NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
404203 |
1wyl   |
11085 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1wyl
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 2401
_Distance_constraint_stats_list.Viol_count 937
_Distance_constraint_stats_list.Viol_total 161.916
_Distance_constraint_stats_list.Viol_max 0.089
_Distance_constraint_stats_list.Viol_rms 0.0020
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0002
_Distance_constraint_stats_list.Viol_average_violations_only 0.0086
_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 7 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 THR 0.000 0.000 15 0 "[ . 1 . 2]"
1 9 GLN 0.108 0.089 7 0 "[ . 1 . 2]"
1 10 GLU 0.307 0.080 19 0 "[ . 1 . 2]"
1 11 GLU 0.000 0.000 12 0 "[ . 1 . 2]"
1 12 LEU 0.026 0.005 17 0 "[ . 1 . 2]"
1 13 LEU 0.003 0.003 9 0 "[ . 1 . 2]"
1 14 ARG 0.008 0.006 17 0 "[ . 1 . 2]"
1 15 TRP 0.009 0.002 1 0 "[ . 1 . 2]"
1 16 CYS 0.007 0.002 3 0 "[ . 1 . 2]"
1 17 GLN 0.012 0.006 17 0 "[ . 1 . 2]"
1 18 GLU 0.005 0.004 4 0 "[ . 1 . 2]"
1 19 GLN 0.022 0.004 16 0 "[ . 1 . 2]"
1 20 THR 0.071 0.030 12 0 "[ . 1 . 2]"
1 21 ALA 0.098 0.030 12 0 "[ . 1 . 2]"
1 22 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 TYR 0.074 0.010 20 0 "[ . 1 . 2]"
1 24 PRO 0.004 0.004 4 0 "[ . 1 . 2]"
1 25 GLY 0.003 0.001 1 0 "[ . 1 . 2]"
1 26 VAL 0.087 0.018 8 0 "[ . 1 . 2]"
1 27 HIS 0.054 0.018 8 0 "[ . 1 . 2]"
1 28 VAL 0.192 0.038 17 0 "[ . 1 . 2]"
1 29 SER 0.003 0.003 9 0 "[ . 1 . 2]"
1 30 ASP 0.149 0.072 16 0 "[ . 1 . 2]"
1 31 LEU 0.010 0.007 20 0 "[ . 1 . 2]"
1 32 SER 0.225 0.072 16 0 "[ . 1 . 2]"
1 33 SER 0.004 0.004 6 0 "[ . 1 . 2]"
1 34 SER 0.201 0.038 17 0 "[ . 1 . 2]"
1 35 TRP 0.186 0.047 16 0 "[ . 1 . 2]"
1 36 ALA 0.035 0.009 19 0 "[ . 1 . 2]"
1 37 ASP 0.039 0.009 11 0 "[ . 1 . 2]"
1 38 GLY 0.153 0.012 20 0 "[ . 1 . 2]"
1 39 LEU 0.086 0.010 20 0 "[ . 1 . 2]"
1 40 ALA 0.017 0.005 2 0 "[ . 1 . 2]"
1 41 LEU 0.174 0.013 10 0 "[ . 1 . 2]"
1 42 CYS 0.043 0.010 3 0 "[ . 1 . 2]"
1 43 ALA 0.037 0.009 10 0 "[ . 1 . 2]"
1 44 LEU 0.107 0.008 1 0 "[ . 1 . 2]"
1 45 VAL 0.031 0.007 14 0 "[ . 1 . 2]"
1 46 TYR 0.844 0.066 14 0 "[ . 1 . 2]"
1 47 ARG 0.400 0.053 13 0 "[ . 1 . 2]"
1 48 LEU 0.082 0.009 2 0 "[ . 1 . 2]"
1 49 GLN 0.132 0.015 20 0 "[ . 1 . 2]"
1 50 PRO 0.260 0.050 11 0 "[ . 1 . 2]"
1 51 GLY 0.189 0.050 11 0 "[ . 1 . 2]"
1 52 LEU 0.555 0.065 18 0 "[ . 1 . 2]"
1 53 LEU 0.267 0.065 18 0 "[ . 1 . 2]"
1 54 GLU 0.672 0.087 20 0 "[ . 1 . 2]"
1 55 PRO 0.325 0.087 20 0 "[ . 1 . 2]"
1 56 SER 0.001 0.001 1 0 "[ . 1 . 2]"
1 57 GLU 0.358 0.058 8 0 "[ . 1 . 2]"
1 58 LEU 0.756 0.039 3 0 "[ . 1 . 2]"
1 59 GLN 0.159 0.025 9 0 "[ . 1 . 2]"
1 60 GLY 0.008 0.008 7 0 "[ . 1 . 2]"
1 61 LEU 0.295 0.033 9 0 "[ . 1 . 2]"
1 62 GLY 0.023 0.007 8 0 "[ . 1 . 2]"
1 63 ALA 0.652 0.067 16 0 "[ . 1 . 2]"
1 64 LEU 0.648 0.067 16 0 "[ . 1 . 2]"
1 65 GLU 0.190 0.013 17 0 "[ . 1 . 2]"
1 66 ALA 0.066 0.010 20 0 "[ . 1 . 2]"
1 67 THR 0.070 0.010 20 0 "[ . 1 . 2]"
1 68 ALA 0.022 0.008 17 0 "[ . 1 . 2]"
1 69 TRP 1.230 0.042 18 0 "[ . 1 . 2]"
1 70 ALA 0.359 0.023 18 0 "[ . 1 . 2]"
1 71 LEU 0.053 0.008 17 0 "[ . 1 . 2]"
1 72 LYS 0.044 0.010 3 0 "[ . 1 . 2]"
1 73 VAL 0.651 0.039 9 0 "[ . 1 . 2]"
1 74 ALA 0.066 0.009 3 0 "[ . 1 . 2]"
1 75 GLU 0.038 0.013 12 0 "[ . 1 . 2]"
1 76 ASN 0.012 0.008 12 0 "[ . 1 . 2]"
1 77 GLU 0.189 0.030 17 0 "[ . 1 . 2]"
1 78 LEU 0.048 0.027 6 0 "[ . 1 . 2]"
1 79 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 ILE 0.061 0.035 12 0 "[ . 1 . 2]"
1 81 THR 0.152 0.072 15 0 "[ . 1 . 2]"
1 82 PRO 0.135 0.072 15 0 "[ . 1 . 2]"
1 83 VAL 0.029 0.006 6 0 "[ . 1 . 2]"
1 84 VAL 0.152 0.024 19 0 "[ . 1 . 2]"
1 85 SER 0.053 0.012 19 0 "[ . 1 . 2]"
1 86 ALA 0.068 0.012 19 0 "[ . 1 . 2]"
1 87 GLN 0.037 0.006 17 0 "[ . 1 . 2]"
1 88 ALA 0.017 0.008 8 0 "[ . 1 . 2]"
1 89 VAL 0.051 0.016 14 0 "[ . 1 . 2]"
1 90 VAL 0.053 0.016 14 0 "[ . 1 . 2]"
1 91 ALA 0.168 0.040 8 0 "[ . 1 . 2]"
1 92 GLY 0.043 0.009 6 0 "[ . 1 . 2]"
1 93 SER 0.114 0.040 8 0 "[ . 1 . 2]"
1 94 ASP 0.482 0.047 8 0 "[ . 1 . 2]"
1 95 PRO 0.469 0.047 8 0 "[ . 1 . 2]"
1 96 LEU 0.033 0.009 3 0 "[ . 1 . 2]"
1 97 GLY 0.159 0.024 19 0 "[ . 1 . 2]"
1 98 LEU 0.056 0.006 4 0 "[ . 1 . 2]"
1 99 ILE 0.030 0.009 14 0 "[ . 1 . 2]"
1 100 ALA 0.022 0.007 6 0 "[ . 1 . 2]"
1 101 TYR 0.068 0.010 20 0 "[ . 1 . 2]"
1 102 LEU 0.016 0.007 14 0 "[ . 1 . 2]"
1 103 SER 0.004 0.003 6 0 "[ . 1 . 2]"
1 104 HIS 0.015 0.005 12 0 "[ . 1 . 2]"
1 105 PHE 0.019 0.006 17 0 "[ . 1 . 2]"
1 106 HIS 0.036 0.013 2 0 "[ . 1 . 2]"
1 107 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 108 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 109 PHE 0.013 0.006 17 0 "[ . 1 . 2]"
1 110 LYS 0.112 0.022 16 0 "[ . 1 . 2]"
1 111 SER 0.019 0.019 13 0 "[ . 1 . 2]"
1 112 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 113 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 7 GLY QA 1 8 THR MG . . 5.500 4.329 3.445 5.227 . 0 0 "[ . 1 . 2]" 1
2 1 8 THR H 1 8 THR MG . . 4.610 2.927 1.930 4.004 . 0 0 "[ . 1 . 2]" 1
3 1 8 THR HA 1 8 THR MG . . 3.290 2.829 2.077 3.207 . 0 0 "[ . 1 . 2]" 1
4 1 8 THR HB 1 10 GLU H . . 4.120 3.767 2.787 4.120 0.000 15 0 "[ . 1 . 2]" 1
5 1 8 THR MG 1 9 GLN HA . . 5.500 4.289 3.753 4.765 . 0 0 "[ . 1 . 2]" 1
6 1 8 THR MG 1 10 GLU H . . 5.040 2.095 1.746 2.461 . 0 0 "[ . 1 . 2]" 1
7 1 8 THR MG 1 10 GLU HB2 . . 4.820 2.434 1.930 4.039 . 0 0 "[ . 1 . 2]" 1
8 1 8 THR MG 1 10 GLU HB3 . . 4.820 2.387 1.829 3.682 . 0 0 "[ . 1 . 2]" 1
9 1 8 THR MG 1 10 GLU QG . . 4.770 3.713 3.218 4.534 . 0 0 "[ . 1 . 2]" 1
10 1 8 THR MG 1 11 GLU H . . 5.330 3.322 2.264 4.374 . 0 0 "[ . 1 . 2]" 1
11 1 9 GLN H 1 10 GLU H . . 4.760 2.768 2.360 3.174 . 0 0 "[ . 1 . 2]" 1
12 1 9 GLN HA 1 9 GLN HG2 . . 4.080 3.407 2.665 3.703 . 0 0 "[ . 1 . 2]" 1
13 1 9 GLN HA 1 9 GLN QG . . 3.510 2.706 2.221 3.375 . 0 0 "[ . 1 . 2]" 1
14 1 9 GLN HA 1 9 GLN HG3 . . 4.080 3.026 2.246 4.169 0.089 7 0 "[ . 1 . 2]" 1
15 1 9 GLN HA 1 12 LEU H . . 3.470 3.238 3.020 3.424 . 0 0 "[ . 1 . 2]" 1
16 1 9 GLN HA 1 12 LEU HB2 . . 4.000 3.529 2.446 3.982 . 0 0 "[ . 1 . 2]" 1
17 1 9 GLN HA 1 12 LEU HB3 . . 4.000 2.829 2.277 3.291 . 0 0 "[ . 1 . 2]" 1
18 1 9 GLN HA 1 12 LEU MD2 . . 4.050 3.434 2.739 3.888 . 0 0 "[ . 1 . 2]" 1
19 1 9 GLN HA 1 31 LEU QD . . 4.490 4.292 3.918 4.497 0.007 20 0 "[ . 1 . 2]" 1
20 1 9 GLN QB 1 12 LEU H . . 4.440 4.329 3.858 4.445 0.005 10 0 "[ . 1 . 2]" 1
21 1 9 GLN QB 1 12 LEU MD2 . . 4.410 3.180 2.103 3.801 . 0 0 "[ . 1 . 2]" 1
22 1 9 GLN QB 1 31 LEU QD . . 3.440 2.693 2.111 3.298 . 0 0 "[ . 1 . 2]" 1
23 1 9 GLN QB 1 99 ILE MD . . 5.060 4.173 3.371 4.752 . 0 0 "[ . 1 . 2]" 1
24 1 9 GLN QB 1 99 ILE MG . . 4.740 3.145 2.117 4.075 . 0 0 "[ . 1 . 2]" 1
25 1 9 GLN HB2 1 10 GLU H . . 4.630 3.511 2.684 4.528 . 0 0 "[ . 1 . 2]" 1
26 1 9 GLN HB3 1 10 GLU H . . 4.630 4.115 3.607 4.636 0.006 14 0 "[ . 1 . 2]" 1
27 1 9 GLN QE 1 99 ILE MD . . 3.870 2.990 1.932 3.844 . 0 0 "[ . 1 . 2]" 1
28 1 9 GLN QE 1 99 ILE MG . . 4.320 3.053 2.077 4.293 . 0 0 "[ . 1 . 2]" 1
29 1 9 GLN QG 1 31 LEU QD . . 3.790 3.236 2.575 3.784 . 0 0 "[ . 1 . 2]" 1
30 1 9 GLN QG 1 99 ILE MD . . 4.040 3.330 2.784 4.040 0.000 14 0 "[ . 1 . 2]" 1
31 1 9 GLN QG 1 99 ILE MG . . 3.620 2.538 1.794 3.620 0.000 14 0 "[ . 1 . 2]" 1
32 1 9 GLN HG2 1 99 ILE MD . . 4.710 3.725 2.968 4.697 . 0 0 "[ . 1 . 2]" 1
33 1 9 GLN HG2 1 99 ILE MG . . 4.130 2.947 1.827 4.080 . 0 0 "[ . 1 . 2]" 1
34 1 9 GLN HG3 1 99 ILE MD . . 4.710 4.174 2.836 4.707 . 0 0 "[ . 1 . 2]" 1
35 1 9 GLN HG3 1 99 ILE MG . . 4.130 3.078 2.095 4.112 . 0 0 "[ . 1 . 2]" 1
36 1 10 GLU H 1 10 GLU HB2 . . 3.900 2.516 2.177 3.541 . 0 0 "[ . 1 . 2]" 1
37 1 10 GLU H 1 10 GLU QB . . 3.050 2.221 2.126 2.284 . 0 0 "[ . 1 . 2]" 1
38 1 10 GLU H 1 10 GLU HB3 . . 3.900 2.614 2.265 2.975 . 0 0 "[ . 1 . 2]" 1
39 1 10 GLU H 1 10 GLU QG . . 3.970 3.886 2.668 4.050 0.080 19 0 "[ . 1 . 2]" 1
40 1 10 GLU H 1 11 GLU H . . 3.460 2.865 2.527 3.192 . 0 0 "[ . 1 . 2]" 1
41 1 10 GLU HA 1 10 GLU QG . . 3.490 2.599 2.210 3.311 . 0 0 "[ . 1 . 2]" 1
42 1 10 GLU HA 1 13 LEU QB . . 3.890 2.786 2.334 3.372 . 0 0 "[ . 1 . 2]" 1
43 1 10 GLU HA 1 13 LEU MD2 . . 3.700 3.305 2.912 3.641 . 0 0 "[ . 1 . 2]" 1
44 1 10 GLU HA 1 14 ARG H . . 4.450 3.944 3.505 4.449 . 0 0 "[ . 1 . 2]" 1
45 1 10 GLU QB 1 11 GLU H . . 3.310 2.425 2.137 3.290 . 0 0 "[ . 1 . 2]" 1
46 1 10 GLU HB2 1 11 GLU H . . 4.070 3.723 3.482 3.988 . 0 0 "[ . 1 . 2]" 1
47 1 10 GLU HB3 1 11 GLU H . . 4.070 2.470 2.157 3.627 . 0 0 "[ . 1 . 2]" 1
48 1 10 GLU QG 1 11 GLU H . . 4.920 3.475 1.829 4.161 . 0 0 "[ . 1 . 2]" 1
49 1 10 GLU QG 1 13 LEU MD2 . . 4.750 4.169 3.059 4.750 0.000 18 0 "[ . 1 . 2]" 1
50 1 10 GLU QG 1 14 ARG H . . 5.500 4.263 3.687 5.276 . 0 0 "[ . 1 . 2]" 1
51 1 11 GLU H 1 11 GLU QB . . 3.440 2.283 2.123 2.569 . 0 0 "[ . 1 . 2]" 1
52 1 11 GLU H 1 11 GLU QG . . 4.270 3.348 2.280 4.050 . 0 0 "[ . 1 . 2]" 1
53 1 11 GLU HA 1 11 GLU HG2 . . 4.250 3.259 2.185 3.889 . 0 0 "[ . 1 . 2]" 1
54 1 11 GLU HA 1 11 GLU QG . . 3.690 2.809 2.164 3.449 . 0 0 "[ . 1 . 2]" 1
55 1 11 GLU HA 1 11 GLU HG3 . . 4.250 3.264 2.391 4.234 . 0 0 "[ . 1 . 2]" 1
56 1 11 GLU HA 1 13 LEU H . . 5.140 4.767 4.278 5.130 . 0 0 "[ . 1 . 2]" 1
57 1 11 GLU HA 1 14 ARG QB . . 3.480 3.140 2.685 3.461 . 0 0 "[ . 1 . 2]" 1
58 1 11 GLU HA 1 14 ARG QD . . 4.710 4.094 3.064 4.710 . 0 0 "[ . 1 . 2]" 1
59 1 11 GLU HA 1 15 TRP H . . 4.660 4.032 3.492 4.543 . 0 0 "[ . 1 . 2]" 1
60 1 11 GLU HA 1 106 HIS HE1 . . 5.500 5.376 4.702 5.500 0.000 12 0 "[ . 1 . 2]" 1
61 1 11 GLU QB 1 106 HIS HE1 . . 4.520 3.542 2.201 4.262 . 0 0 "[ . 1 . 2]" 1
62 1 11 GLU QG 1 106 HIS HE1 . . 4.320 3.156 2.096 4.105 . 0 0 "[ . 1 . 2]" 1
63 1 11 GLU HG2 1 12 LEU H . . 5.500 3.962 1.987 5.064 . 0 0 "[ . 1 . 2]" 1
64 1 11 GLU HG2 1 106 HIS HE1 . . 5.140 3.795 2.299 5.139 . 0 0 "[ . 1 . 2]" 1
65 1 11 GLU HG3 1 12 LEU H . . 5.500 4.294 2.133 5.214 . 0 0 "[ . 1 . 2]" 1
66 1 11 GLU HG3 1 106 HIS HE1 . . 5.140 3.743 2.416 4.805 . 0 0 "[ . 1 . 2]" 1
67 1 12 LEU H 1 12 LEU HB2 . . 3.160 2.672 2.365 2.877 . 0 0 "[ . 1 . 2]" 1
68 1 12 LEU H 1 12 LEU HB3 . . 3.160 2.392 2.242 2.648 . 0 0 "[ . 1 . 2]" 1
69 1 12 LEU H 1 12 LEU MD1 . . 4.320 4.178 3.910 4.325 0.005 17 0 "[ . 1 . 2]" 1
70 1 12 LEU H 1 12 LEU MD2 . . 4.370 4.165 4.052 4.249 . 0 0 "[ . 1 . 2]" 1
71 1 12 LEU H 1 12 LEU HG . . 5.000 4.393 4.250 4.558 . 0 0 "[ . 1 . 2]" 1
72 1 12 LEU H 1 13 LEU H . . 3.310 2.664 2.288 2.879 . 0 0 "[ . 1 . 2]" 1
73 1 12 LEU H 1 31 LEU QD . . 5.130 4.856 4.226 5.132 0.002 16 0 "[ . 1 . 2]" 1
74 1 12 LEU HA 1 12 LEU MD1 . . 3.110 2.232 1.974 2.548 . 0 0 "[ . 1 . 2]" 1
75 1 12 LEU HA 1 12 LEU MD2 . . 4.510 3.936 3.812 4.012 . 0 0 "[ . 1 . 2]" 1
76 1 12 LEU HA 1 15 TRP H . . 4.020 3.813 3.580 4.009 . 0 0 "[ . 1 . 2]" 1
77 1 12 LEU HA 1 15 TRP QB . . 3.810 2.737 2.569 2.944 . 0 0 "[ . 1 . 2]" 1
78 1 12 LEU HA 1 16 CYS HG . . 4.950 3.759 3.154 4.284 . 0 0 "[ . 1 . 2]" 1
79 1 12 LEU HA 1 106 HIS HB3 . . 4.850 4.371 3.881 4.850 . 0 0 "[ . 1 . 2]" 1
80 1 12 LEU HA 1 106 HIS HE1 . . 4.860 4.390 3.730 4.864 0.004 20 0 "[ . 1 . 2]" 1
81 1 12 LEU QB 1 13 LEU H . . 3.320 2.400 2.148 2.689 . 0 0 "[ . 1 . 2]" 1
82 1 12 LEU QB 1 31 LEU QD . . 4.490 3.257 2.767 3.600 . 0 0 "[ . 1 . 2]" 1
83 1 12 LEU HB2 1 13 LEU H . . 4.030 3.822 3.588 4.030 . 0 0 "[ . 1 . 2]" 1
84 1 12 LEU HB3 1 13 LEU H . . 4.030 2.426 2.164 2.730 . 0 0 "[ . 1 . 2]" 1
85 1 12 LEU MD1 1 13 LEU H . . 4.570 4.374 4.151 4.521 . 0 0 "[ . 1 . 2]" 1
86 1 12 LEU MD1 1 15 TRP H . . 5.390 5.057 4.687 5.337 . 0 0 "[ . 1 . 2]" 1
87 1 12 LEU MD1 1 15 TRP QB . . 4.240 3.436 3.130 3.770 . 0 0 "[ . 1 . 2]" 1
88 1 12 LEU MD1 1 15 TRP HE3 . . 3.700 2.622 2.177 3.168 . 0 0 "[ . 1 . 2]" 1
89 1 12 LEU MD1 1 15 TRP HZ3 . . 4.500 3.333 2.839 4.125 . 0 0 "[ . 1 . 2]" 1
90 1 12 LEU MD1 1 16 CYS H . . 4.520 4.134 3.876 4.467 . 0 0 "[ . 1 . 2]" 1
91 1 12 LEU MD1 1 16 CYS HA . . 5.450 4.956 4.754 5.389 . 0 0 "[ . 1 . 2]" 1
92 1 12 LEU MD1 1 16 CYS HG . . 3.560 2.377 2.069 2.920 . 0 0 "[ . 1 . 2]" 1
93 1 12 LEU MD1 1 102 LEU H . . 5.020 4.795 4.303 5.024 0.004 9 0 "[ . 1 . 2]" 1
94 1 12 LEU MD1 1 102 LEU HB2 . . 3.990 2.877 2.305 3.272 . 0 0 "[ . 1 . 2]" 1
95 1 12 LEU MD1 1 102 LEU HB3 . . 3.400 2.387 2.106 2.995 . 0 0 "[ . 1 . 2]" 1
96 1 12 LEU MD1 1 103 SER H . . 4.660 3.340 2.570 3.777 . 0 0 "[ . 1 . 2]" 1
97 1 12 LEU MD1 1 103 SER HA . . 3.380 2.185 1.978 2.489 . 0 0 "[ . 1 . 2]" 1
98 1 12 LEU MD1 1 103 SER QB . . 4.640 3.666 3.168 4.077 . 0 0 "[ . 1 . 2]" 1
99 1 12 LEU MD1 1 106 HIS H . . 4.030 3.286 2.933 3.871 . 0 0 "[ . 1 . 2]" 1
100 1 12 LEU MD1 1 106 HIS HA . . 4.900 4.342 4.033 4.901 0.001 6 0 "[ . 1 . 2]" 1
101 1 12 LEU MD1 1 106 HIS HB2 . . 3.570 2.318 1.946 2.829 . 0 0 "[ . 1 . 2]" 1
102 1 12 LEU MD1 1 106 HIS HB3 . . 3.310 2.599 2.188 3.065 . 0 0 "[ . 1 . 2]" 1
103 1 12 LEU MD1 1 107 SER H . . 4.830 4.086 3.768 4.484 . 0 0 "[ . 1 . 2]" 1
104 1 12 LEU MD2 1 13 LEU H . . 4.600 3.919 3.443 4.388 . 0 0 "[ . 1 . 2]" 1
105 1 12 LEU MD2 1 16 CYS HG . . 4.940 3.700 3.360 4.217 . 0 0 "[ . 1 . 2]" 1
106 1 12 LEU MD2 1 99 ILE HA . . 4.370 3.169 2.963 3.494 . 0 0 "[ . 1 . 2]" 1
107 1 12 LEU MD2 1 102 LEU MD1 . . 4.320 2.561 2.045 3.117 . 0 0 "[ . 1 . 2]" 1
108 1 12 LEU MD2 1 103 SER H . . 3.770 2.794 2.255 3.276 . 0 0 "[ . 1 . 2]" 1
109 1 12 LEU MD2 1 103 SER HA . . 4.130 2.934 2.336 3.512 . 0 0 "[ . 1 . 2]" 1
110 1 12 LEU MD2 1 103 SER HB2 . . 4.850 3.443 2.756 4.214 . 0 0 "[ . 1 . 2]" 1
111 1 12 LEU MD2 1 103 SER QB . . 4.010 3.166 2.713 3.833 . 0 0 "[ . 1 . 2]" 1
112 1 12 LEU MD2 1 103 SER HB3 . . 4.850 4.124 2.945 4.848 . 0 0 "[ . 1 . 2]" 1
113 1 12 LEU HG 1 13 LEU H . . 5.040 3.414 3.121 3.800 . 0 0 "[ . 1 . 2]" 1
114 1 12 LEU HG 1 16 CYS H . . 4.810 4.470 3.985 4.777 . 0 0 "[ . 1 . 2]" 1
115 1 12 LEU HG 1 16 CYS HG . . 4.330 2.245 2.006 2.774 . 0 0 "[ . 1 . 2]" 1
116 1 12 LEU HG 1 31 LEU QD . . 4.710 2.881 2.454 3.297 . 0 0 "[ . 1 . 2]" 1
117 1 12 LEU HG 1 102 LEU HB3 . . 5.220 3.617 3.090 3.973 . 0 0 "[ . 1 . 2]" 1
118 1 13 LEU H 1 13 LEU HB2 . . 3.120 2.687 2.475 2.872 . 0 0 "[ . 1 . 2]" 1
119 1 13 LEU H 1 13 LEU HB3 . . 3.120 2.344 2.207 2.575 . 0 0 "[ . 1 . 2]" 1
120 1 13 LEU H 1 13 LEU MD1 . . 4.370 4.199 4.039 4.302 . 0 0 "[ . 1 . 2]" 1
121 1 13 LEU H 1 13 LEU MD2 . . 5.050 4.138 4.017 4.219 . 0 0 "[ . 1 . 2]" 1
122 1 13 LEU H 1 13 LEU HG . . 4.890 4.362 4.215 4.511 . 0 0 "[ . 1 . 2]" 1
123 1 13 LEU H 1 14 ARG H . . 3.320 2.967 2.633 3.197 . 0 0 "[ . 1 . 2]" 1
124 1 13 LEU H 1 31 LEU MD1 . . 4.450 3.505 2.869 3.902 . 0 0 "[ . 1 . 2]" 1
125 1 13 LEU H 1 31 LEU QD . . 3.880 3.269 2.831 3.526 . 0 0 "[ . 1 . 2]" 1
126 1 13 LEU H 1 31 LEU MD2 . . 4.450 3.989 3.480 4.327 . 0 0 "[ . 1 . 2]" 1
127 1 13 LEU HA 1 13 LEU MD1 . . 3.120 2.319 2.111 2.624 . 0 0 "[ . 1 . 2]" 1
128 1 13 LEU HA 1 16 CYS H . . 4.060 3.618 3.392 3.784 . 0 0 "[ . 1 . 2]" 1
129 1 13 LEU HA 1 16 CYS HB2 . . 4.020 2.797 2.572 2.956 . 0 0 "[ . 1 . 2]" 1
130 1 13 LEU HA 1 16 CYS HB3 . . 4.600 4.399 4.168 4.589 . 0 0 "[ . 1 . 2]" 1
131 1 13 LEU HA 1 16 CYS HG . . 4.450 3.375 2.712 3.798 . 0 0 "[ . 1 . 2]" 1
132 1 13 LEU HA 1 17 GLN H . . 4.390 4.151 4.010 4.336 . 0 0 "[ . 1 . 2]" 1
133 1 13 LEU HA 1 28 VAL MG1 . . 4.690 3.880 3.410 4.186 . 0 0 "[ . 1 . 2]" 1
134 1 13 LEU HA 1 31 LEU QD . . 3.310 2.428 2.020 2.943 . 0 0 "[ . 1 . 2]" 1
135 1 13 LEU QB 1 13 LEU MD2 . . 3.070 2.043 1.931 2.089 . 0 0 "[ . 1 . 2]" 1
136 1 13 LEU QB 1 14 ARG H . . 3.650 2.317 2.058 2.608 . 0 0 "[ . 1 . 2]" 1
137 1 13 LEU QB 1 31 LEU QD . . 3.580 2.091 1.817 2.481 . 0 0 "[ . 1 . 2]" 1
138 1 13 LEU HB2 1 13 LEU MD2 . . 3.640 2.480 2.368 2.693 . 0 0 "[ . 1 . 2]" 1
139 1 13 LEU HB3 1 13 LEU MD2 . . 3.640 2.185 1.979 2.287 . 0 0 "[ . 1 . 2]" 1
140 1 13 LEU MD1 1 14 ARG H . . 4.570 4.145 3.865 4.523 . 0 0 "[ . 1 . 2]" 1
141 1 13 LEU MD1 1 14 ARG HA . . 4.840 4.307 4.081 4.745 . 0 0 "[ . 1 . 2]" 1
142 1 13 LEU MD1 1 16 CYS HB2 . . 4.550 3.561 3.326 3.798 . 0 0 "[ . 1 . 2]" 1
143 1 13 LEU MD1 1 16 CYS HB3 . . 4.930 4.606 4.370 4.802 . 0 0 "[ . 1 . 2]" 1
144 1 13 LEU MD1 1 16 CYS HG . . 5.500 4.946 4.418 5.422 . 0 0 "[ . 1 . 2]" 1
145 1 13 LEU MD1 1 17 GLN H . . 4.350 4.004 3.633 4.309 . 0 0 "[ . 1 . 2]" 1
146 1 13 LEU MD1 1 17 GLN HE21 . . 4.090 2.507 1.891 3.049 . 0 0 "[ . 1 . 2]" 1
147 1 13 LEU MD1 1 17 GLN HE22 . . 4.510 3.408 2.914 3.699 . 0 0 "[ . 1 . 2]" 1
148 1 13 LEU MD1 1 17 GLN HG2 . . 3.750 3.337 2.876 3.603 . 0 0 "[ . 1 . 2]" 1
149 1 13 LEU MD1 1 17 GLN HG3 . . 4.130 2.546 2.130 2.865 . 0 0 "[ . 1 . 2]" 1
150 1 13 LEU MD1 1 28 VAL HA . . 5.200 4.672 4.358 4.995 . 0 0 "[ . 1 . 2]" 1
151 1 13 LEU MD1 1 28 VAL HB . . 4.970 3.994 3.552 4.642 . 0 0 "[ . 1 . 2]" 1
152 1 13 LEU MD1 1 28 VAL MG2 . . 5.050 4.383 3.946 4.755 . 0 0 "[ . 1 . 2]" 1
153 1 13 LEU MD1 1 29 SER H . . 4.880 4.517 4.036 4.883 0.003 9 0 "[ . 1 . 2]" 1
154 1 13 LEU MD1 1 29 SER HA . . 4.480 3.668 3.108 4.302 . 0 0 "[ . 1 . 2]" 1
155 1 13 LEU MD1 1 30 ASP H . . 3.930 3.546 3.190 3.889 . 0 0 "[ . 1 . 2]" 1
156 1 13 LEU MD1 1 30 ASP HA . . 3.750 2.390 2.032 2.955 . 0 0 "[ . 1 . 2]" 1
157 1 13 LEU MD1 1 30 ASP QB . . 5.340 4.059 3.520 4.635 . 0 0 "[ . 1 . 2]" 1
158 1 13 LEU MD1 1 31 LEU QD . . 3.620 2.002 1.728 2.647 . 0 0 "[ . 1 . 2]" 1
159 1 13 LEU MD1 1 35 TRP HE1 . . 4.720 3.280 3.048 3.593 . 0 0 "[ . 1 . 2]" 1
160 1 13 LEU MD2 1 14 ARG H . . 4.310 3.573 3.205 3.956 . 0 0 "[ . 1 . 2]" 1
161 1 13 LEU MD2 1 17 GLN HE21 . . 4.960 3.545 3.022 4.190 . 0 0 "[ . 1 . 2]" 1
162 1 13 LEU MD2 1 17 GLN HE22 . . 4.620 3.233 2.605 3.997 . 0 0 "[ . 1 . 2]" 1
163 1 13 LEU MD2 1 17 GLN HG3 . . 5.170 4.213 3.870 4.480 . 0 0 "[ . 1 . 2]" 1
164 1 13 LEU MD2 1 30 ASP HA . . 4.070 3.021 2.461 3.772 . 0 0 "[ . 1 . 2]" 1
165 1 13 LEU HG 1 14 ARG HA . . 4.220 3.114 2.894 3.341 . 0 0 "[ . 1 . 2]" 1
166 1 13 LEU HG 1 17 GLN H . . 4.950 4.382 4.056 4.656 . 0 0 "[ . 1 . 2]" 1
167 1 13 LEU HG 1 17 GLN HB2 . . 5.060 4.390 4.128 4.832 . 0 0 "[ . 1 . 2]" 1
168 1 13 LEU HG 1 17 GLN HE22 . . 4.870 3.690 3.135 4.418 . 0 0 "[ . 1 . 2]" 1
169 1 13 LEU HG 1 17 GLN HG2 . . 4.660 4.295 3.833 4.603 . 0 0 "[ . 1 . 2]" 1
170 1 14 ARG H 1 14 ARG QB . . 2.760 2.399 2.207 2.609 . 0 0 "[ . 1 . 2]" 1
171 1 14 ARG H 1 14 ARG QD . . 4.330 3.918 3.234 4.325 . 0 0 "[ . 1 . 2]" 1
172 1 14 ARG H 1 14 ARG HG2 . . 4.120 3.200 1.897 3.951 . 0 0 "[ . 1 . 2]" 1
173 1 14 ARG H 1 14 ARG QG . . 3.470 2.339 1.887 2.736 . 0 0 "[ . 1 . 2]" 1
174 1 14 ARG H 1 14 ARG HG3 . . 4.120 2.644 1.994 3.358 . 0 0 "[ . 1 . 2]" 1
175 1 14 ARG H 1 15 TRP H . . 3.440 2.928 2.783 3.058 . 0 0 "[ . 1 . 2]" 1
176 1 14 ARG H 1 16 CYS H . . 4.730 4.305 4.100 4.478 . 0 0 "[ . 1 . 2]" 1
177 1 14 ARG H 1 17 GLN HG3 . . 5.500 4.733 4.232 4.950 . 0 0 "[ . 1 . 2]" 1
178 1 14 ARG HA 1 14 ARG QD . . 4.210 3.786 2.183 4.166 . 0 0 "[ . 1 . 2]" 1
179 1 14 ARG HA 1 14 ARG HG2 . . 4.030 2.525 2.221 3.015 . 0 0 "[ . 1 . 2]" 1
180 1 14 ARG HA 1 14 ARG QG . . 3.390 2.403 2.172 2.910 . 0 0 "[ . 1 . 2]" 1
181 1 14 ARG HA 1 14 ARG HG3 . . 4.030 3.147 2.476 3.844 . 0 0 "[ . 1 . 2]" 1
182 1 14 ARG HA 1 17 GLN H . . 3.800 3.451 3.249 3.626 . 0 0 "[ . 1 . 2]" 1
183 1 14 ARG HA 1 17 GLN HB2 . . 3.490 2.605 2.317 2.737 . 0 0 "[ . 1 . 2]" 1
184 1 14 ARG HA 1 17 GLN HB3 . . 4.300 4.144 3.881 4.274 . 0 0 "[ . 1 . 2]" 1
185 1 14 ARG HA 1 17 GLN HG2 . . 4.740 4.627 4.210 4.746 0.006 17 0 "[ . 1 . 2]" 1
186 1 14 ARG HA 1 17 GLN HG3 . . 4.490 3.311 2.896 3.573 . 0 0 "[ . 1 . 2]" 1
187 1 14 ARG HA 1 18 GLU H . . 4.920 4.387 4.197 4.742 . 0 0 "[ . 1 . 2]" 1
188 1 14 ARG QB 1 14 ARG QD . . 3.440 2.237 2.039 2.608 . 0 0 "[ . 1 . 2]" 1
189 1 14 ARG QB 1 15 TRP H . . 3.250 2.393 2.238 2.579 . 0 0 "[ . 1 . 2]" 1
190 1 14 ARG QB 1 15 TRP HA . . 4.020 3.787 3.727 3.838 . 0 0 "[ . 1 . 2]" 1
191 1 14 ARG QB 1 15 TRP QB . . 4.960 3.856 3.768 3.942 . 0 0 "[ . 1 . 2]" 1
192 1 14 ARG QB 1 16 CYS H . . 4.890 4.631 4.450 4.815 . 0 0 "[ . 1 . 2]" 1
193 1 14 ARG QG 1 15 TRP H . . 4.630 4.078 3.775 4.328 . 0 0 "[ . 1 . 2]" 1
194 1 15 TRP H 1 15 TRP QB . . 2.870 2.253 2.227 2.262 . 0 0 "[ . 1 . 2]" 1
195 1 15 TRP H 1 15 TRP HD1 . . 5.130 4.953 4.866 5.084 . 0 0 "[ . 1 . 2]" 1
