NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
405444 |
1x5o   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1x5o
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 1994
_Distance_constraint_stats_list.Viol_count 1490
_Distance_constraint_stats_list.Viol_total 6165.250
_Distance_constraint_stats_list.Viol_max 4.178
_Distance_constraint_stats_list.Viol_rms 0.0922
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0077
_Distance_constraint_stats_list.Viol_average_violations_only 0.2069
_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 8 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 18 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 19 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 GLU 0.064 0.064 13 0 "[ . 1 . 2]"
1 23 GLN 0.221 0.076 16 0 "[ . 1 . 2]"
1 24 ASP 0.151 0.076 16 0 "[ . 1 . 2]"
1 25 PRO 0.152 0.152 10 0 "[ . 1 . 2]"
1 26 THR 0.251 0.120 6 0 "[ . 1 . 2]"
1 27 ASN 0.157 0.079 9 0 "[ . 1 . 2]"
1 28 LEU 8.649 0.376 10 0 "[ . 1 . 2]"
1 29 TYR 0.756 0.113 8 0 "[ . 1 . 2]"
1 30 ILE 2.313 0.428 14 0 "[ . 1 . 2]"
1 31 SER 8.966 0.618 14 6 "[ . 1 * +* *-*2]"
1 32 ASN 0.901 0.243 15 0 "[ . 1 . 2]"
1 33 LEU 9.891 0.287 19 0 "[ . 1 . 2]"
1 34 PRO 39.862 0.721 9 20 [********+***-*******]
1 35 LEU 0.096 0.013 11 0 "[ . 1 . 2]"
1 36 SER 0.027 0.027 10 0 "[ . 1 . 2]"
1 37 MET 11.305 0.418 15 0 "[ . 1 . 2]"
1 38 ASP 3.826 0.474 9 0 "[ . 1 . 2]"
1 39 GLU 106.184 4.178 10 20 [*********+***-******]
1 40 GLN 106.793 4.178 10 20 [*********+***-******]
1 41 GLU 5.712 0.278 6 0 "[ . 1 . 2]"
1 42 LEU 2.676 0.198 5 0 "[ . 1 . 2]"
1 43 GLU 6.322 0.276 8 0 "[ . 1 . 2]"
1 44 ASN 6.112 0.497 6 0 "[ . 1 . 2]"
1 45 MET 7.589 0.292 9 0 "[ . 1 . 2]"
1 46 LEU 6.082 0.292 9 0 "[ . 1 . 2]"
1 47 LYS 10.477 0.798 18 3 "[ . 1- . + *]"
1 48 PRO 0.002 0.001 2 0 "[ . 1 . 2]"
1 49 PHE 7.288 0.450 9 0 "[ . 1 . 2]"
1 50 GLY 5.035 0.455 15 0 "[ . 1 . 2]"
1 51 GLN 10.085 0.798 18 5 "[ . 1- **. + *]"
1 52 VAL 14.064 0.676 14 2 "[ . 1 -+. 2]"
1 53 ILE 5.416 0.442 12 0 "[ . 1 . 2]"
1 54 SER 0.002 0.002 13 0 "[ . 1 . 2]"
1 55 THR 9.222 0.497 14 0 "[ . 1 . 2]"
1 56 ARG 0.360 0.244 10 0 "[ . 1 . 2]"
1 57 ILE 2.840 0.244 10 0 "[ . 1 . 2]"
1 58 LEU 1.437 0.254 4 0 "[ . 1 . 2]"
1 59 ARG 2.349 0.254 4 0 "[ . 1 . 2]"
1 60 ASP 0.812 0.246 6 0 "[ . 1 . 2]"
1 61 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 GLY 0.279 0.075 4 0 "[ . 1 . 2]"
1 64 THR 0.006 0.004 17 0 "[ . 1 . 2]"
1 65 SER 0.117 0.111 17 0 "[ . 1 . 2]"
1 66 ARG 1.564 0.246 6 0 "[ . 1 . 2]"
1 67 GLY 1.156 0.172 1 0 "[ . 1 . 2]"
1 68 VAL 0.196 0.075 1 0 "[ . 1 . 2]"
1 69 GLY 1.824 0.171 19 0 "[ . 1 . 2]"
1 70 PHE 0.239 0.071 12 0 "[ . 1 . 2]"
1 71 ALA 9.695 0.426 17 0 "[ . 1 . 2]"
1 72 ARG 18.536 0.448 17 0 "[ . 1 . 2]"
1 73 MET 25.265 0.455 15 0 "[ . 1 . 2]"
1 74 GLU 1.858 0.227 13 0 "[ . 1 . 2]"
1 75 SER 0.586 0.163 9 0 "[ . 1 . 2]"
1 76 THR 0.149 0.120 6 0 "[ . 1 . 2]"
1 77 GLU 1.755 0.287 19 0 "[ . 1 . 2]"
1 78 LYS 2.079 0.260 11 0 "[ . 1 . 2]"
1 79 CYS 0.558 0.127 8 0 "[ . 1 . 2]"
1 80 GLU 1.742 0.287 19 0 "[ . 1 . 2]"
1 81 ALA 0.522 0.171 13 0 "[ . 1 . 2]"
1 82 VAL 11.014 0.584 4 7 "[ * +. *** -. *2]"
1 83 ILE 10.717 0.584 4 7 "[ * +. *** -. *2]"
1 84 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 85 HIS 0.053 0.038 13 0 "[ . 1 . 2]"
1 86 PHE 1.312 0.182 18 0 "[ . 1 . 2]"
1 87 ASN 3.957 0.676 14 2 "[ . -1 +. 2]"
1 88 GLY 9.630 0.512 1 1 "[+ . 1 . 2]"
1 89 LYS 4.024 0.247 9 0 "[ . 1 . 2]"
1 90 PHE 5.943 0.419 20 0 "[ . 1 . 2]"
1 91 ILE 25.922 0.721 9 12 "[ *****+1* - * * **]"
1 92 LYS 0.189 0.174 15 0 "[ . 1 . 2]"
1 93 THR 0.149 0.051 5 0 "[ . 1 . 2]"
1 94 PRO 0.303 0.085 10 0 "[ . 1 . 2]"
1 95 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 VAL 0.540 0.085 10 0 "[ . 1 . 2]"
1 98 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 PRO 18.521 0.699 2 20 [*+*************-****]
1 101 THR 0.088 0.048 8 0 "[ . 1 . 2]"
1 102 GLU 5.445 0.419 20 0 "[ . 1 . 2]"
1 103 PRO 6.731 0.512 1 1 "[+ . 1 . 2]"
1 104 LEU 13.072 0.287 19 0 "[ . 1 . 2]"
1 105 LEU 8.365 0.618 14 6 "[ . 1 * +* *-*2]"
1 106 CYS 4.734 0.676 14 2 "[ . -1 +. 2]"
1 107 LYS 0.002 0.002 9 0 "[ . 1 . 2]"
1 108 PHE 0.180 0.152 10 0 "[ . 1 . 2]"
1 109 SER 0.082 0.073 15 0 "[ . 1 . 2]"
1 110 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 111 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 8 LEU H 1 8 LEU HG . . 5.500 3.726 2.038 5.092 . 0 0 "[ . 1 . 2]" 1
2 1 8 LEU HA 1 8 LEU MD1 . . 4.450 3.260 1.991 4.034 . 0 0 "[ . 1 . 2]" 1
3 1 8 LEU HA 1 8 LEU QD . . 3.750 2.635 1.985 3.415 . 0 0 "[ . 1 . 2]" 1
4 1 8 LEU HA 1 8 LEU MD2 . . 4.450 3.280 2.159 4.136 . 0 0 "[ . 1 . 2]" 1
5 1 13 VAL H 1 13 VAL QG . . 4.270 2.064 1.861 2.465 . 0 0 "[ . 1 . 2]" 1
6 1 13 VAL HA 1 14 GLN QB . . 5.340 4.229 3.918 4.533 . 0 0 "[ . 1 . 2]" 1
7 1 18 ALA MB 1 19 LYS H . . 4.640 2.864 2.138 3.690 . 0 0 "[ . 1 . 2]" 1
8 1 20 GLN H 1 20 GLN QB . . 3.430 2.425 2.171 2.906 . 0 0 "[ . 1 . 2]" 1
9 1 22 GLU H 1 23 GLN H . . 4.940 4.209 2.344 4.648 . 0 0 "[ . 1 . 2]" 1
10 1 22 GLU HA 1 22 GLU QG . . 3.710 2.690 2.167 3.455 . 0 0 "[ . 1 . 2]" 1
11 1 22 GLU HA 1 23 GLN H . . 3.190 2.421 2.139 3.254 0.064 13 0 "[ . 1 . 2]" 1
12 1 22 GLU QB 1 23 GLN H . . 4.030 2.953 2.091 3.871 . 0 0 "[ . 1 . 2]" 1
13 1 23 GLN H 1 23 GLN QB . . 3.470 2.516 2.230 2.987 . 0 0 "[ . 1 . 2]" 1
14 1 23 GLN H 1 23 GLN HG2 . . 5.250 3.425 1.942 4.659 . 0 0 "[ . 1 . 2]" 1
15 1 23 GLN H 1 23 GLN QG . . 4.540 2.967 1.904 4.182 . 0 0 "[ . 1 . 2]" 1
16 1 23 GLN H 1 23 GLN HG3 . . 5.250 3.629 2.306 4.806 . 0 0 "[ . 1 . 2]" 1
17 1 23 GLN H 1 24 ASP H . . 5.330 3.733 1.952 4.627 . 0 0 "[ . 1 . 2]" 1
18 1 23 GLN HA 1 23 GLN HG2 . . 4.180 2.962 2.218 3.832 . 0 0 "[ . 1 . 2]" 1
19 1 23 GLN HA 1 23 GLN QG . . 3.570 2.699 2.181 3.395 . 0 0 "[ . 1 . 2]" 1
20 1 23 GLN HA 1 23 GLN HG3 . . 4.180 3.315 2.396 4.187 0.007 15 0 "[ . 1 . 2]" 1
21 1 23 GLN HA 1 24 ASP H . . 3.300 2.472 2.141 3.234 . 0 0 "[ . 1 . 2]" 1
22 1 23 GLN HA 1 24 ASP HB2 . . 5.500 4.742 3.936 5.505 0.005 10 0 "[ . 1 . 2]" 1
23 1 23 GLN HA 1 24 ASP HB3 . . 5.500 5.200 4.755 5.576 0.076 16 0 "[ . 1 . 2]" 1
24 1 23 GLN QB 1 24 ASP H . . 3.890 3.426 2.301 3.885 . 0 0 "[ . 1 . 2]" 1
25 1 23 GLN HB2 1 24 ASP H . . 4.630 4.069 2.675 4.586 . 0 0 "[ . 1 . 2]" 1
26 1 23 GLN HB3 1 24 ASP H . . 4.630 3.887 2.322 4.598 . 0 0 "[ . 1 . 2]" 1
27 1 23 GLN QG 1 24 ASP H . . 4.810 4.108 2.579 4.720 . 0 0 "[ . 1 . 2]" 1
28 1 23 GLN HG2 1 24 ASP H . . 5.500 4.602 2.649 5.178 . 0 0 "[ . 1 . 2]" 1
29 1 23 GLN HG3 1 24 ASP H . . 5.500 4.760 3.246 5.487 . 0 0 "[ . 1 . 2]" 1
30 1 24 ASP H 1 24 ASP HB2 . . 4.100 2.960 2.345 3.909 . 0 0 "[ . 1 . 2]" 1
31 1 24 ASP H 1 24 ASP QB . . 3.510 2.604 2.313 3.433 . 0 0 "[ . 1 . 2]" 1
32 1 24 ASP H 1 24 ASP HB3 . . 4.100 3.051 2.577 4.069 . 0 0 "[ . 1 . 2]" 1
33 1 24 ASP H 1 25 PRO QD . . 4.610 3.115 2.134 4.263 . 0 0 "[ . 1 . 2]" 1
34 1 24 ASP HA 1 25 PRO QD . . 3.540 2.063 1.919 2.290 . 0 0 "[ . 1 . 2]" 1
35 1 24 ASP HA 1 26 THR H . . 4.760 3.128 2.986 3.941 . 0 0 "[ . 1 . 2]" 1
36 1 24 ASP QB 1 25 PRO QD . . 3.870 3.704 1.969 3.835 . 0 0 "[ . 1 . 2]" 1
37 1 24 ASP QB 1 26 THR H . . 4.860 3.874 2.212 4.308 . 0 0 "[ . 1 . 2]" 1
38 1 24 ASP HB2 1 25 PRO HD2 . . 5.140 4.507 2.034 4.846 . 0 0 "[ . 1 . 2]" 1
39 1 24 ASP HB2 1 25 PRO HD3 . . 5.140 4.889 3.476 5.042 . 0 0 "[ . 1 . 2]" 1
40 1 24 ASP HB2 1 111 PRO HA . . 5.500 4.262 2.643 5.410 . 0 0 "[ . 1 . 2]" 1
41 1 24 ASP HB3 1 25 PRO HD2 . . 5.140 4.608 2.781 4.868 . 0 0 "[ . 1 . 2]" 1
42 1 24 ASP HB3 1 25 PRO HD3 . . 5.140 4.889 3.821 5.050 . 0 0 "[ . 1 . 2]" 1
43 1 24 ASP HB3 1 111 PRO HA . . 5.500 3.793 2.186 5.402 . 0 0 "[ . 1 . 2]" 1
44 1 25 PRO HA 1 26 THR MG . . 5.280 5.166 5.075 5.280 . 0 0 "[ . 1 . 2]" 1
45 1 25 PRO HA 1 27 ASN H . . 4.320 3.699 3.205 4.112 . 0 0 "[ . 1 . 2]" 1
46 1 25 PRO HA 1 108 PHE QD . . 4.560 3.527 2.900 4.356 . 0 0 "[ . 1 . 2]" 1
47 1 25 PRO QB 1 26 THR MG . . 5.220 4.539 4.088 4.850 . 0 0 "[ . 1 . 2]" 1
48 1 25 PRO QB 1 108 PHE QB . . 4.590 3.848 2.799 4.742 0.152 10 0 "[ . 1 . 2]" 1
49 1 25 PRO QB 1 108 PHE QD . . 4.290 3.269 2.602 4.159 . 0 0 "[ . 1 . 2]" 1
50 1 25 PRO QB 1 108 PHE QE . . 4.730 3.139 2.320 4.060 . 0 0 "[ . 1 . 2]" 1
51 1 25 PRO HB2 1 76 THR MG . . 4.290 2.466 1.969 3.035 . 0 0 "[ . 1 . 2]" 1
52 1 25 PRO HB2 1 108 PHE QD . . 5.000 3.517 2.704 4.587 . 0 0 "[ . 1 . 2]" 1
53 1 25 PRO HB3 1 76 THR MG . . 4.290 3.574 3.112 4.130 . 0 0 "[ . 1 . 2]" 1
54 1 25 PRO HB3 1 108 PHE QD . . 5.000 3.927 3.384 4.761 . 0 0 "[ . 1 . 2]" 1
55 1 25 PRO QD 1 26 THR H . . 4.160 2.818 2.775 2.958 . 0 0 "[ . 1 . 2]" 1
56 1 25 PRO QD 1 76 THR MG . . 5.350 4.599 3.694 4.882 . 0 0 "[ . 1 . 2]" 1
57 1 25 PRO HD2 1 26 THR H . . 4.920 2.883 2.836 3.041 . 0 0 "[ . 1 . 2]" 1
58 1 25 PRO HD3 1 26 THR H . . 4.920 3.967 3.942 4.049 . 0 0 "[ . 1 . 2]" 1
59 1 25 PRO QG 1 26 THR H . . 4.240 3.059 2.983 3.290 . 0 0 "[ . 1 . 2]" 1
60 1 25 PRO QG 1 26 THR MG . . 4.680 3.485 2.966 3.943 . 0 0 "[ . 1 . 2]" 1
61 1 25 PRO QG 1 76 THR MG . . 3.770 2.939 2.041 3.394 . 0 0 "[ . 1 . 2]" 1
62 1 25 PRO HG2 1 26 THR H . . 4.940 3.117 3.036 3.366 . 0 0 "[ . 1 . 2]" 1
63 1 25 PRO HG2 1 76 THR MG . . 4.600 3.217 2.175 3.729 . 0 0 "[ . 1 . 2]" 1
64 1 25 PRO HG3 1 26 THR H . . 4.940 4.442 4.380 4.632 . 0 0 "[ . 1 . 2]" 1
65 1 25 PRO HG3 1 76 THR MG . . 4.600 3.410 2.471 4.085 . 0 0 "[ . 1 . 2]" 1
66 1 26 THR H 1 26 THR MG . . 3.820 2.349 2.114 2.698 . 0 0 "[ . 1 . 2]" 1
67 1 26 THR H 1 27 ASN H . . 3.120 2.764 2.469 2.949 . 0 0 "[ . 1 . 2]" 1
68 1 26 THR H 1 27 ASN QB . . 4.900 4.649 4.258 4.979 0.079 9 0 "[ . 1 . 2]" 1
69 1 26 THR HA 1 76 THR HA . . 4.490 3.720 3.131 4.165 . 0 0 "[ . 1 . 2]" 1
70 1 26 THR HB 1 75 SER H . . 5.500 5.344 5.062 5.501 0.001 15 0 "[ . 1 . 2]" 1
71 1 26 THR MG 1 27 ASN H . . 4.470 4.075 3.955 4.176 . 0 0 "[ . 1 . 2]" 1
72 1 26 THR MG 1 73 MET HB2 . . 4.690 4.505 4.005 4.691 0.001 13 0 "[ . 1 . 2]" 1
73 1 26 THR MG 1 74 GLU HA . . 5.480 4.836 4.600 5.222 . 0 0 "[ . 1 . 2]" 1
74 1 26 THR MG 1 75 SER H . . 4.440 4.192 3.922 4.434 . 0 0 "[ . 1 . 2]" 1
75 1 26 THR MG 1 75 SER HA . . 3.440 2.366 2.058 2.607 . 0 0 "[ . 1 . 2]" 1
76 1 26 THR MG 1 75 SER HB2 . . 5.330 4.818 4.473 5.043 . 0 0 "[ . 1 . 2]" 1
77 1 26 THR MG 1 75 SER QB . . 4.610 4.191 3.938 4.319 . 0 0 "[ . 1 . 2]" 1
78 1 26 THR MG 1 75 SER HB3 . . 5.330 4.666 4.212 5.041 . 0 0 "[ . 1 . 2]" 1
79 1 26 THR MG 1 76 THR HA . . 4.780 4.398 3.930 4.900 0.120 6 0 "[ . 1 . 2]" 1
80 1 27 ASN H 1 27 ASN HB2 . . 3.930 2.504 2.203 3.617 . 0 0 "[ . 1 . 2]" 1
81 1 27 ASN H 1 27 ASN HB3 . . 3.930 3.039 2.341 3.611 . 0 0 "[ . 1 . 2]" 1
82 1 27 ASN H 1 27 ASN QD . . 4.610 4.358 3.971 4.607 . 0 0 "[ . 1 . 2]" 1
83 1 27 ASN HA 1 28 LEU H . . 3.260 2.266 2.142 2.436 . 0 0 "[ . 1 . 2]" 1
84 1 27 ASN HA 1 28 LEU HB2 . . 4.940 4.189 4.113 4.299 . 0 0 "[ . 1 . 2]" 1
85 1 27 ASN HA 1 71 ALA MB . . 5.310 4.877 4.598 4.991 . 0 0 "[ . 1 . 2]" 1
86 1 27 ASN HA 1 72 ARG HA . . 3.440 2.453 2.079 2.866 . 0 0 "[ . 1 . 2]" 1
87 1 27 ASN HA 1 72 ARG QB . . 4.650 3.908 3.525 4.449 . 0 0 "[ . 1 . 2]" 1
88 1 27 ASN HA 1 72 ARG QG . . 4.970 3.427 2.572 3.829 . 0 0 "[ . 1 . 2]" 1
89 1 27 ASN HA 1 73 MET H . . 4.720 3.602 3.197 4.165 . 0 0 "[ . 1 . 2]" 1
90 1 27 ASN QB 1 72 ARG QG . . 4.880 3.959 3.074 4.752 . 0 0 "[ . 1 . 2]" 1
91 1 27 ASN QB 1 109 SER QB . . 4.210 2.723 2.003 3.466 . 0 0 "[ . 1 . 2]" 1
92 1 27 ASN HB2 1 28 LEU H . . 4.830 3.992 2.608 4.395 . 0 0 "[ . 1 . 2]" 1
93 1 27 ASN HB3 1 28 LEU H . . 4.830 3.391 2.420 4.144 . 0 0 "[ . 1 . 2]" 1
94 1 27 ASN QD 1 70 PHE HB2 . . 5.270 4.406 3.494 5.326 0.056 20 0 "[ . 1 . 2]" 1
95 1 27 ASN QD 1 70 PHE HB3 . . 4.800 2.989 2.062 4.019 . 0 0 "[ . 1 . 2]" 1
96 1 28 LEU H 1 28 LEU HB2 . . 3.900 2.455 2.272 2.626 . 0 0 "[ . 1 . 2]" 1
97 1 28 LEU H 1 28 LEU HB3 . . 4.180 3.597 3.508 3.710 . 0 0 "[ . 1 . 2]" 1
98 1 28 LEU H 1 28 LEU MD2 . . 4.140 4.228 3.940 4.391 0.251 15 0 "[ . 1 . 2]" 1
99 1 28 LEU H 1 28 LEU HG . . 4.370 3.611 3.351 3.803 . 0 0 "[ . 1 . 2]" 1
100 1 28 LEU H 1 70 PHE HA . . 5.170 4.293 3.898 4.809 . 0 0 "[ . 1 . 2]" 1
101 1 28 LEU H 1 71 ALA H . . 3.960 3.056 2.534 3.305 . 0 0 "[ . 1 . 2]" 1
102 1 28 LEU H 1 71 ALA MB . . 4.750 3.964 3.516 4.178 . 0 0 "[ . 1 . 2]" 1
103 1 28 LEU H 1 72 ARG HA . . 4.630 3.819 3.118 4.078 . 0 0 "[ . 1 . 2]" 1
104 1 28 LEU HA 1 28 LEU MD1 . . 3.850 3.810 3.755 3.826 . 0 0 "[ . 1 . 2]" 1
105 1 28 LEU HA 1 28 LEU MD2 . . 4.020 2.093 1.912 2.366 . 0 0 "[ . 1 . 2]" 1
106 1 28 LEU HA 1 29 TYR H . . 3.170 2.178 2.147 2.288 . 0 0 "[ . 1 . 2]" 1
107 1 28 LEU HA 1 109 SER H . . 4.750 2.570 2.277 2.973 . 0 0 "[ . 1 . 2]" 1
108 1 28 LEU HA 1 109 SER HB2 . . 4.970 3.813 2.992 4.866 . 0 0 "[ . 1 . 2]" 1
109 1 28 LEU HA 1 109 SER QB . . 4.340 3.247 2.865 3.775 . 0 0 "[ . 1 . 2]" 1
110 1 28 LEU HA 1 109 SER HB3 . . 4.970 3.727 2.970 4.940 . 0 0 "[ . 1 . 2]" 1
111 1 28 LEU HB2 1 28 LEU MD2 . . 3.370 3.177 3.159 3.191 . 0 0 "[ . 1 . 2]" 1
112 1 28 LEU HB2 1 29 TYR H . . 4.610 4.303 4.078 4.370 . 0 0 "[ . 1 . 2]" 1
113 1 28 LEU HB2 1 30 ILE MD . . 3.950 3.239 3.085 3.379 . 0 0 "[ . 1 . 2]" 1
114 1 28 LEU HB2 1 30 ILE HG12 . . 4.690 4.519 4.273 4.689 . 0 0 "[ . 1 . 2]" 1
115 1 28 LEU HB2 1 30 ILE HG13 . . 4.380 3.768 3.643 3.862 . 0 0 "[ . 1 . 2]" 1
116 1 28 LEU HB2 1 70 PHE HA . . 5.500 5.191 4.829 5.499 . 0 0 "[ . 1 . 2]" 1
117 1 28 LEU HB2 1 71 ALA H . . 4.130 3.620 3.280 3.886 . 0 0 "[ . 1 . 2]" 1
118 1 28 LEU HB2 1 71 ALA MB . . 3.810 3.243 2.275 3.609 . 0 0 "[ . 1 . 2]" 1
119 1 28 LEU HB3 1 28 LEU MD1 . . 3.660 2.384 2.159 2.568 . 0 0 "[ . 1 . 2]" 1
120 1 28 LEU HB3 1 28 LEU MD2 . . 3.020 2.304 2.157 2.420 . 0 0 "[ . 1 . 2]" 1
121 1 28 LEU HB3 1 29 TYR H . . 4.170 3.211 2.802 3.360 . 0 0 "[ . 1 . 2]" 1
122 1 28 LEU HB3 1 30 ILE H . . 5.120 4.578 4.470 4.805 . 0 0 "[ . 1 . 2]" 1
123 1 28 LEU HB3 1 30 ILE MD . . 3.190 3.171 3.082 3.194 0.004 16 0 "[ . 1 . 2]" 1
124 1 28 LEU HB3 1 30 ILE HG13 . . 4.620 2.895 2.825 2.983 . 0 0 "[ . 1 . 2]" 1
125 1 28 LEU HB3 1 71 ALA H . . 5.440 4.544 4.211 4.777 . 0 0 "[ . 1 . 2]" 1
126 1 28 LEU MD1 1 29 TYR H . . 5.030 4.840 4.600 4.971 . 0 0 "[ . 1 . 2]" 1
127 1 28 LEU MD1 1 73 MET QG . . 3.590 2.138 1.878 2.652 . 0 0 "[ . 1 . 2]" 1
128 1 28 LEU MD1 1 79 CYS HA . . 4.060 2.088 1.950 2.319 . 0 0 "[ . 1 . 2]" 1
129 1 28 LEU MD1 1 79 CYS HB2 . . 4.300 4.079 3.794 4.306 0.006 14 0 "[ . 1 . 2]" 1
130 1 28 LEU MD1 1 79 CYS QB . . 3.540 2.838 2.465 3.192 . 0 0 "[ . 1 . 2]" 1
131 1 28 LEU MD1 1 79 CYS HB3 . . 4.300 2.897 2.497 3.291 . 0 0 "[ . 1 . 2]" 1
132 1 28 LEU MD1 1 82 VAL HB . . 4.360 2.171 1.950 2.409 . 0 0 "[ . 1 . 2]" 1
133 1 28 LEU MD1 1 82 VAL QG . . 3.860 2.024 1.911 2.203 . 0 0 "[ . 1 . 2]" 1
134 1 28 LEU MD1 1 83 ILE H . . 4.760 3.236 2.839 3.504 . 0 0 "[ . 1 . 2]" 1
135 1 28 LEU MD1 1 83 ILE MD . . 3.320 3.425 3.238 3.491 0.171 5 0 "[ . 1 . 2]" 1
136 1 28 LEU MD1 1 83 ILE HG12 . . 4.250 3.713 2.600 4.144 . 0 0 "[ . 1 . 2]" 1
137 1 28 LEU MD1 1 83 ILE HG13 . . 3.820 2.798 2.530 2.984 . 0 0 "[ . 1 . 2]" 1
138 1 28 LEU MD1 1 108 PHE HA . . 5.350 5.202 5.001 5.355 0.005 17 0 "[ . 1 . 2]" 1
139 1 28 LEU MD1 1 108 PHE QD . . 5.040 4.960 4.814 5.047 0.007 14 0 "[ . 1 . 2]" 1
140 1 28 LEU MD1 1 108 PHE QE . . 4.960 4.515 4.046 4.897 . 0 0 "[ . 1 . 2]" 1
141 1 28 LEU MD2 1 29 TYR H . . 4.780 2.777 2.468 3.144 . 0 0 "[ . 1 . 2]" 1
142 1 28 LEU MD2 1 73 MET HB2 . . 5.500 5.615 4.693 5.876 0.376 10 0 "[ . 1 . 2]" 1
143 1 28 LEU MD2 1 73 MET QG . . 4.500 4.222 3.639 4.413 . 0 0 "[ . 1 . 2]" 1
144 1 28 LEU MD2 1 79 CYS HA . . 3.650 3.520 2.749 3.777 0.127 8 0 "[ . 1 . 2]" 1
145 1 28 LEU MD2 1 79 CYS QB . . 3.500 2.444 1.920 2.896 . 0 0 "[ . 1 . 2]" 1
146 1 28 LEU MD2 1 79 CYS HG . . 4.440 3.468 2.423 4.080 . 0 0 "[ . 1 . 2]" 1
147 1 28 LEU MD2 1 82 VAL H . . 5.500 5.263 4.717 5.423 . 0 0 "[ . 1 . 2]" 1
148 1 28 LEU MD2 1 82 VAL HB . . 4.140 3.538 3.336 3.680 . 0 0 "[ . 1 . 2]" 1
149 1 28 LEU MD2 1 83 ILE H . . 4.900 3.525 3.394 3.704 . 0 0 "[ . 1 . 2]" 1
150 1 28 LEU MD2 1 83 ILE MD . . 4.470 1.893 1.792 1.992 . 0 0 "[ . 1 . 2]" 1
151 1 28 LEU MD2 1 83 ILE HG12 . . 4.640 2.371 2.114 2.613 . 0 0 "[ . 1 . 2]" 1
152 1 28 LEU MD2 1 83 ILE HG13 . . 3.690 2.034 1.942 2.295 . 0 0 "[ . 1 . 2]" 1
153 1 28 LEU HG 1 73 MET QG . . 4.720 3.225 2.464 3.579 . 0 0 "[ . 1 . 2]" 1
154 1 28 LEU HG 1 79 CYS QB . . 4.910 3.097 2.726 3.747 . 0 0 "[ . 1 . 2]" 1
155 1 28 LEU HG 1 79 CYS HG . . 4.590 2.421 2.000 3.938 . 0 0 "[ . 1 . 2]" 1
156 1 28 LEU HG 1 82 VAL QG . . 5.180 4.296 3.944 4.459 . 0 0 "[ . 1 . 2]" 1
157 1 29 TYR H 1 29 TYR QB . . 3.790 2.286 2.240 2.381 . 0 0 "[ . 1 . 2]" 1
158 1 29 TYR H 1 29 TYR QD . . 4.630 4.191 4.113 4.264 . 0 0 "[ . 1 . 2]" 1
159 1 29 TYR H 1 30 ILE HG13 . . 5.110 4.242 3.968 4.327 . 0 0 "[ . 1 . 2]" 1
160 1 29 TYR H 1 107 LYS H . . 3.880 3.005 2.828 3.217 . 0 0 "[ . 1 . 2]" 1
161 1 29 TYR H 1 107 LYS QG . . 5.260 3.573 3.348 3.756 . 0 0 "[ . 1 . 2]" 1
162 1 29 TYR H 1 108 PHE HA . . 4.840 3.572 3.300 3.840 . 0 0 "[ . 1 . 2]" 1
163 1 29 TYR H 1 109 SER HA . . 4.980 4.069 3.677 4.379 . 0 0 "[ . 1 . 2]" 1
164 1 29 TYR H 1 109 SER HB2 . . 5.240 3.241 2.322 4.792 . 0 0 "[ . 1 . 2]" 1
165 1 29 TYR H 1 109 SER QB . . 4.480 2.840 2.304 3.829 . 0 0 "[ . 1 . 2]" 1
166 1 29 TYR H 1 109 SER HB3 . . 5.240 3.776 2.391 4.686 . 0 0 "[ . 1 . 2]" 1
167 1 29 TYR HA 1 30 ILE H . . 3.070 2.179 2.156 2.189 . 0 0 "[ . 1 . 2]" 1
168 1 29 TYR HA 1 30 ILE HG12 . . 5.200 5.165 5.017 5.313 0.113 8 0 "[ . 1 . 2]" 1
169 1 29 TYR HA 1 30 ILE HG13 . . 4.330 3.727 3.635 3.825 . 0 0 "[ . 1 . 2]" 1
170 1 29 TYR HA 1 70 PHE HA . . 4.130 4.004 3.691 4.126 . 0 0 "[ . 1 . 2]" 1
171 1 29 TYR QB 1 30 ILE H . . 5.360 3.916 3.872 3.939 . 0 0 "[ . 1 . 2]" 1
172 1 29 TYR QB 1 68 VAL QG . . 5.280 4.792 4.588 4.886 . 0 0 "[ . 1 . 2]" 1
173 1 29 TYR QB 1 107 LYS H . . 4.700 2.839 2.641 2.982 . 0 0 "[ . 1 . 2]" 1
174 1 29 TYR QB 1 107 LYS HB2 . . 5.500 4.098 3.921 4.349 . 0 0 "[ . 1 . 2]" 1
175 1 29 TYR QB 1 107 LYS HB3 . . 5.500 4.095 4.018 4.239 . 0 0 "[ . 1 . 2]" 1
176 1 29 TYR QB 1 107 LYS QG . . 3.610 1.798 1.752 1.907 . 0 0 "[ . 1 . 2]" 1
177 1 29 TYR QB 1 109 SER HA . . 4.250 2.542 2.101 2.758 . 0 0 "[ . 1 . 2]" 1
178 1 29 TYR QB 1 109 SER HB2 . . 4.550 2.473 1.991 3.967 . 0 0 "[ . 1 . 2]" 1
179 1 29 TYR QB 1 109 SER QB . . 3.300 2.222 1.981 3.373 0.073 15 0 "[ . 1 . 2]" 1
180 1 29 TYR QB 1 109 SER HB3 . . 4.550 3.415 2.038 3.970 . 0 0 "[ . 1 . 2]" 1
181 1 29 TYR QD 1 30 ILE H . . 4.610 3.639 3.506 3.966 . 0 0 "[ . 1 . 2]" 1
182 1 29 TYR QD 1 30 ILE HA . . 4.840 3.926 3.750 4.245 . 0 0 "[ . 1 . 2]" 1
183 1 29 TYR QD 1 68 VAL QG . . 3.830 3.378 3.264 3.504 . 0 0 "[ . 1 . 2]" 1
184 1 29 TYR QD 1 70 PHE QD . . 4.600 4.476 4.173 4.599 . 0 0 "[ . 1 . 2]" 1
185 1 29 TYR QD 1 70 PHE QE . . 3.880 2.637 2.044 3.306 . 0 0 "[ . 1 . 2]" 1
186 1 29 TYR QD 1 70 PHE HZ . . 4.630 3.877 3.144 4.365 . 0 0 "[ . 1 . 2]" 1
187 1 29 TYR QD 1 105 LEU MD2 . . 4.300 3.956 3.464 4.263 . 0 0 "[ . 1 . 2]" 1
188 1 29 TYR QD 1 107 LYS H . . 4.780 4.542 4.234 4.664 . 0 0 "[ . 1 . 2]" 1
189 1 29 TYR QD 1 107 LYS HD2 . . 5.500 5.068 4.683 5.436 . 0 0 "[ . 1 . 2]" 1
190 1 29 TYR QD 1 107 LYS HD3 . . 5.500 4.529 3.047 5.085 . 0 0 "[ . 1 . 2]" 1
191 1 29 TYR QD 1 107 LYS HE2 . . 4.640 3.551 3.030 4.415 . 0 0 "[ . 1 . 2]" 1
192 1 29 TYR QD 1 107 LYS QE . . 4.060 2.906 2.721 3.799 . 0 0 "[ . 1 . 2]" 1
193 1 29 TYR QD 1 107 LYS HE3 . . 4.640 3.169 2.798 4.144 . 0 0 "[ . 1 . 2]" 1
194 1 29 TYR QD 1 107 LYS HG2 . . 4.270 3.327 3.074 3.542 . 0 0 "[ . 1 . 2]" 1
195 1 29 TYR QD 1 107 LYS QG . . 3.690 3.126 2.930 3.358 . 0 0 "[ . 1 . 2]" 1
196 1 29 TYR QD 1 107 LYS HG3 . . 4.270 3.806 3.678 4.170 . 0 0 "[ . 1 . 2]" 1
197 1 29 TYR QD 1 109 SER HA . . 4.620 2.795 2.422 3.287 . 0 0 "[ . 1 . 2]" 1
198 1 29 TYR QD 1 109 SER QB . . 4.770 2.611 2.018 3.362 . 0 0 "[ . 1 . 2]" 1
199 1 29 TYR QE 1 31 SER HB2 . . 4.520 4.128 3.817 4.351 . 0 0 "[ . 1 . 2]" 1
200 1 29 TYR QE 1 31 SER QB . . 3.850 3.160 2.460 3.756 . 0 0 "[ . 1 . 2]" 1
201 1 29 TYR QE 1 31 SER HB3 . . 4.520 3.455 2.482 4.349 . 0 0 "[ . 1 . 2]" 1
202 1 29 TYR QE 1 58 LEU MD1 . . 4.500 4.419 4.232 4.503 0.003 4 0 "[ . 1 . 2]" 1
203 1 29 TYR QE 1 68 VAL HB . . 5.270 5.188 4.934 5.271 0.001 16 0 "[ . 1 . 2]" 1
204 1 29 TYR QE 1 68 VAL MG1 . . 4.100 2.734 2.413 3.079 . 0 0 "[ . 1 . 2]" 1
