "[ . 1 . 2 . 3 ]" 1
860 1 49 PHE H 1 49 PHE QE . . 5.240 4.089 3.803 4.464 . 0 0 "[ . 1 . 2 . 3 ]" 1
861 1 49 PHE H 1 60 GLY H . . 3.850 3.180 2.783 3.860 0.010 2 0 "[ . 1 . 2 . 3 ]" 1
862 1 49 PHE H 1 61 MET HA . . 4.470 3.448 2.981 3.820 . 0 0 "[ . 1 . 2 . 3 ]" 1
863 1 49 PHE HA 1 49 PHE QD . . 3.930 3.779 3.748 3.805 . 0 0 "[ . 1 . 2 . 3 ]" 1
864 1 49 PHE HA 1 50 MET H . . 2.880 2.303 2.134 2.561 . 0 0 "[ . 1 . 2 . 3 ]" 1
865 1 49 PHE HB2 1 50 MET H . . 3.640 2.543 2.070 2.846 . 0 0 "[ . 1 . 2 . 3 ]" 1
866 1 49 PHE HB3 1 50 MET H . . 3.880 3.807 3.576 3.914 0.034 2 0 "[ . 1 . 2 . 3 ]" 1
867 1 49 PHE QD 1 50 MET H . . 4.350 3.489 2.708 3.800 . 0 0 "[ . 1 . 2 . 3 ]" 1
868 1 49 PHE QD 1 50 MET HA . . 5.220 3.549 2.606 4.629 . 0 0 "[ . 1 . 2 . 3 ]" 1
869 1 49 PHE QD 1 51 ARG H . . 5.320 3.684 1.859 4.924 . 0 0 "[ . 1 . 2 . 3 ]" 1
870 1 49 PHE QD 1 51 ARG HA . . 6.600 4.443 4.054 4.946 . 0 0 "[ . 1 . 2 . 3 ]" 1
871 1 49 PHE QD 1 51 ARG QB . . 3.690 2.616 2.068 3.557 . 0 0 "[ . 1 . 2 . 3 ]" 1
872 1 49 PHE QD 1 59 MET HA . . 6.050 4.342 3.302 5.200 . 0 0 "[ . 1 . 2 . 3 ]" 1
873 1 49 PHE QD 1 60 GLY H . . 5.150 3.736 3.271 4.224 . 0 0 "[ . 1 . 2 . 3 ]" 1
874 1 49 PHE QD 1 60 GLY HA3 . . 6.450 4.325 3.912 4.869 . 0 0 "[ . 1 . 2 . 3 ]" 1
875 1 49 PHE QD 1 61 MET H . . 5.600 5.004 4.099 5.571 . 0 0 "[ . 1 . 2 . 3 ]" 1
876 1 49 PHE QD 1 61 MET HA . . 4.170 3.480 2.806 4.178 0.008 2 0 "[ . 1 . 2 . 3 ]" 1
877 1 49 PHE QD 1 62 ARG H . . 4.710 4.060 3.348 4.712 0.002 20 0 "[ . 1 . 2 . 3 ]" 1
878 1 49 PHE QD 1 62 ARG QD . . 5.310 4.049 2.514 5.318 0.008 7 0 "[ . 1 . 2 . 3 ]" 1
879 1 49 PHE QD 1 62 ARG QG . . 5.210 3.895 2.147 5.208 . 0 0 "[ . 1 . 2 . 3 ]" 1
880 1 49 PHE QE 1 50 MET H . . 5.880 5.690 4.996 5.934 0.054 24 0 "[ . 1 . 2 . 3 ]" 1
881 1 49 PHE QE 1 50 MET HA . . 6.320 5.031 3.988 6.049 . 0 0 "[ . 1 . 2 . 3 ]" 1
882 1 49 PHE QE 1 51 ARG H . . 6.030 4.635 3.376 5.869 . 0 0 "[ . 1 . 2 . 3 ]" 1
883 1 49 PHE QE 1 51 ARG HA . . 5.870 5.391 4.512 5.886 0.016 12 0 "[ . 1 . 2 . 3 ]" 1
884 1 49 PHE QE 1 51 ARG QB . . 4.130 2.729 2.281 3.369 . 0 0 "[ . 1 . 2 . 3 ]" 1
885 1 49 PHE QE 1 51 ARG QD . . 4.880 3.171 2.099 3.851 . 0 0 "[ . 1 . 2 . 3 ]" 1
886 1 49 PHE QE 1 60 GLY H . . 5.660 4.008 3.487 4.693 . 0 0 "[ . 1 . 2 . 3 ]" 1
887 1 49 PHE QE 1 60 GLY HA3 . . 6.310 3.282 2.822 4.051 . 0 0 "[ . 1 . 2 . 3 ]" 1
888 1 49 PHE QE 1 61 MET H . . 4.600 3.849 3.024 4.611 0.011 2 0 "[ . 1 . 2 . 3 ]" 1
889 1 49 PHE QE 1 61 MET HA . . 4.670 3.566 2.526 4.313 . 0 0 "[ . 1 . 2 . 3 ]" 1
890 1 49 PHE QE 1 62 ARG H . . 4.910 3.929 2.974 4.678 . 0 0 "[ . 1 . 2 . 3 ]" 1
891 1 49 PHE QE 1 62 ARG HA . . 4.890 4.441 4.103 4.905 0.015 2 0 "[ . 1 . 2 . 3 ]" 1
892 1 49 PHE QE 1 62 ARG QB . . 5.150 2.628 2.088 4.151 . 0 0 "[ . 1 . 2 . 3 ]" 1
893 1 49 PHE QE 1 62 ARG HD2 . . 4.710 4.003 2.514 4.752 0.042 29 0 "[ . 1 . 2 . 3 ]" 1
894 1 49 PHE QE 1 62 ARG HD3 . . 4.710 3.632 2.451 4.729 0.019 10 0 "[ . 1 . 2 . 3 ]" 1
895 1 49 PHE QE 1 62 ARG HG2 . . 4.690 3.690 2.130 4.717 0.027 22 0 "[ . 1 . 2 . 3 ]" 1
896 1 49 PHE QE 1 62 ARG QG . . 4.050 2.577 2.050 3.414 . 0 0 "[ . 1 . 2 . 3 ]" 1
897 1 49 PHE QE 1 62 ARG HG3 . . 4.690 2.961 2.064 4.133 . 0 0 "[ . 1 . 2 . 3 ]" 1
898 1 49 PHE HZ 1 51 ARG QB . . 5.120 4.841 4.311 5.160 0.040 28 0 "[ . 1 . 2 . 3 ]" 1
899 1 49 PHE HZ 1 51 ARG QD . . 5.250 4.535 2.945 5.277 0.027 19 0 "[ . 1 . 2 . 3 ]" 1
900 1 49 PHE HZ 1 60 GLY H . . 6.390 4.840 4.032 5.528 . 0 0 "[ . 1 . 2 . 3 ]" 1
901 1 49 PHE HZ 1 60 GLY HA3 . . 5.800 3.131 2.577 4.143 . 0 0 "[ . 1 . 2 . 3 ]" 1
902 1 49 PHE HZ 1 61 MET H . . 5.700 4.510 3.497 5.540 . 0 0 "[ . 1 . 2 . 3 ]" 1
903 1 49 PHE HZ 1 61 MET HA . . 6.430 5.447 3.994 6.230 . 0 0 "[ . 1 . 2 . 3 ]" 1
904 1 49 PHE HZ 1 62 ARG HA . . 6.390 6.276 5.378 6.445 0.055 16 0 "[ . 1 . 2 . 3 ]" 1
905 1 49 PHE HZ 1 62 ARG QD . . 5.410 4.183 2.828 5.464 0.054 28 0 "[ . 1 . 2 . 3 ]" 1
906 1 49 PHE HZ 1 62 ARG HG2 . . 6.270 5.197 3.449 6.302 0.032 27 0 "[ . 1 . 2 . 3 ]" 1
907 1 49 PHE HZ 1 62 ARG QG . . 5.530 4.012 2.645 4.688 . 0 0 "[ . 1 . 2 . 3 ]" 1
908 1 49 PHE HZ 1 62 ARG HG3 . . 6.270 4.519 2.672 6.295 0.025 4 0 "[ . 1 . 2 . 3 ]" 1
909 1 50 MET H 1 50 MET ME . . 4.510 4.078 2.448 4.539 0.029 24 0 "[ . 1 . 2 . 3 ]" 1
910 1 50 MET H 1 50 MET QG . . 3.760 2.716 2.016 3.838 0.078 22 0 "[ . 1 . 2 . 3 ]" 1
911 1 50 MET HA 1 50 MET QG . . 3.540 2.966 2.155 3.527 . 0 0 "[ . 1 . 2 . 3 ]" 1
912 1 50 MET HA 1 51 ARG H . . 2.740 2.251 1.995 2.668 . 0 0 "[ . 1 . 2 . 3 ]" 1
913 1 50 MET HA 1 59 MET HA . . 3.140 2.490 2.146 3.135 . 0 0 "[ . 1 . 2 . 3 ]" 1
914 1 50 MET HA 1 60 GLY H . . 4.240 3.851 3.269 4.250 0.010 24 0 "[ . 1 . 2 . 3 ]" 1
915 1 50 MET QB 1 51 ARG H . . 4.090 2.981 2.323 3.895 . 0 0 "[ . 1 . 2 . 3 ]" 1
916 1 50 MET QG 1 51 ARG H . . 4.170 3.854 2.544 4.266 0.096 24 0 "[ . 1 . 2 . 3 ]" 1
917 1 51 ARG H 1 51 ARG QB . . 3.550 2.819 2.268 3.378 . 0 0 "[ . 1 . 2 . 3 ]" 1
918 1 51 ARG H 1 51 ARG QD . . 4.750 4.505 3.343 4.834 0.084 19 0 "[ . 1 . 2 . 3 ]" 1
919 1 51 ARG H 1 51 ARG QG . . 4.480 3.731 2.521 4.463 . 0 0 "[ . 1 . 2 . 3 ]" 1
920 1 51 ARG H 1 58 VAL H . . 3.880 3.136 2.759 3.911 0.031 24 0 "[ . 1 . 2 . 3 ]" 1
921 1 51 ARG H 1 59 MET HA . . 4.410 3.669 2.560 4.359 . 0 0 "[ . 1 . 2 . 3 ]" 1
922 1 51 ARG HA 1 51 ARG QG . . 3.720 2.521 2.097 3.403 . 0 0 "[ . 1 . 2 . 3 ]" 1
923 1 51 ARG HA 1 52 GLU H . . 2.790 2.318 2.103 2.673 . 0 0 "[ . 1 . 2 . 3 ]" 1
924 1 51 ARG QB 1 51 ARG QD . . 3.310 2.205 2.049 2.395 . 0 0 "[ . 1 . 2 . 3 ]" 1
925 1 51 ARG QB 1 52 GLU H . . 3.890 2.944 2.289 3.684 . 0 0 "[ . 1 . 2 . 3 ]" 1
926 1 51 ARG QD 1 52 GLU H . . 6.290 4.371 3.411 5.790 . 0 0 "[ . 1 . 2 . 3 ]" 1
927 1 51 ARG QG 1 52 GLU H . . 4.990 3.010 1.899 4.551 . 0 0 "[ . 1 . 2 . 3 ]" 1
928 1 52 GLU H 1 52 GLU QB . . 3.340 2.304 2.058 2.834 . 0 0 "[ . 1 . 2 . 3 ]" 1
929 1 52 GLU H 1 53 VAL H . . 4.720 4.487 4.174 4.627 . 0 0 "[ . 1 . 2 . 3 ]" 1
930 1 52 GLU H 1 53 VAL QG . . 5.440 4.627 3.902 5.451 0.011 5 0 "[ . 1 . 2 . 3 ]" 1
931 1 52 GLU HA 1 52 GLU HG2 . . 3.540 3.378 2.333 3.679 0.139 17 0 "[ . 1 . 2 . 3 ]" 1
932 1 52 GLU HA 1 52 GLU QG . . 2.850 2.414 2.121 3.159 0.309 13 0 "[ . 1 . 2 . 3 ]" 1
933 1 52 GLU HA 1 52 GLU HG3 . . 3.540 2.641 2.175 3.767 0.227 13 0 "[ . 1 . 2 . 3 ]" 1
934 1 52 GLU HA 1 53 VAL H . . 2.570 2.202 2.067 2.640 0.070 11 0 "[ . 1 . 2 . 3 ]" 1
935 1 52 GLU HA 1 53 VAL QG . . 4.220 3.587 3.116 3.994 . 0 0 "[ . 1 . 2 . 3 ]" 1
936 1 52 GLU HA 1 56 LYS H . . 4.650 4.646 4.090 4.726 0.076 5 0 "[ . 1 . 2 . 3 ]" 1
937 1 52 GLU HA 1 57 LYS HA . . 2.980 2.516 2.099 3.013 0.033 5 0 "[ . 1 . 2 . 3 ]" 1
938 1 52 GLU HA 1 58 VAL H . . 4.100 3.341 2.636 3.983 . 0 0 "[ . 1 . 2 . 3 ]" 1
939 1 52 GLU QB 1 53 VAL H . . 4.170 2.934 2.078 3.535 . 0 0 "[ . 1 . 2 . 3 ]" 1
940 1 52 GLU QB 1 55 GLY QA . . 3.670 3.440 2.556 3.874 0.204 11 0 "[ . 1 . 2 . 3 ]" 1
941 1 52 GLU QG 1 53 VAL H . . 3.800 3.224 2.136 3.917 0.117 13 0 "[ . 1 . 2 . 3 ]" 1
942 1 52 GLU HG2 1 53 VAL H . . 4.570 4.306 2.152 4.705 0.135 25 0 "[ . 1 . 2 . 3 ]" 1
943 1 52 GLU HG3 1 53 VAL H . . 4.570 3.474 2.591 4.597 0.027 23 0 "[ . 1 . 2 . 3 ]" 1
944 1 53 VAL H 1 53 VAL HB . . 3.320 3.045 2.702 3.398 0.078 24 0 "[ . 1 . 2 . 3 ]" 1
945 1 53 VAL H 1 53 VAL QG . . 3.870 2.756 2.199 3.258 . 0 0 "[ . 1 . 2 . 3 ]" 1
946 1 53 VAL H 1 56 LYS H . . 3.820 3.298 2.593 3.890 0.070 11 0 "[ . 1 . 2 . 3 ]" 1
947 1 53 VAL HA 1 53 VAL MG1 . . 3.110 2.657 2.225 3.204 0.094 13 0 "[ . 1 . 2 . 3 ]" 1
948 1 53 VAL HA 1 53 VAL MG2 . . 3.110 2.423 2.248 2.692 . 0 0 "[ . 1 . 2 . 3 ]" 1
949 1 53 VAL HA 1 54 GLU H . . 3.310 3.006 2.147 3.440 0.130 29 0 "[ . 1 . 2 . 3 ]" 1
950 1 53 VAL QG 1 54 GLU H . . 5.000 2.448 1.570 3.238 . 0 0 "[ . 1 . 2 . 3 ]" 1
951 1 53 VAL QG 1 54 GLU HA . . 4.410 3.842 3.508 4.258 . 0 0 "[ . 1 . 2 . 3 ]" 1
952 1 53 VAL QG 1 56 LYS H . . 5.240 4.355 3.554 5.153 . 0 0 "[ . 1 . 2 . 3 ]" 1
953 1 53 VAL MG1 1 54 GLU H . . 6.010 2.650 1.587 3.933 . 0 0 "[ . 1 . 2 . 3 ]" 1
954 1 53 VAL MG2 1 54 GLU H . . 6.010 3.644 2.495 4.332 . 0 0 "[ . 1 . 2 . 3 ]" 1
955 1 54 GLU H 1 54 GLU QG . . 4.150 3.566 1.990 4.222 0.072 6 0 "[ . 1 . 2 . 3 ]" 1
956 1 54 GLU H 1 55 GLY H . . 5.210 3.047 2.047 3.774 . 0 0 "[ . 1 . 2 . 3 ]" 1
957 1 54 GLU HA 1 54 GLU QB . . 2.510 2.376 2.141 2.487 . 0 0 "[ . 1 . 2 . 3 ]" 1
958 1 54 GLU HA 1 54 GLU HG2 . . 3.810 2.871 2.256 3.833 0.023 26 0 "[ . 1 . 2 . 3 ]" 1
959 1 54 GLU HA 1 54 GLU QG . . 3.220 2.546 2.227 3.285 0.065 26 0 "[ . 1 . 2 . 3 ]" 1
960 1 54 GLU HA 1 54 GLU HG3 . . 3.810 3.048 2.533 3.599 . 0 0 "[ . 1 . 2 . 3 ]" 1
961 1 54 GLU HA 1 55 GLY H . . 3.280 2.845 2.281 3.256 . 0 0 "[ . 1 . 2 . 3 ]" 1
962 1 54 GLU HA 1 56 LYS H . . 4.970 4.205 3.836 4.796 . 0 0 "[ . 1 . 2 . 3 ]" 1
963 1 54 GLU QB 1 55 GLY H . . 4.410 3.871 3.521 4.110 . 0 0 "[ . 1 . 2 . 3 ]" 1