196 1 15 TRP H 1 16 CYS H . . 3.340 2.822 2.681 2.932 . 0 0 "[ . 1 . 2]" 1
197 1 15 TRP H 1 16 CYS HB2 . . 5.160 4.898 4.684 5.013 . 0 0 "[ . 1 . 2]" 1
198 1 15 TRP H 1 17 GLN H . . 4.830 4.207 3.982 4.492 . 0 0 "[ . 1 . 2]" 1
199 1 15 TRP HA 1 15 TRP HD1 . . 3.930 2.988 2.840 3.168 . 0 0 "[ . 1 . 2]" 1
200 1 15 TRP HA 1 15 TRP HE1 . . 5.250 5.053 4.970 5.106 . 0 0 "[ . 1 . 2]" 1
201 1 15 TRP HA 1 18 GLU H . . 4.040 3.725 3.494 3.963 . 0 0 "[ . 1 . 2]" 1
202 1 15 TRP HA 1 18 GLU HB2 . . 3.870 3.263 2.946 3.508 . 0 0 "[ . 1 . 2]" 1
203 1 15 TRP HA 1 18 GLU HB3 . . 5.330 4.870 4.554 5.121 . 0 0 "[ . 1 . 2]" 1
204 1 15 TRP HA 1 18 GLU QG . . 4.220 3.517 3.125 4.004 . 0 0 "[ . 1 . 2]" 1
205 1 15 TRP HA 1 19 GLN H . . 4.910 4.583 4.353 4.908 . 0 0 "[ . 1 . 2]" 1
206 1 15 TRP HA 1 19 GLN HE21 . . 5.110 4.133 3.778 4.430 . 0 0 "[ . 1 . 2]" 1
207 1 15 TRP QB 1 15 TRP HE1 . . 4.920 4.464 4.443 4.480 . 0 0 "[ . 1 . 2]" 1
208 1 15 TRP QB 1 15 TRP HE3 . . 3.660 2.453 2.411 2.524 . 0 0 "[ . 1 . 2]" 1
209 1 15 TRP QB 1 15 TRP HZ3 . . 4.850 4.717 4.683 4.772 . 0 0 "[ . 1 . 2]" 1
210 1 15 TRP QB 1 16 CYS H . . 3.300 2.517 2.393 2.642 . 0 0 "[ . 1 . 2]" 1
211 1 15 TRP QB 1 16 CYS HG . . 4.830 3.864 3.389 4.284 . 0 0 "[ . 1 . 2]" 1
212 1 15 TRP QB 1 17 GLN H . . 5.000 4.727 4.582 4.959 . 0 0 "[ . 1 . 2]" 1
213 1 15 TRP QB 1 106 HIS HD2 . . 4.590 3.720 3.199 4.480 . 0 0 "[ . 1 . 2]" 1
214 1 15 TRP HD1 1 19 GLN HE21 . . 4.660 3.654 2.555 4.166 . 0 0 "[ . 1 . 2]" 1
215 1 15 TRP HD1 1 19 GLN HE22 . . 5.440 4.827 3.846 5.413 . 0 0 "[ . 1 . 2]" 1
216 1 15 TRP HD1 1 19 GLN HG2 . . 5.450 4.679 3.890 5.241 . 0 0 "[ . 1 . 2]" 1
217 1 15 TRP HD1 1 106 HIS HD2 . . 4.750 3.666 3.319 4.014 . 0 0 "[ . 1 . 2]" 1
218 1 15 TRP HE1 1 19 GLN HE21 . . 4.240 3.397 2.328 3.934 . 0 0 "[ . 1 . 2]" 1
219 1 15 TRP HE1 1 19 GLN HE22 . . 4.670 4.089 2.987 4.547 . 0 0 "[ . 1 . 2]" 1
220 1 15 TRP HE1 1 19 GLN HG2 . . 4.910 4.329 3.607 4.911 0.001 12 0 "[ . 1 . 2]" 1
221 1 15 TRP HE1 1 19 GLN HG3 . . 5.190 4.334 3.310 4.882 . 0 0 "[ . 1 . 2]" 1
222 1 15 TRP HE1 1 106 HIS HA . . 5.130 4.562 4.121 5.049 . 0 0 "[ . 1 . 2]" 1
223 1 15 TRP HE1 1 106 HIS HD2 . . 4.520 3.107 2.576 3.643 . 0 0 "[ . 1 . 2]" 1
224 1 15 TRP HE1 1 109 PHE QB . . 4.970 3.849 3.649 4.210 . 0 0 "[ . 1 . 2]" 1
225 1 15 TRP HE1 1 110 LYS HA . . 4.000 3.501 3.071 3.960 . 0 0 "[ . 1 . 2]" 1
226 1 15 TRP HE1 1 110 LYS QB . . 5.340 5.054 4.625 5.341 0.001 15 0 "[ . 1 . 2]" 1
227 1 15 TRP HE3 1 16 CYS H . . 3.860 3.022 2.728 3.223 . 0 0 "[ . 1 . 2]" 1
228 1 15 TRP HE3 1 16 CYS HA . . 4.090 3.228 2.681 3.578 . 0 0 "[ . 1 . 2]" 1
229 1 15 TRP HE3 1 16 CYS HG . . 4.060 2.798 2.350 3.213 . 0 0 "[ . 1 . 2]" 1
230 1 15 TRP HE3 1 44 LEU MD1 . . 4.720 3.937 3.642 4.271 . 0 0 "[ . 1 . 2]" 1
231 1 15 TRP HE3 1 44 LEU MD2 . . 5.240 4.844 4.489 5.084 . 0 0 "[ . 1 . 2]" 1
232 1 15 TRP HE3 1 105 PHE HB3 . . 5.500 5.298 4.954 5.460 . 0 0 "[ . 1 . 2]" 1
233 1 15 TRP HE3 1 106 HIS HB2 . . 3.990 2.662 2.346 2.921 . 0 0 "[ . 1 . 2]" 1
234 1 15 TRP HE3 1 106 HIS HB3 . . 4.590 4.350 4.031 4.592 0.002 1 0 "[ . 1 . 2]" 1
235 1 15 TRP HE3 1 106 HIS HD2 . . 5.430 4.166 3.647 4.940 . 0 0 "[ . 1 . 2]" 1
236 1 15 TRP HH2 1 44 LEU MD1 . . 3.860 2.704 2.190 3.098 . 0 0 "[ . 1 . 2]" 1
237 1 15 TRP HH2 1 44 LEU MD2 . . 4.740 3.935 3.542 4.280 . 0 0 "[ . 1 . 2]" 1
238 1 15 TRP HH2 1 48 LEU MD1 . . 3.770 2.789 2.388 3.165 . 0 0 "[ . 1 . 2]" 1
239 1 15 TRP HH2 1 48 LEU MD2 . . 4.040 2.935 2.555 3.240 . 0 0 "[ . 1 . 2]" 1
240 1 15 TRP HH2 1 105 PHE HB2 . . 3.840 3.590 3.264 3.809 . 0 0 "[ . 1 . 2]" 1
241 1 15 TRP HH2 1 105 PHE HB3 . . 4.200 2.318 2.067 2.538 . 0 0 "[ . 1 . 2]" 1
242 1 15 TRP HH2 1 105 PHE QD . . 4.360 3.835 3.496 4.094 . 0 0 "[ . 1 . 2]" 1
243 1 15 TRP HH2 1 106 HIS H . . 5.160 3.742 3.480 4.157 . 0 0 "[ . 1 . 2]" 1
244 1 15 TRP HH2 1 106 HIS HA . . 4.400 2.915 2.628 3.277 . 0 0 "[ . 1 . 2]" 1
245 1 15 TRP HH2 1 108 ALA MB . . 5.500 5.381 5.058 5.496 . 0 0 "[ . 1 . 2]" 1
246 1 15 TRP HH2 1 109 PHE H . . 4.960 4.262 3.962 4.546 . 0 0 "[ . 1 . 2]" 1
247 1 15 TRP HH2 1 109 PHE HB2 . . 4.760 2.646 2.337 2.998 . 0 0 "[ . 1 . 2]" 1
248 1 15 TRP HH2 1 109 PHE QB . . 4.050 2.601 2.309 2.940 . 0 0 "[ . 1 . 2]" 1
249 1 15 TRP HH2 1 109 PHE HB3 . . 4.760 3.849 3.595 4.236 . 0 0 "[ . 1 . 2]" 1
250 1 15 TRP HH2 1 109 PHE QD . . 4.830 3.857 3.158 4.259 . 0 0 "[ . 1 . 2]" 1
251 1 15 TRP HZ2 1 19 GLN HG3 . . 4.420 3.546 2.887 4.041 . 0 0 "[ . 1 . 2]" 1
252 1 15 TRP HZ2 1 48 LEU MD2 . . 3.720 2.699 2.109 3.362 . 0 0 "[ . 1 . 2]" 1
253 1 15 TRP HZ2 1 106 HIS HA . . 4.640 3.177 2.668 3.661 . 0 0 "[ . 1 . 2]" 1
254 1 15 TRP HZ2 1 109 PHE H . . 4.460 4.220 3.976 4.462 0.002 1 0 "[ . 1 . 2]" 1
255 1 15 TRP HZ2 1 109 PHE HB2 . . 3.990 2.214 2.026 2.451 . 0 0 "[ . 1 . 2]" 1
256 1 15 TRP HZ2 1 109 PHE QB . . 3.460 1.977 1.859 2.167 . 0 0 "[ . 1 . 2]" 1
257 1 15 TRP HZ2 1 109 PHE HB3 . . 3.990 2.241 2.007 2.439 . 0 0 "[ . 1 . 2]" 1
258 1 15 TRP HZ2 1 109 PHE QD . . 4.880 3.967 3.784 4.239 . 0 0 "[ . 1 . 2]" 1
259 1 15 TRP HZ2 1 110 LYS HA . . 5.130 4.464 4.186 4.892 . 0 0 "[ . 1 . 2]" 1
260 1 15 TRP HZ3 1 16 CYS H . . 5.380 5.162 4.878 5.316 . 0 0 "[ . 1 . 2]" 1
261 1 15 TRP HZ3 1 16 CYS HA . . 4.760 4.084 3.472 4.488 . 0 0 "[ . 1 . 2]" 1
262 1 15 TRP HZ3 1 16 CYS HG . . 4.770 4.019 3.332 4.536 . 0 0 "[ . 1 . 2]" 1
263 1 15 TRP HZ3 1 19 GLN HG2 . . 5.500 5.195 4.566 5.502 0.002 19 0 "[ . 1 . 2]" 1
264 1 15 TRP HZ3 1 44 LEU MD1 . . 4.210 2.702 2.151 3.264 . 0 0 "[ . 1 . 2]" 1
265 1 15 TRP HZ3 1 44 LEU MD2 . . 4.430 3.230 2.918 3.520 . 0 0 "[ . 1 . 2]" 1
266 1 15 TRP HZ3 1 44 LEU HG . . 5.500 4.975 4.587 5.331 . 0 0 "[ . 1 . 2]" 1
267 1 15 TRP HZ3 1 105 PHE HB2 . . 4.290 2.893 2.595 3.108 . 0 0 "[ . 1 . 2]" 1
268 1 15 TRP HZ3 1 105 PHE HB3 . . 4.490 2.874 2.537 3.031 . 0 0 "[ . 1 . 2]" 1
269 1 15 TRP HZ3 1 106 HIS H . . 4.820 3.114 2.661 3.531 . 0 0 "[ . 1 . 2]" 1
270 1 15 TRP HZ3 1 106 HIS HA . . 4.750 3.474 3.149 3.862 . 0 0 "[ . 1 . 2]" 1
271 1 15 TRP HZ3 1 106 HIS HB2 . . 5.190 2.856 2.478 3.204 . 0 0 "[ . 1 . 2]" 1
272 1 16 CYS H 1 16 CYS HB2 . . 3.290 2.386 2.299 2.497 . 0 0 "[ . 1 . 2]" 1
273 1 16 CYS H 1 16 CYS HB3 . . 3.710 3.575 3.551 3.597 . 0 0 "[ . 1 . 2]" 1
274 1 16 CYS H 1 16 CYS HG . . 3.210 2.924 2.563 3.195 . 0 0 "[ . 1 . 2]" 1
275 1 16 CYS H 1 17 GLN HB2 . . 4.730 4.651 4.419 4.725 . 0 0 "[ . 1 . 2]" 1
276 1 16 CYS H 1 18 GLU H . . 5.080 4.305 4.059 4.686 . 0 0 "[ . 1 . 2]" 1
277 1 16 CYS H 1 28 VAL MG1 . . 5.270 5.169 4.902 5.272 0.002 11 0 "[ . 1 . 2]" 1
278 1 16 CYS H 1 35 TRP HZ2 . . 5.220 4.984 4.754 5.216 . 0 0 "[ . 1 . 2]" 1
279 1 16 CYS HA 1 16 CYS HG . . 4.100 3.773 3.529 3.970 . 0 0 "[ . 1 . 2]" 1
280 1 16 CYS HA 1 19 GLN H . . 4.080 3.376 3.210 3.702 . 0 0 "[ . 1 . 2]" 1
281 1 16 CYS HA 1 19 GLN QB . . 3.890 2.724 2.502 3.053 . 0 0 "[ . 1 . 2]" 1
282 1 16 CYS HA 1 20 THR H . . 4.250 3.775 3.421 4.213 . 0 0 "[ . 1 . 2]" 1
283 1 16 CYS HA 1 20 THR MG . . 4.200 3.633 3.406 3.817 . 0 0 "[ . 1 . 2]" 1
284 1 16 CYS HA 1 35 TRP HH2 . . 4.730 3.942 3.552 4.158 . 0 0 "[ . 1 . 2]" 1
285 1 16 CYS HA 1 35 TRP HZ2 . . 5.020 4.761 4.527 5.003 . 0 0 "[ . 1 . 2]" 1
286 1 16 CYS HA 1 44 LEU MD1 . . 4.090 2.957 2.737 3.182 . 0 0 "[ . 1 . 2]" 1
287 1 16 CYS HA 1 44 LEU MD2 . . 4.830 4.464 3.997 4.785 . 0 0 "[ . 1 . 2]" 1
288 1 16 CYS HB2 1 17 GLN H . . 4.240 2.676 2.476 2.867 . 0 0 "[ . 1 . 2]" 1
289 1 16 CYS HB2 1 28 VAL MG1 . . 4.260 3.292 2.995 3.460 . 0 0 "[ . 1 . 2]" 1
290 1 16 CYS HB2 1 31 LEU QD . . 4.520 3.820 3.240 4.433 . 0 0 "[ . 1 . 2]" 1
291 1 16 CYS HB2 1 35 TRP HH2 . . 4.410 3.569 3.405 3.855 . 0 0 "[ . 1 . 2]" 1
292 1 16 CYS HB2 1 35 TRP HZ2 . . 3.880 2.637 2.398 2.878 . 0 0 "[ . 1 . 2]" 1
293 1 16 CYS HB3 1 17 GLN H . . 4.030 3.556 3.340 3.750 . 0 0 "[ . 1 . 2]" 1
294 1 16 CYS HB3 1 20 THR MG . . 4.550 3.043 2.824 3.258 . 0 0 "[ . 1 . 2]" 1
295 1 16 CYS HB3 1 28 VAL MG1 . . 3.890 3.229 2.823 3.432 . 0 0 "[ . 1 . 2]" 1
296 1 16 CYS HB3 1 28 VAL MG2 . . 4.580 3.538 2.805 4.187 . 0 0 "[ . 1 . 2]" 1
297 1 16 CYS HB3 1 35 TRP HH2 . . 4.000 2.137 2.000 2.387 . 0 0 "[ . 1 . 2]" 1
298 1 16 CYS HB3 1 35 TRP HZ2 . . 3.480 2.278 2.016 2.494 . 0 0 "[ . 1 . 2]" 1
299 1 16 CYS HB3 1 35 TRP HZ3 . . 4.880 4.525 4.362 4.788 . 0 0 "[ . 1 . 2]" 1
300 1 16 CYS HG 1 17 GLN H . . 5.130 4.854 4.601 5.067 . 0 0 "[ . 1 . 2]" 1
301 1 16 CYS HG 1 28 VAL MG1 . . 5.260 5.073 4.555 5.262 0.002 3 0 "[ . 1 . 2]" 1
302 1 16 CYS HG 1 35 TRP HZ2 . . 4.890 3.876 3.466 4.431 . 0 0 "[ . 1 . 2]" 1
303 1 17 GLN H 1 17 GLN HB2 . . 2.920 2.359 2.264 2.494 . 0 0 "[ . 1 . 2]" 1
304 1 17 GLN H 1 17 GLN HB3 . . 3.610 3.567 3.538 3.600 . 0 0 "[ . 1 . 2]" 1
305 1 17 GLN H 1 17 GLN HG2 . . 3.810 3.628 3.340 3.811 0.001 13 0 "[ . 1 . 2]" 1
306 1 17 GLN H 1 17 GLN HG3 . . 3.590 2.470 2.249 2.666 . 0 0 "[ . 1 . 2]" 1
307 1 17 GLN H 1 18 GLU H . . 3.400 2.805 2.625 3.074 . 0 0 "[ . 1 . 2]" 1
308 1 17 GLN H 1 18 GLU HB2 . . 5.400 4.881 4.619 5.110 . 0 0 "[ . 1 . 2]" 1
309 1 17 GLN H 1 18 GLU QG . . 5.340 4.597 4.337 5.090 . 0 0 "[ . 1 . 2]" 1
310 1 17 GLN H 1 19 GLN H . . 4.560 4.223 4.051 4.371 . 0 0 "[ . 1 . 2]" 1
311 1 17 GLN H 1 20 THR H . . 5.430 4.808 4.550 4.957 . 0 0 "[ . 1 . 2]" 1
312 1 17 GLN H 1 28 VAL HB . . 5.010 4.619 4.199 4.908 . 0 0 "[ . 1 . 2]" 1
313 1 17 GLN H 1 28 VAL MG1 . . 4.220 3.992 3.759 4.189 . 0 0 "[ . 1 . 2]" 1
314 1 17 GLN H 1 35 TRP HZ2 . . 5.500 4.803 4.456 5.073 . 0 0 "[ . 1 . 2]" 1
315 1 17 GLN HA 1 17 GLN HE21 . . 4.920 4.742 4.551 4.852 . 0 0 "[ . 1 . 2]" 1
316 1 17 GLN HA 1 17 GLN HG2 . . 3.480 2.453 2.307 2.570 . 0 0 "[ . 1 . 2]" 1
317 1 17 GLN HA 1 17 GLN HG3 . . 3.610 2.913 2.722 3.057 . 0 0 "[ . 1 . 2]" 1
318 1 17 GLN HA 1 20 THR H . . 4.290 3.788 3.280 4.081 . 0 0 "[ . 1 . 2]" 1
319 1 17 GLN HA 1 20 THR HB . . 4.940 4.719 4.361 4.941 0.001 17 0 "[ . 1 . 2]" 1
320 1 17 GLN HA 1 20 THR HG1 . . 3.450 2.321 2.028 2.726 . 0 0 "[ . 1 . 2]" 1
321 1 17 GLN HA 1 20 THR MG . . 4.650 3.974 3.682 4.217 . 0 0 "[ . 1 . 2]" 1
322 1 17 GLN HA 1 21 ALA H . . 5.120 4.104 3.652 4.964 . 0 0 "[ . 1 . 2]" 1
323 1 17 GLN HA 1 28 VAL HB . . 3.810 2.780 2.571 3.136 . 0 0 "[ . 1 . 2]" 1
324 1 17 GLN HA 1 28 VAL MG1 . . 4.850 3.600 3.080 3.888 . 0 0 "[ . 1 . 2]" 1
325 1 17 GLN HA 1 28 VAL MG2 . . 4.480 3.678 3.276 3.948 . 0 0 "[ . 1 . 2]" 1
326 1 17 GLN HB2 1 18 GLU H . . 3.440 2.641 2.331 2.946 . 0 0 "[ . 1 . 2]" 1
327 1 17 GLN HB3 1 17 GLN HE22 . . 5.150 4.520 4.379 4.667 . 0 0 "[ . 1 . 2]" 1
328 1 17 GLN HB3 1 18 GLU H . . 4.190 3.404 2.975 3.711 . 0 0 "[ . 1 . 2]" 1
329 1 17 GLN HB3 1 28 VAL MG1 . . 5.290 4.886 4.271 5.151 . 0 0 "[ . 1 . 2]" 1
330 1 17 GLN HE21 1 28 VAL HA . . 5.500 5.197 4.921 5.459 . 0 0 "[ . 1 . 2]" 1
331 1 17 GLN HE21 1 28 VAL HB . . 5.200 4.138 3.467 4.678 . 0 0 "[ . 1 . 2]" 1
332 1 17 GLN HE21 1 28 VAL MG1 . . 4.490 3.270 2.673 3.712 . 0 0 "[ . 1 . 2]" 1
333 1 17 GLN HE21 1 29 SER HA . . 3.700 2.581 2.182 3.273 . 0 0 "[ . 1 . 2]" 1
334 1 17 GLN HE22 1 17 GLN HG3 . . 3.870 3.730 3.636 3.818 . 0 0 "[ . 1 . 2]" 1
335 1 17 GLN HE22 1 28 VAL MG1 . . 5.280 4.719 4.210 5.122 . 0 0 "[ . 1 . 2]" 1
336 1 17 GLN HE22 1 29 SER HA . . 3.860 3.402 2.845 3.820 . 0 0 "[ . 1 . 2]" 1
337 1 17 GLN HG2 1 28 VAL HB . . 4.130 2.680 2.117 3.059 . 0 0 "[ . 1 . 2]" 1
338 1 17 GLN HG2 1 28 VAL MG1 . . 3.680 2.921 2.167 3.264 . 0 0 "[ . 1 . 2]" 1
339 1 17 GLN HG2 1 28 VAL MG2 . . 4.730 4.261 3.726 4.581 . 0 0 "[ . 1 . 2]" 1
340 1 17 GLN HG3 1 28 VAL HB . . 4.100 3.574 2.982 3.926 . 0 0 "[ . 1 . 2]" 1
341 1 17 GLN HG3 1 28 VAL MG1 . . 3.890 2.881 2.559 3.372 . 0 0 "[ . 1 . 2]" 1
342 1 17 GLN HG3 1 28 VAL MG2 . . 5.040 4.741 4.203 5.041 0.001 17 0 "[ . 1 . 2]" 1
343 1 18 GLU H 1 18 GLU HB2 . . 3.220 2.403 2.237 2.562 . 0 0 "[ . 1 . 2]" 1
344 1 18 GLU H 1 18 GLU HB3 . . 3.710 3.575 3.527 3.596 . 0 0 "[ . 1 . 2]" 1
345 1 18 GLU H 1 18 GLU HG2 . . 3.750 2.888 2.043 3.751 0.001 8 0 "[ . 1 . 2]" 1
346 1 18 GLU H 1 18 GLU QG . . 3.260 2.389 2.028 2.825 . 0 0 "[ . 1 . 2]" 1
347 1 18 GLU H 1 18 GLU HG3 . . 3.750 3.076 2.177 3.680 . 0 0 "[ . 1 . 2]" 1
348 1 18 GLU H 1 19 GLN H . . 3.390 2.666 2.408 2.905 . 0 0 "[ . 1 . 2]" 1
349 1 18 GLU H 1 20 THR H . . 4.800 4.374 3.874 4.749 . 0 0 "[ . 1 . 2]" 1
350 1 18 GLU H 1 21 ALA MB . . 5.010 4.255 4.071 4.383 . 0 0 "[ . 1 . 2]" 1
351 1 18 GLU HA 1 18 GLU HG2 . . 3.870 2.623 2.204 3.047 . 0 0 "[ . 1 . 2]" 1
352 1 18 GLU HA 1 18 GLU QG . . 3.320 2.535 2.166 2.916 . 0 0 "[ . 1 . 2]" 1
353 1 18 GLU HA 1 18 GLU HG3 . . 3.870 3.439 2.825 3.810 . 0 0 "[ . 1 . 2]" 1
354 1 18 GLU HA 1 21 ALA H . . 4.030 3.751 3.604 3.892 . 0 0 "[ . 1 . 2]" 1
355 1 18 GLU HA 1 21 ALA MB . . 3.570 2.386 2.299 2.557 . 0 0 "[ . 1 . 2]" 1
356 1 18 GLU HB2 1 19 GLN H . . 3.410 2.649 2.465 2.811 . 0 0 "[ . 1 . 2]" 1
357 1 18 GLU HB2 1 19 GLN HA . . 5.300 4.427 4.228 4.630 . 0 0 "[ . 1 . 2]" 1
358 1 18 GLU HB2 1 19 GLN HE21 . . 4.610 3.061 2.384 3.528 . 0 0 "[ . 1 . 2]" 1
359 1 18 GLU HB2 1 19 GLN HE22 . . 4.650 4.020 3.343 4.358 . 0 0 "[ . 1 . 2]" 1
360 1 18 GLU HB3 1 19 GLN H . . 3.630 3.539 3.190 3.634 0.004 4 0 "[ . 1 . 2]" 1
361 1 18 GLU HB3 1 19 GLN HE21 . . 4.780 3.738 2.961 4.199 . 0 0 "[ . 1 . 2]" 1
362 1 18 GLU HB3 1 19 GLN HE22 . . 4.890 3.950 3.196 4.464 . 0 0 "[ . 1 . 2]" 1
363 1 18 GLU HG2 1 19 GLN H . . 5.210 4.681 4.210 5.066 . 0 0 "[ . 1 . 2]" 1
364 1 18 GLU HG3 1 19 GLN H . . 5.210 4.694 4.280 5.046 . 0 0 "[ . 1 . 2]" 1
365 1 19 GLN H 1 19 GLN HB2 . . 3.720 2.495 2.405 2.622 . 0 0 "[ . 1 . 2]" 1
366 1 19 GLN H 1 19 GLN QB . . 3.060 2.451 2.370 2.562 . 0 0 "[ . 1 . 2]" 1
367 1 19 GLN H 1 19 GLN HB3 . . 3.720 3.594 3.582 3.611 . 0 0 "[ . 1 . 2]" 1
368 1 19 GLN H 1 19 GLN HE21 . . 4.210 3.433 2.924 3.767 . 0 0 "[ . 1 . 2]" 1
369 1 19 GLN H 1 19 GLN HE22 . . 4.820 4.463 4.091 4.770 . 0 0 "[ . 1 . 2]" 1
370 1 19 GLN H 1 19 GLN HG2 . . 3.240 2.337 2.132 2.525 . 0 0 "[ . 1 . 2]" 1
371 1 19 GLN H 1 19 GLN HG3 . . 3.900 3.786 3.651 3.901 0.001 1 0 "[ . 1 . 2]" 1
372 1 19 GLN H 1 20 THR H . . 3.310 2.721 2.513 2.846 . 0 0 "[ . 1 . 2]" 1
373 1 19 GLN H 1 20 THR MG . . 4.510 4.351 4.163 4.491 . 0 0 "[ . 1 . 2]" 1
374 1 19 GLN H 1 21 ALA H . . 4.430 3.817 3.600 4.238 . 0 0 "[ . 1 . 2]" 1
375 1 19 GLN H 1 44 LEU MD1 . . 4.740 4.489 4.048 4.743 0.003 19 0 "[ . 1 . 2]" 1
376 1 19 GLN HA 1 19 GLN HE21 . . 4.930 3.859 3.427 4.166 . 0 0 "[ . 1 . 2]" 1
377 1 19 GLN HA 1 19 GLN HE22 . . 4.920 3.781 3.559 4.044 . 0 0 "[ . 1 . 2]" 1
378 1 19 GLN HA 1 19 GLN HG2 . . 4.050 3.304 3.211 3.412 . 0 0 "[ . 1 . 2]" 1
379 1 19 GLN HA 1 19 GLN HG3 . . 4.180 3.660 3.551 3.744 . 0 0 "[ . 1 . 2]" 1
380 1 19 GLN HA 1 21 ALA H . . 4.720 4.004 3.695 4.570 . 0 0 "[ . 1 . 2]" 1
381 1 19 GLN HA 1 47 ARG QB . . 5.320 3.878 3.325 4.384 . 0 0 "[ . 1 . 2]" 1
382 1 19 GLN HA 1 47 ARG QD . . 4.810 3.884 2.305 4.814 0.004 16 0 "[ . 1 . 2]" 1
383 1 19 GLN HA 1 47 ARG QG . . 3.940 3.227 2.175 3.942 0.002 5 0 "[ . 1 . 2]" 1
384 1 19 GLN QB 1 20 THR H . . 3.650 2.321 2.102 2.960 . 0 0 "[ . 1 . 2]" 1
385 1 19 GLN QB 1 20 THR MG . . 4.470 2.964 2.758 3.159 . 0 0 "[ . 1 . 2]" 1
386 1 19 GLN QB 1 44 LEU HA . . 3.760 2.826 2.412 3.187 . 0 0 "[ . 1 . 2]" 1
387 1 19 GLN QB 1 44 LEU MD1 . . 3.300 2.178 1.782 2.492 . 0 0 "[ . 1 . 2]" 1
388 1 19 GLN QB 1 44 LEU MD2 . . 4.770 4.437 4.001 4.766 . 0 0 "[ . 1 . 2]" 1
389 1 19 GLN HB2 1 20 THR H . . 4.240 2.362 2.135 3.045 . 0 0 "[ . 1 . 2]" 1
390 1 19 GLN HB2 1 44 LEU MD1 . . 4.110 2.437 1.943 2.756 . 0 0 "[ . 1 . 2]" 1
391 1 19 GLN HB2 1 44 LEU MD2 . . 5.500 4.826 4.261 5.221 . 0 0 "[ . 1 . 2]" 1
392 1 19 GLN HB3 1 20 THR H . . 4.240 3.426 3.106 4.033 . 0 0 "[ . 1 . 2]" 1
393 1 19 GLN HB3 1 44 LEU MD1 . . 4.110 2.467 1.967 2.868 . 0 0 "[ . 1 . 2]" 1
394 1 19 GLN HB3 1 44 LEU MD2 . . 5.500 5.183 4.768 5.503 0.003 1 0 "[ . 1 . 2]" 1
395 1 19 GLN HE22 1 19 GLN HG2 . . 3.910 3.450 3.436 3.472 . 0 0 "[ . 1 . 2]" 1
396 1 20 THR H 1 20 THR HB . . 4.020 3.634 3.608 3.753 . 0 0 "[ . 1 . 2]" 1
397 1 20 THR H 1 20 THR HG1 . . 2.970 2.237 1.907 2.980 0.010 8 0 "[ . 1 . 2]" 1
398 1 20 THR H 1 20 THR MG . . 3.330 2.277 1.973 2.891 . 0 0 "[ . 1 . 2]" 1
399 1 20 THR H 1 21 ALA H . . 2.990 2.662 2.542 2.806 . 0 0 "[ . 1 . 2]" 1
400 1 20 THR H 1 21 ALA MB . . 4.240 4.145 3.738 4.270 0.030 12 0 "[ . 1 . 2]" 1
401 1 20 THR H 1 28 VAL MG2 . . 4.810 4.516 4.286 4.760 . 0 0 "[ . 1 . 2]" 1
402 1 20 THR H 1 43 ALA MB . . 5.100 4.493 4.272 4.850 . 0 0 "[ . 1 . 2]" 1
403 1 20 THR H 1 44 LEU HA . . 4.880 4.197 3.643 4.867 . 0 0 "[ . 1 . 2]" 1
404 1 20 THR H 1 44 LEU MD1 . . 4.760 3.947 3.454 4.551 . 0 0 "[ . 1 . 2]" 1
405 1 20 THR HA 1 20 THR MG . . 3.170 2.334 2.210 2.445 . 0 0 "[ . 1 . 2]" 1
406 1 20 THR HA 1 23 TYR H . . 5.500 4.680 3.395 5.193 . 0 0 "[ . 1 . 2]" 1
407 1 20 THR HA 1 23 TYR HB2 . . 4.990 3.963 3.338 4.451 . 0 0 "[ . 1 . 2]" 1
408 1 20 THR HA 1 23 TYR QD . . 5.190 4.891 4.658 5.171 . 0 0 "[ . 1 . 2]" 1
409 1 20 THR HA 1 26 VAL MG1 . . 4.580 3.594 3.355 4.008 . 0 0 "[ . 1 . 2]" 1
410 1 20 THR HA 1 43 ALA MB . . 3.660 2.095 1.967 2.359 . 0 0 "[ . 1 . 2]" 1
411 1 20 THR HA 1 44 LEU H . . 5.090 3.918 3.025 4.471 . 0 0 "[ . 1 . 2]" 1
412 1 20 THR HB 1 21 ALA H . . 4.740 4.045 3.634 4.475 . 0 0 "[ . 1 . 2]" 1
413 1 20 THR HB 1 23 TYR HB3 . . 4.950 4.355 3.870 4.870 . 0 0 "[ . 1 . 2]" 1
414 1 20 THR HB 1 26 VAL HB . . 4.890 3.668 2.720 4.220 . 0 0 "[ . 1 . 2]" 1
415 1 20 THR HB 1 26 VAL MG1 . . 3.300 1.925 1.793 2.161 . 0 0 "[ . 1 . 2]" 1
416 1 20 THR HB 1 28 VAL MG2 . . 4.350 2.780 2.304 3.108 . 0 0 "[ . 1 . 2]" 1
417 1 20 THR HB 1 40 ALA HA . . 5.120 3.794 3.200 4.188 . 0 0 "[ . 1 . 2]" 1
418 1 20 THR HB 1 43 ALA MB . . 3.640 2.736 2.450 3.058 . 0 0 "[ . 1 . 2]" 1
419 1 20 THR HG1 1 20 THR MG . . 3.020 2.547 2.082 3.019 . 0 0 "[ . 1 . 2]" 1
420 1 20 THR HG1 1 21 ALA H . . 3.890 2.867 1.952 3.745 . 0 0 "[ . 1 . 2]" 1
421 1 20 THR HG1 1 28 VAL MG1 . . 4.970 4.313 3.706 4.815 . 0 0 "[ . 1 . 2]" 1
422 1 20 THR HG1 1 28 VAL MG2 . . 3.800 3.120 1.949 3.586 . 0 0 "[ . 1 . 2]" 1
423 1 20 THR MG 1 21 ALA H . . 4.420 4.079 3.866 4.363 . 0 0 "[ . 1 . 2]" 1
424 1 20 THR MG 1 35 TRP HH2 . . 4.070 3.058 2.740 3.324 . 0 0 "[ . 1 . 2]" 1
425 1 20 THR MG 1 40 ALA HA . . 3.770 3.227 2.780 3.729 . 0 0 "[ . 1 . 2]" 1
426 1 20 THR MG 1 40 ALA MB . . 3.960 3.343 2.811 3.713 . 0 0 "[ . 1 . 2]" 1
427 1 20 THR MG 1 43 ALA H . . 4.360 4.174 3.926 4.353 . 0 0 "[ . 1 . 2]" 1
428 1 20 THR MG 1 43 ALA HA . . 5.050 4.689 4.375 5.050 0.000 12 0 "[ . 1 . 2]" 1
429 1 20 THR MG 1 43 ALA MB . . 3.140 2.472 2.280 2.756 . 0 0 "[ . 1 . 2]" 1
430 1 20 THR MG 1 44 LEU H . . 3.750 2.498 2.136 2.763 . 0 0 "[ . 1 . 2]" 1
431 1 20 THR MG 1 44 LEU HA . . 3.790 2.823 2.310 3.201 . 0 0 "[ . 1 . 2]" 1
432 1 20 THR MG 1 44 LEU HB2 . . 3.680 2.250 1.873 2.622 . 0 0 "[ . 1 . 2]" 1
433 1 20 THR MG 1 44 LEU HB3 . . 3.670 3.343 2.839 3.669 . 0 0 "[ . 1 . 2]" 1
434 1 20 THR MG 1 44 LEU MD1 . . 3.560 3.067 2.768 3.425 . 0 0 "[ . 1 . 2]" 1
435 1 21 ALA H 1 21 ALA MB . . 2.760 2.093 2.025 2.361 . 0 0 "[ . 1 . 2]" 1
436 1 21 ALA H 1 22 GLY H . . 4.900 3.929 2.189 4.650 . 0 0 "[ . 1 . 2]" 1
437 1 21 ALA H 1 23 TYR H . . 5.310 4.924 4.460 5.280 . 0 0 "[ . 1 . 2]" 1
438 1 21 ALA H 1 47 ARG QD . . 5.500 5.288 4.314 5.507 0.007 11 0 "[ . 1 . 2]" 1
439 1 21 ALA HA 1 23 TYR H . . 4.540 3.898 3.520 4.536 . 0 0 "[ . 1 . 2]" 1
440 1 21 ALA MB 1 22 GLY H . . 4.910 2.815 2.373 3.164 . 0 0 "[ . 1 . 2]" 1
441 1 21 ALA MB 1 22 GLY QA . . 4.850 3.544 3.368 3.679 . 0 0 "[ . 1 . 2]" 1
442 1 21 ALA MB 1 23 TYR H . . 4.770 4.484 4.243 4.711 . 0 0 "[ . 1 . 2]" 1
443 1 22 GLY H 1 23 TYR H . . 4.200 3.281 2.944 3.629 . 0 0 "[ . 1 . 2]" 1
444 1 23 TYR H 1 23 TYR HB2 . . 3.250 2.542 2.201 3.256 0.006 13 0 "[ . 1 . 2]" 1
445 1 23 TYR H 1 23 TYR HB3 . . 3.320 2.919 2.751 3.176 . 0 0 "[ . 1 . 2]" 1
446 1 23 TYR H 1 23 TYR QD . . 4.580 4.213 4.054 4.470 . 0 0 "[ . 1 . 2]" 1
447 1 23 TYR H 1 24 PRO HD2 . . 4.950 4.725 4.620 4.788 . 0 0 "[ . 1 . 2]" 1
448 1 23 TYR H 1 24 PRO HD3 . . 4.790 4.609 4.224 4.768 . 0 0 "[ . 1 . 2]" 1
449 1 23 TYR H 1 26 VAL HB . . 4.540 4.172 3.964 4.463 . 0 0 "[ . 1 . 2]" 1