205 1 29 TYR QE 1 68 VAL QG . . 3.310 2.589 2.341 2.780 . 0 0 "[ . 1 . 2]" 1
206 1 29 TYR QE 1 68 VAL MG2 . . 4.100 3.258 3.023 3.514 . 0 0 "[ . 1 . 2]" 1
207 1 29 TYR QE 1 70 PHE QE . . 4.870 3.258 2.754 3.411 . 0 0 "[ . 1 . 2]" 1
208 1 29 TYR QE 1 70 PHE HZ . . 4.800 2.820 2.239 3.327 . 0 0 "[ . 1 . 2]" 1
209 1 29 TYR QE 1 105 LEU MD2 . . 4.690 4.486 4.008 4.778 0.088 12 0 "[ . 1 . 2]" 1
210 1 29 TYR QE 1 107 LYS HE2 . . 5.500 4.010 3.440 5.063 . 0 0 "[ . 1 . 2]" 1
211 1 29 TYR QE 1 107 LYS HE3 . . 5.500 4.001 3.665 5.190 . 0 0 "[ . 1 . 2]" 1
212 1 29 TYR QE 1 109 SER HA . . 5.500 4.872 4.540 5.164 . 0 0 "[ . 1 . 2]" 1
213 1 30 ILE H 1 30 ILE HB . . 3.640 2.731 2.665 2.788 . 0 0 "[ . 1 . 2]" 1
214 1 30 ILE H 1 30 ILE MD . . 4.330 3.633 3.543 3.767 . 0 0 "[ . 1 . 2]" 1
215 1 30 ILE H 1 30 ILE HG12 . . 4.540 3.733 3.614 3.852 . 0 0 "[ . 1 . 2]" 1
216 1 30 ILE H 1 30 ILE HG13 . . 4.020 2.367 2.225 2.510 . 0 0 "[ . 1 . 2]" 1
217 1 30 ILE H 1 30 ILE MG . . 4.090 3.871 3.852 3.898 . 0 0 "[ . 1 . 2]" 1
218 1 30 ILE H 1 31 SER H . . 4.700 4.301 4.123 4.440 . 0 0 "[ . 1 . 2]" 1
219 1 30 ILE H 1 68 VAL QG . . 4.250 3.556 3.308 3.799 . 0 0 "[ . 1 . 2]" 1
220 1 30 ILE H 1 69 GLY H . . 3.970 3.775 3.539 3.961 . 0 0 "[ . 1 . 2]" 1
221 1 30 ILE H 1 70 PHE HA . . 4.510 3.599 3.375 3.820 . 0 0 "[ . 1 . 2]" 1
222 1 30 ILE H 1 70 PHE QD . . 5.210 4.202 3.469 5.048 . 0 0 "[ . 1 . 2]" 1
223 1 30 ILE HA 1 30 ILE MD . . 4.260 3.941 3.915 3.971 . 0 0 "[ . 1 . 2]" 1
224 1 30 ILE HA 1 30 ILE HG12 . . 3.840 2.785 2.714 2.851 . 0 0 "[ . 1 . 2]" 1
225 1 30 ILE HA 1 30 ILE HG13 . . 3.970 3.034 2.940 3.125 . 0 0 "[ . 1 . 2]" 1
226 1 30 ILE HA 1 30 ILE MG . . 3.290 2.264 2.171 2.375 . 0 0 "[ . 1 . 2]" 1
227 1 30 ILE HA 1 31 SER H . . 3.010 2.146 2.139 2.163 . 0 0 "[ . 1 . 2]" 1
228 1 30 ILE HA 1 106 CYS HA . . 3.550 2.772 2.662 2.979 . 0 0 "[ . 1 . 2]" 1
229 1 30 ILE HA 1 106 CYS HB2 . . 5.500 5.185 4.475 5.502 0.002 16 0 "[ . 1 . 2]" 1
230 1 30 ILE HA 1 106 CYS HB3 . . 5.500 5.056 4.438 5.502 0.002 9 0 "[ . 1 . 2]" 1
231 1 30 ILE HA 1 107 LYS H . . 4.310 4.117 3.866 4.289 . 0 0 "[ . 1 . 2]" 1
232 1 30 ILE HB 1 30 ILE MD . . 3.190 2.261 2.207 2.314 . 0 0 "[ . 1 . 2]" 1
233 1 30 ILE HB 1 31 SER H . . 4.830 4.176 3.974 4.297 . 0 0 "[ . 1 . 2]" 1
234 1 30 ILE HB 1 69 GLY H . . 4.200 2.951 2.718 3.354 . 0 0 "[ . 1 . 2]" 1
235 1 30 ILE HB 1 69 GLY HA3 . . 4.820 3.734 3.467 4.067 . 0 0 "[ . 1 . 2]" 1
236 1 30 ILE MD 1 30 ILE MG . . 2.990 2.263 2.130 2.369 . 0 0 "[ . 1 . 2]" 1
237 1 30 ILE MD 1 31 SER H . . 5.380 5.367 5.184 5.494 0.114 9 0 "[ . 1 . 2]" 1
238 1 30 ILE MD 1 71 ALA H . . 4.590 3.314 3.015 3.683 . 0 0 "[ . 1 . 2]" 1
239 1 30 ILE MD 1 106 CYS HA . . 5.250 5.002 4.660 5.193 . 0 0 "[ . 1 . 2]" 1
240 1 30 ILE MD 1 106 CYS HB3 . . 5.500 5.411 4.876 5.928 0.428 14 0 "[ . 1 . 2]" 1
241 1 30 ILE HG12 1 30 ILE MG . . 3.200 2.180 2.114 2.326 . 0 0 "[ . 1 . 2]" 1
242 1 30 ILE HG12 1 31 SER H . . 5.280 4.782 4.635 4.927 . 0 0 "[ . 1 . 2]" 1
243 1 30 ILE HG12 1 106 CYS HA . . 4.430 3.551 3.138 3.801 . 0 0 "[ . 1 . 2]" 1
244 1 30 ILE HG12 1 106 CYS HB2 . . 5.500 4.868 3.802 5.335 . 0 0 "[ . 1 . 2]" 1
245 1 30 ILE HG12 1 106 CYS HB3 . . 5.500 4.378 3.686 4.984 . 0 0 "[ . 1 . 2]" 1
246 1 30 ILE HG12 1 107 LYS H . . 5.500 4.716 4.458 4.971 . 0 0 "[ . 1 . 2]" 1
247 1 30 ILE HG13 1 30 ILE MG . . 3.610 3.173 3.161 3.185 . 0 0 "[ . 1 . 2]" 1
248 1 30 ILE HG13 1 106 CYS HA . . 5.150 4.294 3.888 4.508 . 0 0 "[ . 1 . 2]" 1
249 1 30 ILE MG 1 31 SER H . . 3.560 2.690 2.312 2.974 . 0 0 "[ . 1 . 2]" 1
250 1 30 ILE MG 1 31 SER HA . . 4.750 3.908 3.621 4.100 . 0 0 "[ . 1 . 2]" 1
251 1 30 ILE MG 1 32 ASN H . . 5.500 5.368 5.167 5.499 . 0 0 "[ . 1 . 2]" 1
252 1 30 ILE MG 1 45 MET ME . . 2.950 2.244 2.100 2.369 . 0 0 "[ . 1 . 2]" 1
253 1 30 ILE MG 1 69 GLY H . . 4.600 3.820 3.311 4.140 . 0 0 "[ . 1 . 2]" 1
254 1 30 ILE MG 1 104 LEU HB3 . . 3.990 2.930 2.491 3.302 . 0 0 "[ . 1 . 2]" 1
255 1 30 ILE MG 1 104 LEU HG . . 5.140 4.784 4.442 5.104 . 0 0 "[ . 1 . 2]" 1
256 1 30 ILE MG 1 105 LEU H . . 4.310 3.749 3.486 3.861 . 0 0 "[ . 1 . 2]" 1
257 1 30 ILE MG 1 106 CYS HA . . 4.170 3.845 3.550 4.033 . 0 0 "[ . 1 . 2]" 1
258 1 30 ILE MG 1 106 CYS HB2 . . 5.460 4.800 3.762 5.136 . 0 0 "[ . 1 . 2]" 1
259 1 30 ILE MG 1 106 CYS HB3 . . 5.500 5.009 4.535 5.309 . 0 0 "[ . 1 . 2]" 1
260 1 31 SER H 1 31 SER HB2 . . 4.130 3.121 2.459 3.823 . 0 0 "[ . 1 . 2]" 1
261 1 31 SER H 1 31 SER HB3 . . 4.130 3.526 2.957 3.873 . 0 0 "[ . 1 . 2]" 1
262 1 31 SER H 1 68 VAL QG . . 5.330 4.040 3.805 4.236 . 0 0 "[ . 1 . 2]" 1
263 1 31 SER H 1 104 LEU HA . . 5.250 4.708 4.221 4.941 . 0 0 "[ . 1 . 2]" 1
264 1 31 SER H 1 105 LEU H . . 3.900 3.223 3.049 3.401 . 0 0 "[ . 1 . 2]" 1
265 1 31 SER H 1 105 LEU HB2 . . 4.440 4.353 3.907 4.714 0.274 3 0 "[ . 1 . 2]" 1
266 1 31 SER H 1 105 LEU HB3 . . 4.310 2.824 2.514 3.125 . 0 0 "[ . 1 . 2]" 1
267 1 31 SER H 1 105 LEU MD2 . . 4.640 3.955 3.694 4.180 . 0 0 "[ . 1 . 2]" 1
268 1 31 SER H 1 105 LEU HG . . 4.990 4.638 4.329 4.905 . 0 0 "[ . 1 . 2]" 1
269 1 31 SER H 1 106 CYS HA . . 4.530 4.029 3.794 4.359 . 0 0 "[ . 1 . 2]" 1
270 1 31 SER HA 1 32 ASN H . . 3.170 2.637 2.593 2.654 . 0 0 "[ . 1 . 2]" 1
271 1 31 SER HA 1 32 ASN HA . . 4.690 4.685 4.660 4.697 0.007 8 0 "[ . 1 . 2]" 1
272 1 31 SER HA 1 33 LEU H . . 3.990 3.707 3.431 3.935 . 0 0 "[ . 1 . 2]" 1
273 1 31 SER HA 1 33 LEU MD1 . . 5.140 3.614 3.507 3.672 . 0 0 "[ . 1 . 2]" 1
274 1 31 SER HA 1 33 LEU HG . . 4.620 2.776 2.670 2.888 . 0 0 "[ . 1 . 2]" 1
275 1 31 SER HA 1 68 VAL HA . . 3.330 2.088 1.999 2.257 . 0 0 "[ . 1 . 2]" 1
276 1 31 SER HA 1 68 VAL HB . . 5.090 4.547 4.351 4.740 . 0 0 "[ . 1 . 2]" 1
277 1 31 SER HA 1 68 VAL MG1 . . 4.100 2.854 2.654 3.120 . 0 0 "[ . 1 . 2]" 1
278 1 31 SER HA 1 68 VAL QG . . 3.410 2.296 2.064 2.523 . 0 0 "[ . 1 . 2]" 1
279 1 31 SER HA 1 68 VAL MG2 . . 4.100 2.431 2.134 2.796 . 0 0 "[ . 1 . 2]" 1
280 1 31 SER HA 1 69 GLY H . . 4.270 3.420 3.235 3.691 . 0 0 "[ . 1 . 2]" 1
281 1 31 SER QB 1 32 ASN H . . 3.110 1.972 1.914 2.121 . 0 0 "[ . 1 . 2]" 1
282 1 31 SER QB 1 32 ASN HA . . 4.160 3.877 3.807 4.165 0.005 10 0 "[ . 1 . 2]" 1
283 1 31 SER QB 1 33 LEU H . . 4.660 4.367 4.201 4.536 . 0 0 "[ . 1 . 2]" 1
284 1 31 SER QB 1 68 VAL HA . . 4.220 3.796 3.465 4.248 0.028 11 0 "[ . 1 . 2]" 1
285 1 31 SER QB 1 68 VAL QG . . 3.180 2.384 1.990 2.908 . 0 0 "[ . 1 . 2]" 1
286 1 31 SER QB 1 105 LEU HB2 . . 4.300 4.126 3.761 4.387 0.087 14 0 "[ . 1 . 2]" 1
287 1 31 SER HB2 1 32 ASN H . . 3.680 2.629 1.926 3.440 . 0 0 "[ . 1 . 2]" 1
288 1 31 SER HB2 1 68 VAL HA . . 5.020 4.676 3.787 5.095 0.075 1 0 "[ . 1 . 2]" 1
289 1 31 SER HB2 1 68 VAL MG1 . . 4.380 4.143 3.396 4.383 0.003 17 0 "[ . 1 . 2]" 1
290 1 31 SER HB2 1 68 VAL MG2 . . 4.380 3.382 2.488 3.979 . 0 0 "[ . 1 . 2]" 1
291 1 31 SER HB2 1 105 LEU HB2 . . 5.050 4.312 3.886 4.910 . 0 0 "[ . 1 . 2]" 1
292 1 31 SER HB2 1 105 LEU HB3 . . 4.170 3.127 2.366 4.189 0.019 10 0 "[ . 1 . 2]" 1
293 1 31 SER HB3 1 32 ASN H . . 3.680 2.644 1.935 3.641 . 0 0 "[ . 1 . 2]" 1
294 1 31 SER HB3 1 68 VAL HA . . 5.020 4.030 3.653 4.561 . 0 0 "[ . 1 . 2]" 1
295 1 31 SER HB3 1 68 VAL MG1 . . 4.380 3.335 2.406 4.335 . 0 0 "[ . 1 . 2]" 1
296 1 31 SER HB3 1 68 VAL MG2 . . 4.380 2.601 2.085 3.119 . 0 0 "[ . 1 . 2]" 1
297 1 31 SER HB3 1 105 LEU HB2 . . 5.050 5.352 4.887 5.668 0.618 14 6 "[ . 1 * +* *-*2]" 1
298 1 31 SER HB3 1 105 LEU HB3 . . 4.170 4.059 3.607 4.191 0.021 4 0 "[ . 1 . 2]" 1
299 1 32 ASN H 1 32 ASN HA . . 2.890 2.274 2.273 2.275 . 0 0 "[ . 1 . 2]" 1
300 1 32 ASN H 1 33 LEU H . . 3.300 2.716 2.657 2.780 . 0 0 "[ . 1 . 2]" 1
301 1 32 ASN H 1 33 LEU MD1 . . 5.500 5.096 4.997 5.177 . 0 0 "[ . 1 . 2]" 1
302 1 32 ASN H 1 33 LEU HG . . 4.900 3.734 3.663 3.800 . 0 0 "[ . 1 . 2]" 1
303 1 32 ASN H 1 68 VAL HA . . 4.550 4.012 3.768 4.222 . 0 0 "[ . 1 . 2]" 1
304 1 32 ASN H 1 68 VAL MG1 . . 4.920 4.716 4.417 4.909 . 0 0 "[ . 1 . 2]" 1
305 1 32 ASN H 1 68 VAL QG . . 3.980 2.958 2.703 3.100 . 0 0 "[ . 1 . 2]" 1
306 1 32 ASN H 1 68 VAL MG2 . . 4.920 2.989 2.727 3.136 . 0 0 "[ . 1 . 2]" 1
307 1 32 ASN H 1 104 LEU MD2 . . 5.500 5.230 5.129 5.339 . 0 0 "[ . 1 . 2]" 1
308 1 32 ASN HA 1 33 LEU H . . 3.450 2.713 2.616 2.835 . 0 0 "[ . 1 . 2]" 1
309 1 32 ASN QB 1 104 LEU HA . . 3.340 2.743 2.643 2.849 . 0 0 "[ . 1 . 2]" 1
310 1 32 ASN QB 1 104 LEU MD2 . . 3.850 3.362 3.114 3.654 . 0 0 "[ . 1 . 2]" 1
311 1 32 ASN QB 1 105 LEU H . . 4.030 2.379 2.245 2.571 . 0 0 "[ . 1 . 2]" 1
312 1 32 ASN HB2 1 104 LEU HA . . 3.960 2.913 2.706 3.074 . 0 0 "[ . 1 . 2]" 1
313 1 32 ASN HB2 1 104 LEU MD2 . . 4.400 3.737 3.467 4.104 . 0 0 "[ . 1 . 2]" 1
314 1 32 ASN HB2 1 105 LEU H . . 4.830 2.403 2.267 2.597 . 0 0 "[ . 1 . 2]" 1
315 1 32 ASN HB3 1 104 LEU HA . . 3.960 3.378 3.219 3.737 . 0 0 "[ . 1 . 2]" 1
316 1 32 ASN HB3 1 104 LEU MD2 . . 4.400 3.835 3.414 4.166 . 0 0 "[ . 1 . 2]" 1
317 1 32 ASN HB3 1 105 LEU H . . 4.830 3.809 3.586 4.129 . 0 0 "[ . 1 . 2]" 1
318 1 32 ASN HD21 1 102 GLU HB2 . . 4.820 3.297 2.917 3.695 . 0 0 "[ . 1 . 2]" 1
319 1 32 ASN HD21 1 102 GLU QB . . 4.150 2.290 1.952 2.714 . 0 0 "[ . 1 . 2]" 1
320 1 32 ASN HD21 1 102 GLU HB3 . . 4.820 2.339 1.973 2.792 . 0 0 "[ . 1 . 2]" 1
321 1 32 ASN HD21 1 104 LEU HA . . 4.320 4.336 4.134 4.563 0.243 15 0 "[ . 1 . 2]" 1
322 1 32 ASN HD21 1 105 LEU H . . 4.490 4.178 3.818 4.486 . 0 0 "[ . 1 . 2]" 1
323 1 32 ASN HD21 1 105 LEU HB2 . . 4.590 3.978 3.367 4.486 . 0 0 "[ . 1 . 2]" 1
324 1 32 ASN HD22 1 102 GLU HB2 . . 4.480 3.890 3.635 4.166 . 0 0 "[ . 1 . 2]" 1
325 1 32 ASN HD22 1 102 GLU QB . . 3.860 2.714 2.367 3.062 . 0 0 "[ . 1 . 2]" 1
326 1 32 ASN HD22 1 102 GLU HB3 . . 4.480 2.772 2.398 3.150 . 0 0 "[ . 1 . 2]" 1
327 1 32 ASN HD22 1 102 GLU HG2 . . 5.500 4.697 3.750 5.422 . 0 0 "[ . 1 . 2]" 1
328 1 32 ASN HD22 1 102 GLU HG3 . . 5.500 4.760 3.646 5.480 . 0 0 "[ . 1 . 2]" 1
329 1 32 ASN HD22 1 105 LEU H . . 5.500 5.250 4.955 5.409 . 0 0 "[ . 1 . 2]" 1
330 1 32 ASN HD22 1 105 LEU HB2 . . 4.900 4.294 3.907 4.596 . 0 0 "[ . 1 . 2]" 1
331 1 32 ASN HD22 1 105 LEU MD1 . . 5.030 4.716 4.117 5.029 . 0 0 "[ . 1 . 2]" 1
332 1 33 LEU H 1 33 LEU HB2 . . 3.420 2.781 2.744 2.863 . 0 0 "[ . 1 . 2]" 1
333 1 33 LEU H 1 33 LEU HB3 . . 4.020 3.723 3.669 3.773 . 0 0 "[ . 1 . 2]" 1
334 1 33 LEU H 1 33 LEU MD1 . . 4.060 3.936 3.842 3.995 . 0 0 "[ . 1 . 2]" 1
335 1 33 LEU H 1 33 LEU MD2 . . 4.220 2.889 2.644 3.247 . 0 0 "[ . 1 . 2]" 1
336 1 33 LEU H 1 33 LEU HG . . 3.210 2.419 2.248 2.548 . 0 0 "[ . 1 . 2]" 1
337 1 33 LEU H 1 34 PRO HD2 . . 4.820 4.810 4.799 4.815 . 0 0 "[ . 1 . 2]" 1
338 1 33 LEU H 1 34 PRO HD3 . . 5.350 5.026 5.002 5.050 . 0 0 "[ . 1 . 2]" 1
339 1 33 LEU H 1 67 GLY HA2 . . 4.170 2.714 2.545 2.966 . 0 0 "[ . 1 . 2]" 1
340 1 33 LEU H 1 67 GLY HA3 . . 4.100 2.691 2.496 2.975 . 0 0 "[ . 1 . 2]" 1
341 1 33 LEU H 1 104 LEU MD2 . . 4.620 4.448 4.288 4.588 . 0 0 "[ . 1 . 2]" 1
342 1 33 LEU HA 1 33 LEU MD2 . . 4.560 2.166 1.972 2.288 . 0 0 "[ . 1 . 2]" 1
343 1 33 LEU HA 1 33 LEU HG . . 4.170 3.523 3.434 3.594 . 0 0 "[ . 1 . 2]" 1
344 1 33 LEU HA 1 34 PRO HD2 . . 3.250 2.389 2.379 2.417 . 0 0 "[ . 1 . 2]" 1
345 1 33 LEU HA 1 34 PRO HD3 . . 3.120 2.296 2.292 2.307 . 0 0 "[ . 1 . 2]" 1
346 1 33 LEU HA 1 34 PRO HG2 . . 4.690 4.503 4.495 4.527 . 0 0 "[ . 1 . 2]" 1
347 1 33 LEU HA 1 91 ILE MD . . 4.160 4.022 3.787 4.242 0.082 4 0 "[ . 1 . 2]" 1
348 1 33 LEU HA 1 100 PRO QG . . 4.470 4.043 3.942 4.128 . 0 0 "[ . 1 . 2]" 1
349 1 33 LEU HA 1 104 LEU MD1 . . 5.040 5.188 5.085 5.327 0.287 19 0 "[ . 1 . 2]" 1
350 1 33 LEU HA 1 104 LEU MD2 . . 3.060 2.953 2.841 3.036 . 0 0 "[ . 1 . 2]" 1
351 1 33 LEU HB2 1 33 LEU MD1 . . 3.480 2.360 2.290 2.444 . 0 0 "[ . 1 . 2]" 1
352 1 33 LEU HB2 1 33 LEU MD2 . . 3.490 3.180 3.173 3.187 . 0 0 "[ . 1 . 2]" 1
353 1 33 LEU HB2 1 34 PRO HD2 . . 4.240 3.305 3.142 3.352 . 0 0 "[ . 1 . 2]" 1
354 1 33 LEU HB2 1 34 PRO HD3 . . 4.590 4.457 4.337 4.492 . 0 0 "[ . 1 . 2]" 1
355 1 33 LEU HB2 1 67 GLY HA2 . . 4.060 2.239 2.047 2.510 . 0 0 "[ . 1 . 2]" 1
356 1 33 LEU HB2 1 67 GLY HA3 . . 4.270 3.720 3.484 4.002 . 0 0 "[ . 1 . 2]" 1
357 1 33 LEU HB3 1 33 LEU MD1 . . 3.410 2.326 2.273 2.360 . 0 0 "[ . 1 . 2]" 1
358 1 33 LEU HB3 1 33 LEU MD2 . . 3.470 2.486 2.339 2.551 . 0 0 "[ . 1 . 2]" 1
359 1 33 LEU HB3 1 34 PRO HA . . 5.500 5.152 5.116 5.227 . 0 0 "[ . 1 . 2]" 1
360 1 33 LEU HB3 1 34 PRO HD2 . . 3.710 1.989 1.972 1.998 . 0 0 "[ . 1 . 2]" 1
361 1 33 LEU HB3 1 34 PRO HD3 . . 3.870 3.388 3.345 3.404 . 0 0 "[ . 1 . 2]" 1
362 1 33 LEU HB3 1 37 MET HB2 . . 4.810 3.375 3.189 3.555 . 0 0 "[ . 1 . 2]" 1
363 1 33 LEU HB3 1 37 MET QB . . 4.050 3.183 3.008 3.336 . 0 0 "[ . 1 . 2]" 1
364 1 33 LEU HB3 1 37 MET HB3 . . 4.810 3.923 3.587 4.237 . 0 0 "[ . 1 . 2]" 1
365 1 33 LEU HB3 1 67 GLY HA2 . . 4.570 3.896 3.705 4.173 . 0 0 "[ . 1 . 2]" 1
366 1 33 LEU HB3 1 104 LEU MD2 . . 4.350 3.727 3.521 3.883 . 0 0 "[ . 1 . 2]" 1
367 1 33 LEU MD1 1 34 PRO HD2 . . 3.860 3.877 3.822 3.922 0.062 18 0 "[ . 1 . 2]" 1
368 1 33 LEU MD1 1 34 PRO HG2 . . 5.500 5.331 5.315 5.352 . 0 0 "[ . 1 . 2]" 1
369 1 33 LEU MD1 1 37 MET HB2 . . 5.090 4.295 4.166 4.415 . 0 0 "[ . 1 . 2]" 1
370 1 33 LEU MD1 1 37 MET QB . . 4.400 3.735 3.584 3.853 . 0 0 "[ . 1 . 2]" 1
371 1 33 LEU MD1 1 37 MET HB3 . . 5.090 4.107 3.908 4.271 . 0 0 "[ . 1 . 2]" 1
372 1 33 LEU MD1 1 37 MET ME . . 3.360 2.565 2.020 2.875 . 0 0 "[ . 1 . 2]" 1
373 1 33 LEU MD1 1 37 MET HG2 . . 4.570 3.995 2.886 4.322 . 0 0 "[ . 1 . 2]" 1
374 1 33 LEU MD1 1 45 MET ME . . 3.610 3.229 2.852 3.551 . 0 0 "[ . 1 . 2]" 1
375 1 33 LEU MD1 1 69 GLY H . . 4.310 2.014 1.884 2.337 . 0 0 "[ . 1 . 2]" 1
376 1 33 LEU MD1 1 91 ILE MD . . 3.950 4.118 3.986 4.175 0.225 9 0 "[ . 1 . 2]" 1
377 1 33 LEU MD2 1 34 PRO HD2 . . 4.920 3.419 3.148 3.658 . 0 0 "[ . 1 . 2]" 1
378 1 33 LEU MD2 1 37 MET ME . . 4.090 2.954 2.694 3.339 . 0 0 "[ . 1 . 2]" 1
379 1 33 LEU MD2 1 67 GLY HA2 . . 4.690 4.555 4.394 4.676 . 0 0 "[ . 1 . 2]" 1
380 1 33 LEU MD2 1 67 GLY HA3 . . 5.050 5.092 4.944 5.222 0.172 1 0 "[ . 1 . 2]" 1
381 1 33 LEU MD2 1 68 VAL H . . 5.490 5.332 5.165 5.486 . 0 0 "[ . 1 . 2]" 1
382 1 33 LEU MD2 1 68 VAL HA . . 4.140 3.825 3.552 4.057 . 0 0 "[ . 1 . 2]" 1
383 1 33 LEU MD2 1 69 GLY H . . 3.800 3.878 3.703 3.971 0.171 19 0 "[ . 1 . 2]" 1
384 1 33 LEU MD2 1 69 GLY HA3 . . 4.880 4.765 4.581 4.882 0.002 16 0 "[ . 1 . 2]" 1
385 1 33 LEU HG 1 34 PRO HD2 . . 5.430 4.812 4.773 4.831 . 0 0 "[ . 1 . 2]" 1
386 1 33 LEU HG 1 67 GLY HA2 . . 5.110 3.583 3.271 3.756 . 0 0 "[ . 1 . 2]" 1
387 1 33 LEU HG 1 67 GLY HA3 . . 4.380 4.244 4.051 4.381 0.001 1 0 "[ . 1 . 2]" 1
388 1 33 LEU HG 1 68 VAL HA . . 4.780 2.523 2.301 2.815 . 0 0 "[ . 1 . 2]" 1
389 1 34 PRO HA 1 35 LEU H . . 3.060 2.180 2.156 2.228 . 0 0 "[ . 1 . 2]" 1
390 1 34 PRO HA 1 35 LEU QD . . 4.730 3.970 3.718 4.162 . 0 0 "[ . 1 . 2]" 1
391 1 34 PRO HA 1 35 LEU HG . . 4.530 3.799 3.622 3.933 . 0 0 "[ . 1 . 2]" 1
392 1 34 PRO HA 1 36 SER H . . 4.590 3.709 3.578 3.880 . 0 0 "[ . 1 . 2]" 1
393 1 34 PRO HA 1 37 MET H . . 5.040 4.793 4.509 4.933 . 0 0 "[ . 1 . 2]" 1
394 1 34 PRO HA 1 100 PRO HD3 . . 4.550 4.732 4.527 4.983 0.433 11 0 "[ . 1 . 2]" 1
395 1 34 PRO HA 1 100 PRO QG . . 3.980 4.608 4.525 4.679 0.699 2 20 [*+*************-****] 1
396 1 34 PRO QB 1 35 LEU H . . 4.300 3.162 2.978 3.301 . 0 0 "[ . 1 . 2]" 1
397 1 34 PRO QB 1 36 SER H . . 4.240 2.406 2.141 2.587 . 0 0 "[ . 1 . 2]" 1
398 1 34 PRO QB 1 37 MET H . . 3.940 3.406 2.922 3.568 . 0 0 "[ . 1 . 2]" 1
399 1 34 PRO QB 1 91 ILE MD . . 5.500 4.968 4.748 5.192 . 0 0 "[ . 1 . 2]" 1
400 1 34 PRO QB 1 93 THR MG . . 4.210 3.403 3.204 3.715 . 0 0 "[ . 1 . 2]" 1
401 1 34 PRO QB 1 97 VAL QG . . 4.490 3.274 3.136 3.397 . 0 0 "[ . 1 . 2]" 1
402 1 34 PRO QB 1 100 PRO HB2 . . 3.990 4.105 4.034 4.175 0.185 6 0 "[ . 1 . 2]" 1
403 1 34 PRO QB 1 100 PRO HB3 . . 3.530 2.453 2.357 2.539 . 0 0 "[ . 1 . 2]" 1
404 1 34 PRO QB 1 100 PRO HD2 . . 5.190 4.081 3.887 4.308 . 0 0 "[ . 1 . 2]" 1
405 1 34 PRO QB 1 100 PRO HD3 . . 3.440 2.476 2.274 2.725 . 0 0 "[ . 1 . 2]" 1
406 1 34 PRO QB 1 100 PRO QG . . 3.820 3.147 3.065 3.174 . 0 0 "[ . 1 . 2]" 1
407 1 34 PRO HD2 1 37 MET QB . . 4.270 2.711 2.575 2.822 . 0 0 "[ . 1 . 2]" 1
408 1 34 PRO HD2 1 37 MET ME . . 3.560 2.961 2.740 3.198 . 0 0 "[ . 1 . 2]" 1
409 1 34 PRO HD2 1 37 MET HG3 . . 5.030 4.384 3.810 4.792 . 0 0 "[ . 1 . 2]" 1
410 1 34 PRO HD2 1 91 ILE MD . . 3.800 3.173 2.831 3.460 . 0 0 "[ . 1 . 2]" 1
411 1 34 PRO HD2 1 91 ILE HG12 . . 5.500 5.251 4.908 5.446 . 0 0 "[ . 1 . 2]" 1
412 1 34 PRO HD2 1 100 PRO QG . . 3.860 3.773 3.718 3.804 . 0 0 "[ . 1 . 2]" 1
413 1 34 PRO HD2 1 104 LEU MD2 . . 4.590 3.886 3.766 3.962 . 0 0 "[ . 1 . 2]" 1
414 1 34 PRO HD3 1 37 MET ME . . 4.790 4.116 3.949 4.314 . 0 0 "[ . 1 . 2]" 1
415 1 34 PRO HD3 1 91 ILE MD . . 3.650 3.357 3.142 3.608 . 0 0 "[ . 1 . 2]" 1
416 1 34 PRO HD3 1 91 ILE HG12 . . 4.790 4.713 4.456 4.885 0.095 13 0 "[ . 1 . 2]" 1
417 1 34 PRO HD3 1 91 ILE HG13 . . 5.070 4.377 4.119 4.759 . 0 0 "[ . 1 . 2]" 1
418 1 34 PRO HD3 1 100 PRO HB2 . . 4.440 3.792 3.630 3.866 . 0 0 "[ . 1 . 2]" 1
419 1 34 PRO HD3 1 100 PRO HB3 . . 4.540 2.813 2.630 2.981 . 0 0 "[ . 1 . 2]" 1
420 1 34 PRO HD3 1 100 PRO QG . . 3.370 2.227 2.157 2.287 . 0 0 "[ . 1 . 2]" 1
421 1 34 PRO HD3 1 104 LEU MD2 . . 3.760 3.715 3.621 3.778 0.018 11 0 "[ . 1 . 2]" 1
422 1 34 PRO HG2 1 91 ILE MD . . 3.700 4.121 3.772 4.421 0.721 9 7 "[ . -*+1 * . * **]" 1
423 1 34 PRO HG2 1 91 ILE HG13 . . 5.160 5.593 5.268 5.767 0.607 15 8 "[ *** * 1* - + *]" 1
424 1 34 PRO HG2 1 93 THR MG . . 4.300 3.697 3.532 3.983 . 0 0 "[ . 1 . 2]" 1
425 1 34 PRO HG2 1 97 VAL QG . . 4.440 4.067 3.667 4.300 . 0 0 "[ . 1 . 2]" 1
426 1 34 PRO HG2 1 104 LEU MD2 . . 5.500 5.676 5.568 5.765 0.265 15 0 "[ . 1 . 2]" 1
427 1 34 PRO HG3 1 91 ILE MD . . 4.000 3.622 3.364 3.904 . 0 0 "[ . 1 . 2]" 1
428 1 34 PRO HG3 1 91 ILE HG13 . . 4.910 4.309 4.036 4.526 . 0 0 "[ . 1 . 2]" 1
429 1 34 PRO HG3 1 93 THR MG . . 3.810 2.901 2.725 3.075 . 0 0 "[ . 1 . 2]" 1
430 1 34 PRO HG3 1 97 VAL QG . . 4.920 4.104 3.785 4.338 . 0 0 "[ . 1 . 2]" 1
431 1 34 PRO HG3 1 100 PRO HB3 . . 4.560 3.632 3.542 3.657 . 0 0 "[ . 1 . 2]" 1
432 1 34 PRO HG3 1 100 PRO HD3 . . 3.470 2.443 2.247 2.633 . 0 0 "[ . 1 . 2]" 1
433 1 35 LEU H 1 35 LEU HB2 . . 3.870 2.629 2.523 2.710 . 0 0 "[ . 1 . 2]" 1
434 1 35 LEU H 1 35 LEU HB3 . . 3.940 3.581 3.573 3.590 . 0 0 "[ . 1 . 2]" 1
435 1 35 LEU H 1 35 LEU MD1 . . 4.210 3.614 3.504 3.747 . 0 0 "[ . 1 . 2]" 1
436 1 35 LEU H 1 35 LEU QD . . 3.610 2.802 2.681 2.916 . 0 0 "[ . 1 . 2]" 1
437 1 35 LEU H 1 35 LEU MD2 . . 4.210 2.923 2.748 3.084 . 0 0 "[ . 1 . 2]" 1
438 1 35 LEU H 1 35 LEU HG . . 3.160 2.053 1.919 2.213 . 0 0 "[ . 1 . 2]" 1
439 1 35 LEU H 1 36 SER H . . 3.730 2.676 2.594 2.755 . 0 0 "[ . 1 . 2]" 1
440 1 35 LEU H 1 97 VAL QG . . 5.440 5.443 5.406 5.453 0.013 11 0 "[ . 1 . 2]" 1
441 1 35 LEU HA 1 35 LEU MD1 . . 4.010 3.875 3.805 3.922 . 0 0 "[ . 1 . 2]" 1
442 1 35 LEU HA 1 35 LEU QD . . 2.860 2.112 1.964 2.298 . 0 0 "[ . 1 . 2]" 1
443 1 35 LEU HA 1 35 LEU MD2 . . 4.010 2.122 1.970 2.314 . 0 0 "[ . 1 . 2]" 1
444 1 35 LEU HA 1 35 LEU HG . . 4.090 3.276 3.191 3.395 . 0 0 "[ . 1 . 2]" 1
445 1 35 LEU HA 1 37 MET H . . 4.330 3.445 3.351 3.746 . 0 0 "[ . 1 . 2]" 1
446 1 35 LEU HA 1 65 SER HG . . 4.200 3.232 2.312 3.963 . 0 0 "[ . 1 . 2]" 1
447 1 35 LEU HA 1 67 GLY HA2 . . 4.700 4.328 4.079 4.534 . 0 0 "[ . 1 . 2]" 1
448 1 35 LEU HB2 1 36 SER H . . 5.080 3.077 2.855 3.528 . 0 0 "[ . 1 . 2]" 1
449 1 35 LEU HB2 1 65 SER HB3 . . 4.840 4.522 4.370 4.563 . 0 0 "[ . 1 . 2]" 1
450 1 35 LEU HB3 1 35 LEU MD1 . . 3.330 2.335 2.178 2.449 . 0 0 "[ . 1 . 2]" 1
451 1 35 LEU HB3 1 35 LEU MD2 . . 3.330 2.381 2.259 2.499 . 0 0 "[ . 1 . 2]" 1
452 1 35 LEU HB3 1 36 SER H . . 4.660 4.088 3.946 4.381 . 0 0 "[ . 1 . 2]" 1
453 1 35 LEU HB3 1 64 THR MG . . 4.130 2.740 2.198 3.086 . 0 0 "[ . 1 . 2]" 1
454 1 35 LEU HB3 1 65 SER HB3 . . 3.960 3.213 2.899 3.388 . 0 0 "[ . 1 . 2]" 1
455 1 35 LEU QD 1 64 THR MG . . 3.200 2.475 2.197 2.735 . 0 0 "[ . 1 . 2]" 1
456 1 35 LEU QD 1 65 SER H . . 4.810 4.072 3.714 4.289 . 0 0 "[ . 1 . 2]" 1
457 1 35 LEU QD 1 65 SER HB3 . . 3.620 2.781 2.374 3.182 . 0 0 "[ . 1 . 2]" 1
458 1 35 LEU QD 1 65 SER HG . . 4.100 3.462 2.827 3.868 . 0 0 "[ . 1 . 2]" 1
459 1 35 LEU QD 1 66 ARG HA . . 4.000 3.320 3.122 3.617 . 0 0 "[ . 1 . 2]" 1
460 1 35 LEU QD 1 67 GLY H . . 3.570 2.875 2.700 3.085 . 0 0 "[ . 1 . 2]" 1