964 1 54 GLU HB2 1 55 GLY H . . 5.020 4.444 3.697 4.658 . 0 0 "[ . 1 . 2 . 3 ]" 1
965 1 54 GLU HB2 1 56 LYS H . . 5.410 4.137 2.484 5.292 . 0 0 "[ . 1 . 2 . 3 ]" 1
966 1 54 GLU HB3 1 55 GLY H . . 5.020 4.299 3.827 4.725 . 0 0 "[ . 1 . 2 . 3 ]" 1
967 1 54 GLU HB3 1 56 LYS H . . 5.410 3.598 2.630 5.272 . 0 0 "[ . 1 . 2 . 3 ]" 1
968 1 55 GLY H 1 56 LYS H . . 3.500 2.918 2.439 3.403 . 0 0 "[ . 1 . 2 . 3 ]" 1
969 1 55 GLY QA 1 56 LYS QG . . 5.010 4.071 3.252 5.064 0.054 29 0 "[ . 1 . 2 . 3 ]" 1
970 1 56 LYS H 1 56 LYS HB2 . . 3.500 2.615 2.046 3.606 0.106 14 0 "[ . 1 . 2 . 3 ]" 1
971 1 56 LYS H 1 56 LYS HB3 . . 3.500 3.353 2.424 3.641 0.141 23 0 "[ . 1 . 2 . 3 ]" 1
972 1 56 LYS H 1 56 LYS QE . . 5.500 3.807 2.899 5.223 . 0 0 "[ . 1 . 2 . 3 ]" 1
973 1 56 LYS H 1 56 LYS QG . . 3.620 2.479 1.864 3.630 0.010 29 0 "[ . 1 . 2 . 3 ]" 1
974 1 56 LYS H 1 57 LYS H . . 4.840 4.555 4.255 4.653 . 0 0 "[ . 1 . 2 . 3 ]" 1
975 1 56 LYS HA 1 56 LYS QB . . 2.470 2.338 2.157 2.535 0.065 29 0 "[ . 1 . 2 . 3 ]" 1
976 1 56 LYS HA 1 56 LYS QE . . 5.830 4.521 4.061 5.495 . 0 0 "[ . 1 . 2 . 3 ]" 1
977 1 56 LYS HA 1 57 LYS H . . 2.590 2.235 2.143 2.371 . 0 0 "[ . 1 . 2 . 3 ]" 1
978 1 56 LYS HA 1 57 LYS QG . . 5.540 4.077 2.948 5.635 0.095 16 0 "[ . 1 . 2 . 3 ]" 1
979 1 56 LYS QB 1 57 LYS H . . 3.110 2.967 2.536 3.150 0.040 2 0 "[ . 1 . 2 . 3 ]" 1
980 1 56 LYS QG 1 57 LYS H . . 5.350 4.074 2.588 4.804 . 0 0 "[ . 1 . 2 . 3 ]" 1
981 1 57 LYS H 1 57 LYS QB . . 3.600 2.577 1.946 3.080 . 0 0 "[ . 1 . 2 . 3 ]" 1
982 1 57 LYS H 1 57 LYS HG2 . . 4.270 2.996 1.745 4.319 0.049 5 0 "[ . 1 . 2 . 3 ]" 1
983 1 57 LYS H 1 57 LYS QG . . 3.690 2.487 1.739 3.792 0.102 16 0 "[ . 1 . 2 . 3 ]" 1
984 1 57 LYS H 1 57 LYS HG3 . . 4.270 3.077 2.141 4.233 . 0 0 "[ . 1 . 2 . 3 ]" 1
985 1 57 LYS H 1 58 VAL H . . 5.080 4.547 4.257 4.660 . 0 0 "[ . 1 . 2 . 3 ]" 1
986 1 57 LYS H 1 58 VAL QG . . 5.440 4.319 3.560 5.383 . 0 0 "[ . 1 . 2 . 3 ]" 1
987 1 57 LYS HA 1 57 LYS QE . . 4.070 3.800 2.587 4.194 0.124 6 0 "[ . 1 . 2 . 3 ]" 1
988 1 57 LYS HA 1 57 LYS QG . . 3.600 2.945 2.076 3.554 . 0 0 "[ . 1 . 2 . 3 ]" 1
989 1 57 LYS HA 1 58 VAL H . . 2.700 2.180 2.089 2.264 . 0 0 "[ . 1 . 2 . 3 ]" 1
990 1 57 LYS QB 1 58 VAL H . . 3.910 3.210 2.667 3.851 . 0 0 "[ . 1 . 2 . 3 ]" 1
991 1 57 LYS HB2 1 58 VAL H . . 4.470 3.826 2.728 4.484 0.014 13 0 "[ . 1 . 2 . 3 ]" 1
992 1 57 LYS HB3 1 58 VAL H . . 4.470 3.659 2.881 4.483 0.013 9 0 "[ . 1 . 2 . 3 ]" 1
993 1 57 LYS QE 1 57 LYS QG . . 3.430 2.480 2.014 2.954 . 0 0 "[ . 1 . 2 . 3 ]" 1
994 1 58 VAL H 1 58 VAL HB . . 3.380 2.804 2.420 3.414 0.034 5 0 "[ . 1 . 2 . 3 ]" 1
995 1 58 VAL H 1 58 VAL QG . . 3.330 2.741 2.096 2.943 . 0 0 "[ . 1 . 2 . 3 ]" 1
996 1 58 VAL H 1 59 MET H . . 4.790 4.462 4.355 4.634 . 0 0 "[ . 1 . 2 . 3 ]" 1
997 1 58 VAL HA 1 58 VAL HB . . 3.010 2.954 2.451 3.040 0.030 15 0 "[ . 1 . 2 . 3 ]" 1
998 1 58 VAL HA 1 58 VAL QG . . 2.930 2.180 2.134 2.301 . 0 0 "[ . 1 . 2 . 3 ]" 1
999 1 58 VAL HA 1 59 MET H . . 2.580 2.317 2.188 2.625 0.045 5 0 "[ . 1 . 2 . 3 ]" 1
1000 1 58 VAL HA 1 59 MET HA . . 6.130 4.496 4.329 4.610 . 0 0 "[ . 1 . 2 . 3 ]" 1
1001 1 58 VAL QG 1 59 MET H . . 3.650 2.222 1.730 2.612 . 0 0 "[ . 1 . 2 . 3 ]" 1
1002 1 58 VAL QG 1 60 GLY H . . 5.440 4.475 3.546 5.375 . 0 0 "[ . 1 . 2 . 3 ]" 1
1003 1 58 VAL MG1 1 59 MET H . . 4.480 2.425 1.732 3.765 . 0 0 "[ . 1 . 2 . 3 ]" 1
1004 1 58 VAL MG2 1 59 MET H . . 4.480 3.719 2.131 4.115 . 0 0 "[ . 1 . 2 . 3 ]" 1
1005 1 59 MET H 1 59 MET QB . . 3.300 2.533 2.218 3.130 . 0 0 "[ . 1 . 2 . 3 ]" 1
1006 1 59 MET H 1 59 MET ME . . 4.400 3.599 2.155 4.435 0.035 25 0 "[ . 1 . 2 . 3 ]" 1
1007 1 59 MET H 1 59 MET QG . . 4.680 3.189 1.990 4.296 . 0 0 "[ . 1 . 2 . 3 ]" 1
1008 1 59 MET HA 1 59 MET ME . . 4.070 3.904 2.130 4.149 0.079 30 0 "[ . 1 . 2 . 3 ]" 1
1009 1 59 MET HA 1 60 GLY H . . 2.900 2.277 2.126 2.587 . 0 0 "[ . 1 . 2 . 3 ]" 1
1010 1 59 MET QB 1 60 GLY H . . 3.910 2.960 2.149 3.736 . 0 0 "[ . 1 . 2 . 3 ]" 1
1011 1 59 MET QG 1 60 GLY H . . 4.830 3.582 2.147 4.676 . 0 0 "[ . 1 . 2 . 3 ]" 1
1012 1 60 GLY H 1 61 MET H . . 4.760 4.383 3.228 4.580 . 0 0 "[ . 1 . 2 . 3 ]" 1
1013 1 60 GLY H 1 61 MET HA . . 5.500 4.855 4.640 5.265 . 0 0 "[ . 1 . 2 . 3 ]" 1
1014 1 60 GLY HA3 1 61 MET H . . 3.320 2.760 2.458 3.508 0.188 2 0 "[ . 1 . 2 . 3 ]" 1
1015 1 61 MET H 1 61 MET QB . . 3.550 2.582 2.360 3.218 . 0 0 "[ . 1 . 2 . 3 ]" 1
1016 1 61 MET H 1 61 MET HG2 . . 4.580 4.278 3.415 4.586 0.006 29 0 "[ . 1 . 2 . 3 ]" 1
1017 1 61 MET H 1 61 MET HG3 . . 4.580 3.714 3.174 4.498 . 0 0 "[ . 1 . 2 . 3 ]" 1
1018 1 61 MET HA 1 61 MET HG2 . . 4.110 3.465 2.499 3.697 . 0 0 "[ . 1 . 2 . 3 ]" 1
1019 1 61 MET HA 1 61 MET QG . . 3.540 2.452 2.289 3.408 . 0 0 "[ . 1 . 2 . 3 ]" 1
1020 1 61 MET HA 1 61 MET HG3 . . 4.110 2.595 2.317 4.132 0.022 9 0 "[ . 1 . 2 . 3 ]" 1
1021 1 61 MET HA 1 62 ARG H . . 3.300 2.312 2.133 2.477 . 0 0 "[ . 1 . 2 . 3 ]" 1
1022 1 61 MET HA 1 62 ARG HA . . 6.020 4.565 4.430 4.678 . 0 0 "[ . 1 . 2 . 3 ]" 1
1023 1 61 MET HA 1 62 ARG QG . . 5.340 4.478 3.450 5.348 0.008 22 0 "[ . 1 . 2 . 3 ]" 1
1024 1 61 MET HA 1 83 HIS HE1 . . 5.230 4.279 3.440 4.776 . 0 0 "[ . 1 . 2 . 3 ]" 1
1025 1 61 MET QB 1 83 HIS HE1 . . 4.430 2.970 2.178 4.042 . 0 0 "[ . 1 . 2 . 3 ]" 1
1026 1 61 MET HB2 1 62 ARG H . . 4.530 3.772 2.542 4.309 . 0 0 "[ . 1 . 2 . 3 ]" 1
1027 1 61 MET HB3 1 62 ARG H . . 4.530 2.695 2.382 3.928 . 0 0 "[ . 1 . 2 . 3 ]" 1
1028 1 61 MET ME 1 61 MET HG2 . . 3.540 2.475 2.303 3.325 . 0 0 "[ . 1 . 2 . 3 ]" 1
1029 1 61 MET ME 1 61 MET QG . . 3.100 2.175 2.140 2.233 . 0 0 "[ . 1 . 2 . 3 ]" 1
1030 1 61 MET ME 1 61 MET HG3 . . 3.540 2.440 2.269 2.660 . 0 0 "[ . 1 . 2 . 3 ]" 1
1031 1 61 MET ME 1 83 HIS HE1 . . 4.420 3.443 2.298 4.438 0.018 30 0 "[ . 1 . 2 . 3 ]" 1
1032 1 61 MET QG 1 62 ARG H . . 4.820 3.862 3.367 4.145 . 0 0 "[ . 1 . 2 . 3 ]" 1
1033 1 61 MET HG2 1 62 ARG H . . 5.500 4.582 3.531 5.299 . 0 0 "[ . 1 . 2 . 3 ]" 1
1034 1 61 MET HG2 1 83 HIS HE1 . . 4.030 2.493 2.133 3.731 . 0 0 "[ . 1 . 2 . 3 ]" 1
1035 1 61 MET HG3 1 62 ARG H . . 5.500 4.260 3.760 4.904 . 0 0 "[ . 1 . 2 . 3 ]" 1
1036 1 61 MET HG3 1 83 HIS HE1 . . 4.030 2.936 2.199 4.041 0.011 23 0 "[ . 1 . 2 . 3 ]" 1
1037 1 62 ARG H 1 62 ARG QG . . 4.320 3.586 2.518 4.259 . 0 0 "[ . 1 . 2 . 3 ]" 1
1038 1 62 ARG H 1 63 PRO QD . . 5.480 4.253 4.020 4.408 . 0 0 "[ . 1 . 2 . 3 ]" 1
1039 1 62 ARG HA 1 63 PRO QD . . 2.890 2.174 2.069 2.238 . 0 0 "[ . 1 . 2 . 3 ]" 1
1040 1 62 ARG QB 1 62 ARG QD . . 3.110 2.303 2.036 2.908 . 0 0 "[ . 1 . 2 . 3 ]" 1
1041 1 63 PRO HB2 1 64 VAL H . . 4.200 3.094 2.951 3.261 . 0 0 "[ . 1 . 2 . 3 ]" 1
1042 1 63 PRO QG 1 64 VAL H . . 4.550 4.532 4.410 4.585 0.035 26 0 "[ . 1 . 2 . 3 ]" 1
1043 1 64 VAL H 1 64 VAL MG1 . . 4.320 3.320 3.107 3.599 . 0 0 "[ . 1 . 2 . 3 ]" 1
1044 1 64 VAL H 1 64 VAL MG2 . . 3.720 2.220 2.074 2.359 . 0 0 "[ . 1 . 2 . 3 ]" 1
1045 1 64 VAL H 1 65 PRO QD . . 5.010 4.457 4.356 4.488 . 0 0 "[ . 1 . 2 . 3 ]" 1
1046 1 64 VAL HA 1 64 VAL MG1 . . 3.450 2.228 2.182 2.263 . 0 0 "[ . 1 . 2 . 3 ]" 1
1047 1 64 VAL HA 1 64 VAL MG2 . . 3.570 3.257 3.197 3.274 . 0 0 "[ . 1 . 2 . 3 ]" 1
1048 1 64 VAL HA 1 65 PRO QD . . 2.720 2.208 2.119 2.248 . 0 0 "[ . 1 . 2 . 3 ]" 1
1049 1 64 VAL HA 1 66 PHE H . . 4.780 4.115 3.920 4.390 . 0 0 "[ . 1 . 2 . 3 ]" 1
1050 1 64 VAL HB 1 65 PRO HD2 . . 4.910 2.184 2.111 2.447 . 0 0 "[ . 1 . 2 . 3 ]" 1
1051 1 64 VAL HB 1 65 PRO QD . . 4.150 2.167 2.097 2.416 . 0 0 "[ . 1 . 2 . 3 ]" 1
1052 1 64 VAL HB 1 65 PRO HD3 . . 4.910 3.620 3.555 3.738 . 0 0 "[ . 1 . 2 . 3 ]" 1
1053 1 64 VAL HB 1 66 PHE H . . 3.760 2.325 2.107 2.625 . 0 0 "[ . 1 . 2 . 3 ]" 1
1054 1 64 VAL MG1 1 65 PRO QD . . 4.580 2.595 2.201 2.804 . 0 0 "[ . 1 . 2 . 3 ]" 1
1055 1 64 VAL MG1 1 66 PHE H . . 3.980 3.984 3.825 4.010 0.030 24 0 "[ . 1 . 2 . 3 ]" 1
1056 1 64 VAL MG1 1 82 TYR QD . . 4.660 4.283 3.445 4.669 0.009 29 0 "[ . 1 . 2 . 3 ]" 1
1057 1 64 VAL MG1 1 82 TYR QE . . 4.160 3.817 2.894 4.165 0.005 6 0 "[ . 1 . 2 . 3 ]" 1
1058 1 64 VAL MG2 1 65 PRO HD2 . . 5.440 3.856 3.798 4.052 . 0 0 "[ . 1 . 2 . 3 ]" 1
1059 1 64 VAL MG2 1 65 PRO QD . . 4.590 3.699 3.656 3.843 . 0 0 "[ . 1 . 2 . 3 ]" 1
1060 1 64 VAL MG2 1 65 PRO HD3 . . 5.440 4.762 4.707 4.800 . 0 0 "[ . 1 . 2 . 3 ]" 1
1061 1 64 VAL MG2 1 66 PHE H . . 4.420 2.997 2.680 3.812 . 0 0 "[ . 1 . 2 . 3 ]" 1
1062 1 64 VAL MG2 1 82 TYR QD . . 4.300 3.377 2.745 3.651 . 0 0 "[ . 1 . 2 . 3 ]" 1
1063 1 64 VAL MG2 1 82 TYR QE . . 4.040 3.969 3.229 4.064 0.024 12 0 "[ . 1 . 2 . 3 ]" 1
1064 1 65 PRO HA 1 66 PHE QD . . 4.570 4.459 4.294 4.575 0.005 9 0 "[ . 1 . 2 . 3 ]" 1
1065 1 65 PRO QB 1 66 PHE H . . 4.070 3.631 3.448 3.762 . 0 0 "[ . 1 . 2 . 3 ]" 1
1066 1 65 PRO QB 1 66 PHE QD . . 4.400 2.490 2.371 2.645 . 0 0 "[ . 1 . 2 . 3 ]" 1