450 1 23 TYR H 1 26 VAL MG1 . . 5.500 4.853 4.497 5.108 . 0 0 "[ . 1 . 2]" 1
451 1 23 TYR H 1 26 VAL MG2 . . 5.500 4.692 4.436 4.940 . 0 0 "[ . 1 . 2]" 1
452 1 23 TYR H 1 43 ALA MB . . 4.720 4.042 3.414 4.677 . 0 0 "[ . 1 . 2]" 1
453 1 23 TYR HA 1 23 TYR QD . . 3.850 3.001 2.859 3.107 . 0 0 "[ . 1 . 2]" 1
454 1 23 TYR HA 1 24 PRO HD2 . . 3.240 2.045 1.989 2.137 . 0 0 "[ . 1 . 2]" 1
455 1 23 TYR HA 1 24 PRO HD3 . . 3.060 2.278 2.252 2.307 . 0 0 "[ . 1 . 2]" 1
456 1 23 TYR HA 1 24 PRO QG . . 4.100 3.806 3.782 3.850 . 0 0 "[ . 1 . 2]" 1
457 1 23 TYR HB2 1 24 PRO HD2 . . 4.930 4.032 3.849 4.172 . 0 0 "[ . 1 . 2]" 1
458 1 23 TYR HB2 1 24 PRO HD3 . . 4.950 4.833 4.714 4.917 . 0 0 "[ . 1 . 2]" 1
459 1 23 TYR HB2 1 26 VAL HB . . 4.270 3.654 3.337 3.809 . 0 0 "[ . 1 . 2]" 1
460 1 23 TYR HB2 1 26 VAL MG1 . . 4.770 4.129 3.981 4.283 . 0 0 "[ . 1 . 2]" 1
461 1 23 TYR HB2 1 26 VAL MG2 . . 4.270 3.274 3.060 3.521 . 0 0 "[ . 1 . 2]" 1
462 1 23 TYR HB2 1 43 ALA MB . . 3.830 2.175 1.966 2.453 . 0 0 "[ . 1 . 2]" 1
463 1 23 TYR HB3 1 24 PRO HD2 . . 4.910 4.024 3.860 4.166 . 0 0 "[ . 1 . 2]" 1
464 1 23 TYR HB3 1 24 PRO HD3 . . 4.980 4.898 4.818 4.967 . 0 0 "[ . 1 . 2]" 1
465 1 23 TYR HB3 1 26 VAL H . . 4.610 3.592 2.947 4.146 . 0 0 "[ . 1 . 2]" 1
466 1 23 TYR HB3 1 26 VAL HB . . 3.850 2.035 1.994 2.185 . 0 0 "[ . 1 . 2]" 1
467 1 23 TYR HB3 1 26 VAL MG1 . . 4.380 3.242 3.092 3.423 . 0 0 "[ . 1 . 2]" 1
468 1 23 TYR HB3 1 26 VAL MG2 . . 3.840 2.177 1.941 2.533 . 0 0 "[ . 1 . 2]" 1
469 1 23 TYR HB3 1 43 ALA HA . . 4.770 4.646 4.439 4.772 0.002 19 0 "[ . 1 . 2]" 1
470 1 23 TYR HB3 1 43 ALA MB . . 3.770 2.511 2.299 2.648 . 0 0 "[ . 1 . 2]" 1
471 1 23 TYR QD 1 24 PRO HA . . 4.890 3.918 3.742 4.175 . 0 0 "[ . 1 . 2]" 1
472 1 23 TYR QD 1 24 PRO HD2 . . 4.150 2.474 2.267 3.003 . 0 0 "[ . 1 . 2]" 1
473 1 23 TYR QD 1 24 PRO HD3 . . 4.340 3.764 3.602 4.193 . 0 0 "[ . 1 . 2]" 1
474 1 23 TYR QD 1 24 PRO QG . . 4.490 3.092 2.917 3.606 . 0 0 "[ . 1 . 2]" 1
475 1 23 TYR QD 1 26 VAL H . . 4.300 3.176 2.388 3.963 . 0 0 "[ . 1 . 2]" 1
476 1 23 TYR QD 1 26 VAL HB . . 3.940 3.601 3.409 3.879 . 0 0 "[ . 1 . 2]" 1
477 1 23 TYR QD 1 26 VAL MG1 . . 4.450 4.343 4.250 4.443 . 0 0 "[ . 1 . 2]" 1
478 1 23 TYR QD 1 26 VAL MG2 . . 3.260 2.375 2.038 2.651 . 0 0 "[ . 1 . 2]" 1
479 1 23 TYR QD 1 39 LEU HB3 . . 4.950 4.637 4.414 4.832 . 0 0 "[ . 1 . 2]" 1
480 1 23 TYR QD 1 43 ALA H . . 5.080 4.059 3.572 4.319 . 0 0 "[ . 1 . 2]" 1
481 1 23 TYR QD 1 43 ALA HA . . 4.060 2.028 1.995 2.169 . 0 0 "[ . 1 . 2]" 1
482 1 23 TYR QD 1 43 ALA MB . . 3.640 2.090 1.970 2.390 . 0 0 "[ . 1 . 2]" 1
483 1 23 TYR QD 1 46 TYR QB . . 4.880 3.604 3.239 3.912 . 0 0 "[ . 1 . 2]" 1
484 1 23 TYR QD 1 46 TYR QD . . 4.180 3.892 3.369 4.190 0.010 20 0 "[ . 1 . 2]" 1
485 1 23 TYR QE 1 24 PRO HD2 . . 4.660 3.429 3.283 3.853 . 0 0 "[ . 1 . 2]" 1
486 1 23 TYR QE 1 24 PRO QG . . 4.810 3.081 2.830 3.694 . 0 0 "[ . 1 . 2]" 1
487 1 23 TYR QE 1 26 VAL MG2 . . 4.150 3.304 3.133 3.520 . 0 0 "[ . 1 . 2]" 1
488 1 23 TYR QE 1 39 LEU HB3 . . 4.830 4.352 3.984 4.587 . 0 0 "[ . 1 . 2]" 1
489 1 23 TYR QE 1 39 LEU MD1 . . 4.580 3.123 2.781 3.450 . 0 0 "[ . 1 . 2]" 1
490 1 23 TYR QE 1 39 LEU MD2 . . 3.820 2.438 2.120 2.712 . 0 0 "[ . 1 . 2]" 1
491 1 23 TYR QE 1 43 ALA H . . 5.050 4.200 3.877 4.541 . 0 0 "[ . 1 . 2]" 1
492 1 23 TYR QE 1 43 ALA HA . . 4.310 3.009 2.778 3.328 . 0 0 "[ . 1 . 2]" 1
493 1 23 TYR QE 1 43 ALA MB . . 4.510 3.563 3.405 3.785 . 0 0 "[ . 1 . 2]" 1
494 1 23 TYR QE 1 46 TYR H . . 5.500 5.292 4.927 5.508 0.008 13 0 "[ . 1 . 2]" 1
495 1 23 TYR QE 1 46 TYR QB . . 3.750 3.486 2.939 3.757 0.007 16 0 "[ . 1 . 2]" 1
496 1 23 TYR QE 1 46 TYR QD . . 4.250 2.585 2.250 3.130 . 0 0 "[ . 1 . 2]" 1
497 1 23 TYR QE 1 55 PRO HA . . 5.500 5.408 5.207 5.508 0.008 8 0 "[ . 1 . 2]" 1
498 1 23 TYR QE 1 55 PRO HB2 . . 5.170 3.834 3.649 4.066 . 0 0 "[ . 1 . 2]" 1
499 1 23 TYR QE 1 55 PRO QB . . 4.290 3.158 2.969 3.333 . 0 0 "[ . 1 . 2]" 1
500 1 23 TYR QE 1 55 PRO HB3 . . 5.170 3.364 3.127 3.550 . 0 0 "[ . 1 . 2]" 1
501 1 23 TYR QE 1 55 PRO HD3 . . 4.930 3.668 3.421 3.955 . 0 0 "[ . 1 . 2]" 1
502 1 23 TYR QE 1 55 PRO HG2 . . 4.540 3.516 3.376 3.635 . 0 0 "[ . 1 . 2]" 1
503 1 23 TYR QE 1 55 PRO HG3 . . 4.670 2.002 1.989 2.128 . 0 0 "[ . 1 . 2]" 1
504 1 24 PRO HA 1 25 GLY H . . 2.860 2.185 2.154 2.244 . 0 0 "[ . 1 . 2]" 1
505 1 24 PRO HA 1 26 VAL H . . 4.240 3.923 3.648 4.244 0.004 4 0 "[ . 1 . 2]" 1
506 1 24 PRO QB 1 25 GLY H . . 3.800 3.549 3.304 3.738 . 0 0 "[ . 1 . 2]" 1
507 1 24 PRO HB2 1 25 GLY H . . 4.430 3.823 3.523 4.054 . 0 0 "[ . 1 . 2]" 1
508 1 24 PRO HB3 1 25 GLY H . . 4.430 4.209 3.996 4.382 . 0 0 "[ . 1 . 2]" 1
509 1 24 PRO HD2 1 39 LEU MD2 . . 5.500 5.292 5.120 5.500 . 0 0 "[ . 1 . 2]" 1
510 1 25 GLY H 1 26 VAL H . . 3.340 2.631 2.019 3.226 . 0 0 "[ . 1 . 2]" 1
511 1 25 GLY H 1 26 VAL MG2 . . 4.880 4.502 3.906 4.881 0.001 7 0 "[ . 1 . 2]" 1
512 1 25 GLY QA 1 26 VAL MG2 . . 4.600 3.648 3.316 3.971 . 0 0 "[ . 1 . 2]" 1
513 1 25 GLY QA 1 39 LEU MD1 . . 3.730 3.255 2.914 3.731 0.001 1 0 "[ . 1 . 2]" 1
514 1 26 VAL H 1 26 VAL HB . . 2.910 2.605 2.408 2.884 . 0 0 "[ . 1 . 2]" 1
515 1 26 VAL H 1 26 VAL MG1 . . 4.160 3.796 3.739 3.921 . 0 0 "[ . 1 . 2]" 1
516 1 26 VAL H 1 26 VAL MG2 . . 3.330 2.498 1.939 3.125 . 0 0 "[ . 1 . 2]" 1
517 1 26 VAL H 1 27 HIS H . . 4.380 4.276 3.962 4.398 0.018 8 0 "[ . 1 . 2]" 1
518 1 26 VAL H 1 43 ALA MB . . 5.500 5.004 4.437 5.509 0.009 10 0 "[ . 1 . 2]" 1
519 1 26 VAL HA 1 26 VAL MG1 . . 3.300 2.376 2.251 2.482 . 0 0 "[ . 1 . 2]" 1
520 1 26 VAL HA 1 26 VAL MG2 . . 3.240 2.358 2.183 2.454 . 0 0 "[ . 1 . 2]" 1
521 1 26 VAL HA 1 27 HIS H . . 2.690 2.151 2.140 2.182 . 0 0 "[ . 1 . 2]" 1
522 1 26 VAL HA 1 40 ALA MB . . 5.230 4.635 4.407 4.900 . 0 0 "[ . 1 . 2]" 1
523 1 26 VAL HB 1 27 HIS H . . 4.600 4.364 4.243 4.493 . 0 0 "[ . 1 . 2]" 1
524 1 26 VAL HB 1 28 VAL MG2 . . 4.870 4.607 4.252 4.862 . 0 0 "[ . 1 . 2]" 1
525 1 26 VAL HB 1 43 ALA MB . . 4.680 3.271 3.062 3.489 . 0 0 "[ . 1 . 2]" 1
526 1 26 VAL MG1 1 27 HIS H . . 3.210 2.956 2.654 3.077 . 0 0 "[ . 1 . 2]" 1
527 1 26 VAL MG1 1 27 HIS HA . . 4.300 3.611 3.391 3.793 . 0 0 "[ . 1 . 2]" 1
528 1 26 VAL MG1 1 28 VAL H . . 4.130 2.957 2.520 3.439 . 0 0 "[ . 1 . 2]" 1
529 1 26 VAL MG1 1 28 VAL HA . . 5.500 4.304 4.118 4.482 . 0 0 "[ . 1 . 2]" 1
530 1 26 VAL MG1 1 28 VAL HB . . 4.740 4.131 3.725 4.626 . 0 0 "[ . 1 . 2]" 1
531 1 26 VAL MG1 1 28 VAL MG2 . . 3.080 2.273 1.967 2.563 . 0 0 "[ . 1 . 2]" 1
532 1 26 VAL MG1 1 40 ALA H . . 4.140 3.650 2.994 3.958 . 0 0 "[ . 1 . 2]" 1
533 1 26 VAL MG1 1 40 ALA HA . . 3.180 2.085 1.796 2.356 . 0 0 "[ . 1 . 2]" 1
534 1 26 VAL MG1 1 40 ALA MB . . 3.220 2.971 2.601 3.220 . 0 0 "[ . 1 . 2]" 1
535 1 26 VAL MG1 1 43 ALA H . . 4.690 3.982 3.670 4.202 . 0 0 "[ . 1 . 2]" 1
536 1 26 VAL MG1 1 43 ALA MB . . 3.320 2.261 2.031 2.494 . 0 0 "[ . 1 . 2]" 1
537 1 26 VAL MG2 1 28 VAL MG2 . . 5.360 4.372 3.997 4.885 . 0 0 "[ . 1 . 2]" 1
538 1 26 VAL MG2 1 39 LEU H . . 4.990 4.742 4.543 4.907 . 0 0 "[ . 1 . 2]" 1
539 1 26 VAL MG2 1 39 LEU HB2 . . 3.550 3.067 2.813 3.264 . 0 0 "[ . 1 . 2]" 1
540 1 26 VAL MG2 1 39 LEU HB3 . . 3.320 1.960 1.877 2.106 . 0 0 "[ . 1 . 2]" 1
541 1 26 VAL MG2 1 39 LEU HG . . 4.430 4.371 4.216 4.438 0.008 8 0 "[ . 1 . 2]" 1
542 1 26 VAL MG2 1 40 ALA H . . 3.880 3.504 3.242 3.731 . 0 0 "[ . 1 . 2]" 1
543 1 26 VAL MG2 1 40 ALA HA . . 3.370 2.946 2.539 3.201 . 0 0 "[ . 1 . 2]" 1
544 1 26 VAL MG2 1 43 ALA H . . 4.570 3.404 3.140 3.669 . 0 0 "[ . 1 . 2]" 1
545 1 26 VAL MG2 1 43 ALA HA . . 4.830 4.091 3.752 4.508 . 0 0 "[ . 1 . 2]" 1
546 1 26 VAL MG2 1 43 ALA MB . . 3.510 2.108 1.845 2.544 . 0 0 "[ . 1 . 2]" 1
547 1 27 HIS H 1 27 HIS QB . . 3.560 2.770 2.315 3.180 . 0 0 "[ . 1 . 2]" 1
548 1 27 HIS H 1 27 HIS HD2 . . 5.040 4.495 3.207 5.047 0.007 9 0 "[ . 1 . 2]" 1
549 1 27 HIS H 1 28 VAL HA . . 5.260 4.492 4.296 4.848 . 0 0 "[ . 1 . 2]" 1
550 1 27 HIS H 1 28 VAL MG2 . . 4.410 4.057 3.895 4.281 . 0 0 "[ . 1 . 2]" 1
551 1 27 HIS H 1 40 ALA HA . . 5.500 5.351 5.211 5.486 . 0 0 "[ . 1 . 2]" 1
552 1 27 HIS H 1 40 ALA MB . . 4.840 4.808 4.647 4.845 0.005 2 0 "[ . 1 . 2]" 1
553 1 27 HIS HA 1 27 HIS HD2 . . 5.130 3.672 2.536 4.699 . 0 0 "[ . 1 . 2]" 1
554 1 27 HIS HA 1 28 VAL HB . . 5.120 4.698 4.599 4.859 . 0 0 "[ . 1 . 2]" 1
555 1 27 HIS HA 1 28 VAL MG2 . . 4.720 4.093 3.850 4.293 . 0 0 "[ . 1 . 2]" 1
556 1 27 HIS QB 1 28 VAL H . . 4.470 3.948 3.750 4.060 . 0 0 "[ . 1 . 2]" 1
557 1 27 HIS HD2 1 28 VAL H . . 5.500 4.342 2.965 5.467 . 0 0 "[ . 1 . 2]" 1
558 1 27 HIS HD2 1 29 SER QB . . 4.590 3.337 1.988 4.578 . 0 0 "[ . 1 . 2]" 1
559 1 28 VAL H 1 28 VAL HB . . 3.720 2.501 2.435 2.645 . 0 0 "[ . 1 . 2]" 1
560 1 28 VAL H 1 28 VAL MG1 . . 4.260 3.766 3.752 3.834 . 0 0 "[ . 1 . 2]" 1
561 1 28 VAL H 1 28 VAL MG2 . . 3.560 2.232 1.932 2.440 . 0 0 "[ . 1 . 2]" 1
562 1 28 VAL H 1 29 SER H . . 5.020 4.191 3.730 4.447 . 0 0 "[ . 1 . 2]" 1
563 1 28 VAL HA 1 28 VAL MG1 . . 3.380 2.364 2.215 2.446 . 0 0 "[ . 1 . 2]" 1
564 1 28 VAL HA 1 28 VAL MG2 . . 3.290 2.332 2.240 2.445 . 0 0 "[ . 1 . 2]" 1
565 1 28 VAL HA 1 29 SER H . . 3.020 2.228 2.139 2.396 . 0 0 "[ . 1 . 2]" 1
566 1 28 VAL HA 1 29 SER HA . . 5.090 4.441 4.393 4.520 . 0 0 "[ . 1 . 2]" 1
567 1 28 VAL HA 1 30 ASP H . . 4.220 3.358 3.149 3.564 . 0 0 "[ . 1 . 2]" 1
568 1 28 VAL HA 1 34 SER H . . 5.500 5.508 5.490 5.538 0.038 17 0 "[ . 1 . 2]" 1
569 1 28 VAL HA 1 34 SER HA . . 4.770 4.435 4.186 4.676 . 0 0 "[ . 1 . 2]" 1
570 1 28 VAL HA 1 34 SER QB . . 3.410 2.261 1.980 2.701 . 0 0 "[ . 1 . 2]" 1
571 1 28 VAL HB 1 29 SER HA . . 5.500 4.932 4.784 5.036 . 0 0 "[ . 1 . 2]" 1
572 1 28 VAL MG1 1 29 SER H . . 3.950 3.288 2.719 3.714 . 0 0 "[ . 1 . 2]" 1
573 1 28 VAL MG1 1 29 SER HA . . 4.490 3.935 3.560 4.272 . 0 0 "[ . 1 . 2]" 1
574 1 28 VAL MG1 1 30 ASP H . . 3.720 2.980 2.660 3.296 . 0 0 "[ . 1 . 2]" 1
575 1 28 VAL MG1 1 34 SER H . . 5.500 5.407 5.212 5.504 0.004 18 0 "[ . 1 . 2]" 1
576 1 28 VAL MG1 1 34 SER HB2 . . 4.970 3.644 3.025 4.096 . 0 0 "[ . 1 . 2]" 1
577 1 28 VAL MG1 1 34 SER QB . . 4.140 2.863 2.731 3.002 . 0 0 "[ . 1 . 2]" 1
578 1 28 VAL MG1 1 34 SER HB3 . . 4.970 3.035 2.847 3.704 . 0 0 "[ . 1 . 2]" 1
579 1 28 VAL MG1 1 35 TRP HD1 . . 4.310 3.514 3.258 3.855 . 0 0 "[ . 1 . 2]" 1
580 1 28 VAL MG1 1 35 TRP HE1 . . 3.350 1.964 1.705 2.288 . 0 0 "[ . 1 . 2]" 1
581 1 28 VAL MG1 1 35 TRP HH2 . . 4.610 3.855 3.532 4.052 . 0 0 "[ . 1 . 2]" 1
582 1 28 VAL MG1 1 35 TRP HZ2 . . 3.330 2.049 1.967 2.393 . 0 0 "[ . 1 . 2]" 1
583 1 28 VAL MG1 1 40 ALA MB . . 4.320 3.853 3.369 4.246 . 0 0 "[ . 1 . 2]" 1
584 1 28 VAL MG2 1 29 SER H . . 4.440 4.201 4.019 4.354 . 0 0 "[ . 1 . 2]" 1
585 1 28 VAL MG2 1 30 ASP H . . 5.180 4.801 4.521 5.008 . 0 0 "[ . 1 . 2]" 1
586 1 28 VAL MG2 1 34 SER QB . . 3.940 3.315 2.910 3.702 . 0 0 "[ . 1 . 2]" 1
587 1 28 VAL MG2 1 35 TRP HA . . 5.110 4.059 3.690 4.557 . 0 0 "[ . 1 . 2]" 1
588 1 28 VAL MG2 1 35 TRP HE1 . . 4.650 3.611 3.193 4.125 . 0 0 "[ . 1 . 2]" 1
589 1 28 VAL MG2 1 35 TRP HH2 . . 4.610 3.687 3.379 4.180 . 0 0 "[ . 1 . 2]" 1
590 1 28 VAL MG2 1 35 TRP HZ2 . . 3.930 3.137 2.565 3.762 . 0 0 "[ . 1 . 2]" 1
591 1 28 VAL MG2 1 40 ALA HA . . 4.840 3.209 2.986 3.616 . 0 0 "[ . 1 . 2]" 1
592 1 28 VAL MG2 1 40 ALA MB . . 3.240 2.375 1.939 2.789 . 0 0 "[ . 1 . 2]" 1
593 1 29 SER H 1 30 ASP H . . 3.100 2.143 1.790 2.441 . 0 0 "[ . 1 . 2]" 1
594 1 29 SER H 1 34 SER QB . . 3.440 2.531 2.322 2.834 . 0 0 "[ . 1 . 2]" 1
595 1 29 SER H 1 35 TRP HE1 . . 5.500 5.152 4.385 5.494 . 0 0 "[ . 1 . 2]" 1
596 1 30 ASP H 1 34 SER QB . . 4.250 2.276 1.924 2.516 . 0 0 "[ . 1 . 2]" 1
597 1 30 ASP H 1 35 TRP HE1 . . 4.350 4.037 3.805 4.337 . 0 0 "[ . 1 . 2]" 1
598 1 30 ASP HA 1 35 TRP HD1 . . 5.500 5.347 4.922 5.507 0.007 20 0 "[ . 1 . 2]" 1
599 1 30 ASP QB 1 31 LEU H . . 3.310 2.490 1.938 3.027 . 0 0 "[ . 1 . 2]" 1
600 1 30 ASP QB 1 32 SER H . . 3.600 2.752 2.414 3.171 . 0 0 "[ . 1 . 2]" 1
601 1 30 ASP HB2 1 31 LEU H . . 4.070 3.173 1.954 4.031 . 0 0 "[ . 1 . 2]" 1
602 1 30 ASP HB2 1 32 SER H . . 4.250 3.236 2.431 4.265 0.015 17 0 "[ . 1 . 2]" 1
603 1 30 ASP HB3 1 31 LEU H . . 4.070 2.960 1.989 3.686 . 0 0 "[ . 1 . 2]" 1
604 1 30 ASP HB3 1 32 SER H . . 4.250 3.642 2.500 4.322 0.072 16 0 "[ . 1 . 2]" 1
605 1 31 LEU H 1 31 LEU QB . . 3.510 2.410 2.145 2.697 . 0 0 "[ . 1 . 2]" 1
606 1 31 LEU H 1 31 LEU MD1 . . 4.850 2.545 1.871 3.691 . 0 0 "[ . 1 . 2]" 1
607 1 31 LEU H 1 31 LEU QD . . 4.230 2.459 1.867 3.387 . 0 0 "[ . 1 . 2]" 1
608 1 31 LEU H 1 31 LEU MD2 . . 4.850 4.018 3.402 4.347 . 0 0 "[ . 1 . 2]" 1
609 1 31 LEU H 1 32 SER H . . 3.530 3.034 2.500 3.495 . 0 0 "[ . 1 . 2]" 1
610 1 31 LEU HA 1 31 LEU QD . . 3.180 2.675 2.317 2.966 . 0 0 "[ . 1 . 2]" 1
611 1 31 LEU QB 1 32 SER H . . 4.130 3.831 3.723 3.893 . 0 0 "[ . 1 . 2]" 1
612 1 31 LEU QB 1 35 TRP HE1 . . 4.390 4.122 3.622 4.390 . 0 0 "[ . 1 . 2]" 1
613 1 31 LEU QB 1 99 ILE MD . . 3.820 3.477 3.042 3.807 . 0 0 "[ . 1 . 2]" 1
614 1 31 LEU QB 1 99 ILE HG12 . . 3.620 2.646 2.164 3.101 . 0 0 "[ . 1 . 2]" 1
615 1 31 LEU HB2 1 32 SER H . . 4.920 4.233 4.044 4.439 . 0 0 "[ . 1 . 2]" 1
616 1 31 LEU HB2 1 99 ILE HG12 . . 4.130 3.213 2.435 3.869 . 0 0 "[ . 1 . 2]" 1
617 1 31 LEU HB3 1 32 SER H . . 4.920 4.391 4.306 4.546 . 0 0 "[ . 1 . 2]" 1
618 1 31 LEU HB3 1 99 ILE HG12 . . 4.130 2.871 2.266 3.380 . 0 0 "[ . 1 . 2]" 1
619 1 31 LEU QD 1 32 SER H . . 4.960 4.336 4.141 4.522 . 0 0 "[ . 1 . 2]" 1
620 1 31 LEU QD 1 35 TRP HD1 . . 4.680 3.809 3.300 4.204 . 0 0 "[ . 1 . 2]" 1
621 1 31 LEU QD 1 35 TRP HE1 . . 3.440 2.346 1.937 2.928 . 0 0 "[ . 1 . 2]" 1
622 1 31 LEU QD 1 35 TRP HZ2 . . 4.170 3.141 2.280 3.814 . 0 0 "[ . 1 . 2]" 1
623 1 31 LEU QD 1 99 ILE MG . . 3.620 2.671 2.005 3.233 . 0 0 "[ . 1 . 2]" 1
624 1 31 LEU QD 1 102 LEU MD1 . . 3.000 1.917 1.680 2.135 . 0 0 "[ . 1 . 2]" 1
625 1 31 LEU QD 1 102 LEU MD2 . . 4.800 3.921 3.252 4.280 . 0 0 "[ . 1 . 2]" 1
626 1 31 LEU MD1 1 102 LEU MD1 . . 3.620 3.300 2.821 3.621 0.001 4 0 "[ . 1 . 2]" 1
627 1 31 LEU MD2 1 102 LEU MD1 . . 3.620 1.931 1.693 2.167 . 0 0 "[ . 1 . 2]" 1
628 1 31 LEU HG 1 35 TRP HE1 . . 4.410 2.960 2.325 3.865 . 0 0 "[ . 1 . 2]" 1
629 1 32 SER H 1 32 SER QB . . 3.600 2.534 2.225 3.093 . 0 0 "[ . 1 . 2]" 1
630 1 32 SER H 1 33 SER H . . 3.770 2.488 2.224 2.774 . 0 0 "[ . 1 . 2]" 1
631 1 32 SER H 1 33 SER HA . . 5.150 4.726 4.532 4.962 . 0 0 "[ . 1 . 2]" 1
632 1 32 SER H 1 33 SER QB . . 5.260 4.835 4.522 5.206 . 0 0 "[ . 1 . 2]" 1
633 1 32 SER H 1 34 SER H . . 3.670 3.052 2.685 3.427 . 0 0 "[ . 1 . 2]" 1
634 1 32 SER H 1 35 TRP H . . 4.610 4.053 3.670 4.484 . 0 0 "[ . 1 . 2]" 1
635 1 32 SER H 1 35 TRP HD1 . . 3.770 3.365 3.038 3.672 . 0 0 "[ . 1 . 2]" 1
636 1 32 SER H 1 35 TRP HE1 . . 4.950 4.843 4.524 4.952 0.002 9 0 "[ . 1 . 2]" 1
637 1 32 SER H 1 98 LEU MD2 . . 4.840 4.385 4.025 4.643 . 0 0 "[ . 1 . 2]" 1
638 1 32 SER HA 1 34 SER H . . 5.340 4.963 4.542 5.332 . 0 0 "[ . 1 . 2]" 1
639 1 32 SER HA 1 35 TRP H . . 5.500 5.397 5.269 5.547 0.047 16 0 "[ . 1 . 2]" 1
640 1 32 SER HA 1 35 TRP HD1 . . 5.500 5.290 5.158 5.496 . 0 0 "[ . 1 . 2]" 1
641 1 32 SER HA 1 98 LEU MD2 . . 4.010 3.901 3.578 4.016 0.006 4 0 "[ . 1 . 2]" 1
642 1 32 SER HB2 1 33 SER H . . 4.230 2.976 1.926 3.675 . 0 0 "[ . 1 . 2]" 1
643 1 32 SER HB3 1 33 SER H . . 4.230 2.502 1.900 3.686 . 0 0 "[ . 1 . 2]" 1
644 1 33 SER H 1 33 SER QB . . 3.640 2.608 2.384 3.109 . 0 0 "[ . 1 . 2]" 1
645 1 33 SER H 1 34 SER H . . 3.970 1.969 1.803 2.876 . 0 0 "[ . 1 . 2]" 1
646 1 33 SER HA 1 35 TRP H . . 3.810 3.547 3.366 3.814 0.004 6 0 "[ . 1 . 2]" 1
647 1 33 SER HA 1 36 ALA H . . 4.850 2.799 2.560 3.557 . 0 0 "[ . 1 . 2]" 1
648 1 33 SER HA 1 36 ALA MB . . 3.960 2.156 1.943 2.923 . 0 0 "[ . 1 . 2]" 1
649 1 33 SER QB 1 34 SER H . . 4.150 3.191 2.724 3.891 . 0 0 "[ . 1 . 2]" 1
650 1 33 SER QB 1 36 ALA H . . 5.110 4.255 3.933 4.950 . 0 0 "[ . 1 . 2]" 1
651 1 33 SER QB 1 36 ALA MB . . 4.500 3.171 2.759 3.795 . 0 0 "[ . 1 . 2]" 1
652 1 34 SER H 1 34 SER QB . . 3.230 2.242 2.123 2.757 . 0 0 "[ . 1 . 2]" 1
653 1 34 SER H 1 35 TRP H . . 3.450 2.685 1.799 2.882 . 0 0 "[ . 1 . 2]" 1
654 1 34 SER H 1 35 TRP HB2 . . 5.500 4.983 4.051 5.207 . 0 0 "[ . 1 . 2]" 1
655 1 34 SER H 1 35 TRP HD1 . . 4.080 3.618 2.724 3.980 . 0 0 "[ . 1 . 2]" 1
656 1 34 SER H 1 36 ALA H . . 4.560 3.923 3.158 4.168 . 0 0 "[ . 1 . 2]" 1
657 1 34 SER H 1 36 ALA MB . . 4.870 4.526 3.991 4.704 . 0 0 "[ . 1 . 2]" 1
658 1 34 SER H 1 98 LEU MD2 . . 5.500 5.277 4.237 5.501 0.001 16 0 "[ . 1 . 2]" 1
659 1 34 SER HA 1 36 ALA H . . 5.020 4.278 3.921 4.600 . 0 0 "[ . 1 . 2]" 1
660 1 34 SER QB 1 35 TRP H . . 3.910 2.952 2.832 3.153 . 0 0 "[ . 1 . 2]" 1
661 1 34 SER QB 1 35 TRP HD1 . . 3.990 2.584 2.348 2.772 . 0 0 "[ . 1 . 2]" 1
662 1 34 SER QB 1 35 TRP HE1 . . 4.440 3.477 3.192 3.795 . 0 0 "[ . 1 . 2]" 1
663 1 34 SER HB2 1 35 TRP H . . 4.650 3.358 2.986 3.846 . 0 0 "[ . 1 . 2]" 1
664 1 34 SER HB2 1 35 TRP HD1 . . 4.680 3.078 2.424 3.790 . 0 0 "[ . 1 . 2]" 1
665 1 34 SER HB2 1 35 TRP HE1 . . 5.240 4.171 3.471 4.792 . 0 0 "[ . 1 . 2]" 1
666 1 34 SER HB2 1 36 ALA H . . 5.500 5.201 4.929 5.509 0.009 19 0 "[ . 1 . 2]" 1
667 1 34 SER HB3 1 35 TRP H . . 4.650 3.465 3.010 4.140 . 0 0 "[ . 1 . 2]" 1
668 1 34 SER HB3 1 35 TRP HD1 . . 4.680 3.183 2.378 4.105 . 0 0 "[ . 1 . 2]" 1
669 1 34 SER HB3 1 35 TRP HE1 . . 5.240 3.925 3.255 4.907 . 0 0 "[ . 1 . 2]" 1
670 1 34 SER HB3 1 36 ALA H . . 5.500 5.277 4.895 5.505 0.005 6 0 "[ . 1 . 2]" 1
671 1 35 TRP H 1 35 TRP HB2 . . 3.270 2.502 2.427 2.551 . 0 0 "[ . 1 . 2]" 1
672 1 35 TRP H 1 35 TRP HB3 . . 3.900 3.674 3.633 3.704 . 0 0 "[ . 1 . 2]" 1
673 1 35 TRP H 1 35 TRP HD1 . . 3.230 2.380 2.238 2.446 . 0 0 "[ . 1 . 2]" 1
674 1 35 TRP H 1 35 TRP HE1 . . 4.840 4.831 4.746 4.860 0.020 11 0 "[ . 1 . 2]" 1
675 1 35 TRP H 1 36 ALA H . . 2.870 2.131 2.041 2.235 . 0 0 "[ . 1 . 2]" 1
676 1 35 TRP H 1 36 ALA MB . . 3.990 3.790 3.680 3.903 . 0 0 "[ . 1 . 2]" 1
677 1 35 TRP H 1 37 ASP H . . 4.810 4.398 4.100 4.736 . 0 0 "[ . 1 . 2]" 1
678 1 35 TRP H 1 98 LEU MD2 . . 4.470 3.714 3.460 3.975 . 0 0 "[ . 1 . 2]" 1
679 1 35 TRP HA 1 35 TRP HD1 . . 4.900 3.847 3.723 3.969 . 0 0 "[ . 1 . 2]" 1
680 1 35 TRP HA 1 35 TRP HE3 . . 4.860 3.700 3.514 3.874 . 0 0 "[ . 1 . 2]" 1
681 1 35 TRP HA 1 37 ASP H . . 5.280 3.904 3.289 4.279 . 0 0 "[ . 1 . 2]" 1
682 1 35 TRP HA 1 40 ALA MB . . 3.890 1.926 1.859 2.036 . 0 0 "[ . 1 . 2]" 1
683 1 35 TRP HB2 1 35 TRP HD1 . . 3.830 2.826 2.764 2.889 . 0 0 "[ . 1 . 2]" 1
684 1 35 TRP HB2 1 36 ALA H . . 4.080 3.118 2.831 3.383 . 0 0 "[ . 1 . 2]" 1
685 1 35 TRP HB2 1 89 VAL MG1 . . 4.300 3.608 3.163 4.132 . 0 0 "[ . 1 . 2]" 1
686 1 35 TRP HB2 1 98 LEU MD1 . . 4.580 3.284 2.982 3.512 . 0 0 "[ . 1 . 2]" 1
687 1 35 TRP HB2 1 98 LEU MD2 . . 3.670 1.963 1.794 2.187 . 0 0 "[ . 1 . 2]" 1
688 1 35 TRP HB3 1 35 TRP HE3 . . 3.980 2.433 2.408 2.468 . 0 0 "[ . 1 . 2]" 1
689 1 35 TRP HB3 1 36 ALA H . . 4.410 4.034 3.821 4.201 . 0 0 "[ . 1 . 2]" 1
690 1 35 TRP HB3 1 89 VAL MG1 . . 4.290 3.321 3.149 3.616 . 0 0 "[ . 1 . 2]" 1
691 1 35 TRP HB3 1 98 LEU MD2 . . 3.890 2.788 2.537 3.130 . 0 0 "[ . 1 . 2]" 1
692 1 35 TRP HB3 1 102 LEU MD2 . . 4.620 4.299 3.836 4.622 0.002 19 0 "[ . 1 . 2]" 1
693 1 35 TRP HD1 1 36 ALA H . . 4.730 4.387 4.247 4.513 . 0 0 "[ . 1 . 2]" 1
694 1 35 TRP HD1 1 98 LEU MD2 . . 4.530 3.280 2.823 3.610 . 0 0 "[ . 1 . 2]" 1
695 1 35 TRP HD1 1 102 LEU MD1 . . 5.230 4.430 4.108 4.674 . 0 0 "[ . 1 . 2]" 1
696 1 35 TRP HE1 1 102 LEU MD1 . . 4.390 3.676 3.244 4.060 . 0 0 "[ . 1 . 2]" 1
697 1 35 TRP HE3 1 40 ALA MB . . 3.870 2.455 2.040 2.923 . 0 0 "[ . 1 . 2]" 1
698 1 35 TRP HE3 1 41 LEU H . . 4.490 3.094 2.630 3.746 . 0 0 "[ . 1 . 2]" 1
699 1 35 TRP HE3 1 41 LEU HA . . 4.240 3.271 3.092 3.490 . 0 0 "[ . 1 . 2]" 1
700 1 35 TRP HE3 1 41 LEU HB2 . . 4.660 4.073 3.785 4.458 . 0 0 "[ . 1 . 2]" 1
701 1 35 TRP HE3 1 41 LEU MD1 . . 4.290 3.585 3.154 3.771 . 0 0 "[ . 1 . 2]" 1
702 1 35 TRP HE3 1 41 LEU MD2 . . 3.750 3.218 2.605 3.717 . 0 0 "[ . 1 . 2]" 1
703 1 35 TRP HE3 1 41 LEU HG . . 3.510 2.141 2.027 2.323 . 0 0 "[ . 1 . 2]" 1
704 1 35 TRP HE3 1 102 LEU MD2 . . 4.610 2.852 2.478 3.259 . 0 0 "[ . 1 . 2]" 1