461 1 35 LEU QD 1 67 GLY HA2 . . 3.690 3.498 3.225 3.618 . 0 0 "[ . 1 . 2]" 1
462 1 35 LEU QD 1 67 GLY HA3 . . 3.950 3.576 3.349 3.712 . 0 0 "[ . 1 . 2]" 1
463 1 35 LEU QD 1 68 VAL H . . 5.440 5.034 4.824 5.171 . 0 0 "[ . 1 . 2]" 1
464 1 35 LEU MD1 1 64 THR MG . . 3.890 2.809 2.451 3.118 . 0 0 "[ . 1 . 2]" 1
465 1 35 LEU MD1 1 66 ARG HA . . 5.500 5.252 4.851 5.489 . 0 0 "[ . 1 . 2]" 1
466 1 35 LEU MD2 1 64 THR MG . . 3.890 2.774 2.398 3.080 . 0 0 "[ . 1 . 2]" 1
467 1 35 LEU MD2 1 66 ARG HA . . 5.500 3.357 3.153 3.678 . 0 0 "[ . 1 . 2]" 1
468 1 36 SER H 1 36 SER HB2 . . 3.920 2.383 2.192 2.906 . 0 0 "[ . 1 . 2]" 1
469 1 36 SER H 1 36 SER QB . . 3.410 2.280 2.170 2.344 . 0 0 "[ . 1 . 2]" 1
470 1 36 SER H 1 36 SER HB3 . . 3.920 3.324 2.301 3.610 . 0 0 "[ . 1 . 2]" 1
471 1 36 SER H 1 37 MET H . . 3.230 2.592 2.286 2.788 . 0 0 "[ . 1 . 2]" 1
472 1 36 SER H 1 97 VAL QG . . 4.500 3.662 3.569 3.760 . 0 0 "[ . 1 . 2]" 1
473 1 36 SER QB 1 37 MET H . . 3.920 3.570 3.165 3.686 . 0 0 "[ . 1 . 2]" 1
474 1 36 SER QB 1 97 VAL QG . . 3.830 1.650 1.567 1.915 . 0 0 "[ . 1 . 2]" 1
475 1 36 SER HB2 1 37 MET H . . 4.530 3.969 3.302 4.557 0.027 10 0 "[ . 1 . 2]" 1
476 1 36 SER HB3 1 37 MET H . . 4.530 4.144 3.791 4.346 . 0 0 "[ . 1 . 2]" 1
477 1 37 MET H 1 37 MET HB2 . . 3.220 2.664 2.343 2.869 . 0 0 "[ . 1 . 2]" 1
478 1 37 MET H 1 37 MET QB . . 2.790 2.241 2.184 2.288 . 0 0 "[ . 1 . 2]" 1
479 1 37 MET H 1 37 MET HB3 . . 3.220 2.434 2.264 2.734 . 0 0 "[ . 1 . 2]" 1
480 1 37 MET H 1 37 MET ME . . 5.500 5.361 5.031 5.649 0.149 15 0 "[ . 1 . 2]" 1
481 1 37 MET H 1 37 MET HG3 . . 4.960 4.491 4.438 4.563 . 0 0 "[ . 1 . 2]" 1
482 1 37 MET H 1 38 ASP H . . 4.860 4.617 4.583 4.638 . 0 0 "[ . 1 . 2]" 1
483 1 37 MET HA 1 37 MET ME . . 4.260 3.945 3.704 4.266 0.006 15 0 "[ . 1 . 2]" 1
484 1 37 MET HA 1 37 MET HG2 . . 4.070 3.333 3.065 3.701 . 0 0 "[ . 1 . 2]" 1
485 1 37 MET HA 1 37 MET HG3 . . 3.590 2.570 2.469 2.770 . 0 0 "[ . 1 . 2]" 1
486 1 37 MET HA 1 38 ASP H . . 2.850 2.272 2.209 2.352 . 0 0 "[ . 1 . 2]" 1
487 1 37 MET HA 1 41 GLU H . . 5.500 5.360 5.097 5.503 0.003 19 0 "[ . 1 . 2]" 1
488 1 37 MET HA 1 41 GLU HB2 . . 4.210 4.204 3.787 4.443 0.233 17 0 "[ . 1 . 2]" 1
489 1 37 MET HA 1 41 GLU HB3 . . 3.960 3.759 3.508 3.943 . 0 0 "[ . 1 . 2]" 1
490 1 37 MET HA 1 41 GLU HG2 . . 5.260 4.370 3.902 5.307 0.047 16 0 "[ . 1 . 2]" 1
491 1 37 MET HA 1 41 GLU QG . . 4.450 4.085 3.781 4.480 0.030 20 0 "[ . 1 . 2]" 1
492 1 37 MET HA 1 41 GLU HG3 . . 5.260 5.143 4.031 5.531 0.271 8 0 "[ . 1 . 2]" 1
493 1 37 MET HA 1 42 LEU H . . 5.500 5.398 5.173 5.500 . 0 0 "[ . 1 . 2]" 1
494 1 37 MET QB 1 38 ASP H . . 4.200 3.485 3.349 3.598 . 0 0 "[ . 1 . 2]" 1
495 1 37 MET QB 1 57 ILE MD . . 3.990 3.283 2.909 3.603 . 0 0 "[ . 1 . 2]" 1
496 1 37 MET HB2 1 38 ASP H . . 4.890 3.923 3.651 4.119 . 0 0 "[ . 1 . 2]" 1
497 1 37 MET HB3 1 38 ASP H . . 4.890 3.913 3.599 4.109 . 0 0 "[ . 1 . 2]" 1
498 1 37 MET ME 1 37 MET HG2 . . 3.560 3.095 2.364 3.278 . 0 0 "[ . 1 . 2]" 1
499 1 37 MET ME 1 37 MET HG3 . . 3.010 2.067 1.986 2.697 . 0 0 "[ . 1 . 2]" 1
500 1 37 MET ME 1 38 ASP H . . 4.480 3.944 3.689 4.396 . 0 0 "[ . 1 . 2]" 1
501 1 37 MET ME 1 41 GLU HB3 . . 3.240 2.667 2.192 3.186 . 0 0 "[ . 1 . 2]" 1
502 1 37 MET ME 1 41 GLU HG2 . . 3.740 3.061 2.150 3.951 0.211 2 0 "[ . 1 . 2]" 1
503 1 37 MET ME 1 41 GLU QG . . 3.010 2.353 1.969 3.288 0.278 6 0 "[ . 1 . 2]" 1
504 1 37 MET ME 1 41 GLU HG3 . . 3.740 2.599 2.022 3.700 . 0 0 "[ . 1 . 2]" 1
505 1 37 MET ME 1 42 LEU H . . 3.700 3.049 2.633 3.475 . 0 0 "[ . 1 . 2]" 1
506 1 37 MET ME 1 42 LEU HA . . 3.030 2.154 1.984 2.341 . 0 0 "[ . 1 . 2]" 1
507 1 37 MET ME 1 42 LEU HB2 . . 3.600 2.791 2.447 3.210 . 0 0 "[ . 1 . 2]" 1
508 1 37 MET ME 1 42 LEU MD1 . . 3.660 2.772 2.350 3.101 . 0 0 "[ . 1 . 2]" 1
509 1 37 MET ME 1 45 MET H . . 4.900 4.959 4.585 5.137 0.237 6 0 "[ . 1 . 2]" 1
510 1 37 MET ME 1 45 MET ME . . 3.400 2.984 2.708 3.244 . 0 0 "[ . 1 . 2]" 1
511 1 37 MET ME 1 57 ILE MD . . 4.470 3.386 3.071 3.655 . 0 0 "[ . 1 . 2]" 1
512 1 37 MET ME 1 86 PHE QE . . 5.500 4.885 4.514 5.301 . 0 0 "[ . 1 . 2]" 1
513 1 37 MET ME 1 91 ILE MD . . 2.860 2.180 1.774 2.598 . 0 0 "[ . 1 . 2]" 1
514 1 37 MET ME 1 91 ILE MG . . 3.950 4.078 3.581 4.348 0.398 6 0 "[ . 1 . 2]" 1
515 1 37 MET HG2 1 38 ASP H . . 4.020 2.770 2.359 3.684 . 0 0 "[ . 1 . 2]" 1
516 1 37 MET HG2 1 41 GLU HB3 . . 4.090 3.704 3.047 4.083 . 0 0 "[ . 1 . 2]" 1
517 1 37 MET HG2 1 42 LEU H . . 4.020 3.748 3.326 4.041 0.021 15 0 "[ . 1 . 2]" 1
518 1 37 MET HG2 1 42 LEU HB2 . . 4.360 3.495 3.219 3.739 . 0 0 "[ . 1 . 2]" 1
519 1 37 MET HG2 1 42 LEU HB3 . . 5.040 4.576 4.345 4.910 . 0 0 "[ . 1 . 2]" 1
520 1 37 MET HG2 1 42 LEU MD2 . . 4.910 4.635 4.358 4.828 . 0 0 "[ . 1 . 2]" 1
521 1 37 MET HG2 1 57 ILE MD . . 3.850 2.423 2.050 2.759 . 0 0 "[ . 1 . 2]" 1
522 1 37 MET HG3 1 38 ASP H . . 4.010 2.329 1.961 2.887 . 0 0 "[ . 1 . 2]" 1
523 1 37 MET HG3 1 41 GLU HB2 . . 3.830 3.844 3.627 4.036 0.206 3 0 "[ . 1 . 2]" 1
524 1 37 MET HG3 1 41 GLU HB3 . . 3.520 2.432 2.272 2.580 . 0 0 "[ . 1 . 2]" 1
525 1 37 MET HG3 1 42 LEU H . . 3.900 3.337 3.015 3.786 . 0 0 "[ . 1 . 2]" 1
526 1 37 MET HG3 1 57 ILE MD . . 4.610 3.599 3.229 3.979 . 0 0 "[ . 1 . 2]" 1
527 1 37 MET HG3 1 91 ILE MD . . 4.460 4.422 3.903 4.878 0.418 15 0 "[ . 1 . 2]" 1
528 1 38 ASP H 1 38 ASP HB3 . . 4.020 3.378 3.065 3.536 . 0 0 "[ . 1 . 2]" 1
529 1 38 ASP H 1 40 GLN H . . 4.910 4.457 4.136 4.776 . 0 0 "[ . 1 . 2]" 1
530 1 38 ASP H 1 41 GLU H . . 4.130 3.393 3.202 3.567 . 0 0 "[ . 1 . 2]" 1
531 1 38 ASP H 1 41 GLU HB2 . . 3.670 3.186 2.862 3.356 . 0 0 "[ . 1 . 2]" 1
532 1 38 ASP H 1 41 GLU HB3 . . 3.580 2.628 2.209 2.875 . 0 0 "[ . 1 . 2]" 1
533 1 38 ASP H 1 41 GLU HG2 . . 4.880 4.381 4.109 5.011 0.131 16 0 "[ . 1 . 2]" 1
534 1 38 ASP H 1 41 GLU QG . . 4.200 4.043 3.873 4.237 0.037 3 0 "[ . 1 . 2]" 1
535 1 38 ASP H 1 41 GLU HG3 . . 4.880 4.824 4.243 5.079 0.199 3 0 "[ . 1 . 2]" 1
536 1 38 ASP H 1 42 LEU H . . 4.600 3.732 3.550 3.978 . 0 0 "[ . 1 . 2]" 1
537 1 38 ASP HA 1 57 ILE HB . . 5.080 4.977 4.673 5.259 0.179 19 0 "[ . 1 . 2]" 1
538 1 38 ASP HA 1 57 ILE MD . . 4.750 4.594 4.051 4.749 . 0 0 "[ . 1 . 2]" 1
539 1 38 ASP HA 1 57 ILE HG13 . . 3.740 3.566 3.305 3.725 . 0 0 "[ . 1 . 2]" 1
540 1 38 ASP HB2 1 39 GLU H . . 3.210 2.835 2.508 3.074 . 0 0 "[ . 1 . 2]" 1
541 1 38 ASP HB2 1 40 GLN H . . 4.180 2.573 2.303 3.036 . 0 0 "[ . 1 . 2]" 1
542 1 38 ASP HB2 1 40 GLN QG . . 5.330 5.340 4.967 5.804 0.474 9 0 "[ . 1 . 2]" 1
543 1 38 ASP HB3 1 39 GLU H . . 3.900 3.790 3.565 4.091 0.191 4 0 "[ . 1 . 2]" 1
544 1 38 ASP HB3 1 40 GLN H . . 4.390 4.173 3.999 4.427 0.037 11 0 "[ . 1 . 2]" 1
545 1 39 GLU H 1 39 GLU HB2 . . 3.790 2.366 2.261 2.596 . 0 0 "[ . 1 . 2]" 1
546 1 39 GLU H 1 39 GLU HB3 . . 3.790 3.578 3.538 3.622 . 0 0 "[ . 1 . 2]" 1
547 1 39 GLU H 1 39 GLU HG2 . . 4.450 3.907 3.447 4.081 . 0 0 "[ . 1 . 2]" 1
548 1 39 GLU H 1 39 GLU QG . . 3.700 2.800 2.480 3.310 . 0 0 "[ . 1 . 2]" 1
549 1 39 GLU H 1 39 GLU HG3 . . 4.450 2.882 2.509 3.507 . 0 0 "[ . 1 . 2]" 1
550 1 39 GLU H 1 40 GLN H . . 3.620 2.881 2.780 2.991 . 0 0 "[ . 1 . 2]" 1
551 1 39 GLU H 1 57 ILE MD . . 4.620 4.670 4.319 4.828 0.208 9 0 "[ . 1 . 2]" 1
552 1 39 GLU H 1 57 ILE HG12 . . 4.500 4.228 3.823 4.495 . 0 0 "[ . 1 . 2]" 1
553 1 39 GLU H 1 57 ILE HG13 . . 4.550 3.455 3.118 3.780 . 0 0 "[ . 1 . 2]" 1
554 1 39 GLU HA 1 39 GLU HG2 . . 3.890 2.948 2.252 3.531 . 0 0 "[ . 1 . 2]" 1
555 1 39 GLU HA 1 39 GLU QG . . 3.410 2.258 2.157 2.340 . 0 0 "[ . 1 . 2]" 1
556 1 39 GLU HA 1 39 GLU HG3 . . 3.890 2.477 2.178 3.046 . 0 0 "[ . 1 . 2]" 1
557 1 39 GLU HA 1 42 LEU H . . 4.040 3.865 3.571 4.041 0.001 3 0 "[ . 1 . 2]" 1
558 1 39 GLU HA 1 42 LEU HB2 . . 4.310 3.757 3.467 3.915 . 0 0 "[ . 1 . 2]" 1
559 1 39 GLU HA 1 42 LEU HB3 . . 4.300 2.753 2.464 2.931 . 0 0 "[ . 1 . 2]" 1
560 1 39 GLU HA 1 42 LEU MD1 . . 5.140 5.163 5.008 5.222 0.082 9 0 "[ . 1 . 2]" 1
561 1 39 GLU HA 1 43 GLU H . . 4.690 4.640 4.270 4.853 0.163 13 0 "[ . 1 . 2]" 1
562 1 39 GLU HA 1 55 THR HB . . 4.250 3.850 3.593 4.069 . 0 0 "[ . 1 . 2]" 1
563 1 39 GLU HA 1 55 THR MG . . 4.900 4.915 4.676 5.190 0.290 13 0 "[ . 1 . 2]" 1
564 1 39 GLU HA 1 56 ARG H . . 5.500 5.431 5.233 5.501 0.001 10 0 "[ . 1 . 2]" 1
565 1 39 GLU HA 1 57 ILE H . . 5.500 5.138 4.679 5.498 . 0 0 "[ . 1 . 2]" 1
566 1 39 GLU HA 1 57 ILE MD . . 3.850 3.542 3.082 3.807 . 0 0 "[ . 1 . 2]" 1
567 1 39 GLU HA 1 57 ILE HG12 . . 3.960 2.922 2.625 3.128 . 0 0 "[ . 1 . 2]" 1
568 1 39 GLU HA 1 57 ILE HG13 . . 4.890 3.166 2.836 3.601 . 0 0 "[ . 1 . 2]" 1
569 1 39 GLU QB 1 40 GLN H . . 4.000 2.874 2.622 3.068 . 0 0 "[ . 1 . 2]" 1
570 1 39 GLU QB 1 40 GLN QE . . 4.330 6.049 4.823 7.021 2.691 10 19 [****.****+***-******] 1
571 1 39 GLU QB 1 55 THR HB . . 5.340 4.407 3.959 4.667 . 0 0 "[ . 1 . 2]" 1
572 1 39 GLU QG 1 40 GLN H . . 4.730 4.497 4.340 4.645 . 0 0 "[ . 1 . 2]" 1
573 1 39 GLU QG 1 40 GLN QE . . 4.670 7.861 6.719 8.848 4.178 10 20 [****-****+**********] 1
574 1 39 GLU QG 1 55 THR HB . . 4.470 4.010 3.602 4.396 . 0 0 "[ . 1 . 2]" 1
575 1 39 GLU QG 1 56 ARG H . . 5.170 4.565 4.343 4.855 . 0 0 "[ . 1 . 2]" 1
576 1 39 GLU QG 1 56 ARG HA . . 3.460 2.839 2.604 3.104 . 0 0 "[ . 1 . 2]" 1
577 1 39 GLU QG 1 57 ILE H . . 3.610 3.385 3.049 3.611 0.001 6 0 "[ . 1 . 2]" 1
578 1 39 GLU QG 1 57 ILE MD . . 4.380 4.070 3.613 4.374 . 0 0 "[ . 1 . 2]" 1
579 1 39 GLU QG 1 57 ILE HG12 . . 3.880 2.769 2.235 3.203 . 0 0 "[ . 1 . 2]" 1
580 1 39 GLU QG 1 57 ILE HG13 . . 4.410 3.357 2.887 3.688 . 0 0 "[ . 1 . 2]" 1
581 1 39 GLU HG2 1 40 GLN H . . 5.400 5.282 5.041 5.400 . 0 0 "[ . 1 . 2]" 1
582 1 39 GLU HG2 1 55 THR HB . . 5.200 4.496 3.663 5.402 0.202 6 0 "[ . 1 . 2]" 1
583 1 39 GLU HG2 1 56 ARG HA . . 4.000 3.164 2.678 3.825 . 0 0 "[ . 1 . 2]" 1
584 1 39 GLU HG2 1 57 ILE HG12 . . 4.720 3.781 2.288 4.632 . 0 0 "[ . 1 . 2]" 1
585 1 39 GLU HG3 1 40 GLN H . . 5.400 4.873 4.712 5.067 . 0 0 "[ . 1 . 2]" 1
586 1 39 GLU HG3 1 55 THR HB . . 5.200 4.965 4.122 5.697 0.497 14 0 "[ . 1 . 2]" 1
587 1 39 GLU HG3 1 56 ARG HA . . 4.000 3.526 2.792 3.990 . 0 0 "[ . 1 . 2]" 1
588 1 39 GLU HG3 1 57 ILE HG12 . . 4.720 2.958 2.391 3.720 . 0 0 "[ . 1 . 2]" 1
589 1 40 GLN H 1 40 GLN HB2 . . 3.720 2.310 2.214 2.424 . 0 0 "[ . 1 . 2]" 1
590 1 40 GLN H 1 40 GLN QB . . 2.980 2.198 2.147 2.246 . 0 0 "[ . 1 . 2]" 1
591 1 40 GLN H 1 40 GLN HB3 . . 3.720 2.777 2.630 2.889 . 0 0 "[ . 1 . 2]" 1
592 1 40 GLN H 1 40 GLN HG2 . . 4.390 4.570 4.472 4.639 0.249 2 0 "[ . 1 . 2]" 1
593 1 40 GLN H 1 40 GLN QG . . 3.810 3.951 3.843 4.070 0.260 2 0 "[ . 1 . 2]" 1
594 1 40 GLN H 1 40 GLN HG3 . . 4.390 4.327 4.146 4.516 0.126 5 0 "[ . 1 . 2]" 1
595 1 40 GLN H 1 41 GLU H . . 3.000 2.830 2.620 2.994 . 0 0 "[ . 1 . 2]" 1
596 1 40 GLN HA 1 40 GLN QE . . 4.670 4.000 2.601 4.606 . 0 0 "[ . 1 . 2]" 1
597 1 40 GLN HA 1 40 GLN QG . . 3.220 2.402 2.158 2.802 . 0 0 "[ . 1 . 2]" 1
598 1 40 GLN HA 1 43 GLU H . . 3.930 3.726 3.490 3.863 . 0 0 "[ . 1 . 2]" 1
599 1 40 GLN HA 1 43 GLU HB2 . . 4.360 4.202 4.018 4.357 . 0 0 "[ . 1 . 2]" 1
600 1 40 GLN HA 1 43 GLU QB . . 3.630 3.121 2.893 3.316 . 0 0 "[ . 1 . 2]" 1
601 1 40 GLN HA 1 43 GLU HB3 . . 4.360 3.224 2.945 3.520 . 0 0 "[ . 1 . 2]" 1
602 1 40 GLN HA 1 44 ASN QD . . 5.040 4.364 3.355 4.894 . 0 0 "[ . 1 . 2]" 1
603 1 40 GLN QB 1 44 ASN QD . . 4.550 3.517 2.986 4.121 . 0 0 "[ . 1 . 2]" 1
604 1 40 GLN HB2 1 41 GLU H . . 3.740 3.451 3.301 3.626 . 0 0 "[ . 1 . 2]" 1
605 1 40 GLN HB3 1 41 GLU H . . 3.740 2.158 1.915 2.543 . 0 0 "[ . 1 . 2]" 1
606 1 40 GLN QG 1 41 GLU H . . 4.840 3.648 3.304 3.962 . 0 0 "[ . 1 . 2]" 1
607 1 40 GLN QG 1 44 ASN QD . . 4.700 2.152 1.853 2.552 . 0 0 "[ . 1 . 2]" 1
608 1 40 GLN HG2 1 41 GLU H . . 5.500 3.998 3.504 4.516 . 0 0 "[ . 1 . 2]" 1
609 1 40 GLN HG3 1 41 GLU H . . 5.500 4.403 3.480 4.884 . 0 0 "[ . 1 . 2]" 1
610 1 41 GLU H 1 41 GLU HB2 . . 3.260 2.387 2.204 2.556 . 0 0 "[ . 1 . 2]" 1
611 1 41 GLU H 1 41 GLU HB3 . . 3.380 2.688 2.501 2.934 . 0 0 "[ . 1 . 2]" 1
612 1 41 GLU H 1 41 GLU HG2 . . 5.080 4.532 4.220 4.609 . 0 0 "[ . 1 . 2]" 1
613 1 41 GLU H 1 41 GLU QG . . 4.470 4.038 3.914 4.073 . 0 0 "[ . 1 . 2]" 1
614 1 41 GLU H 1 41 GLU HG3 . . 5.080 4.539 4.448 4.639 . 0 0 "[ . 1 . 2]" 1
615 1 41 GLU HA 1 41 GLU HG2 . . 3.750 3.550 2.817 3.751 0.001 8 0 "[ . 1 . 2]" 1
616 1 41 GLU HA 1 41 GLU HG3 . . 3.750 3.129 2.525 3.735 . 0 0 "[ . 1 . 2]" 1
617 1 41 GLU HA 1 43 GLU H . . 4.560 3.881 3.749 4.095 . 0 0 "[ . 1 . 2]" 1
618 1 41 GLU HA 1 44 ASN H . . 3.560 3.026 2.906 3.122 . 0 0 "[ . 1 . 2]" 1
619 1 41 GLU HA 1 44 ASN HB2 . . 3.380 2.029 2.000 2.129 . 0 0 "[ . 1 . 2]" 1
620 1 41 GLU HA 1 44 ASN HB3 . . 3.950 3.645 3.596 3.718 . 0 0 "[ . 1 . 2]" 1
621 1 41 GLU HA 1 44 ASN HD21 . . 4.710 2.742 2.198 3.573 . 0 0 "[ . 1 . 2]" 1
622 1 41 GLU HA 1 44 ASN QD . . 4.010 2.682 2.181 3.440 . 0 0 "[ . 1 . 2]" 1
623 1 41 GLU HA 1 44 ASN HD22 . . 4.710 3.914 3.498 4.486 . 0 0 "[ . 1 . 2]" 1
624 1 41 GLU HA 1 45 MET H . . 4.930 3.912 3.725 4.069 . 0 0 "[ . 1 . 2]" 1
625 1 41 GLU HB3 1 42 LEU H . . 3.220 2.318 2.163 2.594 . 0 0 "[ . 1 . 2]" 1
626 1 41 GLU HG2 1 42 LEU H . . 5.350 4.482 3.390 4.994 . 0 0 "[ . 1 . 2]" 1
627 1 41 GLU HG3 1 42 LEU H . . 5.350 3.817 3.377 4.599 . 0 0 "[ . 1 . 2]" 1
628 1 42 LEU H 1 42 LEU HB2 . . 3.390 2.598 2.439 2.680 . 0 0 "[ . 1 . 2]" 1
629 1 42 LEU H 1 42 LEU HB3 . . 3.210 2.447 2.354 2.622 . 0 0 "[ . 1 . 2]" 1
630 1 42 LEU H 1 42 LEU MD1 . . 4.330 4.093 3.961 4.191 . 0 0 "[ . 1 . 2]" 1
631 1 42 LEU H 1 42 LEU MD2 . . 4.490 4.207 4.171 4.237 . 0 0 "[ . 1 . 2]" 1
632 1 42 LEU H 1 42 LEU HG . . 4.560 4.447 4.376 4.572 0.012 9 0 "[ . 1 . 2]" 1
633 1 42 LEU H 1 43 GLU H . . 3.310 2.846 2.713 2.919 . 0 0 "[ . 1 . 2]" 1
634 1 42 LEU H 1 45 MET ME . . 5.500 5.389 5.137 5.502 0.002 20 0 "[ . 1 . 2]" 1
635 1 42 LEU H 1 55 THR MG . . 5.500 5.275 4.948 5.409 . 0 0 "[ . 1 . 2]" 1
636 1 42 LEU H 1 57 ILE MD . . 4.300 3.895 3.670 4.107 . 0 0 "[ . 1 . 2]" 1
637 1 42 LEU HA 1 42 LEU MD1 . . 3.840 2.119 1.977 2.344 . 0 0 "[ . 1 . 2]" 1
638 1 42 LEU HA 1 42 LEU HG . . 3.870 3.330 3.253 3.395 . 0 0 "[ . 1 . 2]" 1
639 1 42 LEU HA 1 45 MET ME . . 3.980 3.121 2.861 3.286 . 0 0 "[ . 1 . 2]" 1
640 1 42 LEU HA 1 45 MET QG . . 5.020 2.920 2.625 3.312 . 0 0 "[ . 1 . 2]" 1
641 1 42 LEU HA 1 46 LEU QD . . 5.440 4.164 3.912 4.302 . 0 0 "[ . 1 . 2]" 1
642 1 42 LEU HA 1 57 ILE MD . . 4.560 4.059 3.876 4.182 . 0 0 "[ . 1 . 2]" 1
643 1 42 LEU HB2 1 42 LEU MD1 . . 3.430 2.380 2.258 2.464 . 0 0 "[ . 1 . 2]" 1
644 1 42 LEU HB2 1 43 GLU H . . 4.220 4.106 4.004 4.186 . 0 0 "[ . 1 . 2]" 1
645 1 42 LEU HB2 1 45 MET ME . . 5.030 4.308 4.107 4.742 . 0 0 "[ . 1 . 2]" 1
646 1 42 LEU HB2 1 55 THR MG . . 5.430 4.561 4.285 4.662 . 0 0 "[ . 1 . 2]" 1
647 1 42 LEU HB2 1 57 ILE MD . . 3.910 2.067 1.983 2.206 . 0 0 "[ . 1 . 2]" 1
648 1 42 LEU HB3 1 42 LEU MD1 . . 3.260 3.187 3.178 3.196 . 0 0 "[ . 1 . 2]" 1
649 1 42 LEU HB3 1 42 LEU MD2 . . 3.280 2.246 2.174 2.426 . 0 0 "[ . 1 . 2]" 1
650 1 42 LEU HB3 1 43 GLU H . . 3.580 2.886 2.787 2.995 . 0 0 "[ . 1 . 2]" 1
651 1 42 LEU HB3 1 55 THR HB . . 4.180 3.067 2.634 3.337 . 0 0 "[ . 1 . 2]" 1
652 1 42 LEU HB3 1 55 THR MG . . 3.770 3.581 3.086 3.770 . 0 0 "[ . 1 . 2]" 1
653 1 42 LEU HB3 1 57 ILE MD . . 4.130 3.085 2.639 3.459 . 0 0 "[ . 1 . 2]" 1
654 1 42 LEU MD1 1 43 GLU H . . 4.300 4.386 4.311 4.498 0.198 5 0 "[ . 1 . 2]" 1
655 1 42 LEU MD1 1 43 GLU HA . . 5.250 4.316 4.156 4.512 . 0 0 "[ . 1 . 2]" 1
656 1 42 LEU MD1 1 55 THR HA . . 4.720 4.584 4.420 4.718 . 0 0 "[ . 1 . 2]" 1
657 1 42 LEU MD1 1 55 THR HB . . 3.920 3.850 3.735 3.925 0.005 17 0 "[ . 1 . 2]" 1
658 1 42 LEU MD1 1 55 THR MG . . 3.260 3.202 3.014 3.261 0.001 20 0 "[ . 1 . 2]" 1
659 1 42 LEU MD1 1 56 ARG H . . 4.560 4.283 3.971 4.493 . 0 0 "[ . 1 . 2]" 1
660 1 42 LEU MD1 1 57 ILE MD . . 2.910 2.884 2.739 2.921 0.011 17 0 "[ . 1 . 2]" 1
661 1 42 LEU MD1 1 57 ILE HG12 . . 5.080 4.672 4.382 4.955 . 0 0 "[ . 1 . 2]" 1
662 1 42 LEU MD1 1 69 GLY HA2 . . 4.270 4.033 3.821 4.270 . 0 0 "[ . 1 . 2]" 1
663 1 42 LEU MD1 1 69 GLY HA3 . . 3.990 2.627 2.372 2.938 . 0 0 "[ . 1 . 2]" 1
664 1 42 LEU MD1 1 70 PHE H . . 4.230 4.115 3.759 4.301 0.071 12 0 "[ . 1 . 2]" 1
665 1 42 LEU MD1 1 71 ALA H . . 4.620 4.158 3.967 4.297 . 0 0 "[ . 1 . 2]" 1
666 1 42 LEU MD1 1 71 ALA HA . . 4.790 4.321 4.073 4.649 . 0 0 "[ . 1 . 2]" 1
667 1 42 LEU MD1 1 71 ALA MB . . 3.150 2.454 2.174 2.781 . 0 0 "[ . 1 . 2]" 1
668 1 42 LEU MD2 1 55 THR MG . . 3.360 2.704 2.445 3.031 . 0 0 "[ . 1 . 2]" 1
669 1 42 LEU MD2 1 57 ILE MD . . 3.730 1.912 1.793 2.085 . 0 0 "[ . 1 . 2]" 1
670 1 42 LEU MD2 1 57 ILE HG12 . . 3.510 2.504 2.153 2.776 . 0 0 "[ . 1 . 2]" 1
671 1 42 LEU MD2 1 69 GLY HA3 . . 4.420 2.371 2.097 2.679 . 0 0 "[ . 1 . 2]" 1
672 1 42 LEU MD2 1 71 ALA MB . . 3.950 3.111 2.630 3.473 . 0 0 "[ . 1 . 2]" 1
673 1 42 LEU HG 1 43 GLU H . . 4.740 3.752 3.576 4.027 . 0 0 "[ . 1 . 2]" 1
674 1 42 LEU HG 1 55 THR HB . . 4.270 2.446 2.203 2.625 . 0 0 "[ . 1 . 2]" 1
675 1 42 LEU HG 1 55 THR MG . . 3.230 2.004 1.956 2.064 . 0 0 "[ . 1 . 2]" 1
676 1 43 GLU H 1 43 GLU HB2 . . 3.640 2.781 2.616 2.945 . 0 0 "[ . 1 . 2]" 1
677 1 43 GLU H 1 43 GLU QB . . 2.960 2.309 2.260 2.339 . 0 0 "[ . 1 . 2]" 1
678 1 43 GLU H 1 43 GLU HB3 . . 3.640 2.475 2.348 2.636 . 0 0 "[ . 1 . 2]" 1
679 1 43 GLU H 1 43 GLU HG2 . . 4.760 4.411 4.246 4.511 . 0 0 "[ . 1 . 2]" 1
680 1 43 GLU H 1 43 GLU QG . . 4.180 4.001 3.913 4.098 . 0 0 "[ . 1 . 2]" 1
681 1 43 GLU H 1 43 GLU HG3 . . 4.760 4.586 4.510 4.716 . 0 0 "[ . 1 . 2]" 1
682 1 43 GLU H 1 46 LEU QD . . 5.330 4.738 4.431 4.946 . 0 0 "[ . 1 . 2]" 1
683 1 43 GLU H 1 52 VAL MG1 . . 5.410 4.961 4.736 5.104 . 0 0 "[ . 1 . 2]" 1
684 1 43 GLU H 1 55 THR MG . . 3.620 3.671 3.322 3.817 0.197 4 0 "[ . 1 . 2]" 1
685 1 43 GLU HA 1 43 GLU HG2 . . 3.930 3.050 2.354 3.382 . 0 0 "[ . 1 . 2]" 1
686 1 43 GLU HA 1 43 GLU HG3 . . 3.930 2.737 2.418 3.603 . 0 0 "[ . 1 . 2]" 1
687 1 43 GLU HA 1 46 LEU H . . 4.240 3.170 3.048 3.327 . 0 0 "[ . 1 . 2]" 1
688 1 43 GLU HA 1 46 LEU HB2 . . 4.030 2.811 2.569 3.130 . 0 0 "[ . 1 . 2]" 1
689 1 43 GLU HA 1 46 LEU HB3 . . 4.620 4.532 4.309 4.848 0.228 18 0 "[ . 1 . 2]" 1
690 1 43 GLU HA 1 46 LEU QD . . 4.170 2.977 2.457 3.244 . 0 0 "[ . 1 . 2]" 1
691 1 43 GLU HA 1 47 LYS H . . 4.570 4.241 4.042 4.303 . 0 0 "[ . 1 . 2]" 1
692 1 43 GLU HA 1 52 VAL HB . . 4.690 4.691 4.433 4.966 0.276 8 0 "[ . 1 . 2]" 1
693 1 43 GLU HA 1 52 VAL MG1 . . 3.410 2.788 2.549 3.070 . 0 0 "[ . 1 . 2]" 1
694 1 43 GLU HA 1 52 VAL MG2 . . 3.640 2.962 2.821 3.141 . 0 0 "[ . 1 . 2]" 1
695 1 43 GLU HA 1 55 THR MG . . 3.360 2.578 2.352 2.781 . 0 0 "[ . 1 . 2]" 1
696 1 43 GLU QB 1 44 ASN H . . 3.250 2.629 2.419 2.900 . 0 0 "[ . 1 . 2]" 1
697 1 43 GLU QB 1 52 VAL MG1 . . 4.010 2.992 2.623 3.205 . 0 0 "[ . 1 . 2]" 1
698 1 43 GLU QB 1 55 THR MG . . 3.240 2.164 1.982 2.553 . 0 0 "[ . 1 . 2]" 1
699 1 43 GLU HB2 1 44 ASN H . . 3.980 3.923 3.707 4.120 0.140 10 0 "[ . 1 . 2]" 1
700 1 43 GLU HB2 1 52 VAL MG1 . . 4.560 3.065 2.670 3.304 . 0 0 "[ . 1 . 2]" 1
701 1 43 GLU HB3 1 44 ASN H . . 3.980 2.672 2.446 2.974 . 0 0 "[ . 1 . 2]" 1
702 1 43 GLU HB3 1 52 VAL MG1 . . 4.560 4.192 3.843 4.339 . 0 0 "[ . 1 . 2]" 1
703 1 43 GLU QG 1 52 VAL H . . 4.900 4.427 4.159 4.729 . 0 0 "[ . 1 . 2]" 1
704 1 43 GLU QG 1 52 VAL HB . . 3.570 2.463 2.275 2.698 . 0 0 "[ . 1 . 2]" 1
705 1 43 GLU QG 1 52 VAL MG1 . . 3.270 2.074 1.825 2.389 . 0 0 "[ . 1 . 2]" 1
706 1 43 GLU QG 1 52 VAL MG2 . . 3.460 2.059 1.857 2.226 . 0 0 "[ . 1 . 2]" 1
707 1 43 GLU HG2 1 52 VAL MG1 . . 3.980 3.331 1.940 3.879 . 0 0 "[ . 1 . 2]" 1
708 1 43 GLU HG3 1 52 VAL MG1 . . 3.980 2.172 1.938 2.748 . 0 0 "[ . 1 . 2]" 1
709 1 44 ASN H 1 44 ASN HB2 . . 3.090 2.338 2.216 2.532 . 0 0 "[ . 1 . 2]" 1
710 1 44 ASN H 1 44 ASN HB3 . . 3.650 3.561 3.515 3.597 . 0 0 "[ . 1 . 2]" 1
711 1 44 ASN H 1 45 MET H . . 3.290 2.732 2.502 2.886 . 0 0 "[ . 1 . 2]" 1
712 1 44 ASN H 1 47 LYS QG . . 5.160 3.910 3.592 4.384 . 0 0 "[ . 1 . 2]" 1
713 1 44 ASN HA 1 46 LEU H . . 4.860 4.237 4.078 4.426 . 0 0 "[ . 1 . 2]" 1
714 1 44 ASN HA 1 47 LYS H . . 3.880 3.359 3.262 3.505 . 0 0 "[ . 1 . 2]" 1
715 1 44 ASN HA 1 47 LYS HB2 . . 4.070 2.441 2.280 2.659 . 0 0 "[ . 1 . 2]" 1
716 1 44 ASN HA 1 47 LYS HB3 . . 4.180 3.848 3.647 4.089 . 0 0 "[ . 1 . 2]" 1
717 1 44 ASN HA 1 47 LYS HD2 . . 4.670 3.368 1.986 5.071 0.401 11 0 "[ . 1 . 2]" 1