1067 1 65 PRO QB 1 66 PHE QE . . 4.830 3.586 3.367 4.108 . 0 0 "[ . 1 . 2 . 3 ]" 1
1068 1 65 PRO HB2 1 66 PHE QE . . 5.500 3.668 3.433 4.251 . 0 0 "[ . 1 . 2 . 3 ]" 1
1069 1 65 PRO HB3 1 66 PHE QE . . 5.500 5.068 4.765 5.443 . 0 0 "[ . 1 . 2 . 3 ]" 1
1070 1 65 PRO QD 1 66 PHE H . . 4.350 2.817 2.719 2.936 . 0 0 "[ . 1 . 2 . 3 ]" 1
1071 1 65 PRO QD 1 66 PHE QD . . 5.280 4.665 4.184 5.216 . 0 0 "[ . 1 . 2 . 3 ]" 1
1072 1 65 PRO QD 1 66 PHE QE . . 6.370 5.079 4.469 5.938 . 0 0 "[ . 1 . 2 . 3 ]" 1
1073 1 65 PRO HD2 1 66 PHE H . . 5.050 2.876 2.768 3.008 . 0 0 "[ . 1 . 2 . 3 ]" 1
1074 1 65 PRO HD3 1 66 PHE H . . 5.050 4.031 3.959 4.102 . 0 0 "[ . 1 . 2 . 3 ]" 1
1075 1 65 PRO QG 1 66 PHE H . . 4.290 2.774 2.498 3.047 . 0 0 "[ . 1 . 2 . 3 ]" 1
1076 1 65 PRO QG 1 66 PHE QD . . 5.370 2.989 2.288 3.790 . 0 0 "[ . 1 . 2 . 3 ]" 1
1077 1 65 PRO QG 1 66 PHE QE . . 5.370 3.264 2.683 4.211 . 0 0 "[ . 1 . 2 . 3 ]" 1
1078 1 65 PRO HG2 1 66 PHE H . . 5.170 2.808 2.520 3.097 . 0 0 "[ . 1 . 2 . 3 ]" 1
1079 1 65 PRO HG3 1 66 PHE H . . 5.170 4.314 4.096 4.533 . 0 0 "[ . 1 . 2 . 3 ]" 1
1080 1 66 PHE H 1 66 PHE QD . . 4.400 3.655 3.414 3.929 . 0 0 "[ . 1 . 2 . 3 ]" 1
1081 1 66 PHE H 1 66 PHE QE . . 5.500 4.996 4.720 5.362 . 0 0 "[ . 1 . 2 . 3 ]" 1
1082 1 66 PHE H 1 67 LEU H . . 4.590 4.236 4.038 4.302 . 0 0 "[ . 1 . 2 . 3 ]" 1
1083 1 66 PHE H 1 67 LEU HG . . 5.470 5.518 5.479 5.610 0.140 21 0 "[ . 1 . 2 . 3 ]" 1
1084 1 66 PHE HA 1 66 PHE QD . . 3.980 3.783 3.773 3.810 . 0 0 "[ . 1 . 2 . 3 ]" 1
1085 1 66 PHE HA 1 66 PHE QE . . 5.720 5.727 5.650 5.744 0.024 27 0 "[ . 1 . 2 . 3 ]" 1
1086 1 66 PHE HA 1 67 LEU H . . 3.010 2.303 2.212 2.396 . 0 0 "[ . 1 . 2 . 3 ]" 1
1087 1 66 PHE QB 1 67 LEU H . . 3.220 2.273 2.082 2.516 . 0 0 "[ . 1 . 2 . 3 ]" 1
1088 1 66 PHE HB2 1 67 LEU H . . 3.730 2.298 2.099 2.557 . 0 0 "[ . 1 . 2 . 3 ]" 1
1089 1 66 PHE HB3 1 67 LEU H . . 3.730 3.614 3.473 3.760 0.030 21 0 "[ . 1 . 2 . 3 ]" 1
1090 1 66 PHE QD 1 67 LEU H . . 4.190 3.349 2.968 3.655 . 0 0 "[ . 1 . 2 . 3 ]" 1
1091 1 66 PHE QD 1 67 LEU HA . . 3.890 3.078 2.777 3.561 . 0 0 "[ . 1 . 2 . 3 ]" 1
1092 1 66 PHE QD 1 67 LEU MD1 . . 6.150 5.986 4.428 6.114 . 0 0 "[ . 1 . 2 . 3 ]" 1
1093 1 66 PHE QD 1 67 LEU MD2 . . 6.600 4.652 4.286 6.132 . 0 0 "[ . 1 . 2 . 3 ]" 1
1094 1 66 PHE QD 1 68 GLU H . . 4.380 4.195 4.029 4.343 . 0 0 "[ . 1 . 2 . 3 ]" 1
1095 1 66 PHE QD 1 68 GLU QB . . 4.050 2.972 2.609 3.361 . 0 0 "[ . 1 . 2 . 3 ]" 1
1096 1 66 PHE QD 1 68 GLU QG . . 4.630 4.010 3.636 4.586 . 0 0 "[ . 1 . 2 . 3 ]" 1
1097 1 66 PHE QE 1 67 LEU H . . 6.600 5.606 5.175 5.831 . 0 0 "[ . 1 . 2 . 3 ]" 1
1098 1 66 PHE QE 1 67 LEU HA . . 5.100 4.707 3.933 5.103 0.003 21 0 "[ . 1 . 2 . 3 ]" 1
1099 1 66 PHE QE 1 68 GLU H . . 5.500 5.397 5.097 5.506 0.006 18 0 "[ . 1 . 2 . 3 ]" 1
1100 1 66 PHE QE 1 68 GLU QB . . 4.050 3.654 3.107 4.060 0.010 9 0 "[ . 1 . 2 . 3 ]" 1
1101 1 66 PHE QE 1 68 GLU QG . . 4.810 3.780 3.300 4.380 . 0 0 "[ . 1 . 2 . 3 ]" 1
1102 1 67 LEU H 1 67 LEU HB2 . . 4.000 2.558 2.407 3.910 . 0 0 "[ . 1 . 2 . 3 ]" 1
1103 1 67 LEU H 1 67 LEU HB3 . . 4.000 3.449 3.314 3.647 . 0 0 "[ . 1 . 2 . 3 ]" 1
1104 1 67 LEU H 1 67 LEU MD1 . . 4.690 4.377 3.136 4.569 . 0 0 "[ . 1 . 2 . 3 ]" 1
1105 1 67 LEU H 1 67 LEU MD2 . . 5.800 4.346 3.896 4.419 . 0 0 "[ . 1 . 2 . 3 ]" 1
1106 1 67 LEU HA 1 67 LEU MD1 . . 4.000 3.756 2.153 3.941 . 0 0 "[ . 1 . 2 . 3 ]" 1
1107 1 67 LEU HA 1 67 LEU MD2 . . 3.910 2.193 2.049 3.905 . 0 0 "[ . 1 . 2 . 3 ]" 1
1108 1 67 LEU HA 1 68 GLU H . . 3.090 2.567 2.151 2.652 . 0 0 "[ . 1 . 2 . 3 ]" 1
1109 1 67 LEU HA 1 68 GLU QG . . 4.880 4.303 3.966 4.915 0.035 21 0 "[ . 1 . 2 . 3 ]" 1
1110 1 67 LEU HA 1 82 TYR QE . . 6.030 5.463 5.099 5.973 . 0 0 "[ . 1 . 2 . 3 ]" 1
1111 1 67 LEU HB2 1 68 GLU H . . 4.080 3.870 2.201 4.139 0.059 21 0 "[ . 1 . 2 . 3 ]" 1
1112 1 67 LEU HB3 1 68 GLU H . . 4.080 2.556 2.221 3.564 . 0 0 "[ . 1 . 2 . 3 ]" 1
1113 1 67 LEU MD1 1 68 GLU H . . 3.810 3.813 3.258 3.907 0.097 21 0 "[ . 1 . 2 . 3 ]" 1
1114 1 67 LEU MD1 1 82 TYR QB . . 4.330 2.317 2.069 4.342 0.012 21 0 "[ . 1 . 2 . 3 ]" 1
1115 1 67 LEU MD1 1 82 TYR QD . . 4.400 2.943 2.753 4.176 . 0 0 "[ . 1 . 2 . 3 ]" 1
1116 1 67 LEU MD1 1 82 TYR QE . . 4.480 3.930 3.000 4.506 0.026 17 0 "[ . 1 . 2 . 3 ]" 1
1117 1 67 LEU MD1 1 84 PHE QE . . 6.600 5.404 4.999 6.322 . 0 0 "[ . 1 . 2 . 3 ]" 1
1118 1 67 LEU MD2 1 68 GLU H . . 4.870 2.420 2.004 4.810 . 0 0 "[ . 1 . 2 . 3 ]" 1
1119 1 67 LEU MD2 1 82 TYR H . . 6.460 6.338 5.537 6.482 0.022 10 0 "[ . 1 . 2 . 3 ]" 1
1120 1 67 LEU MD2 1 82 TYR HB2 . . 4.920 4.267 3.250 4.518 . 0 0 "[ . 1 . 2 . 3 ]" 1
1121 1 67 LEU MD2 1 82 TYR QB . . 4.080 3.616 2.544 3.872 . 0 0 "[ . 1 . 2 . 3 ]" 1
1122 1 67 LEU MD2 1 82 TYR HB3 . . 4.920 3.914 2.647 4.278 . 0 0 "[ . 1 . 2 . 3 ]" 1
1123 1 67 LEU MD2 1 82 TYR QD . . 4.260 3.144 2.356 3.413 . 0 0 "[ . 1 . 2 . 3 ]" 1
1124 1 67 LEU MD2 1 82 TYR QE . . 4.670 3.039 2.805 3.343 . 0 0 "[ . 1 . 2 . 3 ]" 1
1125 1 67 LEU HG 1 82 TYR QD . . 5.490 3.375 2.999 5.326 . 0 0 "[ . 1 . 2 . 3 ]" 1
1126 1 67 LEU HG 1 82 TYR QE . . 5.800 4.162 3.803 5.805 0.005 17 0 "[ . 1 . 2 . 3 ]" 1
1127 1 68 GLU H 1 68 GLU QB . . 3.380 3.237 2.887 3.315 . 0 0 "[ . 1 . 2 . 3 ]" 1
1128 1 68 GLU H 1 68 GLU HG2 . . 4.180 3.087 2.647 3.635 . 0 0 "[ . 1 . 2 . 3 ]" 1
1129 1 68 GLU H 1 68 GLU QG . . 3.500 2.977 2.572 3.433 . 0 0 "[ . 1 . 2 . 3 ]" 1
1130 1 68 GLU H 1 68 GLU HG3 . . 4.180 3.929 3.493 4.220 0.040 21 0 "[ . 1 . 2 . 3 ]" 1
1131 1 68 GLU H 1 69 VAL H . . 5.210 4.358 4.288 4.463 . 0 0 "[ . 1 . 2 . 3 ]" 1
1132 1 68 GLU HA 1 68 GLU HG2 . . 3.880 3.850 3.762 3.948 0.068 13 0 "[ . 1 . 2 . 3 ]" 1
1133 1 68 GLU HA 1 68 GLU HG3 . . 3.880 3.734 3.370 3.845 . 0 0 "[ . 1 . 2 . 3 ]" 1
1134 1 68 GLU HA 1 69 VAL H . . 2.880 2.350 2.225 2.461 . 0 0 "[ . 1 . 2 . 3 ]" 1
1135 1 68 GLU QB 1 69 VAL H . . 4.060 2.342 2.221 2.688 . 0 0 "[ . 1 . 2 . 3 ]" 1
1136 1 68 GLU HB2 1 69 VAL H . . 4.870 2.365 2.240 2.734 . 0 0 "[ . 1 . 2 . 3 ]" 1
1137 1 68 GLU HB3 1 69 VAL H . . 4.870 3.785 3.678 3.965 . 0 0 "[ . 1 . 2 . 3 ]" 1
1138 1 68 GLU QG 1 69 VAL H . . 3.870 3.128 2.521 3.389 . 0 0 "[ . 1 . 2 . 3 ]" 1
1139 1 68 GLU QG 1 69 VAL HA . . 3.830 3.876 3.843 3.902 0.072 3 0 "[ . 1 . 2 . 3 ]" 1
1140 1 68 GLU HG2 1 69 VAL H . . 4.440 4.341 4.008 4.468 0.028 19 0 "[ . 1 . 2 . 3 ]" 1
1141 1 68 GLU HG3 1 69 VAL H . . 4.440 3.210 2.547 3.518 . 0 0 "[ . 1 . 2 . 3 ]" 1
1142 1 69 VAL H 1 69 VAL HB . . 3.820 2.926 2.712 3.077 . 0 0 "[ . 1 . 2 . 3 ]" 1
1143 1 69 VAL H 1 69 VAL MG2 . . 3.810 2.824 2.587 3.051 . 0 0 "[ . 1 . 2 . 3 ]" 1
1144 1 69 VAL H 1 70 PRO HD2 . . 6.190 4.884 4.811 4.929 . 0 0 "[ . 1 . 2 . 3 ]" 1
1145 1 69 VAL H 1 70 PRO QD . . 5.360 4.250 4.155 4.323 . 0 0 "[ . 1 . 2 . 3 ]" 1
1146 1 69 VAL H 1 70 PRO HD3 . . 6.190 4.676 4.501 4.850 . 0 0 "[ . 1 . 2 . 3 ]" 1
1147 1 69 VAL HA 1 69 VAL MG1 . . 3.010 2.374 2.292 2.480 . 0 0 "[ . 1 . 2 . 3 ]" 1
1148 1 69 VAL HA 1 70 PRO HD2 . . 3.150 2.256 2.176 2.335 . 0 0 "[ . 1 . 2 . 3 ]" 1
1149 1 69 VAL HA 1 70 PRO QD . . 2.700 2.092 2.052 2.128 . 0 0 "[ . 1 . 2 . 3 ]" 1
1150 1 69 VAL HA 1 70 PRO HD3 . . 3.150 2.483 2.389 2.618 . 0 0 "[ . 1 . 2 . 3 ]" 1
1151 1 69 VAL MG1 1 70 PRO QD . . 3.520 2.157 1.984 2.326 . 0 0 "[ . 1 . 2 . 3 ]" 1
1152 1 69 VAL MG1 1 73 GLY H . . 5.190 3.535 3.328 3.759 . 0 0 "[ . 1 . 2 . 3 ]" 1
1153 1 69 VAL MG1 1 74 ARG HA . . 4.190 3.369 2.159 4.202 0.012 13 0 "[ . 1 . 2 . 3 ]" 1
1154 1 69 VAL MG2 1 70 PRO HD2 . . 5.660 3.985 3.798 4.190 . 0 0 "[ . 1 . 2 . 3 ]" 1
1155 1 69 VAL MG2 1 70 PRO QD . . 4.840 3.776 3.608 3.955 . 0 0 "[ . 1 . 2 . 3 ]" 1
1156 1 69 VAL MG2 1 70 PRO HD3 . . 5.660 4.683 4.477 4.927 . 0 0 "[ . 1 . 2 . 3 ]" 1
1157 1 70 PRO HA 1 71 PRO HD2 . . 3.190 2.466 2.386 2.561 . 0 0 "[ . 1 . 2 . 3 ]" 1
1158 1 70 PRO HA 1 71 PRO HD3 . . 3.300 2.468 2.367 2.567 . 0 0 "[ . 1 . 2 . 3 ]" 1
1159 1 70 PRO QB 1 71 PRO HD2 . . 4.040 2.185 2.126 2.257 . 0 0 "[ . 1 . 2 . 3 ]" 1
1160 1 70 PRO QB 1 71 PRO HD3 . . 3.420 3.445 3.416 3.464 0.044 9 0 "[ . 1 . 2 . 3 ]" 1
1161 1 70 PRO HD2 1 75 VAL MG1 . . 4.890 3.528 2.720 4.199 . 0 0 "[ . 1 . 2 . 3 ]" 1
1162 1 70 PRO HD3 1 75 VAL MG1 . . 4.890 4.481 3.642 4.900 0.010 29 0 "[ . 1 . 2 . 3 ]" 1
1163 1 71 PRO HA 1 72 LYS H . . 2.910 2.178 2.101 2.299 . 0 0 "[ . 1 . 2 . 3 ]" 1
1164 1 71 PRO HA 1 73 GLY H . . 3.970 3.330 3.109 3.560 . 0 0 "[ . 1 . 2 . 3 ]" 1
1165 1 71 PRO HB3 1 72 LYS H . . 4.400 3.670 3.549 3.859 . 0 0 "[ . 1 . 2 . 3 ]" 1
1166 1 72 LYS H 1 72 LYS QD . . 4.340 2.699 2.144 3.382 . 0 0 "[ . 1 . 2 . 3 ]" 1
1167 1 72 LYS H 1 72 LYS QE . . 5.500 3.868 2.619 4.788 . 0 0 "[ . 1 . 2 . 3 ]" 1
1168 1 72 LYS H 1 72 LYS QG . . 3.770 3.121 2.694 3.882 0.112 7 0 "[ . 1 . 2 . 3 ]" 1
1169 1 72 LYS H 1 73 GLY H . . 3.650 2.782 2.663 2.952 . 0 0 "[ . 1 . 2 . 3 ]" 1