705 1 35 TRP HH2 1 40 ALA MB . . 4.950 4.417 4.008 4.953 0.003 11 0 "[ . 1 . 2]" 1
706 1 35 TRP HH2 1 41 LEU HA . . 4.960 4.806 4.545 4.956 . 0 0 "[ . 1 . 2]" 1
707 1 35 TRP HH2 1 44 LEU HB2 . . 5.000 3.406 3.080 3.736 . 0 0 "[ . 1 . 2]" 1
708 1 35 TRP HH2 1 44 LEU MD1 . . 3.970 3.440 2.974 3.700 . 0 0 "[ . 1 . 2]" 1
709 1 35 TRP HH2 1 44 LEU MD2 . . 4.250 2.946 2.670 3.183 . 0 0 "[ . 1 . 2]" 1
710 1 35 TRP HH2 1 102 LEU MD2 . . 4.530 2.806 2.236 3.095 . 0 0 "[ . 1 . 2]" 1
711 1 35 TRP HZ2 1 102 LEU MD1 . . 4.340 3.040 2.687 3.658 . 0 0 "[ . 1 . 2]" 1
712 1 35 TRP HZ2 1 102 LEU MD2 . . 5.160 3.924 3.502 4.263 . 0 0 "[ . 1 . 2]" 1
713 1 35 TRP HZ3 1 40 ALA MB . . 4.190 3.471 3.178 4.031 . 0 0 "[ . 1 . 2]" 1
714 1 35 TRP HZ3 1 41 LEU H . . 4.830 4.183 3.755 4.776 . 0 0 "[ . 1 . 2]" 1
715 1 35 TRP HZ3 1 41 LEU HA . . 3.540 2.561 2.237 2.850 . 0 0 "[ . 1 . 2]" 1
716 1 35 TRP HZ3 1 41 LEU MD1 . . 4.780 4.686 4.355 4.784 0.004 11 0 "[ . 1 . 2]" 1
717 1 35 TRP HZ3 1 41 LEU MD2 . . 3.680 2.747 2.117 3.267 . 0 0 "[ . 1 . 2]" 1
718 1 35 TRP HZ3 1 41 LEU HG . . 4.620 3.278 2.809 3.623 . 0 0 "[ . 1 . 2]" 1
719 1 35 TRP HZ3 1 44 LEU H . . 4.930 4.645 4.278 4.934 0.004 16 0 "[ . 1 . 2]" 1
720 1 35 TRP HZ3 1 44 LEU HB2 . . 4.750 3.372 3.055 3.691 . 0 0 "[ . 1 . 2]" 1
721 1 35 TRP HZ3 1 44 LEU MD1 . . 4.920 4.248 3.900 4.535 . 0 0 "[ . 1 . 2]" 1
722 1 35 TRP HZ3 1 44 LEU MD2 . . 4.540 2.529 2.118 2.861 . 0 0 "[ . 1 . 2]" 1
723 1 35 TRP HZ3 1 102 LEU MD2 . . 4.600 2.337 2.100 2.739 . 0 0 "[ . 1 . 2]" 1
724 1 36 ALA H 1 36 ALA MB . . 2.780 2.170 2.023 2.253 . 0 0 "[ . 1 . 2]" 1
725 1 36 ALA H 1 37 ASP H . . 3.250 2.952 2.684 3.259 0.009 11 0 "[ . 1 . 2]" 1
726 1 36 ALA H 1 89 VAL MG1 . . 4.470 4.279 3.759 4.473 0.003 2 0 "[ . 1 . 2]" 1
727 1 36 ALA HA 1 89 VAL MG1 . . 3.490 2.714 2.235 2.987 . 0 0 "[ . 1 . 2]" 1
728 1 36 ALA HA 1 90 VAL H . . 5.250 4.143 3.862 4.400 . 0 0 "[ . 1 . 2]" 1
729 1 36 ALA MB 1 37 ASP H . . 3.760 2.760 2.240 3.693 . 0 0 "[ . 1 . 2]" 1
730 1 36 ALA MB 1 37 ASP QB . . 4.940 4.359 4.054 4.901 . 0 0 "[ . 1 . 2]" 1
731 1 36 ALA MB 1 90 VAL H . . 5.160 4.689 4.278 5.118 . 0 0 "[ . 1 . 2]" 1
732 1 36 ALA MB 1 90 VAL HA . . 3.770 2.432 2.101 2.865 . 0 0 "[ . 1 . 2]" 1
733 1 36 ALA MB 1 90 VAL HB . . 5.200 4.780 4.519 5.136 . 0 0 "[ . 1 . 2]" 1
734 1 36 ALA MB 1 91 ALA H . . 5.180 4.768 4.533 5.124 . 0 0 "[ . 1 . 2]" 1
735 1 36 ALA MB 1 92 GLY H . . 4.910 3.990 3.390 4.610 . 0 0 "[ . 1 . 2]" 1
736 1 37 ASP H 1 38 GLY H . . 3.100 2.752 1.800 3.096 . 0 0 "[ . 1 . 2]" 1
737 1 37 ASP QB 1 38 GLY H . . 4.350 2.766 2.205 3.480 . 0 0 "[ . 1 . 2]" 1
738 1 37 ASP QB 1 63 ALA MB . . 3.880 3.828 3.689 3.889 0.009 9 0 "[ . 1 . 2]" 1
739 1 37 ASP HB2 1 38 GLY H . . 4.970 3.152 2.236 4.208 . 0 0 "[ . 1 . 2]" 1
740 1 37 ASP HB3 1 38 GLY H . . 4.970 3.546 2.348 4.163 . 0 0 "[ . 1 . 2]" 1
741 1 38 GLY H 1 40 ALA H . . 5.140 3.321 3.107 3.556 . 0 0 "[ . 1 . 2]" 1
742 1 38 GLY H 1 41 LEU MD1 . . 5.500 5.141 4.529 5.502 0.002 19 0 "[ . 1 . 2]" 1
743 1 38 GLY H 1 63 ALA MB . . 5.070 5.021 4.857 5.077 0.007 19 0 "[ . 1 . 2]" 1
744 1 38 GLY H 1 66 ALA MB . . 4.780 4.762 4.668 4.786 0.006 2 0 "[ . 1 . 2]" 1
745 1 38 GLY H 1 67 THR H . . 5.500 5.470 5.383 5.508 0.008 19 0 "[ . 1 . 2]" 1
746 1 38 GLY H 1 67 THR HG1 . . 4.580 4.481 4.217 4.585 0.005 19 0 "[ . 1 . 2]" 1
747 1 38 GLY H 1 90 VAL MG2 . . 4.260 4.029 3.375 4.263 0.003 2 0 "[ . 1 . 2]" 1
748 1 38 GLY HA2 1 40 ALA MB . . 5.490 4.391 4.163 4.647 . 0 0 "[ . 1 . 2]" 1
749 1 38 GLY HA2 1 41 LEU H . . 4.530 4.011 3.871 4.246 . 0 0 "[ . 1 . 2]" 1
750 1 38 GLY HA2 1 41 LEU HB2 . . 4.630 3.799 3.578 3.910 . 0 0 "[ . 1 . 2]" 1
751 1 38 GLY HA2 1 41 LEU HB3 . . 5.500 5.440 5.209 5.512 0.012 20 0 "[ . 1 . 2]" 1
752 1 38 GLY HA2 1 41 LEU MD1 . . 4.420 3.859 3.424 4.358 . 0 0 "[ . 1 . 2]" 1
753 1 38 GLY HA2 1 66 ALA MB . . 3.740 3.482 3.020 3.738 . 0 0 "[ . 1 . 2]" 1
754 1 38 GLY HA2 1 67 THR H . . 3.880 3.365 3.062 3.531 . 0 0 "[ . 1 . 2]" 1
755 1 38 GLY HA2 1 67 THR HG1 . . 4.160 2.511 2.248 2.795 . 0 0 "[ . 1 . 2]" 1
756 1 38 GLY HA2 1 90 VAL MG2 . . 3.750 3.386 3.024 3.745 . 0 0 "[ . 1 . 2]" 1
757 1 38 GLY HA3 1 41 LEU H . . 5.500 5.217 4.948 5.377 . 0 0 "[ . 1 . 2]" 1
758 1 38 GLY HA3 1 63 ALA MB . . 4.550 4.330 4.084 4.498 . 0 0 "[ . 1 . 2]" 1
759 1 38 GLY HA3 1 64 LEU HA . . 4.710 4.545 4.433 4.693 . 0 0 "[ . 1 . 2]" 1
760 1 38 GLY HA3 1 64 LEU MD1 . . 5.360 5.306 5.113 5.369 0.009 20 0 "[ . 1 . 2]" 1
761 1 38 GLY HA3 1 66 ALA H . . 4.590 4.489 4.296 4.597 0.007 16 0 "[ . 1 . 2]" 1
762 1 38 GLY HA3 1 66 ALA MB . . 3.490 2.328 2.166 2.448 . 0 0 "[ . 1 . 2]" 1
763 1 38 GLY HA3 1 67 THR H . . 3.260 2.727 2.517 3.184 . 0 0 "[ . 1 . 2]" 1
764 1 38 GLY HA3 1 67 THR HG1 . . 4.170 2.459 2.123 3.065 . 0 0 "[ . 1 . 2]" 1
765 1 39 LEU H 1 39 LEU HB2 . . 3.180 2.220 2.178 2.288 . 0 0 "[ . 1 . 2]" 1
766 1 39 LEU H 1 39 LEU HB3 . . 3.570 3.516 3.491 3.550 . 0 0 "[ . 1 . 2]" 1
767 1 39 LEU H 1 39 LEU MD1 . . 3.960 3.633 3.507 3.761 . 0 0 "[ . 1 . 2]" 1
768 1 39 LEU H 1 39 LEU MD2 . . 4.040 3.875 3.806 3.978 . 0 0 "[ . 1 . 2]" 1
769 1 39 LEU H 1 39 LEU HG . . 3.140 2.824 2.689 2.920 . 0 0 "[ . 1 . 2]" 1
770 1 39 LEU H 1 40 ALA H . . 3.420 2.867 2.745 3.000 . 0 0 "[ . 1 . 2]" 1
771 1 39 LEU H 1 40 ALA MB . . 4.770 4.383 4.302 4.507 . 0 0 "[ . 1 . 2]" 1
772 1 39 LEU H 1 41 LEU H . . 5.010 4.898 4.643 4.992 . 0 0 "[ . 1 . 2]" 1
773 1 39 LEU H 1 63 ALA MB . . 5.140 5.107 4.928 5.146 0.006 7 0 "[ . 1 . 2]" 1
774 1 39 LEU H 1 66 ALA MB . . 3.440 3.314 3.016 3.450 0.010 20 0 "[ . 1 . 2]" 1
775 1 39 LEU HA 1 39 LEU MD2 . . 2.970 2.032 1.965 2.152 . 0 0 "[ . 1 . 2]" 1
776 1 39 LEU HA 1 39 LEU HG . . 4.180 2.703 2.618 2.780 . 0 0 "[ . 1 . 2]" 1
777 1 39 LEU HA 1 42 CYS H . . 3.740 3.251 3.111 3.339 . 0 0 "[ . 1 . 2]" 1
778 1 39 LEU HA 1 42 CYS HB2 . . 3.610 2.477 2.293 2.648 . 0 0 "[ . 1 . 2]" 1
779 1 39 LEU HA 1 42 CYS HB3 . . 4.160 3.785 3.651 3.943 . 0 0 "[ . 1 . 2]" 1
780 1 39 LEU HA 1 42 CYS HG . . 3.940 2.827 2.416 3.119 . 0 0 "[ . 1 . 2]" 1
781 1 39 LEU HA 1 43 ALA H . . 4.300 3.936 3.676 4.120 . 0 0 "[ . 1 . 2]" 1
782 1 39 LEU HA 1 66 ALA MB . . 4.620 3.077 2.873 3.297 . 0 0 "[ . 1 . 2]" 1
783 1 39 LEU HB2 1 39 LEU MD1 . . 3.280 2.223 2.100 2.368 . 0 0 "[ . 1 . 2]" 1
784 1 39 LEU HB2 1 40 ALA H . . 3.840 2.685 2.590 2.847 . 0 0 "[ . 1 . 2]" 1
785 1 39 LEU HB2 1 40 ALA MB . . 4.930 4.402 4.331 4.439 . 0 0 "[ . 1 . 2]" 1
786 1 39 LEU HB3 1 39 LEU MD1 . . 3.340 2.462 2.304 2.568 . 0 0 "[ . 1 . 2]" 1
787 1 39 LEU HB3 1 40 ALA H . . 4.170 3.140 3.042 3.326 . 0 0 "[ . 1 . 2]" 1
788 1 39 LEU HB3 1 40 ALA MB . . 5.400 4.622 4.555 4.691 . 0 0 "[ . 1 . 2]" 1
789 1 39 LEU HB3 1 43 ALA H . . 4.980 4.201 4.009 4.370 . 0 0 "[ . 1 . 2]" 1
790 1 39 LEU HB3 1 43 ALA MB . . 4.800 3.988 3.762 4.237 . 0 0 "[ . 1 . 2]" 1
791 1 39 LEU MD1 1 40 ALA H . . 4.870 4.476 4.385 4.577 . 0 0 "[ . 1 . 2]" 1
792 1 39 LEU MD1 1 42 CYS HB2 . . 5.120 5.113 5.072 5.125 0.005 16 0 "[ . 1 . 2]" 1
793 1 39 LEU MD2 1 40 ALA H . . 4.980 4.594 4.495 4.669 . 0 0 "[ . 1 . 2]" 1
794 1 39 LEU MD2 1 42 CYS H . . 4.610 4.470 4.365 4.553 . 0 0 "[ . 1 . 2]" 1
795 1 39 LEU MD2 1 42 CYS HB2 . . 4.170 2.604 2.503 2.810 . 0 0 "[ . 1 . 2]" 1
796 1 39 LEU MD2 1 42 CYS HB3 . . 4.480 3.487 3.406 3.555 . 0 0 "[ . 1 . 2]" 1
797 1 39 LEU MD2 1 42 CYS HG . . 4.400 4.167 3.834 4.367 . 0 0 "[ . 1 . 2]" 1
798 1 40 ALA H 1 40 ALA MB . . 3.110 2.218 2.075 2.273 . 0 0 "[ . 1 . 2]" 1
799 1 40 ALA H 1 41 LEU H . . 3.630 3.252 3.136 3.324 . 0 0 "[ . 1 . 2]" 1
800 1 40 ALA H 1 41 LEU HB2 . . 5.220 5.083 4.989 5.146 . 0 0 "[ . 1 . 2]" 1
801 1 40 ALA H 1 42 CYS H . . 4.840 4.177 4.064 4.332 . 0 0 "[ . 1 . 2]" 1
802 1 40 ALA H 1 43 ALA MB . . 5.380 4.752 4.613 4.961 . 0 0 "[ . 1 . 2]" 1
803 1 40 ALA HA 1 42 CYS H . . 4.890 4.412 4.239 4.604 . 0 0 "[ . 1 . 2]" 1
804 1 40 ALA HA 1 43 ALA H . . 4.110 3.782 3.590 4.045 . 0 0 "[ . 1 . 2]" 1
805 1 40 ALA HA 1 43 ALA MB . . 3.290 3.049 2.872 3.215 . 0 0 "[ . 1 . 2]" 1
806 1 40 ALA MB 1 41 LEU H . . 3.550 2.193 1.989 2.475 . 0 0 "[ . 1 . 2]" 1
807 1 40 ALA MB 1 41 LEU HA . . 4.660 3.698 3.575 3.747 . 0 0 "[ . 1 . 2]" 1
808 1 40 ALA MB 1 41 LEU MD1 . . 5.500 4.314 4.061 4.563 . 0 0 "[ . 1 . 2]" 1
809 1 40 ALA MB 1 41 LEU HG . . 4.860 3.630 3.518 3.729 . 0 0 "[ . 1 . 2]" 1
810 1 40 ALA MB 1 43 ALA H . . 5.030 4.775 4.613 4.997 . 0 0 "[ . 1 . 2]" 1
811 1 40 ALA MB 1 43 ALA MB . . 4.470 4.281 4.161 4.433 . 0 0 "[ . 1 . 2]" 1
812 1 41 LEU H 1 41 LEU HB2 . . 3.240 2.198 2.179 2.217 . 0 0 "[ . 1 . 2]" 1
813 1 41 LEU H 1 41 LEU HB3 . . 3.650 3.504 3.492 3.514 . 0 0 "[ . 1 . 2]" 1
814 1 41 LEU H 1 41 LEU MD1 . . 4.210 3.567 3.314 3.784 . 0 0 "[ . 1 . 2]" 1
815 1 41 LEU H 1 41 LEU MD2 . . 4.240 3.963 3.784 4.096 . 0 0 "[ . 1 . 2]" 1
816 1 41 LEU H 1 41 LEU HG . . 3.500 2.887 2.829 2.954 . 0 0 "[ . 1 . 2]" 1
817 1 41 LEU H 1 42 CYS H . . 3.320 2.740 2.590 2.841 . 0 0 "[ . 1 . 2]" 1
818 1 41 LEU H 1 42 CYS HG . . 4.850 3.877 3.733 4.204 . 0 0 "[ . 1 . 2]" 1
819 1 41 LEU H 1 43 ALA MB . . 5.160 5.094 4.988 5.166 0.006 18 0 "[ . 1 . 2]" 1
820 1 41 LEU H 1 67 THR HA . . 5.500 5.118 4.997 5.241 . 0 0 "[ . 1 . 2]" 1
821 1 41 LEU H 1 70 ALA MB . . 4.610 4.336 4.180 4.475 . 0 0 "[ . 1 . 2]" 1
822 1 41 LEU HA 1 41 LEU MD1 . . 3.830 3.810 3.791 3.824 . 0 0 "[ . 1 . 2]" 1
823 1 41 LEU HA 1 41 LEU MD2 . . 3.180 2.204 1.995 2.470 . 0 0 "[ . 1 . 2]" 1
824 1 41 LEU HA 1 41 LEU HG . . 4.140 2.645 2.502 2.815 . 0 0 "[ . 1 . 2]" 1
825 1 41 LEU HA 1 44 LEU H . . 3.870 3.637 3.500 3.795 . 0 0 "[ . 1 . 2]" 1
826 1 41 LEU HA 1 44 LEU HB2 . . 4.320 3.857 3.650 4.084 . 0 0 "[ . 1 . 2]" 1
827 1 41 LEU HA 1 44 LEU HB3 . . 3.750 2.710 2.617 2.784 . 0 0 "[ . 1 . 2]" 1
828 1 41 LEU HA 1 44 LEU MD1 . . 5.160 5.105 5.011 5.165 0.005 7 0 "[ . 1 . 2]" 1
829 1 41 LEU HA 1 44 LEU MD2 . . 4.150 3.012 2.837 3.327 . 0 0 "[ . 1 . 2]" 1
830 1 41 LEU HA 1 102 LEU MD2 . . 4.540 3.879 3.530 4.178 . 0 0 "[ . 1 . 2]" 1
831 1 41 LEU HB2 1 41 LEU MD1 . . 3.380 2.195 2.013 2.382 . 0 0 "[ . 1 . 2]" 1
832 1 41 LEU HB2 1 42 CYS H . . 3.640 2.867 2.732 2.992 . 0 0 "[ . 1 . 2]" 1
833 1 41 LEU HB2 1 70 ALA MB . . 3.650 2.838 2.755 2.895 . 0 0 "[ . 1 . 2]" 1
834 1 41 LEU HB2 1 71 LEU H . . 5.500 5.345 5.131 5.508 0.008 17 0 "[ . 1 . 2]" 1
835 1 41 LEU HB3 1 41 LEU MD1 . . 3.540 2.490 2.313 2.648 . 0 0 "[ . 1 . 2]" 1
836 1 41 LEU HB3 1 41 LEU MD2 . . 3.330 2.241 2.077 2.354 . 0 0 "[ . 1 . 2]" 1
837 1 41 LEU HB3 1 42 CYS H . . 3.860 3.357 3.190 3.477 . 0 0 "[ . 1 . 2]" 1
838 1 41 LEU HB3 1 45 VAL MG2 . . 3.880 3.258 3.094 3.414 . 0 0 "[ . 1 . 2]" 1
839 1 41 LEU MD1 1 42 CYS H . . 4.810 4.626 4.524 4.759 . 0 0 "[ . 1 . 2]" 1
840 1 41 LEU MD1 1 44 LEU MD2 . . 4.890 4.796 4.578 4.890 . 0 0 "[ . 1 . 2]" 1
841 1 41 LEU MD1 1 67 THR HB . . 4.730 4.595 4.342 4.731 0.001 11 0 "[ . 1 . 2]" 1
842 1 41 LEU MD1 1 70 ALA MB . . 3.750 2.849 2.609 3.155 . 0 0 "[ . 1 . 2]" 1
843 1 41 LEU MD1 1 101 TYR QD . . 4.360 2.921 2.556 3.295 . 0 0 "[ . 1 . 2]" 1
844 1 41 LEU MD1 1 101 TYR QE . . 3.930 2.405 2.013 3.134 . 0 0 "[ . 1 . 2]" 1
845 1 41 LEU MD1 1 102 LEU MD2 . . 4.080 3.734 3.471 4.069 . 0 0 "[ . 1 . 2]" 1
846 1 41 LEU MD2 1 44 LEU MD2 . . 3.930 2.475 2.255 2.662 . 0 0 "[ . 1 . 2]" 1
847 1 41 LEU MD2 1 67 THR HA . . 5.480 5.277 4.869 5.490 0.010 20 0 "[ . 1 . 2]" 1
848 1 41 LEU MD2 1 70 ALA MB . . 3.610 3.042 2.786 3.306 . 0 0 "[ . 1 . 2]" 1
849 1 41 LEU MD2 1 71 LEU H . . 5.350 4.869 4.355 5.312 . 0 0 "[ . 1 . 2]" 1
850 1 41 LEU MD2 1 71 LEU HG . . 4.720 4.094 3.473 4.549 . 0 0 "[ . 1 . 2]" 1
851 1 41 LEU MD2 1 101 TYR QD . . 3.810 2.571 2.132 2.862 . 0 0 "[ . 1 . 2]" 1
852 1 41 LEU MD2 1 101 TYR QE . . 3.370 2.053 1.796 2.454 . 0 0 "[ . 1 . 2]" 1
853 1 41 LEU MD2 1 102 LEU MD2 . . 3.360 2.222 1.911 2.604 . 0 0 "[ . 1 . 2]" 1
854 1 41 LEU HG 1 42 CYS H . . 4.890 4.827 4.774 4.875 . 0 0 "[ . 1 . 2]" 1
855 1 41 LEU HG 1 70 ALA MB . . 4.330 4.333 4.298 4.343 0.013 10 0 "[ . 1 . 2]" 1
856 1 42 CYS H 1 42 CYS HB2 . . 3.230 2.680 2.643 2.711 . 0 0 "[ . 1 . 2]" 1
857 1 42 CYS H 1 42 CYS HB3 . . 3.620 3.581 3.575 3.589 . 0 0 "[ . 1 . 2]" 1
858 1 42 CYS H 1 42 CYS HG . . 3.020 1.961 1.897 2.051 . 0 0 "[ . 1 . 2]" 1
859 1 42 CYS H 1 43 ALA H . . 3.340 2.809 2.641 3.039 . 0 0 "[ . 1 . 2]" 1
860 1 42 CYS H 1 43 ALA MB . . 5.050 4.347 4.216 4.518 . 0 0 "[ . 1 . 2]" 1
861 1 42 CYS H 1 44 LEU H . . 4.690 4.284 3.934 4.526 . 0 0 "[ . 1 . 2]" 1
862 1 42 CYS H 1 70 ALA MB . . 3.980 3.119 2.953 3.406 . 0 0 "[ . 1 . 2]" 1
863 1 42 CYS HA 1 42 CYS HG . . 4.140 3.256 3.026 3.474 . 0 0 "[ . 1 . 2]" 1
864 1 42 CYS HA 1 45 VAL H . . 4.000 3.640 3.242 3.850 . 0 0 "[ . 1 . 2]" 1
865 1 42 CYS HA 1 45 VAL HB . . 3.910 2.967 2.693 3.097 . 0 0 "[ . 1 . 2]" 1
866 1 42 CYS HA 1 45 VAL MG1 . . 4.350 4.261 4.118 4.354 0.004 1 0 "[ . 1 . 2]" 1
867 1 42 CYS HA 1 45 VAL MG2 . . 3.570 3.088 2.740 3.334 . 0 0 "[ . 1 . 2]" 1
868 1 42 CYS HA 1 46 TYR H . . 4.860 3.771 3.502 4.028 . 0 0 "[ . 1 . 2]" 1
869 1 42 CYS HA 1 69 TRP HE3 . . 4.670 2.848 2.618 3.142 . 0 0 "[ . 1 . 2]" 1
870 1 42 CYS HA 1 69 TRP HH2 . . 5.500 4.372 4.260 4.540 . 0 0 "[ . 1 . 2]" 1
871 1 42 CYS HA 1 69 TRP HZ3 . . 4.120 2.016 1.992 2.126 . 0 0 "[ . 1 . 2]" 1
872 1 42 CYS HA 1 70 ALA H . . 4.690 4.200 3.932 4.591 . 0 0 "[ . 1 . 2]" 1
873 1 42 CYS HA 1 70 ALA MB . . 3.460 2.543 2.350 2.886 . 0 0 "[ . 1 . 2]" 1
874 1 42 CYS HB2 1 43 ALA H . . 3.840 2.339 2.125 2.528 . 0 0 "[ . 1 . 2]" 1
875 1 42 CYS HB2 1 58 LEU MD2 . . 4.970 3.283 3.004 3.487 . 0 0 "[ . 1 . 2]" 1
876 1 42 CYS HB2 1 66 ALA MB . . 4.570 4.267 3.935 4.574 0.004 6 0 "[ . 1 . 2]" 1
877 1 42 CYS HB3 1 43 ALA H . . 3.780 3.591 3.381 3.780 0.000 8 0 "[ . 1 . 2]" 1
878 1 42 CYS HB3 1 46 TYR QD . . 4.980 2.746 2.261 3.375 . 0 0 "[ . 1 . 2]" 1
879 1 42 CYS HB3 1 46 TYR QE . . 5.050 2.062 1.996 2.464 . 0 0 "[ . 1 . 2]" 1
880 1 42 CYS HB3 1 58 LEU QB . . 5.230 4.224 3.812 4.531 . 0 0 "[ . 1 . 2]" 1
881 1 42 CYS HB3 1 58 LEU MD1 . . 4.710 4.595 4.357 4.720 0.010 3 0 "[ . 1 . 2]" 1
882 1 42 CYS HB3 1 58 LEU MD2 . . 3.940 2.361 2.035 2.586 . 0 0 "[ . 1 . 2]" 1
883 1 42 CYS HB3 1 66 ALA MB . . 5.500 4.363 4.056 4.707 . 0 0 "[ . 1 . 2]" 1
884 1 42 CYS HB3 1 69 TRP HZ3 . . 5.480 3.166 3.036 3.312 . 0 0 "[ . 1 . 2]" 1
885 1 42 CYS HB3 1 70 ALA MB . . 4.990 4.008 3.730 4.461 . 0 0 "[ . 1 . 2]" 1
886 1 42 CYS HG 1 45 VAL MG2 . . 5.500 5.191 5.007 5.453 . 0 0 "[ . 1 . 2]" 1
887 1 42 CYS HG 1 58 LEU MD2 . . 5.500 3.492 3.180 3.710 . 0 0 "[ . 1 . 2]" 1
888 1 42 CYS HG 1 66 ALA MB . . 3.880 3.083 2.821 3.316 . 0 0 "[ . 1 . 2]" 1
889 1 42 CYS HG 1 70 ALA H . . 4.950 4.125 3.842 4.460 . 0 0 "[ . 1 . 2]" 1
890 1 42 CYS HG 1 70 ALA MB . . 3.780 2.698 2.409 3.012 . 0 0 "[ . 1 . 2]" 1
891 1 43 ALA H 1 43 ALA MB . . 2.920 2.107 2.026 2.199 . 0 0 "[ . 1 . 2]" 1
892 1 43 ALA H 1 44 LEU H . . 3.400 2.827 2.669 2.941 . 0 0 "[ . 1 . 2]" 1
893 1 43 ALA H 1 44 LEU HB2 . . 5.500 5.405 5.273 5.501 0.001 18 0 "[ . 1 . 2]" 1
894 1 43 ALA H 1 44 LEU HB3 . . 4.980 4.779 4.628 4.918 . 0 0 "[ . 1 . 2]" 1
895 1 43 ALA H 1 45 VAL HB . . 5.500 5.365 5.214 5.500 . 0 0 "[ . 1 . 2]" 1
896 1 43 ALA HA 1 46 TYR QD . . 4.430 2.965 2.342 3.331 . 0 0 "[ . 1 . 2]" 1
897 1 43 ALA HA 1 55 PRO HG3 . . 5.150 4.799 4.583 5.034 . 0 0 "[ . 1 . 2]" 1
898 1 43 ALA MB 1 44 LEU H . . 3.370 2.530 2.353 2.853 . 0 0 "[ . 1 . 2]" 1
899 1 43 ALA MB 1 44 LEU HA . . 4.640 3.713 3.663 3.805 . 0 0 "[ . 1 . 2]" 1
900 1 43 ALA MB 1 44 LEU HB2 . . 4.850 4.211 4.118 4.273 . 0 0 "[ . 1 . 2]" 1
901 1 43 ALA MB 1 44 LEU HB3 . . 4.780 4.458 4.361 4.566 . 0 0 "[ . 1 . 2]" 1
902 1 43 ALA MB 1 46 TYR QB . . 4.660 4.186 4.007 4.407 . 0 0 "[ . 1 . 2]" 1
903 1 43 ALA MB 1 47 ARG H . . 4.850 4.381 4.196 4.615 . 0 0 "[ . 1 . 2]" 1
904 1 44 LEU H 1 44 LEU HB2 . . 3.220 2.678 2.636 2.811 . 0 0 "[ . 1 . 2]" 1
905 1 44 LEU H 1 44 LEU HB3 . . 3.280 2.348 2.274 2.380 . 0 0 "[ . 1 . 2]" 1
906 1 44 LEU H 1 44 LEU MD1 . . 4.520 4.192 4.142 4.272 . 0 0 "[ . 1 . 2]" 1
907 1 44 LEU H 1 44 LEU MD2 . . 4.340 4.128 4.074 4.196 . 0 0 "[ . 1 . 2]" 1
908 1 44 LEU H 1 44 LEU HG . . 4.390 4.371 4.304 4.398 0.008 19 0 "[ . 1 . 2]" 1
909 1 44 LEU H 1 45 VAL H . . 3.450 2.790 2.500 2.932 . 0 0 "[ . 1 . 2]" 1
910 1 44 LEU H 1 45 VAL HB . . 5.390 5.016 4.694 5.146 . 0 0 "[ . 1 . 2]" 1
911 1 44 LEU H 1 45 VAL MG2 . . 4.820 4.352 4.135 4.444 . 0 0 "[ . 1 . 2]" 1
912 1 44 LEU H 1 47 ARG QB . . 5.340 4.711 4.482 4.831 . 0 0 "[ . 1 . 2]" 1
913 1 44 LEU HA 1 44 LEU MD1 . . 3.230 2.293 2.161 2.622 . 0 0 "[ . 1 . 2]" 1
914 1 44 LEU HA 1 44 LEU MD2 . . 4.040 3.986 3.964 4.015 . 0 0 "[ . 1 . 2]" 1
915 1 44 LEU HA 1 44 LEU HG . . 4.060 3.182 3.109 3.250 . 0 0 "[ . 1 . 2]" 1
916 1 44 LEU HA 1 47 ARG H . . 4.370 4.118 3.935 4.340 . 0 0 "[ . 1 . 2]" 1
917 1 44 LEU HA 1 47 ARG HB2 . . 4.410 3.612 2.782 4.265 . 0 0 "[ . 1 . 2]" 1
918 1 44 LEU HA 1 47 ARG QB . . 3.850 3.010 2.742 3.351 . 0 0 "[ . 1 . 2]" 1
919 1 44 LEU HA 1 47 ARG HB3 . . 4.410 3.646 2.916 4.383 . 0 0 "[ . 1 . 2]" 1
920 1 44 LEU HA 1 48 LEU MD1 . . 5.010 4.190 3.829 4.483 . 0 0 "[ . 1 . 2]" 1
921 1 44 LEU HA 1 48 LEU MD2 . . 5.500 5.209 4.895 5.500 . 0 0 "[ . 1 . 2]" 1
922 1 44 LEU HB2 1 44 LEU MD1 . . 3.510 2.268 2.106 2.329 . 0 0 "[ . 1 . 2]" 1
923 1 44 LEU HB2 1 44 LEU MD2 . . 3.550 2.544 2.423 2.611 . 0 0 "[ . 1 . 2]" 1
924 1 44 LEU HB2 1 45 VAL H . . 4.060 3.956 3.881 4.037 . 0 0 "[ . 1 . 2]" 1
925 1 44 LEU HB2 1 48 LEU MD1 . . 5.030 4.652 4.245 5.028 . 0 0 "[ . 1 . 2]" 1
926 1 44 LEU HB3 1 44 LEU MD2 . . 3.320 2.124 2.031 2.276 . 0 0 "[ . 1 . 2]" 1
927 1 44 LEU HB3 1 45 VAL H . . 3.390 2.601 2.481 2.732 . 0 0 "[ . 1 . 2]" 1
928 1 44 LEU HB3 1 46 TYR H . . 5.350 5.348 5.301 5.358 0.008 1 0 "[ . 1 . 2]" 1
929 1 44 LEU HB3 1 105 PHE QE . . 5.500 4.882 4.515 5.306 . 0 0 "[ . 1 . 2]" 1
930 1 44 LEU MD1 1 45 VAL H . . 4.470 4.433 4.404 4.471 0.001 1 0 "[ . 1 . 2]" 1
931 1 44 LEU MD1 1 47 ARG QB . . 4.730 4.076 3.780 4.382 . 0 0 "[ . 1 . 2]" 1
932 1 44 LEU MD1 1 48 LEU MD1 . . 3.980 2.298 1.973 2.883 . 0 0 "[ . 1 . 2]" 1
933 1 44 LEU MD1 1 48 LEU HG . . 4.050 2.699 2.267 2.999 . 0 0 "[ . 1 . 2]" 1
934 1 44 LEU MD1 1 102 LEU MD2 . . 4.230 3.980 3.690 4.170 . 0 0 "[ . 1 . 2]" 1
935 1 44 LEU MD1 1 105 PHE HB2 . . 4.640 3.867 3.371 4.152 . 0 0 "[ . 1 . 2]" 1
936 1 44 LEU MD1 1 105 PHE QD . . 4.830 3.328 2.962 3.801 . 0 0 "[ . 1 . 2]" 1
937 1 44 LEU MD2 1 45 VAL H . . 4.320 3.891 3.683 4.103 . 0 0 "[ . 1 . 2]" 1
938 1 44 LEU MD2 1 48 LEU MD1 . . 4.320 3.045 2.903 3.374 . 0 0 "[ . 1 . 2]" 1
939 1 44 LEU MD2 1 102 LEU HA . . 4.640 3.631 3.460 3.799 . 0 0 "[ . 1 . 2]" 1
940 1 44 LEU MD2 1 102 LEU HB3 . . 4.160 3.885 3.665 4.052 . 0 0 "[ . 1 . 2]" 1
941 1 44 LEU MD2 1 102 LEU MD2 . . 3.470 2.433 2.181 2.729 . 0 0 "[ . 1 . 2]" 1
942 1 44 LEU MD2 1 105 PHE HB2 . . 4.290 2.882 2.528 3.118 . 0 0 "[ . 1 . 2]" 1
943 1 44 LEU MD2 1 105 PHE HB3 . . 4.310 2.752 2.457 3.141 . 0 0 "[ . 1 . 2]" 1
944 1 44 LEU MD2 1 105 PHE QD . . 4.480 2.537 2.325 2.784 . 0 0 "[ . 1 . 2]" 1
945 1 44 LEU MD2 1 105 PHE QE . . 3.850 3.172 2.789 3.496 . 0 0 "[ . 1 . 2]" 1
946 1 44 LEU MD2 1 105 PHE HZ . . 4.280 3.982 3.701 4.273 . 0 0 "[ . 1 . 2]" 1
947 1 44 LEU HG 1 45 VAL H . . 4.900 3.390 3.287 3.490 . 0 0 "[ . 1 . 2]" 1
948 1 44 LEU HG 1 48 LEU MD1 . . 3.820 2.191 1.928 2.578 . 0 0 "[ . 1 . 2]" 1
949 1 44 LEU HG 1 105 PHE QE . . 4.930 3.640 3.224 4.254 . 0 0 "[ . 1 . 2]" 1
950 1 45 VAL H 1 45 VAL HB . . 3.120 2.518 2.489 2.560 . 0 0 "[ . 1 . 2]" 1
951 1 45 VAL H 1 45 VAL MG1 . . 3.860 3.764 3.762 3.770 . 0 0 "[ . 1 . 2]" 1
952 1 45 VAL H 1 45 VAL MG2 . . 3.100 2.303 2.131 2.421 . 0 0 "[ . 1 . 2]" 1
953 1 45 VAL H 1 46 TYR H . . 3.380 2.827 2.707 2.968 . 0 0 "[ . 1 . 2]" 1
954 1 45 VAL H 1 46 TYR QB . . 4.750 4.538 4.387 4.727 . 0 0 "[ . 1 . 2]" 1
955 1 45 VAL H 1 47 ARG H . . 4.970 4.236 3.983 4.438 . 0 0 "[ . 1 . 2]" 1
956 1 45 VAL H 1 78 LEU MD1 . . 5.090 4.708 4.435 4.968 . 0 0 "[ . 1 . 2]" 1
957 1 45 VAL HA 1 45 VAL MG1 . . 3.270 2.432 2.396 2.451 . 0 0 "[ . 1 . 2]" 1
958 1 45 VAL HA 1 45 VAL MG2 . . 3.270 2.327 2.282 2.433 . 0 0 "[ . 1 . 2]" 1
959 1 45 VAL HA 1 48 LEU H . . 4.060 3.871 3.619 4.045 . 0 0 "[ . 1 . 2]" 1