718 1 44 ASN HA 1 47 LYS QD . . 4.010 2.992 1.956 4.418 0.408 11 0 "[ . 1 . 2]" 1
719 1 44 ASN HA 1 47 LYS HD3 . . 4.670 3.891 1.987 4.946 0.276 18 0 "[ . 1 . 2]" 1
720 1 44 ASN HA 1 47 LYS HE2 . . 4.490 3.998 2.157 4.987 0.497 6 0 "[ . 1 . 2]" 1
721 1 44 ASN HA 1 47 LYS QE . . 3.830 3.310 1.946 3.863 0.033 7 0 "[ . 1 . 2]" 1
722 1 44 ASN HA 1 47 LYS HE3 . . 4.490 3.759 2.033 4.985 0.495 11 0 "[ . 1 . 2]" 1
723 1 44 ASN HA 1 47 LYS QG . . 3.320 2.328 2.080 3.018 . 0 0 "[ . 1 . 2]" 1
724 1 44 ASN HB2 1 45 MET H . . 3.570 2.868 2.760 3.092 . 0 0 "[ . 1 . 2]" 1
725 1 44 ASN HB3 1 45 MET H . . 3.780 3.583 3.360 3.774 . 0 0 "[ . 1 . 2]" 1
726 1 44 ASN HB3 1 47 LYS HB2 . . 5.090 4.350 4.174 4.524 . 0 0 "[ . 1 . 2]" 1
727 1 45 MET H 1 45 MET HB2 . . 3.740 3.606 3.595 3.629 . 0 0 "[ . 1 . 2]" 1
728 1 45 MET H 1 45 MET QB . . 3.010 2.541 2.442 2.596 . 0 0 "[ . 1 . 2]" 1
729 1 45 MET H 1 45 MET HB3 . . 3.740 2.598 2.483 2.662 . 0 0 "[ . 1 . 2]" 1
730 1 45 MET H 1 45 MET ME . . 4.750 4.674 4.589 4.807 0.057 9 0 "[ . 1 . 2]" 1
731 1 45 MET H 1 45 MET HG2 . . 4.660 2.055 1.926 2.340 . 0 0 "[ . 1 . 2]" 1
732 1 45 MET H 1 45 MET QG . . 3.960 2.041 1.916 2.319 . 0 0 "[ . 1 . 2]" 1
733 1 45 MET H 1 45 MET HG3 . . 4.660 3.484 3.353 3.784 . 0 0 "[ . 1 . 2]" 1
734 1 45 MET H 1 46 LEU H . . 3.110 2.474 2.342 2.579 . 0 0 "[ . 1 . 2]" 1
735 1 45 MET H 1 46 LEU HG . . 4.770 4.105 3.930 4.355 . 0 0 "[ . 1 . 2]" 1
736 1 45 MET HA 1 45 MET HG2 . . 3.930 3.662 3.624 3.749 . 0 0 "[ . 1 . 2]" 1
737 1 45 MET HA 1 45 MET HG3 . . 3.930 3.846 3.742 3.902 . 0 0 "[ . 1 . 2]" 1
738 1 45 MET HA 1 46 LEU QD . . 5.440 4.811 4.640 4.993 . 0 0 "[ . 1 . 2]" 1
739 1 45 MET HA 1 47 LYS H . . 4.310 3.940 3.791 4.132 . 0 0 "[ . 1 . 2]" 1
740 1 45 MET HA 1 47 LYS HB2 . . 5.040 4.726 4.620 4.893 . 0 0 "[ . 1 . 2]" 1
741 1 45 MET HA 1 48 PRO HD2 . . 4.360 3.425 3.315 3.549 . 0 0 "[ . 1 . 2]" 1
742 1 45 MET HA 1 48 PRO HD3 . . 4.700 4.379 4.257 4.469 . 0 0 "[ . 1 . 2]" 1
743 1 45 MET HA 1 48 PRO HG2 . . 4.400 3.925 3.785 4.144 . 0 0 "[ . 1 . 2]" 1
744 1 45 MET HA 1 48 PRO HG3 . . 4.400 4.039 3.901 4.205 . 0 0 "[ . 1 . 2]" 1
745 1 45 MET QB 1 45 MET ME . . 3.510 3.230 2.997 3.411 . 0 0 "[ . 1 . 2]" 1
746 1 45 MET QB 1 46 LEU H . . 3.480 3.523 3.431 3.599 0.119 5 0 "[ . 1 . 2]" 1
747 1 45 MET QB 1 46 LEU QD . . 4.490 3.672 3.391 3.908 . 0 0 "[ . 1 . 2]" 1
748 1 45 MET QB 1 46 LEU HG . . 4.440 3.963 3.810 4.123 . 0 0 "[ . 1 . 2]" 1
749 1 45 MET QB 1 104 LEU MD1 . . 4.720 3.758 3.649 3.855 . 0 0 "[ . 1 . 2]" 1
750 1 45 MET HB2 1 45 MET ME . . 4.160 3.455 3.156 3.659 . 0 0 "[ . 1 . 2]" 1
751 1 45 MET HB2 1 46 LEU H . . 4.050 3.914 3.765 4.035 . 0 0 "[ . 1 . 2]" 1
752 1 45 MET HB2 1 104 LEU MD1 . . 5.500 4.037 3.920 4.110 . 0 0 "[ . 1 . 2]" 1
753 1 45 MET HB3 1 45 MET ME . . 4.160 3.883 3.739 4.076 . 0 0 "[ . 1 . 2]" 1
754 1 45 MET HB3 1 46 LEU H . . 4.050 4.002 3.855 4.054 0.004 5 0 "[ . 1 . 2]" 1
755 1 45 MET HB3 1 104 LEU MD1 . . 5.500 4.482 4.305 4.722 . 0 0 "[ . 1 . 2]" 1
756 1 45 MET ME 1 45 MET HG2 . . 3.670 2.986 2.828 3.143 . 0 0 "[ . 1 . 2]" 1
757 1 45 MET ME 1 45 MET QG . . 3.060 2.009 1.964 2.098 . 0 0 "[ . 1 . 2]" 1
758 1 45 MET ME 1 45 MET HG3 . . 3.670 2.043 1.986 2.163 . 0 0 "[ . 1 . 2]" 1
759 1 45 MET ME 1 46 LEU HA . . 4.640 4.849 4.511 4.932 0.292 9 0 "[ . 1 . 2]" 1
760 1 45 MET ME 1 46 LEU QD . . 2.930 2.318 2.156 2.494 . 0 0 "[ . 1 . 2]" 1
761 1 45 MET ME 1 46 LEU HG . . 3.760 2.720 2.299 3.017 . 0 0 "[ . 1 . 2]" 1
762 1 45 MET ME 1 86 PHE HB3 . . 4.740 4.603 4.397 4.899 0.159 18 0 "[ . 1 . 2]" 1
763 1 45 MET ME 1 86 PHE QD . . 4.130 2.924 2.679 3.484 . 0 0 "[ . 1 . 2]" 1
764 1 45 MET ME 1 86 PHE QE . . 4.290 2.099 1.880 2.661 . 0 0 "[ . 1 . 2]" 1
765 1 45 MET ME 1 86 PHE HZ . . 4.140 3.316 2.940 3.466 . 0 0 "[ . 1 . 2]" 1
766 1 45 MET ME 1 91 ILE MD . . 3.950 3.355 2.970 3.631 . 0 0 "[ . 1 . 2]" 1
767 1 45 MET ME 1 104 LEU MD1 . . 3.500 2.644 1.957 2.802 . 0 0 "[ . 1 . 2]" 1
768 1 45 MET ME 1 104 LEU MD2 . . 3.930 3.028 2.444 3.820 . 0 0 "[ . 1 . 2]" 1
769 1 45 MET QG 1 46 LEU QD . . 3.840 2.379 2.128 2.741 . 0 0 "[ . 1 . 2]" 1
770 1 45 MET QG 1 86 PHE QE . . 4.390 2.544 2.055 2.987 . 0 0 "[ . 1 . 2]" 1
771 1 45 MET QG 1 86 PHE HZ . . 3.860 2.240 2.028 2.520 . 0 0 "[ . 1 . 2]" 1
772 1 45 MET HG2 1 86 PHE QE . . 5.170 3.932 3.618 4.296 . 0 0 "[ . 1 . 2]" 1
773 1 45 MET HG2 1 86 PHE HZ . . 4.580 3.731 3.371 4.058 . 0 0 "[ . 1 . 2]" 1
774 1 45 MET HG3 1 86 PHE QE . . 5.170 2.580 2.067 3.050 . 0 0 "[ . 1 . 2]" 1
775 1 45 MET HG3 1 86 PHE HZ . . 4.580 2.258 2.044 2.545 . 0 0 "[ . 1 . 2]" 1
776 1 46 LEU H 1 46 LEU HB2 . . 3.000 2.564 2.445 2.709 . 0 0 "[ . 1 . 2]" 1
777 1 46 LEU H 1 46 LEU HB3 . . 3.640 3.659 3.637 3.685 0.045 14 0 "[ . 1 . 2]" 1
778 1 46 LEU H 1 46 LEU MD1 . . 3.950 3.664 3.360 3.840 . 0 0 "[ . 1 . 2]" 1
779 1 46 LEU H 1 46 LEU MD2 . . 3.950 3.505 3.319 3.649 . 0 0 "[ . 1 . 2]" 1
780 1 46 LEU H 1 46 LEU HG . . 3.660 2.422 2.091 2.643 . 0 0 "[ . 1 . 2]" 1
781 1 46 LEU H 1 47 LYS H . . 3.160 2.278 2.146 2.405 . 0 0 "[ . 1 . 2]" 1
782 1 46 LEU H 1 47 LYS QG . . 5.070 4.274 4.217 4.361 . 0 0 "[ . 1 . 2]" 1
783 1 46 LEU H 1 48 PRO HD3 . . 5.500 5.029 4.866 5.128 . 0 0 "[ . 1 . 2]" 1
784 1 46 LEU H 1 52 VAL MG2 . . 4.060 3.741 3.515 3.900 . 0 0 "[ . 1 . 2]" 1
785 1 46 LEU H 1 82 VAL QG . . 5.500 5.298 4.962 5.499 . 0 0 "[ . 1 . 2]" 1
786 1 46 LEU HA 1 46 LEU MD1 . . 4.350 3.921 3.875 4.001 . 0 0 "[ . 1 . 2]" 1
787 1 46 LEU HA 1 46 LEU QD . . 2.980 2.216 2.025 2.545 . 0 0 "[ . 1 . 2]" 1
788 1 46 LEU HA 1 46 LEU MD2 . . 4.350 2.229 2.032 2.575 . 0 0 "[ . 1 . 2]" 1
789 1 46 LEU HA 1 48 PRO HD2 . . 4.520 3.719 3.608 3.768 . 0 0 "[ . 1 . 2]" 1
790 1 46 LEU HA 1 48 PRO HD3 . . 5.500 5.461 5.363 5.501 0.001 2 0 "[ . 1 . 2]" 1
791 1 46 LEU HA 1 49 PHE H . . 4.840 3.456 3.326 3.515 . 0 0 "[ . 1 . 2]" 1
792 1 46 LEU HA 1 49 PHE QD . . 3.860 3.005 2.551 3.234 . 0 0 "[ . 1 . 2]" 1
793 1 46 LEU HA 1 49 PHE QE . . 4.930 4.541 4.096 4.641 . 0 0 "[ . 1 . 2]" 1
794 1 46 LEU HA 1 52 VAL MG2 . . 4.540 4.031 3.751 4.247 . 0 0 "[ . 1 . 2]" 1
795 1 46 LEU HA 1 73 MET ME . . 4.360 3.977 3.760 4.197 . 0 0 "[ . 1 . 2]" 1
796 1 46 LEU HA 1 82 VAL QG . . 4.540 3.475 3.036 3.662 . 0 0 "[ . 1 . 2]" 1
797 1 46 LEU HA 1 86 PHE QE . . 4.020 3.315 3.087 3.601 . 0 0 "[ . 1 . 2]" 1
798 1 46 LEU HB2 1 47 LYS H . . 3.740 3.388 3.124 3.514 . 0 0 "[ . 1 . 2]" 1
799 1 46 LEU HB2 1 47 LYS HA . . 5.200 4.307 4.192 4.401 . 0 0 "[ . 1 . 2]" 1
800 1 46 LEU HB2 1 52 VAL MG2 . . 3.200 2.013 1.863 2.126 . 0 0 "[ . 1 . 2]" 1
801 1 46 LEU HB3 1 46 LEU MD1 . . 3.430 2.407 2.291 2.603 . 0 0 "[ . 1 . 2]" 1
802 1 46 LEU HB3 1 46 LEU MD2 . . 3.430 2.271 2.120 2.391 . 0 0 "[ . 1 . 2]" 1
803 1 46 LEU HB3 1 47 LYS H . . 4.380 4.258 4.078 4.344 . 0 0 "[ . 1 . 2]" 1
804 1 46 LEU HB3 1 52 VAL MG2 . . 3.360 2.682 2.254 3.049 . 0 0 "[ . 1 . 2]" 1
805 1 46 LEU HB3 1 73 MET ME . . 3.580 2.655 2.394 3.075 . 0 0 "[ . 1 . 2]" 1
806 1 46 LEU HB3 1 82 VAL QG . . 4.160 3.521 3.040 3.818 . 0 0 "[ . 1 . 2]" 1
807 1 46 LEU QD 1 52 VAL MG1 . . 3.970 2.772 2.465 3.142 . 0 0 "[ . 1 . 2]" 1
808 1 46 LEU QD 1 52 VAL MG2 . . 3.740 2.969 2.777 3.196 . 0 0 "[ . 1 . 2]" 1
809 1 46 LEU QD 1 55 THR HB . . 4.900 4.472 4.207 4.669 . 0 0 "[ . 1 . 2]" 1
810 1 46 LEU QD 1 71 ALA HA . . 4.860 3.783 3.647 4.050 . 0 0 "[ . 1 . 2]" 1
811 1 46 LEU QD 1 71 ALA MB . . 2.850 1.756 1.649 1.901 . 0 0 "[ . 1 . 2]" 1
812 1 46 LEU QD 1 73 MET ME . . 3.780 3.067 2.749 3.408 . 0 0 "[ . 1 . 2]" 1
813 1 46 LEU QD 1 73 MET QG . . 4.920 3.584 3.231 3.866 . 0 0 "[ . 1 . 2]" 1
814 1 46 LEU QD 1 82 VAL HA . . 4.820 4.278 4.075 4.497 . 0 0 "[ . 1 . 2]" 1
815 1 46 LEU QD 1 82 VAL HB . . 4.280 4.032 3.691 4.234 . 0 0 "[ . 1 . 2]" 1
816 1 46 LEU QD 1 82 VAL QG . . 3.130 1.981 1.785 2.151 . 0 0 "[ . 1 . 2]" 1
817 1 46 LEU QD 1 86 PHE QE . . 3.610 2.574 2.213 2.770 . 0 0 "[ . 1 . 2]" 1
818 1 46 LEU QD 1 86 PHE HZ . . 4.460 2.315 2.050 2.555 . 0 0 "[ . 1 . 2]" 1
819 1 46 LEU HG 1 71 ALA MB . . 4.300 3.906 3.722 4.140 . 0 0 "[ . 1 . 2]" 1
820 1 47 LYS H 1 47 LYS HB2 . . 3.260 2.163 2.150 2.218 . 0 0 "[ . 1 . 2]" 1
821 1 47 LYS H 1 47 LYS HB3 . . 3.530 3.475 3.461 3.515 . 0 0 "[ . 1 . 2]" 1
822 1 47 LYS H 1 47 LYS HD2 . . 5.500 4.819 4.158 5.211 . 0 0 "[ . 1 . 2]" 1
823 1 47 LYS H 1 47 LYS HD3 . . 5.500 5.046 4.271 5.478 . 0 0 "[ . 1 . 2]" 1
824 1 47 LYS H 1 47 LYS QG . . 3.500 2.919 2.824 2.994 . 0 0 "[ . 1 . 2]" 1
825 1 47 LYS H 1 48 PRO HD2 . . 3.860 2.045 1.940 2.258 . 0 0 "[ . 1 . 2]" 1
826 1 47 LYS H 1 48 PRO HD3 . . 3.580 3.115 3.037 3.284 . 0 0 "[ . 1 . 2]" 1
827 1 47 LYS H 1 52 VAL MG2 . . 3.710 3.369 3.060 3.578 . 0 0 "[ . 1 . 2]" 1
828 1 47 LYS HA 1 47 LYS HD2 . . 5.500 4.188 2.603 4.656 . 0 0 "[ . 1 . 2]" 1
829 1 47 LYS HA 1 47 LYS HD3 . . 5.500 4.044 2.696 4.565 . 0 0 "[ . 1 . 2]" 1
830 1 47 LYS HA 1 52 VAL MG2 . . 3.430 2.390 2.186 2.562 . 0 0 "[ . 1 . 2]" 1
831 1 47 LYS HB2 1 47 LYS QD . . 3.660 2.796 2.403 3.393 . 0 0 "[ . 1 . 2]" 1
832 1 47 LYS HB2 1 47 LYS HE2 . . 5.440 4.212 3.112 4.905 . 0 0 "[ . 1 . 2]" 1
833 1 47 LYS HB2 1 47 LYS QE . . 4.640 3.576 2.451 4.181 . 0 0 "[ . 1 . 2]" 1
834 1 47 LYS HB2 1 47 LYS HE3 . . 5.440 3.968 2.487 4.966 . 0 0 "[ . 1 . 2]" 1
835 1 47 LYS HB2 1 48 PRO HA . . 5.500 4.860 4.847 4.862 . 0 0 "[ . 1 . 2]" 1
836 1 47 LYS HB2 1 48 PRO HD3 . . 3.670 1.962 1.948 1.966 . 0 0 "[ . 1 . 2]" 1
837 1 47 LYS HB2 1 49 PHE H . . 5.080 4.607 4.597 4.612 . 0 0 "[ . 1 . 2]" 1
838 1 47 LYS HB2 1 52 VAL MG2 . . 4.560 4.252 4.060 4.364 . 0 0 "[ . 1 . 2]" 1
839 1 47 LYS HB3 1 47 LYS HE2 . . 5.130 3.932 2.231 4.478 . 0 0 "[ . 1 . 2]" 1
840 1 47 LYS HB3 1 47 LYS QE . . 4.350 3.327 2.019 4.056 . 0 0 "[ . 1 . 2]" 1
841 1 47 LYS HB3 1 47 LYS HE3 . . 5.130 3.708 2.031 4.705 . 0 0 "[ . 1 . 2]" 1
842 1 47 LYS HB3 1 48 PRO HD3 . . 4.080 2.436 2.430 2.473 . 0 0 "[ . 1 . 2]" 1
843 1 47 LYS HB3 1 52 VAL MG2 . . 4.510 4.476 4.276 4.560 0.050 9 0 "[ . 1 . 2]" 1
844 1 47 LYS QD 1 52 VAL MG2 . . 4.840 4.261 3.095 4.726 . 0 0 "[ . 1 . 2]" 1
845 1 47 LYS HD2 1 52 VAL MG2 . . 5.500 4.922 3.576 5.461 . 0 0 "[ . 1 . 2]" 1
846 1 47 LYS HD3 1 52 VAL MG2 . . 5.500 4.717 3.178 5.224 . 0 0 "[ . 1 . 2]" 1
847 1 47 LYS QG 1 48 PRO HD2 . . 4.580 4.135 4.112 4.177 . 0 0 "[ . 1 . 2]" 1
848 1 47 LYS QG 1 48 PRO HD3 . . 4.340 3.924 3.792 3.997 . 0 0 "[ . 1 . 2]" 1
849 1 47 LYS QG 1 51 GLN HA . . 5.330 5.542 5.264 6.128 0.798 18 3 "[ . 1- . + *]" 1
850 1 47 LYS QG 1 52 VAL H . . 4.680 4.429 4.171 4.817 0.137 18 0 "[ . 1 . 2]" 1
851 1 47 LYS QG 1 52 VAL MG2 . . 4.100 2.654 2.398 2.946 . 0 0 "[ . 1 . 2]" 1
852 1 48 PRO HA 1 50 GLY H . . 4.810 4.591 4.195 4.800 . 0 0 "[ . 1 . 2]" 1
853 1 48 PRO QB 1 49 PHE H . . 4.000 3.722 3.695 3.730 . 0 0 "[ . 1 . 2]" 1
854 1 48 PRO QB 1 49 PHE QD . . 4.810 3.474 3.303 3.663 . 0 0 "[ . 1 . 2]" 1
855 1 48 PRO QB 1 49 PHE QE . . 4.550 4.087 3.991 4.210 . 0 0 "[ . 1 . 2]" 1
856 1 48 PRO HD2 1 49 PHE H . . 3.940 3.031 2.985 3.045 . 0 0 "[ . 1 . 2]" 1
857 1 48 PRO HD2 1 49 PHE QD . . 4.190 2.917 2.749 3.053 . 0 0 "[ . 1 . 2]" 1
858 1 48 PRO HD3 1 49 PHE H . . 4.370 4.045 4.021 4.053 . 0 0 "[ . 1 . 2]" 1
859 1 48 PRO HD3 1 49 PHE QD . . 4.470 4.315 4.216 4.379 . 0 0 "[ . 1 . 2]" 1
860 1 48 PRO QG 1 49 PHE H . . 4.610 3.277 3.216 3.296 . 0 0 "[ . 1 . 2]" 1
861 1 48 PRO QG 1 49 PHE QE . . 4.600 2.674 2.544 2.760 . 0 0 "[ . 1 . 2]" 1
862 1 49 PHE H 1 49 PHE HB2 . . 3.480 2.357 2.333 2.385 . 0 0 "[ . 1 . 2]" 1
863 1 49 PHE H 1 49 PHE HB3 . . 3.820 3.603 3.586 3.623 . 0 0 "[ . 1 . 2]" 1
864 1 49 PHE H 1 49 PHE QD . . 3.540 2.537 2.426 2.648 . 0 0 "[ . 1 . 2]" 1
865 1 49 PHE H 1 49 PHE QE . . 5.130 4.842 4.732 4.933 . 0 0 "[ . 1 . 2]" 1
866 1 49 PHE H 1 50 GLY H . . 3.060 2.166 2.055 2.267 . 0 0 "[ . 1 . 2]" 1
867 1 49 PHE H 1 50 GLY QA . . 4.810 4.216 4.181 4.251 . 0 0 "[ . 1 . 2]" 1
868 1 49 PHE H 1 52 VAL MG2 . . 4.740 4.534 4.331 4.727 . 0 0 "[ . 1 . 2]" 1
869 1 49 PHE H 1 73 MET ME . . 4.390 4.655 4.464 4.840 0.450 9 0 "[ . 1 . 2]" 1
870 1 49 PHE HA 1 49 PHE QD . . 3.710 3.069 2.984 3.101 . 0 0 "[ . 1 . 2]" 1
871 1 49 PHE HA 1 81 ALA MB . . 4.680 4.497 4.182 4.758 0.078 19 0 "[ . 1 . 2]" 1
872 1 49 PHE HB2 1 50 GLY H . . 4.210 2.740 2.548 3.054 . 0 0 "[ . 1 . 2]" 1
873 1 49 PHE HB2 1 73 MET ME . . 3.440 3.409 3.195 3.607 0.167 2 0 "[ . 1 . 2]" 1
874 1 49 PHE HB2 1 82 VAL QG . . 3.830 3.133 2.622 3.378 . 0 0 "[ . 1 . 2]" 1
875 1 49 PHE HB3 1 50 GLY H . . 4.350 3.478 3.330 3.803 . 0 0 "[ . 1 . 2]" 1
876 1 49 PHE HB3 1 73 MET ME . . 3.610 3.364 2.809 3.690 0.080 11 0 "[ . 1 . 2]" 1
877 1 49 PHE HB3 1 81 ALA MB . . 3.910 3.818 3.445 3.911 0.001 18 0 "[ . 1 . 2]" 1
878 1 49 PHE HB3 1 82 VAL QG . . 3.540 2.408 1.956 2.633 . 0 0 "[ . 1 . 2]" 1
879 1 49 PHE QD 1 50 GLY H . . 4.800 4.269 4.177 4.361 . 0 0 "[ . 1 . 2]" 1
880 1 49 PHE QD 1 73 MET ME . . 4.740 4.642 4.272 4.921 0.181 11 0 "[ . 1 . 2]" 1
881 1 49 PHE QD 1 81 ALA MB . . 3.400 3.171 2.855 3.374 . 0 0 "[ . 1 . 2]" 1
882 1 49 PHE QD 1 82 VAL H . . 4.600 3.773 3.212 4.079 . 0 0 "[ . 1 . 2]" 1
883 1 49 PHE QD 1 82 VAL HA . . 3.690 2.295 2.003 2.641 . 0 0 "[ . 1 . 2]" 1
884 1 49 PHE QD 1 82 VAL HB . . 5.450 4.674 4.224 5.011 . 0 0 "[ . 1 . 2]" 1
885 1 49 PHE QD 1 82 VAL QG . . 3.760 2.421 2.073 2.779 . 0 0 "[ . 1 . 2]" 1
886 1 49 PHE QD 1 85 HIS QB . . 5.050 3.608 3.191 4.054 . 0 0 "[ . 1 . 2]" 1
887 1 49 PHE QD 1 86 PHE HZ . . 4.080 3.919 3.759 4.140 0.060 15 0 "[ . 1 . 2]" 1
888 1 49 PHE QE 1 81 ALA MB . . 4.710 4.532 4.119 4.881 0.171 13 0 "[ . 1 . 2]" 1
889 1 49 PHE QE 1 85 HIS QB . . 4.730 1.957 1.804 2.141 . 0 0 "[ . 1 . 2]" 1
890 1 49 PHE QE 1 86 PHE HZ . . 4.360 3.742 3.416 3.928 . 0 0 "[ . 1 . 2]" 1
891 1 49 PHE HZ 1 85 HIS HB2 . . 4.880 4.306 3.900 4.875 . 0 0 "[ . 1 . 2]" 1
892 1 49 PHE HZ 1 85 HIS QB . . 4.290 3.198 2.731 3.736 . 0 0 "[ . 1 . 2]" 1
893 1 49 PHE HZ 1 85 HIS HB3 . . 4.880 3.301 2.789 3.899 . 0 0 "[ . 1 . 2]" 1
894 1 49 PHE HZ 1 86 PHE QE . . 4.900 3.369 3.093 3.671 . 0 0 "[ . 1 . 2]" 1
895 1 50 GLY H 1 51 GLN H . . 4.530 4.378 4.355 4.388 . 0 0 "[ . 1 . 2]" 1
896 1 50 GLY H 1 52 VAL MG2 . . 4.720 3.757 3.534 3.953 . 0 0 "[ . 1 . 2]" 1
897 1 50 GLY H 1 73 MET ME . . 3.830 3.338 3.068 3.654 . 0 0 "[ . 1 . 2]" 1
898 1 50 GLY H 1 78 LYS QD . . 4.530 4.434 3.947 4.790 0.260 11 0 "[ . 1 . 2]" 1
899 1 50 GLY H 1 82 VAL QG . . 5.150 4.707 4.072 4.905 . 0 0 "[ . 1 . 2]" 1
900 1 50 GLY QA 1 51 GLN HB2 . . 5.150 4.378 4.271 4.539 . 0 0 "[ . 1 . 2]" 1
901 1 50 GLY QA 1 51 GLN HB3 . . 5.340 4.353 4.225 4.446 . 0 0 "[ . 1 . 2]" 1
902 1 50 GLY QA 1 73 MET ME . . 3.170 2.635 1.941 2.932 . 0 0 "[ . 1 . 2]" 1
903 1 50 GLY QA 1 74 GLU QG . . 4.560 3.751 3.405 3.953 . 0 0 "[ . 1 . 2]" 1
904 1 50 GLY QA 1 78 LYS HB3 . . 4.690 3.297 2.842 3.748 . 0 0 "[ . 1 . 2]" 1
905 1 50 GLY QA 1 78 LYS QD . . 3.790 2.237 1.952 2.692 . 0 0 "[ . 1 . 2]" 1
906 1 50 GLY QA 1 78 LYS QE . . 3.540 2.379 1.856 3.098 . 0 0 "[ . 1 . 2]" 1
907 1 50 GLY HA2 1 51 GLN H . . 3.300 2.538 2.396 2.678 . 0 0 "[ . 1 . 2]" 1
908 1 50 GLY HA2 1 73 MET ME . . 3.850 4.014 3.422 4.305 0.455 15 0 "[ . 1 . 2]" 1
909 1 50 GLY HA2 1 78 LYS HE2 . . 4.550 3.497 2.231 4.495 . 0 0 "[ . 1 . 2]" 1
910 1 50 GLY HA2 1 78 LYS HE3 . . 4.550 2.844 2.082 4.464 . 0 0 "[ . 1 . 2]" 1
911 1 50 GLY HA2 1 78 LYS HG3 . . 4.310 4.024 3.662 4.199 . 0 0 "[ . 1 . 2]" 1
912 1 50 GLY HA3 1 51 GLN H . . 3.300 2.590 2.455 2.744 . 0 0 "[ . 1 . 2]" 1
913 1 50 GLY HA3 1 73 MET ME . . 3.850 2.673 1.952 2.984 . 0 0 "[ . 1 . 2]" 1
914 1 50 GLY HA3 1 78 LYS HE2 . . 4.550 3.635 2.048 4.465 . 0 0 "[ . 1 . 2]" 1
915 1 50 GLY HA3 1 78 LYS HE3 . . 4.550 3.228 2.315 4.546 . 0 0 "[ . 1 . 2]" 1
916 1 50 GLY HA3 1 78 LYS HG3 . . 4.310 3.006 2.567 3.372 . 0 0 "[ . 1 . 2]" 1
917 1 51 GLN H 1 51 GLN HB2 . . 3.210 2.653 2.475 2.835 . 0 0 "[ . 1 . 2]" 1
918 1 51 GLN H 1 51 GLN HB3 . . 3.430 2.428 2.301 2.573 . 0 0 "[ . 1 . 2]" 1
919 1 51 GLN H 1 51 GLN HG2 . . 4.590 4.465 4.246 4.618 0.028 15 0 "[ . 1 . 2]" 1
920 1 51 GLN H 1 51 GLN HG3 . . 4.590 4.451 4.329 4.559 . 0 0 "[ . 1 . 2]" 1
921 1 51 GLN H 1 52 VAL H . . 4.550 4.350 4.214 4.455 . 0 0 "[ . 1 . 2]" 1
922 1 51 GLN H 1 73 MET ME . . 4.150 3.783 3.434 4.032 . 0 0 "[ . 1 . 2]" 1
923 1 51 GLN H 1 74 GLU H . . 4.900 4.363 4.153 4.543 . 0 0 "[ . 1 . 2]" 1
924 1 51 GLN H 1 74 GLU HB2 . . 5.340 5.289 4.948 5.532 0.192 13 0 "[ . 1 . 2]" 1
925 1 51 GLN H 1 74 GLU HB3 . . 4.110 4.109 3.794 4.337 0.227 13 0 "[ . 1 . 2]" 1
926 1 51 GLN H 1 74 GLU QG . . 3.320 2.961 2.509 3.244 . 0 0 "[ . 1 . 2]" 1
927 1 51 GLN H 1 78 LYS HE2 . . 5.090 3.824 2.707 4.943 . 0 0 "[ . 1 . 2]" 1
928 1 51 GLN H 1 78 LYS QE . . 4.420 3.128 2.666 4.109 . 0 0 "[ . 1 . 2]" 1
929 1 51 GLN H 1 78 LYS HE3 . . 5.090 3.790 2.951 4.732 . 0 0 "[ . 1 . 2]" 1
930 1 51 GLN HA 1 51 GLN HG2 . . 4.000 3.561 3.216 3.880 . 0 0 "[ . 1 . 2]" 1
931 1 51 GLN HA 1 51 GLN QG . . 3.460 2.655 2.373 3.006 . 0 0 "[ . 1 . 2]" 1
932 1 51 GLN HA 1 51 GLN HG3 . . 4.000 2.745 2.419 3.154 . 0 0 "[ . 1 . 2]" 1
933 1 51 GLN HA 1 52 VAL H . . 2.820 2.161 2.140 2.212 . 0 0 "[ . 1 . 2]" 1
934 1 51 GLN HA 1 52 VAL HB . . 4.880 4.754 4.673 4.881 0.001 2 0 "[ . 1 . 2]" 1
935 1 51 GLN HA 1 52 VAL MG2 . . 3.810 3.627 3.521 3.773 . 0 0 "[ . 1 . 2]" 1
936 1 51 GLN HB2 1 52 VAL H . . 4.770 4.394 4.320 4.463 . 0 0 "[ . 1 . 2]" 1
937 1 51 GLN HB3 1 52 VAL H . . 5.130 4.429 4.292 4.515 . 0 0 "[ . 1 . 2]" 1
938 1 51 GLN HB3 1 53 ILE MD . . 4.230 3.618 3.426 3.851 . 0 0 "[ . 1 . 2]" 1
939 1 51 GLN HB3 1 74 GLU H . . 4.470 3.815 3.403 4.111 . 0 0 "[ . 1 . 2]" 1
940 1 51 GLN HB3 1 74 GLU HA . . 4.800 4.582 4.297 4.775 . 0 0 "[ . 1 . 2]" 1
941 1 51 GLN HB3 1 74 GLU HB2 . . 4.030 3.706 3.388 3.942 . 0 0 "[ . 1 . 2]" 1
942 1 51 GLN HB3 1 74 GLU HB3 . . 3.590 2.319 2.033 2.504 . 0 0 "[ . 1 . 2]" 1
943 1 51 GLN HB3 1 74 GLU QG . . 3.930 2.773 2.033 3.205 . 0 0 "[ . 1 . 2]" 1
944 1 51 GLN QE 1 53 ILE MD . . 4.770 3.428 1.893 4.767 . 0 0 "[ . 1 . 2]" 1
945 1 51 GLN QG 1 52 VAL H . . 3.900 3.281 3.059 3.598 . 0 0 "[ . 1 . 2]" 1
946 1 51 GLN QG 1 52 VAL HA . . 4.640 4.255 4.145 4.378 . 0 0 "[ . 1 . 2]" 1
947 1 51 GLN QG 1 52 VAL MG2 . . 5.340 4.676 4.463 4.911 . 0 0 "[ . 1 . 2]" 1
948 1 51 GLN QG 1 53 ILE MD . . 3.550 2.414 1.991 2.949 . 0 0 "[ . 1 . 2]" 1
949 1 51 GLN QG 1 74 GLU H . . 4.840 4.400 3.995 4.742 . 0 0 "[ . 1 . 2]" 1
950 1 51 GLN HG2 1 52 VAL H . . 4.510 4.368 3.665 5.186 0.676 14 2 "[ . 1 -+. 2]" 1
951 1 51 GLN HG3 1 52 VAL H . . 4.510 3.443 3.099 3.737 . 0 0 "[ . 1 . 2]" 1
952 1 52 VAL H 1 52 VAL HB . . 3.380 2.631 2.550 2.767 . 0 0 "[ . 1 . 2]" 1
953 1 52 VAL H 1 52 VAL MG1 . . 4.160 3.778 3.752 3.796 . 0 0 "[ . 1 . 2]" 1
954 1 52 VAL H 1 52 VAL MG2 . . 3.310 2.095 1.916 2.324 . 0 0 "[ . 1 . 2]" 1
955 1 52 VAL HA 1 52 VAL MG1 . . 3.180 2.246 2.104 2.402 . 0 0 "[ . 1 . 2]" 1
956 1 52 VAL HA 1 52 VAL MG2 . . 3.170 2.472 2.376 2.535 . 0 0 "[ . 1 . 2]" 1
957 1 52 VAL HA 1 53 ILE H . . 3.090 2.147 2.140 2.168 . 0 0 "[ . 1 . 2]" 1
958 1 52 VAL HA 1 53 ILE HA . . 4.990 4.390 4.376 4.440 . 0 0 "[ . 1 . 2]" 1
959 1 52 VAL HA 1 53 ILE HB . . 4.800 4.744 4.656 4.804 0.004 6 0 "[ . 1 . 2]" 1
960 1 52 VAL HA 1 53 ILE MD . . 4.600 4.372 3.965 4.601 0.001 6 0 "[ . 1 . 2]" 1
961 1 52 VAL HA 1 53 ILE HG12 . . 4.680 3.608 3.455 3.755 . 0 0 "[ . 1 . 2]" 1
962 1 52 VAL HA 1 53 ILE HG13 . . 5.500 5.306 5.039 5.455 . 0 0 "[ . 1 . 2]" 1
963 1 52 VAL HA 1 54 SER H . . 4.370 4.246 4.047 4.343 . 0 0 "[ . 1 . 2]" 1
964 1 52 VAL HA 1 73 MET HA . . 3.460 3.298 2.742 3.447 . 0 0 "[ . 1 . 2]" 1
965 1 52 VAL HA 1 73 MET ME . . 3.950 3.327 2.734 3.723 . 0 0 "[ . 1 . 2]" 1
966 1 52 VAL HA 1 74 GLU H . . 4.780 4.223 3.981 4.513 . 0 0 "[ . 1 . 2]" 1
967 1 52 VAL HB 1 53 ILE H . . 5.170 4.171 4.058 4.360 . 0 0 "[ . 1 . 2]" 1
968 1 52 VAL MG1 1 53 ILE H . . 3.570 2.662 2.262 3.051 . 0 0 "[ . 1 . 2]" 1
969 1 52 VAL MG1 1 54 SER H . . 3.370 2.993 2.803 3.208 . 0 0 "[ . 1 . 2]" 1
970 1 52 VAL MG1 1 55 THR H . . 4.700 4.198 3.920 4.361 . 0 0 "[ . 1 . 2]" 1
971 1 52 VAL MG1 1 55 THR HA . . 4.830 4.225 4.054 4.391 . 0 0 "[ . 1 . 2]" 1
972 1 52 VAL MG1 1 71 ALA HA . . 4.930 4.244 4.075 4.418 . 0 0 "[ . 1 . 2]" 1
973 1 52 VAL MG1 1 71 ALA MB . . 3.700 3.109 2.853 3.361 . 0 0 "[ . 1 . 2]" 1
974 1 52 VAL MG1 1 72 ARG H . . 4.390 3.674 3.170 4.183 . 0 0 "[ . 1 . 2]" 1
975 1 52 VAL MG1 1 73 MET HA . . 4.550 4.333 3.863 4.546 . 0 0 "[ . 1 . 2]" 1