1170 1 72 LYS HA 1 72 LYS QD . . 3.270 2.263 2.136 2.427 . 0 0 "[ . 1 . 2 . 3 ]" 1
1171 1 72 LYS HA 1 72 LYS QE . . 5.680 3.979 3.030 4.444 . 0 0 "[ . 1 . 2 . 3 ]" 1
1172 1 72 LYS HA 1 72 LYS QG . . 3.520 2.965 2.209 3.245 . 0 0 "[ . 1 . 2 . 3 ]" 1
1173 1 72 LYS QB 1 72 LYS QD . . 2.980 2.568 2.325 2.947 . 0 0 "[ . 1 . 2 . 3 ]" 1
1174 1 72 LYS QB 1 73 GLY H . . 4.110 3.504 3.403 3.641 . 0 0 "[ . 1 . 2 . 3 ]" 1
1175 1 72 LYS QD 1 73 GLY H . . 5.410 4.715 4.241 5.069 . 0 0 "[ . 1 . 2 . 3 ]" 1
1176 1 72 LYS QE 1 72 LYS QG . . 3.410 2.219 2.076 2.599 . 0 0 "[ . 1 . 2 . 3 ]" 1
1177 1 72 LYS HG2 1 73 GLY H . . 5.500 4.753 4.462 5.744 0.244 12 0 "[ . 1 . 2 . 3 ]" 1
1178 1 72 LYS HG3 1 73 GLY H . . 5.500 5.494 4.825 5.611 0.111 3 0 "[ . 1 . 2 . 3 ]" 1
1179 1 73 GLY H 1 74 ARG H . . 4.220 4.329 4.292 4.390 0.170 17 0 "[ . 1 . 2 . 3 ]" 1
1180 1 73 GLY QA 1 74 ARG H . . 2.790 2.019 1.939 2.180 . 0 0 "[ . 1 . 2 . 3 ]" 1
1181 1 73 GLY QA 1 74 ARG HA . . 3.950 3.980 3.891 4.033 0.083 21 0 "[ . 1 . 2 . 3 ]" 1
1182 1 73 GLY HA3 1 74 ARG H . . 3.190 2.949 2.243 3.266 0.076 13 0 "[ . 1 . 2 . 3 ]" 1
1183 1 73 GLY HA3 1 74 ARG HA . . 4.750 4.495 4.273 4.675 . 0 0 "[ . 1 . 2 . 3 ]" 1
1184 1 74 ARG H 1 74 ARG HB2 . . 4.160 3.366 2.453 4.122 . 0 0 "[ . 1 . 2 . 3 ]" 1
1185 1 74 ARG H 1 74 ARG QB . . 3.510 2.648 2.189 3.320 . 0 0 "[ . 1 . 2 . 3 ]" 1
1186 1 74 ARG H 1 74 ARG HB3 . . 4.160 2.873 2.265 3.853 . 0 0 "[ . 1 . 2 . 3 ]" 1
1187 1 74 ARG H 1 74 ARG HD2 . . 6.590 5.256 4.671 6.287 . 0 0 "[ . 1 . 2 . 3 ]" 1
1188 1 74 ARG H 1 74 ARG HD3 . . 6.590 5.468 4.360 6.300 . 0 0 "[ . 1 . 2 . 3 ]" 1
1189 1 74 ARG H 1 74 ARG QG . . 4.120 3.520 2.374 4.120 0.000 19 0 "[ . 1 . 2 . 3 ]" 1
1190 1 74 ARG H 1 75 VAL H . . 4.770 4.466 4.217 4.612 . 0 0 "[ . 1 . 2 . 3 ]" 1
1191 1 74 ARG HA 1 74 ARG QG . . 3.690 2.903 2.220 3.555 . 0 0 "[ . 1 . 2 . 3 ]" 1
1192 1 74 ARG HA 1 75 VAL H . . 3.010 2.182 2.076 2.386 . 0 0 "[ . 1 . 2 . 3 ]" 1
1193 1 74 ARG HA 1 75 VAL HA . . 5.790 4.495 4.388 4.592 . 0 0 "[ . 1 . 2 . 3 ]" 1
1194 1 74 ARG HA 1 75 VAL MG1 . . 5.330 3.942 3.518 4.329 . 0 0 "[ . 1 . 2 . 3 ]" 1
1195 1 74 ARG HA 1 75 VAL MG2 . . 3.660 3.653 3.396 3.704 0.044 2 0 "[ . 1 . 2 . 3 ]" 1
1196 1 74 ARG QB 1 74 ARG QD . . 3.230 2.234 1.942 2.589 . 0 0 "[ . 1 . 2 . 3 ]" 1
1197 1 74 ARG QB 1 75 VAL H . . 3.690 3.248 2.405 3.722 0.032 23 0 "[ . 1 . 2 . 3 ]" 1
1198 1 74 ARG QD 1 75 VAL H . . 5.340 4.162 2.284 4.943 . 0 0 "[ . 1 . 2 . 3 ]" 1
1199 1 75 VAL H 1 75 VAL MG1 . . 4.450 3.287 2.967 3.607 . 0 0 "[ . 1 . 2 . 3 ]" 1
1200 1 75 VAL H 1 75 VAL MG2 . . 3.390 2.431 2.189 2.712 . 0 0 "[ . 1 . 2 . 3 ]" 1
1201 1 75 VAL HA 1 75 VAL MG1 . . 3.280 2.343 2.232 2.423 . 0 0 "[ . 1 . 2 . 3 ]" 1
1202 1 75 VAL HA 1 75 VAL MG2 . . 3.330 3.269 3.247 3.290 . 0 0 "[ . 1 . 2 . 3 ]" 1
1203 1 75 VAL HA 1 76 GLU H . . 2.700 2.357 2.069 2.679 . 0 0 "[ . 1 . 2 . 3 ]" 1
1204 1 75 VAL HB 1 76 GLU H . . 3.520 2.691 1.954 3.526 0.006 2 0 "[ . 1 . 2 . 3 ]" 1
1205 1 75 VAL MG1 1 76 GLU H . . 4.410 3.743 3.433 3.988 . 0 0 "[ . 1 . 2 . 3 ]" 1
1206 1 75 VAL MG2 1 76 GLU H . . 4.190 3.711 3.027 4.224 0.034 26 0 "[ . 1 . 2 . 3 ]" 1
1207 1 76 GLU H 1 76 GLU QB . . 3.430 2.673 2.245 3.309 . 0 0 "[ . 1 . 2 . 3 ]" 1
1208 1 76 GLU H 1 76 GLU QG . . 4.060 3.339 2.399 4.138 0.078 21 0 "[ . 1 . 2 . 3 ]" 1
1209 1 76 GLU H 1 77 LEU H . . 5.500 4.286 3.583 4.663 . 0 0 "[ . 1 . 2 . 3 ]" 1
1210 1 76 GLU HA 1 76 GLU QG . . 3.520 2.600 2.178 3.322 . 0 0 "[ . 1 . 2 . 3 ]" 1
1211 1 76 GLU HA 1 77 LEU H . . 3.150 2.126 2.020 2.238 . 0 0 "[ . 1 . 2 . 3 ]" 1
1212 1 76 GLU QB 1 77 LEU H . . 4.400 3.418 2.697 4.028 . 0 0 "[ . 1 . 2 . 3 ]" 1
1213 1 77 LEU H 1 77 LEU MD1 . . 4.260 2.419 2.222 2.742 . 0 0 "[ . 1 . 2 . 3 ]" 1
1214 1 77 LEU H 1 77 LEU MD2 . . 5.500 4.161 3.984 4.347 . 0 0 "[ . 1 . 2 . 3 ]" 1
1215 1 77 LEU HA 1 77 LEU MD1 . . 3.940 2.990 2.739 3.256 . 0 0 "[ . 1 . 2 . 3 ]" 1
1216 1 77 LEU HA 1 77 LEU HG . . 3.910 2.369 2.173 2.488 . 0 0 "[ . 1 . 2 . 3 ]" 1
1217 1 77 LEU HA 1 78 LYS H . . 3.480 2.239 2.107 2.357 . 0 0 "[ . 1 . 2 . 3 ]" 1
1218 1 77 LEU HA 1 82 TYR H . . 5.290 3.566 3.162 4.223 . 0 0 "[ . 1 . 2 . 3 ]" 1
1219 1 77 LEU HA 1 82 TYR QB . . 4.880 2.422 2.016 3.412 . 0 0 "[ . 1 . 2 . 3 ]" 1
1220 1 77 LEU HA 1 82 TYR QD . . 5.050 3.584 3.016 4.199 . 0 0 "[ . 1 . 2 . 3 ]" 1
1221 1 77 LEU HB2 1 83 HIS HA . . 5.090 4.091 3.770 4.653 . 0 0 "[ . 1 . 2 . 3 ]" 1
1222 1 77 LEU HB3 1 83 HIS HA . . 4.160 2.506 2.128 3.041 . 0 0 "[ . 1 . 2 . 3 ]" 1
1223 1 77 LEU MD1 1 82 TYR H . . 6.560 5.797 5.292 6.313 . 0 0 "[ . 1 . 2 . 3 ]" 1
1224 1 77 LEU MD1 1 82 TYR HB2 . . 5.460 3.799 3.327 4.342 . 0 0 "[ . 1 . 2 . 3 ]" 1
1225 1 77 LEU MD1 1 82 TYR QB . . 4.750 3.554 3.121 4.032 . 0 0 "[ . 1 . 2 . 3 ]" 1
1226 1 77 LEU MD1 1 82 TYR HB3 . . 5.460 4.285 3.776 4.925 . 0 0 "[ . 1 . 2 . 3 ]" 1
1227 1 77 LEU MD1 1 82 TYR QD . . 5.510 4.669 4.188 5.217 . 0 0 "[ . 1 . 2 . 3 ]" 1
1228 1 77 LEU MD2 1 82 TYR H . . 5.500 5.284 4.663 5.503 0.003 6 0 "[ . 1 . 2 . 3 ]" 1
1229 1 77 LEU MD2 1 82 TYR HA . . 4.720 4.671 4.151 4.750 0.030 24 0 "[ . 1 . 2 . 3 ]" 1
1230 1 77 LEU MD2 1 82 TYR HB2 . . 4.160 3.662 3.167 3.935 . 0 0 "[ . 1 . 2 . 3 ]" 1
1231 1 77 LEU MD2 1 82 TYR QB . . 3.640 3.101 2.624 3.278 . 0 0 "[ . 1 . 2 . 3 ]" 1
1232 1 77 LEU MD2 1 82 TYR HB3 . . 4.160 3.357 2.762 3.758 . 0 0 "[ . 1 . 2 . 3 ]" 1
1233 1 77 LEU MD2 1 83 HIS H . . 5.380 3.489 3.086 3.824 . 0 0 "[ . 1 . 2 . 3 ]" 1
1234 1 77 LEU MD2 1 83 HIS HA . . 3.720 2.445 2.138 3.015 . 0 0 "[ . 1 . 2 . 3 ]" 1
1235 1 77 LEU MD2 1 83 HIS HB2 . . 5.190 4.566 4.285 5.182 . 0 0 "[ . 1 . 2 . 3 ]" 1
1236 1 77 LEU MD2 1 83 HIS HB3 . . 5.480 4.519 4.074 5.051 . 0 0 "[ . 1 . 2 . 3 ]" 1
1237 1 77 LEU MD2 1 84 PHE H . . 4.690 3.582 3.110 4.463 . 0 0 "[ . 1 . 2 . 3 ]" 1
1238 1 77 LEU MD2 1 84 PHE QB . . 5.770 4.208 3.662 5.003 . 0 0 "[ . 1 . 2 . 3 ]" 1
1239 1 77 LEU MD2 1 84 PHE QE . . 4.350 2.771 2.323 3.583 . 0 0 "[ . 1 . 2 . 3 ]" 1
1240 1 77 LEU HG 1 82 TYR H . . 5.760 4.823 4.240 5.450 . 0 0 "[ . 1 . 2 . 3 ]" 1
1241 1 77 LEU HG 1 82 TYR HA . . 5.500 4.752 4.308 5.333 . 0 0 "[ . 1 . 2 . 3 ]" 1
1242 1 77 LEU HG 1 82 TYR HB2 . . 4.010 2.410 2.185 2.930 . 0 0 "[ . 1 . 2 . 3 ]" 1
1243 1 77 LEU HG 1 82 TYR QB . . 3.450 2.284 2.047 2.670 . 0 0 "[ . 1 . 2 . 3 ]" 1
1244 1 77 LEU HG 1 82 TYR HB3 . . 4.010 2.894 2.463 3.697 . 0 0 "[ . 1 . 2 . 3 ]" 1
1245 1 77 LEU HG 1 82 TYR QD . . 5.520 4.151 3.633 4.498 . 0 0 "[ . 1 . 2 . 3 ]" 1
1246 1 77 LEU HG 1 83 HIS H . . 5.500 4.512 3.897 5.098 . 0 0 "[ . 1 . 2 . 3 ]" 1
1247 1 77 LEU HG 1 83 HIS HA . . 4.440 4.066 3.561 4.470 0.030 10 0 "[ . 1 . 2 . 3 ]" 1
1248 1 78 LYS H 1 78 LYS QG . . 4.210 2.033 1.707 2.915 . 0 0 "[ . 1 . 2 . 3 ]" 1
1249 1 78 LYS H 1 81 GLY HA3 . . 5.500 3.838 3.657 4.076 . 0 0 "[ . 1 . 2 . 3 ]" 1
1250 1 78 LYS H 1 82 TYR H . . 5.320 3.013 2.346 3.599 . 0 0 "[ . 1 . 2 . 3 ]" 1
1251 1 78 LYS HA 1 78 LYS QE . . 4.870 4.455 3.873 4.918 0.048 27 0 "[ . 1 . 2 . 3 ]" 1
1252 1 78 LYS HA 1 79 PRO HD2 . . 3.350 2.339 2.121 2.592 . 0 0 "[ . 1 . 2 . 3 ]" 1
1253 1 78 LYS HA 1 79 PRO HD3 . . 3.680 2.546 2.360 2.697 . 0 0 "[ . 1 . 2 . 3 ]" 1
1254 1 78 LYS QG 1 81 GLY H . . 4.390 3.869 2.955 4.444 0.054 21 0 "[ . 1 . 2 . 3 ]" 1
1255 1 78 LYS QG 1 82 TYR H . . 5.960 2.931 2.456 3.378 . 0 0 "[ . 1 . 2 . 3 ]" 1
1256 1 78 LYS QG 1 82 TYR QE . . 4.940 4.959 4.444 5.027 0.087 12 0 "[ . 1 . 2 . 3 ]" 1
1257 1 81 GLY H 1 82 TYR H . . 4.710 3.111 2.440 4.408 . 0 0 "[ . 1 . 2 . 3 ]" 1
1258 1 81 GLY HA3 1 82 TYR H . . 3.560 2.374 2.216 2.628 . 0 0 "[ . 1 . 2 . 3 ]" 1
1259 1 81 GLY HA3 1 82 TYR QD . . 5.640 3.381 2.864 3.768 . 0 0 "[ . 1 . 2 . 3 ]" 1
1260 1 82 TYR H 1 82 TYR QB . . 3.590 2.889 2.592 2.995 . 0 0 "[ . 1 . 2 . 3 ]" 1
1261 1 82 TYR H 1 82 TYR QD . . 4.170 3.363 1.999 3.639 . 0 0 "[ . 1 . 2 . 3 ]" 1
1262 1 82 TYR H 1 82 TYR QE . . 5.430 5.121 3.756 5.410 . 0 0 "[ . 1 . 2 . 3 ]" 1
1263 1 82 TYR H 1 83 HIS H . . 5.500 4.344 4.253 4.642 . 0 0 "[ . 1 . 2 . 3 ]" 1
1264 1 82 TYR HA 1 82 TYR QD . . 3.790 2.842 2.694 3.116 . 0 0 "[ . 1 . 2 . 3 ]" 1
1265 1 82 TYR HA 1 82 TYR QE . . 5.030 4.679 4.525 4.844 . 0 0 "[ . 1 . 2 . 3 ]" 1
1266 1 82 TYR HA 1 83 HIS H . . 3.350 2.301 2.204 2.408 . 0 0 "[ . 1 . 2 . 3 ]" 1
1267 1 82 TYR HA 1 83 HIS HA . . 6.600 4.558 4.507 4.616 . 0 0 "[ . 1 . 2 . 3 ]" 1
1268 1 82 TYR QB 1 83 HIS H . . 4.090 2.861 2.627 3.038 . 0 0 "[ . 1 . 2 . 3 ]" 1
1269 1 82 TYR HB2 1 83 HIS H . . 4.940 3.938 3.703 4.094 . 0 0 "[ . 1 . 2 . 3 ]" 1
1270 1 82 TYR HB3 1 83 HIS H . . 4.940 2.938 2.688 3.135 . 0 0 "[ . 1 . 2 . 3 ]" 1
1271 1 82 TYR QD 1 83 HIS H . . 4.700 4.126 3.978 4.412 . 0 0 "[ . 1 . 2 . 3 ]" 1
1272 1 83 HIS H 1 83 HIS HD2 . . 5.790 4.634 4.259 5.043 . 0 0 "[ . 1 . 2 . 3 ]" 1
1273 1 83 HIS H 1 84 PHE H . . 5.380 4.395 4.333 4.442 . 0 0 "[ . 1 . 2 . 3 ]" 1