960 1 45 VAL HA 1 48 LEU HB2 . . 3.860 2.749 2.525 2.922 . 0 0 "[ . 1 . 2]" 1
961 1 45 VAL HA 1 48 LEU HB3 . . 4.500 4.263 3.959 4.453 . 0 0 "[ . 1 . 2]" 1
962 1 45 VAL HA 1 48 LEU MD1 . . 4.000 2.487 2.080 2.775 . 0 0 "[ . 1 . 2]" 1
963 1 45 VAL HA 1 78 LEU MD1 . . 3.670 2.571 2.176 2.828 . 0 0 "[ . 1 . 2]" 1
964 1 45 VAL HA 1 78 LEU MD2 . . 4.400 3.940 3.618 4.221 . 0 0 "[ . 1 . 2]" 1
965 1 45 VAL HA 1 105 PHE QE . . 4.680 3.264 2.914 3.635 . 0 0 "[ . 1 . 2]" 1
966 1 45 VAL HB 1 46 TYR H . . 3.480 2.165 2.071 2.270 . 0 0 "[ . 1 . 2]" 1
967 1 45 VAL HB 1 46 TYR QB . . 5.170 4.315 4.243 4.402 . 0 0 "[ . 1 . 2]" 1
968 1 45 VAL HB 1 46 TYR QD . . 4.670 4.149 3.747 4.310 . 0 0 "[ . 1 . 2]" 1
969 1 45 VAL HB 1 46 TYR QE . . 5.500 4.978 4.649 5.226 . 0 0 "[ . 1 . 2]" 1
970 1 45 VAL HB 1 48 LEU MD1 . . 5.260 5.103 4.718 5.267 0.007 14 0 "[ . 1 . 2]" 1
971 1 45 VAL HB 1 69 TRP HH2 . . 5.080 2.945 2.676 3.173 . 0 0 "[ . 1 . 2]" 1
972 1 45 VAL HB 1 69 TRP HZ3 . . 4.990 2.110 1.997 2.249 . 0 0 "[ . 1 . 2]" 1
973 1 45 VAL HB 1 73 VAL MG1 . . 4.580 4.006 3.928 4.150 . 0 0 "[ . 1 . 2]" 1
974 1 45 VAL HB 1 78 LEU MD1 . . 4.880 4.307 4.030 4.583 . 0 0 "[ . 1 . 2]" 1
975 1 45 VAL MG1 1 46 TYR H . . 3.870 3.087 2.908 3.183 . 0 0 "[ . 1 . 2]" 1
976 1 45 VAL MG1 1 46 TYR HA . . 3.900 3.355 3.154 3.424 . 0 0 "[ . 1 . 2]" 1
977 1 45 VAL MG1 1 46 TYR QB . . 5.160 4.521 4.410 4.586 . 0 0 "[ . 1 . 2]" 1
978 1 45 VAL MG1 1 48 LEU H . . 5.180 4.987 4.779 5.147 . 0 0 "[ . 1 . 2]" 1
979 1 45 VAL MG1 1 48 LEU HB2 . . 4.140 3.922 3.807 4.077 . 0 0 "[ . 1 . 2]" 1
980 1 45 VAL MG1 1 49 GLN H . . 5.010 4.201 3.969 4.458 . 0 0 "[ . 1 . 2]" 1
981 1 45 VAL MG1 1 52 LEU HB2 . . 4.810 4.379 4.165 4.579 . 0 0 "[ . 1 . 2]" 1
982 1 45 VAL MG1 1 69 TRP HH2 . . 4.050 2.426 2.196 2.625 . 0 0 "[ . 1 . 2]" 1
983 1 45 VAL MG1 1 69 TRP HZ2 . . 4.490 3.639 3.417 3.821 . 0 0 "[ . 1 . 2]" 1
984 1 45 VAL MG1 1 69 TRP HZ3 . . 4.890 2.926 2.758 3.043 . 0 0 "[ . 1 . 2]" 1
985 1 45 VAL MG1 1 70 ALA H . . 5.500 5.408 5.295 5.502 0.002 14 0 "[ . 1 . 2]" 1
986 1 45 VAL MG1 1 70 ALA HA . . 4.020 3.231 3.016 3.357 . 0 0 "[ . 1 . 2]" 1
987 1 45 VAL MG1 1 70 ALA MB . . 4.340 3.956 3.862 4.042 . 0 0 "[ . 1 . 2]" 1
988 1 45 VAL MG1 1 73 VAL H . . 4.600 4.399 4.214 4.586 . 0 0 "[ . 1 . 2]" 1
989 1 45 VAL MG1 1 73 VAL HA . . 4.750 4.443 4.271 4.593 . 0 0 "[ . 1 . 2]" 1
990 1 45 VAL MG1 1 73 VAL HB . . 3.820 2.411 2.195 2.686 . 0 0 "[ . 1 . 2]" 1
991 1 45 VAL MG1 1 73 VAL MG1 . . 3.260 1.839 1.792 1.975 . 0 0 "[ . 1 . 2]" 1
992 1 45 VAL MG1 1 73 VAL MG2 . . 3.880 3.409 3.228 3.552 . 0 0 "[ . 1 . 2]" 1
993 1 45 VAL MG1 1 74 ALA H . . 4.140 3.534 3.281 3.750 . 0 0 "[ . 1 . 2]" 1
994 1 45 VAL MG1 1 74 ALA MB . . 3.520 2.801 2.537 2.984 . 0 0 "[ . 1 . 2]" 1
995 1 45 VAL MG1 1 78 LEU HB2 . . 5.040 4.678 4.453 4.884 . 0 0 "[ . 1 . 2]" 1
996 1 45 VAL MG1 1 105 PHE HZ . . 4.790 4.598 4.256 4.791 0.001 13 0 "[ . 1 . 2]" 1
997 1 45 VAL MG2 1 46 TYR H . . 3.900 3.683 3.639 3.734 . 0 0 "[ . 1 . 2]" 1
998 1 45 VAL MG2 1 46 TYR QB . . 5.500 5.321 5.273 5.377 . 0 0 "[ . 1 . 2]" 1
999 1 45 VAL MG2 1 46 TYR QD . . 5.500 5.142 4.854 5.301 . 0 0 "[ . 1 . 2]" 1
1000 1 45 VAL MG2 1 69 TRP HE3 . . 5.500 4.146 3.877 4.332 . 0 0 "[ . 1 . 2]" 1
1001 1 45 VAL MG2 1 69 TRP HH2 . . 5.180 4.320 4.082 4.533 . 0 0 "[ . 1 . 2]" 1
1002 1 45 VAL MG2 1 69 TRP HZ3 . . 5.030 3.193 2.899 3.439 . 0 0 "[ . 1 . 2]" 1
1003 1 45 VAL MG2 1 70 ALA H . . 4.880 4.699 4.488 4.853 . 0 0 "[ . 1 . 2]" 1
1004 1 45 VAL MG2 1 70 ALA HA . . 3.720 2.632 2.367 2.799 . 0 0 "[ . 1 . 2]" 1
1005 1 45 VAL MG2 1 70 ALA MB . . 3.350 2.087 1.954 2.312 . 0 0 "[ . 1 . 2]" 1
1006 1 45 VAL MG2 1 71 LEU H . . 5.040 4.701 4.559 4.864 . 0 0 "[ . 1 . 2]" 1
1007 1 45 VAL MG2 1 73 VAL H . . 5.380 5.104 4.916 5.338 . 0 0 "[ . 1 . 2]" 1
1008 1 45 VAL MG2 1 73 VAL HB . . 4.420 3.853 3.581 4.020 . 0 0 "[ . 1 . 2]" 1
1009 1 45 VAL MG2 1 73 VAL MG1 . . 3.800 3.661 3.545 3.806 0.006 7 0 "[ . 1 . 2]" 1
1010 1 45 VAL MG2 1 73 VAL MG2 . . 5.180 4.909 4.673 5.011 . 0 0 "[ . 1 . 2]" 1
1011 1 45 VAL MG2 1 74 ALA H . . 4.320 3.692 3.500 3.872 . 0 0 "[ . 1 . 2]" 1
1012 1 45 VAL MG2 1 74 ALA HA . . 4.470 3.555 3.415 3.819 . 0 0 "[ . 1 . 2]" 1
1013 1 45 VAL MG2 1 74 ALA MB . . 3.330 2.018 1.938 2.220 . 0 0 "[ . 1 . 2]" 1
1014 1 45 VAL MG2 1 105 PHE QD . . 4.760 3.853 3.628 4.092 . 0 0 "[ . 1 . 2]" 1
1015 1 45 VAL MG2 1 105 PHE QE . . 4.110 2.224 2.008 2.606 . 0 0 "[ . 1 . 2]" 1
1016 1 45 VAL MG2 1 105 PHE HZ . . 3.730 3.014 2.673 3.262 . 0 0 "[ . 1 . 2]" 1
1017 1 46 TYR H 1 46 TYR QB . . 2.930 2.374 2.277 2.471 . 0 0 "[ . 1 . 2]" 1
1018 1 46 TYR H 1 46 TYR QD . . 3.780 2.990 2.675 3.174 . 0 0 "[ . 1 . 2]" 1
1019 1 46 TYR H 1 46 TYR QE . . 5.110 4.582 4.407 4.804 . 0 0 "[ . 1 . 2]" 1
1020 1 46 TYR H 1 47 ARG H . . 3.610 2.974 2.876 3.088 . 0 0 "[ . 1 . 2]" 1
1021 1 46 TYR H 1 48 LEU H . . 4.950 4.692 4.532 4.776 . 0 0 "[ . 1 . 2]" 1
1022 1 46 TYR H 1 48 LEU HB2 . . 5.230 5.120 4.963 5.239 0.009 3 0 "[ . 1 . 2]" 1
1023 1 46 TYR HA 1 46 TYR QD . . 3.450 2.331 2.209 2.597 . 0 0 "[ . 1 . 2]" 1
1024 1 46 TYR HA 1 46 TYR QE . . 4.950 4.343 4.257 4.458 . 0 0 "[ . 1 . 2]" 1
1025 1 46 TYR HA 1 49 GLN H . . 4.190 3.882 3.739 4.062 . 0 0 "[ . 1 . 2]" 1
1026 1 46 TYR HA 1 52 LEU HB2 . . 4.370 3.715 3.590 3.857 . 0 0 "[ . 1 . 2]" 1
1027 1 46 TYR HA 1 52 LEU HB3 . . 4.700 4.408 4.294 4.526 . 0 0 "[ . 1 . 2]" 1
1028 1 46 TYR HA 1 52 LEU MD1 . . 4.420 3.845 3.631 4.073 . 0 0 "[ . 1 . 2]" 1
1029 1 46 TYR HA 1 52 LEU MD2 . . 5.470 5.480 5.416 5.495 0.025 18 0 "[ . 1 . 2]" 1
1030 1 46 TYR HA 1 69 TRP HZ2 . . 4.720 4.369 4.217 4.540 . 0 0 "[ . 1 . 2]" 1
1031 1 46 TYR QB 1 47 ARG H . . 3.500 2.399 2.263 2.573 . 0 0 "[ . 1 . 2]" 1
1032 1 46 TYR QB 1 47 ARG QB . . 5.340 3.938 3.734 4.202 . 0 0 "[ . 1 . 2]" 1
1033 1 46 TYR QB 1 48 LEU H . . 4.970 4.902 4.788 4.979 0.009 2 0 "[ . 1 . 2]" 1
1034 1 46 TYR QB 1 53 LEU MD1 . . 5.500 5.274 5.182 5.392 . 0 0 "[ . 1 . 2]" 1
1035 1 46 TYR QB 1 53 LEU MD2 . . 5.500 5.460 5.375 5.515 0.015 3 0 "[ . 1 . 2]" 1
1036 1 46 TYR QB 1 55 PRO HG3 . . 5.000 4.007 3.697 4.262 . 0 0 "[ . 1 . 2]" 1
1037 1 46 TYR QD 1 47 ARG H . . 4.460 4.300 4.187 4.440 . 0 0 "[ . 1 . 2]" 1
1038 1 46 TYR QD 1 50 PRO HA . . 5.500 5.330 5.053 5.505 0.005 7 0 "[ . 1 . 2]" 1
1039 1 46 TYR QD 1 52 LEU H . . 5.500 5.402 5.235 5.507 0.007 14 0 "[ . 1 . 2]" 1
1040 1 46 TYR QD 1 52 LEU HB2 . . 4.260 3.869 3.613 4.273 0.013 14 0 "[ . 1 . 2]" 1
1041 1 46 TYR QD 1 52 LEU HB3 . . 4.250 3.781 3.667 4.070 . 0 0 "[ . 1 . 2]" 1
1042 1 46 TYR QD 1 53 LEU H . . 5.460 5.158 5.008 5.295 . 0 0 "[ . 1 . 2]" 1
1043 1 46 TYR QD 1 53 LEU MD1 . . 4.770 3.261 3.164 3.411 . 0 0 "[ . 1 . 2]" 1
1044 1 46 TYR QD 1 53 LEU QD . . 3.870 3.088 3.028 3.184 . 0 0 "[ . 1 . 2]" 1
1045 1 46 TYR QD 1 53 LEU MD2 . . 4.770 3.823 3.756 3.888 . 0 0 "[ . 1 . 2]" 1
1046 1 46 TYR QD 1 54 GLU HA . . 4.240 3.040 2.534 3.187 . 0 0 "[ . 1 . 2]" 1
1047 1 46 TYR QD 1 54 GLU QG . . 5.330 4.405 4.097 5.396 0.066 14 0 "[ . 1 . 2]" 1
1048 1 46 TYR QD 1 55 PRO HD2 . . 4.820 4.291 3.888 4.415 . 0 0 "[ . 1 . 2]" 1
1049 1 46 TYR QD 1 55 PRO HD3 . . 5.080 3.024 2.727 3.127 . 0 0 "[ . 1 . 2]" 1
1050 1 46 TYR QD 1 55 PRO HG2 . . 5.480 4.870 4.536 4.995 . 0 0 "[ . 1 . 2]" 1
1051 1 46 TYR QD 1 55 PRO HG3 . . 4.310 3.320 2.899 3.483 . 0 0 "[ . 1 . 2]" 1
1052 1 46 TYR QD 1 58 LEU MD1 . . 5.500 5.269 5.064 5.504 0.004 18 0 "[ . 1 . 2]" 1
1053 1 46 TYR QD 1 58 LEU MD2 . . 4.610 3.926 3.559 4.308 . 0 0 "[ . 1 . 2]" 1
1054 1 46 TYR QD 1 73 VAL MG2 . . 5.500 4.947 4.860 5.207 . 0 0 "[ . 1 . 2]" 1
1055 1 46 TYR QE 1 52 LEU HB2 . . 5.450 5.022 4.774 5.285 . 0 0 "[ . 1 . 2]" 1
1056 1 46 TYR QE 1 52 LEU HB3 . . 4.240 4.026 3.738 4.256 0.016 20 0 "[ . 1 . 2]" 1
1057 1 46 TYR QE 1 52 LEU MD2 . . 4.990 4.828 4.471 4.995 0.005 13 0 "[ . 1 . 2]" 1
1058 1 46 TYR QE 1 53 LEU H . . 4.940 4.582 4.309 4.965 0.025 18 0 "[ . 1 . 2]" 1
1059 1 46 TYR QE 1 53 LEU HG . . 5.130 4.153 4.004 4.360 . 0 0 "[ . 1 . 2]" 1
1060 1 46 TYR QE 1 54 GLU HA . . 3.920 2.978 2.688 3.153 . 0 0 "[ . 1 . 2]" 1
1061 1 46 TYR QE 1 54 GLU QB . . 5.340 4.661 4.342 4.806 . 0 0 "[ . 1 . 2]" 1
1062 1 46 TYR QE 1 54 GLU QG . . 5.500 4.823 4.657 5.154 . 0 0 "[ . 1 . 2]" 1
1063 1 46 TYR QE 1 55 PRO HD2 . . 4.540 4.387 4.195 4.497 . 0 0 "[ . 1 . 2]" 1
1064 1 46 TYR QE 1 55 PRO HD3 . . 4.600 3.181 3.035 3.300 . 0 0 "[ . 1 . 2]" 1
1065 1 46 TYR QE 1 55 PRO HG3 . . 5.300 3.535 3.078 3.871 . 0 0 "[ . 1 . 2]" 1
1066 1 46 TYR QE 1 58 LEU MD1 . . 4.690 3.472 3.268 3.759 . 0 0 "[ . 1 . 2]" 1
1067 1 46 TYR QE 1 58 LEU MD2 . . 4.560 2.051 1.834 2.408 . 0 0 "[ . 1 . 2]" 1
1068 1 46 TYR QE 1 69 TRP HD1 . . 5.500 5.500 5.416 5.538 0.038 18 0 "[ . 1 . 2]" 1
1069 1 46 TYR QE 1 69 TRP HE1 . . 4.270 3.851 3.772 4.039 . 0 0 "[ . 1 . 2]" 1
1070 1 46 TYR QE 1 73 VAL MG2 . . 5.370 4.031 3.955 4.218 . 0 0 "[ . 1 . 2]" 1
1071 1 47 ARG H 1 47 ARG HB2 . . 3.480 2.320 2.178 2.690 . 0 0 "[ . 1 . 2]" 1
1072 1 47 ARG H 1 47 ARG QB . . 2.990 2.200 2.124 2.250 . 0 0 "[ . 1 . 2]" 1
1073 1 47 ARG H 1 47 ARG HB3 . . 3.480 3.012 2.380 3.521 0.041 19 0 "[ . 1 . 2]" 1
1074 1 47 ARG H 1 47 ARG QD . . 4.500 3.971 2.018 4.531 0.031 17 0 "[ . 1 . 2]" 1
1075 1 47 ARG H 1 47 ARG HG2 . . 4.870 4.016 2.770 4.630 . 0 0 "[ . 1 . 2]" 1
1076 1 47 ARG H 1 47 ARG QG . . 4.260 3.599 2.701 4.046 . 0 0 "[ . 1 . 2]" 1
1077 1 47 ARG H 1 47 ARG HG3 . . 4.870 4.174 3.622 4.559 . 0 0 "[ . 1 . 2]" 1
1078 1 47 ARG H 1 48 LEU H . . 3.410 2.962 2.726 3.073 . 0 0 "[ . 1 . 2]" 1
1079 1 47 ARG H 1 48 LEU MD1 . . 5.500 5.433 5.261 5.502 0.002 9 0 "[ . 1 . 2]" 1
1080 1 47 ARG HA 1 47 ARG QD . . 3.120 2.808 2.191 3.173 0.053 13 0 "[ . 1 . 2]" 1
1081 1 47 ARG HA 1 47 ARG QG . . 3.740 2.533 2.167 2.846 . 0 0 "[ . 1 . 2]" 1
1082 1 47 ARG QB 1 47 ARG QD . . 3.150 2.207 2.050 2.564 . 0 0 "[ . 1 . 2]" 1
1083 1 47 ARG QB 1 48 LEU H . . 3.650 2.211 2.037 2.361 . 0 0 "[ . 1 . 2]" 1
1084 1 47 ARG QB 1 48 LEU MD1 . . 5.340 4.721 4.595 4.941 . 0 0 "[ . 1 . 2]" 1
1085 1 47 ARG QB 1 48 LEU MD2 . . 5.110 4.564 4.296 4.870 . 0 0 "[ . 1 . 2]" 1
1086 1 47 ARG HB2 1 47 ARG QD . . 3.680 2.667 2.074 3.390 . 0 0 "[ . 1 . 2]" 1
1087 1 47 ARG HB2 1 48 LEU H . . 4.340 3.113 2.420 3.811 . 0 0 "[ . 1 . 2]" 1
1088 1 47 ARG HB3 1 47 ARG QD . . 3.680 2.872 2.114 3.474 . 0 0 "[ . 1 . 2]" 1
1089 1 47 ARG HB3 1 48 LEU H . . 4.340 2.418 2.050 2.864 . 0 0 "[ . 1 . 2]" 1
1090 1 48 LEU H 1 48 LEU HB2 . . 3.250 2.372 2.268 2.477 . 0 0 "[ . 1 . 2]" 1
1091 1 48 LEU H 1 48 LEU HB3 . . 3.670 3.585 3.543 3.610 . 0 0 "[ . 1 . 2]" 1
1092 1 48 LEU H 1 48 LEU MD1 . . 3.910 3.563 3.436 3.681 . 0 0 "[ . 1 . 2]" 1
1093 1 48 LEU H 1 48 LEU MD2 . . 3.970 3.739 3.603 3.843 . 0 0 "[ . 1 . 2]" 1
1094 1 48 LEU H 1 48 LEU HG . . 3.140 2.580 2.373 2.738 . 0 0 "[ . 1 . 2]" 1
1095 1 48 LEU H 1 49 GLN H . . 3.220 3.018 2.937 3.202 . 0 0 "[ . 1 . 2]" 1
1096 1 48 LEU HA 1 48 LEU MD1 . . 4.150 3.834 3.817 3.862 . 0 0 "[ . 1 . 2]" 1
1097 1 48 LEU HA 1 48 LEU MD2 . . 2.910 2.162 1.989 2.356 . 0 0 "[ . 1 . 2]" 1
1098 1 48 LEU HA 1 48 LEU HG . . 3.880 2.739 2.669 2.830 . 0 0 "[ . 1 . 2]" 1
1099 1 48 LEU HA 1 109 PHE QE . . 5.480 4.806 3.812 5.406 . 0 0 "[ . 1 . 2]" 1
1100 1 48 LEU HB2 1 48 LEU MD1 . . 3.330 2.268 2.145 2.345 . 0 0 "[ . 1 . 2]" 1
1101 1 48 LEU HB2 1 48 LEU MD2 . . 3.580 3.175 3.163 3.186 . 0 0 "[ . 1 . 2]" 1
1102 1 48 LEU HB2 1 49 GLN H . . 3.830 2.716 2.432 2.865 . 0 0 "[ . 1 . 2]" 1
1103 1 48 LEU HB2 1 109 PHE QD . . 5.500 5.420 5.225 5.501 0.001 12 0 "[ . 1 . 2]" 1
1104 1 48 LEU HB3 1 48 LEU MD1 . . 3.330 2.449 2.349 2.528 . 0 0 "[ . 1 . 2]" 1
1105 1 48 LEU HB3 1 48 LEU MD2 . . 3.330 2.250 2.142 2.363 . 0 0 "[ . 1 . 2]" 1
1106 1 48 LEU HB3 1 49 GLN H . . 4.150 3.300 2.858 3.487 . 0 0 "[ . 1 . 2]" 1
1107 1 48 LEU MD1 1 49 GLN H . . 4.870 4.535 4.231 4.667 . 0 0 "[ . 1 . 2]" 1
1108 1 48 LEU MD1 1 105 PHE HA . . 4.540 3.895 3.688 4.103 . 0 0 "[ . 1 . 2]" 1
1109 1 48 LEU MD1 1 105 PHE HB2 . . 4.280 4.202 3.981 4.284 0.004 13 0 "[ . 1 . 2]" 1
1110 1 48 LEU MD1 1 105 PHE HB3 . . 4.830 2.736 2.490 2.841 . 0 0 "[ . 1 . 2]" 1
1111 1 48 LEU MD1 1 105 PHE QD . . 3.730 1.927 1.837 2.149 . 0 0 "[ . 1 . 2]" 1
1112 1 48 LEU MD1 1 105 PHE QE . . 4.100 3.006 2.779 3.292 . 0 0 "[ . 1 . 2]" 1
1113 1 48 LEU MD1 1 109 PHE HB2 . . 4.600 3.648 3.367 3.958 . 0 0 "[ . 1 . 2]" 1
1114 1 48 LEU MD1 1 109 PHE QB . . 3.850 3.453 3.224 3.720 . 0 0 "[ . 1 . 2]" 1
1115 1 48 LEU MD1 1 109 PHE HB3 . . 4.600 4.272 4.054 4.530 . 0 0 "[ . 1 . 2]" 1
1116 1 48 LEU MD1 1 109 PHE QD . . 3.990 3.234 2.535 3.632 . 0 0 "[ . 1 . 2]" 1
1117 1 48 LEU MD1 1 109 PHE QE . . 4.280 3.290 2.342 3.813 . 0 0 "[ . 1 . 2]" 1
1118 1 48 LEU MD2 1 49 GLN H . . 5.100 4.658 4.444 4.776 . 0 0 "[ . 1 . 2]" 1
1119 1 48 LEU MD2 1 106 HIS HA . . 5.330 4.802 4.531 5.077 . 0 0 "[ . 1 . 2]" 1
1120 1 48 LEU MD2 1 109 PHE H . . 5.080 4.594 4.311 5.077 . 0 0 "[ . 1 . 2]" 1
1121 1 48 LEU MD2 1 109 PHE HB2 . . 3.860 2.616 2.187 3.056 . 0 0 "[ . 1 . 2]" 1
1122 1 48 LEU MD2 1 109 PHE QB . . 3.290 2.275 1.943 2.559 . 0 0 "[ . 1 . 2]" 1
1123 1 48 LEU MD2 1 109 PHE HB3 . . 3.860 2.510 2.176 2.824 . 0 0 "[ . 1 . 2]" 1
1124 1 48 LEU MD2 1 109 PHE QD . . 3.690 2.349 2.070 2.682 . 0 0 "[ . 1 . 2]" 1
1125 1 48 LEU MD2 1 109 PHE QE . . 5.370 3.029 2.409 3.321 . 0 0 "[ . 1 . 2]" 1
1126 1 48 LEU HG 1 109 PHE QD . . 5.500 4.876 4.475 5.118 . 0 0 "[ . 1 . 2]" 1
1127 1 49 GLN H 1 49 GLN HB2 . . 3.780 2.753 2.410 3.208 . 0 0 "[ . 1 . 2]" 1
1128 1 49 GLN H 1 49 GLN QB . . 3.140 2.544 2.374 2.647 . 0 0 "[ . 1 . 2]" 1
1129 1 49 GLN H 1 49 GLN HB3 . . 3.780 3.235 2.695 3.713 . 0 0 "[ . 1 . 2]" 1
1130 1 49 GLN H 1 49 GLN HG2 . . 4.790 4.549 4.300 4.719 . 0 0 "[ . 1 . 2]" 1
1131 1 49 GLN H 1 49 GLN HG3 . . 4.790 4.235 3.518 4.801 0.011 4 0 "[ . 1 . 2]" 1
1132 1 49 GLN H 1 50 PRO HD2 . . 4.630 4.477 4.363 4.611 . 0 0 "[ . 1 . 2]" 1
1133 1 49 GLN H 1 50 PRO HD3 . . 4.330 3.954 3.758 4.199 . 0 0 "[ . 1 . 2]" 1
1134 1 49 GLN H 1 52 LEU HB2 . . 5.020 4.869 4.733 4.988 . 0 0 "[ . 1 . 2]" 1
1135 1 49 GLN H 1 52 LEU MD1 . . 5.460 4.109 3.844 4.274 . 0 0 "[ . 1 . 2]" 1
1136 1 49 GLN H 1 78 LEU MD2 . . 4.750 4.181 3.869 4.743 . 0 0 "[ . 1 . 2]" 1
1137 1 49 GLN QB 1 49 GLN QE . . 3.410 2.240 1.856 3.190 . 0 0 "[ . 1 . 2]" 1
1138 1 49 GLN QB 1 50 PRO HD2 . . 4.220 3.854 3.487 4.023 . 0 0 "[ . 1 . 2]" 1
1139 1 49 GLN QB 1 52 LEU H . . 3.960 2.951 2.583 3.589 . 0 0 "[ . 1 . 2]" 1
1140 1 49 GLN QB 1 52 LEU HB2 . . 4.100 2.988 2.641 3.472 . 0 0 "[ . 1 . 2]" 1
1141 1 49 GLN QB 1 52 LEU HB3 . . 4.880 4.461 4.164 4.854 . 0 0 "[ . 1 . 2]" 1
1142 1 49 GLN QB 1 52 LEU MD1 . . 3.140 2.026 1.820 2.328 . 0 0 "[ . 1 . 2]" 1
1143 1 49 GLN QB 1 52 LEU HG . . 4.360 3.452 3.049 3.903 . 0 0 "[ . 1 . 2]" 1
1144 1 49 GLN QB 1 78 LEU MD2 . . 4.120 2.828 2.402 3.252 . 0 0 "[ . 1 . 2]" 1
1145 1 49 GLN HB2 1 50 PRO HD2 . . 4.910 4.548 4.179 4.768 . 0 0 "[ . 1 . 2]" 1
1146 1 49 GLN HB2 1 52 LEU MD1 . . 3.830 2.653 1.993 3.315 . 0 0 "[ . 1 . 2]" 1
1147 1 49 GLN HB3 1 50 PRO HD2 . . 4.910 4.230 3.614 4.642 . 0 0 "[ . 1 . 2]" 1
1148 1 49 GLN HB3 1 52 LEU MD1 . . 3.830 2.198 1.913 2.711 . 0 0 "[ . 1 . 2]" 1
1149 1 49 GLN QE 1 50 PRO HD2 . . 5.340 5.224 4.753 5.355 0.015 20 0 "[ . 1 . 2]" 1
1150 1 49 GLN QE 1 52 LEU MD1 . . 3.970 2.248 1.824 2.635 . 0 0 "[ . 1 . 2]" 1
1151 1 49 GLN QE 1 52 LEU MD2 . . 4.270 3.615 3.110 4.281 0.011 20 0 "[ . 1 . 2]" 1
1152 1 49 GLN QE 1 52 LEU HG . . 3.790 2.645 1.757 3.800 0.010 18 0 "[ . 1 . 2]" 1
1153 1 49 GLN QE 1 73 VAL MG1 . . 4.750 4.324 3.997 4.699 . 0 0 "[ . 1 . 2]" 1
1154 1 49 GLN QE 1 78 LEU MD2 . . 5.110 3.503 2.436 4.576 . 0 0 "[ . 1 . 2]" 1
1155 1 49 GLN HE21 1 73 VAL MG1 . . 5.500 4.986 4.426 5.502 0.002 20 0 "[ . 1 . 2]" 1
1156 1 49 GLN HE22 1 73 VAL MG1 . . 5.500 4.810 4.355 5.504 0.004 4 0 "[ . 1 . 2]" 1
1157 1 49 GLN QG 1 50 PRO HD2 . . 4.050 3.238 2.848 3.600 . 0 0 "[ . 1 . 2]" 1
1158 1 49 GLN QG 1 52 LEU MD1 . . 4.020 3.256 2.836 3.815 . 0 0 "[ . 1 . 2]" 1
1159 1 49 GLN QG 1 78 LEU MD2 . . 4.390 3.495 2.636 4.361 . 0 0 "[ . 1 . 2]" 1
1160 1 49 GLN HG2 1 52 LEU MD1 . . 4.840 3.650 2.937 4.661 . 0 0 "[ . 1 . 2]" 1
1161 1 49 GLN HG2 1 78 LEU MD2 . . 5.090 4.517 3.928 5.093 0.003 17 0 "[ . 1 . 2]" 1
1162 1 49 GLN HG3 1 52 LEU MD1 . . 4.840 3.814 3.248 4.217 . 0 0 "[ . 1 . 2]" 1
1163 1 49 GLN HG3 1 78 LEU MD2 . . 5.090 3.674 2.678 4.741 . 0 0 "[ . 1 . 2]" 1
1164 1 50 PRO HA 1 51 GLY H . . 3.460 3.419 3.345 3.510 0.050 11 0 "[ . 1 . 2]" 1
1165 1 50 PRO HA 1 52 LEU H . . 4.600 4.254 3.964 4.511 . 0 0 "[ . 1 . 2]" 1
1166 1 50 PRO HD2 1 51 GLY H . . 4.700 2.796 2.656 2.935 . 0 0 "[ . 1 . 2]" 1
1167 1 50 PRO QG 1 51 GLY H . . 4.010 2.860 2.460 3.144 . 0 0 "[ . 1 . 2]" 1
1168 1 51 GLY H 1 52 LEU H . . 3.400 2.563 2.313 2.892 . 0 0 "[ . 1 . 2]" 1
1169 1 52 LEU H 1 52 LEU HB2 . . 3.140 2.228 2.161 2.329 . 0 0 "[ . 1 . 2]" 1
1170 1 52 LEU H 1 52 LEU MD1 . . 3.660 3.298 3.139 3.447 . 0 0 "[ . 1 . 2]" 1
1171 1 52 LEU H 1 52 LEU HG . . 3.210 2.899 2.634 3.096 . 0 0 "[ . 1 . 2]" 1
1172 1 52 LEU HA 1 52 LEU MD1 . . 4.130 3.802 3.776 3.839 . 0 0 "[ . 1 . 2]" 1
1173 1 52 LEU HA 1 52 LEU MD2 . . 3.130 2.577 2.509 2.623 . 0 0 "[ . 1 . 2]" 1
1174 1 52 LEU HA 1 52 LEU HG . . 4.070 2.517 2.459 2.607 . 0 0 "[ . 1 . 2]" 1
1175 1 52 LEU HA 1 53 LEU H . . 3.050 2.321 2.292 2.372 . 0 0 "[ . 1 . 2]" 1
1176 1 52 LEU HB2 1 52 LEU MD1 . . 3.330 2.110 1.968 2.176 . 0 0 "[ . 1 . 2]" 1
1177 1 52 LEU HB2 1 53 LEU H . . 4.010 3.985 3.845 4.075 0.065 18 0 "[ . 1 . 2]" 1
1178 1 52 LEU HB2 1 69 TRP HH2 . . 5.310 4.691 4.512 4.912 . 0 0 "[ . 1 . 2]" 1
1179 1 52 LEU HB2 1 69 TRP HZ2 . . 4.990 4.341 4.099 4.707 . 0 0 "[ . 1 . 2]" 1
1180 1 52 LEU HB3 1 52 LEU MD2 . . 2.940 2.030 2.006 2.068 . 0 0 "[ . 1 . 2]" 1
1181 1 52 LEU HB3 1 53 LEU H . . 3.610 2.680 2.510 2.793 . 0 0 "[ . 1 . 2]" 1
1182 1 52 LEU HB3 1 69 TRP HE1 . . 5.500 5.067 4.830 5.495 . 0 0 "[ . 1 . 2]" 1
1183 1 52 LEU HB3 1 69 TRP HH2 . . 4.750 4.381 4.250 4.519 . 0 0 "[ . 1 . 2]" 1
1184 1 52 LEU HB3 1 69 TRP HZ2 . . 4.390 3.141 2.915 3.456 . 0 0 "[ . 1 . 2]" 1
1185 1 52 LEU HB3 1 73 VAL MG1 . . 4.070 3.018 2.858 3.191 . 0 0 "[ . 1 . 2]" 1
1186 1 52 LEU HB3 1 73 VAL MG2 . . 4.530 3.693 3.494 3.969 . 0 0 "[ . 1 . 2]" 1
1187 1 52 LEU MD1 1 69 TRP HH2 . . 4.530 4.005 3.765 4.334 . 0 0 "[ . 1 . 2]" 1
1188 1 52 LEU MD1 1 69 TRP HZ2 . . 4.660 3.896 3.604 4.281 . 0 0 "[ . 1 . 2]" 1
1189 1 52 LEU MD1 1 73 VAL HB . . 4.780 4.087 3.839 4.263 . 0 0 "[ . 1 . 2]" 1
1190 1 52 LEU MD1 1 73 VAL MG1 . . 3.560 1.760 1.649 1.876 . 0 0 "[ . 1 . 2]" 1
1191 1 52 LEU MD1 1 73 VAL MG2 . . 4.520 3.496 3.359 3.682 . 0 0 "[ . 1 . 2]" 1
1192 1 52 LEU MD1 1 77 GLU H . . 4.910 4.162 3.941 4.650 . 0 0 "[ . 1 . 2]" 1
1193 1 52 LEU MD1 1 77 GLU HB3 . . 4.270 2.639 2.291 3.020 . 0 0 "[ . 1 . 2]" 1
1194 1 52 LEU MD1 1 77 GLU QG . . 4.050 2.103 1.915 3.397 . 0 0 "[ . 1 . 2]" 1
1195 1 52 LEU MD1 1 78 LEU H . . 4.950 3.886 3.653 4.133 . 0 0 "[ . 1 . 2]" 1
1196 1 52 LEU MD1 1 78 LEU HG . . 4.980 3.745 3.433 3.959 . 0 0 "[ . 1 . 2]" 1
1197 1 52 LEU MD2 1 53 LEU H . . 3.920 2.930 2.790 3.159 . 0 0 "[ . 1 . 2]" 1
1198 1 52 LEU MD2 1 69 TRP HZ2 . . 4.820 3.452 3.185 3.685 . 0 0 "[ . 1 . 2]" 1
1199 1 52 LEU MD2 1 73 VAL HA . . 5.010 3.683 3.518 3.873 . 0 0 "[ . 1 . 2]" 1
1200 1 52 LEU MD2 1 73 VAL MG2 . . 3.460 2.648 2.419 2.849 . 0 0 "[ . 1 . 2]" 1
1201 1 52 LEU MD2 1 77 GLU H . . 5.260 4.199 4.012 4.447 . 0 0 "[ . 1 . 2]" 1
1202 1 52 LEU MD2 1 77 GLU HB2 . . 3.090 3.018 2.843 3.099 0.009 10 0 "[ . 1 . 2]" 1
1203 1 52 LEU MD2 1 77 GLU QG . . 3.390 1.894 1.753 2.313 . 0 0 "[ . 1 . 2]" 1
1204 1 53 LEU H 1 53 LEU HB2 . . 3.900 3.569 3.535 3.581 . 0 0 "[ . 1 . 2]" 1
1205 1 53 LEU H 1 53 LEU QB . . 3.420 2.333 2.229 2.359 . 0 0 "[ . 1 . 2]" 1
1206 1 53 LEU H 1 53 LEU HB3 . . 3.900 2.365 2.253 2.393 . 0 0 "[ . 1 . 2]" 1
1207 1 53 LEU H 1 53 LEU MD1 . . 4.650 1.824 1.799 1.935 . 0 0 "[ . 1 . 2]" 1
1208 1 53 LEU H 1 53 LEU QD . . 3.980 1.820 1.796 1.931 . 0 0 "[ . 1 . 2]" 1
1209 1 53 LEU H 1 53 LEU MD2 . . 4.650 3.884 3.830 3.990 . 0 0 "[ . 1 . 2]" 1