976 1 52 VAL MG2 1 53 ILE H . . 4.420 4.183 4.081 4.279 . 0 0 "[ . 1 . 2]" 1
977 1 52 VAL MG2 1 73 MET HA . . 4.450 4.710 4.216 4.857 0.407 8 0 "[ . 1 . 2]" 1
978 1 52 VAL MG2 1 73 MET ME . . 3.150 3.060 2.945 3.148 . 0 0 "[ . 1 . 2]" 1
979 1 52 VAL MG2 1 73 MET QG . . 5.340 5.311 3.898 5.698 0.358 10 0 "[ . 1 . 2]" 1
980 1 53 ILE H 1 53 ILE HB . . 3.450 2.621 2.527 2.674 . 0 0 "[ . 1 . 2]" 1
981 1 53 ILE H 1 53 ILE MD . . 4.030 3.359 3.127 3.633 . 0 0 "[ . 1 . 2]" 1
982 1 53 ILE H 1 53 ILE HG12 . . 3.780 2.123 1.911 2.345 . 0 0 "[ . 1 . 2]" 1
983 1 53 ILE H 1 53 ILE HG13 . . 3.890 3.570 3.394 3.782 . 0 0 "[ . 1 . 2]" 1
984 1 53 ILE H 1 53 ILE MG . . 3.950 3.795 3.763 3.831 . 0 0 "[ . 1 . 2]" 1
985 1 53 ILE H 1 54 SER H . . 3.280 2.557 2.351 2.826 . 0 0 "[ . 1 . 2]" 1
986 1 53 ILE H 1 72 ARG HB2 . . 5.500 5.467 5.179 5.824 0.324 1 0 "[ . 1 . 2]" 1
987 1 53 ILE H 1 72 ARG QB . . 4.750 3.830 3.570 4.161 . 0 0 "[ . 1 . 2]" 1
988 1 53 ILE H 1 72 ARG HB3 . . 5.500 3.912 3.631 4.262 . 0 0 "[ . 1 . 2]" 1
989 1 53 ILE H 1 73 MET HA . . 3.840 3.291 2.846 3.553 . 0 0 "[ . 1 . 2]" 1
990 1 53 ILE HA 1 53 ILE MD . . 3.120 2.112 1.984 2.399 . 0 0 "[ . 1 . 2]" 1
991 1 53 ILE HA 1 53 ILE HG12 . . 3.800 3.082 2.944 3.233 . 0 0 "[ . 1 . 2]" 1
992 1 53 ILE HA 1 53 ILE HG13 . . 3.980 3.799 3.731 3.863 . 0 0 "[ . 1 . 2]" 1
993 1 53 ILE HA 1 53 ILE MG . . 2.990 2.306 2.163 2.429 . 0 0 "[ . 1 . 2]" 1
994 1 53 ILE HB 1 53 ILE MD . . 3.660 3.213 3.186 3.219 . 0 0 "[ . 1 . 2]" 1
995 1 53 ILE HB 1 54 SER H . . 3.410 2.235 2.156 2.446 . 0 0 "[ . 1 . 2]" 1
996 1 53 ILE HB 1 54 SER QB . . 5.040 3.620 3.417 3.987 . 0 0 "[ . 1 . 2]" 1
997 1 53 ILE HB 1 72 ARG H . . 4.990 4.133 3.966 4.347 . 0 0 "[ . 1 . 2]" 1
998 1 53 ILE HB 1 72 ARG HB2 . . 4.120 3.932 3.713 4.190 0.070 17 0 "[ . 1 . 2]" 1
999 1 53 ILE HB 1 72 ARG QB . . 3.550 2.196 1.991 2.470 . 0 0 "[ . 1 . 2]" 1
1000 1 53 ILE HB 1 72 ARG HB3 . . 4.120 2.208 1.998 2.488 . 0 0 "[ . 1 . 2]" 1
1001 1 53 ILE HB 1 72 ARG QD . . 3.620 2.641 2.084 3.139 . 0 0 "[ . 1 . 2]" 1
1002 1 53 ILE HB 1 73 MET HA . . 5.020 4.603 4.212 4.872 . 0 0 "[ . 1 . 2]" 1
1003 1 53 ILE MD 1 53 ILE MG . . 2.960 1.958 1.881 2.088 . 0 0 "[ . 1 . 2]" 1
1004 1 53 ILE MD 1 54 SER H . . 5.500 4.568 4.476 4.727 . 0 0 "[ . 1 . 2]" 1
1005 1 53 ILE MD 1 73 MET HA . . 5.030 4.512 4.030 4.729 . 0 0 "[ . 1 . 2]" 1
1006 1 53 ILE MD 1 74 GLU H . . 4.300 3.577 3.274 3.920 . 0 0 "[ . 1 . 2]" 1
1007 1 53 ILE MD 1 74 GLU HA . . 3.220 2.350 2.023 2.595 . 0 0 "[ . 1 . 2]" 1
1008 1 53 ILE MD 1 74 GLU HB2 . . 4.880 3.523 3.050 3.926 . 0 0 "[ . 1 . 2]" 1
1009 1 53 ILE MD 1 74 GLU HB3 . . 3.550 2.614 2.203 2.953 . 0 0 "[ . 1 . 2]" 1
1010 1 53 ILE HG12 1 53 ILE MG . . 3.670 3.189 3.164 3.202 . 0 0 "[ . 1 . 2]" 1
1011 1 53 ILE HG12 1 54 SER H . . 4.650 3.925 3.821 4.057 . 0 0 "[ . 1 . 2]" 1
1012 1 53 ILE HG12 1 73 MET HA . . 4.570 3.238 2.833 3.539 . 0 0 "[ . 1 . 2]" 1
1013 1 53 ILE HG12 1 74 GLU H . . 4.990 3.120 2.725 3.564 . 0 0 "[ . 1 . 2]" 1
1014 1 53 ILE HG12 1 74 GLU HA . . 3.990 2.889 2.642 3.226 . 0 0 "[ . 1 . 2]" 1
1015 1 53 ILE HG13 1 53 ILE MG . . 3.180 2.439 2.286 2.539 . 0 0 "[ . 1 . 2]" 1
1016 1 53 ILE HG13 1 54 SER H . . 4.950 4.508 4.327 4.660 . 0 0 "[ . 1 . 2]" 1
1017 1 53 ILE HG13 1 73 MET HA . . 5.140 4.281 3.969 4.567 . 0 0 "[ . 1 . 2]" 1
1018 1 53 ILE HG13 1 74 GLU HA . . 4.010 2.536 2.321 2.751 . 0 0 "[ . 1 . 2]" 1
1019 1 53 ILE MG 1 54 SER H . . 3.830 3.352 3.197 3.598 . 0 0 "[ . 1 . 2]" 1
1020 1 53 ILE MG 1 54 SER QB . . 3.800 3.020 2.614 3.554 . 0 0 "[ . 1 . 2]" 1
1021 1 53 ILE MG 1 72 ARG HB2 . . 4.370 4.564 4.245 4.812 0.442 12 0 "[ . 1 . 2]" 1
1022 1 53 ILE MG 1 72 ARG QB . . 3.770 3.262 2.995 3.517 . 0 0 "[ . 1 . 2]" 1
1023 1 53 ILE MG 1 72 ARG HB3 . . 4.370 3.341 3.061 3.618 . 0 0 "[ . 1 . 2]" 1
1024 1 53 ILE MG 1 72 ARG QD . . 3.560 2.306 2.047 2.791 . 0 0 "[ . 1 . 2]" 1
1025 1 53 ILE MG 1 72 ARG QG . . 4.440 3.806 3.403 4.176 . 0 0 "[ . 1 . 2]" 1
1026 1 54 SER H 1 55 THR H . . 4.400 4.338 4.234 4.402 0.002 13 0 "[ . 1 . 2]" 1
1027 1 54 SER H 1 55 THR MG . . 4.410 3.800 3.671 3.968 . 0 0 "[ . 1 . 2]" 1
1028 1 54 SER H 1 71 ALA HA . . 4.790 4.574 4.425 4.725 . 0 0 "[ . 1 . 2]" 1
1029 1 54 SER H 1 71 ALA MB . . 5.040 4.685 4.404 4.953 . 0 0 "[ . 1 . 2]" 1
1030 1 54 SER H 1 72 ARG H . . 3.600 2.853 2.675 3.039 . 0 0 "[ . 1 . 2]" 1
1031 1 54 SER H 1 72 ARG HB2 . . 4.850 3.847 3.467 4.244 . 0 0 "[ . 1 . 2]" 1
1032 1 54 SER H 1 72 ARG QB . . 4.170 2.493 2.262 2.782 . 0 0 "[ . 1 . 2]" 1
1033 1 54 SER H 1 72 ARG HB3 . . 4.850 2.528 2.280 2.840 . 0 0 "[ . 1 . 2]" 1
1034 1 54 SER HA 1 55 THR H . . 3.550 2.272 2.183 2.342 . 0 0 "[ . 1 . 2]" 1
1035 1 54 SER QB 1 55 THR H . . 3.700 2.911 2.579 3.302 . 0 0 "[ . 1 . 2]" 1
1036 1 54 SER QB 1 55 THR HA . . 4.740 4.197 3.943 4.508 . 0 0 "[ . 1 . 2]" 1
1037 1 54 SER QB 1 72 ARG H . . 5.170 4.067 3.241 4.936 . 0 0 "[ . 1 . 2]" 1
1038 1 54 SER QB 1 72 ARG HB2 . . 5.500 3.678 2.785 4.235 . 0 0 "[ . 1 . 2]" 1
1039 1 54 SER QB 1 72 ARG QB . . 4.780 3.053 2.518 3.642 . 0 0 "[ . 1 . 2]" 1
1040 1 54 SER QB 1 72 ARG HB3 . . 5.500 3.280 2.660 4.003 . 0 0 "[ . 1 . 2]" 1
1041 1 54 SER QB 1 72 ARG QD . . 4.810 3.573 2.906 4.457 . 0 0 "[ . 1 . 2]" 1
1042 1 55 THR H 1 55 THR MG . . 3.840 3.191 3.062 3.347 . 0 0 "[ . 1 . 2]" 1
1043 1 55 THR HA 1 55 THR MG . . 3.200 2.261 2.134 2.347 . 0 0 "[ . 1 . 2]" 1
1044 1 55 THR HA 1 56 ARG H . . 2.910 2.221 2.186 2.297 . 0 0 "[ . 1 . 2]" 1
1045 1 55 THR HA 1 70 PHE H . . 5.320 4.893 4.602 5.127 . 0 0 "[ . 1 . 2]" 1
1046 1 55 THR HA 1 71 ALA HA . . 3.310 2.337 2.182 2.576 . 0 0 "[ . 1 . 2]" 1
1047 1 55 THR HA 1 72 ARG H . . 4.180 3.658 3.450 3.873 . 0 0 "[ . 1 . 2]" 1
1048 1 55 THR HB 1 56 ARG H . . 3.310 2.924 2.665 3.071 . 0 0 "[ . 1 . 2]" 1
1049 1 55 THR HB 1 56 ARG HA . . 4.880 4.260 4.137 4.330 . 0 0 "[ . 1 . 2]" 1
1050 1 55 THR HB 1 57 ILE MD . . 4.650 4.391 4.043 4.617 . 0 0 "[ . 1 . 2]" 1
1051 1 55 THR HB 1 71 ALA HA . . 4.480 4.287 4.128 4.480 0.000 12 0 "[ . 1 . 2]" 1
1052 1 55 THR HB 1 71 ALA MB . . 4.700 3.967 3.483 4.309 . 0 0 "[ . 1 . 2]" 1
1053 1 55 THR MG 1 56 ARG H . . 3.920 3.722 3.583 3.832 . 0 0 "[ . 1 . 2]" 1
1054 1 55 THR MG 1 72 ARG H . . 4.140 3.434 3.056 3.650 . 0 0 "[ . 1 . 2]" 1
1055 1 55 THR MG 1 72 ARG HB2 . . 5.500 5.629 5.210 5.948 0.448 17 0 "[ . 1 . 2]" 1
1056 1 55 THR MG 1 72 ARG HB3 . . 5.500 5.316 5.048 5.600 0.100 8 0 "[ . 1 . 2]" 1
1057 1 56 ARG H 1 56 ARG HB2 . . 3.780 3.306 3.164 3.422 . 0 0 "[ . 1 . 2]" 1
1058 1 56 ARG H 1 56 ARG HB3 . . 3.780 2.817 2.721 2.924 . 0 0 "[ . 1 . 2]" 1
1059 1 56 ARG H 1 56 ARG QD . . 5.340 4.882 4.080 5.272 . 0 0 "[ . 1 . 2]" 1
1060 1 56 ARG H 1 56 ARG QG . . 4.420 4.118 4.026 4.311 . 0 0 "[ . 1 . 2]" 1
1061 1 56 ARG H 1 57 ILE MD . . 4.470 4.278 3.988 4.714 0.244 10 0 "[ . 1 . 2]" 1
1062 1 56 ARG H 1 70 PHE H . . 3.650 3.040 2.776 3.215 . 0 0 "[ . 1 . 2]" 1
1063 1 56 ARG H 1 70 PHE HB2 . . 4.340 3.789 3.576 4.067 . 0 0 "[ . 1 . 2]" 1
1064 1 56 ARG H 1 70 PHE HB3 . . 5.050 4.655 4.445 4.771 . 0 0 "[ . 1 . 2]" 1
1065 1 56 ARG H 1 71 ALA HA . . 3.960 3.598 3.375 3.765 . 0 0 "[ . 1 . 2]" 1
1066 1 56 ARG HA 1 56 ARG QG . . 3.620 2.492 2.390 2.870 . 0 0 "[ . 1 . 2]" 1
1067 1 56 ARG HA 1 57 ILE H . . 3.170 2.292 2.187 2.370 . 0 0 "[ . 1 . 2]" 1
1068 1 56 ARG HB2 1 56 ARG HD2 . . 3.930 2.893 2.214 3.628 . 0 0 "[ . 1 . 2]" 1
1069 1 56 ARG HB2 1 56 ARG QD . . 3.430 2.622 2.141 3.218 . 0 0 "[ . 1 . 2]" 1
1070 1 56 ARG HB2 1 56 ARG HD3 . . 3.930 3.394 2.310 3.909 . 0 0 "[ . 1 . 2]" 1
1071 1 56 ARG HB2 1 57 ILE H . . 4.410 3.930 3.819 4.153 . 0 0 "[ . 1 . 2]" 1
1072 1 56 ARG HB2 1 70 PHE H . . 5.320 4.820 4.565 4.963 . 0 0 "[ . 1 . 2]" 1
1073 1 56 ARG HB2 1 70 PHE HB2 . . 4.690 4.193 3.934 4.337 . 0 0 "[ . 1 . 2]" 1
1074 1 56 ARG HB3 1 56 ARG HD2 . . 3.980 2.733 2.142 3.797 . 0 0 "[ . 1 . 2]" 1
1075 1 56 ARG HB3 1 56 ARG QD . . 3.490 2.471 2.122 3.234 . 0 0 "[ . 1 . 2]" 1
1076 1 56 ARG HB3 1 56 ARG HD3 . . 3.980 3.269 2.644 3.703 . 0 0 "[ . 1 . 2]" 1
1077 1 56 ARG HB3 1 57 ILE H . . 4.300 3.838 3.521 4.049 . 0 0 "[ . 1 . 2]" 1
1078 1 56 ARG HB3 1 70 PHE H . . 4.560 3.258 3.067 3.408 . 0 0 "[ . 1 . 2]" 1
1079 1 56 ARG HB3 1 70 PHE HA . . 5.500 5.152 5.012 5.312 . 0 0 "[ . 1 . 2]" 1
1080 1 56 ARG HB3 1 70 PHE HB2 . . 4.050 2.552 2.388 2.688 . 0 0 "[ . 1 . 2]" 1
1081 1 56 ARG HB3 1 70 PHE HB3 . . 4.420 3.946 3.684 4.196 . 0 0 "[ . 1 . 2]" 1
1082 1 56 ARG HB3 1 70 PHE QD . . 4.840 3.780 3.511 4.280 . 0 0 "[ . 1 . 2]" 1
1083 1 56 ARG QD 1 57 ILE H . . 5.340 3.951 2.590 4.307 . 0 0 "[ . 1 . 2]" 1
1084 1 56 ARG QD 1 58 LEU MD2 . . 4.050 3.645 2.844 4.051 0.001 16 0 "[ . 1 . 2]" 1
1085 1 56 ARG QG 1 57 ILE H . . 3.640 2.116 1.897 2.414 . 0 0 "[ . 1 . 2]" 1
1086 1 56 ARG QG 1 58 LEU MD2 . . 5.340 3.943 2.565 4.882 . 0 0 "[ . 1 . 2]" 1
1087 1 56 ARG QG 1 70 PHE QD . . 4.520 4.034 3.337 4.468 . 0 0 "[ . 1 . 2]" 1
1088 1 56 ARG HG2 1 57 ILE H . . 4.150 2.430 1.938 3.945 . 0 0 "[ . 1 . 2]" 1
1089 1 56 ARG HG2 1 70 PHE HB2 . . 5.500 4.241 3.701 5.137 . 0 0 "[ . 1 . 2]" 1
1090 1 56 ARG HG3 1 57 ILE H . . 4.150 2.609 2.067 3.686 . 0 0 "[ . 1 . 2]" 1
1091 1 56 ARG HG3 1 70 PHE HB2 . . 5.500 5.249 4.284 5.500 0.000 9 0 "[ . 1 . 2]" 1
1092 1 57 ILE H 1 57 ILE HB . . 3.130 2.664 2.498 2.759 . 0 0 "[ . 1 . 2]" 1
1093 1 57 ILE H 1 57 ILE MD . . 4.600 3.945 3.758 4.076 . 0 0 "[ . 1 . 2]" 1
1094 1 57 ILE H 1 57 ILE HG12 . . 3.840 2.948 2.719 3.071 . 0 0 "[ . 1 . 2]" 1
1095 1 57 ILE H 1 57 ILE HG13 . . 4.250 4.161 3.957 4.319 0.069 20 0 "[ . 1 . 2]" 1
1096 1 57 ILE H 1 57 ILE MG . . 4.000 3.849 3.755 3.896 . 0 0 "[ . 1 . 2]" 1
1097 1 57 ILE H 1 58 LEU H . . 4.400 4.162 4.010 4.283 . 0 0 "[ . 1 . 2]" 1
1098 1 57 ILE HA 1 57 ILE MD . . 3.130 2.119 1.983 2.321 . 0 0 "[ . 1 . 2]" 1
1099 1 57 ILE HA 1 57 ILE MG . . 3.480 2.360 2.262 2.450 . 0 0 "[ . 1 . 2]" 1
1100 1 57 ILE HA 1 58 LEU H . . 3.070 2.147 2.140 2.184 . 0 0 "[ . 1 . 2]" 1
1101 1 57 ILE HA 1 58 LEU HB2 . . 4.850 4.313 4.252 4.509 . 0 0 "[ . 1 . 2]" 1
1102 1 57 ILE HA 1 58 LEU HG . . 5.290 4.571 4.217 4.773 . 0 0 "[ . 1 . 2]" 1
1103 1 57 ILE HA 1 69 GLY HA2 . . 4.300 2.229 2.064 2.415 . 0 0 "[ . 1 . 2]" 1
1104 1 57 ILE HA 1 69 GLY HA3 . . 3.970 3.344 3.220 3.472 . 0 0 "[ . 1 . 2]" 1
1105 1 57 ILE HA 1 70 PHE H . . 4.220 3.421 3.269 3.599 . 0 0 "[ . 1 . 2]" 1
1106 1 57 ILE HB 1 57 ILE MD . . 3.340 3.218 3.198 3.228 . 0 0 "[ . 1 . 2]" 1
1107 1 57 ILE HB 1 58 LEU H . . 4.380 4.346 4.211 4.471 0.091 10 0 "[ . 1 . 2]" 1
1108 1 57 ILE MD 1 57 ILE MG . . 2.900 1.941 1.872 2.081 . 0 0 "[ . 1 . 2]" 1
1109 1 57 ILE MD 1 58 LEU H . . 4.080 3.707 3.540 3.890 . 0 0 "[ . 1 . 2]" 1
1110 1 57 ILE MD 1 65 SER HG . . 4.650 4.422 4.120 4.640 . 0 0 "[ . 1 . 2]" 1
1111 1 57 ILE MD 1 69 GLY H . . 4.990 4.029 3.759 4.357 . 0 0 "[ . 1 . 2]" 1
1112 1 57 ILE MD 1 69 GLY HA2 . . 4.090 2.498 2.213 3.040 . 0 0 "[ . 1 . 2]" 1
1113 1 57 ILE MD 1 69 GLY HA3 . . 3.590 2.219 1.989 2.710 . 0 0 "[ . 1 . 2]" 1
1114 1 57 ILE MD 1 70 PHE H . . 4.330 3.695 3.422 4.102 . 0 0 "[ . 1 . 2]" 1
1115 1 57 ILE HG12 1 57 ILE MG . . 3.710 3.187 3.179 3.197 . 0 0 "[ . 1 . 2]" 1
1116 1 57 ILE HG13 1 57 ILE MG . . 3.400 2.404 2.247 2.544 . 0 0 "[ . 1 . 2]" 1
1117 1 57 ILE MG 1 58 LEU H . . 3.340 2.833 2.653 3.097 . 0 0 "[ . 1 . 2]" 1
1118 1 57 ILE MG 1 59 ARG HA . . 4.980 4.143 3.925 4.389 . 0 0 "[ . 1 . 2]" 1
1119 1 57 ILE MG 1 59 ARG HG2 . . 4.290 3.583 3.013 4.181 . 0 0 "[ . 1 . 2]" 1
1120 1 57 ILE MG 1 59 ARG QG . . 3.710 3.208 2.827 3.658 . 0 0 "[ . 1 . 2]" 1
1121 1 57 ILE MG 1 59 ARG HG3 . . 4.290 3.692 3.330 4.281 . 0 0 "[ . 1 . 2]" 1
1122 1 57 ILE MG 1 65 SER HA . . 3.770 2.854 2.623 3.106 . 0 0 "[ . 1 . 2]" 1
1123 1 57 ILE MG 1 65 SER HB2 . . 3.470 2.759 2.336 3.226 . 0 0 "[ . 1 . 2]" 1
1124 1 57 ILE MG 1 65 SER HG . . 3.560 2.884 2.534 3.516 . 0 0 "[ . 1 . 2]" 1
1125 1 57 ILE MG 1 66 ARG H . . 4.150 3.308 3.073 3.585 . 0 0 "[ . 1 . 2]" 1
1126 1 57 ILE MG 1 67 GLY H . . 4.290 4.061 3.879 4.266 . 0 0 "[ . 1 . 2]" 1
1127 1 57 ILE MG 1 68 VAL H . . 4.440 3.527 3.380 3.928 . 0 0 "[ . 1 . 2]" 1
1128 1 58 LEU H 1 58 LEU HB2 . . 3.110 2.260 2.186 2.525 . 0 0 "[ . 1 . 2]" 1
1129 1 58 LEU H 1 58 LEU MD1 . . 4.100 3.795 3.636 3.990 . 0 0 "[ . 1 . 2]" 1
1130 1 58 LEU H 1 58 LEU MD2 . . 4.060 3.616 2.887 3.888 . 0 0 "[ . 1 . 2]" 1
1131 1 58 LEU H 1 58 LEU HG . . 3.520 2.721 2.277 2.886 . 0 0 "[ . 1 . 2]" 1
1132 1 58 LEU H 1 59 ARG H . . 4.710 4.590 4.467 4.645 . 0 0 "[ . 1 . 2]" 1
1133 1 58 LEU H 1 68 VAL H . . 4.470 4.197 3.890 4.461 . 0 0 "[ . 1 . 2]" 1
1134 1 58 LEU H 1 68 VAL HB . . 5.060 3.921 3.714 4.058 . 0 0 "[ . 1 . 2]" 1
1135 1 58 LEU H 1 68 VAL MG1 . . 5.420 4.101 3.937 4.331 . 0 0 "[ . 1 . 2]" 1
1136 1 58 LEU H 1 68 VAL QG . . 4.390 3.964 3.822 4.154 . 0 0 "[ . 1 . 2]" 1
1137 1 58 LEU H 1 68 VAL MG2 . . 5.420 5.259 5.075 5.391 . 0 0 "[ . 1 . 2]" 1
1138 1 58 LEU H 1 69 GLY H . . 5.220 4.893 4.729 5.032 . 0 0 "[ . 1 . 2]" 1
1139 1 58 LEU H 1 69 GLY HA2 . . 4.590 2.825 2.640 2.973 . 0 0 "[ . 1 . 2]" 1
1140 1 58 LEU H 1 69 GLY HA3 . . 4.690 4.418 4.241 4.578 . 0 0 "[ . 1 . 2]" 1
1141 1 58 LEU HA 1 58 LEU MD1 . . 3.930 3.793 3.719 3.843 . 0 0 "[ . 1 . 2]" 1
1142 1 58 LEU HA 1 58 LEU MD2 . . 3.110 2.016 1.894 2.152 . 0 0 "[ . 1 . 2]" 1
1143 1 58 LEU HA 1 58 LEU HG . . 3.610 2.921 2.727 3.274 . 0 0 "[ . 1 . 2]" 1
1144 1 58 LEU HA 1 59 ARG H . . 2.810 2.199 2.140 2.315 . 0 0 "[ . 1 . 2]" 1
1145 1 58 LEU HA 1 59 ARG HA . . 4.610 4.405 4.388 4.441 . 0 0 "[ . 1 . 2]" 1
1146 1 58 LEU HB2 1 58 LEU MD1 . . 3.490 2.386 2.222 2.518 . 0 0 "[ . 1 . 2]" 1
1147 1 58 LEU HB2 1 66 ARG H . . 5.170 3.681 3.489 4.047 . 0 0 "[ . 1 . 2]" 1
1148 1 58 LEU HB2 1 66 ARG HB2 . . 4.380 2.857 2.585 3.286 . 0 0 "[ . 1 . 2]" 1
1149 1 58 LEU HB2 1 66 ARG HB3 . . 5.500 4.524 4.223 4.984 . 0 0 "[ . 1 . 2]" 1
1150 1 58 LEU HB2 1 67 GLY H . . 5.500 5.321 5.011 5.497 . 0 0 "[ . 1 . 2]" 1
1151 1 58 LEU HB2 1 68 VAL H . . 4.660 3.507 3.155 3.802 . 0 0 "[ . 1 . 2]" 1
1152 1 58 LEU HB2 1 68 VAL MG1 . . 4.150 3.517 3.382 3.744 . 0 0 "[ . 1 . 2]" 1
1153 1 58 LEU HB2 1 68 VAL QG . . 3.640 3.269 3.151 3.423 . 0 0 "[ . 1 . 2]" 1
1154 1 58 LEU HB2 1 68 VAL MG2 . . 4.150 3.890 3.656 4.019 . 0 0 "[ . 1 . 2]" 1
1155 1 58 LEU HB2 1 69 GLY HA2 . . 5.500 4.388 4.047 4.723 . 0 0 "[ . 1 . 2]" 1
1156 1 58 LEU HB2 1 70 PHE QE . . 4.910 4.573 4.069 4.952 0.042 16 0 "[ . 1 . 2]" 1
1157 1 58 LEU HB3 1 58 LEU MD2 . . 3.090 2.350 2.257 2.463 . 0 0 "[ . 1 . 2]" 1
1158 1 58 LEU HB3 1 59 ARG H . . 3.600 3.119 2.675 3.566 . 0 0 "[ . 1 . 2]" 1
1159 1 58 LEU HB3 1 66 ARG H . . 5.500 3.925 3.640 4.310 . 0 0 "[ . 1 . 2]" 1
1160 1 58 LEU HB3 1 66 ARG HB2 . . 4.710 2.651 2.263 3.211 . 0 0 "[ . 1 . 2]" 1
1161 1 58 LEU HB3 1 66 ARG HB3 . . 5.500 4.096 3.645 4.614 . 0 0 "[ . 1 . 2]" 1
1162 1 58 LEU HB3 1 66 ARG HD2 . . 4.550 3.745 2.724 4.254 . 0 0 "[ . 1 . 2]" 1
1163 1 58 LEU HB3 1 66 ARG QD . . 3.980 2.884 2.377 3.306 . 0 0 "[ . 1 . 2]" 1
1164 1 58 LEU HB3 1 66 ARG HD3 . . 4.550 3.185 2.401 4.523 . 0 0 "[ . 1 . 2]" 1
1165 1 58 LEU HB3 1 66 ARG HG3 . . 4.230 2.926 2.568 3.408 . 0 0 "[ . 1 . 2]" 1
1166 1 58 LEU HB3 1 70 PHE QE . . 5.500 5.000 4.715 5.291 . 0 0 "[ . 1 . 2]" 1
1167 1 58 LEU MD1 1 59 ARG H . . 4.720 4.701 4.377 4.974 0.254 4 0 "[ . 1 . 2]" 1
1168 1 58 LEU MD1 1 66 ARG HD2 . . 4.910 4.412 3.094 4.847 . 0 0 "[ . 1 . 2]" 1
1169 1 58 LEU MD1 1 66 ARG QD . . 4.210 3.237 2.851 3.554 . 0 0 "[ . 1 . 2]" 1
1170 1 58 LEU MD1 1 66 ARG HD3 . . 4.910 3.453 2.890 4.811 . 0 0 "[ . 1 . 2]" 1
1171 1 58 LEU MD1 1 68 VAL HB . . 3.040 2.305 2.028 2.900 . 0 0 "[ . 1 . 2]" 1
1172 1 58 LEU MD1 1 68 VAL QG . . 3.360 2.066 1.913 2.375 . 0 0 "[ . 1 . 2]" 1
1173 1 58 LEU MD1 1 70 PHE QD . . 4.360 3.663 3.277 4.084 . 0 0 "[ . 1 . 2]" 1
1174 1 58 LEU MD1 1 70 PHE QE . . 3.480 2.109 1.902 2.515 . 0 0 "[ . 1 . 2]" 1
1175 1 58 LEU MD1 1 70 PHE HZ . . 4.440 3.276 2.713 3.680 . 0 0 "[ . 1 . 2]" 1
1176 1 58 LEU MD2 1 59 ARG H . . 4.060 2.894 2.587 3.353 . 0 0 "[ . 1 . 2]" 1
1177 1 58 LEU MD2 1 70 PHE QD . . 4.090 3.435 2.743 3.971 . 0 0 "[ . 1 . 2]" 1
1178 1 58 LEU MD2 1 70 PHE QE . . 3.730 2.835 2.411 3.372 . 0 0 "[ . 1 . 2]" 1
1179 1 58 LEU HG 1 59 ARG H . . 5.220 4.837 4.576 5.126 . 0 0 "[ . 1 . 2]" 1
1180 1 58 LEU HG 1 68 VAL QG . . 4.570 3.399 3.015 3.753 . 0 0 "[ . 1 . 2]" 1
1181 1 58 LEU HG 1 69 GLY HA2 . . 5.500 4.297 3.845 4.699 . 0 0 "[ . 1 . 2]" 1
1182 1 58 LEU HG 1 70 PHE QE . . 4.750 2.543 2.143 3.009 . 0 0 "[ . 1 . 2]" 1
1183 1 59 ARG H 1 59 ARG HB2 . . 3.760 2.521 2.396 2.610 . 0 0 "[ . 1 . 2]" 1
1184 1 59 ARG H 1 59 ARG HB3 . . 3.970 3.687 3.619 3.759 . 0 0 "[ . 1 . 2]" 1
1185 1 59 ARG H 1 59 ARG HG2 . . 4.430 4.050 3.367 4.334 . 0 0 "[ . 1 . 2]" 1
1186 1 59 ARG H 1 59 ARG QG . . 3.630 3.193 2.817 3.487 . 0 0 "[ . 1 . 2]" 1
1187 1 59 ARG H 1 59 ARG HG3 . . 4.430 3.376 2.896 4.131 . 0 0 "[ . 1 . 2]" 1
1188 1 59 ARG H 1 60 ASP H . . 4.510 4.470 4.423 4.527 0.017 1 0 "[ . 1 . 2]" 1
1189 1 59 ARG H 1 66 ARG QD . . 5.340 4.120 3.677 4.849 . 0 0 "[ . 1 . 2]" 1
1190 1 59 ARG H 1 66 ARG HG2 . . 5.500 5.202 4.808 5.416 . 0 0 "[ . 1 . 2]" 1
1191 1 59 ARG H 1 66 ARG HG3 . . 5.020 3.573 3.239 3.787 . 0 0 "[ . 1 . 2]" 1
1192 1 59 ARG HA 1 59 ARG QD . . 4.670 3.761 2.419 3.981 . 0 0 "[ . 1 . 2]" 1
1193 1 59 ARG HA 1 59 ARG HG2 . . 4.030 2.354 2.202 2.553 . 0 0 "[ . 1 . 2]" 1
1194 1 59 ARG HA 1 59 ARG QG . . 3.500 2.285 2.161 2.510 . 0 0 "[ . 1 . 2]" 1
1195 1 59 ARG HA 1 59 ARG HG3 . . 4.030 3.126 2.858 3.697 . 0 0 "[ . 1 . 2]" 1
1196 1 59 ARG HA 1 60 ASP H . . 3.060 2.293 2.233 2.422 . 0 0 "[ . 1 . 2]" 1
1197 1 59 ARG HA 1 65 SER HA . . 3.530 2.432 2.132 2.602 . 0 0 "[ . 1 . 2]" 1
1198 1 59 ARG HA 1 65 SER HB2 . . 5.170 4.761 4.356 4.992 . 0 0 "[ . 1 . 2]" 1
1199 1 59 ARG HA 1 65 SER HB3 . . 5.500 5.308 5.035 5.470 . 0 0 "[ . 1 . 2]" 1
1200 1 59 ARG HA 1 66 ARG H . . 3.650 3.279 2.607 3.518 . 0 0 "[ . 1 . 2]" 1
1201 1 59 ARG HA 1 66 ARG HG2 . . 4.180 3.692 3.491 4.134 . 0 0 "[ . 1 . 2]" 1
1202 1 59 ARG HA 1 66 ARG HG3 . . 4.460 2.684 2.338 2.903 . 0 0 "[ . 1 . 2]" 1
1203 1 59 ARG HB2 1 59 ARG HD2 . . 4.070 2.802 2.438 3.581 . 0 0 "[ . 1 . 2]" 1
1204 1 59 ARG HB2 1 59 ARG QD . . 3.570 2.701 2.373 3.220 . 0 0 "[ . 1 . 2]" 1
1205 1 59 ARG HB2 1 59 ARG HD3 . . 4.070 3.605 3.088 3.906 . 0 0 "[ . 1 . 2]" 1
1206 1 59 ARG HB2 1 60 ASP H . . 4.270 3.971 3.729 4.159 . 0 0 "[ . 1 . 2]" 1
1207 1 59 ARG HB2 1 63 GLY HA2 . . 4.710 3.720 3.484 3.922 . 0 0 "[ . 1 . 2]" 1
1208 1 59 ARG HB2 1 63 GLY HA3 . . 5.420 5.320 5.028 5.495 0.075 4 0 "[ . 1 . 2]" 1
1209 1 59 ARG HB3 1 59 ARG HD2 . . 4.180 2.471 2.139 3.012 . 0 0 "[ . 1 . 2]" 1
1210 1 59 ARG HB3 1 59 ARG QD . . 3.670 2.261 2.118 2.397 . 0 0 "[ . 1 . 2]" 1
1211 1 59 ARG HB3 1 59 ARG HD3 . . 4.180 2.985 2.288 3.544 . 0 0 "[ . 1 . 2]" 1
1212 1 59 ARG HB3 1 60 ASP H . . 3.590 2.741 2.394 2.960 . 0 0 "[ . 1 . 2]" 1
1213 1 59 ARG HB3 1 60 ASP HA . . 4.900 4.658 4.512 4.776 . 0 0 "[ . 1 . 2]" 1
1214 1 59 ARG HB3 1 63 GLY H . . 4.470 3.888 3.507 4.100 . 0 0 "[ . 1 . 2]" 1
1215 1 59 ARG HB3 1 63 GLY HA2 . . 4.480 2.320 2.128 2.570 . 0 0 "[ . 1 . 2]" 1
1216 1 59 ARG HB3 1 63 GLY HA3 . . 4.490 3.929 3.744 4.154 . 0 0 "[ . 1 . 2]" 1
1217 1 59 ARG HB3 1 64 THR H . . 4.070 3.534 3.117 3.855 . 0 0 "[ . 1 . 2]" 1
1218 1 59 ARG QD 1 60 ASP H . . 5.340 4.306 3.123 4.685 . 0 0 "[ . 1 . 2]" 1
1219 1 59 ARG QD 1 63 GLY HA2 . . 4.250 2.671 2.314 3.035 . 0 0 "[ . 1 . 2]" 1
1220 1 59 ARG QD 1 63 GLY HA3 . . 4.400 3.344 2.859 3.807 . 0 0 "[ . 1 . 2]" 1
1221 1 59 ARG QD 1 65 SER HA . . 5.060 4.451 2.673 4.946 . 0 0 "[ . 1 . 2]" 1
1222 1 59 ARG HD2 1 63 GLY HA2 . . 4.990 3.014 2.327 4.041 . 0 0 "[ . 1 . 2]" 1
1223 1 59 ARG HD2 1 63 GLY HA3 . . 5.190 3.856 2.895 4.877 . 0 0 "[ . 1 . 2]" 1
1224 1 59 ARG HD3 1 63 GLY HA2 . . 4.990 3.575 2.671 4.444 . 0 0 "[ . 1 . 2]" 1
1225 1 59 ARG HD3 1 63 GLY HA3 . . 5.190 4.152 3.432 4.877 . 0 0 "[ . 1 . 2]" 1
1226 1 59 ARG QG 1 60 ASP H . . 4.590 3.725 3.549 4.217 . 0 0 "[ . 1 . 2]" 1
1227 1 59 ARG QG 1 65 SER H . . 4.660 3.476 2.769 4.130 . 0 0 "[ . 1 . 2]" 1
1228 1 59 ARG QG 1 65 SER HA . . 3.520 2.725 2.402 2.920 . 0 0 "[ . 1 . 2]" 1
1229 1 59 ARG QG 1 65 SER HB2 . . 4.880 3.949 3.544 4.251 . 0 0 "[ . 1 . 2]" 1
1230 1 59 ARG QG 1 66 ARG H . . 4.400 4.367 3.869 4.552 0.152 13 0 "[ . 1 . 2]" 1
1231 1 59 ARG HG2 1 65 SER H . . 5.500 3.537 2.806 4.348 . 0 0 "[ . 1 . 2]" 1