1274 1 83 HIS HA 1 83 HIS HD2 . . 5.090 4.528 4.371 4.753 . 0 0 "[ . 1 . 2 . 3 ]" 1
1275 1 83 HIS HA 1 84 PHE H . . 3.180 2.434 2.270 2.592 . 0 0 "[ . 1 . 2 . 3 ]" 1
1276 1 83 HIS HB2 1 84 PHE H . . 3.800 2.445 2.216 2.872 . 0 0 "[ . 1 . 2 . 3 ]" 1
1277 1 83 HIS HB3 1 84 PHE H . . 4.090 3.780 3.644 3.965 . 0 0 "[ . 1 . 2 . 3 ]" 1
1278 1 83 HIS HD2 1 84 PHE H . . 4.750 3.732 3.106 4.472 . 0 0 "[ . 1 . 2 . 3 ]" 1
1279 1 83 HIS HD2 1 85 MET H . . 5.470 3.942 3.058 4.520 . 0 0 "[ . 1 . 2 . 3 ]" 1
1280 1 83 HIS HD2 1 85 MET HA . . 4.840 3.576 3.023 4.216 . 0 0 "[ . 1 . 2 . 3 ]" 1
1281 1 83 HIS HD2 1 85 MET QB . . 4.930 4.226 2.561 4.915 . 0 0 "[ . 1 . 2 . 3 ]" 1
1282 1 83 HIS HD2 1 85 MET ME . . 5.240 2.412 2.085 2.840 . 0 0 "[ . 1 . 2 . 3 ]" 1
1283 1 83 HIS HD2 1 85 MET QG . . 4.120 3.147 2.589 4.247 0.127 11 0 "[ . 1 . 2 . 3 ]" 1
1284 1 84 PHE H 1 84 PHE QB . . 3.590 2.378 2.227 2.532 . 0 0 "[ . 1 . 2 . 3 ]" 1
1285 1 84 PHE H 1 84 PHE QD . . 4.420 3.249 2.732 3.729 . 0 0 "[ . 1 . 2 . 3 ]" 1
1286 1 84 PHE H 1 84 PHE QE . . 5.840 5.160 4.757 5.641 . 0 0 "[ . 1 . 2 . 3 ]" 1
1287 1 84 PHE H 1 85 MET H . . 5.170 4.388 4.140 4.533 . 0 0 "[ . 1 . 2 . 3 ]" 1
1288 1 84 PHE H 1 85 MET ME . . 4.970 4.968 4.708 5.004 0.034 21 0 "[ . 1 . 2 . 3 ]" 1
1289 1 84 PHE HA 1 84 PHE QD . . 3.870 2.485 2.280 2.801 . 0 0 "[ . 1 . 2 . 3 ]" 1
1290 1 84 PHE HA 1 84 PHE QE . . 5.230 4.513 4.408 4.695 . 0 0 "[ . 1 . 2 . 3 ]" 1
1291 1 84 PHE HA 1 85 MET H . . 3.240 2.124 2.077 2.220 . 0 0 "[ . 1 . 2 . 3 ]" 1
1292 1 84 PHE QB 1 85 MET H . . 4.550 3.237 2.881 3.537 . 0 0 "[ . 1 . 2 . 3 ]" 1
1293 1 84 PHE QB 1 86 LEU MD2 . . 3.400 2.536 2.109 2.870 . 0 0 "[ . 1 . 2 . 3 ]" 1
1294 1 84 PHE HB2 1 85 MET H . . 4.350 4.299 4.033 4.432 0.082 16 0 "[ . 1 . 2 . 3 ]" 1
1295 1 84 PHE HB2 1 86 LEU MD2 . . 3.880 3.212 2.395 3.721 . 0 0 "[ . 1 . 2 . 3 ]" 1
1296 1 84 PHE HB3 1 85 MET H . . 4.350 3.350 2.950 3.718 . 0 0 "[ . 1 . 2 . 3 ]" 1
1297 1 84 PHE HB3 1 86 LEU MD2 . . 3.880 2.675 2.174 3.014 . 0 0 "[ . 1 . 2 . 3 ]" 1
1298 1 84 PHE QD 1 85 MET H . . 5.300 3.746 3.436 4.115 . 0 0 "[ . 1 . 2 . 3 ]" 1
1299 1 84 PHE QD 1 101 LEU QD . . 4.120 3.504 2.837 3.963 . 0 0 "[ . 1 . 2 . 3 ]" 1
1300 1 84 PHE QD 1 103 LEU QD . . 5.100 4.266 3.724 4.916 . 0 0 "[ . 1 . 2 . 3 ]" 1
1301 1 84 PHE QE 1 101 LEU QD . . 4.150 3.526 2.760 3.925 . 0 0 "[ . 1 . 2 . 3 ]" 1
1302 1 84 PHE QE 1 103 LEU QD . . 3.790 2.707 2.111 3.397 . 0 0 "[ . 1 . 2 . 3 ]" 1
1303 1 84 PHE QE 1 104 LEU H . . 6.460 5.048 4.737 5.475 . 0 0 "[ . 1 . 2 . 3 ]" 1
1304 1 84 PHE HZ 1 101 LEU QD . . 4.560 4.346 3.757 4.598 0.038 11 0 "[ . 1 . 2 . 3 ]" 1
1305 1 84 PHE HZ 1 103 LEU QD . . 3.870 3.013 2.425 3.888 0.018 21 0 "[ . 1 . 2 . 3 ]" 1
1306 1 84 PHE HZ 1 104 LEU H . . 6.230 4.516 4.129 4.864 . 0 0 "[ . 1 . 2 . 3 ]" 1
1307 1 85 MET H 1 85 MET QB . . 3.690 2.245 2.122 2.424 . 0 0 "[ . 1 . 2 . 3 ]" 1
1308 1 85 MET H 1 85 MET ME . . 5.500 4.128 3.837 4.302 . 0 0 "[ . 1 . 2 . 3 ]" 1
1309 1 85 MET H 1 85 MET QG . . 5.140 3.324 2.723 4.110 . 0 0 "[ . 1 . 2 . 3 ]" 1
1310 1 85 MET H 1 86 LEU H . . 5.500 4.454 4.128 4.568 . 0 0 "[ . 1 . 2 . 3 ]" 1
1311 1 85 MET H 1 86 LEU MD2 . . 5.500 4.278 3.634 4.627 . 0 0 "[ . 1 . 2 . 3 ]" 1
1312 1 85 MET HA 1 85 MET ME . . 3.770 2.066 1.966 2.378 . 0 0 "[ . 1 . 2 . 3 ]" 1
1313 1 85 MET HA 1 85 MET QG . . 3.720 2.558 2.275 2.712 . 0 0 "[ . 1 . 2 . 3 ]" 1
1314 1 85 MET HA 1 86 LEU H . . 3.010 2.112 2.019 2.196 . 0 0 "[ . 1 . 2 . 3 ]" 1
1315 1 85 MET HA 1 86 LEU MD2 . . 4.300 4.012 3.042 4.335 0.035 31 0 "[ . 1 . 2 . 3 ]" 1
1316 1 85 MET QB 1 85 MET ME . . 3.770 3.279 2.713 3.513 . 0 0 "[ . 1 . 2 . 3 ]" 1
1317 1 85 MET QB 1 86 LEU H . . 4.220 3.377 3.041 3.819 . 0 0 "[ . 1 . 2 . 3 ]" 1
1318 1 85 MET QB 1 87 LEU MD1 . . 4.000 3.748 2.714 4.028 0.028 9 0 "[ . 1 . 2 . 3 ]" 1
1319 1 85 MET HB2 1 86 LEU H . . 5.020 4.401 4.203 4.574 . 0 0 "[ . 1 . 2 . 3 ]" 1
1320 1 85 MET HB3 1 86 LEU H . . 5.020 3.519 3.120 4.156 . 0 0 "[ . 1 . 2 . 3 ]" 1
1321 1 85 MET ME 1 86 LEU H . . 4.160 3.260 2.883 3.685 . 0 0 "[ . 1 . 2 . 3 ]" 1
1322 1 85 MET QG 1 86 LEU H . . 5.410 4.031 2.512 4.599 . 0 0 "[ . 1 . 2 . 3 ]" 1
1323 1 86 LEU H 1 86 LEU MD1 . . 5.480 3.968 3.628 4.205 . 0 0 "[ . 1 . 2 . 3 ]" 1
1324 1 86 LEU H 1 86 LEU MD2 . . 4.080 3.287 2.405 3.746 . 0 0 "[ . 1 . 2 . 3 ]" 1
1325 1 86 LEU H 1 86 LEU HG . . 4.690 3.155 2.513 4.557 . 0 0 "[ . 1 . 2 . 3 ]" 1
1326 1 86 LEU H 1 87 LEU H . . 5.900 4.323 3.911 4.660 . 0 0 "[ . 1 . 2 . 3 ]" 1
1327 1 86 LEU HA 1 86 LEU MD2 . . 3.850 2.435 2.118 3.207 . 0 0 "[ . 1 . 2 . 3 ]" 1
1328 1 86 LEU HA 1 87 LEU H . . 3.400 2.195 2.098 2.442 . 0 0 "[ . 1 . 2 . 3 ]" 1
1329 1 86 LEU QB 1 89 LEU MD1 . . 4.090 3.970 3.480 4.139 0.049 7 0 "[ . 1 . 2 . 3 ]" 1
1330 1 87 LEU H 1 87 LEU QB . . 3.640 2.424 2.252 2.688 . 0 0 "[ . 1 . 2 . 3 ]" 1
1331 1 87 LEU H 1 87 LEU MD1 . . 5.500 4.120 3.598 4.545 . 0 0 "[ . 1 . 2 . 3 ]" 1
1332 1 87 LEU H 1 87 LEU MD2 . . 4.670 3.505 2.239 4.547 . 0 0 "[ . 1 . 2 . 3 ]" 1
1333 1 87 LEU HA 1 87 LEU MD2 . . 4.420 2.655 2.168 3.312 . 0 0 "[ . 1 . 2 . 3 ]" 1
1334 1 87 LEU QB 1 88 GLY H . . 4.050 3.310 2.681 3.959 . 0 0 "[ . 1 . 2 . 3 ]" 1
1335 1 87 LEU HB2 1 88 GLY H . . 4.630 4.336 3.815 4.626 . 0 0 "[ . 1 . 2 . 3 ]" 1
1336 1 87 LEU HB3 1 88 GLY H . . 4.630 3.447 2.735 4.311 . 0 0 "[ . 1 . 2 . 3 ]" 1
1337 1 87 LEU MD2 1 88 GLY H . . 5.470 3.688 1.974 4.996 . 0 0 "[ . 1 . 2 . 3 ]" 1
1338 1 88 GLY H 1 89 LEU H . . 4.100 3.055 2.447 3.611 . 0 0 "[ . 1 . 2 . 3 ]" 1
1339 1 89 LEU H 1 89 LEU HB2 . . 3.990 2.677 2.344 3.643 . 0 0 "[ . 1 . 2 . 3 ]" 1
1340 1 89 LEU H 1 89 LEU QB . . 3.330 2.568 2.315 3.377 0.047 6 0 "[ . 1 . 2 . 3 ]" 1
1341 1 89 LEU H 1 89 LEU HB3 . . 3.990 3.627 2.752 4.000 0.010 16 0 "[ . 1 . 2 . 3 ]" 1
1342 1 89 LEU H 1 89 LEU MD1 . . 5.210 3.816 2.306 4.457 . 0 0 "[ . 1 . 2 . 3 ]" 1
1343 1 89 LEU H 1 89 LEU MD2 . . 4.030 3.186 2.135 4.031 0.001 14 0 "[ . 1 . 2 . 3 ]" 1
1344 1 89 LEU H 1 89 LEU HG . . 3.870 2.470 1.922 3.055 . 0 0 "[ . 1 . 2 . 3 ]" 1
1345 1 89 LEU HA 1 91 ARG H . . 4.110 3.688 3.117 4.004 . 0 0 "[ . 1 . 2 . 3 ]" 1
1346 1 89 LEU QB 1 90 LYS H . . 4.010 3.252 2.624 3.724 . 0 0 "[ . 1 . 2 . 3 ]" 1
1347 1 89 LEU QB 1 90 LYS HA . . 4.870 4.593 4.194 4.882 0.012 27 0 "[ . 1 . 2 . 3 ]" 1
1348 1 89 LEU QB 1 91 ARG H . . 3.280 2.930 2.121 3.307 0.027 12 0 "[ . 1 . 2 . 3 ]" 1
1349 1 89 LEU MD1 1 90 LYS H . . 5.160 5.022 4.447 5.218 0.058 14 0 "[ . 1 . 2 . 3 ]" 1
1350 1 89 LEU MD1 1 91 ARG H . . 5.060 4.620 3.493 5.089 0.029 14 0 "[ . 1 . 2 . 3 ]" 1
1351 1 89 LEU MD1 1 92 PRO HA . . 4.130 3.476 2.069 4.150 0.020 14 0 "[ . 1 . 2 . 3 ]" 1
1352 1 90 LYS H 1 90 LYS QG . . 4.260 2.279 1.831 2.762 . 0 0 "[ . 1 . 2 . 3 ]" 1
1353 1 90 LYS H 1 91 ARG H . . 3.500 2.623 1.951 2.987 . 0 0 "[ . 1 . 2 . 3 ]" 1
1354 1 90 LYS HA 1 90 LYS QD . . 4.220 3.792 2.201 4.297 0.077 29 0 "[ . 1 . 2 . 3 ]" 1
1355 1 90 LYS HA 1 90 LYS QG . . 3.460 2.652 2.257 3.403 . 0 0 "[ . 1 . 2 . 3 ]" 1
1356 1 91 ARG H 1 91 ARG QB . . 3.580 3.050 2.482 3.479 . 0 0 "[ . 1 . 2 . 3 ]" 1
1357 1 91 ARG H 1 91 ARG QD . . 4.680 4.422 3.203 4.740 0.060 17 0 "[ . 1 . 2 . 3 ]" 1
1358 1 91 ARG H 1 91 ARG QG . . 3.680 3.037 2.470 3.760 0.080 3 0 "[ . 1 . 2 . 3 ]" 1
1359 1 91 ARG HA 1 91 ARG QG . . 3.960 2.999 2.307 3.486 . 0 0 "[ . 1 . 2 . 3 ]" 1
1360 1 91 ARG HA 1 92 PRO HD2 . . 3.420 2.288 2.024 2.473 . 0 0 "[ . 1 . 2 . 3 ]" 1
1361 1 91 ARG HA 1 92 PRO QD . . 2.940 2.138 1.976 2.227 . 0 0 "[ . 1 . 2 . 3 ]" 1
1362 1 91 ARG HA 1 92 PRO HD3 . . 3.420 2.619 2.330 2.869 . 0 0 "[ . 1 . 2 . 3 ]" 1
1363 1 92 PRO HA 1 93 LEU H . . 2.930 2.249 2.083 3.130 0.200 26 0 "[ . 1 . 2 . 3 ]" 1
1364 1 92 PRO QB 1 93 LEU H . . 3.290 3.152 2.656 3.384 0.094 20 0 "[ . 1 . 2 . 3 ]" 1
1365 1 93 LEU H 1 93 LEU QD . . 4.500 2.394 1.888 3.473 . 0 0 "[ . 1 . 2 . 3 ]" 1
1366 1 93 LEU HA 1 93 LEU HG . . 4.220 3.291 2.442 3.808 . 0 0 "[ . 1 . 2 . 3 ]" 1
1367 1 93 LEU HA 1 94 LYS H . . 3.360 2.255 2.059 2.501 . 0 0 "[ . 1 . 2 . 3 ]" 1
1368 1 93 LEU QD 1 94 LYS H . . 3.940 3.697 3.088 3.962 0.022 12 0 "[ . 1 . 2 . 3 ]" 1
1369 1 94 LYS H 1 94 LYS QD . . 4.420 3.972 2.212 4.486 0.066 8 0 "[ . 1 . 2 . 3 ]" 1
1370 1 94 LYS H 1 94 LYS QG . . 4.210 3.511 2.238 4.216 0.006 29 0 "[ . 1 . 2 . 3 ]" 1
1371 1 94 LYS H 1 95 ALA H . . 4.830 4.206 1.810 4.682 . 0 0 "[ . 1 . 2 . 3 ]" 1
1372 1 94 LYS H 1 97 GLU QB . . 4.870 3.914 2.729 5.009 0.139 9 0 "[ . 1 . 2 . 3 ]" 1
1373 1 94 LYS H 1 97 GLU HG2 . . 4.790 3.837 2.801 4.827 0.037 27 0 "[ . 1 . 2 . 3 ]" 1
1374 1 94 LYS H 1 97 GLU QG . . 4.170 3.088 1.999 3.771 . 0 0 "[ . 1 . 2 . 3 ]" 1
1375 1 94 LYS H 1 97 GLU HG3 . . 4.790 3.563 2.016 4.825 0.035 15 0 "[ . 1 . 2 . 3 ]" 1
1376 1 94 LYS HA 1 94 LYS QD . . 4.350 3.099 2.085 4.250 . 0 0 "[ . 1 . 2 . 3 ]" 1