1210 1 53 LEU H 1 53 LEU HG . . 3.760 3.540 3.469 3.766 0.006 18 0 "[ . 1 . 2]" 1
1211 1 53 LEU H 1 54 GLU H . . 4.690 4.611 4.576 4.650 . 0 0 "[ . 1 . 2]" 1
1212 1 53 LEU H 1 69 TRP HZ2 . . 4.890 4.558 4.377 4.804 . 0 0 "[ . 1 . 2]" 1
1213 1 53 LEU HA 1 53 LEU MD1 . . 3.840 3.297 3.263 3.381 . 0 0 "[ . 1 . 2]" 1
1214 1 53 LEU HA 1 53 LEU QD . . 3.180 3.037 3.015 3.052 . 0 0 "[ . 1 . 2]" 1
1215 1 53 LEU HA 1 53 LEU MD2 . . 3.840 3.555 3.451 3.596 . 0 0 "[ . 1 . 2]" 1
1216 1 53 LEU HA 1 54 GLU H . . 3.000 2.541 2.382 2.625 . 0 0 "[ . 1 . 2]" 1
1217 1 53 LEU QB 1 54 GLU H . . 3.770 2.204 2.065 2.544 . 0 0 "[ . 1 . 2]" 1
1218 1 53 LEU QB 1 73 VAL MG2 . . 5.340 5.108 4.917 5.325 . 0 0 "[ . 1 . 2]" 1
1219 1 53 LEU QD 1 54 GLU H . . 4.220 2.405 2.303 2.591 . 0 0 "[ . 1 . 2]" 1
1220 1 53 LEU QD 1 54 GLU HA . . 4.630 2.878 2.754 3.040 . 0 0 "[ . 1 . 2]" 1
1221 1 53 LEU QD 1 54 GLU QG . . 4.250 4.055 3.467 4.264 0.014 10 0 "[ . 1 . 2]" 1
1222 1 53 LEU QD 1 69 TRP HD1 . . 4.800 3.734 3.576 4.064 . 0 0 "[ . 1 . 2]" 1
1223 1 53 LEU QD 1 69 TRP HE1 . . 4.280 1.915 1.823 2.209 . 0 0 "[ . 1 . 2]" 1
1224 1 53 LEU QD 1 69 TRP HZ2 . . 4.730 1.887 1.857 1.921 . 0 0 "[ . 1 . 2]" 1
1225 1 53 LEU MD1 1 54 GLU QG . . 5.300 4.989 4.717 5.172 . 0 0 "[ . 1 . 2]" 1
1226 1 53 LEU MD2 1 54 GLU QG . . 5.300 4.307 3.537 4.556 . 0 0 "[ . 1 . 2]" 1
1227 1 53 LEU HG 1 54 GLU H . . 5.000 4.371 4.202 4.590 . 0 0 "[ . 1 . 2]" 1
1228 1 53 LEU HG 1 69 TRP HZ2 . . 4.810 4.394 4.272 4.471 . 0 0 "[ . 1 . 2]" 1
1229 1 53 LEU HG 1 73 VAL MG2 . . 5.500 4.252 4.089 4.544 . 0 0 "[ . 1 . 2]" 1
1230 1 54 GLU H 1 54 GLU HB2 . . 3.780 2.522 2.326 3.691 . 0 0 "[ . 1 . 2]" 1
1231 1 54 GLU H 1 54 GLU QB . . 3.210 2.419 2.298 2.971 . 0 0 "[ . 1 . 2]" 1
1232 1 54 GLU H 1 54 GLU HB3 . . 3.780 3.548 3.068 3.718 . 0 0 "[ . 1 . 2]" 1
1233 1 54 GLU H 1 54 GLU QG . . 3.940 3.148 1.884 3.750 . 0 0 "[ . 1 . 2]" 1
1234 1 54 GLU HA 1 55 PRO HD2 . . 3.160 2.477 2.407 2.534 . 0 0 "[ . 1 . 2]" 1
1235 1 54 GLU HA 1 55 PRO HD3 . . 3.270 2.331 2.299 2.360 . 0 0 "[ . 1 . 2]" 1
1236 1 54 GLU HA 1 55 PRO HG2 . . 4.990 4.575 4.517 4.623 . 0 0 "[ . 1 . 2]" 1
1237 1 54 GLU HA 1 55 PRO HG3 . . 5.220 4.519 4.475 4.557 . 0 0 "[ . 1 . 2]" 1
1238 1 54 GLU HA 1 69 TRP HH2 . . 5.500 5.519 5.503 5.542 0.042 18 0 "[ . 1 . 2]" 1
1239 1 54 GLU HA 1 69 TRP HZ2 . . 5.280 5.201 5.078 5.273 . 0 0 "[ . 1 . 2]" 1
1240 1 54 GLU QB 1 55 PRO HD2 . . 4.200 1.983 1.943 2.030 . 0 0 "[ . 1 . 2]" 1
1241 1 54 GLU QB 1 55 PRO HD3 . . 3.970 3.351 3.254 3.396 . 0 0 "[ . 1 . 2]" 1
1242 1 54 GLU HB2 1 55 PRO HD2 . . 4.780 3.431 1.964 3.637 . 0 0 "[ . 1 . 2]" 1
1243 1 54 GLU HB2 1 55 PRO HD3 . . 4.760 4.556 3.418 4.712 . 0 0 "[ . 1 . 2]" 1
1244 1 54 GLU HB3 1 55 PRO HD2 . . 4.780 2.110 1.988 3.185 . 0 0 "[ . 1 . 2]" 1
1245 1 54 GLU HB3 1 55 PRO HD3 . . 4.760 3.512 3.433 4.178 . 0 0 "[ . 1 . 2]" 1
1246 1 54 GLU QG 1 55 PRO HD3 . . 4.710 3.776 3.187 4.797 0.087 20 0 "[ . 1 . 2]" 1
1247 1 55 PRO HA 1 58 LEU H . . 3.990 2.908 2.734 3.489 . 0 0 "[ . 1 . 2]" 1
1248 1 55 PRO HA 1 58 LEU MD2 . . 4.350 3.239 2.825 3.694 . 0 0 "[ . 1 . 2]" 1
1249 1 55 PRO QB 1 56 SER H . . 4.110 3.780 3.737 3.895 . 0 0 "[ . 1 . 2]" 1
1250 1 55 PRO QB 1 58 LEU H . . 4.650 3.561 3.474 3.707 . 0 0 "[ . 1 . 2]" 1
1251 1 55 PRO QB 1 58 LEU MD2 . . 4.440 2.498 2.332 2.624 . 0 0 "[ . 1 . 2]" 1
1252 1 55 PRO HD3 1 58 LEU MD2 . . 4.780 4.782 4.702 4.798 0.018 12 0 "[ . 1 . 2]" 1
1253 1 55 PRO HG3 1 58 LEU MD1 . . 5.500 5.397 5.054 5.509 0.009 3 0 "[ . 1 . 2]" 1
1254 1 55 PRO HG3 1 58 LEU MD2 . . 4.860 4.376 4.239 4.612 . 0 0 "[ . 1 . 2]" 1
1255 1 56 SER H 1 56 SER QB . . 3.880 2.458 2.185 2.769 . 0 0 "[ . 1 . 2]" 1
1256 1 56 SER HA 1 58 LEU H . . 5.070 4.861 4.765 5.071 0.001 1 0 "[ . 1 . 2]" 1
1257 1 56 SER HA 1 59 GLN H . . 4.900 4.153 4.008 4.506 . 0 0 "[ . 1 . 2]" 1
1258 1 56 SER HA 1 59 GLN QB . . 4.470 3.747 3.082 4.252 . 0 0 "[ . 1 . 2]" 1
1259 1 56 SER HA 1 59 GLN QE . . 5.250 4.001 1.871 5.079 . 0 0 "[ . 1 . 2]" 1
1260 1 56 SER HA 1 59 GLN QG . . 4.150 3.385 2.762 4.049 . 0 0 "[ . 1 . 2]" 1
1261 1 56 SER QB 1 57 GLU H . . 4.420 2.876 2.606 3.463 . 0 0 "[ . 1 . 2]" 1
1262 1 57 GLU H 1 57 GLU HB3 . . 3.670 3.619 3.121 3.728 0.058 8 0 "[ . 1 . 2]" 1
1263 1 57 GLU H 1 57 GLU HG2 . . 4.380 3.139 1.897 4.008 . 0 0 "[ . 1 . 2]" 1
1264 1 57 GLU H 1 57 GLU QG . . 3.720 2.540 1.784 3.218 . 0 0 "[ . 1 . 2]" 1
1265 1 57 GLU H 1 57 GLU HG3 . . 4.380 3.098 2.170 4.197 . 0 0 "[ . 1 . 2]" 1
1266 1 57 GLU H 1 58 LEU H . . 3.310 2.351 1.985 2.574 . 0 0 "[ . 1 . 2]" 1
1267 1 57 GLU HA 1 57 GLU HG2 . . 3.910 3.060 2.392 3.674 . 0 0 "[ . 1 . 2]" 1
1268 1 57 GLU HA 1 57 GLU QG . . 3.330 2.656 2.319 3.239 . 0 0 "[ . 1 . 2]" 1
1269 1 57 GLU HA 1 57 GLU HG3 . . 3.910 3.245 2.413 3.847 . 0 0 "[ . 1 . 2]" 1
1270 1 57 GLU HA 1 59 GLN H . . 4.290 3.858 3.598 4.274 . 0 0 "[ . 1 . 2]" 1
1271 1 57 GLU HB2 1 58 LEU H . . 4.750 2.576 2.457 2.951 . 0 0 "[ . 1 . 2]" 1
1272 1 57 GLU HB2 1 58 LEU MD1 . . 4.580 2.906 2.824 2.992 . 0 0 "[ . 1 . 2]" 1
1273 1 57 GLU HB2 1 58 LEU MD2 . . 5.500 5.423 5.328 5.538 0.038 3 0 "[ . 1 . 2]" 1
1274 1 57 GLU HB2 1 61 LEU MD1 . . 4.490 3.215 2.458 3.550 . 0 0 "[ . 1 . 2]" 1
1275 1 57 GLU HB2 1 61 LEU HG . . 4.660 4.359 3.449 4.676 0.016 20 0 "[ . 1 . 2]" 1
1276 1 57 GLU HB3 1 58 LEU H . . 3.880 3.685 3.486 3.919 0.039 3 0 "[ . 1 . 2]" 1
1277 1 57 GLU HB3 1 58 LEU MD1 . . 4.610 4.029 3.781 4.210 . 0 0 "[ . 1 . 2]" 1
1278 1 57 GLU QG 1 61 LEU MD1 . . 4.740 4.585 3.720 4.755 0.015 10 0 "[ . 1 . 2]" 1
1279 1 58 LEU H 1 58 LEU QB . . 2.930 2.223 2.179 2.376 . 0 0 "[ . 1 . 2]" 1
1280 1 58 LEU H 1 58 LEU MD1 . . 4.030 1.955 1.769 2.032 . 0 0 "[ . 1 . 2]" 1
1281 1 58 LEU H 1 58 LEU MD2 . . 4.190 3.914 3.580 3.979 . 0 0 "[ . 1 . 2]" 1
1282 1 58 LEU H 1 58 LEU HG . . 3.950 3.805 3.598 3.892 . 0 0 "[ . 1 . 2]" 1
1283 1 58 LEU H 1 59 GLN H . . 3.200 2.780 2.722 2.875 . 0 0 "[ . 1 . 2]" 1
1284 1 58 LEU H 1 59 GLN QG . . 4.960 4.491 4.169 4.889 . 0 0 "[ . 1 . 2]" 1
1285 1 58 LEU H 1 61 LEU MD1 . . 4.620 3.308 2.730 3.789 . 0 0 "[ . 1 . 2]" 1
1286 1 58 LEU HA 1 58 LEU MD1 . . 3.280 2.664 2.389 2.815 . 0 0 "[ . 1 . 2]" 1
1287 1 58 LEU HA 1 58 LEU MD2 . . 3.860 3.765 3.731 3.855 . 0 0 "[ . 1 . 2]" 1
1288 1 58 LEU HA 1 58 LEU HG . . 4.030 2.441 2.397 2.645 . 0 0 "[ . 1 . 2]" 1
1289 1 58 LEU HA 1 61 LEU HB2 . . 3.520 2.144 1.990 2.333 . 0 0 "[ . 1 . 2]" 1
1290 1 58 LEU HA 1 61 LEU MD1 . . 3.460 1.936 1.846 2.192 . 0 0 "[ . 1 . 2]" 1
1291 1 58 LEU HA 1 61 LEU HG . . 3.740 2.721 2.255 2.965 . 0 0 "[ . 1 . 2]" 1
1292 1 58 LEU QB 1 58 LEU MD1 . . 3.170 2.187 2.135 2.400 . 0 0 "[ . 1 . 2]" 1
1293 1 58 LEU QB 1 58 LEU MD2 . . 3.050 2.048 2.016 2.089 . 0 0 "[ . 1 . 2]" 1
1294 1 58 LEU QB 1 59 GLN H . . 3.640 2.856 2.577 3.008 . 0 0 "[ . 1 . 2]" 1
1295 1 58 LEU QB 1 59 GLN QG . . 4.940 4.308 3.654 4.941 0.001 3 0 "[ . 1 . 2]" 1
1296 1 58 LEU MD1 1 61 LEU HB2 . . 4.560 4.196 3.895 4.440 . 0 0 "[ . 1 . 2]" 1
1297 1 58 LEU MD1 1 61 LEU HB3 . . 5.340 4.876 4.631 5.150 . 0 0 "[ . 1 . 2]" 1
1298 1 58 LEU MD1 1 61 LEU MD1 . . 3.200 2.122 1.862 2.448 . 0 0 "[ . 1 . 2]" 1
1299 1 58 LEU MD1 1 66 ALA HA . . 4.730 3.740 3.539 3.884 . 0 0 "[ . 1 . 2]" 1
1300 1 58 LEU MD1 1 66 ALA MB . . 4.850 4.318 4.050 4.490 . 0 0 "[ . 1 . 2]" 1
1301 1 58 LEU MD1 1 69 TRP HB2 . . 4.780 2.886 2.555 3.128 . 0 0 "[ . 1 . 2]" 1
1302 1 58 LEU MD1 1 69 TRP HB3 . . 4.850 3.005 2.822 3.180 . 0 0 "[ . 1 . 2]" 1
1303 1 58 LEU MD1 1 69 TRP HE3 . . 4.790 4.076 3.878 4.213 . 0 0 "[ . 1 . 2]" 1
1304 1 58 LEU MD1 1 69 TRP HZ3 . . 5.500 5.327 5.136 5.507 0.007 3 0 "[ . 1 . 2]" 1
1305 1 58 LEU MD1 1 70 ALA MB . . 5.500 5.509 5.500 5.523 0.023 18 0 "[ . 1 . 2]" 1
1306 1 58 LEU MD2 1 61 LEU HB2 . . 4.990 4.803 4.507 5.006 0.016 4 0 "[ . 1 . 2]" 1
1307 1 58 LEU MD2 1 66 ALA HA . . 4.570 2.568 2.185 2.784 . 0 0 "[ . 1 . 2]" 1
1308 1 58 LEU MD2 1 69 TRP HB3 . . 4.470 2.540 2.125 2.704 . 0 0 "[ . 1 . 2]" 1
1309 1 58 LEU MD2 1 69 TRP HD1 . . 5.090 4.735 4.529 4.827 . 0 0 "[ . 1 . 2]" 1
1310 1 58 LEU MD2 1 69 TRP HE1 . . 5.150 5.137 4.876 5.161 0.011 7 0 "[ . 1 . 2]" 1
1311 1 58 LEU MD2 1 69 TRP HE3 . . 4.770 2.755 2.484 2.917 . 0 0 "[ . 1 . 2]" 1
1312 1 58 LEU MD2 1 69 TRP HZ2 . . 5.500 5.173 4.901 5.285 . 0 0 "[ . 1 . 2]" 1
1313 1 58 LEU MD2 1 69 TRP HZ3 . . 4.850 3.854 3.603 4.054 . 0 0 "[ . 1 . 2]" 1
1314 1 58 LEU HG 1 59 GLN H . . 5.200 5.178 5.113 5.225 0.025 9 0 "[ . 1 . 2]" 1
1315 1 58 LEU HG 1 61 LEU MD1 . . 4.800 2.315 2.008 2.603 . 0 0 "[ . 1 . 2]" 1
1316 1 58 LEU HG 1 69 TRP H . . 5.500 4.886 4.446 5.081 . 0 0 "[ . 1 . 2]" 1
1317 1 59 GLN H 1 59 GLN QB . . 2.980 2.310 2.170 2.419 . 0 0 "[ . 1 . 2]" 1
1318 1 59 GLN H 1 59 GLN QG . . 3.550 2.517 2.360 2.956 . 0 0 "[ . 1 . 2]" 1
1319 1 59 GLN H 1 60 GLY H . . 4.000 2.947 2.751 4.008 0.008 7 0 "[ . 1 . 2]" 1
1320 1 59 GLN HA 1 59 GLN QG . . 3.720 2.773 2.197 3.439 . 0 0 "[ . 1 . 2]" 1
1321 1 59 GLN QB 1 60 GLY H . . 4.220 2.968 2.367 3.840 . 0 0 "[ . 1 . 2]" 1
1322 1 59 GLN QB 1 61 LEU H . . 5.290 4.914 4.496 5.234 . 0 0 "[ . 1 . 2]" 1
1323 1 59 GLN QG 1 60 GLY H . . 5.090 3.366 1.809 4.667 . 0 0 "[ . 1 . 2]" 1
1324 1 60 GLY H 1 61 LEU H . . 3.430 2.860 2.240 3.297 . 0 0 "[ . 1 . 2]" 1
1325 1 60 GLY H 1 61 LEU HA . . 5.230 4.833 4.591 5.070 . 0 0 "[ . 1 . 2]" 1
1326 1 60 GLY QA 1 61 LEU H . . 3.100 2.678 2.571 2.816 . 0 0 "[ . 1 . 2]" 1
1327 1 61 LEU H 1 61 LEU HB2 . . 3.070 2.391 2.229 2.529 . 0 0 "[ . 1 . 2]" 1
1328 1 61 LEU H 1 61 LEU HB3 . . 3.640 3.569 3.521 3.641 0.001 20 0 "[ . 1 . 2]" 1
1329 1 61 LEU H 1 61 LEU MD1 . . 4.470 4.044 3.553 4.289 . 0 0 "[ . 1 . 2]" 1
1330 1 61 LEU H 1 61 LEU MD2 . . 4.180 3.985 3.331 4.213 0.033 9 0 "[ . 1 . 2]" 1
1331 1 61 LEU H 1 61 LEU HG . . 3.570 3.236 2.233 3.575 0.005 4 0 "[ . 1 . 2]" 1
1332 1 61 LEU H 1 62 GLY H . . 4.660 4.039 2.409 4.653 . 0 0 "[ . 1 . 2]" 1
1333 1 61 LEU HA 1 61 LEU MD1 . . 4.350 3.817 3.766 3.873 . 0 0 "[ . 1 . 2]" 1
1334 1 61 LEU HA 1 61 LEU MD2 . . 3.060 2.028 1.963 2.160 . 0 0 "[ . 1 . 2]" 1
1335 1 61 LEU HA 1 61 LEU HG . . 3.970 2.845 2.739 2.997 . 0 0 "[ . 1 . 2]" 1
1336 1 61 LEU HA 1 65 GLU HB2 . . 4.760 3.862 3.437 4.205 . 0 0 "[ . 1 . 2]" 1
1337 1 61 LEU HA 1 65 GLU HB3 . . 5.500 4.230 3.699 4.765 . 0 0 "[ . 1 . 2]" 1
1338 1 61 LEU HB2 1 61 LEU MD1 . . 3.410 2.271 2.156 2.433 . 0 0 "[ . 1 . 2]" 1
1339 1 61 LEU HB2 1 62 GLY H . . 3.960 3.442 2.320 3.962 0.002 11 0 "[ . 1 . 2]" 1
1340 1 61 LEU HB2 1 65 GLU HB2 . . 4.370 3.640 3.353 3.797 . 0 0 "[ . 1 . 2]" 1
1341 1 61 LEU HB2 1 66 ALA H . . 4.780 4.459 4.068 4.656 . 0 0 "[ . 1 . 2]" 1
1342 1 61 LEU HB3 1 61 LEU MD1 . . 3.320 2.365 2.209 2.483 . 0 0 "[ . 1 . 2]" 1
1343 1 61 LEU HB3 1 61 LEU MD2 . . 3.310 2.330 2.266 2.389 . 0 0 "[ . 1 . 2]" 1
1344 1 61 LEU HB3 1 62 GLY H . . 3.600 2.469 2.073 2.746 . 0 0 "[ . 1 . 2]" 1
1345 1 61 LEU HB3 1 62 GLY HA3 . . 4.920 4.270 3.953 4.596 . 0 0 "[ . 1 . 2]" 1
1346 1 61 LEU HB3 1 65 GLU HB2 . . 3.770 2.011 1.993 2.085 . 0 0 "[ . 1 . 2]" 1
1347 1 61 LEU HB3 1 65 GLU HB3 . . 3.870 2.276 1.999 2.850 . 0 0 "[ . 1 . 2]" 1
1348 1 61 LEU HB3 1 65 GLU HG2 . . 4.540 4.150 3.767 4.443 . 0 0 "[ . 1 . 2]" 1
1349 1 61 LEU HB3 1 65 GLU HG3 . . 4.670 3.357 2.754 3.680 . 0 0 "[ . 1 . 2]" 1
1350 1 61 LEU HB3 1 66 ALA H . . 4.460 3.636 3.238 4.130 . 0 0 "[ . 1 . 2]" 1
1351 1 61 LEU HB3 1 66 ALA HA . . 5.500 4.194 3.868 4.759 . 0 0 "[ . 1 . 2]" 1
1352 1 61 LEU MD1 1 62 GLY H . . 4.960 4.238 3.963 4.610 . 0 0 "[ . 1 . 2]" 1
1353 1 61 LEU MD1 1 65 GLU H . . 5.500 5.323 5.109 5.495 . 0 0 "[ . 1 . 2]" 1
1354 1 61 LEU MD1 1 65 GLU HA . . 5.280 4.305 3.994 4.563 . 0 0 "[ . 1 . 2]" 1
1355 1 61 LEU MD1 1 65 GLU HB2 . . 4.340 3.470 3.151 3.770 . 0 0 "[ . 1 . 2]" 1
1356 1 61 LEU MD1 1 65 GLU HB3 . . 3.970 2.499 2.171 2.833 . 0 0 "[ . 1 . 2]" 1
1357 1 61 LEU MD1 1 65 GLU HG2 . . 5.300 4.984 4.668 5.302 0.002 5 0 "[ . 1 . 2]" 1
1358 1 61 LEU MD1 1 65 GLU HG3 . . 4.810 4.127 3.805 4.486 . 0 0 "[ . 1 . 2]" 1
1359 1 61 LEU MD1 1 66 ALA H . . 4.620 4.143 3.763 4.390 . 0 0 "[ . 1 . 2]" 1
1360 1 61 LEU MD1 1 66 ALA HA . . 3.490 3.126 2.898 3.488 . 0 0 "[ . 1 . 2]" 1
1361 1 61 LEU MD1 1 69 TRP H . . 5.040 4.772 4.357 4.993 . 0 0 "[ . 1 . 2]" 1
1362 1 61 LEU MD1 1 69 TRP HB2 . . 4.680 4.102 3.670 4.385 . 0 0 "[ . 1 . 2]" 1
1363 1 61 LEU MD1 1 69 TRP HB3 . . 4.990 4.612 4.345 4.879 . 0 0 "[ . 1 . 2]" 1
1364 1 61 LEU MD2 1 62 GLY H . . 4.360 3.053 2.308 4.366 0.006 17 0 "[ . 1 . 2]" 1
1365 1 61 LEU MD2 1 62 GLY HA3 . . 5.420 4.703 4.336 5.098 . 0 0 "[ . 1 . 2]" 1
1366 1 61 LEU MD2 1 65 GLU H . . 5.500 4.954 4.671 5.502 0.002 4 0 "[ . 1 . 2]" 1
1367 1 61 LEU MD2 1 65 GLU HA . . 5.500 4.366 3.899 4.914 . 0 0 "[ . 1 . 2]" 1
1368 1 61 LEU MD2 1 65 GLU HB2 . . 3.950 2.997 2.599 3.633 . 0 0 "[ . 1 . 2]" 1
1369 1 61 LEU MD2 1 65 GLU HB3 . . 3.650 2.289 1.902 2.964 . 0 0 "[ . 1 . 2]" 1
1370 1 61 LEU MD2 1 65 GLU HG2 . . 4.540 3.766 3.424 4.215 . 0 0 "[ . 1 . 2]" 1
1371 1 61 LEU MD2 1 65 GLU HG3 . . 4.360 2.373 2.015 2.680 . 0 0 "[ . 1 . 2]" 1
1372 1 61 LEU HG 1 62 GLY H . . 4.830 4.570 4.371 4.836 0.006 16 0 "[ . 1 . 2]" 1
1373 1 61 LEU HG 1 65 GLU HG3 . . 5.270 5.132 4.736 5.279 0.009 9 0 "[ . 1 . 2]" 1
1374 1 62 GLY H 1 65 GLU HB2 . . 3.760 2.277 1.897 3.038 . 0 0 "[ . 1 . 2]" 1
1375 1 62 GLY H 1 65 GLU HG2 . . 4.890 3.536 2.603 4.844 . 0 0 "[ . 1 . 2]" 1
1376 1 62 GLY H 1 65 GLU HG3 . . 5.110 3.033 2.206 4.795 . 0 0 "[ . 1 . 2]" 1
1377 1 62 GLY H 1 66 ALA H . . 4.890 4.284 3.718 4.738 . 0 0 "[ . 1 . 2]" 1
1378 1 62 GLY HA2 1 63 ALA H . . 3.500 2.374 2.225 2.626 . 0 0 "[ . 1 . 2]" 1
1379 1 62 GLY HA2 1 63 ALA MB . . 4.610 4.108 4.031 4.262 . 0 0 "[ . 1 . 2]" 1
1380 1 62 GLY HA3 1 63 ALA H . . 3.480 2.786 2.502 2.985 . 0 0 "[ . 1 . 2]" 1
1381 1 62 GLY HA3 1 63 ALA MB . . 4.730 4.370 4.200 4.470 . 0 0 "[ . 1 . 2]" 1
1382 1 62 GLY HA3 1 64 LEU H . . 4.040 3.442 3.142 3.852 . 0 0 "[ . 1 . 2]" 1
1383 1 62 GLY HA3 1 65 GLU HB2 . . 3.790 3.189 2.860 3.409 . 0 0 "[ . 1 . 2]" 1
1384 1 62 GLY HA3 1 65 GLU HG2 . . 3.890 3.321 2.499 3.897 0.007 8 0 "[ . 1 . 2]" 1
1385 1 62 GLY HA3 1 65 GLU HG3 . . 4.100 3.815 3.301 4.101 0.001 6 0 "[ . 1 . 2]" 1
1386 1 63 ALA H 1 63 ALA MB . . 2.900 2.074 2.026 2.212 . 0 0 "[ . 1 . 2]" 1
1387 1 63 ALA H 1 64 LEU H . . 3.320 2.840 2.684 2.992 . 0 0 "[ . 1 . 2]" 1
1388 1 63 ALA HA 1 64 LEU MD1 . . 5.500 5.528 5.510 5.567 0.067 16 0 "[ . 1 . 2]" 1
1389 1 63 ALA HA 1 67 THR H . . 5.150 4.950 4.736 5.104 . 0 0 "[ . 1 . 2]" 1
1390 1 63 ALA HA 1 90 VAL MG2 . . 4.750 4.535 4.174 4.741 . 0 0 "[ . 1 . 2]" 1
1391 1 63 ALA MB 1 64 LEU H . . 3.470 2.638 2.318 2.856 . 0 0 "[ . 1 . 2]" 1
1392 1 63 ALA MB 1 64 LEU HA . . 4.570 3.781 3.672 3.849 . 0 0 "[ . 1 . 2]" 1
1393 1 63 ALA MB 1 67 THR HG1 . . 5.500 4.716 4.479 4.915 . 0 0 "[ . 1 . 2]" 1
1394 1 63 ALA MB 1 90 VAL HA . . 5.500 5.097 4.677 5.376 . 0 0 "[ . 1 . 2]" 1
1395 1 63 ALA MB 1 90 VAL HB . . 5.240 4.790 4.499 5.074 . 0 0 "[ . 1 . 2]" 1
1396 1 63 ALA MB 1 90 VAL MG1 . . 3.250 2.482 2.109 2.759 . 0 0 "[ . 1 . 2]" 1
1397 1 64 LEU H 1 64 LEU HB2 . . 3.570 2.287 2.166 2.362 . 0 0 "[ . 1 . 2]" 1
1398 1 64 LEU H 1 64 LEU QB . . 2.760 2.197 2.112 2.250 . 0 0 "[ . 1 . 2]" 1
1399 1 64 LEU H 1 64 LEU HB3 . . 3.570 2.850 2.830 2.923 . 0 0 "[ . 1 . 2]" 1
1400 1 64 LEU H 1 64 LEU MD1 . . 3.930 3.647 3.469 3.725 . 0 0 "[ . 1 . 2]" 1
1401 1 64 LEU H 1 64 LEU HG . . 4.760 4.612 4.584 4.623 . 0 0 "[ . 1 . 2]" 1
1402 1 64 LEU H 1 65 GLU H . . 3.230 2.547 2.459 2.725 . 0 0 "[ . 1 . 2]" 1
1403 1 64 LEU H 1 65 GLU HB2 . . 4.890 4.443 4.225 4.678 . 0 0 "[ . 1 . 2]" 1
1404 1 64 LEU H 1 66 ALA H . . 4.600 3.974 3.842 4.120 . 0 0 "[ . 1 . 2]" 1
1405 1 64 LEU H 1 90 VAL MG2 . . 4.100 4.007 3.555 4.102 0.002 5 0 "[ . 1 . 2]" 1
1406 1 64 LEU HA 1 64 LEU MD1 . . 3.240 1.948 1.909 2.019 . 0 0 "[ . 1 . 2]" 1
1407 1 64 LEU HA 1 64 LEU MD2 . . 3.920 3.793 3.758 3.814 . 0 0 "[ . 1 . 2]" 1
1408 1 64 LEU HA 1 64 LEU HG . . 3.700 2.880 2.789 2.962 . 0 0 "[ . 1 . 2]" 1
1409 1 64 LEU HA 1 67 THR H . . 4.470 3.530 3.218 3.720 . 0 0 "[ . 1 . 2]" 1
1410 1 64 LEU HA 1 67 THR HG1 . . 4.020 2.867 2.216 3.189 . 0 0 "[ . 1 . 2]" 1
1411 1 64 LEU HA 1 90 VAL MG2 . . 3.060 2.254 2.042 2.461 . 0 0 "[ . 1 . 2]" 1
1412 1 64 LEU QB 1 64 LEU MD1 . . 3.180 2.311 2.289 2.347 . 0 0 "[ . 1 . 2]" 1
1413 1 64 LEU QB 1 65 GLU H . . 3.200 2.311 2.191 2.385 . 0 0 "[ . 1 . 2]" 1
1414 1 64 LEU QB 1 65 GLU HG2 . . 4.910 3.642 3.379 3.862 . 0 0 "[ . 1 . 2]" 1
1415 1 64 LEU QB 1 66 ALA H . . 4.720 4.455 4.357 4.598 . 0 0 "[ . 1 . 2]" 1
1416 1 64 LEU HB2 1 65 GLU H . . 3.840 3.406 3.356 3.458 . 0 0 "[ . 1 . 2]" 1
1417 1 64 LEU HB3 1 65 GLU H . . 3.840 2.351 2.220 2.430 . 0 0 "[ . 1 . 2]" 1
1418 1 64 LEU MD1 1 67 THR H . . 4.980 4.629 4.431 4.804 . 0 0 "[ . 1 . 2]" 1
1419 1 64 LEU MD1 1 67 THR HG1 . . 5.070 3.591 3.058 3.798 . 0 0 "[ . 1 . 2]" 1
1420 1 64 LEU MD1 1 68 ALA H . . 5.120 4.666 4.360 4.975 . 0 0 "[ . 1 . 2]" 1
1421 1 64 LEU MD1 1 68 ALA MB . . 5.220 4.792 4.513 5.185 . 0 0 "[ . 1 . 2]" 1
1422 1 64 LEU MD1 1 86 ALA MB . . 3.170 2.871 2.478 3.150 . 0 0 "[ . 1 . 2]" 1
1423 1 64 LEU MD1 1 87 GLN H . . 4.100 3.853 3.628 3.999 . 0 0 "[ . 1 . 2]" 1
1424 1 64 LEU MD1 1 87 GLN HA . . 3.160 2.101 1.963 2.187 . 0 0 "[ . 1 . 2]" 1
1425 1 64 LEU MD1 1 87 GLN HB2 . . 4.320 3.826 3.651 3.997 . 0 0 "[ . 1 . 2]" 1
1426 1 64 LEU MD1 1 87 GLN HB3 . . 4.640 4.618 4.539 4.646 0.006 17 0 "[ . 1 . 2]" 1
1427 1 64 LEU MD1 1 87 GLN QG . . 3.960 3.263 2.920 3.819 . 0 0 "[ . 1 . 2]" 1
1428 1 64 LEU MD1 1 90 VAL HA . . 5.500 4.324 4.161 4.477 . 0 0 "[ . 1 . 2]" 1
1429 1 64 LEU MD1 1 90 VAL HB . . 3.780 2.184 1.949 2.467 . 0 0 "[ . 1 . 2]" 1
1430 1 64 LEU MD2 1 65 GLU H . . 4.350 4.311 4.182 4.360 0.010 4 0 "[ . 1 . 2]" 1
1431 1 64 LEU MD2 1 65 GLU HA . . 5.260 5.081 4.977 5.219 . 0 0 "[ . 1 . 2]" 1
1432 1 64 LEU MD2 1 87 GLN H . . 4.710 4.497 4.032 4.711 0.001 4 0 "[ . 1 . 2]" 1
1433 1 64 LEU MD2 1 87 GLN HA . . 3.540 3.144 2.794 3.346 . 0 0 "[ . 1 . 2]" 1
1434 1 64 LEU MD2 1 87 GLN QG . . 4.080 3.156 2.477 4.067 . 0 0 "[ . 1 . 2]" 1
1435 1 64 LEU MD2 1 90 VAL HB . . 4.790 4.118 3.776 4.361 . 0 0 "[ . 1 . 2]" 1
1436 1 64 LEU HG 1 65 GLU H . . 4.380 4.252 4.128 4.322 . 0 0 "[ . 1 . 2]" 1
1437 1 64 LEU HG 1 65 GLU HA . . 4.730 4.605 4.523 4.665 . 0 0 "[ . 1 . 2]" 1
1438 1 64 LEU HG 1 68 ALA H . . 4.930 4.518 4.196 4.802 . 0 0 "[ . 1 . 2]" 1
1439 1 64 LEU HG 1 87 GLN HA . . 4.930 4.097 3.895 4.324 . 0 0 "[ . 1 . 2]" 1
1440 1 65 GLU H 1 65 GLU HB2 . . 3.110 2.486 2.340 2.662 . 0 0 "[ . 1 . 2]" 1
1441 1 65 GLU H 1 65 GLU HB3 . . 3.600 3.601 3.579 3.613 0.013 17 0 "[ . 1 . 2]" 1
1442 1 65 GLU H 1 65 GLU HG2 . . 3.560 2.323 2.053 2.616 . 0 0 "[ . 1 . 2]" 1
1443 1 65 GLU H 1 65 GLU HG3 . . 3.830 3.692 3.465 3.825 . 0 0 "[ . 1 . 2]" 1
1444 1 65 GLU H 1 66 ALA H . . 3.200 2.922 2.825 3.021 . 0 0 "[ . 1 . 2]" 1
1445 1 65 GLU H 1 66 ALA MB . . 5.090 4.543 4.460 4.618 . 0 0 "[ . 1 . 2]" 1
1446 1 65 GLU H 1 67 THR H . . 5.220 4.973 4.586 5.141 . 0 0 "[ . 1 . 2]" 1
1447 1 65 GLU H 1 68 ALA MB . . 5.500 4.691 4.503 4.888 . 0 0 "[ . 1 . 2]" 1
1448 1 65 GLU HA 1 65 GLU HG2 . . 3.530 2.946 2.624 3.269 . 0 0 "[ . 1 . 2]" 1
1449 1 65 GLU HA 1 65 GLU HG3 . . 3.820 3.672 3.592 3.753 . 0 0 "[ . 1 . 2]" 1
1450 1 65 GLU HA 1 68 ALA H . . 4.010 3.850 3.704 3.980 . 0 0 "[ . 1 . 2]" 1
1451 1 65 GLU HA 1 68 ALA MB . . 3.340 2.797 2.597 3.015 . 0 0 "[ . 1 . 2]" 1
1452 1 65 GLU HA 1 69 TRP H . . 4.960 4.873 4.753 4.969 0.009 8 0 "[ . 1 . 2]" 1
1453 1 65 GLU HB2 1 65 GLU HG2 . . 2.920 2.439 2.318 2.550 . 0 0 "[ . 1 . 2]" 1
1454 1 65 GLU HB2 1 66 ALA H . . 3.480 2.787 2.647 2.955 . 0 0 "[ . 1 . 2]" 1
1455 1 65 GLU HB3 1 66 ALA H . . 3.790 3.599 3.239 3.748 . 0 0 "[ . 1 . 2]" 1
1456 1 65 GLU HG2 1 66 ALA H . . 4.850 4.540 4.231 4.739 . 0 0 "[ . 1 . 2]" 1
1457 1 65 GLU HG3 1 66 ALA H . . 5.220 5.109 4.969 5.225 0.005 13 0 "[ . 1 . 2]" 1
1458 1 66 ALA H 1 66 ALA MB . . 2.860 2.133 2.081 2.174 . 0 0 "[ . 1 . 2]" 1
1459 1 66 ALA H 1 67 THR H . . 3.220 2.919 2.739 3.059 . 0 0 "[ . 1 . 2]" 1
1460 1 66 ALA H 1 67 THR HB . . 5.150 5.026 4.876 5.151 0.001 14 0 "[ . 1 . 2]" 1
1461 1 66 ALA H 1 67 THR HG1 . . 4.630 4.371 4.131 4.551 . 0 0 "[ . 1 . 2]" 1