1232 1 59 ARG HG2 1 65 SER HA . . 4.380 2.784 2.478 2.999 . 0 0 "[ . 1 . 2]" 1
1233 1 59 ARG HG3 1 65 SER H . . 5.500 5.165 4.239 5.456 . 0 0 "[ . 1 . 2]" 1
1234 1 59 ARG HG3 1 65 SER HA . . 4.380 3.947 3.088 4.491 0.111 17 0 "[ . 1 . 2]" 1
1235 1 60 ASP H 1 60 ASP HB2 . . 4.010 2.691 2.203 3.677 . 0 0 "[ . 1 . 2]" 1
1236 1 60 ASP H 1 60 ASP QB . . 3.400 2.334 2.180 2.634 . 0 0 "[ . 1 . 2]" 1
1237 1 60 ASP H 1 60 ASP HB3 . . 4.010 2.946 2.509 3.601 . 0 0 "[ . 1 . 2]" 1
1238 1 60 ASP H 1 63 GLY H . . 4.410 3.660 3.286 4.111 . 0 0 "[ . 1 . 2]" 1
1239 1 60 ASP H 1 64 THR H . . 3.580 2.429 2.108 2.902 . 0 0 "[ . 1 . 2]" 1
1240 1 60 ASP H 1 64 THR HA . . 4.590 4.156 3.854 4.511 . 0 0 "[ . 1 . 2]" 1
1241 1 60 ASP H 1 64 THR HB . . 4.810 3.807 3.656 4.084 . 0 0 "[ . 1 . 2]" 1
1242 1 60 ASP H 1 65 SER H . . 5.070 4.488 4.233 4.765 . 0 0 "[ . 1 . 2]" 1
1243 1 60 ASP H 1 65 SER HA . . 4.130 3.974 3.706 4.127 . 0 0 "[ . 1 . 2]" 1
1244 1 60 ASP H 1 66 ARG H . . 4.740 4.688 4.026 4.986 0.246 6 0 "[ . 1 . 2]" 1
1245 1 60 ASP H 1 66 ARG QD . . 5.340 4.008 3.603 5.020 . 0 0 "[ . 1 . 2]" 1
1246 1 60 ASP H 1 66 ARG HG2 . . 4.480 3.263 2.857 4.065 . 0 0 "[ . 1 . 2]" 1
1247 1 60 ASP H 1 66 ARG HG3 . . 4.050 3.265 2.863 3.740 . 0 0 "[ . 1 . 2]" 1
1248 1 60 ASP QB 1 66 ARG HG2 . . 4.150 2.689 2.028 3.815 . 0 0 "[ . 1 . 2]" 1
1249 1 60 ASP QB 1 66 ARG HG3 . . 4.330 3.754 3.166 4.327 . 0 0 "[ . 1 . 2]" 1
1250 1 60 ASP HB2 1 66 ARG HG2 . . 4.800 3.161 2.037 4.161 . 0 0 "[ . 1 . 2]" 1
1251 1 60 ASP HB3 1 66 ARG HG2 . . 4.800 3.713 2.051 4.636 . 0 0 "[ . 1 . 2]" 1
1252 1 61 SER HA 1 63 GLY H . . 4.310 3.851 3.478 4.277 . 0 0 "[ . 1 . 2]" 1
1253 1 62 SER H 1 62 SER HB2 . . 4.110 2.631 2.259 3.703 . 0 0 "[ . 1 . 2]" 1
1254 1 62 SER H 1 62 SER QB . . 3.460 2.367 2.181 2.774 . 0 0 "[ . 1 . 2]" 1
1255 1 62 SER H 1 62 SER HB3 . . 4.110 3.028 2.319 3.683 . 0 0 "[ . 1 . 2]" 1
1256 1 62 SER H 1 63 GLY H . . 3.300 2.571 2.002 2.885 . 0 0 "[ . 1 . 2]" 1
1257 1 62 SER H 1 64 THR H . . 4.320 3.668 3.218 4.118 . 0 0 "[ . 1 . 2]" 1
1258 1 62 SER QB 1 63 GLY H . . 3.900 3.332 2.783 3.790 . 0 0 "[ . 1 . 2]" 1
1259 1 62 SER HB2 1 63 GLY H . . 4.660 3.919 2.878 4.555 . 0 0 "[ . 1 . 2]" 1
1260 1 62 SER HB3 1 63 GLY H . . 4.660 3.805 2.840 4.471 . 0 0 "[ . 1 . 2]" 1
1261 1 64 THR H 1 64 THR HB . . 2.780 2.678 2.584 2.776 . 0 0 "[ . 1 . 2]" 1
1262 1 64 THR H 1 64 THR MG . . 3.920 3.866 3.831 3.901 . 0 0 "[ . 1 . 2]" 1
1263 1 64 THR H 1 65 SER H . . 4.670 4.413 4.353 4.489 . 0 0 "[ . 1 . 2]" 1
1264 1 64 THR HA 1 64 THR MG . . 2.960 2.300 2.192 2.447 . 0 0 "[ . 1 . 2]" 1
1265 1 64 THR HA 1 65 SER H . . 3.090 2.160 2.143 2.205 . 0 0 "[ . 1 . 2]" 1
1266 1 64 THR HB 1 65 SER H . . 4.180 4.085 3.918 4.184 0.004 17 0 "[ . 1 . 2]" 1
1267 1 64 THR MG 1 65 SER H . . 3.450 2.434 2.172 2.697 . 0 0 "[ . 1 . 2]" 1
1268 1 64 THR MG 1 65 SER HA . . 4.440 4.297 4.107 4.443 0.003 17 0 "[ . 1 . 2]" 1
1269 1 64 THR MG 1 65 SER HB2 . . 5.100 4.146 3.875 4.587 . 0 0 "[ . 1 . 2]" 1
1270 1 64 THR MG 1 65 SER HB3 . . 4.050 3.382 3.084 3.588 . 0 0 "[ . 1 . 2]" 1
1271 1 65 SER H 1 65 SER HB2 . . 3.290 2.472 2.309 2.742 . 0 0 "[ . 1 . 2]" 1
1272 1 65 SER H 1 65 SER HB3 . . 3.590 2.682 2.373 2.879 . 0 0 "[ . 1 . 2]" 1
1273 1 65 SER H 1 65 SER HG . . 4.630 4.347 4.241 4.519 . 0 0 "[ . 1 . 2]" 1
1274 1 65 SER HA 1 66 ARG H . . 3.050 2.250 2.149 2.302 . 0 0 "[ . 1 . 2]" 1
1275 1 65 SER HA 1 66 ARG HG3 . . 4.670 3.840 3.509 4.005 . 0 0 "[ . 1 . 2]" 1
1276 1 65 SER HA 1 67 GLY H . . 4.510 3.888 3.699 3.982 . 0 0 "[ . 1 . 2]" 1
1277 1 65 SER HA 1 68 VAL H . . 5.330 4.942 4.700 5.038 . 0 0 "[ . 1 . 2]" 1
1278 1 65 SER HB2 1 66 ARG H . . 4.720 3.995 3.691 4.167 . 0 0 "[ . 1 . 2]" 1
1279 1 65 SER HB3 1 66 ARG H . . 5.030 3.916 3.726 4.273 . 0 0 "[ . 1 . 2]" 1
1280 1 65 SER HB3 1 67 GLY H . . 3.910 3.364 3.074 3.619 . 0 0 "[ . 1 . 2]" 1
1281 1 65 SER HG 1 66 ARG H . . 4.740 2.712 1.902 3.931 . 0 0 "[ . 1 . 2]" 1
1282 1 65 SER HG 1 67 GLY H . . 3.500 2.074 1.899 2.425 . 0 0 "[ . 1 . 2]" 1
1283 1 65 SER HG 1 67 GLY HA2 . . 4.740 3.321 2.719 3.623 . 0 0 "[ . 1 . 2]" 1
1284 1 65 SER HG 1 67 GLY HA3 . . 4.780 4.503 4.066 4.715 . 0 0 "[ . 1 . 2]" 1
1285 1 66 ARG H 1 66 ARG HB2 . . 3.530 2.574 2.481 2.675 . 0 0 "[ . 1 . 2]" 1
1286 1 66 ARG H 1 66 ARG HB3 . . 4.000 3.714 3.627 3.749 . 0 0 "[ . 1 . 2]" 1
1287 1 66 ARG H 1 66 ARG QD . . 4.700 4.388 4.103 4.564 . 0 0 "[ . 1 . 2]" 1
1288 1 66 ARG H 1 66 ARG HG2 . . 3.620 3.492 3.363 3.603 . 0 0 "[ . 1 . 2]" 1
1289 1 66 ARG H 1 66 ARG HG3 . . 3.960 2.833 2.504 3.054 . 0 0 "[ . 1 . 2]" 1
1290 1 66 ARG H 1 67 GLY H . . 3.500 2.550 2.356 2.871 . 0 0 "[ . 1 . 2]" 1
1291 1 66 ARG H 1 67 GLY HA2 . . 5.050 4.624 4.499 4.959 . 0 0 "[ . 1 . 2]" 1
1292 1 66 ARG H 1 68 VAL H . . 4.220 3.105 2.984 3.383 . 0 0 "[ . 1 . 2]" 1
1293 1 66 ARG H 1 68 VAL QG . . 5.440 4.501 4.371 4.616 . 0 0 "[ . 1 . 2]" 1
1294 1 66 ARG HA 1 66 ARG HD2 . . 5.020 4.762 4.530 4.876 . 0 0 "[ . 1 . 2]" 1
1295 1 66 ARG HA 1 66 ARG QD . . 4.410 4.073 3.717 4.273 . 0 0 "[ . 1 . 2]" 1
1296 1 66 ARG HA 1 66 ARG HD3 . . 5.020 4.436 3.923 4.725 . 0 0 "[ . 1 . 2]" 1
1297 1 66 ARG HA 1 66 ARG HG2 . . 3.680 2.455 2.401 2.613 . 0 0 "[ . 1 . 2]" 1
1298 1 66 ARG HA 1 66 ARG HG3 . . 3.680 3.398 3.248 3.504 . 0 0 "[ . 1 . 2]" 1
1299 1 66 ARG HA 1 68 VAL H . . 5.500 4.529 4.433 4.597 . 0 0 "[ . 1 . 2]" 1
1300 1 66 ARG HA 1 68 VAL QG . . 4.710 4.542 4.424 4.626 . 0 0 "[ . 1 . 2]" 1
1301 1 66 ARG HB2 1 66 ARG HD2 . . 3.970 3.619 2.696 3.856 . 0 0 "[ . 1 . 2]" 1
1302 1 66 ARG HB2 1 66 ARG HD3 . . 3.970 2.750 2.531 3.447 . 0 0 "[ . 1 . 2]" 1
1303 1 66 ARG HB2 1 67 GLY H . . 4.790 3.978 3.836 4.093 . 0 0 "[ . 1 . 2]" 1
1304 1 66 ARG HB2 1 68 VAL H . . 4.180 3.450 3.290 3.652 . 0 0 "[ . 1 . 2]" 1
1305 1 66 ARG HB2 1 68 VAL HB . . 4.770 3.262 3.207 3.312 . 0 0 "[ . 1 . 2]" 1
1306 1 66 ARG HB2 1 68 VAL MG1 . . 4.750 4.728 4.693 4.754 0.004 17 0 "[ . 1 . 2]" 1
1307 1 66 ARG HB2 1 68 VAL QG . . 3.750 3.212 2.980 3.409 . 0 0 "[ . 1 . 2]" 1
1308 1 66 ARG HB2 1 68 VAL MG2 . . 4.750 3.269 3.012 3.495 . 0 0 "[ . 1 . 2]" 1
1309 1 66 ARG HB3 1 66 ARG HD2 . . 4.190 3.502 2.612 3.661 . 0 0 "[ . 1 . 2]" 1
1310 1 66 ARG HB3 1 66 ARG QD . . 3.620 2.480 2.079 2.859 . 0 0 "[ . 1 . 2]" 1
1311 1 66 ARG HB3 1 66 ARG HD3 . . 4.190 2.546 2.116 2.984 . 0 0 "[ . 1 . 2]" 1
1312 1 66 ARG HB3 1 67 GLY H . . 5.160 4.455 4.408 4.490 . 0 0 "[ . 1 . 2]" 1
1313 1 66 ARG HB3 1 68 VAL H . . 4.850 4.535 4.376 4.738 . 0 0 "[ . 1 . 2]" 1
1314 1 66 ARG HB3 1 68 VAL QG . . 3.810 3.380 3.097 3.587 . 0 0 "[ . 1 . 2]" 1
1315 1 66 ARG HG2 1 67 GLY H . . 5.500 4.975 4.887 5.097 . 0 0 "[ . 1 . 2]" 1
1316 1 67 GLY H 1 68 VAL H . . 3.260 2.669 2.608 2.729 . 0 0 "[ . 1 . 2]" 1
1317 1 67 GLY H 1 68 VAL HB . . 5.350 5.177 5.112 5.215 . 0 0 "[ . 1 . 2]" 1
1318 1 67 GLY H 1 68 VAL QG . . 4.680 4.271 4.174 4.356 . 0 0 "[ . 1 . 2]" 1
1319 1 68 VAL H 1 68 VAL HB . . 3.150 2.856 2.821 2.900 . 0 0 "[ . 1 . 2]" 1
1320 1 68 VAL H 1 68 VAL MG1 . . 4.040 3.933 3.920 3.953 . 0 0 "[ . 1 . 2]" 1
1321 1 68 VAL H 1 68 VAL QG . . 3.220 2.876 2.764 2.959 . 0 0 "[ . 1 . 2]" 1
1322 1 68 VAL H 1 68 VAL MG2 . . 4.040 2.957 2.825 3.060 . 0 0 "[ . 1 . 2]" 1
1323 1 68 VAL H 1 69 GLY H . . 4.720 4.261 4.162 4.357 . 0 0 "[ . 1 . 2]" 1
1324 1 68 VAL HA 1 68 VAL MG1 . . 3.400 2.409 2.367 2.433 . 0 0 "[ . 1 . 2]" 1
1325 1 68 VAL HA 1 68 VAL MG2 . . 3.400 2.353 2.302 2.467 . 0 0 "[ . 1 . 2]" 1
1326 1 68 VAL HA 1 69 GLY H . . 3.220 2.173 2.146 2.228 . 0 0 "[ . 1 . 2]" 1
1327 1 68 VAL HB 1 69 GLY H . . 4.370 4.090 3.907 4.220 . 0 0 "[ . 1 . 2]" 1
1328 1 68 VAL HB 1 69 GLY HA2 . . 5.500 4.659 4.543 4.744 . 0 0 "[ . 1 . 2]" 1
1329 1 68 VAL QG 1 69 GLY H . . 3.390 2.425 2.100 2.715 . 0 0 "[ . 1 . 2]" 1
1330 1 68 VAL QG 1 70 PHE HB2 . . 5.440 5.178 4.853 5.348 . 0 0 "[ . 1 . 2]" 1
1331 1 68 VAL QG 1 70 PHE QD . . 4.860 3.800 3.118 4.048 . 0 0 "[ . 1 . 2]" 1
1332 1 68 VAL QG 1 70 PHE QE . . 4.210 3.190 2.575 3.622 . 0 0 "[ . 1 . 2]" 1
1333 1 68 VAL QG 1 70 PHE HZ . . 4.760 3.498 3.263 3.919 . 0 0 "[ . 1 . 2]" 1
1334 1 68 VAL MG1 1 69 GLY H . . 4.290 2.446 2.108 2.754 . 0 0 "[ . 1 . 2]" 1
1335 1 68 VAL MG2 1 69 GLY H . . 4.290 4.040 3.940 4.122 . 0 0 "[ . 1 . 2]" 1
1336 1 69 GLY HA3 1 70 PHE H . . 3.410 3.028 2.827 3.151 . 0 0 "[ . 1 . 2]" 1
1337 1 70 PHE H 1 70 PHE HB2 . . 3.600 2.437 2.319 2.541 . 0 0 "[ . 1 . 2]" 1
1338 1 70 PHE H 1 70 PHE HB3 . . 3.780 3.650 3.575 3.716 . 0 0 "[ . 1 . 2]" 1
1339 1 70 PHE H 1 70 PHE QD . . 4.170 3.220 2.450 3.522 . 0 0 "[ . 1 . 2]" 1
1340 1 70 PHE HA 1 70 PHE QD . . 4.090 2.551 2.121 3.070 . 0 0 "[ . 1 . 2]" 1
1341 1 70 PHE HA 1 71 ALA H . . 3.010 2.146 2.138 2.196 . 0 0 "[ . 1 . 2]" 1
1342 1 70 PHE HA 1 71 ALA MB . . 4.550 3.960 3.827 4.028 . 0 0 "[ . 1 . 2]" 1
1343 1 70 PHE HB2 1 71 ALA H . . 4.680 4.368 4.113 4.473 . 0 0 "[ . 1 . 2]" 1
1344 1 70 PHE HB3 1 71 ALA H . . 3.880 3.451 3.046 3.608 . 0 0 "[ . 1 . 2]" 1
1345 1 70 PHE QD 1 71 ALA H . . 4.660 3.793 3.587 4.377 . 0 0 "[ . 1 . 2]" 1
1346 1 70 PHE QD 1 109 SER HB2 . . 4.960 3.877 3.476 4.327 . 0 0 "[ . 1 . 2]" 1
1347 1 70 PHE QD 1 109 SER QB . . 4.290 3.561 3.201 3.892 . 0 0 "[ . 1 . 2]" 1
1348 1 70 PHE QD 1 109 SER HB3 . . 4.960 4.214 3.528 4.959 . 0 0 "[ . 1 . 2]" 1
1349 1 70 PHE QE 1 109 SER HB2 . . 4.590 3.301 2.627 4.468 . 0 0 "[ . 1 . 2]" 1
1350 1 70 PHE QE 1 109 SER QB . . 3.880 3.108 2.232 3.695 . 0 0 "[ . 1 . 2]" 1
1351 1 70 PHE QE 1 109 SER HB3 . . 4.590 4.040 2.415 4.591 0.001 19 0 "[ . 1 . 2]" 1
1352 1 71 ALA H 1 71 ALA MB . . 3.460 2.467 2.376 2.597 . 0 0 "[ . 1 . 2]" 1
1353 1 71 ALA HA 1 72 ARG H . . 3.030 2.222 2.143 2.378 . 0 0 "[ . 1 . 2]" 1
1354 1 71 ALA HA 1 72 ARG HB2 . . 5.500 4.292 4.038 4.502 . 0 0 "[ . 1 . 2]" 1
1355 1 71 ALA HA 1 72 ARG QB . . 4.730 3.988 3.851 4.075 . 0 0 "[ . 1 . 2]" 1
1356 1 71 ALA HA 1 72 ARG HB3 . . 5.500 4.764 4.566 4.972 . 0 0 "[ . 1 . 2]" 1
1357 1 71 ALA HA 1 72 ARG QG . . 5.340 5.662 5.500 5.766 0.426 17 0 "[ . 1 . 2]" 1
1358 1 71 ALA MB 1 72 ARG H . . 3.560 2.897 2.585 3.193 . 0 0 "[ . 1 . 2]" 1
1359 1 71 ALA MB 1 72 ARG HA . . 4.740 4.134 3.861 4.319 . 0 0 "[ . 1 . 2]" 1
1360 1 71 ALA MB 1 72 ARG HB2 . . 5.500 5.007 4.678 5.256 . 0 0 "[ . 1 . 2]" 1
1361 1 71 ALA MB 1 72 ARG HB3 . . 5.500 5.103 4.855 5.310 . 0 0 "[ . 1 . 2]" 1
1362 1 71 ALA MB 1 72 ARG QG . . 5.340 5.498 5.241 5.640 0.300 16 0 "[ . 1 . 2]" 1
1363 1 71 ALA MB 1 73 MET QG . . 4.280 3.779 3.572 3.989 . 0 0 "[ . 1 . 2]" 1
1364 1 72 ARG H 1 72 ARG HB2 . . 3.990 2.780 2.448 3.074 . 0 0 "[ . 1 . 2]" 1
1365 1 72 ARG H 1 72 ARG QB . . 3.370 2.434 2.302 2.706 . 0 0 "[ . 1 . 2]" 1
1366 1 72 ARG H 1 72 ARG HB3 . . 3.990 2.720 2.530 3.071 . 0 0 "[ . 1 . 2]" 1
1367 1 72 ARG H 1 72 ARG QD . . 5.340 4.631 4.401 4.875 . 0 0 "[ . 1 . 2]" 1
1368 1 72 ARG HA 1 72 ARG HG2 . . 4.240 2.719 2.202 3.060 . 0 0 "[ . 1 . 2]" 1
1369 1 72 ARG HA 1 72 ARG QG . . 3.680 2.394 2.180 2.520 . 0 0 "[ . 1 . 2]" 1
1370 1 72 ARG HA 1 72 ARG HG3 . . 4.240 2.734 2.528 3.486 . 0 0 "[ . 1 . 2]" 1
1371 1 72 ARG HA 1 73 MET H . . 3.470 2.161 2.142 2.170 . 0 0 "[ . 1 . 2]" 1
1372 1 72 ARG HA 1 73 MET HB2 . . 4.840 4.655 4.582 4.770 . 0 0 "[ . 1 . 2]" 1
1373 1 72 ARG QB 1 72 ARG QD . . 3.170 2.127 2.081 2.267 . 0 0 "[ . 1 . 2]" 1
1374 1 73 MET HA 1 73 MET ME . . 3.580 2.704 2.247 3.295 . 0 0 "[ . 1 . 2]" 1
1375 1 73 MET HA 1 73 MET QG . . 3.730 3.013 2.333 3.139 . 0 0 "[ . 1 . 2]" 1
1376 1 73 MET HA 1 74 GLU H . . 3.460 2.316 2.228 2.532 . 0 0 "[ . 1 . 2]" 1
1377 1 73 MET HA 1 74 GLU HA . . 4.600 4.299 4.293 4.307 . 0 0 "[ . 1 . 2]" 1
1378 1 73 MET HB2 1 73 MET ME . . 4.300 3.553 3.426 3.807 . 0 0 "[ . 1 . 2]" 1
1379 1 73 MET HB2 1 74 GLU H . . 5.130 3.739 3.231 3.956 . 0 0 "[ . 1 . 2]" 1
1380 1 73 MET HB2 1 75 SER H . . 4.360 3.072 2.713 3.216 . 0 0 "[ . 1 . 2]" 1
1381 1 73 MET HB2 1 79 CYS H . . 3.970 3.531 3.246 3.860 . 0 0 "[ . 1 . 2]" 1
1382 1 73 MET HB3 1 73 MET ME . . 3.060 2.222 1.998 2.623 . 0 0 "[ . 1 . 2]" 1
1383 1 73 MET HB3 1 74 GLU H . . 3.640 2.680 2.229 2.935 . 0 0 "[ . 1 . 2]" 1
1384 1 73 MET HB3 1 75 SER H . . 3.740 2.840 2.590 2.980 . 0 0 "[ . 1 . 2]" 1
1385 1 73 MET HB3 1 79 CYS H . . 4.430 3.689 3.500 4.051 . 0 0 "[ . 1 . 2]" 1
1386 1 73 MET ME 1 73 MET QG . . 2.800 2.346 2.135 2.482 . 0 0 "[ . 1 . 2]" 1
1387 1 73 MET ME 1 74 GLU H . . 3.820 3.151 2.903 3.599 . 0 0 "[ . 1 . 2]" 1
1388 1 73 MET ME 1 74 GLU QG . . 4.320 3.461 3.227 3.657 . 0 0 "[ . 1 . 2]" 1
1389 1 73 MET ME 1 75 SER H . . 4.860 4.392 4.204 4.573 . 0 0 "[ . 1 . 2]" 1
1390 1 73 MET ME 1 79 CYS H . . 4.580 4.384 4.205 4.542 . 0 0 "[ . 1 . 2]" 1
1391 1 73 MET ME 1 79 CYS HA . . 4.860 4.116 3.760 4.409 . 0 0 "[ . 1 . 2]" 1
1392 1 73 MET ME 1 82 VAL HB . . 4.710 4.755 4.028 5.106 0.396 9 0 "[ . 1 . 2]" 1
1393 1 73 MET ME 1 82 VAL QG . . 2.920 2.520 2.036 2.828 . 0 0 "[ . 1 . 2]" 1
1394 1 73 MET QG 1 79 CYS HA . . 4.940 2.619 2.251 3.293 . 0 0 "[ . 1 . 2]" 1
1395 1 73 MET QG 1 82 VAL HB . . 4.570 4.185 3.949 4.320 . 0 0 "[ . 1 . 2]" 1
1396 1 73 MET QG 1 82 VAL QG . . 3.700 2.713 2.478 3.138 . 0 0 "[ . 1 . 2]" 1
1397 1 74 GLU H 1 74 GLU HB2 . . 4.130 3.594 3.572 3.618 . 0 0 "[ . 1 . 2]" 1
1398 1 74 GLU H 1 74 GLU HB3 . . 3.720 2.623 2.443 2.748 . 0 0 "[ . 1 . 2]" 1
1399 1 74 GLU H 1 74 GLU QG . . 3.340 2.125 1.971 2.323 . 0 0 "[ . 1 . 2]" 1
1400 1 74 GLU H 1 75 SER H . . 3.720 2.799 2.568 2.938 . 0 0 "[ . 1 . 2]" 1
1401 1 74 GLU HB2 1 75 SER H . . 4.730 3.751 3.502 3.995 . 0 0 "[ . 1 . 2]" 1
1402 1 74 GLU QG 1 75 SER H . . 3.230 2.107 1.901 2.451 . 0 0 "[ . 1 . 2]" 1
1403 1 74 GLU QG 1 75 SER QB . . 3.700 2.992 2.623 3.425 . 0 0 "[ . 1 . 2]" 1
1404 1 74 GLU QG 1 78 LYS QD . . 5.180 4.046 3.776 4.392 . 0 0 "[ . 1 . 2]" 1
1405 1 74 GLU QG 1 78 LYS QE . . 4.390 3.597 3.271 3.882 . 0 0 "[ . 1 . 2]" 1
1406 1 74 GLU QG 1 78 LYS HG3 . . 3.580 2.265 1.974 2.576 . 0 0 "[ . 1 . 2]" 1
1407 1 74 GLU HG2 1 78 LYS HG3 . . 4.230 2.444 2.014 2.750 . 0 0 "[ . 1 . 2]" 1
1408 1 74 GLU HG3 1 78 LYS HG3 . . 4.230 2.744 2.224 3.205 . 0 0 "[ . 1 . 2]" 1
1409 1 75 SER H 1 75 SER HB2 . . 4.210 3.122 2.882 3.933 . 0 0 "[ . 1 . 2]" 1
1410 1 75 SER H 1 75 SER HB3 . . 4.210 3.670 3.237 3.960 . 0 0 "[ . 1 . 2]" 1
1411 1 75 SER H 1 78 LYS H . . 4.440 3.857 3.550 4.078 . 0 0 "[ . 1 . 2]" 1
1412 1 75 SER H 1 78 LYS HB2 . . 3.660 3.048 2.822 3.224 . 0 0 "[ . 1 . 2]" 1
1413 1 75 SER H 1 78 LYS HB3 . . 4.720 4.599 4.354 4.717 . 0 0 "[ . 1 . 2]" 1
1414 1 75 SER H 1 78 LYS HG2 . . 4.820 4.367 3.873 4.851 0.031 16 0 "[ . 1 . 2]" 1
1415 1 75 SER H 1 78 LYS HG3 . . 5.020 4.021 3.716 4.436 . 0 0 "[ . 1 . 2]" 1
1416 1 75 SER H 1 79 CYS H . . 4.860 4.321 4.055 4.543 . 0 0 "[ . 1 . 2]" 1
1417 1 75 SER QB 1 77 GLU H . . 4.100 2.621 2.276 3.068 . 0 0 "[ . 1 . 2]" 1
1418 1 75 SER QB 1 77 GLU QB . . 4.320 3.137 2.840 3.778 . 0 0 "[ . 1 . 2]" 1
1419 1 75 SER QB 1 78 LYS H . . 4.400 3.418 3.141 3.862 . 0 0 "[ . 1 . 2]" 1
1420 1 75 SER HB2 1 77 GLU H . . 4.920 3.855 2.568 4.613 . 0 0 "[ . 1 . 2]" 1
1421 1 75 SER HB2 1 77 GLU HB2 . . 5.500 4.936 3.974 5.473 . 0 0 "[ . 1 . 2]" 1
1422 1 75 SER HB2 1 77 GLU HB3 . . 5.500 4.172 3.312 4.787 . 0 0 "[ . 1 . 2]" 1
1423 1 75 SER HB2 1 78 LYS H . . 5.040 4.153 3.233 5.025 . 0 0 "[ . 1 . 2]" 1
1424 1 75 SER HB2 1 78 LYS HB2 . . 5.500 4.813 3.875 5.661 0.161 4 0 "[ . 1 . 2]" 1
1425 1 75 SER HB3 1 77 GLU H . . 4.920 2.759 2.324 4.267 . 0 0 "[ . 1 . 2]" 1
1426 1 75 SER HB3 1 77 GLU HB2 . . 5.500 4.243 3.619 5.444 . 0 0 "[ . 1 . 2]" 1
1427 1 75 SER HB3 1 77 GLU HB3 . . 5.500 3.641 2.976 4.706 . 0 0 "[ . 1 . 2]" 1
1428 1 75 SER HB3 1 78 LYS H . . 5.040 3.861 3.335 5.035 . 0 0 "[ . 1 . 2]" 1
1429 1 75 SER HB3 1 78 LYS HB2 . . 5.500 5.029 4.222 5.663 0.163 9 0 "[ . 1 . 2]" 1
1430 1 76 THR HA 1 76 THR MG . . 3.350 2.259 2.170 2.354 . 0 0 "[ . 1 . 2]" 1
1431 1 76 THR HA 1 79 CYS H . . 3.740 3.089 2.917 3.207 . 0 0 "[ . 1 . 2]" 1
1432 1 76 THR HA 1 79 CYS HA . . 5.020 4.804 4.605 4.951 . 0 0 "[ . 1 . 2]" 1
1433 1 76 THR HA 1 79 CYS HB2 . . 4.150 2.463 2.107 2.841 . 0 0 "[ . 1 . 2]" 1
1434 1 76 THR HA 1 79 CYS QB . . 3.520 2.436 2.095 2.790 . 0 0 "[ . 1 . 2]" 1
1435 1 76 THR HA 1 79 CYS HB3 . . 4.150 3.876 3.660 4.122 . 0 0 "[ . 1 . 2]" 1
1436 1 76 THR HA 1 79 CYS HG . . 4.410 3.866 2.618 4.288 . 0 0 "[ . 1 . 2]" 1
1437 1 76 THR HA 1 80 GLU H . . 4.800 4.167 3.790 4.573 . 0 0 "[ . 1 . 2]" 1
1438 1 76 THR HA 1 108 PHE QE . . 4.380 3.511 3.192 3.715 . 0 0 "[ . 1 . 2]" 1
1439 1 76 THR HA 1 108 PHE HZ . . 4.880 4.470 3.761 4.819 . 0 0 "[ . 1 . 2]" 1
1440 1 76 THR HB 1 77 GLU H . . 3.730 2.684 2.442 3.119 . 0 0 "[ . 1 . 2]" 1
1441 1 76 THR HB 1 77 GLU QB . . 5.340 4.317 4.186 4.621 . 0 0 "[ . 1 . 2]" 1
1442 1 76 THR HB 1 78 LYS H . . 5.500 5.066 4.861 5.418 . 0 0 "[ . 1 . 2]" 1
1443 1 76 THR HB 1 108 PHE HZ . . 5.500 5.221 4.738 5.501 0.001 8 0 "[ . 1 . 2]" 1
1444 1 76 THR MG 1 77 GLU H . . 4.310 3.772 3.573 3.970 . 0 0 "[ . 1 . 2]" 1
1445 1 76 THR MG 1 77 GLU HA . . 4.170 4.003 3.786 4.165 . 0 0 "[ . 1 . 2]" 1
1446 1 76 THR MG 1 79 CYS H . . 4.590 4.161 3.996 4.339 . 0 0 "[ . 1 . 2]" 1
1447 1 76 THR MG 1 79 CYS HB2 . . 4.290 2.564 2.293 2.784 . 0 0 "[ . 1 . 2]" 1
1448 1 76 THR MG 1 79 CYS QB . . 3.700 2.520 2.260 2.728 . 0 0 "[ . 1 . 2]" 1
1449 1 76 THR MG 1 79 CYS HB3 . . 4.290 3.721 3.422 3.995 . 0 0 "[ . 1 . 2]" 1
1450 1 76 THR MG 1 80 GLU H . . 4.600 3.451 3.120 3.822 . 0 0 "[ . 1 . 2]" 1
1451 1 76 THR MG 1 80 GLU QG . . 3.510 2.856 2.162 3.486 . 0 0 "[ . 1 . 2]" 1
1452 1 76 THR MG 1 108 PHE QD . . 4.570 4.098 3.640 4.411 . 0 0 "[ . 1 . 2]" 1
1453 1 76 THR MG 1 108 PHE QE . . 3.800 2.543 2.147 2.908 . 0 0 "[ . 1 . 2]" 1
1454 1 76 THR MG 1 108 PHE HZ . . 3.420 2.458 2.070 2.837 . 0 0 "[ . 1 . 2]" 1
1455 1 77 GLU H 1 77 GLU HB2 . . 3.830 2.663 2.330 3.606 . 0 0 "[ . 1 . 2]" 1
1456 1 77 GLU H 1 77 GLU QB . . 3.340 2.296 2.225 2.528 . 0 0 "[ . 1 . 2]" 1
1457 1 77 GLU H 1 77 GLU HB3 . . 3.830 2.640 2.439 2.819 . 0 0 "[ . 1 . 2]" 1
1458 1 77 GLU H 1 77 GLU HG2 . . 5.420 4.164 2.057 4.658 . 0 0 "[ . 1 . 2]" 1
1459 1 77 GLU H 1 77 GLU QG . . 4.610 3.655 2.033 4.087 . 0 0 "[ . 1 . 2]" 1
1460 1 77 GLU H 1 77 GLU HG3 . . 5.420 4.190 2.414 4.565 . 0 0 "[ . 1 . 2]" 1
1461 1 77 GLU H 1 78 LYS H . . 3.710 2.899 2.723 3.021 . 0 0 "[ . 1 . 2]" 1
1462 1 77 GLU HA 1 77 GLU QG . . 3.720 2.830 2.293 3.424 . 0 0 "[ . 1 . 2]" 1
1463 1 77 GLU HA 1 80 GLU H . . 4.210 4.243 3.964 4.497 0.287 19 0 "[ . 1 . 2]" 1
1464 1 77 GLU HA 1 80 GLU HB2 . . 4.050 3.916 3.717 4.120 0.070 19 0 "[ . 1 . 2]" 1
1465 1 77 GLU QB 1 78 LYS H . . 3.300 2.738 2.457 3.350 0.050 11 0 "[ . 1 . 2]" 1
1466 1 77 GLU QB 1 78 LYS HA . . 5.340 4.197 4.095 4.326 . 0 0 "[ . 1 . 2]" 1
1467 1 77 GLU HB2 1 78 LYS H . . 3.930 3.824 3.530 3.930 0.000 8 0 "[ . 1 . 2]" 1
1468 1 77 GLU HB3 1 78 LYS H . . 3.930 2.885 2.489 3.927 . 0 0 "[ . 1 . 2]" 1
1469 1 77 GLU QG 1 78 LYS H . . 4.750 3.343 1.893 3.888 . 0 0 "[ . 1 . 2]" 1
1470 1 77 GLU QG 1 78 LYS HA . . 4.140 3.714 3.417 4.045 . 0 0 "[ . 1 . 2]" 1
1471 1 77 GLU QG 1 78 LYS QD . . 5.180 4.007 3.424 4.354 . 0 0 "[ . 1 . 2]" 1
1472 1 78 LYS H 1 78 LYS HB2 . . 3.690 2.291 2.188 2.445 . 0 0 "[ . 1 . 2]" 1
1473 1 78 LYS H 1 78 LYS QD . . 4.030 3.956 3.663 4.102 0.072 7 0 "[ . 1 . 2]" 1
1474 1 78 LYS H 1 78 LYS HG2 . . 3.460 2.734 2.409 3.049 . 0 0 "[ . 1 . 2]" 1
1475 1 78 LYS HA 1 78 LYS HD2 . . 3.790 3.080 2.734 3.372 . 0 0 "[ . 1 . 2]" 1
1476 1 78 LYS HA 1 78 LYS QD . . 3.210 2.034 1.980 2.124 . 0 0 "[ . 1 . 2]" 1
1477 1 78 LYS HA 1 78 LYS HD3 . . 3.790 2.066 1.999 2.170 . 0 0 "[ . 1 . 2]" 1
1478 1 78 LYS HA 1 78 LYS QE . . 4.380 4.024 3.694 4.201 . 0 0 "[ . 1 . 2]" 1
1479 1 78 LYS HA 1 78 LYS HG2 . . 3.350 2.796 2.705 2.990 . 0 0 "[ . 1 . 2]" 1
1480 1 78 LYS HA 1 80 GLU H . . 4.820 4.457 4.138 4.812 . 0 0 "[ . 1 . 2]" 1
1481 1 78 LYS HA 1 81 ALA H . . 3.770 3.480 3.361 3.601 . 0 0 "[ . 1 . 2]" 1
1482 1 78 LYS HA 1 81 ALA MB . . 3.270 2.798 2.543 2.995 . 0 0 "[ . 1 . 2]" 1
1483 1 78 LYS HB2 1 79 CYS H . . 3.950 2.617 2.454 2.883 . 0 0 "[ . 1 . 2]" 1
1484 1 78 LYS HB3 1 79 CYS H . . 4.510 3.360 3.060 3.579 . 0 0 "[ . 1 . 2]" 1
1485 1 78 LYS HB3 1 81 ALA MB . . 4.460 4.107 3.924 4.205 . 0 0 "[ . 1 . 2]" 1
1486 1 78 LYS QE 1 78 LYS HG2 . . 3.680 2.591 2.228 3.013 . 0 0 "[ . 1 . 2]" 1
1487 1 78 LYS QE 1 78 LYS HG3 . . 3.300 2.426 2.208 2.900 . 0 0 "[ . 1 . 2]" 1
1488 1 78 LYS HG2 1 79 CYS H . . 4.740 4.542 4.279 4.688 . 0 0 "[ . 1 . 2]" 1