1377 1 94 LYS HA 1 94 LYS QG . . 3.490 2.806 2.248 3.496 0.006 16 0 "[ . 1 . 2 . 3 ]" 1
1378 1 94 LYS HA 1 95 ALA H . . 3.370 2.331 2.035 3.421 0.051 22 0 "[ . 1 . 2 . 3 ]" 1
1379 1 94 LYS QB 1 94 LYS QD . . 2.730 2.421 1.991 2.756 0.026 20 0 "[ . 1 . 2 . 3 ]" 1
1380 1 94 LYS QB 1 95 ALA H . . 4.480 3.380 1.800 4.073 . 0 0 "[ . 1 . 2 . 3 ]" 1
1381 1 94 LYS QD 1 95 ALA H . . 4.170 3.706 2.667 4.272 0.102 2 0 "[ . 1 . 2 . 3 ]" 1
1382 1 94 LYS QE 1 94 LYS QG . . 3.470 2.303 1.994 2.754 . 0 0 "[ . 1 . 2 . 3 ]" 1
1383 1 94 LYS QG 1 95 ALA H . . 4.620 3.862 2.556 4.669 0.049 31 0 "[ . 1 . 2 . 3 ]" 1
1384 1 95 ALA H 1 95 ALA MB . . 3.240 2.318 2.160 3.225 . 0 0 "[ . 1 . 2 . 3 ]" 1
1385 1 95 ALA H 1 96 GLY H . . 5.340 4.551 4.184 4.687 . 0 0 "[ . 1 . 2 . 3 ]" 1
1386 1 95 ALA HA 1 96 GLY H . . 2.900 2.192 2.079 2.486 . 0 0 "[ . 1 . 2 . 3 ]" 1
1387 1 95 ALA HA 1 97 GLU H . . 3.760 3.651 3.397 3.793 0.033 30 0 "[ . 1 . 2 . 3 ]" 1
1388 1 95 ALA HA 1 117 VAL HB . . 3.870 3.226 2.397 3.895 0.025 26 0 "[ . 1 . 2 . 3 ]" 1
1389 1 95 ALA HA 1 117 VAL MG1 . . 3.430 2.372 2.041 3.441 0.011 16 0 "[ . 1 . 2 . 3 ]" 1
1390 1 95 ALA MB 1 96 GLY H . . 3.770 3.133 2.446 3.406 . 0 0 "[ . 1 . 2 . 3 ]" 1
1391 1 95 ALA MB 1 97 GLU H . . 6.100 4.769 4.252 4.980 . 0 0 "[ . 1 . 2 . 3 ]" 1
1392 1 96 GLY H 1 97 GLU H . . 3.810 2.590 2.351 3.068 . 0 0 "[ . 1 . 2 . 3 ]" 1
1393 1 96 GLY H 1 117 VAL H . . 5.430 3.940 3.151 5.021 . 0 0 "[ . 1 . 2 . 3 ]" 1
1394 1 96 GLY H 1 117 VAL HB . . 4.790 3.030 2.156 3.682 . 0 0 "[ . 1 . 2 . 3 ]" 1
1395 1 96 GLY H 1 117 VAL MG1 . . 5.200 3.444 2.356 4.627 . 0 0 "[ . 1 . 2 . 3 ]" 1
1396 1 97 GLU H 1 97 GLU HB2 . . 3.780 2.963 2.264 3.892 0.112 19 0 "[ . 1 . 2 . 3 ]" 1
1397 1 97 GLU H 1 97 GLU QB . . 3.120 2.665 2.240 3.192 0.072 19 0 "[ . 1 . 2 . 3 ]" 1
1398 1 97 GLU H 1 97 GLU HB3 . . 3.780 3.515 2.317 3.849 0.069 16 0 "[ . 1 . 2 . 3 ]" 1
1399 1 97 GLU H 1 97 GLU HG2 . . 4.220 3.168 2.149 4.243 0.023 29 0 "[ . 1 . 2 . 3 ]" 1
1400 1 97 GLU H 1 97 GLU QG . . 3.680 2.679 1.967 3.171 . 0 0 "[ . 1 . 2 . 3 ]" 1
1401 1 97 GLU H 1 97 GLU HG3 . . 4.220 3.425 1.985 4.255 0.035 21 0 "[ . 1 . 2 . 3 ]" 1
1402 1 97 GLU H 1 98 GLU H . . 4.810 4.409 4.180 4.611 . 0 0 "[ . 1 . 2 . 3 ]" 1
1403 1 97 GLU H 1 99 VAL MG2 . . 5.500 5.466 4.968 5.577 0.077 21 0 "[ . 1 . 2 . 3 ]" 1
1404 1 97 GLU H 1 117 VAL H . . 5.020 3.447 2.680 4.269 . 0 0 "[ . 1 . 2 . 3 ]" 1
1405 1 97 GLU H 1 117 VAL MG1 . . 4.950 3.615 2.809 4.460 . 0 0 "[ . 1 . 2 . 3 ]" 1
1406 1 97 GLU HA 1 97 GLU HG2 . . 4.090 3.109 2.404 3.838 . 0 0 "[ . 1 . 2 . 3 ]" 1
1407 1 97 GLU HA 1 97 GLU HG3 . . 4.090 3.538 2.830 4.160 0.070 9 0 "[ . 1 . 2 . 3 ]" 1
1408 1 97 GLU HA 1 98 GLU H . . 3.020 2.444 2.167 2.859 . 0 0 "[ . 1 . 2 . 3 ]" 1
1409 1 97 GLU QB 1 98 GLU H . . 3.190 2.250 1.963 2.543 . 0 0 "[ . 1 . 2 . 3 ]" 1
1410 1 97 GLU HB2 1 98 GLU H . . 3.670 3.047 2.123 3.769 0.099 10 0 "[ . 1 . 2 . 3 ]" 1
1411 1 97 GLU HB3 1 98 GLU H . . 3.670 2.722 1.984 3.747 0.077 22 0 "[ . 1 . 2 . 3 ]" 1
1412 1 97 GLU QG 1 98 GLU H . . 4.070 3.643 2.471 4.120 0.050 14 0 "[ . 1 . 2 . 3 ]" 1
1413 1 97 GLU QG 1 99 VAL MG2 . . 6.000 4.531 2.308 5.814 . 0 0 "[ . 1 . 2 . 3 ]" 1
1414 1 97 GLU QG 1 117 VAL MG2 . . 4.980 3.175 1.929 4.376 . 0 0 "[ . 1 . 2 . 3 ]" 1
1415 1 97 GLU HG2 1 98 GLU H . . 4.780 4.207 3.567 4.791 0.011 4 0 "[ . 1 . 2 . 3 ]" 1
1416 1 97 GLU HG3 1 98 GLU H . . 4.780 4.228 2.508 4.805 0.025 11 0 "[ . 1 . 2 . 3 ]" 1
1417 1 98 GLU H 1 98 GLU QB . . 3.600 2.622 2.263 3.198 . 0 0 "[ . 1 . 2 . 3 ]" 1
1418 1 98 GLU H 1 98 GLU QG . . 4.130 3.037 1.963 4.124 . 0 0 "[ . 1 . 2 . 3 ]" 1
1419 1 98 GLU H 1 99 VAL H . . 4.980 4.397 3.941 4.598 . 0 0 "[ . 1 . 2 . 3 ]" 1
1420 1 98 GLU H 1 99 VAL MG2 . . 5.440 4.567 3.999 5.439 . 0 0 "[ . 1 . 2 . 3 ]" 1
1421 1 98 GLU HA 1 99 VAL H . . 2.970 2.244 2.087 2.468 . 0 0 "[ . 1 . 2 . 3 ]" 1
1422 1 99 VAL H 1 99 VAL HB . . 3.440 2.568 2.274 2.987 . 0 0 "[ . 1 . 2 . 3 ]" 1
1423 1 99 VAL H 1 99 VAL MG1 . . 4.110 3.844 3.726 4.012 . 0 0 "[ . 1 . 2 . 3 ]" 1
1424 1 99 VAL H 1 99 VAL MG2 . . 3.540 2.858 2.426 3.328 . 0 0 "[ . 1 . 2 . 3 ]" 1
1425 1 99 VAL H 1 100 GLU H . . 4.990 4.223 3.693 4.466 . 0 0 "[ . 1 . 2 . 3 ]" 1
1426 1 99 VAL H 1 115 LEU H . . 4.290 2.967 2.589 3.503 . 0 0 "[ . 1 . 2 . 3 ]" 1
1427 1 99 VAL H 1 116 PRO HA . . 4.400 3.514 3.141 3.724 . 0 0 "[ . 1 . 2 . 3 ]" 1
1428 1 99 VAL H 1 117 VAL H . . 5.280 4.451 3.767 5.354 0.074 16 0 "[ . 1 . 2 . 3 ]" 1
1429 1 99 VAL HA 1 99 VAL MG1 . . 3.430 2.480 2.343 2.601 . 0 0 "[ . 1 . 2 . 3 ]" 1
1430 1 99 VAL HA 1 99 VAL MG2 . . 3.190 2.307 2.172 2.495 . 0 0 "[ . 1 . 2 . 3 ]" 1
1431 1 99 VAL HA 1 100 GLU H . . 2.850 2.111 1.976 2.228 . 0 0 "[ . 1 . 2 . 3 ]" 1
1432 1 99 VAL MG1 1 100 GLU H . . 3.640 3.002 2.644 3.377 . 0 0 "[ . 1 . 2 . 3 ]" 1
1433 1 99 VAL MG1 1 101 LEU H . . 5.500 4.161 2.767 4.729 . 0 0 "[ . 1 . 2 . 3 ]" 1
1434 1 99 VAL MG1 1 101 LEU HB2 . . 4.070 2.807 2.361 3.078 . 0 0 "[ . 1 . 2 . 3 ]" 1
1435 1 99 VAL MG1 1 101 LEU QB . . 3.460 2.744 2.326 2.997 . 0 0 "[ . 1 . 2 . 3 ]" 1
1436 1 99 VAL MG1 1 101 LEU HB3 . . 4.070 4.033 2.547 4.177 0.107 9 0 "[ . 1 . 2 . 3 ]" 1
1437 1 99 VAL MG1 1 101 LEU HG . . 4.390 3.262 2.057 4.455 0.065 21 0 "[ . 1 . 2 . 3 ]" 1
1438 1 99 VAL MG2 1 100 GLU H . . 4.550 3.989 3.692 4.292 . 0 0 "[ . 1 . 2 . 3 ]" 1
1439 1 99 VAL MG2 1 117 VAL H . . 5.500 4.186 3.202 5.262 . 0 0 "[ . 1 . 2 . 3 ]" 1
1440 1 100 GLU H 1 100 GLU QB . . 3.060 2.352 2.006 3.055 . 0 0 "[ . 1 . 2 . 3 ]" 1
1441 1 100 GLU H 1 100 GLU QG . . 4.790 2.855 2.183 3.996 . 0 0 "[ . 1 . 2 . 3 ]" 1
1442 1 100 GLU H 1 101 LEU H . . 5.490 4.571 3.491 4.676 . 0 0 "[ . 1 . 2 . 3 ]" 1
1443 1 100 GLU HA 1 101 LEU H . . 2.980 2.223 2.130 2.631 . 0 0 "[ . 1 . 2 . 3 ]" 1
1444 1 100 GLU QB 1 101 LEU H . . 4.110 3.049 2.565 4.043 . 0 0 "[ . 1 . 2 . 3 ]" 1
1445 1 100 GLU QG 1 101 LEU H . . 5.500 3.968 2.447 4.664 . 0 0 "[ . 1 . 2 . 3 ]" 1
1446 1 101 LEU H 1 101 LEU HB2 . . 3.940 2.946 2.039 3.826 . 0 0 "[ . 1 . 2 . 3 ]" 1
1447 1 101 LEU H 1 101 LEU QB . . 3.460 2.643 2.024 2.928 . 0 0 "[ . 1 . 2 . 3 ]" 1
1448 1 101 LEU H 1 101 LEU HB3 . . 3.940 3.250 2.728 3.804 . 0 0 "[ . 1 . 2 . 3 ]" 1
1449 1 101 LEU H 1 101 LEU HG . . 4.830 4.430 3.336 4.880 0.050 18 0 "[ . 1 . 2 . 3 ]" 1
1450 1 101 LEU H 1 102 ASP H . . 5.500 4.132 3.906 4.516 . 0 0 "[ . 1 . 2 . 3 ]" 1
1451 1 101 LEU HA 1 101 LEU MD1 . . 4.650 3.642 2.748 3.875 . 0 0 "[ . 1 . 2 . 3 ]" 1
1452 1 101 LEU HA 1 101 LEU QD . . 3.400 2.574 2.168 3.089 . 0 0 "[ . 1 . 2 . 3 ]" 1
1453 1 101 LEU HA 1 101 LEU MD2 . . 4.650 2.683 2.189 3.897 . 0 0 "[ . 1 . 2 . 3 ]" 1
1454 1 101 LEU HA 1 101 LEU HG . . 3.880 2.671 2.302 3.890 0.010 16 0 "[ . 1 . 2 . 3 ]" 1
1455 1 101 LEU HA 1 102 ASP H . . 3.230 2.062 1.940 2.231 . 0 0 "[ . 1 . 2 . 3 ]" 1
1456 1 101 LEU QB 1 102 ASP H . . 3.840 3.585 3.284 3.846 0.006 20 0 "[ . 1 . 2 . 3 ]" 1
1457 1 101 LEU QB 1 113 VAL H . . 4.360 3.806 3.467 4.430 0.070 16 0 "[ . 1 . 2 . 3 ]" 1
1458 1 101 LEU HB2 1 102 ASP H . . 4.610 4.332 3.419 4.555 . 0 0 "[ . 1 . 2 . 3 ]" 1
1459 1 101 LEU HB3 1 102 ASP H . . 4.610 3.888 3.395 4.342 . 0 0 "[ . 1 . 2 . 3 ]" 1
1460 1 101 LEU QD 1 102 ASP H . . 4.020 2.679 2.362 2.975 . 0 0 "[ . 1 . 2 . 3 ]" 1
1461 1 101 LEU QD 1 102 ASP HA . . 5.420 4.205 3.468 4.870 . 0 0 "[ . 1 . 2 . 3 ]" 1
1462 1 101 LEU QD 1 103 LEU QD . . 3.360 2.418 1.955 3.370 0.010 29 0 "[ . 1 . 2 . 3 ]" 1
1463 1 101 LEU MD1 1 102 ASP H . . 5.410 4.528 2.442 5.091 . 0 0 "[ . 1 . 2 . 3 ]" 1
1464 1 101 LEU MD1 1 103 LEU H . . 6.010 5.705 3.427 6.081 0.071 9 0 "[ . 1 . 2 . 3 ]" 1
1465 1 101 LEU MD2 1 102 ASP H . . 5.410 2.834 2.369 4.511 . 0 0 "[ . 1 . 2 . 3 ]" 1
1466 1 101 LEU MD2 1 103 LEU H . . 6.010 4.433 3.066 6.036 0.026 3 0 "[ . 1 . 2 . 3 ]" 1
1467 1 101 LEU HG 1 102 ASP H . . 5.500 3.948 3.022 5.124 . 0 0 "[ . 1 . 2 . 3 ]" 1
1468 1 102 ASP H 1 102 ASP HB2 . . 3.780 2.176 2.009 2.485 . 0 0 "[ . 1 . 2 . 3 ]" 1
1469 1 102 ASP H 1 102 ASP HB3 . . 3.970 3.456 3.228 3.707 . 0 0 "[ . 1 . 2 . 3 ]" 1
1470 1 102 ASP H 1 103 LEU H . . 4.520 4.260 3.898 4.483 . 0 0 "[ . 1 . 2 . 3 ]" 1
1471 1 102 ASP HA 1 103 LEU H . . 2.930 2.248 2.127 2.391 . 0 0 "[ . 1 . 2 . 3 ]" 1
1472 1 102 ASP HA 1 103 LEU QD . . 4.760 4.336 3.277 4.767 0.007 5 0 "[ . 1 . 2 . 3 ]" 1
1473 1 102 ASP HA 1 110 VAL MG2 . . 4.950 3.205 2.684 3.691 . 0 0 "[ . 1 . 2 . 3 ]" 1
1474 1 102 ASP HA 1 111 LEU H . . 5.500 4.134 3.535 4.715 . 0 0 "[ . 1 . 2 . 3 ]" 1
1475 1 102 ASP HB2 1 103 LEU H . . 4.900 4.564 4.281 4.679 . 0 0 "[ . 1 . 2 . 3 ]" 1
1476 1 102 ASP HB2 1 110 VAL MG2 . . 3.760 3.604 3.444 3.804 0.044 25 0 "[ . 1 . 2 . 3 ]" 1
1477 1 102 ASP HB3 1 103 LEU H . . 4.070 3.930 3.364 4.148 0.078 3 0 "[ . 1 . 2 . 3 ]" 1
1478 1 102 ASP HB3 1 110 VAL MG2 . . 4.600 2.218 2.042 2.485 . 0 0 "[ . 1 . 2 . 3 ]" 1