1462 1 66 ALA H 1 68 ALA H . . 4.530 3.996 3.858 4.177 . 0 0 "[ . 1 . 2]" 1
1463 1 66 ALA HA 1 69 TRP H . . 3.850 3.641 3.556 3.739 . 0 0 "[ . 1 . 2]" 1
1464 1 66 ALA HA 1 69 TRP HB2 . . 4.390 4.244 4.060 4.390 0.000 14 0 "[ . 1 . 2]" 1
1465 1 66 ALA HA 1 69 TRP HB3 . . 3.780 3.563 3.370 3.717 . 0 0 "[ . 1 . 2]" 1
1466 1 66 ALA HA 1 70 ALA H . . 5.230 4.563 4.374 4.713 . 0 0 "[ . 1 . 2]" 1
1467 1 66 ALA MB 1 67 THR H . . 3.010 2.022 1.897 2.333 . 0 0 "[ . 1 . 2]" 1
1468 1 66 ALA MB 1 67 THR HG1 . . 4.260 3.337 3.191 3.728 . 0 0 "[ . 1 . 2]" 1
1469 1 66 ALA MB 1 69 TRP H . . 5.240 4.684 4.581 4.821 . 0 0 "[ . 1 . 2]" 1
1470 1 66 ALA MB 1 69 TRP HB3 . . 5.210 4.509 4.347 4.607 . 0 0 "[ . 1 . 2]" 1
1471 1 66 ALA MB 1 70 ALA H . . 5.500 4.731 4.602 4.855 . 0 0 "[ . 1 . 2]" 1
1472 1 67 THR H 1 67 THR HB . . 3.620 2.789 2.650 2.851 . 0 0 "[ . 1 . 2]" 1
1473 1 67 THR H 1 67 THR HG1 . . 2.870 1.995 1.900 2.249 . 0 0 "[ . 1 . 2]" 1
1474 1 67 THR H 1 67 THR MG . . 3.860 3.750 3.720 3.769 . 0 0 "[ . 1 . 2]" 1
1475 1 67 THR H 1 68 ALA H . . 3.310 2.926 2.800 3.015 . 0 0 "[ . 1 . 2]" 1
1476 1 67 THR H 1 90 VAL MG2 . . 4.210 3.894 3.678 4.213 0.003 9 0 "[ . 1 . 2]" 1
1477 1 67 THR HA 1 67 THR HG1 . . 3.430 3.216 3.084 3.428 . 0 0 "[ . 1 . 2]" 1
1478 1 67 THR HA 1 67 THR MG . . 3.070 2.323 2.206 2.446 . 0 0 "[ . 1 . 2]" 1
1479 1 67 THR HA 1 68 ALA H . . 3.540 3.527 3.512 3.548 0.008 17 0 "[ . 1 . 2]" 1
1480 1 67 THR HA 1 70 ALA H . . 4.190 3.698 3.573 3.778 . 0 0 "[ . 1 . 2]" 1
1481 1 67 THR HA 1 70 ALA MB . . 4.680 2.751 2.646 2.873 . 0 0 "[ . 1 . 2]" 1
1482 1 67 THR HA 1 90 VAL MG2 . . 5.500 4.738 4.429 5.165 . 0 0 "[ . 1 . 2]" 1
1483 1 67 THR HB 1 68 ALA H . . 3.910 2.672 2.535 2.756 . 0 0 "[ . 1 . 2]" 1
1484 1 67 THR HB 1 69 TRP H . . 5.400 5.338 5.159 5.404 0.004 8 0 "[ . 1 . 2]" 1
1485 1 67 THR HB 1 70 ALA MB . . 5.140 5.067 4.964 5.141 0.001 6 0 "[ . 1 . 2]" 1
1486 1 67 THR HB 1 90 VAL MG2 . . 3.960 3.015 2.702 3.373 . 0 0 "[ . 1 . 2]" 1
1487 1 67 THR HG1 1 68 ALA H . . 4.200 3.986 3.829 4.104 . 0 0 "[ . 1 . 2]" 1
1488 1 67 THR HG1 1 90 VAL MG2 . . 3.260 2.402 2.076 2.810 . 0 0 "[ . 1 . 2]" 1
1489 1 67 THR MG 1 68 ALA H . . 4.000 3.679 3.453 3.818 . 0 0 "[ . 1 . 2]" 1
1490 1 67 THR MG 1 70 ALA H . . 5.120 4.844 4.637 5.000 . 0 0 "[ . 1 . 2]" 1
1491 1 67 THR MG 1 71 LEU H . . 4.600 3.584 3.343 3.804 . 0 0 "[ . 1 . 2]" 1
1492 1 67 THR MG 1 71 LEU MD1 . . 3.120 1.943 1.763 2.136 . 0 0 "[ . 1 . 2]" 1
1493 1 67 THR MG 1 71 LEU HG . . 4.150 2.747 2.374 3.009 . 0 0 "[ . 1 . 2]" 1
1494 1 67 THR MG 1 86 ALA HA . . 2.910 2.098 1.846 2.352 . 0 0 "[ . 1 . 2]" 1
1495 1 67 THR MG 1 89 VAL H . . 4.500 4.278 4.005 4.431 . 0 0 "[ . 1 . 2]" 1
1496 1 67 THR MG 1 89 VAL HA . . 5.290 4.926 4.728 5.125 . 0 0 "[ . 1 . 2]" 1
1497 1 67 THR MG 1 89 VAL HB . . 3.160 2.413 2.118 2.651 . 0 0 "[ . 1 . 2]" 1
1498 1 67 THR MG 1 89 VAL MG2 . . 3.280 2.738 2.414 3.114 . 0 0 "[ . 1 . 2]" 1
1499 1 67 THR MG 1 90 VAL H . . 4.180 3.737 3.353 4.117 . 0 0 "[ . 1 . 2]" 1
1500 1 67 THR MG 1 101 TYR QE . . 5.090 4.570 4.187 4.816 . 0 0 "[ . 1 . 2]" 1
1501 1 68 ALA H 1 68 ALA MB . . 2.850 2.159 2.038 2.235 . 0 0 "[ . 1 . 2]" 1
1502 1 68 ALA H 1 69 TRP H . . 3.340 2.939 2.852 3.004 . 0 0 "[ . 1 . 2]" 1
1503 1 68 ALA H 1 69 TRP HB2 . . 5.500 5.458 5.369 5.500 . 1 0 "[ . 1 . 2]" 1
1504 1 68 ALA H 1 69 TRP HB3 . . 5.140 5.003 4.945 5.056 . 0 0 "[ . 1 . 2]" 1
1505 1 68 ALA H 1 70 ALA H . . 4.790 4.622 4.486 4.719 . 0 0 "[ . 1 . 2]" 1
1506 1 68 ALA H 1 71 LEU HB2 . . 5.400 5.305 5.159 5.391 . 0 0 "[ . 1 . 2]" 1
1507 1 68 ALA H 1 86 ALA MB . . 3.660 3.464 3.251 3.661 0.001 14 0 "[ . 1 . 2]" 1
1508 1 68 ALA HA 1 71 LEU H . . 4.140 4.080 3.989 4.143 0.003 14 0 "[ . 1 . 2]" 1
1509 1 68 ALA HA 1 71 LEU HB2 . . 3.850 3.216 3.120 3.302 . 0 0 "[ . 1 . 2]" 1
1510 1 68 ALA HA 1 71 LEU HG . . 5.080 4.841 4.502 5.070 . 0 0 "[ . 1 . 2]" 1
1511 1 68 ALA HA 1 72 LYS H . . 4.880 4.621 4.490 4.748 . 0 0 "[ . 1 . 2]" 1
1512 1 68 ALA HA 1 86 ALA MB . . 3.370 2.704 2.551 2.906 . 0 0 "[ . 1 . 2]" 1
1513 1 68 ALA MB 1 69 TRP H . . 3.230 2.329 2.203 2.447 . 0 0 "[ . 1 . 2]" 1
1514 1 68 ALA MB 1 69 TRP HA . . 3.970 3.720 3.614 3.795 . 0 0 "[ . 1 . 2]" 1
1515 1 68 ALA MB 1 69 TRP HB2 . . 4.750 3.991 3.904 4.107 . 0 0 "[ . 1 . 2]" 1
1516 1 68 ALA MB 1 69 TRP HB3 . . 5.500 4.409 4.319 4.497 . 0 0 "[ . 1 . 2]" 1
1517 1 68 ALA MB 1 70 ALA H . . 4.770 4.717 4.633 4.774 0.004 5 0 "[ . 1 . 2]" 1
1518 1 68 ALA MB 1 71 LEU H . . 5.340 5.015 4.935 5.068 . 0 0 "[ . 1 . 2]" 1
1519 1 69 TRP H 1 69 TRP HB2 . . 3.040 2.604 2.570 2.660 . 0 0 "[ . 1 . 2]" 1
1520 1 69 TRP H 1 69 TRP HB3 . . 3.040 2.458 2.409 2.490 . 0 0 "[ . 1 . 2]" 1
1521 1 69 TRP H 1 69 TRP HD1 . . 5.180 5.040 4.994 5.107 . 0 0 "[ . 1 . 2]" 1
1522 1 69 TRP H 1 70 ALA MB . . 4.550 4.427 4.340 4.482 . 0 0 "[ . 1 . 2]" 1
1523 1 69 TRP H 1 72 LYS HB3 . . 5.460 5.372 5.094 5.464 0.004 20 0 "[ . 1 . 2]" 1
1524 1 69 TRP HA 1 69 TRP HD1 . . 3.860 3.212 3.142 3.273 . 0 0 "[ . 1 . 2]" 1
1525 1 69 TRP HA 1 69 TRP HE3 . . 4.750 4.585 4.540 4.667 . 0 0 "[ . 1 . 2]" 1
1526 1 69 TRP HA 1 72 LYS H . . 4.440 3.360 3.290 3.452 . 0 0 "[ . 1 . 2]" 1
1527 1 69 TRP HA 1 72 LYS HB3 . . 3.590 2.748 2.520 2.865 . 0 0 "[ . 1 . 2]" 1
1528 1 69 TRP HA 1 72 LYS QD . . 4.100 3.393 3.164 3.813 . 0 0 "[ . 1 . 2]" 1
1529 1 69 TRP HA 1 72 LYS QE . . 5.400 4.567 3.104 5.380 . 0 0 "[ . 1 . 2]" 1
1530 1 69 TRP HA 1 73 VAL MG2 . . 4.620 3.881 3.745 4.022 . 0 0 "[ . 1 . 2]" 1
1531 1 69 TRP HB2 1 69 TRP HD1 . . 3.810 2.674 2.655 2.702 . 0 0 "[ . 1 . 2]" 1
1532 1 69 TRP HB2 1 70 ALA H . . 3.810 3.714 3.674 3.785 . 0 0 "[ . 1 . 2]" 1
1533 1 69 TRP HB3 1 69 TRP HE3 . . 4.110 2.561 2.527 2.589 . 0 0 "[ . 1 . 2]" 1
1534 1 69 TRP HB3 1 70 ALA H . . 3.210 2.238 2.180 2.345 . 0 0 "[ . 1 . 2]" 1
1535 1 69 TRP HB3 1 70 ALA MB . . 4.510 3.896 3.864 3.948 . 0 0 "[ . 1 . 2]" 1
1536 1 69 TRP HB3 1 71 LEU H . . 5.320 5.117 5.019 5.215 . 0 0 "[ . 1 . 2]" 1
1537 1 69 TRP HB3 1 72 LYS H . . 5.280 5.215 5.179 5.269 . 0 0 "[ . 1 . 2]" 1
1538 1 69 TRP HD1 1 70 ALA H . . 5.500 5.419 5.371 5.495 . 0 0 "[ . 1 . 2]" 1
1539 1 69 TRP HD1 1 72 LYS HB3 . . 5.170 4.308 4.158 4.492 . 0 0 "[ . 1 . 2]" 1
1540 1 69 TRP HD1 1 73 VAL HB . . 5.500 5.360 5.222 5.446 . 0 0 "[ . 1 . 2]" 1
1541 1 69 TRP HD1 1 73 VAL MG2 . . 3.880 3.119 3.037 3.214 . 0 0 "[ . 1 . 2]" 1
1542 1 69 TRP HE1 1 72 LYS HB3 . . 5.500 5.316 5.129 5.496 . 0 0 "[ . 1 . 2]" 1
1543 1 69 TRP HE1 1 72 LYS QD . . 5.500 5.107 4.500 5.505 0.005 11 0 "[ . 1 . 2]" 1
1544 1 69 TRP HE1 1 73 VAL HA . . 5.500 5.329 5.270 5.425 . 0 0 "[ . 1 . 2]" 1
1545 1 69 TRP HE1 1 73 VAL HB . . 4.720 4.442 4.339 4.534 . 0 0 "[ . 1 . 2]" 1
1546 1 69 TRP HE1 1 73 VAL MG1 . . 4.920 4.129 4.001 4.267 . 0 0 "[ . 1 . 2]" 1
1547 1 69 TRP HE1 1 73 VAL MG2 . . 3.510 2.149 2.085 2.237 . 0 0 "[ . 1 . 2]" 1
1548 1 69 TRP HE3 1 70 ALA H . . 3.770 2.167 2.078 2.389 . 0 0 "[ . 1 . 2]" 1
1549 1 69 TRP HE3 1 70 ALA HA . . 4.040 2.408 2.311 2.661 . 0 0 "[ . 1 . 2]" 1
1550 1 69 TRP HE3 1 70 ALA MB . . 3.880 2.603 2.508 2.768 . 0 0 "[ . 1 . 2]" 1
1551 1 69 TRP HE3 1 73 VAL MG2 . . 5.500 4.289 4.207 4.373 . 0 0 "[ . 1 . 2]" 1
1552 1 69 TRP HH2 1 73 VAL HB . . 4.850 3.953 3.858 4.036 . 0 0 "[ . 1 . 2]" 1
1553 1 69 TRP HH2 1 73 VAL MG1 . . 4.790 3.210 3.044 3.352 . 0 0 "[ . 1 . 2]" 1
1554 1 69 TRP HH2 1 73 VAL MG2 . . 4.610 3.714 3.646 3.795 . 0 0 "[ . 1 . 2]" 1
1555 1 69 TRP HZ2 1 73 VAL HA . . 5.500 5.524 5.509 5.539 0.039 9 0 "[ . 1 . 2]" 1
1556 1 69 TRP HZ2 1 73 VAL HB . . 5.010 3.764 3.705 3.808 . 0 0 "[ . 1 . 2]" 1
1557 1 69 TRP HZ2 1 73 VAL MG1 . . 4.420 2.692 2.513 2.801 . 0 0 "[ . 1 . 2]" 1
1558 1 69 TRP HZ2 1 73 VAL MG2 . . 3.990 2.122 2.064 2.208 . 0 0 "[ . 1 . 2]" 1
1559 1 69 TRP HZ3 1 70 ALA HA . . 5.500 2.992 2.852 3.298 . 0 0 "[ . 1 . 2]" 1
1560 1 69 TRP HZ3 1 70 ALA MB . . 4.730 3.377 3.270 3.573 . 0 0 "[ . 1 . 2]" 1
1561 1 69 TRP HZ3 1 73 VAL MG1 . . 5.500 4.430 4.224 4.553 . 0 0 "[ . 1 . 2]" 1
1562 1 69 TRP HZ3 1 73 VAL MG2 . . 4.980 4.577 4.513 4.656 . 0 0 "[ . 1 . 2]" 1
1563 1 70 ALA H 1 70 ALA MB . . 2.900 2.155 2.129 2.174 . 0 0 "[ . 1 . 2]" 1
1564 1 70 ALA H 1 71 LEU H . . 3.380 3.121 3.066 3.184 . 0 0 "[ . 1 . 2]" 1
1565 1 70 ALA H 1 71 LEU HG . . 5.500 5.418 5.167 5.497 . 0 0 "[ . 1 . 2]" 1
1566 1 70 ALA H 1 72 LYS H . . 4.450 4.047 3.922 4.127 . 0 0 "[ . 1 . 2]" 1
1567 1 70 ALA H 1 72 LYS HB2 . . 5.500 5.452 5.332 5.508 0.008 3 0 "[ . 1 . 2]" 1
1568 1 70 ALA H 1 73 VAL MG2 . . 5.230 4.947 4.800 5.049 . 0 0 "[ . 1 . 2]" 1
1569 1 70 ALA HA 1 72 LYS H . . 5.090 4.086 3.872 4.225 . 0 0 "[ . 1 . 2]" 1
1570 1 70 ALA HA 1 73 VAL H . . 4.140 3.946 3.791 4.060 . 0 0 "[ . 1 . 2]" 1
1571 1 70 ALA HA 1 73 VAL HB . . 3.800 3.219 3.078 3.328 . 0 0 "[ . 1 . 2]" 1
1572 1 70 ALA HA 1 73 VAL MG1 . . 4.500 4.385 4.192 4.495 . 0 0 "[ . 1 . 2]" 1
1573 1 70 ALA HA 1 73 VAL MG2 . . 4.240 4.159 4.062 4.241 0.001 15 0 "[ . 1 . 2]" 1
1574 1 70 ALA HA 1 74 ALA H . . 4.380 3.940 3.785 4.026 . 0 0 "[ . 1 . 2]" 1
1575 1 70 ALA MB 1 71 LEU H . . 3.430 2.183 2.107 2.276 . 0 0 "[ . 1 . 2]" 1
1576 1 70 ALA MB 1 71 LEU MD1 . . 4.750 4.114 3.944 4.327 . 0 0 "[ . 1 . 2]" 1
1577 1 70 ALA MB 1 71 LEU MD2 . . 4.610 4.285 3.953 4.419 . 0 0 "[ . 1 . 2]" 1
1578 1 70 ALA MB 1 73 VAL MG2 . . 5.500 5.161 5.076 5.229 . 0 0 "[ . 1 . 2]" 1
1579 1 70 ALA MB 1 74 ALA H . . 4.710 4.694 4.603 4.719 0.009 3 0 "[ . 1 . 2]" 1
1580 1 71 LEU H 1 71 LEU HB2 . . 3.060 2.347 2.282 2.435 . 0 0 "[ . 1 . 2]" 1
1581 1 71 LEU H 1 71 LEU HB3 . . 3.640 3.562 3.543 3.577 . 0 0 "[ . 1 . 2]" 1
1582 1 71 LEU H 1 71 LEU MD1 . . 3.650 3.284 3.169 3.477 . 0 0 "[ . 1 . 2]" 1
1583 1 71 LEU H 1 71 LEU MD2 . . 4.070 3.863 3.629 3.968 . 0 0 "[ . 1 . 2]" 1
1584 1 71 LEU H 1 71 LEU HG . . 3.540 2.553 2.329 2.677 . 0 0 "[ . 1 . 2]" 1
1585 1 71 LEU H 1 72 LYS H . . 3.160 2.702 2.639 2.746 . 0 0 "[ . 1 . 2]" 1
1586 1 71 LEU HA 1 71 LEU MD1 . . 3.960 3.860 3.846 3.894 . 0 0 "[ . 1 . 2]" 1
1587 1 71 LEU HA 1 71 LEU MD2 . . 3.290 2.384 2.151 2.565 . 0 0 "[ . 1 . 2]" 1
1588 1 71 LEU HA 1 71 LEU HG . . 3.970 2.698 2.629 2.885 . 0 0 "[ . 1 . 2]" 1
1589 1 71 LEU HA 1 74 ALA H . . 4.290 3.891 3.757 3.988 . 0 0 "[ . 1 . 2]" 1
1590 1 71 LEU HA 1 74 ALA MB . . 3.660 2.601 2.451 2.799 . 0 0 "[ . 1 . 2]" 1
1591 1 71 LEU HA 1 101 TYR QE . . 4.160 3.686 3.406 3.849 . 0 0 "[ . 1 . 2]" 1
1592 1 71 LEU HA 1 101 TYR HH . . 3.810 2.659 2.044 3.120 . 0 0 "[ . 1 . 2]" 1
1593 1 71 LEU HB2 1 72 LYS H . . 4.010 2.945 2.824 3.116 . 0 0 "[ . 1 . 2]" 1
1594 1 71 LEU HB2 1 82 PRO HB3 . . 4.570 4.314 3.855 4.521 . 0 0 "[ . 1 . 2]" 1
1595 1 71 LEU HB3 1 71 LEU MD2 . . 3.350 2.158 2.034 2.263 . 0 0 "[ . 1 . 2]" 1
1596 1 71 LEU HB3 1 72 LYS H . . 4.000 3.716 3.618 3.860 . 0 0 "[ . 1 . 2]" 1
1597 1 71 LEU HB3 1 82 PRO HB2 . . 4.790 3.884 3.339 4.050 . 0 0 "[ . 1 . 2]" 1
1598 1 71 LEU HB3 1 82 PRO HB3 . . 4.740 2.594 2.133 2.782 . 0 0 "[ . 1 . 2]" 1
1599 1 71 LEU HB3 1 82 PRO HG3 . . 4.360 3.881 3.042 4.176 . 0 0 "[ . 1 . 2]" 1
1600 1 71 LEU HB3 1 86 ALA H . . 5.370 5.230 4.905 5.375 0.005 6 0 "[ . 1 . 2]" 1
1601 1 71 LEU HB3 1 101 TYR QE . . 5.010 4.921 4.771 5.013 0.003 14 0 "[ . 1 . 2]" 1
1602 1 71 LEU MD1 1 72 LYS H . . 4.870 4.590 4.473 4.768 . 0 0 "[ . 1 . 2]" 1
1603 1 71 LEU MD1 1 82 PRO HB2 . . 4.790 3.843 3.208 4.157 . 0 0 "[ . 1 . 2]" 1
1604 1 71 LEU MD1 1 82 PRO HB3 . . 4.000 3.685 3.237 3.996 . 0 0 "[ . 1 . 2]" 1
1605 1 71 LEU MD1 1 84 VAL H . . 5.450 4.928 4.632 5.166 . 0 0 "[ . 1 . 2]" 1
1606 1 71 LEU MD1 1 85 SER HA . . 4.750 3.539 3.219 3.767 . 0 0 "[ . 1 . 2]" 1
1607 1 71 LEU MD1 1 86 ALA H . . 3.730 2.455 2.229 2.749 . 0 0 "[ . 1 . 2]" 1
1608 1 71 LEU MD1 1 86 ALA HA . . 3.710 1.995 1.877 2.221 . 0 0 "[ . 1 . 2]" 1
1609 1 71 LEU MD1 1 89 VAL H . . 5.080 4.756 4.587 4.969 . 0 0 "[ . 1 . 2]" 1
1610 1 71 LEU MD1 1 101 TYR QD . . 5.500 5.196 5.079 5.265 . 0 0 "[ . 1 . 2]" 1
1611 1 71 LEU MD1 1 101 TYR QE . . 4.340 4.310 4.125 4.344 0.004 14 0 "[ . 1 . 2]" 1
1612 1 71 LEU MD2 1 72 LYS H . . 5.000 4.879 4.796 4.964 . 0 0 "[ . 1 . 2]" 1
1613 1 71 LEU MD2 1 82 PRO HA . . 4.580 2.520 2.349 2.728 . 0 0 "[ . 1 . 2]" 1
1614 1 71 LEU MD2 1 82 PRO HB2 . . 4.440 2.696 2.394 3.016 . 0 0 "[ . 1 . 2]" 1
1615 1 71 LEU MD2 1 82 PRO HB3 . . 3.690 1.990 1.873 2.200 . 0 0 "[ . 1 . 2]" 1
1616 1 71 LEU MD2 1 82 PRO HG3 . . 4.610 3.955 3.757 4.196 . 0 0 "[ . 1 . 2]" 1
1617 1 71 LEU MD2 1 83 VAL H . . 4.590 3.916 3.740 3.988 . 0 0 "[ . 1 . 2]" 1
1618 1 71 LEU MD2 1 83 VAL MG1 . . 4.410 4.349 4.218 4.411 0.001 12 0 "[ . 1 . 2]" 1
1619 1 71 LEU MD2 1 84 VAL H . . 3.630 3.433 3.230 3.569 . 0 0 "[ . 1 . 2]" 1
1620 1 71 LEU MD2 1 85 SER HA . . 4.540 4.167 3.792 4.389 . 0 0 "[ . 1 . 2]" 1
1621 1 71 LEU MD2 1 86 ALA H . . 4.110 3.994 3.773 4.113 0.003 3 0 "[ . 1 . 2]" 1
1622 1 71 LEU MD2 1 86 ALA HA . . 4.380 4.007 3.805 4.291 . 0 0 "[ . 1 . 2]" 1
1623 1 71 LEU MD2 1 101 TYR HB2 . . 5.300 4.845 4.679 5.019 . 0 0 "[ . 1 . 2]" 1
1624 1 71 LEU MD2 1 101 TYR QD . . 4.320 3.480 3.284 3.615 . 0 0 "[ . 1 . 2]" 1
1625 1 71 LEU MD2 1 101 TYR QE . . 3.590 2.330 2.011 2.655 . 0 0 "[ . 1 . 2]" 1
1626 1 71 LEU MD2 1 101 TYR HH . . 3.940 2.618 1.900 3.201 . 0 0 "[ . 1 . 2]" 1
1627 1 71 LEU HG 1 86 ALA MB . . 4.750 4.196 3.877 4.365 . 0 0 "[ . 1 . 2]" 1
1628 1 71 LEU HG 1 101 TYR QE . . 4.670 3.353 3.112 3.635 . 0 0 "[ . 1 . 2]" 1
1629 1 72 LYS H 1 72 LYS HB2 . . 2.900 2.387 2.306 2.577 . 0 0 "[ . 1 . 2]" 1
1630 1 72 LYS H 1 72 LYS HB3 . . 3.470 2.734 2.589 2.815 . 0 0 "[ . 1 . 2]" 1
1631 1 72 LYS H 1 72 LYS QD . . 4.760 4.496 4.265 4.660 . 0 0 "[ . 1 . 2]" 1
1632 1 72 LYS H 1 72 LYS HG2 . . 4.590 4.508 4.447 4.563 . 0 0 "[ . 1 . 2]" 1
1633 1 72 LYS H 1 72 LYS HG3 . . 4.870 4.366 4.274 4.646 . 0 0 "[ . 1 . 2]" 1
1634 1 72 LYS H 1 73 VAL H . . 3.180 2.819 2.731 2.900 . 0 0 "[ . 1 . 2]" 1
1635 1 72 LYS H 1 73 VAL HB . . 4.890 4.684 4.535 4.769 . 0 0 "[ . 1 . 2]" 1
1636 1 72 LYS H 1 73 VAL MG2 . . 4.650 4.566 4.490 4.625 . 0 0 "[ . 1 . 2]" 1
1637 1 72 LYS H 1 74 ALA H . . 4.460 3.584 3.444 3.683 . 0 0 "[ . 1 . 2]" 1
1638 1 72 LYS H 1 74 ALA MB . . 5.040 4.271 4.111 4.421 . 0 0 "[ . 1 . 2]" 1
1639 1 72 LYS HA 1 72 LYS QD . . 4.540 4.017 3.364 4.141 . 0 0 "[ . 1 . 2]" 1
1640 1 72 LYS HA 1 72 LYS QE . . 5.500 4.487 4.019 4.884 . 0 0 "[ . 1 . 2]" 1
1641 1 72 LYS HA 1 72 LYS HG2 . . 4.110 2.701 2.328 2.953 . 0 0 "[ . 1 . 2]" 1
1642 1 72 LYS HA 1 72 LYS HG3 . . 3.680 2.646 2.400 3.522 . 0 0 "[ . 1 . 2]" 1
1643 1 72 LYS HA 1 75 GLU H . . 3.890 3.360 3.287 3.586 . 0 0 "[ . 1 . 2]" 1
1644 1 72 LYS HA 1 75 GLU HB3 . . 4.050 2.933 2.796 3.052 . 0 0 "[ . 1 . 2]" 1
1645 1 72 LYS HA 1 76 ASN H . . 4.400 4.211 4.031 4.340 . 0 0 "[ . 1 . 2]" 1
1646 1 72 LYS HB2 1 73 VAL H . . 3.840 3.361 3.299 3.467 . 0 0 "[ . 1 . 2]" 1
1647 1 72 LYS HB2 1 73 VAL MG2 . . 4.990 4.622 4.531 4.706 . 0 0 "[ . 1 . 2]" 1
1648 1 72 LYS HB2 1 76 ASN HD21 . . 5.340 4.784 4.304 5.166 . 0 0 "[ . 1 . 2]" 1
1649 1 72 LYS HB2 1 76 ASN QD . . 4.640 4.380 4.048 4.570 . 0 0 "[ . 1 . 2]" 1
1650 1 72 LYS HB2 1 76 ASN HD22 . . 5.340 5.106 4.857 5.333 . 0 0 "[ . 1 . 2]" 1
1651 1 72 LYS HB3 1 73 VAL H . . 3.290 1.944 1.896 2.097 . 0 0 "[ . 1 . 2]" 1
1652 1 72 LYS HB3 1 73 VAL HA . . 5.350 3.946 3.893 4.085 . 0 0 "[ . 1 . 2]" 1
1653 1 72 LYS HB3 1 73 VAL MG2 . . 4.150 3.145 3.089 3.229 . 0 0 "[ . 1 . 2]" 1
1654 1 72 LYS QD 1 73 VAL MG2 . . 4.890 3.643 2.550 4.097 . 0 0 "[ . 1 . 2]" 1
1655 1 72 LYS QD 1 76 ASN HD21 . . 5.060 3.513 2.461 4.152 . 0 0 "[ . 1 . 2]" 1
1656 1 72 LYS QD 1 76 ASN HD22 . . 5.060 3.574 2.736 4.311 . 0 0 "[ . 1 . 2]" 1
1657 1 72 LYS HG2 1 73 VAL H . . 4.480 3.704 3.472 4.130 . 0 0 "[ . 1 . 2]" 1
1658 1 72 LYS HG2 1 73 VAL HA . . 4.960 4.112 3.858 4.768 . 0 0 "[ . 1 . 2]" 1
1659 1 72 LYS HG2 1 73 VAL MG2 . . 4.860 4.299 4.008 4.870 0.010 3 0 "[ . 1 . 2]" 1
1660 1 72 LYS HG2 1 76 ASN HD21 . . 4.690 2.091 1.899 2.567 . 0 0 "[ . 1 . 2]" 1
1661 1 72 LYS HG2 1 76 ASN QD . . 4.110 1.920 1.764 2.344 . 0 0 "[ . 1 . 2]" 1
1662 1 72 LYS HG2 1 76 ASN HD22 . . 4.690 2.293 1.983 2.709 . 0 0 "[ . 1 . 2]" 1
1663 1 72 LYS HG3 1 76 ASN HD21 . . 4.450 3.623 2.738 4.197 . 0 0 "[ . 1 . 2]" 1
1664 1 72 LYS HG3 1 76 ASN QD . . 3.910 3.004 2.398 3.709 . 0 0 "[ . 1 . 2]" 1
1665 1 72 LYS HG3 1 76 ASN HD22 . . 4.450 3.224 2.651 4.132 . 0 0 "[ . 1 . 2]" 1
1666 1 73 VAL H 1 73 VAL HB . . 3.110 2.458 2.416 2.496 . 0 0 "[ . 1 . 2]" 1
1667 1 73 VAL H 1 73 VAL MG1 . . 3.800 3.753 3.742 3.761 . 0 0 "[ . 1 . 2]" 1
1668 1 73 VAL H 1 73 VAL MG2 . . 3.050 2.323 2.263 2.396 . 0 0 "[ . 1 . 2]" 1
1669 1 73 VAL H 1 74 ALA H . . 3.270 2.763 2.670 2.827 . 0 0 "[ . 1 . 2]" 1
1670 1 73 VAL H 1 74 ALA MB . . 4.710 4.437 4.368 4.507 . 0 0 "[ . 1 . 2]" 1
1671 1 73 VAL H 1 75 GLU H . . 4.900 4.278 4.109 4.412 . 0 0 "[ . 1 . 2]" 1
1672 1 73 VAL HA 1 73 VAL MG1 . . 3.320 2.442 2.412 2.498 . 0 0 "[ . 1 . 2]" 1
1673 1 73 VAL HA 1 73 VAL MG2 . . 3.180 2.187 2.149 2.210 . 0 0 "[ . 1 . 2]" 1
1674 1 73 VAL HA 1 76 ASN H . . 3.950 3.447 3.330 3.561 . 0 0 "[ . 1 . 2]" 1
1675 1 73 VAL HA 1 76 ASN QB . . 3.700 2.560 2.434 3.036 . 0 0 "[ . 1 . 2]" 1
1676 1 73 VAL HA 1 77 GLU H . . 4.020 3.164 3.093 3.377 . 0 0 "[ . 1 . 2]" 1
1677 1 73 VAL HA 1 77 GLU HB3 . . 5.500 5.505 5.480 5.530 0.030 17 0 "[ . 1 . 2]" 1
1678 1 73 VAL HA 1 77 GLU QG . . 4.250 4.028 3.773 4.210 . 0 0 "[ . 1 . 2]" 1
1679 1 73 VAL HB 1 74 ALA H . . 3.380 3.025 2.849 3.193 . 0 0 "[ . 1 . 2]" 1
1680 1 73 VAL MG1 1 74 ALA H . . 4.000 3.553 3.361 3.674 . 0 0 "[ . 1 . 2]" 1
1681 1 73 VAL MG1 1 74 ALA HA . . 4.420 3.452 3.270 3.550 . 0 0 "[ . 1 . 2]" 1
1682 1 73 VAL MG1 1 76 ASN QB . . 4.930 3.993 3.823 4.431 . 0 0 "[ . 1 . 2]" 1
1683 1 73 VAL MG1 1 77 GLU H . . 4.410 3.383 3.133 3.806 . 0 0 "[ . 1 . 2]" 1
1684 1 73 VAL MG1 1 77 GLU HB2 . . 3.560 2.385 2.153 2.710 . 0 0 "[ . 1 . 2]" 1
1685 1 73 VAL MG1 1 77 GLU HB3 . . 3.930 3.654 3.490 3.935 0.005 12 0 "[ . 1 . 2]" 1
1686 1 73 VAL MG1 1 77 GLU QG . . 3.380 2.918 2.768 3.381 0.001 12 0 "[ . 1 . 2]" 1
1687 1 73 VAL MG1 1 78 LEU H . . 5.030 3.716 3.633 3.905 . 0 0 "[ . 1 . 2]" 1
1688 1 73 VAL MG2 1 74 ALA H . . 4.140 4.096 4.022 4.148 0.008 11 0 "[ . 1 . 2]" 1
1689 1 73 VAL MG2 1 76 ASN QB . . 4.950 4.006 3.918 4.278 . 0 0 "[ . 1 . 2]" 1
1690 1 73 VAL MG2 1 77 GLU HB2 . . 4.760 4.558 4.446 4.682 . 0 0 "[ . 1 . 2]" 1
1691 1 73 VAL MG2 1 77 GLU QG . . 4.510 4.211 4.019 4.382 . 0 0 "[ . 1 . 2]" 1
1692 1 74 ALA H 1 74 ALA MB . . 2.940 2.230 2.172 2.320 . 0 0 "[ . 1 . 2]" 1
1693 1 74 ALA H 1 75 GLU H . . 3.400 2.416 2.319 2.551 . 0 0 "[ . 1 . 2]" 1
1694 1 74 ALA H 1 75 GLU HB2 . . 5.250 4.862 4.322 5.027 . 0 0 "[ . 1 . 2]" 1
1695 1 74 ALA H 1 75 GLU HB3 . . 4.880 4.662 4.482 4.844 . 0 0 "[ . 1 . 2]" 1
1696 1 74 ALA HA 1 77 GLU H . . 4.400 4.164 4.011 4.348 . 0 0 "[ . 1 . 2]" 1
1697 1 74 ALA HA 1 77 GLU HB2 . . 4.970 4.134 3.984 4.423 . 0 0 "[ . 1 . 2]" 1
1698 1 74 ALA HA 1 78 LEU H . . 3.590 2.839 2.683 3.039 . 0 0 "[ . 1 . 2]" 1
1699 1 74 ALA HA 1 78 LEU HB2 . . 3.510 2.458 2.196 2.718 . 0 0 "[ . 1 . 2]" 1
1700 1 74 ALA HA 1 78 LEU HB3 . . 4.270 3.912 3.669 4.104 . 0 0 "[ . 1 . 2]" 1
1701 1 74 ALA HA 1 78 LEU MD1 . . 3.480 2.299 1.972 2.525 . 0 0 "[ . 1 . 2]" 1
1702 1 74 ALA HA 1 78 LEU MD2 . . 4.160 3.771 3.705 3.857 . 0 0 "[ . 1 . 2]" 1
1703 1 74 ALA HA 1 78 LEU HG . . 4.060 2.079 1.998 2.207 . 0 0 "[ . 1 . 2]" 1
1704 1 74 ALA HA 1 105 PHE QE . . 4.660 3.920 3.623 4.333 . 0 0 "[ . 1 . 2]" 1
1705 1 74 ALA HA 1 105 PHE HZ . . 4.890 4.250 4.025 4.409 . 0 0 "[ . 1 . 2]" 1
1706 1 74 ALA MB 1 75 GLU H . . 3.490 2.728 2.505 3.341 . 0 0 "[ . 1 . 2]" 1
1707 1 74 ALA MB 1 75 GLU HA . . 4.980 3.912 3.835 4.158 . 0 0 "[ . 1 . 2]" 1
1708 1 74 ALA MB 1 76 ASN H . . 4.980 4.347 4.217 4.832 . 0 0 "[ . 1 . 2]" 1
1709 1 74 ALA MB 1 78 LEU H . . 4.820 4.383 4.232 4.570 . 0 0 "[ . 1 . 2]" 1
1710 1 74 ALA MB 1 78 LEU HB2 . . 4.110 3.065 2.856 3.254 . 0 0 "[ . 1 . 2]" 1
1711 1 74 ALA MB 1 79 GLY H . . 5.300 4.526 4.318 4.767 . 0 0 "[ . 1 . 2]" 1
1712 1 74 ALA MB 1 80 ILE H . . 4.280 3.587 3.441 3.820 . 0 0 "[ . 1 . 2]" 1
1713 1 74 ALA MB 1 80 ILE HB . . 3.490 2.384 2.194 2.795 . 0 0 "[ . 1 . 2]" 1