1489 1 79 CYS H 1 79 CYS HB2 . . 4.030 2.574 2.433 2.720 . 0 0 "[ . 1 . 2]" 1
1490 1 79 CYS H 1 79 CYS QB . . 3.260 2.520 2.396 2.645 . 0 0 "[ . 1 . 2]" 1
1491 1 79 CYS H 1 79 CYS HB3 . . 4.030 3.606 3.587 3.620 . 0 0 "[ . 1 . 2]" 1
1492 1 79 CYS H 1 79 CYS HG . . 4.650 3.667 2.216 4.337 . 0 0 "[ . 1 . 2]" 1
1493 1 79 CYS H 1 80 GLU H . . 3.460 3.064 2.911 3.220 . 0 0 "[ . 1 . 2]" 1
1494 1 79 CYS H 1 108 PHE QE . . 4.980 4.786 4.441 4.979 . 0 0 "[ . 1 . 2]" 1
1495 1 79 CYS HA 1 81 ALA MB . . 5.500 4.898 4.606 5.100 . 0 0 "[ . 1 . 2]" 1
1496 1 79 CYS HA 1 82 VAL H . . 3.880 3.528 3.299 3.717 . 0 0 "[ . 1 . 2]" 1
1497 1 79 CYS HA 1 82 VAL HB . . 3.720 2.969 2.621 3.254 . 0 0 "[ . 1 . 2]" 1
1498 1 79 CYS HA 1 82 VAL QG . . 3.990 2.696 2.419 3.154 . 0 0 "[ . 1 . 2]" 1
1499 1 79 CYS HA 1 83 ILE H . . 4.400 4.036 3.615 4.308 . 0 0 "[ . 1 . 2]" 1
1500 1 79 CYS HA 1 83 ILE HG13 . . 5.280 4.139 3.582 4.532 . 0 0 "[ . 1 . 2]" 1
1501 1 79 CYS HA 1 108 PHE QE . . 5.500 4.544 4.368 4.823 . 0 0 "[ . 1 . 2]" 1
1502 1 79 CYS QB 1 80 GLU H . . 3.360 2.324 2.097 2.478 . 0 0 "[ . 1 . 2]" 1
1503 1 79 CYS QB 1 83 ILE MD . . 3.940 2.826 2.092 3.406 . 0 0 "[ . 1 . 2]" 1
1504 1 79 CYS QB 1 108 PHE QD . . 4.220 3.594 3.036 3.801 . 0 0 "[ . 1 . 2]" 1
1505 1 79 CYS HB2 1 80 GLU H . . 3.880 2.374 2.135 2.531 . 0 0 "[ . 1 . 2]" 1
1506 1 79 CYS HB2 1 108 PHE QD . . 5.090 4.604 4.042 4.890 . 0 0 "[ . 1 . 2]" 1
1507 1 79 CYS HB2 1 108 PHE QE . . 4.110 2.380 2.007 2.635 . 0 0 "[ . 1 . 2]" 1
1508 1 79 CYS HB2 1 108 PHE HZ . . 4.160 3.069 2.334 3.730 . 0 0 "[ . 1 . 2]" 1
1509 1 79 CYS HB3 1 80 GLU H . . 3.880 3.334 3.065 3.611 . 0 0 "[ . 1 . 2]" 1
1510 1 79 CYS HB3 1 108 PHE QD . . 5.090 3.754 3.138 4.049 . 0 0 "[ . 1 . 2]" 1
1511 1 79 CYS HB3 1 108 PHE QE . . 4.110 2.169 1.999 2.590 . 0 0 "[ . 1 . 2]" 1
1512 1 79 CYS HB3 1 108 PHE HZ . . 4.160 3.461 2.649 4.081 . 0 0 "[ . 1 . 2]" 1
1513 1 80 GLU H 1 80 GLU HB2 . . 3.290 2.446 2.296 2.584 . 0 0 "[ . 1 . 2]" 1
1514 1 80 GLU H 1 80 GLU HB3 . . 3.650 3.587 3.555 3.615 . 0 0 "[ . 1 . 2]" 1
1515 1 80 GLU H 1 80 GLU HG2 . . 3.860 3.457 2.972 3.853 . 0 0 "[ . 1 . 2]" 1
1516 1 80 GLU H 1 80 GLU QG . . 3.200 2.329 2.072 2.654 . 0 0 "[ . 1 . 2]" 1
1517 1 80 GLU H 1 80 GLU HG3 . . 3.860 2.374 2.087 2.738 . 0 0 "[ . 1 . 2]" 1
1518 1 80 GLU H 1 81 ALA H . . 3.430 2.976 2.865 3.085 . 0 0 "[ . 1 . 2]" 1
1519 1 80 GLU H 1 81 ALA MB . . 4.680 4.478 4.360 4.571 . 0 0 "[ . 1 . 2]" 1
1520 1 80 GLU H 1 83 ILE H . . 5.170 5.025 4.719 5.226 0.056 10 0 "[ . 1 . 2]" 1
1521 1 80 GLU H 1 108 PHE QE . . 5.160 4.082 3.410 4.423 . 0 0 "[ . 1 . 2]" 1
1522 1 80 GLU H 1 108 PHE HZ . . 4.340 3.474 2.862 4.011 . 0 0 "[ . 1 . 2]" 1
1523 1 80 GLU HA 1 80 GLU HG2 . . 3.770 2.457 2.224 2.790 . 0 0 "[ . 1 . 2]" 1
1524 1 80 GLU HA 1 80 GLU QG . . 3.140 2.328 2.171 2.457 . 0 0 "[ . 1 . 2]" 1
1525 1 80 GLU HA 1 80 GLU HG3 . . 3.770 2.982 2.678 3.307 . 0 0 "[ . 1 . 2]" 1
1526 1 80 GLU HA 1 81 ALA MB . . 5.500 5.016 5.007 5.025 . 0 0 "[ . 1 . 2]" 1
1527 1 80 GLU HA 1 83 ILE H . . 4.100 3.880 3.484 4.077 . 0 0 "[ . 1 . 2]" 1
1528 1 80 GLU HA 1 83 ILE HB . . 3.590 3.053 2.630 3.329 . 0 0 "[ . 1 . 2]" 1
1529 1 80 GLU HA 1 83 ILE MD . . 3.490 3.066 2.699 3.403 . 0 0 "[ . 1 . 2]" 1
1530 1 80 GLU HA 1 83 ILE HG13 . . 5.130 4.074 3.336 4.549 . 0 0 "[ . 1 . 2]" 1
1531 1 80 GLU HA 1 83 ILE MG . . 5.010 4.350 4.031 4.615 . 0 0 "[ . 1 . 2]" 1
1532 1 80 GLU HA 1 84 GLY H . . 4.320 3.691 3.207 3.927 . 0 0 "[ . 1 . 2]" 1
1533 1 80 GLU HA 1 108 PHE QE . . 5.500 4.123 3.181 4.710 . 0 0 "[ . 1 . 2]" 1
1534 1 80 GLU HA 1 108 PHE HZ . . 4.640 3.611 3.078 4.203 . 0 0 "[ . 1 . 2]" 1
1535 1 80 GLU HB2 1 81 ALA H . . 3.680 2.462 2.331 2.640 . 0 0 "[ . 1 . 2]" 1
1536 1 80 GLU HB2 1 81 ALA HA . . 4.640 4.401 4.212 4.626 . 0 0 "[ . 1 . 2]" 1
1537 1 80 GLU HB2 1 108 PHE HZ . . 5.210 4.832 4.434 5.158 . 0 0 "[ . 1 . 2]" 1
1538 1 80 GLU HB3 1 81 ALA H . . 3.960 3.271 2.996 3.494 . 0 0 "[ . 1 . 2]" 1
1539 1 80 GLU QG 1 83 ILE MD . . 4.620 3.940 3.476 4.236 . 0 0 "[ . 1 . 2]" 1
1540 1 80 GLU QG 1 108 PHE QE . . 4.390 3.250 2.520 3.768 . 0 0 "[ . 1 . 2]" 1
1541 1 80 GLU QG 1 108 PHE HZ . . 3.610 2.507 1.950 2.853 . 0 0 "[ . 1 . 2]" 1
1542 1 80 GLU HG2 1 108 PHE HZ . . 4.180 3.066 1.999 4.057 . 0 0 "[ . 1 . 2]" 1
1543 1 80 GLU HG3 1 108 PHE HZ . . 4.180 2.758 2.425 3.120 . 0 0 "[ . 1 . 2]" 1
1544 1 81 ALA H 1 81 ALA MB . . 2.770 2.035 2.023 2.066 . 0 0 "[ . 1 . 2]" 1
1545 1 81 ALA H 1 83 ILE H . . 5.120 4.722 4.386 4.995 . 0 0 "[ . 1 . 2]" 1
1546 1 81 ALA HA 1 84 GLY H . . 4.250 4.064 3.810 4.247 . 0 0 "[ . 1 . 2]" 1
1547 1 81 ALA HA 1 84 GLY HA3 . . 4.520 4.114 3.856 4.488 . 0 0 "[ . 1 . 2]" 1
1548 1 81 ALA MB 1 82 VAL H . . 3.460 2.533 2.369 2.727 . 0 0 "[ . 1 . 2]" 1
1549 1 81 ALA MB 1 82 VAL HA . . 4.670 3.660 3.604 3.746 . 0 0 "[ . 1 . 2]" 1
1550 1 81 ALA MB 1 82 VAL HB . . 4.840 4.648 4.533 4.747 . 0 0 "[ . 1 . 2]" 1
1551 1 81 ALA MB 1 82 VAL QG . . 3.800 3.044 2.874 3.242 . 0 0 "[ . 1 . 2]" 1
1552 1 81 ALA MB 1 83 ILE H . . 5.290 4.847 4.642 4.986 . 0 0 "[ . 1 . 2]" 1
1553 1 82 VAL H 1 82 VAL HB . . 3.160 2.573 2.491 2.685 . 0 0 "[ . 1 . 2]" 1
1554 1 82 VAL H 1 82 VAL QG . . 3.040 2.088 1.899 2.253 . 0 0 "[ . 1 . 2]" 1
1555 1 82 VAL H 1 83 ILE H . . 3.570 2.961 2.612 3.111 . 0 0 "[ . 1 . 2]" 1
1556 1 82 VAL H 1 83 ILE HB . . 5.500 5.019 4.747 5.289 . 0 0 "[ . 1 . 2]" 1
1557 1 82 VAL H 1 84 GLY H . . 4.700 4.430 4.234 4.603 . 0 0 "[ . 1 . 2]" 1
1558 1 82 VAL HA 1 82 VAL QG . . 3.080 2.144 2.102 2.179 . 0 0 "[ . 1 . 2]" 1
1559 1 82 VAL HA 1 85 HIS H . . 4.270 3.672 3.530 3.849 . 0 0 "[ . 1 . 2]" 1
1560 1 82 VAL HA 1 85 HIS HB2 . . 4.660 3.343 2.698 4.496 . 0 0 "[ . 1 . 2]" 1
1561 1 82 VAL HA 1 85 HIS QB . . 4.010 3.002 2.669 3.494 . 0 0 "[ . 1 . 2]" 1
1562 1 82 VAL HA 1 85 HIS HB3 . . 4.660 3.972 3.032 4.559 . 0 0 "[ . 1 . 2]" 1
1563 1 82 VAL HA 1 86 PHE H . . 4.080 3.244 3.038 3.498 . 0 0 "[ . 1 . 2]" 1
1564 1 82 VAL HA 1 86 PHE HB2 . . 5.260 3.987 3.886 4.051 . 0 0 "[ . 1 . 2]" 1
1565 1 82 VAL HA 1 86 PHE QD . . 4.190 2.253 2.034 2.554 . 0 0 "[ . 1 . 2]" 1
1566 1 82 VAL HB 1 83 ILE H . . 3.670 2.135 1.969 2.353 . 0 0 "[ . 1 . 2]" 1
1567 1 82 VAL HB 1 83 ILE HG13 . . 4.680 3.102 2.993 3.302 . 0 0 "[ . 1 . 2]" 1
1568 1 82 VAL HB 1 86 PHE QD . . 5.500 4.253 3.957 4.627 . 0 0 "[ . 1 . 2]" 1
1569 1 82 VAL QG 1 83 ILE H . . 3.780 2.898 2.747 3.068 . 0 0 "[ . 1 . 2]" 1
1570 1 82 VAL QG 1 83 ILE MD . . 3.980 4.395 4.212 4.564 0.584 4 7 "[ * +. *** -. *2]" 1
1571 1 82 VAL QG 1 85 HIS H . . 4.740 4.293 4.131 4.429 . 0 0 "[ . 1 . 2]" 1
1572 1 82 VAL QG 1 86 PHE H . . 4.470 3.326 3.123 3.589 . 0 0 "[ . 1 . 2]" 1
1573 1 82 VAL QG 1 86 PHE HB2 . . 3.880 2.329 2.143 2.536 . 0 0 "[ . 1 . 2]" 1
1574 1 82 VAL QG 1 86 PHE HB3 . . 4.200 3.467 3.315 3.594 . 0 0 "[ . 1 . 2]" 1
1575 1 82 VAL QG 1 86 PHE QD . . 3.280 2.114 1.852 2.357 . 0 0 "[ . 1 . 2]" 1
1576 1 82 VAL QG 1 86 PHE QE . . 4.210 2.440 2.215 2.667 . 0 0 "[ . 1 . 2]" 1
1577 1 83 ILE H 1 83 ILE HB . . 3.410 2.608 2.506 2.778 . 0 0 "[ . 1 . 2]" 1
1578 1 83 ILE H 1 83 ILE MD . . 3.820 3.426 3.163 3.597 . 0 0 "[ . 1 . 2]" 1
1579 1 83 ILE H 1 83 ILE HG12 . . 4.010 3.328 2.714 3.604 . 0 0 "[ . 1 . 2]" 1
1580 1 83 ILE H 1 83 ILE HG13 . . 3.500 1.990 1.896 2.216 . 0 0 "[ . 1 . 2]" 1
1581 1 83 ILE H 1 83 ILE MG . . 3.990 3.766 3.744 3.776 . 0 0 "[ . 1 . 2]" 1
1582 1 83 ILE H 1 84 GLY H . . 3.810 2.998 2.856 3.134 . 0 0 "[ . 1 . 2]" 1
1583 1 83 ILE HA 1 83 ILE MD . . 4.190 3.849 3.771 3.891 . 0 0 "[ . 1 . 2]" 1
1584 1 83 ILE HA 1 83 ILE HG12 . . 3.550 2.606 2.509 2.774 . 0 0 "[ . 1 . 2]" 1
1585 1 83 ILE HA 1 83 ILE HG13 . . 3.690 2.915 2.699 3.319 . 0 0 "[ . 1 . 2]" 1
1586 1 83 ILE HA 1 83 ILE MG . . 3.220 2.361 2.229 2.458 . 0 0 "[ . 1 . 2]" 1
1587 1 83 ILE HA 1 86 PHE H . . 4.510 4.228 4.137 4.352 . 0 0 "[ . 1 . 2]" 1
1588 1 83 ILE HA 1 86 PHE HB2 . . 4.810 3.052 2.844 3.244 . 0 0 "[ . 1 . 2]" 1
1589 1 83 ILE HA 1 86 PHE HB3 . . 4.620 4.306 4.085 4.506 . 0 0 "[ . 1 . 2]" 1
1590 1 83 ILE HA 1 87 ASN H . . 3.930 2.958 2.611 3.276 . 0 0 "[ . 1 . 2]" 1
1591 1 83 ILE HA 1 87 ASN HB2 . . 4.090 3.369 2.929 3.658 . 0 0 "[ . 1 . 2]" 1
1592 1 83 ILE HA 1 106 CYS HB2 . . 4.130 2.585 2.136 3.171 . 0 0 "[ . 1 . 2]" 1
1593 1 83 ILE HA 1 106 CYS HB3 . . 4.310 2.405 2.000 3.116 . 0 0 "[ . 1 . 2]" 1
1594 1 83 ILE HB 1 83 ILE MD . . 3.270 2.312 2.155 2.520 . 0 0 "[ . 1 . 2]" 1
1595 1 83 ILE HB 1 84 GLY H . . 3.510 2.265 2.123 2.359 . 0 0 "[ . 1 . 2]" 1
1596 1 83 ILE HB 1 85 HIS H . . 5.170 4.752 4.670 4.870 . 0 0 "[ . 1 . 2]" 1
1597 1 83 ILE MD 1 83 ILE MG . . 2.900 2.144 1.853 2.418 . 0 0 "[ . 1 . 2]" 1
1598 1 83 ILE MD 1 84 GLY H . . 4.770 4.218 4.057 4.342 . 0 0 "[ . 1 . 2]" 1
1599 1 83 ILE MD 1 106 CYS HB3 . . 4.710 3.780 3.141 4.502 . 0 0 "[ . 1 . 2]" 1
1600 1 83 ILE MD 1 107 LYS HA . . 4.040 2.933 2.504 3.261 . 0 0 "[ . 1 . 2]" 1
1601 1 83 ILE MD 1 107 LYS HB2 . . 5.500 4.829 4.486 5.153 . 0 0 "[ . 1 . 2]" 1
1602 1 83 ILE MD 1 107 LYS HB3 . . 5.500 5.090 4.646 5.430 . 0 0 "[ . 1 . 2]" 1
1603 1 83 ILE MD 1 108 PHE H . . 3.930 2.666 2.368 2.883 . 0 0 "[ . 1 . 2]" 1
1604 1 83 ILE MD 1 108 PHE HA . . 4.590 3.159 2.763 3.559 . 0 0 "[ . 1 . 2]" 1
1605 1 83 ILE MD 1 108 PHE QD . . 4.270 3.018 2.654 3.271 . 0 0 "[ . 1 . 2]" 1
1606 1 83 ILE MD 1 108 PHE QE . . 3.820 2.942 2.522 3.237 . 0 0 "[ . 1 . 2]" 1
1607 1 83 ILE MD 1 108 PHE HZ . . 4.430 3.380 2.988 3.727 . 0 0 "[ . 1 . 2]" 1
1608 1 83 ILE HG12 1 83 ILE MG . . 3.340 2.266 2.077 2.485 . 0 0 "[ . 1 . 2]" 1
1609 1 83 ILE HG12 1 106 CYS HB3 . . 4.110 2.227 1.997 3.224 . 0 0 "[ . 1 . 2]" 1
1610 1 83 ILE HG12 1 107 LYS HA . . 4.550 3.564 2.967 4.449 . 0 0 "[ . 1 . 2]" 1
1611 1 83 ILE HG13 1 83 ILE MG . . 3.670 3.178 3.141 3.201 . 0 0 "[ . 1 . 2]" 1
1612 1 83 ILE HG13 1 84 GLY H . . 4.620 4.156 3.832 4.392 . 0 0 "[ . 1 . 2]" 1
1613 1 83 ILE HG13 1 106 CYS HB3 . . 4.320 3.427 2.774 4.452 0.132 14 0 "[ . 1 . 2]" 1
1614 1 83 ILE MG 1 84 GLY H . . 3.850 3.168 2.803 3.308 . 0 0 "[ . 1 . 2]" 1
1615 1 83 ILE MG 1 84 GLY HA2 . . 4.150 3.426 3.109 3.689 . 0 0 "[ . 1 . 2]" 1
1616 1 83 ILE MG 1 87 ASN H . . 4.150 3.684 3.454 3.911 . 0 0 "[ . 1 . 2]" 1
1617 1 83 ILE MG 1 87 ASN HB2 . . 3.100 2.364 1.987 2.702 . 0 0 "[ . 1 . 2]" 1
1618 1 83 ILE MG 1 87 ASN HD21 . . 4.630 3.050 2.169 3.780 . 0 0 "[ . 1 . 2]" 1
1619 1 83 ILE MG 1 87 ASN QD . . 3.980 2.985 2.151 3.619 . 0 0 "[ . 1 . 2]" 1
1620 1 83 ILE MG 1 87 ASN HD22 . . 4.630 4.321 3.553 4.625 . 0 0 "[ . 1 . 2]" 1
1621 1 83 ILE MG 1 106 CYS HB2 . . 4.280 3.221 2.744 4.050 . 0 0 "[ . 1 . 2]" 1
1622 1 83 ILE MG 1 106 CYS HB3 . . 4.500 2.997 2.394 3.781 . 0 0 "[ . 1 . 2]" 1
1623 1 83 ILE MG 1 107 LYS HA . . 3.950 3.011 2.143 3.567 . 0 0 "[ . 1 . 2]" 1
1624 1 84 GLY H 1 85 HIS H . . 3.420 2.843 2.694 2.983 . 0 0 "[ . 1 . 2]" 1
1625 1 84 GLY H 1 87 ASN HB2 . . 5.340 5.046 4.863 5.273 . 0 0 "[ . 1 . 2]" 1
1626 1 85 HIS H 1 85 HIS HB2 . . 3.540 2.340 2.223 2.598 . 0 0 "[ . 1 . 2]" 1
1627 1 85 HIS H 1 85 HIS QB . . 3.010 2.256 2.199 2.349 . 0 0 "[ . 1 . 2]" 1
1628 1 85 HIS H 1 85 HIS HB3 . . 3.540 3.250 2.570 3.578 0.038 13 0 "[ . 1 . 2]" 1
1629 1 85 HIS H 1 86 PHE H . . 3.410 2.741 2.686 2.835 . 0 0 "[ . 1 . 2]" 1
1630 1 85 HIS H 1 86 PHE QD . . 4.710 4.140 3.948 4.288 . 0 0 "[ . 1 . 2]" 1
1631 1 85 HIS H 1 87 ASN H . . 4.540 3.856 3.723 4.006 . 0 0 "[ . 1 . 2]" 1
1632 1 85 HIS QB 1 86 PHE QD . . 4.110 2.944 2.556 3.339 . 0 0 "[ . 1 . 2]" 1
1633 1 85 HIS HB2 1 86 PHE H . . 3.770 2.649 2.127 3.454 . 0 0 "[ . 1 . 2]" 1
1634 1 85 HIS HB3 1 86 PHE H . . 3.770 2.351 1.895 2.757 . 0 0 "[ . 1 . 2]" 1
1635 1 86 PHE H 1 86 PHE HB2 . . 3.870 2.378 2.341 2.420 . 0 0 "[ . 1 . 2]" 1
1636 1 86 PHE H 1 86 PHE HB3 . . 4.140 3.589 3.578 3.606 . 0 0 "[ . 1 . 2]" 1
1637 1 86 PHE H 1 86 PHE QD . . 3.940 2.089 1.898 2.400 . 0 0 "[ . 1 . 2]" 1
1638 1 86 PHE H 1 87 ASN H . . 3.430 3.063 2.961 3.148 . 0 0 "[ . 1 . 2]" 1
1639 1 86 PHE H 1 87 ASN HB3 . . 5.500 5.117 5.031 5.276 . 0 0 "[ . 1 . 2]" 1
1640 1 86 PHE HA 1 86 PHE QD . . 3.630 3.028 2.892 3.077 . 0 0 "[ . 1 . 2]" 1
1641 1 86 PHE HA 1 89 LYS H . . 5.140 3.876 3.667 3.991 . 0 0 "[ . 1 . 2]" 1
1642 1 86 PHE HA 1 89 LYS HA . . 5.150 4.930 4.836 5.025 . 0 0 "[ . 1 . 2]" 1
1643 1 86 PHE HA 1 89 LYS HB2 . . 4.070 2.441 2.009 2.723 . 0 0 "[ . 1 . 2]" 1
1644 1 86 PHE HA 1 89 LYS QB . . 3.510 2.163 1.992 2.237 . 0 0 "[ . 1 . 2]" 1
1645 1 86 PHE HA 1 89 LYS HB3 . . 4.070 2.559 2.331 3.317 . 0 0 "[ . 1 . 2]" 1
1646 1 86 PHE HA 1 89 LYS HD2 . . 5.500 4.698 3.454 5.503 0.003 20 0 "[ . 1 . 2]" 1
1647 1 86 PHE HA 1 89 LYS QD . . 4.800 3.993 3.360 4.503 . 0 0 "[ . 1 . 2]" 1
1648 1 86 PHE HA 1 89 LYS HD3 . . 5.500 4.522 3.991 5.398 . 0 0 "[ . 1 . 2]" 1
1649 1 86 PHE HA 1 89 LYS QG . . 4.590 3.271 2.268 3.534 . 0 0 "[ . 1 . 2]" 1
1650 1 86 PHE HA 1 104 LEU MD1 . . 4.050 3.748 3.499 3.966 . 0 0 "[ . 1 . 2]" 1
1651 1 86 PHE HB2 1 87 ASN H . . 4.040 2.566 2.442 2.694 . 0 0 "[ . 1 . 2]" 1
1652 1 86 PHE HB2 1 89 LYS QB . . 5.340 4.678 4.608 4.739 . 0 0 "[ . 1 . 2]" 1
1653 1 86 PHE HB2 1 104 LEU MD1 . . 4.980 4.819 4.667 4.903 . 0 0 "[ . 1 . 2]" 1
1654 1 86 PHE HB3 1 87 ASN H . . 4.960 3.147 2.946 3.369 . 0 0 "[ . 1 . 2]" 1
1655 1 86 PHE HB3 1 104 LEU HB3 . . 4.890 3.311 3.140 3.506 . 0 0 "[ . 1 . 2]" 1
1656 1 86 PHE HB3 1 104 LEU MD1 . . 3.540 3.527 3.400 3.556 0.016 17 0 "[ . 1 . 2]" 1
1657 1 86 PHE HB3 1 104 LEU MD2 . . 4.950 4.913 4.745 5.132 0.182 18 0 "[ . 1 . 2]" 1
1658 1 86 PHE QD 1 104 LEU MD1 . . 3.460 1.925 1.779 2.054 . 0 0 "[ . 1 . 2]" 1
1659 1 86 PHE QD 1 104 LEU MD2 . . 5.220 3.709 3.399 4.110 . 0 0 "[ . 1 . 2]" 1
1660 1 86 PHE QE 1 91 ILE MD . . 4.220 3.797 3.499 4.095 . 0 0 "[ . 1 . 2]" 1
1661 1 86 PHE QE 1 91 ILE MG . . 3.710 2.776 2.265 3.195 . 0 0 "[ . 1 . 2]" 1
1662 1 87 ASN H 1 87 ASN HB2 . . 3.070 2.508 2.394 2.595 . 0 0 "[ . 1 . 2]" 1
1663 1 87 ASN H 1 87 ASN HB3 . . 3.290 2.620 2.523 2.780 . 0 0 "[ . 1 . 2]" 1
1664 1 87 ASN H 1 88 GLY H . . 4.430 4.230 4.145 4.328 . 0 0 "[ . 1 . 2]" 1
1665 1 87 ASN H 1 106 CYS HB2 . . 4.260 3.144 2.741 3.709 . 0 0 "[ . 1 . 2]" 1
1666 1 87 ASN H 1 106 CYS HG . . 4.830 4.194 3.624 4.833 0.003 14 0 "[ . 1 . 2]" 1
1667 1 87 ASN HA 1 88 GLY H . . 3.010 2.211 2.167 2.263 . 0 0 "[ . 1 . 2]" 1
1668 1 87 ASN HA 1 88 GLY HA2 . . 4.490 4.377 4.370 4.381 . 0 0 "[ . 1 . 2]" 1
1669 1 87 ASN HA 1 88 GLY HA3 . . 4.560 4.354 4.349 4.361 . 0 0 "[ . 1 . 2]" 1
1670 1 87 ASN HA 1 89 LYS H . . 3.980 4.027 3.879 4.174 0.194 16 0 "[ . 1 . 2]" 1
1671 1 87 ASN HA 1 104 LEU HB2 . . 4.870 4.826 4.507 5.038 0.168 2 0 "[ . 1 . 2]" 1
1672 1 87 ASN HA 1 105 LEU HA . . 3.910 3.557 3.173 3.805 . 0 0 "[ . 1 . 2]" 1
1673 1 87 ASN HA 1 106 CYS H . . 3.780 2.968 2.308 3.463 . 0 0 "[ . 1 . 2]" 1
1674 1 87 ASN HA 1 106 CYS HB2 . . 4.340 3.257 2.755 3.597 . 0 0 "[ . 1 . 2]" 1
1675 1 87 ASN HA 1 106 CYS HG . . 5.110 4.700 3.396 5.786 0.676 14 2 "[ . -1 +. 2]" 1
1676 1 87 ASN HB2 1 87 ASN QD . . 3.360 2.296 2.098 2.853 . 0 0 "[ . 1 . 2]" 1
1677 1 87 ASN HB2 1 87 ASN HD22 . . 4.020 3.523 3.435 3.792 . 0 0 "[ . 1 . 2]" 1
1678 1 87 ASN HB2 1 88 GLY H . . 4.770 4.492 4.433 4.549 . 0 0 "[ . 1 . 2]" 1
1679 1 87 ASN HB2 1 105 LEU HA . . 5.500 5.241 4.730 5.496 . 0 0 "[ . 1 . 2]" 1
1680 1 87 ASN HB2 1 106 CYS H . . 4.320 3.810 3.337 4.283 . 0 0 "[ . 1 . 2]" 1
1681 1 87 ASN HB2 1 106 CYS HB2 . . 3.720 3.214 2.567 3.813 0.093 14 0 "[ . 1 . 2]" 1
1682 1 87 ASN HB3 1 88 GLY H . . 5.120 4.480 4.427 4.522 . 0 0 "[ . 1 . 2]" 1
1683 1 88 GLY H 1 89 LYS H . . 3.280 2.338 2.202 2.415 . 0 0 "[ . 1 . 2]" 1
1684 1 88 GLY H 1 103 PRO HA . . 5.500 5.433 5.236 5.501 0.001 3 0 "[ . 1 . 2]" 1
1685 1 88 GLY H 1 103 PRO QB . . 4.380 3.273 3.041 3.422 . 0 0 "[ . 1 . 2]" 1
1686 1 88 GLY H 1 104 LEU H . . 4.890 3.533 3.087 4.040 . 0 0 "[ . 1 . 2]" 1
1687 1 88 GLY H 1 104 LEU HB2 . . 4.840 3.963 3.772 4.174 . 0 0 "[ . 1 . 2]" 1
1688 1 88 GLY H 1 104 LEU HB3 . . 4.960 4.950 4.760 5.118 0.158 18 0 "[ . 1 . 2]" 1
1689 1 88 GLY H 1 105 LEU HA . . 4.220 3.865 3.605 4.138 . 0 0 "[ . 1 . 2]" 1
1690 1 88 GLY H 1 106 CYS H . . 4.780 4.415 3.819 4.766 . 0 0 "[ . 1 . 2]" 1
1691 1 88 GLY HA2 1 103 PRO QB . . 3.350 2.355 2.144 2.536 . 0 0 "[ . 1 . 2]" 1
1692 1 88 GLY HA2 1 103 PRO HG2 . . 4.580 4.171 3.921 4.313 . 0 0 "[ . 1 . 2]" 1
1693 1 88 GLY HA2 1 104 LEU HB2 . . 5.230 5.320 5.120 5.485 0.255 13 0 "[ . 1 . 2]" 1
1694 1 88 GLY HA3 1 103 PRO HB2 . . 4.820 4.197 3.937 4.398 . 0 0 "[ . 1 . 2]" 1
1695 1 88 GLY HA3 1 103 PRO QB . . 4.020 3.893 3.690 4.059 0.039 1 0 "[ . 1 . 2]" 1
1696 1 88 GLY HA3 1 103 PRO HB3 . . 4.820 4.616 4.457 4.772 . 0 0 "[ . 1 . 2]" 1
1697 1 88 GLY HA3 1 103 PRO HG2 . . 5.500 5.825 5.532 6.012 0.512 1 1 "[+ . 1 . 2]" 1
1698 1 88 GLY HA3 1 103 PRO HG3 . . 5.440 5.347 5.120 5.504 0.064 19 0 "[ . 1 . 2]" 1
1699 1 89 LYS H 1 89 LYS HB2 . . 3.590 2.723 2.434 2.868 . 0 0 "[ . 1 . 2]" 1
1700 1 89 LYS H 1 89 LYS QB . . 3.060 2.498 2.396 2.543 . 0 0 "[ . 1 . 2]" 1
1701 1 89 LYS H 1 89 LYS HB3 . . 3.590 2.990 2.791 3.604 0.014 16 0 "[ . 1 . 2]" 1
1702 1 89 LYS H 1 89 LYS HG2 . . 4.840 4.637 3.531 4.909 0.069 18 0 "[ . 1 . 2]" 1
1703 1 89 LYS H 1 89 LYS QG . . 4.240 4.077 3.356 4.219 . 0 0 "[ . 1 . 2]" 1
1704 1 89 LYS H 1 89 LYS HG3 . . 4.840 4.572 4.192 4.888 0.048 4 0 "[ . 1 . 2]" 1
1705 1 89 LYS H 1 90 PHE H . . 4.780 4.471 4.428 4.498 . 0 0 "[ . 1 . 2]" 1
1706 1 89 LYS H 1 103 PRO QB . . 3.980 3.315 3.149 3.491 . 0 0 "[ . 1 . 2]" 1
1707 1 89 LYS H 1 104 LEU H . . 4.130 2.710 2.526 3.128 . 0 0 "[ . 1 . 2]" 1
1708 1 89 LYS H 1 104 LEU HB2 . . 4.100 3.036 2.842 3.247 . 0 0 "[ . 1 . 2]" 1
1709 1 89 LYS H 1 104 LEU HB3 . . 4.620 4.639 4.407 4.867 0.247 9 0 "[ . 1 . 2]" 1
1710 1 89 LYS HA 1 89 LYS HD2 . . 4.180 2.952 2.131 4.364 0.184 4 0 "[ . 1 . 2]" 1
1711 1 89 LYS HA 1 89 LYS QD . . 3.660 2.579 2.107 3.242 . 0 0 "[ . 1 . 2]" 1
1712 1 89 LYS HA 1 89 LYS HD3 . . 4.180 3.433 2.313 4.018 . 0 0 "[ . 1 . 2]" 1
1713 1 89 LYS HA 1 89 LYS HE2 . . 5.500 4.376 2.329 5.182 . 0 0 "[ . 1 . 2]" 1
1714 1 89 LYS HA 1 89 LYS HE3 . . 5.500 4.159 2.015 5.499 . 0 0 "[ . 1 . 2]" 1
1715 1 89 LYS HA 1 89 LYS HG2 . . 4.050 3.257 2.189 3.713 . 0 0 "[ . 1 . 2]" 1
1716 1 89 LYS HA 1 89 LYS HG3 . . 4.050 2.850 2.439 3.635 . 0 0 "[ . 1 . 2]" 1
1717 1 89 LYS HA 1 90 PHE H . . 3.040 2.298 2.212 2.558 . 0 0 "[ . 1 . 2]" 1
1718 1 89 LYS HA 1 90 PHE HB2 . . 4.940 4.580 4.480 4.627 . 0 0 "[ . 1 . 2]" 1
1719 1 89 LYS HA 1 90 PHE QD . . 4.790 2.839 2.615 4.279 . 0 0 "[ . 1 . 2]" 1
1720 1 89 LYS QB 1 90 PHE H . . 3.610 3.230 2.123 3.550 . 0 0 "[ . 1 . 2]" 1
1721 1 89 LYS HB2 1 90 PHE H . . 4.140 4.097 3.615 4.232 0.092 4 0 "[ . 1 . 2]" 1
1722 1 89 LYS HB3 1 90 PHE H . . 4.140 3.407 2.138 3.830 . 0 0 "[ . 1 . 2]" 1
1723 1 89 LYS QE 1 89 LYS QG . . 3.200 2.251 2.076 2.660 . 0 0 "[ . 1 . 2]" 1
1724 1 89 LYS QG 1 90 PHE H . . 4.290 2.464 1.918 3.908 . 0 0 "[ . 1 . 2]" 1
1725 1 89 LYS HG2 1 90 PHE H . . 4.880 3.696 2.730 4.200 . 0 0 "[ . 1 . 2]" 1
1726 1 89 LYS HG3 1 90 PHE H . . 4.880 2.798 1.926 4.730 . 0 0 "[ . 1 . 2]" 1
1727 1 90 PHE H 1 90 PHE HB2 . . 3.420 2.597 2.495 2.770 . 0 0 "[ . 1 . 2]" 1
1728 1 90 PHE H 1 90 PHE HB3 . . 3.850 3.742 3.688 3.855 0.005 12 0 "[ . 1 . 2]" 1
1729 1 90 PHE H 1 90 PHE QD . . 3.830 2.323 1.973 3.238 . 0 0 "[ . 1 . 2]" 1
1730 1 90 PHE H 1 104 LEU H . . 5.500 5.213 4.930 5.459 . 0 0 "[ . 1 . 2]" 1
1731 1 90 PHE HA 1 90 PHE QD . . 4.020 3.118 2.388 3.197 . 0 0 "[ . 1 . 2]" 1
1732 1 90 PHE HA 1 91 ILE H . . 3.260 2.149 2.139 2.163 . 0 0 "[ . 1 . 2]" 1
1733 1 90 PHE HA 1 103 PRO HA . . 3.950 3.368 3.026 3.591 . 0 0 "[ . 1 . 2]" 1
1734 1 90 PHE HA 1 104 LEU H . . 4.530 3.996 3.468 4.362 . 0 0 "[ . 1 . 2]" 1
1735 1 90 PHE HB2 1 91 ILE H . . 4.660 4.350 4.182 4.392 . 0 0 "[ . 1 . 2]" 1
1736 1 90 PHE HB3 1 91 ILE H . . 3.820 3.610 3.298 3.755 . 0 0 "[ . 1 . 2]" 1
1737 1 90 PHE QD 1 91 ILE H . . 4.810 4.629 3.923 4.795 . 0 0 "[ . 1 . 2]" 1
1738 1 90 PHE QD 1 102 GLU H . . 5.000 5.097 5.000 5.287 0.287 4 0 "[ . 1 . 2]" 1
1739 1 90 PHE QD 1 103 PRO HA . . 4.250 3.455 2.589 3.690 . 0 0 "[ . 1 . 2]" 1
1740 1 90 PHE QD 1 103 PRO QB . . 4.900 3.853 3.651 4.043 . 0 0 "[ . 1 . 2]" 1
1741 1 90 PHE QD 1 104 LEU H . . 5.050 4.857 4.155 5.047 . 0 0 "[ . 1 . 2]" 1
1742 1 90 PHE QE 1 101 THR HA . . 4.480 4.119 3.802 4.489 0.009 19 0 "[ . 1 . 2]" 1