1479 1 103 LEU H 1 103 LEU HB2 . . 4.140 2.421 2.221 2.652 . 0 0 "[ . 1 . 2 . 3 ]" 1
1480 1 103 LEU H 1 103 LEU QB . . 3.590 2.384 2.198 2.588 . 0 0 "[ . 1 . 2 . 3 ]" 1
1481 1 103 LEU H 1 103 LEU HB3 . . 4.140 3.584 3.518 3.625 . 0 0 "[ . 1 . 2 . 3 ]" 1
1482 1 103 LEU H 1 103 LEU MD1 . . 4.630 3.555 2.262 3.868 . 0 0 "[ . 1 . 2 . 3 ]" 1
1483 1 103 LEU H 1 103 LEU QD . . 3.950 2.992 2.088 3.324 . 0 0 "[ . 1 . 2 . 3 ]" 1
1484 1 103 LEU H 1 103 LEU MD2 . . 4.630 3.338 2.102 4.052 . 0 0 "[ . 1 . 2 . 3 ]" 1
1485 1 103 LEU H 1 103 LEU HG . . 3.710 2.460 1.998 3.801 0.091 18 0 "[ . 1 . 2 . 3 ]" 1
1486 1 103 LEU H 1 104 LEU H . . 5.190 4.549 4.449 4.634 . 0 0 "[ . 1 . 2 . 3 ]" 1
1487 1 103 LEU H 1 104 LEU QD . . 4.810 4.408 4.130 4.686 . 0 0 "[ . 1 . 2 . 3 ]" 1
1488 1 103 LEU H 1 105 PHE QD . . 5.500 5.495 5.353 5.587 0.087 4 0 "[ . 1 . 2 . 3 ]" 1
1489 1 103 LEU H 1 105 PHE QE . . 5.180 4.478 3.988 4.917 . 0 0 "[ . 1 . 2 . 3 ]" 1
1490 1 103 LEU H 1 110 VAL HA . . 5.560 4.930 4.601 5.207 . 0 0 "[ . 1 . 2 . 3 ]" 1
1491 1 103 LEU H 1 110 VAL MG2 . . 4.550 3.505 3.060 4.327 . 0 0 "[ . 1 . 2 . 3 ]" 1
1492 1 103 LEU H 1 111 LEU H . . 4.510 3.188 2.843 3.814 . 0 0 "[ . 1 . 2 . 3 ]" 1
1493 1 103 LEU H 1 111 LEU QB . . 4.260 3.802 2.730 4.287 0.027 31 0 "[ . 1 . 2 . 3 ]" 1
1494 1 103 LEU HA 1 103 LEU QD . . 3.680 2.219 2.111 2.905 . 0 0 "[ . 1 . 2 . 3 ]" 1
1495 1 103 LEU HA 1 104 LEU H . . 3.210 2.176 2.129 2.226 . 0 0 "[ . 1 . 2 . 3 ]" 1
1496 1 103 LEU QB 1 104 LEU H . . 4.090 3.311 3.062 3.505 . 0 0 "[ . 1 . 2 . 3 ]" 1
1497 1 103 LEU QB 1 105 PHE QD . . 4.730 3.656 3.332 4.047 . 0 0 "[ . 1 . 2 . 3 ]" 1
1498 1 103 LEU QB 1 111 LEU H . . 4.070 3.070 2.742 3.411 . 0 0 "[ . 1 . 2 . 3 ]" 1
1499 1 103 LEU QB 1 111 LEU QB . . 3.250 2.734 2.112 3.268 0.018 6 0 "[ . 1 . 2 . 3 ]" 1
1500 1 103 LEU HB2 1 104 LEU H . . 4.760 4.283 4.120 4.452 . 0 0 "[ . 1 . 2 . 3 ]" 1
1501 1 103 LEU HB2 1 105 PHE QE . . 4.080 2.390 2.196 2.631 . 0 0 "[ . 1 . 2 . 3 ]" 1
1502 1 103 LEU HB2 1 111 LEU H . . 4.680 3.130 2.775 3.502 . 0 0 "[ . 1 . 2 . 3 ]" 1
1503 1 103 LEU HB3 1 104 LEU H . . 4.760 3.448 3.158 3.667 . 0 0 "[ . 1 . 2 . 3 ]" 1
1504 1 103 LEU HB3 1 105 PHE QE . . 4.080 2.971 2.571 3.411 . 0 0 "[ . 1 . 2 . 3 ]" 1
1505 1 103 LEU HB3 1 111 LEU H . . 4.680 4.465 4.135 4.701 0.021 4 0 "[ . 1 . 2 . 3 ]" 1
1506 1 103 LEU QD 1 104 LEU H . . 4.130 3.749 3.458 4.148 0.018 21 0 "[ . 1 . 2 . 3 ]" 1
1507 1 103 LEU QD 1 105 PHE QE . . 5.160 3.156 2.644 3.802 . 0 0 "[ . 1 . 2 . 3 ]" 1
1508 1 103 LEU QD 1 111 LEU QB . . 4.320 3.218 2.593 4.021 . 0 0 "[ . 1 . 2 . 3 ]" 1
1509 1 103 LEU HG 1 104 LEU H . . 5.360 5.220 4.037 5.394 0.034 24 0 "[ . 1 . 2 . 3 ]" 1
1510 1 104 LEU H 1 104 LEU HB2 . . 3.860 2.606 2.528 2.719 . 0 0 "[ . 1 . 2 . 3 ]" 1
1511 1 104 LEU H 1 104 LEU HB3 . . 4.180 3.685 3.625 3.777 . 0 0 "[ . 1 . 2 . 3 ]" 1
1512 1 104 LEU H 1 104 LEU MD1 . . 4.290 3.858 3.772 3.996 . 0 0 "[ . 1 . 2 . 3 ]" 1
1513 1 104 LEU H 1 104 LEU QD . . 3.680 3.066 2.986 3.175 . 0 0 "[ . 1 . 2 . 3 ]" 1
1514 1 104 LEU H 1 104 LEU MD2 . . 4.290 3.219 3.114 3.356 . 0 0 "[ . 1 . 2 . 3 ]" 1
1515 1 104 LEU H 1 104 LEU HG . . 3.730 2.409 2.307 2.589 . 0 0 "[ . 1 . 2 . 3 ]" 1
1516 1 104 LEU H 1 105 PHE H . . 4.550 4.519 4.357 4.563 0.013 30 0 "[ . 1 . 2 . 3 ]" 1
1517 1 104 LEU H 1 105 PHE QD . . 5.500 4.888 4.444 5.228 . 0 0 "[ . 1 . 2 . 3 ]" 1
1518 1 104 LEU H 1 105 PHE QE . . 6.150 5.143 4.803 5.661 . 0 0 "[ . 1 . 2 . 3 ]" 1
1519 1 104 LEU HA 1 104 LEU MD1 . . 3.990 3.905 3.872 3.944 . 0 0 "[ . 1 . 2 . 3 ]" 1
1520 1 104 LEU HA 1 104 LEU QD . . 3.290 2.285 2.240 2.327 . 0 0 "[ . 1 . 2 . 3 ]" 1
1521 1 104 LEU HA 1 104 LEU MD2 . . 3.990 2.301 2.255 2.344 . 0 0 "[ . 1 . 2 . 3 ]" 1
1522 1 104 LEU HA 1 104 LEU HG . . 4.210 3.394 3.333 3.446 . 0 0 "[ . 1 . 2 . 3 ]" 1
1523 1 104 LEU HA 1 105 PHE H . . 3.080 2.177 2.135 2.266 . 0 0 "[ . 1 . 2 . 3 ]" 1
1524 1 104 LEU HA 1 105 PHE QD . . 4.530 3.708 3.291 4.283 . 0 0 "[ . 1 . 2 . 3 ]" 1
1525 1 104 LEU HA 1 105 PHE QE . . 6.160 5.136 4.749 5.680 . 0 0 "[ . 1 . 2 . 3 ]" 1
1526 1 104 LEU HA 1 110 VAL HA . . 3.450 2.800 2.402 3.152 . 0 0 "[ . 1 . 2 . 3 ]" 1
1527 1 104 LEU HB2 1 105 PHE H . . 4.710 4.144 3.936 4.290 . 0 0 "[ . 1 . 2 . 3 ]" 1
1528 1 104 LEU HB3 1 105 PHE H . . 4.340 3.354 2.995 3.672 . 0 0 "[ . 1 . 2 . 3 ]" 1
1529 1 104 LEU QD 1 105 PHE H . . 5.380 3.866 3.686 4.006 . 0 0 "[ . 1 . 2 . 3 ]" 1
1530 1 104 LEU QD 1 110 VAL HA . . 4.510 3.604 2.651 3.899 . 0 0 "[ . 1 . 2 . 3 ]" 1
1531 1 105 PHE H 1 105 PHE HB2 . . 3.890 2.508 2.314 2.627 . 0 0 "[ . 1 . 2 . 3 ]" 1
1532 1 105 PHE H 1 105 PHE HB3 . . 3.930 3.720 3.600 3.793 . 0 0 "[ . 1 . 2 . 3 ]" 1
1533 1 105 PHE H 1 105 PHE QD . . 3.830 2.960 2.647 3.235 . 0 0 "[ . 1 . 2 . 3 ]" 1
1534 1 105 PHE H 1 109 LYS H . . 4.700 3.833 3.408 4.386 . 0 0 "[ . 1 . 2 . 3 ]" 1
1535 1 105 PHE H 1 109 LYS HB2 . . 5.080 4.189 3.456 5.207 0.127 19 0 "[ . 1 . 2 . 3 ]" 1
1536 1 105 PHE H 1 109 LYS HB3 . . 5.080 3.934 3.444 4.372 . 0 0 "[ . 1 . 2 . 3 ]" 1
1537 1 105 PHE H 1 110 VAL HA . . 4.620 3.092 2.784 3.538 . 0 0 "[ . 1 . 2 . 3 ]" 1
1538 1 105 PHE H 1 110 VAL MG1 . . 4.940 4.961 4.948 5.006 0.066 4 0 "[ . 1 . 2 . 3 ]" 1
1539 1 105 PHE H 1 111 LEU H . . 5.860 4.866 4.324 5.209 . 0 0 "[ . 1 . 2 . 3 ]" 1
1540 1 105 PHE HA 1 105 PHE QD . . 3.900 2.894 2.674 3.108 . 0 0 "[ . 1 . 2 . 3 ]" 1
1541 1 105 PHE HA 1 105 PHE QE . . 5.230 4.706 4.527 4.880 . 0 0 "[ . 1 . 2 . 3 ]" 1
1542 1 105 PHE HA 1 106 ALA H . . 3.110 2.136 1.945 2.342 . 0 0 "[ . 1 . 2 . 3 ]" 1
1543 1 105 PHE HA 1 106 ALA MB . . 4.210 3.969 3.756 4.137 . 0 0 "[ . 1 . 2 . 3 ]" 1
1544 1 105 PHE HA 1 109 LYS QB . . 6.230 4.519 4.124 4.761 . 0 0 "[ . 1 . 2 . 3 ]" 1
1545 1 105 PHE HB2 1 106 ALA H . . 4.120 4.064 3.791 4.215 0.095 6 0 "[ . 1 . 2 . 3 ]" 1
1546 1 105 PHE HB2 1 109 LYS H . . 4.040 3.600 3.203 3.872 . 0 0 "[ . 1 . 2 . 3 ]" 1
1547 1 105 PHE HB2 1 109 LYS HB2 . . 4.120 2.481 2.004 3.664 . 0 0 "[ . 1 . 2 . 3 ]" 1
1548 1 105 PHE HB2 1 109 LYS QB . . 3.350 2.019 1.886 2.156 . 0 0 "[ . 1 . 2 . 3 ]" 1
1549 1 105 PHE HB2 1 109 LYS HB3 . . 4.120 2.240 1.936 2.570 . 0 0 "[ . 1 . 2 . 3 ]" 1
1550 1 105 PHE HB3 1 106 ALA H . . 3.820 3.032 2.588 3.422 . 0 0 "[ . 1 . 2 . 3 ]" 1
1551 1 105 PHE HB3 1 109 LYS H . . 4.610 4.567 4.252 4.678 0.068 7 0 "[ . 1 . 2 . 3 ]" 1
1552 1 105 PHE HB3 1 109 LYS HA . . 6.030 5.826 5.376 6.049 0.019 4 0 "[ . 1 . 2 . 3 ]" 1
1553 1 105 PHE HB3 1 109 LYS QB . . 4.060 2.940 2.437 3.221 . 0 0 "[ . 1 . 2 . 3 ]" 1
1554 1 105 PHE HB3 1 109 LYS QG . . 4.670 4.335 3.340 4.712 0.042 4 0 "[ . 1 . 2 . 3 ]" 1
1555 1 105 PHE QD 1 106 ALA H . . 4.340 3.870 3.560 4.341 0.001 29 0 "[ . 1 . 2 . 3 ]" 1
1556 1 105 PHE QD 1 109 LYS H . . 5.500 5.168 4.819 5.530 0.030 26 0 "[ . 1 . 2 . 3 ]" 1
1557 1 105 PHE QD 1 109 LYS HA . . 5.520 5.067 4.639 5.546 0.026 30 0 "[ . 1 . 2 . 3 ]" 1
1558 1 105 PHE QD 1 109 LYS HB2 . . 4.460 4.158 3.685 4.577 0.117 9 0 "[ . 1 . 2 . 3 ]" 1
1559 1 105 PHE QD 1 109 LYS QB . . 3.860 2.987 2.649 3.325 . 0 0 "[ . 1 . 2 . 3 ]" 1
1560 1 105 PHE QD 1 109 LYS HB3 . . 4.460 3.072 2.715 3.532 . 0 0 "[ . 1 . 2 . 3 ]" 1
1561 1 105 PHE QD 1 109 LYS QG . . 4.540 4.413 2.085 4.610 0.070 31 0 "[ . 1 . 2 . 3 ]" 1
1562 1 105 PHE QD 1 110 VAL H . . 5.500 4.398 3.943 5.126 . 0 0 "[ . 1 . 2 . 3 ]" 1
1563 1 105 PHE QD 1 110 VAL HA . . 4.010 2.708 2.210 3.839 . 0 0 "[ . 1 . 2 . 3 ]" 1
1564 1 105 PHE QD 1 111 LEU H . . 4.760 3.277 2.811 3.816 . 0 0 "[ . 1 . 2 . 3 ]" 1
1565 1 105 PHE QD 1 111 LEU QB . . 4.750 3.687 3.191 4.041 . 0 0 "[ . 1 . 2 . 3 ]" 1
1566 1 105 PHE QD 1 111 LEU QD . . 3.990 3.378 2.257 4.004 0.014 9 0 "[ . 1 . 2 . 3 ]" 1
1567 1 105 PHE QE 1 109 LYS QB . . 5.370 4.751 4.208 5.298 . 0 0 "[ . 1 . 2 . 3 ]" 1
1568 1 105 PHE QE 1 110 VAL H . . 6.600 6.005 5.288 6.696 0.096 4 0 "[ . 1 . 2 . 3 ]" 1
1569 1 105 PHE QE 1 110 VAL HA . . 5.090 4.212 3.486 4.906 . 0 0 "[ . 1 . 2 . 3 ]" 1
1570 1 105 PHE QE 1 111 LEU H . . 4.540 3.288 2.712 3.877 . 0 0 "[ . 1 . 2 . 3 ]" 1
1571 1 105 PHE QE 1 111 LEU HA . . 5.170 4.963 4.493 5.183 0.013 7 0 "[ . 1 . 2 . 3 ]" 1
1572 1 105 PHE QE 1 111 LEU HB2 . . 3.920 2.264 2.128 2.470 . 0 0 "[ . 1 . 2 . 3 ]" 1
1573 1 105 PHE QE 1 111 LEU QB . . 3.290 2.249 2.118 2.443 . 0 0 "[ . 1 . 2 . 3 ]" 1
1574 1 105 PHE QE 1 111 LEU HB3 . . 3.920 3.895 3.558 3.939 0.019 11 0 "[ . 1 . 2 . 3 ]" 1
1575 1 105 PHE QE 1 111 LEU QD . . 3.690 2.599 2.253 3.709 0.019 7 0 "[ . 1 . 2 . 3 ]" 1
1576 1 105 PHE QE 1 111 LEU HG . . 3.930 3.311 2.504 3.945 0.015 9 0 "[ . 1 . 2 . 3 ]" 1
1577 1 106 ALA H 1 106 ALA MB . . 3.250 2.391 2.164 2.686 . 0 0 "[ . 1 . 2 . 3 ]" 1
1578 1 106 ALA MB 1 108 GLY H . . 6.530 4.486 2.811 6.251 . 0 0 "[ . 1 . 2 . 3 ]" 1
1579 1 108 GLY H 1 109 LYS H . . 3.910 2.954 2.006 3.732 . 0 0 "[ . 1 . 2 . 3 ]" 1
1580 1 109 LYS H 1 109 LYS HB2 . . 3.470 2.457 2.094 3.017 . 0 0 "[ . 1 . 2 . 3 ]" 1
1581 1 109 LYS H 1 109 LYS QB . . 2.950 2.382 2.060 2.767 . 0 0 "[ . 1 . 2 . 3 ]" 1
1582 1 109 LYS H 1 109 LYS HB3 . . 3.470 3.424 2.328 3.589 0.119 13 0 "[ . 1 . 2 . 3 ]" 1
1583 1 109 LYS H 1 109 LYS HG2 . . 4.890 4.380 3.157 4.978 0.088 22 0 "[ . 1 . 2 . 3 ]" 1
1584 1 109 LYS H 1 109 LYS HG3 . . 4.890 4.401 3.339 4.889 . 0 0 "[ . 1 . 2 . 3 ]" 1
1585 1 109 LYS H 1 110 VAL H . . 4.620 4.380 3.885 4.569 . 0 0 "[ . 1 . 2 . 3 ]" 1
1586 1 109 LYS H 1 110 VAL MG1 . . 5.500 4.926 4.541 5.480 . 0 0 "[ . 1 . 2 . 3 ]" 1
1587 1 109 LYS HA 1 109 LYS HG2 . . 3.990 3.244 2.309 3.806 . 0 0 "[ . 1 . 2 . 3 ]" 1
1588 1 109 LYS HA 1 109 LYS QG . . 3.340 2.457 2.206 3.016 . 0 0 "[ . 1 . 2 . 3 ]" 1
1589 1 109 LYS HA 1 109 LYS HG3 . . 3.990 2.850 2.261 3.815 . 0 0 "[ . 1 . 2 . 3 ]" 1
1590 1 109 LYS HA 1 110 VAL H . . 2.690 2.215 1.995 2.347 . 0 0 "[ . 1 . 2 . 3 ]" 1
1591 1 109 LYS HA 1 110 VAL HA . . 6.120 4.446 4.324 4.519 . 0 0 "[ . 1 . 2 . 3 ]" 1
1592 1 109 LYS HA 1 110 VAL MG1 . . 4.410 3.682 3.387 3.859 . 0 0 "[ . 1 . 2 . 3 ]" 1
1593 1 109 LYS QB 1 110 VAL H . . 4.010 3.203 2.429 4.044 0.034 7 0 "[ . 1 . 2 . 3 ]" 1
1594 1 109 LYS QG 1 110 VAL H . . 4.050 3.718 2.820 4.157 0.107 26 0 "[ . 1 . 2 . 3 ]" 1
1595 1 110 VAL H 1 110 VAL HB . . 3.360 3.393 3.160 3.466 0.106 26 0 "[ . 1 . 2 . 3 ]" 1
1596 1 110 VAL H 1 110 VAL MG1 . . 4.120 2.392 1.963 2.728 . 0 0 "[ . 1 . 2 . 3 ]" 1
1597 1 110 VAL H 1 110 VAL MG2 . . 4.760 3.936 3.772 4.095 . 0 0 "[ . 1 . 2 . 3 ]" 1
1598 1 110 VAL H 1 111 LEU H . . 4.970 4.250 4.107 4.497 . 0 0 "[ . 1 . 2 . 3 ]" 1
1599 1 110 VAL HA 1 110 VAL MG1 . . 3.330 3.257 3.181 3.277 . 0 0 "[ . 1 . 2 . 3 ]" 1
1600 1 110 VAL HA 1 110 VAL MG2 . . 3.530 2.467 2.390 2.558 . 0 0 "[ . 1 . 2 . 3 ]" 1
1601 1 110 VAL HA 1 111 LEU H . . 2.980 2.221 2.118 2.379 . 0 0 "[ . 1 . 2 . 3 ]" 1
1602 1 110 VAL HA 1 111 LEU QB . . 4.750 4.217 3.938 4.514 . 0 0 "[ . 1 . 2 . 3 ]" 1
1603 1 110 VAL MG2 1 111 LEU H . . 3.540 2.500 2.059 3.138 . 0 0 "[ . 1 . 2 . 3 ]" 1
1604 1 110 VAL MG2 1 112 LYS H . . 5.620 4.071 3.454 4.918 . 0 0 "[ . 1 . 2 . 3 ]" 1
1605 1 110 VAL MG2 1 112 LYS QE . . 6.170 5.476 4.244 6.188 0.018 7 0 "[ . 1 . 2 . 3 ]" 1
1606 1 111 LEU H 1 111 LEU HB2 . . 4.010 2.618 2.274 2.780 . 0 0 "[ . 1 . 2 . 3 ]" 1
1607 1 111 LEU H 1 111 LEU QB . . 3.430 2.570 2.224 2.722 . 0 0 "[ . 1 . 2 . 3 ]" 1
1608 1 111 LEU H 1 111 LEU HB3 . . 4.010 3.764 3.144 3.888 . 0 0 "[ . 1 . 2 . 3 ]" 1
1609 1 111 LEU H 1 111 LEU QD . . 4.190 3.523 2.616 3.972 . 0 0 "[ . 1 . 2 . 3 ]" 1
1610 1 111 LEU H 1 111 LEU HG . . 4.090 3.456 3.019 4.166 0.076 17 0 "[ . 1 . 2 . 3 ]" 1
1611 1 111 LEU H 1 112 LYS H . . 5.120 4.202 3.958 4.566 . 0 0 "[ . 1 . 2 . 3 ]" 1
1612 1 111 LEU HA 1 111 LEU QD . . 3.290 2.196 2.141 2.315 . 0 0 "[ . 1 . 2 . 3 ]" 1
1613 1 111 LEU HA 1 111 LEU HG . . 3.790 3.222 2.494 3.808 0.018 7 0 "[ . 1 . 2 . 3 ]" 1
1614 1 111 LEU HA 1 112 LYS H . . 3.050 2.196 2.100 2.565 . 0 0 "[ . 1 . 2 . 3 ]" 1
1615 1 111 LEU QB 1 111 LEU QD . . 2.830 1.978 1.908 2.083 . 0 0 "[ . 1 . 2 . 3 ]" 1
1616 1 111 LEU QB 1 112 LYS H . . 3.850 3.395 2.695 3.682 . 0 0 "[ . 1 . 2 . 3 ]" 1
1617 1 111 LEU HB2 1 112 LYS H . . 4.410 4.367 3.989 4.496 0.086 13 0 "[ . 1 . 2 . 3 ]" 1
1618 1 111 LEU HB3 1 112 LYS H . . 4.410 3.545 2.740 3.909 . 0 0 "[ . 1 . 2 . 3 ]" 1
1619 1 111 LEU QD 1 112 LYS H . . 4.370 3.633 1.797 3.911 . 0 0 "[ . 1 . 2 . 3 ]" 1
1620 1 112 LYS H 1 112 LYS HB2 . . 3.660 2.922 2.284 3.710 0.050 31 0 "[ . 1 . 2 . 3 ]" 1
1621 1 112 LYS H 1 112 LYS HB3 . . 3.660 2.762 2.360 3.741 0.081 4 0 "[ . 1 . 2 . 3 ]" 1
1622 1 112 LYS H 1 112 LYS QD . . 5.430 4.444 3.185 4.917 . 0 0 "[ . 1 . 2 . 3 ]" 1
1623 1 112 LYS H 1 112 LYS QE . . 5.500 4.492 3.717 5.526 0.026 28 0 "[ . 1 . 2 . 3 ]" 1
1624 1 112 LYS H 1 112 LYS QG . . 4.370 3.281 1.911 4.012 . 0 0 "[ . 1 . 2 . 3 ]" 1
1625 1 112 LYS H 1 113 VAL H . . 4.900 4.469 3.972 4.665 . 0 0 "[ . 1 . 2 . 3 ]" 1
1626 1 112 LYS HA 1 112 LYS QD . . 5.090 3.956 2.248 4.614 . 0 0 "[ . 1 . 2 . 3 ]" 1
1627 1 112 LYS HA 1 112 LYS HG2 . . 4.050 3.218 2.186 3.948 . 0 0 "[ . 1 . 2 . 3 ]" 1
1628 1 112 LYS HA 1 112 LYS HG3 . . 4.050 3.105 2.209 4.026 . 0 0 "[ . 1 . 2 . 3 ]" 1
1629 1 112 LYS HA 1 113 VAL H . . 2.820 2.144 2.003 2.267 . 0 0 "[ . 1 . 2 . 3 ]" 1
1630 1 112 LYS QB 1 112 LYS QE . . 3.690 2.347 1.790 3.620 . 0 0 "[ . 1 . 2 . 3 ]" 1
1631 1 112 LYS QE 1 112 LYS QG . . 3.340 2.450 2.109 2.964 . 0 0 "[ . 1 . 2 . 3 ]" 1
1632 1 112 LYS QG 1 113 VAL H . . 4.130 3.430 2.461 4.146 0.016 30 0 "[ . 1 . 2 . 3 ]" 1
1633 1 113 VAL H 1 113 VAL HB . . 4.000 3.786 2.869 3.968 . 0 0 "[ . 1 . 2 . 3 ]" 1
1634 1 113 VAL H 1 113 VAL MG1 . . 4.120 3.047 2.461 4.019 . 0 0 "[ . 1 . 2 . 3 ]" 1
1635 1 113 VAL H 1 113 VAL MG2 . . 3.710 2.318 2.132 2.702 . 0 0 "[ . 1 . 2 . 3 ]" 1
1636 1 113 VAL H 1 114 VAL H . . 4.830 4.488 4.389 4.663 . 0 0 "[ . 1 . 2 . 3 ]" 1
1637 1 113 VAL HA 1 113 VAL HB . . 3.020 2.475 2.366 3.023 0.003 4 0 "[ . 1 . 2 . 3 ]" 1
1638 1 113 VAL HA 1 113 VAL MG1 . . 3.270 2.351 2.269 2.415 . 0 0 "[ . 1 . 2 . 3 ]" 1
1639 1 113 VAL HA 1 113 VAL MG2 . . 3.740 3.232 2.567 3.288 . 0 0 "[ . 1 . 2 . 3 ]" 1
1640 1 113 VAL HA 1 114 VAL H . . 3.030 2.410 2.117 2.654 . 0 0 "[ . 1 . 2 . 3 ]" 1
1641 1 113 VAL HB 1 114 VAL H . . 3.250 2.462 1.986 3.300 0.050 26 0 "[ . 1 . 2 . 3 ]" 1
1642 1 113 VAL MG2 1 114 VAL H . . 4.140 3.482 2.989 4.067 . 0 0 "[ . 1 . 2 . 3 ]" 1
1643 1 114 VAL H 1 114 VAL HB . . 3.570 3.334 2.842 3.681 0.111 29 0 "[ . 1 . 2 . 3 ]" 1
1644 1 114 VAL H 1 114 VAL MG1 . . 4.680 2.577 1.920 3.416 . 0 0 "[ . 1 . 2 . 3 ]" 1
1645 1 114 VAL H 1 115 LEU H . . 4.780 4.378 4.139 4.591 . 0 0 "[ . 1 . 2 . 3 ]" 1
1646 1 114 VAL HA 1 114 VAL MG1 . . 3.320 2.936 2.194 3.284 . 0 0 "[ . 1 . 2 . 3 ]" 1
1647 1 114 VAL HA 1 114 VAL MG2 . . 3.010 2.594 2.283 3.156 0.146 13 0 "[ . 1 . 2 . 3 ]" 1
1648 1 114 VAL HA 1 115 LEU H . . 3.320 2.209 2.094 2.325 . 0 0 "[ . 1 . 2 . 3 ]" 1
1649 1 114 VAL MG2 1 115 LEU H . . 4.070 2.961 2.113 4.094 0.024 21 0 "[ . 1 . 2 . 3 ]" 1
1650 1 114 VAL MG2 1 116 PRO QD . . 4.630 4.411 3.159 4.686 0.056 4 0 "[ . 1 . 2 . 3 ]" 1
1651 1 115 LEU H 1 115 LEU HB2 . . 4.120 2.790 2.525 3.947 . 0 0 "[ . 1 . 2 . 3 ]" 1
1652 1 115 LEU H 1 115 LEU HB3 . . 4.090 3.820 3.537 3.918 . 0 0 "[ . 1 . 2 . 3 ]" 1
1653 1 115 LEU H 1 115 LEU MD1 . . 4.330 3.943 2.703 4.341 0.011 28 0 "[ . 1 . 2 . 3 ]" 1
1654 1 115 LEU H 1 115 LEU MD2 . . 5.490 3.918 2.460 4.646 . 0 0 "[ . 1 . 2 . 3 ]" 1
1655 1 115 LEU H 1 115 LEU HG . . 4.240 3.238 2.732 4.290 0.050 12 0 "[ . 1 . 2 . 3 ]" 1
1656 1 115 LEU HA 1 115 LEU MD1 . . 3.990 3.848 2.287 4.031 0.041 28 0 "[ . 1 . 2 . 3 ]" 1
1657 1 115 LEU HA 1 115 LEU MD2 . . 4.210 2.536 2.125 3.722 . 0 0 "[ . 1 . 2 . 3 ]" 1
1658 1 115 LEU HA 1 116 PRO HD2 . . 3.450 2.273 2.044 2.565 . 0 0 "[ . 1 . 2 . 3 ]" 1
1659 1 115 LEU HA 1 116 PRO HD3 . . 3.450 2.543 2.327 2.974 . 0 0 "[ . 1 . 2 . 3 ]" 1
1660 1 115 LEU HA 1 116 PRO HG2 . . 5.350 4.481 4.180 4.740 . 0 0 "[ . 1 . 2 . 3 ]" 1
1661 1 115 LEU HA 1 116 PRO QG . . 4.620 4.048 3.899 4.222 . 0 0 "[ . 1 . 2 . 3 ]" 1
1662 1 115 LEU HA 1 116 PRO HG3 . . 5.350 4.617 4.525 4.737 . 0 0 "[ . 1 . 2 . 3 ]" 1
1663 1 115 LEU HB2 1 116 PRO QD . . 4.420 3.852 2.243 4.423 0.003 8 0 "[ . 1 . 2 . 3 ]" 1
1664 1 115 LEU HB3 1 116 PRO HD2 . . 5.500 2.836 2.191 4.094 . 0 0 "[ . 1 . 2 . 3 ]" 1
1665 1 115 LEU HB3 1 116 PRO QD . . 4.770 2.784 2.172 3.934 . 0 0 "[ . 1 . 2 . 3 ]" 1
1666 1 115 LEU HB3 1 116 PRO HD3 . . 5.500 4.139 3.571 5.092 . 0 0 "[ . 1 . 2 . 3 ]" 1
1667 1 116 PRO HA 1 117 VAL H . . 3.020 2.295 2.173 2.842 . 0 0 "[ . 1 . 2 . 3 ]" 1
1668 1 116 PRO QD 1 117 VAL H . . 4.960 4.963 4.750 5.011 0.051 23 0 "[ . 1 . 2 . 3 ]" 1
1669 1 117 VAL H 1 117 VAL HB . . 4.210 2.411 2.216 2.626 . 0 0 "[ . 1 . 2 . 3 ]" 1
1670 1 117 VAL H 1 117 VAL MG1 . . 3.680 3.751 3.693 3.813 0.133 16 0 "[ . 1 . 2 . 3 ]" 1
1671 1 117 VAL H 1 117 VAL MG2 . . 4.400 2.495 2.326 2.866 . 0 0 "[ . 1 . 2 . 3 ]" 1
1672 1 117 VAL H 1 118 GLU H . . 5.100 4.498 3.726 4.678 . 0 0 "[ . 1 . 2 . 3 ]" 1
1673 1 117 VAL HB 1 118 GLU H . . 5.820 4.190 3.920 4.565 . 0 0 "[ . 1 . 2 . 3 ]" 1
1674 1 118 GLU HA 1 118 GLU QG . . 3.400 2.432 2.098 3.338 . 0 0 "[ . 1 . 2 . 3 ]" 1
1675 1 118 GLU QG 1 119 ALA H . . 5.180 2.910 1.779 3.987 . 0 0 "[ . 1 . 2 . 3 ]" 1
1676 1 119 ALA HA 1 120 ARG H . . 3.160 2.545 2.071 3.252 0.092 27 0 "[ . 1 . 2 . 3 ]" 1
1677 1 119 ALA MB 1 120 ARG H . . 4.330 3.487 1.882 3.807 . 0 0 "[ . 1 . 2 . 3 ]" 1
1678 1 120 ARG H 1 120 ARG QB . . 3.600 2.646 2.043 3.423 . 0 0 "[ . 1 . 2 . 3 ]" 1
1679 1 120 ARG H 1 120 ARG QG . . 4.290 3.573 2.386 4.313 0.023 27 0 "[ . 1 . 2 . 3 ]" 1
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