1743 1 90 PHE QE 1 102 GLU H . . 4.500 4.669 4.479 4.919 0.419 20 0 "[ . 1 . 2]" 1
1744 1 90 PHE QE 1 102 GLU HA . . 4.740 3.263 3.054 3.418 . 0 0 "[ . 1 . 2]" 1
1745 1 90 PHE QE 1 102 GLU QB . . 5.340 4.888 4.384 5.047 . 0 0 "[ . 1 . 2]" 1
1746 1 90 PHE QE 1 103 PRO HA . . 4.630 3.453 2.411 3.754 . 0 0 "[ . 1 . 2]" 1
1747 1 90 PHE QE 1 103 PRO QB . . 4.570 2.906 2.666 3.102 . 0 0 "[ . 1 . 2]" 1
1748 1 90 PHE QE 1 103 PRO HD3 . . 4.570 3.032 2.444 3.401 . 0 0 "[ . 1 . 2]" 1
1749 1 90 PHE HZ 1 102 GLU HA . . 5.150 4.523 4.116 4.702 . 0 0 "[ . 1 . 2]" 1
1750 1 90 PHE HZ 1 103 PRO HD2 . . 5.300 4.671 4.497 4.717 . 0 0 "[ . 1 . 2]" 1
1751 1 90 PHE HZ 1 103 PRO HD3 . . 4.100 2.934 2.752 2.993 . 0 0 "[ . 1 . 2]" 1
1752 1 90 PHE HZ 1 103 PRO HG3 . . 5.020 3.639 3.387 3.837 . 0 0 "[ . 1 . 2]" 1
1753 1 91 ILE H 1 91 ILE HB . . 3.730 3.616 3.596 3.646 . 0 0 "[ . 1 . 2]" 1
1754 1 91 ILE H 1 91 ILE MD . . 4.390 3.627 3.582 3.711 . 0 0 "[ . 1 . 2]" 1
1755 1 91 ILE H 1 91 ILE HG12 . . 3.710 1.944 1.899 2.060 . 0 0 "[ . 1 . 2]" 1
1756 1 91 ILE H 1 91 ILE HG13 . . 3.950 2.686 2.433 2.916 . 0 0 "[ . 1 . 2]" 1
1757 1 91 ILE H 1 91 ILE MG . . 3.980 2.568 2.396 2.844 . 0 0 "[ . 1 . 2]" 1
1758 1 91 ILE H 1 103 PRO HA . . 5.500 5.084 4.719 5.279 . 0 0 "[ . 1 . 2]" 1
1759 1 91 ILE H 1 104 LEU MD1 . . 4.610 2.729 2.185 3.272 . 0 0 "[ . 1 . 2]" 1
1760 1 91 ILE HA 1 91 ILE MD . . 4.220 4.179 4.171 4.181 . 0 0 "[ . 1 . 2]" 1
1761 1 91 ILE HA 1 91 ILE HG13 . . 4.150 3.683 3.648 3.707 . 0 0 "[ . 1 . 2]" 1
1762 1 91 ILE HA 1 91 ILE MG . . 3.270 2.289 2.196 2.353 . 0 0 "[ . 1 . 2]" 1
1763 1 91 ILE HA 1 92 LYS H . . 2.940 2.307 2.190 2.560 . 0 0 "[ . 1 . 2]" 1
1764 1 91 ILE HA 1 92 LYS QB . . 4.480 4.278 4.189 4.390 . 0 0 "[ . 1 . 2]" 1
1765 1 91 ILE HA 1 92 LYS QG . . 4.550 4.109 3.716 4.369 . 0 0 "[ . 1 . 2]" 1
1766 1 91 ILE HB 1 91 ILE MD . . 3.400 2.363 2.286 2.435 . 0 0 "[ . 1 . 2]" 1
1767 1 91 ILE HB 1 92 LYS H . . 3.350 2.653 2.038 3.019 . 0 0 "[ . 1 . 2]" 1
1768 1 91 ILE MD 1 92 LYS H . . 5.210 4.462 3.828 4.811 . 0 0 "[ . 1 . 2]" 1
1769 1 91 ILE MD 1 93 THR MG . . 4.220 3.857 3.479 4.174 . 0 0 "[ . 1 . 2]" 1
1770 1 91 ILE MD 1 104 LEU MD2 . . 2.890 2.512 2.081 2.758 . 0 0 "[ . 1 . 2]" 1
1771 1 91 ILE HG12 1 91 ILE MG . . 3.490 2.340 2.263 2.407 . 0 0 "[ . 1 . 2]" 1
1772 1 91 ILE HG12 1 104 LEU MD1 . . 3.780 2.001 1.861 2.190 . 0 0 "[ . 1 . 2]" 1
1773 1 91 ILE HG12 1 104 LEU MD2 . . 4.490 2.845 2.520 3.074 . 0 0 "[ . 1 . 2]" 1
1774 1 91 ILE HG13 1 91 ILE MG . . 3.610 3.196 3.189 3.200 . 0 0 "[ . 1 . 2]" 1
1775 1 91 ILE HG13 1 92 LYS H . . 4.560 4.099 3.547 4.446 . 0 0 "[ . 1 . 2]" 1
1776 1 91 ILE HG13 1 93 THR MG . . 4.240 3.894 3.550 4.223 . 0 0 "[ . 1 . 2]" 1
1777 1 91 ILE HG13 1 100 PRO HD2 . . 5.500 4.183 3.967 4.509 . 0 0 "[ . 1 . 2]" 1
1778 1 91 ILE HG13 1 104 LEU MD1 . . 3.990 3.488 3.281 3.650 . 0 0 "[ . 1 . 2]" 1
1779 1 91 ILE HG13 1 104 LEU MD2 . . 4.600 3.973 3.622 4.215 . 0 0 "[ . 1 . 2]" 1
1780 1 91 ILE MG 1 92 LYS H . . 3.870 3.582 3.431 3.778 . 0 0 "[ . 1 . 2]" 1
1781 1 91 ILE MG 1 104 LEU HB2 . . 4.240 4.233 4.178 4.256 0.016 9 0 "[ . 1 . 2]" 1
1782 1 91 ILE MG 1 104 LEU MD1 . . 3.150 1.727 1.675 1.826 . 0 0 "[ . 1 . 2]" 1
1783 1 92 LYS H 1 92 LYS QB . . 2.940 2.365 2.157 2.878 . 0 0 "[ . 1 . 2]" 1
1784 1 92 LYS H 1 92 LYS QG . . 4.600 2.642 1.884 3.089 . 0 0 "[ . 1 . 2]" 1
1785 1 92 LYS H 1 93 THR H . . 4.700 4.538 4.438 4.610 . 0 0 "[ . 1 . 2]" 1
1786 1 92 LYS HA 1 92 LYS HD2 . . 5.410 3.875 2.013 5.418 0.008 17 0 "[ . 1 . 2]" 1
1787 1 92 LYS HA 1 92 LYS HD3 . . 5.410 3.752 2.132 5.009 . 0 0 "[ . 1 . 2]" 1
1788 1 92 LYS HA 1 92 LYS HG2 . . 4.030 2.928 2.171 4.204 0.174 15 0 "[ . 1 . 2]" 1
1789 1 92 LYS HA 1 92 LYS QG . . 3.510 2.721 2.132 3.412 . 0 0 "[ . 1 . 2]" 1
1790 1 92 LYS HA 1 92 LYS HG3 . . 4.030 3.509 3.007 3.826 . 0 0 "[ . 1 . 2]" 1
1791 1 92 LYS HA 1 93 THR H . . 2.620 2.518 2.299 2.624 0.004 15 0 "[ . 1 . 2]" 1
1792 1 92 LYS HA 1 93 THR MG . . 4.120 3.775 3.503 3.972 . 0 0 "[ . 1 . 2]" 1
1793 1 92 LYS QB 1 93 THR H . . 3.520 2.216 1.979 2.732 . 0 0 "[ . 1 . 2]" 1
1794 1 92 LYS HD2 1 93 THR H . . 5.500 3.866 2.967 5.439 . 0 0 "[ . 1 . 2]" 1
1795 1 92 LYS HD3 1 93 THR H . . 5.500 4.270 2.591 5.267 . 0 0 "[ . 1 . 2]" 1
1796 1 92 LYS QG 1 93 THR H . . 4.410 3.586 2.908 4.161 . 0 0 "[ . 1 . 2]" 1
1797 1 92 LYS HG2 1 93 THR H . . 5.050 4.150 3.434 4.682 . 0 0 "[ . 1 . 2]" 1
1798 1 92 LYS HG3 1 93 THR H . . 5.050 4.194 2.962 4.800 . 0 0 "[ . 1 . 2]" 1
1799 1 93 THR H 1 93 THR HB . . 4.060 3.758 3.654 3.884 . 0 0 "[ . 1 . 2]" 1
1800 1 93 THR H 1 93 THR MG . . 3.670 3.263 3.050 3.435 . 0 0 "[ . 1 . 2]" 1
1801 1 93 THR H 1 94 PRO QD . . 4.810 4.344 4.321 4.371 . 0 0 "[ . 1 . 2]" 1
1802 1 93 THR H 1 99 ALA MB . . 5.500 3.771 3.350 4.289 . 0 0 "[ . 1 . 2]" 1
1803 1 93 THR HA 1 93 THR MG . . 3.110 2.222 2.103 2.286 . 0 0 "[ . 1 . 2]" 1
1804 1 93 THR HA 1 94 PRO HD2 . . 3.120 2.421 2.363 2.478 . 0 0 "[ . 1 . 2]" 1
1805 1 93 THR HA 1 94 PRO HD3 . . 3.120 2.309 2.287 2.334 . 0 0 "[ . 1 . 2]" 1
1806 1 93 THR HA 1 94 PRO HG2 . . 5.160 4.530 4.482 4.577 . 0 0 "[ . 1 . 2]" 1
1807 1 93 THR HA 1 94 PRO QG . . 4.430 4.016 3.979 4.052 . 0 0 "[ . 1 . 2]" 1
1808 1 93 THR HA 1 94 PRO HG3 . . 5.160 4.485 4.450 4.522 . 0 0 "[ . 1 . 2]" 1
1809 1 93 THR HA 1 97 VAL QG . . 4.960 4.054 3.752 4.342 . 0 0 "[ . 1 . 2]" 1
1810 1 93 THR HB 1 94 PRO HD2 . . 3.690 2.031 1.996 2.182 . 0 0 "[ . 1 . 2]" 1
1811 1 93 THR HB 1 94 PRO QD . . 3.050 2.018 1.984 2.164 . 0 0 "[ . 1 . 2]" 1
1812 1 93 THR HB 1 94 PRO HD3 . . 3.690 3.477 3.448 3.602 . 0 0 "[ . 1 . 2]" 1
1813 1 93 THR HB 1 94 PRO QG . . 4.350 3.581 3.524 3.665 . 0 0 "[ . 1 . 2]" 1
1814 1 93 THR HB 1 97 VAL HB . . 3.410 2.307 2.171 2.510 . 0 0 "[ . 1 . 2]" 1
1815 1 93 THR HB 1 97 VAL MG1 . . 3.820 2.434 2.058 2.828 . 0 0 "[ . 1 . 2]" 1
1816 1 93 THR HB 1 97 VAL QG . . 3.310 2.403 2.050 2.754 . 0 0 "[ . 1 . 2]" 1
1817 1 93 THR HB 1 97 VAL MG2 . . 3.820 3.815 3.783 3.828 0.008 9 0 "[ . 1 . 2]" 1
1818 1 93 THR MG 1 94 PRO QD . . 3.690 2.608 2.319 3.081 . 0 0 "[ . 1 . 2]" 1
1819 1 93 THR MG 1 94 PRO HG2 . . 5.500 4.566 4.263 5.018 . 0 0 "[ . 1 . 2]" 1
1820 1 93 THR MG 1 94 PRO HG3 . . 5.500 4.881 4.567 5.397 . 0 0 "[ . 1 . 2]" 1
1821 1 93 THR MG 1 97 VAL HB . . 3.610 3.412 3.157 3.661 0.051 5 0 "[ . 1 . 2]" 1
1822 1 93 THR MG 1 97 VAL MG1 . . 4.260 2.112 1.947 2.377 . 0 0 "[ . 1 . 2]" 1
1823 1 93 THR MG 1 97 VAL QG . . 3.290 2.104 1.944 2.358 . 0 0 "[ . 1 . 2]" 1
1824 1 93 THR MG 1 97 VAL MG2 . . 4.260 4.017 3.808 4.264 0.004 18 0 "[ . 1 . 2]" 1
1825 1 93 THR MG 1 99 ALA H . . 5.270 4.164 3.624 4.663 . 0 0 "[ . 1 . 2]" 1
1826 1 93 THR MG 1 99 ALA HA . . 3.520 2.233 1.938 2.683 . 0 0 "[ . 1 . 2]" 1
1827 1 93 THR MG 1 99 ALA MB . . 3.830 3.072 2.502 3.477 . 0 0 "[ . 1 . 2]" 1
1828 1 93 THR MG 1 100 PRO HD2 . . 4.010 2.743 2.388 3.070 . 0 0 "[ . 1 . 2]" 1
1829 1 93 THR MG 1 100 PRO HD3 . . 3.730 2.487 2.343 2.756 . 0 0 "[ . 1 . 2]" 1
1830 1 93 THR MG 1 100 PRO QG . . 3.910 3.632 3.452 3.706 . 0 0 "[ . 1 . 2]" 1
1831 1 94 PRO HA 1 95 PRO HD2 . . 3.540 2.563 2.546 2.572 . 0 0 "[ . 1 . 2]" 1
1832 1 94 PRO HA 1 95 PRO QD . . 2.950 2.193 2.182 2.199 . 0 0 "[ . 1 . 2]" 1
1833 1 94 PRO HA 1 95 PRO HD3 . . 3.540 2.383 2.373 2.388 . 0 0 "[ . 1 . 2]" 1
1834 1 94 PRO QB 1 95 PRO QD . . 2.820 1.944 1.930 1.979 . 0 0 "[ . 1 . 2]" 1
1835 1 94 PRO QB 1 97 VAL QG . . 3.640 3.610 3.454 3.725 0.085 10 0 "[ . 1 . 2]" 1
1836 1 94 PRO HB2 1 95 PRO HD2 . . 3.830 2.015 1.997 2.055 . 0 0 "[ . 1 . 2]" 1
1837 1 94 PRO HB2 1 95 PRO HD3 . . 3.830 3.462 3.448 3.497 . 0 0 "[ . 1 . 2]" 1
1838 1 94 PRO HB3 1 95 PRO HD2 . . 3.830 2.695 2.687 2.714 . 0 0 "[ . 1 . 2]" 1
1839 1 94 PRO HB3 1 95 PRO HD3 . . 3.830 3.737 3.727 3.761 . 0 0 "[ . 1 . 2]" 1
1840 1 94 PRO QD 1 97 VAL HB . . 3.550 2.477 2.190 2.646 . 0 0 "[ . 1 . 2]" 1
1841 1 94 PRO QD 1 97 VAL QG . . 3.120 2.692 2.548 2.869 . 0 0 "[ . 1 . 2]" 1
1842 1 94 PRO QG 1 97 VAL QG . . 3.240 2.026 1.930 2.115 . 0 0 "[ . 1 . 2]" 1
1843 1 95 PRO HA 1 97 VAL H . . 4.270 3.763 3.648 3.954 . 0 0 "[ . 1 . 2]" 1
1844 1 96 GLY H 1 97 VAL H . . 4.560 1.907 1.800 2.653 . 0 0 "[ . 1 . 2]" 1
1845 1 96 GLY QA 1 97 VAL QG . . 4.370 3.587 3.385 3.754 . 0 0 "[ . 1 . 2]" 1
1846 1 97 VAL H 1 97 VAL HB . . 3.120 2.552 2.334 2.675 . 0 0 "[ . 1 . 2]" 1
1847 1 97 VAL H 1 97 VAL MG1 . . 3.960 3.769 3.689 3.858 . 0 0 "[ . 1 . 2]" 1
1848 1 97 VAL H 1 97 VAL QG . . 3.210 2.906 2.514 3.030 . 0 0 "[ . 1 . 2]" 1
1849 1 97 VAL H 1 97 VAL MG2 . . 3.960 3.028 2.557 3.198 . 0 0 "[ . 1 . 2]" 1
1850 1 97 VAL HA 1 97 VAL MG1 . . 3.220 2.451 2.336 2.522 . 0 0 "[ . 1 . 2]" 1
1851 1 97 VAL HA 1 97 VAL MG2 . . 3.220 2.198 2.117 2.369 . 0 0 "[ . 1 . 2]" 1
1852 1 97 VAL QG 1 98 SER H . . 4.960 2.193 1.860 2.988 . 0 0 "[ . 1 . 2]" 1
1853 1 97 VAL QG 1 98 SER QB . . 4.300 3.560 3.361 4.086 . 0 0 "[ . 1 . 2]" 1
1854 1 97 VAL QG 1 99 ALA HA . . 5.180 3.658 3.494 3.892 . 0 0 "[ . 1 . 2]" 1
1855 1 97 VAL QG 1 100 PRO HD3 . . 4.510 4.141 3.990 4.302 . 0 0 "[ . 1 . 2]" 1
1856 1 98 SER HA 1 99 ALA H . . 2.820 2.144 2.138 2.185 . 0 0 "[ . 1 . 2]" 1
1857 1 98 SER HA 1 99 ALA MB . . 4.050 3.939 3.905 3.995 . 0 0 "[ . 1 . 2]" 1
1858 1 98 SER QB 1 99 ALA H . . 3.960 3.535 3.275 3.886 . 0 0 "[ . 1 . 2]" 1
1859 1 98 SER HB2 1 99 ALA H . . 4.560 4.147 3.406 4.466 . 0 0 "[ . 1 . 2]" 1
1860 1 98 SER HB3 1 99 ALA H . . 4.560 3.971 3.399 4.393 . 0 0 "[ . 1 . 2]" 1
1861 1 99 ALA H 1 99 ALA MB . . 3.120 2.102 2.033 2.236 . 0 0 "[ . 1 . 2]" 1
1862 1 99 ALA HA 1 100 PRO HD2 . . 3.440 2.209 2.156 2.243 . 0 0 "[ . 1 . 2]" 1
1863 1 99 ALA HA 1 100 PRO HD3 . . 3.230 2.255 2.253 2.258 . 0 0 "[ . 1 . 2]" 1
1864 1 99 ALA MB 1 100 PRO HD2 . . 3.220 2.442 2.289 2.620 . 0 0 "[ . 1 . 2]" 1
1865 1 99 ALA MB 1 100 PRO HD3 . . 4.040 3.521 3.465 3.605 . 0 0 "[ . 1 . 2]" 1
1866 1 99 ALA MB 1 100 PRO QG . . 4.760 3.844 3.757 3.934 . 0 0 "[ . 1 . 2]" 1
1867 1 100 PRO HA 1 101 THR H . . 2.970 2.376 2.203 2.535 . 0 0 "[ . 1 . 2]" 1
1868 1 100 PRO HA 1 101 THR MG . . 5.500 4.940 3.156 5.478 . 0 0 "[ . 1 . 2]" 1
1869 1 100 PRO HA 1 102 GLU H . . 4.260 4.100 3.866 4.225 . 0 0 "[ . 1 . 2]" 1
1870 1 100 PRO HB2 1 101 THR H . . 4.050 2.685 2.292 3.220 . 0 0 "[ . 1 . 2]" 1
1871 1 100 PRO HB2 1 102 GLU H . . 4.120 2.980 2.808 3.107 . 0 0 "[ . 1 . 2]" 1
1872 1 100 PRO HB3 1 101 THR H . . 4.070 3.495 3.300 3.798 . 0 0 "[ . 1 . 2]" 1
1873 1 100 PRO HB3 1 102 GLU H . . 4.610 4.293 4.186 4.380 . 0 0 "[ . 1 . 2]" 1
1874 1 100 PRO QG 1 104 LEU MD2 . . 5.050 4.051 3.844 4.159 . 0 0 "[ . 1 . 2]" 1
1875 1 101 THR H 1 101 THR HB . . 4.120 2.903 2.551 3.786 . 0 0 "[ . 1 . 2]" 1
1876 1 101 THR H 1 101 THR MG . . 3.960 3.489 2.073 3.911 . 0 0 "[ . 1 . 2]" 1
1877 1 101 THR H 1 102 GLU H . . 3.140 1.995 1.806 2.260 . 0 0 "[ . 1 . 2]" 1
1878 1 101 THR HA 1 101 THR MG . . 3.010 2.372 2.199 2.622 . 0 0 "[ . 1 . 2]" 1
1879 1 101 THR HB 1 102 GLU H . . 4.440 3.199 2.850 4.177 . 0 0 "[ . 1 . 2]" 1
1880 1 101 THR HB 1 102 GLU HG2 . . 5.500 4.130 3.099 5.363 . 0 0 "[ . 1 . 2]" 1
1881 1 101 THR HB 1 102 GLU HG3 . . 5.500 4.128 3.055 5.053 . 0 0 "[ . 1 . 2]" 1
1882 1 101 THR MG 1 102 GLU H . . 4.340 3.747 3.491 4.264 . 0 0 "[ . 1 . 2]" 1
1883 1 101 THR MG 1 102 GLU HA . . 5.270 4.140 3.606 5.318 0.048 8 0 "[ . 1 . 2]" 1
1884 1 101 THR MG 1 102 GLU HG2 . . 5.500 4.297 3.571 5.394 . 0 0 "[ . 1 . 2]" 1
1885 1 101 THR MG 1 102 GLU HG3 . . 5.500 4.405 3.715 5.288 . 0 0 "[ . 1 . 2]" 1
1886 1 102 GLU H 1 102 GLU HB2 . . 3.860 2.493 2.361 2.585 . 0 0 "[ . 1 . 2]" 1
1887 1 102 GLU H 1 102 GLU QB . . 3.180 2.452 2.331 2.533 . 0 0 "[ . 1 . 2]" 1
1888 1 102 GLU H 1 102 GLU HB3 . . 3.860 3.637 3.606 3.655 . 0 0 "[ . 1 . 2]" 1
1889 1 102 GLU H 1 102 GLU HG2 . . 3.980 3.264 2.455 4.002 0.022 14 0 "[ . 1 . 2]" 1
1890 1 102 GLU H 1 102 GLU QG . . 3.480 2.493 2.179 3.232 . 0 0 "[ . 1 . 2]" 1
1891 1 102 GLU H 1 102 GLU HG3 . . 3.980 2.909 2.212 3.933 . 0 0 "[ . 1 . 2]" 1
1892 1 102 GLU HA 1 102 GLU QG . . 3.700 2.573 2.326 3.083 . 0 0 "[ . 1 . 2]" 1
1893 1 102 GLU HA 1 103 PRO HD2 . . 3.490 2.351 2.238 2.414 . 0 0 "[ . 1 . 2]" 1
1894 1 102 GLU HA 1 103 PRO HD3 . . 3.460 2.282 2.255 2.303 . 0 0 "[ . 1 . 2]" 1
1895 1 102 GLU QB 1 103 PRO HD2 . . 3.470 2.084 1.986 2.303 . 0 0 "[ . 1 . 2]" 1
1896 1 102 GLU QB 1 103 PRO HD3 . . 3.880 3.433 3.345 3.599 . 0 0 "[ . 1 . 2]" 1
1897 1 102 GLU QB 1 103 PRO HG2 . . 4.210 3.792 3.686 3.985 . 0 0 "[ . 1 . 2]" 1
1898 1 102 GLU QB 1 103 PRO HG3 . . 5.000 4.608 4.519 4.803 . 0 0 "[ . 1 . 2]" 1
1899 1 102 GLU HB2 1 103 PRO HD2 . . 4.200 3.632 3.496 3.768 . 0 0 "[ . 1 . 2]" 1
1900 1 102 GLU HB3 1 103 PRO HD2 . . 4.200 2.097 1.997 2.324 . 0 0 "[ . 1 . 2]" 1
1901 1 102 GLU QG 1 103 PRO HD2 . . 4.290 3.523 3.089 3.909 . 0 0 "[ . 1 . 2]" 1
1902 1 102 GLU HG2 1 103 PRO HD3 . . 5.500 4.593 3.997 5.448 . 0 0 "[ . 1 . 2]" 1
1903 1 102 GLU HG3 1 103 PRO HD3 . . 5.500 5.295 4.273 5.496 . 0 0 "[ . 1 . 2]" 1
1904 1 103 PRO HA 1 104 LEU H . . 3.160 2.493 2.252 2.706 . 0 0 "[ . 1 . 2]" 1
1905 1 103 PRO HA 1 104 LEU HB2 . . 4.640 4.623 4.557 4.653 0.013 11 0 "[ . 1 . 2]" 1
1906 1 103 PRO HA 1 104 LEU HG . . 4.560 3.919 3.748 4.095 . 0 0 "[ . 1 . 2]" 1
1907 1 103 PRO QB 1 104 LEU H . . 3.410 2.354 1.919 2.906 . 0 0 "[ . 1 . 2]" 1
1908 1 103 PRO HB2 1 104 LEU H . . 3.980 2.411 1.935 3.041 . 0 0 "[ . 1 . 2]" 1
1909 1 103 PRO HB3 1 104 LEU H . . 3.980 3.366 3.158 3.689 . 0 0 "[ . 1 . 2]" 1
1910 1 104 LEU H 1 104 LEU HB2 . . 3.360 2.380 2.289 2.481 . 0 0 "[ . 1 . 2]" 1
1911 1 104 LEU H 1 104 LEU HB3 . . 3.800 3.614 3.556 3.683 . 0 0 "[ . 1 . 2]" 1
1912 1 104 LEU H 1 104 LEU MD1 . . 4.270 3.800 3.291 4.042 . 0 0 "[ . 1 . 2]" 1
1913 1 104 LEU H 1 104 LEU MD2 . . 4.200 3.877 3.530 4.209 0.009 20 0 "[ . 1 . 2]" 1
1914 1 104 LEU H 1 104 LEU HG . . 3.310 2.924 2.500 3.190 . 0 0 "[ . 1 . 2]" 1
1915 1 104 LEU H 1 105 LEU H . . 4.550 4.349 4.183 4.485 . 0 0 "[ . 1 . 2]" 1
1916 1 104 LEU HA 1 104 LEU MD1 . . 4.470 3.851 3.777 3.903 . 0 0 "[ . 1 . 2]" 1
1917 1 104 LEU HA 1 104 LEU MD2 . . 3.250 2.074 1.959 2.530 . 0 0 "[ . 1 . 2]" 1
1918 1 104 LEU HA 1 104 LEU HG . . 4.160 2.930 2.762 3.140 . 0 0 "[ . 1 . 2]" 1
1919 1 104 LEU HA 1 105 LEU H . . 2.990 2.144 2.139 2.163 . 0 0 "[ . 1 . 2]" 1
1920 1 104 LEU HB2 1 104 LEU MD1 . . 3.240 2.283 2.156 2.446 . 0 0 "[ . 1 . 2]" 1
1921 1 104 LEU HB2 1 105 LEU H . . 4.600 4.390 4.319 4.477 . 0 0 "[ . 1 . 2]" 1
1922 1 104 LEU HB3 1 104 LEU MD1 . . 3.630 2.416 2.255 2.551 . 0 0 "[ . 1 . 2]" 1
1923 1 104 LEU HB3 1 104 LEU MD2 . . 3.300 2.320 2.046 2.421 . 0 0 "[ . 1 . 2]" 1
1924 1 104 LEU HB3 1 105 LEU H . . 4.140 3.539 3.364 3.741 . 0 0 "[ . 1 . 2]" 1
1925 1 104 LEU MD1 1 105 LEU H . . 5.390 5.222 4.987 5.377 . 0 0 "[ . 1 . 2]" 1
1926 1 104 LEU MD2 1 105 LEU H . . 3.960 3.457 3.222 3.752 . 0 0 "[ . 1 . 2]" 1
1927 1 105 LEU H 1 105 LEU HB2 . . 3.900 2.606 2.373 2.851 . 0 0 "[ . 1 . 2]" 1
1928 1 105 LEU H 1 105 LEU HB3 . . 3.790 2.573 2.408 2.776 . 0 0 "[ . 1 . 2]" 1
1929 1 105 LEU H 1 105 LEU MD1 . . 4.640 4.124 3.808 4.365 . 0 0 "[ . 1 . 2]" 1
1930 1 105 LEU H 1 105 LEU MD2 . . 4.840 4.244 4.119 4.358 . 0 0 "[ . 1 . 2]" 1
1931 1 105 LEU H 1 105 LEU HG . . 4.920 4.493 4.399 4.586 . 0 0 "[ . 1 . 2]" 1
1932 1 105 LEU H 1 106 CYS H . . 4.560 4.388 4.213 4.528 . 0 0 "[ . 1 . 2]" 1
1933 1 105 LEU HA 1 105 LEU MD1 . . 3.370 2.416 2.082 2.608 . 0 0 "[ . 1 . 2]" 1
1934 1 105 LEU HA 1 105 LEU MD2 . . 4.110 3.897 3.841 3.951 . 0 0 "[ . 1 . 2]" 1
1935 1 105 LEU HA 1 105 LEU HG . . 4.110 2.788 2.685 2.893 . 0 0 "[ . 1 . 2]" 1
1936 1 105 LEU HA 1 106 CYS H . . 2.820 2.151 2.139 2.184 . 0 0 "[ . 1 . 2]" 1
1937 1 105 LEU HA 1 106 CYS HB2 . . 5.410 4.369 4.231 4.633 . 0 0 "[ . 1 . 2]" 1
1938 1 105 LEU HB2 1 105 LEU MD1 . . 3.250 2.150 2.026 2.309 . 0 0 "[ . 1 . 2]" 1
1939 1 105 LEU HB2 1 106 CYS H . . 4.700 4.390 4.230 4.584 . 0 0 "[ . 1 . 2]" 1
1940 1 105 LEU HB3 1 105 LEU MD2 . . 3.390 2.142 1.971 2.309 . 0 0 "[ . 1 . 2]" 1
1941 1 105 LEU HB3 1 106 CYS H . . 4.610 4.229 3.950 4.419 . 0 0 "[ . 1 . 2]" 1
1942 1 105 LEU MD1 1 106 CYS H . . 3.980 3.481 3.176 3.758 . 0 0 "[ . 1 . 2]" 1
1943 1 105 LEU MD1 1 107 LYS HB3 . . 4.750 4.480 4.085 4.752 0.002 9 0 "[ . 1 . 2]" 1
1944 1 105 LEU MD2 1 106 CYS H . . 4.960 4.606 4.342 4.962 0.002 9 0 "[ . 1 . 2]" 1
1945 1 105 LEU MD2 1 107 LYS HB3 . . 4.360 4.127 3.952 4.300 . 0 0 "[ . 1 . 2]" 1
1946 1 105 LEU MD2 1 107 LYS QD . . 3.660 2.977 2.256 3.558 . 0 0 "[ . 1 . 2]" 1
1947 1 105 LEU MD2 1 107 LYS QE . . 4.530 3.400 2.913 3.593 . 0 0 "[ . 1 . 2]" 1
1948 1 105 LEU HG 1 106 CYS H . . 3.960 3.136 2.772 3.641 . 0 0 "[ . 1 . 2]" 1
1949 1 106 CYS H 1 106 CYS HB2 . . 3.790 2.466 2.343 2.676 . 0 0 "[ . 1 . 2]" 1
1950 1 106 CYS H 1 106 CYS HG . . 4.620 4.122 3.027 4.927 0.307 14 0 "[ . 1 . 2]" 1
1951 1 106 CYS HA 1 107 LYS H . . 3.000 2.177 2.139 2.220 . 0 0 "[ . 1 . 2]" 1
1952 1 106 CYS HA 1 107 LYS QG . . 5.340 3.803 3.600 4.048 . 0 0 "[ . 1 . 2]" 1
1953 1 106 CYS HB3 1 107 LYS H . . 4.350 3.282 2.947 4.110 . 0 0 "[ . 1 . 2]" 1
1954 1 107 LYS H 1 107 LYS HD2 . . 5.500 5.236 4.427 5.409 . 0 0 "[ . 1 . 2]" 1
1955 1 107 LYS H 1 107 LYS HD3 . . 5.500 4.914 4.345 5.087 . 0 0 "[ . 1 . 2]" 1
1956 1 107 LYS H 1 107 LYS HG2 . . 4.470 2.731 2.108 2.889 . 0 0 "[ . 1 . 2]" 1
1957 1 107 LYS H 1 107 LYS QG . . 3.650 2.608 2.083 2.756 . 0 0 "[ . 1 . 2]" 1
1958 1 107 LYS H 1 107 LYS HG3 . . 4.470 3.334 3.149 3.510 . 0 0 "[ . 1 . 2]" 1
1959 1 107 LYS H 1 108 PHE H . . 4.900 4.212 4.100 4.427 . 0 0 "[ . 1 . 2]" 1
1960 1 107 LYS HA 1 107 LYS HD2 . . 5.500 4.661 4.448 4.721 . 0 0 "[ . 1 . 2]" 1
1961 1 107 LYS HA 1 107 LYS QD . . 4.780 4.256 4.241 4.268 . 0 0 "[ . 1 . 2]" 1
1962 1 107 LYS HA 1 107 LYS HD3 . . 5.500 4.931 4.815 5.358 . 0 0 "[ . 1 . 2]" 1
1963 1 107 LYS HA 1 108 PHE H . . 3.260 2.197 2.155 2.347 . 0 0 "[ . 1 . 2]" 1
1964 1 107 LYS HB2 1 107 LYS QD . . 3.330 2.335 2.260 2.877 . 0 0 "[ . 1 . 2]" 1
1965 1 107 LYS HB2 1 107 LYS HE2 . . 5.500 4.677 4.251 4.780 . 0 0 "[ . 1 . 2]" 1
1966 1 107 LYS HB2 1 107 LYS QE . . 4.630 3.921 3.095 4.072 . 0 0 "[ . 1 . 2]" 1
1967 1 107 LYS HB2 1 107 LYS HE3 . . 5.500 4.219 3.179 4.419 . 0 0 "[ . 1 . 2]" 1
1968 1 107 LYS HB2 1 108 PHE H . . 3.270 3.075 2.567 3.270 0.000 11 0 "[ . 1 . 2]" 1
1969 1 107 LYS QD 1 108 PHE H . . 5.340 4.927 4.601 5.183 . 0 0 "[ . 1 . 2]" 1
1970 1 107 LYS QE 1 107 LYS QG . . 3.250 2.140 2.051 2.215 . 0 0 "[ . 1 . 2]" 1
1971 1 107 LYS QE 1 109 SER HA . . 4.730 4.075 3.371 4.696 . 0 0 "[ . 1 . 2]" 1
1972 1 107 LYS QE 1 109 SER QB . . 5.180 4.872 4.440 5.115 . 0 0 "[ . 1 . 2]" 1
1973 1 108 PHE H 1 108 PHE HB2 . . 3.730 2.287 2.208 2.438 . 0 0 "[ . 1 . 2]" 1
1974 1 108 PHE H 1 108 PHE QB . . 3.110 2.260 2.186 2.401 . 0 0 "[ . 1 . 2]" 1
1975 1 108 PHE H 1 108 PHE HB3 . . 3.730 3.548 3.507 3.598 . 0 0 "[ . 1 . 2]" 1
1976 1 108 PHE H 1 108 PHE QD . . 3.870 3.279 3.084 3.377 . 0 0 "[ . 1 . 2]" 1
1977 1 108 PHE H 1 108 PHE QE . . 5.030 4.886 4.604 5.006 . 0 0 "[ . 1 . 2]" 1
1978 1 108 PHE H 1 109 SER H . . 4.690 4.361 4.190 4.479 . 0 0 "[ . 1 . 2]" 1
1979 1 108 PHE HA 1 108 PHE QD . . 3.980 2.107 1.997 2.511 . 0 0 "[ . 1 . 2]" 1
1980 1 108 PHE HA 1 108 PHE QE . . 4.510 4.190 4.131 4.340 . 0 0 "[ . 1 . 2]" 1
1981 1 108 PHE HA 1 109 SER H . . 3.530 2.163 2.138 2.230 . 0 0 "[ . 1 . 2]" 1
1982 1 108 PHE HA 1 109 SER HA . . 4.500 4.428 4.386 4.507 0.007 15 0 "[ . 1 . 2]" 1
1983 1 108 PHE HA 1 109 SER QB . . 5.340 4.166 4.085 4.606 . 0 0 "[ . 1 . 2]" 1
1984 1 108 PHE QB 1 109 SER H . . 4.280 3.579 3.402 3.768 . 0 0 "[ . 1 . 2]" 1
1985 1 108 PHE QD 1 109 SER H . . 5.270 3.503 3.237 4.044 . 0 0 "[ . 1 . 2]" 1
1986 1 109 SER H 1 109 SER QB . . 3.620 2.328 2.166 2.862 . 0 0 "[ . 1 . 2]" 1
1987 1 110 GLY QA 1 111 PRO HA . . 4.200 4.026 4.018 4.045 . 0 0 "[ . 1 . 2]" 1
1988 1 110 GLY QA 1 111 PRO QB . . 4.870 4.276 4.269 4.278 . 0 0 "[ . 1 . 2]" 1
1989 1 110 GLY QA 1 111 PRO QD . . 2.570 1.952 1.881 2.032 . 0 0 "[ . 1 . 2]" 1
1990 1 110 GLY QA 1 111 PRO QG . . 4.350 3.673 3.650 3.700 . 0 0 "[ . 1 . 2]" 1
1991 1 110 GLY HA2 1 111 PRO HD2 . . 3.350 2.980 2.578 3.213 . 0 0 "[ . 1 . 2]" 1
1992 1 110 GLY HA2 1 111 PRO HD3 . . 3.350 2.710 2.385 2.930 . 0 0 "[ . 1 . 2]" 1
1993 1 110 GLY HA3 1 111 PRO HD2 . . 3.350 2.122 1.962 2.449 . 0 0 "[ . 1 . 2]" 1
1994 1 110 GLY HA3 1 111 PRO HD3 . . 3.350 2.941 2.704 3.337 . 0 0 "[ . 1 . 2]" 1
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