1714 1 74 ALA MB 1 80 ILE MD . . 4.810 4.655 4.488 4.813 0.003 19 0 "[ . 1 . 2]" 1
1715 1 74 ALA MB 1 80 ILE HG13 . . 4.510 3.714 3.513 3.971 . 0 0 "[ . 1 . 2]" 1
1716 1 74 ALA MB 1 80 ILE MG . . 3.970 3.430 3.047 3.693 . 0 0 "[ . 1 . 2]" 1
1717 1 74 ALA MB 1 101 TYR QE . . 4.290 3.821 3.635 3.989 . 0 0 "[ . 1 . 2]" 1
1718 1 74 ALA MB 1 101 TYR HH . . 3.480 2.606 2.069 3.228 . 0 0 "[ . 1 . 2]" 1
1719 1 74 ALA MB 1 105 PHE QD . . 4.550 4.257 3.983 4.430 . 0 0 "[ . 1 . 2]" 1
1720 1 74 ALA MB 1 105 PHE QE . . 3.900 2.552 2.176 2.805 . 0 0 "[ . 1 . 2]" 1
1721 1 74 ALA MB 1 105 PHE HZ . . 3.300 1.967 1.821 2.065 . 0 0 "[ . 1 . 2]" 1
1722 1 75 GLU H 1 75 GLU HB2 . . 3.290 2.710 2.606 2.934 . 0 0 "[ . 1 . 2]" 1
1723 1 75 GLU H 1 75 GLU HB3 . . 3.250 2.492 2.393 2.725 . 0 0 "[ . 1 . 2]" 1
1724 1 75 GLU H 1 75 GLU HG2 . . 4.970 4.496 4.458 4.582 . 0 0 "[ . 1 . 2]" 1
1725 1 75 GLU H 1 75 GLU HG3 . . 4.880 4.684 4.640 4.893 0.013 12 0 "[ . 1 . 2]" 1
1726 1 75 GLU H 1 76 ASN H . . 3.270 2.317 1.866 2.437 . 0 0 "[ . 1 . 2]" 1
1727 1 75 GLU H 1 76 ASN QB . . 4.650 4.177 3.844 4.359 . 0 0 "[ . 1 . 2]" 1
1728 1 75 GLU H 1 77 GLU H . . 4.980 4.410 3.504 4.606 . 0 0 "[ . 1 . 2]" 1
1729 1 75 GLU H 1 80 ILE H . . 4.960 4.679 4.374 4.962 0.002 12 0 "[ . 1 . 2]" 1
1730 1 75 GLU H 1 80 ILE HB . . 5.140 4.946 4.713 5.148 0.008 12 0 "[ . 1 . 2]" 1
1731 1 75 GLU H 1 82 PRO QD . . 4.720 4.578 4.454 4.729 0.009 12 0 "[ . 1 . 2]" 1
1732 1 75 GLU HA 1 75 GLU HG2 . . 4.090 2.443 2.321 2.551 . 0 0 "[ . 1 . 2]" 1
1733 1 75 GLU HA 1 75 GLU HG3 . . 4.050 3.623 3.534 3.705 . 0 0 "[ . 1 . 2]" 1
1734 1 75 GLU HA 1 79 GLY H . . 4.500 3.330 3.121 3.546 . 0 0 "[ . 1 . 2]" 1
1735 1 75 GLU HA 1 80 ILE H . . 3.430 2.984 2.630 3.412 . 0 0 "[ . 1 . 2]" 1
1736 1 75 GLU HA 1 82 PRO QD . . 4.860 3.660 3.456 3.884 . 0 0 "[ . 1 . 2]" 1
1737 1 75 GLU HB2 1 76 ASN H . . 4.430 4.164 3.955 4.244 . 0 0 "[ . 1 . 2]" 1
1738 1 75 GLU HB2 1 81 THR HA . . 4.560 3.335 2.989 3.689 . 0 0 "[ . 1 . 2]" 1
1739 1 75 GLU HB2 1 82 PRO QD . . 3.590 2.009 1.984 2.092 . 0 0 "[ . 1 . 2]" 1
1740 1 75 GLU HB3 1 76 ASN H . . 3.320 3.159 2.920 3.313 . 0 0 "[ . 1 . 2]" 1
1741 1 75 GLU HB3 1 82 PRO QD . . 4.490 3.329 3.200 3.418 . 0 0 "[ . 1 . 2]" 1
1742 1 75 GLU HG2 1 76 ASN HA . . 5.130 4.990 4.792 5.130 . 0 0 "[ . 1 . 2]" 1
1743 1 75 GLU HG2 1 81 THR HA . . 3.640 2.451 2.197 2.663 . 0 0 "[ . 1 . 2]" 1
1744 1 75 GLU HG2 1 81 THR HB . . 5.500 5.241 4.905 5.413 . 0 0 "[ . 1 . 2]" 1
1745 1 75 GLU HG2 1 82 PRO QD . . 4.420 2.653 2.372 2.901 . 0 0 "[ . 1 . 2]" 1
1746 1 75 GLU HG3 1 76 ASN H . . 5.500 5.363 5.233 5.473 . 0 0 "[ . 1 . 2]" 1
1747 1 75 GLU HG3 1 81 THR H . . 5.500 5.409 5.158 5.504 0.004 10 0 "[ . 1 . 2]" 1
1748 1 75 GLU HG3 1 81 THR HA . . 4.570 2.974 2.571 3.199 . 0 0 "[ . 1 . 2]" 1
1749 1 75 GLU HG3 1 82 PRO QD . . 4.510 1.937 1.841 1.960 . 0 0 "[ . 1 . 2]" 1
1750 1 75 GLU HG3 1 82 PRO HG3 . . 3.420 3.130 2.843 3.421 0.001 3 0 "[ . 1 . 2]" 1
1751 1 76 ASN H 1 76 ASN QB . . 2.950 2.273 2.209 2.342 . 0 0 "[ . 1 . 2]" 1
1752 1 76 ASN H 1 76 ASN HD21 . . 4.840 3.431 2.697 4.042 . 0 0 "[ . 1 . 2]" 1
1753 1 76 ASN H 1 76 ASN QD . . 4.150 3.319 2.670 3.818 . 0 0 "[ . 1 . 2]" 1
1754 1 76 ASN H 1 76 ASN HD22 . . 4.840 4.508 4.072 4.762 . 0 0 "[ . 1 . 2]" 1
1755 1 76 ASN H 1 77 GLU H . . 3.310 2.522 2.347 2.629 . 0 0 "[ . 1 . 2]" 1
1756 1 76 ASN H 1 77 GLU QG . . 5.500 5.162 4.881 5.265 . 0 0 "[ . 1 . 2]" 1
1757 1 76 ASN H 1 78 LEU H . . 4.650 4.207 3.975 4.402 . 0 0 "[ . 1 . 2]" 1
1758 1 76 ASN H 1 78 LEU HG . . 5.350 5.258 5.055 5.354 0.004 6 0 "[ . 1 . 2]" 1
1759 1 76 ASN H 1 79 GLY H . . 5.070 3.613 3.448 3.815 . 0 0 "[ . 1 . 2]" 1
1760 1 76 ASN HA 1 79 GLY H . . 5.190 4.403 4.164 4.619 . 0 0 "[ . 1 . 2]" 1
1761 1 76 ASN QB 1 77 GLU H . . 3.360 2.276 2.172 2.494 . 0 0 "[ . 1 . 2]" 1
1762 1 76 ASN QB 1 77 GLU HA . . 4.810 3.837 3.795 3.965 . 0 0 "[ . 1 . 2]" 1
1763 1 76 ASN QB 1 77 GLU HB2 . . 4.690 3.902 3.835 4.032 . 0 0 "[ . 1 . 2]" 1
1764 1 76 ASN QB 1 77 GLU QG . . 3.750 3.440 3.294 3.520 . 0 0 "[ . 1 . 2]" 1
1765 1 76 ASN QB 1 78 LEU H . . 4.900 4.760 4.663 4.908 0.008 12 0 "[ . 1 . 2]" 1
1766 1 77 GLU H 1 77 GLU HB2 . . 3.700 2.188 2.169 2.281 . 0 0 "[ . 1 . 2]" 1
1767 1 77 GLU H 1 77 GLU HB3 . . 3.580 3.488 3.473 3.551 . 0 0 "[ . 1 . 2]" 1
1768 1 77 GLU H 1 77 GLU QG . . 3.250 2.975 2.897 3.069 . 0 0 "[ . 1 . 2]" 1
1769 1 77 GLU H 1 78 LEU H . . 3.060 2.835 2.688 2.899 . 0 0 "[ . 1 . 2]" 1
1770 1 77 GLU H 1 78 LEU HG . . 4.420 4.295 4.119 4.390 . 0 0 "[ . 1 . 2]" 1
1771 1 77 GLU H 1 79 GLY H . . 4.010 3.550 3.290 3.775 . 0 0 "[ . 1 . 2]" 1
1772 1 77 GLU HA 1 77 GLU QG . . 3.730 2.650 2.120 2.826 . 0 0 "[ . 1 . 2]" 1
1773 1 77 GLU HA 1 79 GLY H . . 4.810 4.282 4.042 4.599 . 0 0 "[ . 1 . 2]" 1
1774 1 77 GLU HB2 1 78 LEU H . . 4.080 2.358 2.243 2.425 . 0 0 "[ . 1 . 2]" 1
1775 1 77 GLU HB2 1 78 LEU MD1 . . 5.360 4.755 4.666 4.855 . 0 0 "[ . 1 . 2]" 1
1776 1 77 GLU HB2 1 78 LEU HG . . 4.360 3.330 3.214 3.424 . 0 0 "[ . 1 . 2]" 1
1777 1 77 GLU HB3 1 78 LEU H . . 3.420 2.608 2.495 2.762 . 0 0 "[ . 1 . 2]" 1
1778 1 77 GLU HB3 1 78 LEU MD2 . . 4.880 2.923 2.581 3.213 . 0 0 "[ . 1 . 2]" 1
1779 1 77 GLU HB3 1 78 LEU HG . . 4.270 3.617 3.499 3.774 . 0 0 "[ . 1 . 2]" 1
1780 1 77 GLU QG 1 78 LEU H . . 4.790 4.063 4.014 4.122 . 0 0 "[ . 1 . 2]" 1
1781 1 77 GLU QG 1 78 LEU HG . . 5.070 4.936 4.833 5.097 0.027 6 0 "[ . 1 . 2]" 1
1782 1 78 LEU H 1 78 LEU HB2 . . 3.390 2.745 2.694 2.785 . 0 0 "[ . 1 . 2]" 1
1783 1 78 LEU H 1 78 LEU MD2 . . 4.010 2.735 2.442 2.950 . 0 0 "[ . 1 . 2]" 1
1784 1 78 LEU H 1 78 LEU HG . . 3.570 1.928 1.889 1.993 . 0 0 "[ . 1 . 2]" 1
1785 1 78 LEU H 1 79 GLY H . . 3.000 2.674 2.565 2.755 . 0 0 "[ . 1 . 2]" 1
1786 1 78 LEU H 1 80 ILE H . . 4.410 4.287 4.128 4.413 0.003 19 0 "[ . 1 . 2]" 1
1787 1 78 LEU HB2 1 78 LEU MD1 . . 3.560 2.322 2.209 2.429 . 0 0 "[ . 1 . 2]" 1
1788 1 78 LEU HB2 1 79 GLY H . . 4.130 2.871 2.599 3.068 . 0 0 "[ . 1 . 2]" 1
1789 1 78 LEU HB2 1 80 ILE H . . 4.180 2.380 2.274 2.500 . 0 0 "[ . 1 . 2]" 1
1790 1 78 LEU HB2 1 80 ILE HB . . 4.930 3.260 3.028 3.451 . 0 0 "[ . 1 . 2]" 1
1791 1 78 LEU HB2 1 80 ILE MD . . 4.390 4.075 3.887 4.291 . 0 0 "[ . 1 . 2]" 1
1792 1 78 LEU HB2 1 80 ILE HG12 . . 4.240 2.453 2.263 2.726 . 0 0 "[ . 1 . 2]" 1
1793 1 78 LEU HB2 1 80 ILE HG13 . . 4.630 3.427 3.179 3.897 . 0 0 "[ . 1 . 2]" 1
1794 1 78 LEU HB2 1 109 PHE QE . . 4.920 4.541 3.933 4.854 . 0 0 "[ . 1 . 2]" 1
1795 1 78 LEU HB3 1 78 LEU MD1 . . 3.500 2.345 2.210 2.463 . 0 0 "[ . 1 . 2]" 1
1796 1 78 LEU HB3 1 79 GLY H . . 4.320 4.035 3.869 4.184 . 0 0 "[ . 1 . 2]" 1
1797 1 78 LEU HB3 1 80 ILE H . . 4.510 3.472 3.236 3.791 . 0 0 "[ . 1 . 2]" 1
1798 1 78 LEU HB3 1 80 ILE MD . . 4.140 3.599 3.340 3.948 . 0 0 "[ . 1 . 2]" 1
1799 1 78 LEU HB3 1 80 ILE HG13 . . 4.630 3.223 2.817 3.625 . 0 0 "[ . 1 . 2]" 1
1800 1 78 LEU HB3 1 109 PHE QD . . 5.500 4.834 4.075 5.155 . 0 0 "[ . 1 . 2]" 1
1801 1 78 LEU HB3 1 109 PHE QE . . 4.490 2.856 2.230 3.127 . 0 0 "[ . 1 . 2]" 1
1802 1 78 LEU HB3 1 109 PHE HZ . . 4.640 3.901 3.324 4.387 . 0 0 "[ . 1 . 2]" 1
1803 1 78 LEU MD1 1 80 ILE MD . . 4.600 4.163 3.992 4.518 . 0 0 "[ . 1 . 2]" 1
1804 1 78 LEU MD1 1 105 PHE HA . . 5.090 4.344 4.070 4.766 . 0 0 "[ . 1 . 2]" 1
1805 1 78 LEU MD1 1 105 PHE QD . . 4.400 2.710 2.434 2.895 . 0 0 "[ . 1 . 2]" 1
1806 1 78 LEU MD1 1 105 PHE QE . . 4.000 1.907 1.832 2.080 . 0 0 "[ . 1 . 2]" 1
1807 1 78 LEU MD1 1 105 PHE HZ . . 4.850 3.235 2.882 3.633 . 0 0 "[ . 1 . 2]" 1
1808 1 78 LEU MD1 1 109 PHE QD . . 5.450 4.444 3.794 4.860 . 0 0 "[ . 1 . 2]" 1
1809 1 78 LEU MD1 1 109 PHE QE . . 4.580 3.418 2.527 3.999 . 0 0 "[ . 1 . 2]" 1
1810 1 78 LEU MD1 1 109 PHE HZ . . 4.530 4.206 3.681 4.529 . 0 0 "[ . 1 . 2]" 1
1811 1 78 LEU MD2 1 79 GLY H . . 4.990 4.488 4.409 4.627 . 0 0 "[ . 1 . 2]" 1
1812 1 78 LEU MD2 1 105 PHE QD . . 5.300 4.455 4.239 4.800 . 0 0 "[ . 1 . 2]" 1
1813 1 78 LEU MD2 1 109 PHE QD . . 4.950 4.455 4.052 4.686 . 0 0 "[ . 1 . 2]" 1
1814 1 78 LEU MD2 1 109 PHE QE . . 4.380 2.905 2.411 3.438 . 0 0 "[ . 1 . 2]" 1
1815 1 78 LEU MD2 1 109 PHE HZ . . 3.480 2.492 2.132 2.868 . 0 0 "[ . 1 . 2]" 1
1816 1 78 LEU HG 1 79 GLY H . . 4.670 4.035 3.876 4.178 . 0 0 "[ . 1 . 2]" 1
1817 1 79 GLY H 1 80 ILE H . . 3.230 2.548 2.321 2.720 . 0 0 "[ . 1 . 2]" 1
1818 1 79 GLY H 1 80 ILE HB . . 5.080 4.794 4.595 4.924 . 0 0 "[ . 1 . 2]" 1
1819 1 79 GLY H 1 80 ILE HG12 . . 5.170 4.187 3.892 4.591 . 0 0 "[ . 1 . 2]" 1
1820 1 80 ILE H 1 80 ILE HB . . 3.230 2.527 2.464 2.619 . 0 0 "[ . 1 . 2]" 1
1821 1 80 ILE H 1 80 ILE MD . . 4.200 3.376 3.084 3.673 . 0 0 "[ . 1 . 2]" 1
1822 1 80 ILE H 1 80 ILE HG12 . . 3.500 2.196 1.943 2.381 . 0 0 "[ . 1 . 2]" 1
1823 1 80 ILE H 1 80 ILE HG13 . . 3.820 3.607 3.418 3.759 . 0 0 "[ . 1 . 2]" 1
1824 1 80 ILE H 1 80 ILE MG . . 4.110 3.770 3.758 3.794 . 0 0 "[ . 1 . 2]" 1
1825 1 80 ILE H 1 81 THR H . . 4.350 4.106 3.991 4.302 . 0 0 "[ . 1 . 2]" 1
1826 1 80 ILE HA 1 80 ILE MD . . 3.310 2.092 1.965 2.235 . 0 0 "[ . 1 . 2]" 1
1827 1 80 ILE HA 1 80 ILE HG12 . . 3.310 3.004 2.833 3.093 . 0 0 "[ . 1 . 2]" 1
1828 1 80 ILE HA 1 80 ILE MG . . 3.250 2.355 2.260 2.479 . 0 0 "[ . 1 . 2]" 1
1829 1 80 ILE HA 1 81 THR H . . 2.660 2.263 2.179 2.323 . 0 0 "[ . 1 . 2]" 1
1830 1 80 ILE HB 1 101 TYR QE . . 5.320 3.832 3.423 4.227 . 0 0 "[ . 1 . 2]" 1
1831 1 80 ILE MD 1 80 ILE MG . . 3.070 1.953 1.894 2.051 . 0 0 "[ . 1 . 2]" 1
1832 1 80 ILE MD 1 81 THR H . . 4.290 3.981 3.770 4.140 . 0 0 "[ . 1 . 2]" 1
1833 1 80 ILE MD 1 104 HIS HB2 . . 4.500 2.968 2.545 3.388 . 0 0 "[ . 1 . 2]" 1
1834 1 80 ILE MD 1 104 HIS HB3 . . 4.080 2.108 1.975 2.309 . 0 0 "[ . 1 . 2]" 1
1835 1 80 ILE MD 1 104 HIS HD2 . . 5.500 5.433 5.247 5.505 0.005 12 0 "[ . 1 . 2]" 1
1836 1 80 ILE MD 1 105 PHE H . . 4.230 3.673 3.342 3.956 . 0 0 "[ . 1 . 2]" 1
1837 1 80 ILE MD 1 105 PHE HA . . 3.400 2.702 2.346 3.054 . 0 0 "[ . 1 . 2]" 1
1838 1 80 ILE MD 1 105 PHE HB2 . . 5.210 4.924 4.652 5.190 . 0 0 "[ . 1 . 2]" 1
1839 1 80 ILE MD 1 105 PHE QD . . 4.310 3.910 3.489 4.224 . 0 0 "[ . 1 . 2]" 1
1840 1 80 ILE MD 1 105 PHE QE . . 4.800 4.439 4.073 4.768 . 0 0 "[ . 1 . 2]" 1
1841 1 80 ILE MD 1 108 ALA H . . 4.630 4.345 4.117 4.587 . 0 0 "[ . 1 . 2]" 1
1842 1 80 ILE MD 1 108 ALA MB . . 3.180 2.694 2.419 3.012 . 0 0 "[ . 1 . 2]" 1
1843 1 80 ILE MD 1 109 PHE QD . . 4.500 4.040 3.551 4.337 . 0 0 "[ . 1 . 2]" 1
1844 1 80 ILE MD 1 109 PHE QE . . 4.070 3.719 2.932 4.071 0.001 6 0 "[ . 1 . 2]" 1
1845 1 80 ILE HG12 1 80 ILE MG . . 3.630 3.190 3.170 3.202 . 0 0 "[ . 1 . 2]" 1
1846 1 80 ILE HG12 1 81 THR H . . 5.170 5.086 4.942 5.205 0.035 12 0 "[ . 1 . 2]" 1
1847 1 80 ILE HG12 1 105 PHE HA . . 4.600 4.329 4.082 4.600 0.000 6 0 "[ . 1 . 2]" 1
1848 1 80 ILE HG12 1 105 PHE HZ . . 5.500 5.148 4.913 5.497 . 0 0 "[ . 1 . 2]" 1
1849 1 80 ILE HG13 1 80 ILE MG . . 3.550 2.387 2.302 2.488 . 0 0 "[ . 1 . 2]" 1
1850 1 80 ILE HG13 1 109 PHE QE . . 4.850 4.248 3.882 4.676 . 0 0 "[ . 1 . 2]" 1
1851 1 80 ILE MG 1 81 THR H . . 3.580 3.382 3.026 3.581 0.001 18 0 "[ . 1 . 2]" 1
1852 1 80 ILE MG 1 82 PRO HA . . 4.600 4.166 3.882 4.318 . 0 0 "[ . 1 . 2]" 1
1853 1 80 ILE MG 1 101 TYR QD . . 3.860 3.203 3.024 3.415 . 0 0 "[ . 1 . 2]" 1
1854 1 80 ILE MG 1 101 TYR QE . . 3.180 2.199 1.979 2.506 . 0 0 "[ . 1 . 2]" 1
1855 1 80 ILE MG 1 101 TYR HH . . 4.420 3.354 2.777 4.133 . 0 0 "[ . 1 . 2]" 1
1856 1 80 ILE MG 1 104 HIS H . . 4.690 4.173 4.024 4.336 . 0 0 "[ . 1 . 2]" 1
1857 1 80 ILE MG 1 104 HIS HB2 . . 3.720 2.092 1.912 2.323 . 0 0 "[ . 1 . 2]" 1
1858 1 80 ILE MG 1 104 HIS HB3 . . 3.610 2.214 1.940 2.516 . 0 0 "[ . 1 . 2]" 1
1859 1 80 ILE MG 1 104 HIS HD2 . . 5.020 4.815 4.053 5.014 . 0 0 "[ . 1 . 2]" 1
1860 1 80 ILE MG 1 105 PHE H . . 4.340 3.366 3.121 3.552 . 0 0 "[ . 1 . 2]" 1
1861 1 80 ILE MG 1 105 PHE HA . . 4.360 3.705 3.454 3.856 . 0 0 "[ . 1 . 2]" 1
1862 1 80 ILE MG 1 105 PHE QD . . 4.410 2.800 2.291 3.166 . 0 0 "[ . 1 . 2]" 1
1863 1 80 ILE MG 1 105 PHE QE . . 4.440 2.344 1.980 2.739 . 0 0 "[ . 1 . 2]" 1
1864 1 80 ILE MG 1 105 PHE HZ . . 4.250 3.507 3.028 4.070 . 0 0 "[ . 1 . 2]" 1
1865 1 81 THR H 1 81 THR HB . . 3.280 2.633 2.442 2.820 . 0 0 "[ . 1 . 2]" 1
1866 1 81 THR H 1 81 THR MG . . 3.920 3.770 3.750 3.785 . 0 0 "[ . 1 . 2]" 1
1867 1 81 THR H 1 82 PRO QD . . 4.450 4.235 4.145 4.311 . 0 0 "[ . 1 . 2]" 1
1868 1 81 THR HA 1 81 THR MG . . 3.340 2.446 2.334 2.570 . 0 0 "[ . 1 . 2]" 1
1869 1 81 THR HA 1 82 PRO QD . . 2.850 1.947 1.899 1.975 . 0 0 "[ . 1 . 2]" 1
1870 1 81 THR HB 1 82 PRO QD . . 3.980 3.869 3.779 4.052 0.072 15 0 "[ . 1 . 2]" 1
1871 1 81 THR MG 1 82 PRO QD . . 3.200 1.878 1.806 1.953 . 0 0 "[ . 1 . 2]" 1
1872 1 81 THR MG 1 82 PRO HG3 . . 4.330 4.018 3.891 4.260 . 0 0 "[ . 1 . 2]" 1
1873 1 82 PRO HA 1 83 VAL H . . 2.970 2.253 2.197 2.337 . 0 0 "[ . 1 . 2]" 1
1874 1 82 PRO HA 1 83 VAL MG1 . . 4.630 4.164 4.063 4.215 . 0 0 "[ . 1 . 2]" 1
1875 1 82 PRO HA 1 84 VAL H . . 3.840 3.415 3.269 3.634 . 0 0 "[ . 1 . 2]" 1
1876 1 82 PRO HA 1 101 TYR QD . . 4.130 3.625 3.284 3.982 . 0 0 "[ . 1 . 2]" 1
1877 1 82 PRO HA 1 101 TYR QE . . 3.400 2.339 2.117 2.503 . 0 0 "[ . 1 . 2]" 1
1878 1 82 PRO HB2 1 83 VAL H . . 4.310 4.066 3.949 4.188 . 0 0 "[ . 1 . 2]" 1
1879 1 82 PRO HB2 1 84 VAL H . . 4.320 3.887 3.680 4.198 . 0 0 "[ . 1 . 2]" 1
1880 1 82 PRO HB3 1 84 VAL H . . 5.020 4.727 4.559 5.024 0.004 14 0 "[ . 1 . 2]" 1
1881 1 82 PRO HB3 1 101 TYR QE . . 4.360 4.132 3.833 4.370 0.010 20 0 "[ . 1 . 2]" 1
1882 1 83 VAL H 1 83 VAL HB . . 3.560 2.362 2.286 2.436 . 0 0 "[ . 1 . 2]" 1
1883 1 83 VAL H 1 83 VAL MG1 . . 3.080 2.507 2.420 2.641 . 0 0 "[ . 1 . 2]" 1
1884 1 83 VAL H 1 83 VAL MG2 . . 3.750 3.722 3.680 3.754 0.004 15 0 "[ . 1 . 2]" 1
1885 1 83 VAL H 1 84 VAL H . . 3.000 2.497 2.356 2.628 . 0 0 "[ . 1 . 2]" 1
1886 1 83 VAL H 1 84 VAL MG2 . . 4.640 4.396 4.272 4.560 . 0 0 "[ . 1 . 2]" 1
1887 1 83 VAL H 1 101 TYR HA . . 4.900 4.062 3.830 4.282 . 0 0 "[ . 1 . 2]" 1
1888 1 83 VAL H 1 101 TYR HB2 . . 4.710 3.957 3.675 4.290 . 0 0 "[ . 1 . 2]" 1
1889 1 83 VAL H 1 101 TYR QD . . 3.840 2.369 2.198 2.580 . 0 0 "[ . 1 . 2]" 1
1890 1 83 VAL H 1 101 TYR QE . . 4.010 2.820 2.555 3.173 . 0 0 "[ . 1 . 2]" 1
1891 1 83 VAL HA 1 83 VAL MG2 . . 3.000 2.086 2.034 2.261 . 0 0 "[ . 1 . 2]" 1
1892 1 83 VAL HB 1 84 VAL H . . 3.980 3.831 3.697 3.893 . 0 0 "[ . 1 . 2]" 1
1893 1 83 VAL HB 1 84 VAL MG2 . . 4.420 4.304 4.207 4.378 . 0 0 "[ . 1 . 2]" 1
1894 1 83 VAL HB 1 101 TYR HA . . 4.820 3.284 3.189 3.358 . 0 0 "[ . 1 . 2]" 1
1895 1 83 VAL HB 1 101 TYR HB2 . . 4.070 3.979 3.898 4.076 0.006 14 0 "[ . 1 . 2]" 1
1896 1 83 VAL HB 1 101 TYR HB3 . . 5.500 5.481 5.426 5.505 0.005 14 0 "[ . 1 . 2]" 1
1897 1 83 VAL HB 1 101 TYR QD . . 3.920 2.793 2.607 3.068 . 0 0 "[ . 1 . 2]" 1
1898 1 83 VAL MG1 1 84 VAL H . . 3.620 2.016 1.903 2.171 . 0 0 "[ . 1 . 2]" 1
1899 1 83 VAL MG1 1 84 VAL HA . . 4.930 3.449 3.214 3.539 . 0 0 "[ . 1 . 2]" 1
1900 1 83 VAL MG1 1 84 VAL HB . . 4.550 3.010 2.941 3.079 . 0 0 "[ . 1 . 2]" 1
1901 1 83 VAL MG1 1 84 VAL MG2 . . 4.180 1.817 1.742 1.877 . 0 0 "[ . 1 . 2]" 1
1902 1 83 VAL MG1 1 97 GLY HA2 . . 4.330 3.237 3.068 3.489 . 0 0 "[ . 1 . 2]" 1
1903 1 83 VAL MG1 1 97 GLY HA3 . . 4.440 3.576 3.403 3.855 . 0 0 "[ . 1 . 2]" 1
1904 1 83 VAL MG1 1 98 LEU H . . 5.200 4.697 4.541 4.861 . 0 0 "[ . 1 . 2]" 1
1905 1 83 VAL MG1 1 100 ALA H . . 5.500 4.390 4.189 4.569 . 0 0 "[ . 1 . 2]" 1
1906 1 83 VAL MG1 1 100 ALA HA . . 5.110 4.854 4.650 5.067 . 0 0 "[ . 1 . 2]" 1
1907 1 83 VAL MG1 1 100 ALA MB . . 3.170 2.967 2.730 3.163 . 0 0 "[ . 1 . 2]" 1
1908 1 83 VAL MG1 1 101 TYR H . . 3.540 2.700 2.456 3.005 . 0 0 "[ . 1 . 2]" 1
1909 1 83 VAL MG1 1 101 TYR HA . . 3.020 2.030 1.966 2.224 . 0 0 "[ . 1 . 2]" 1
1910 1 83 VAL MG1 1 101 TYR HB2 . . 3.430 1.821 1.786 1.867 . 0 0 "[ . 1 . 2]" 1
1911 1 83 VAL MG1 1 101 TYR HB3 . . 3.880 3.207 3.176 3.250 . 0 0 "[ . 1 . 2]" 1
1912 1 83 VAL MG1 1 101 TYR QD . . 3.080 2.473 2.182 2.703 . 0 0 "[ . 1 . 2]" 1
1913 1 83 VAL MG1 1 101 TYR QE . . 4.570 4.111 3.691 4.366 . 0 0 "[ . 1 . 2]" 1
1914 1 83 VAL MG1 1 104 HIS HD2 . . 5.190 4.947 3.566 5.189 . 0 0 "[ . 1 . 2]" 1
1915 1 83 VAL MG1 1 104 HIS HE1 . . 4.950 4.444 3.636 4.951 0.001 6 0 "[ . 1 . 2]" 1
1916 1 83 VAL MG2 1 84 VAL H . . 4.150 4.065 3.876 4.156 0.006 6 0 "[ . 1 . 2]" 1
1917 1 83 VAL MG2 1 84 VAL MG2 . . 3.680 3.384 3.274 3.492 . 0 0 "[ . 1 . 2]" 1
1918 1 83 VAL MG2 1 97 GLY HA2 . . 4.260 3.942 3.712 4.173 . 0 0 "[ . 1 . 2]" 1
1919 1 83 VAL MG2 1 101 TYR HB2 . . 4.500 4.296 4.205 4.369 . 0 0 "[ . 1 . 2]" 1
1920 1 83 VAL MG2 1 104 HIS HE1 . . 3.920 3.260 2.708 3.687 . 0 0 "[ . 1 . 2]" 1
1921 1 84 VAL H 1 84 VAL HB . . 3.940 2.577 2.498 2.676 . 0 0 "[ . 1 . 2]" 1
1922 1 84 VAL H 1 84 VAL MG1 . . 3.950 3.801 3.772 3.843 . 0 0 "[ . 1 . 2]" 1
1923 1 84 VAL H 1 84 VAL MG2 . . 3.420 2.899 2.779 2.986 . 0 0 "[ . 1 . 2]" 1
1924 1 84 VAL H 1 85 SER H . . 4.700 4.465 4.309 4.544 . 0 0 "[ . 1 . 2]" 1
1925 1 84 VAL H 1 101 TYR HB2 . . 4.810 3.510 3.359 3.733 . 0 0 "[ . 1 . 2]" 1
1926 1 84 VAL HA 1 84 VAL MG1 . . 3.440 2.481 2.447 2.508 . 0 0 "[ . 1 . 2]" 1
1927 1 84 VAL HA 1 84 VAL MG2 . . 3.470 2.240 2.202 2.294 . 0 0 "[ . 1 . 2]" 1
1928 1 84 VAL HA 1 85 SER H . . 2.760 2.254 2.142 2.323 . 0 0 "[ . 1 . 2]" 1
1929 1 84 VAL HA 1 88 ALA MB . . 4.400 3.932 3.713 4.025 . 0 0 "[ . 1 . 2]" 1
1930 1 84 VAL HB 1 85 SER H . . 4.280 3.958 3.803 4.271 . 0 0 "[ . 1 . 2]" 1
1931 1 84 VAL HB 1 88 ALA MB . . 4.380 4.300 4.153 4.374 . 0 0 "[ . 1 . 2]" 1
1932 1 84 VAL HB 1 89 VAL H . . 5.150 4.836 4.680 5.028 . 0 0 "[ . 1 . 2]" 1
1933 1 84 VAL HB 1 89 VAL MG2 . . 4.090 2.649 2.415 2.829 . 0 0 "[ . 1 . 2]" 1
1934 1 84 VAL HB 1 97 GLY HA2 . . 5.500 5.498 5.405 5.524 0.024 19 0 "[ . 1 . 2]" 1
1935 1 84 VAL HB 1 97 GLY HA3 . . 4.600 4.463 4.424 4.527 . 0 0 "[ . 1 . 2]" 1
1936 1 84 VAL HB 1 98 LEU H . . 4.800 4.622 4.416 4.741 . 0 0 "[ . 1 . 2]" 1
1937 1 84 VAL HB 1 98 LEU HA . . 4.670 3.561 3.402 3.682 . 0 0 "[ . 1 . 2]" 1
1938 1 84 VAL HB 1 101 TYR H . . 5.500 5.346 5.141 5.473 . 0 0 "[ . 1 . 2]" 1
1939 1 84 VAL MG1 1 85 SER H . . 3.380 2.180 1.952 2.716 . 0 0 "[ . 1 . 2]" 1
1940 1 84 VAL MG1 1 85 SER HA . . 5.450 3.758 3.650 4.115 . 0 0 "[ . 1 . 2]" 1
1941 1 84 VAL MG1 1 88 ALA H . . 4.720 3.664 3.516 3.854 . 0 0 "[ . 1 . 2]" 1
1942 1 84 VAL MG1 1 88 ALA HA . . 4.980 4.227 4.071 4.306 . 0 0 "[ . 1 . 2]" 1
1943 1 84 VAL MG1 1 88 ALA MB . . 3.330 1.850 1.766 1.916 . 0 0 "[ . 1 . 2]" 1
1944 1 84 VAL MG1 1 89 VAL H . . 4.260 2.599 2.476 2.731 . 0 0 "[ . 1 . 2]" 1
1945 1 84 VAL MG1 1 89 VAL HA . . 4.660 2.992 2.691 3.197 . 0 0 "[ . 1 . 2]" 1
1946 1 84 VAL MG1 1 89 VAL MG2 . . 3.000 1.808 1.710 1.938 . 0 0 "[ . 1 . 2]" 1
1947 1 84 VAL MG1 1 94 ASP HB2 . . 3.720 3.024 2.275 3.269 . 0 0 "[ . 1 . 2]" 1
1948 1 84 VAL MG1 1 94 ASP HB3 . . 4.300 4.120 3.403 4.303 0.003 17 0 "[ . 1 . 2]" 1
1949 1 84 VAL MG1 1 97 GLY H . . 5.020 4.809 4.694 4.967 . 0 0 "[ . 1 . 2]" 1
1950 1 84 VAL MG1 1 97 GLY HA2 . . 5.010 4.829 4.713 4.944 . 0 0 "[ . 1 . 2]" 1
1951 1 84 VAL MG1 1 97 GLY HA3 . . 4.390 3.469 3.335 3.580 . 0 0 "[ . 1 . 2]" 1
1952 1 84 VAL MG1 1 98 LEU H . . 4.000 3.541 3.409 3.677 . 0 0 "[ . 1 . 2]" 1
1953 1 84 VAL MG1 1 98 LEU HA . . 3.770 3.717 3.604 3.770 0.000 16 0 "[ . 1 . 2]" 1
1954 1 84 VAL MG1 1 98 LEU HB2 . . 4.400 3.548 3.421 3.722 . 0 0 "[ . 1 . 2]" 1
1955 1 84 VAL MG1 1 98 LEU HB3 . . 4.970 4.833 4.714 4.945 . 0 0 "[ . 1 . 2]" 1
1956 1 84 VAL MG1 1 101 TYR HB2 . . 4.740 4.660 4.593 4.739 . 0 0 "[ . 1 . 2]" 1
1957 1 84 VAL MG1 1 101 TYR HB3 . . 5.490 5.233 5.093 5.363 . 0 0 "[ . 1 . 2]" 1
1958 1 84 VAL MG2 1 85 SER H . . 4.100 3.757 3.648 4.015 . 0 0 "[ . 1 . 2]" 1
1959 1 84 VAL MG2 1 88 ALA MB . . 3.940 3.722 3.640 3.824 . 0 0 "[ . 1 . 2]" 1
1960 1 84 VAL MG2 1 89 VAL H . . 5.320 5.086 4.927 5.193 . 0 0 "[ . 1 . 2]" 1
1961 1 84 VAL MG2 1 89 VAL HA . . 5.000 4.728 4.570 4.900 . 0 0 "[ . 1 . 2]" 1
1962 1 84 VAL MG2 1 89 VAL MG2 . . 3.840 3.398 3.239 3.518 . 0 0 "[ . 1 . 2]" 1
1963 1 84 VAL MG2 1 94 ASP HB2 . . 4.260 3.703 3.272 4.043 . 0 0 "[ . 1 . 2]" 1
1964 1 84 VAL MG2 1 94 ASP HB3 . . 4.380 4.056 3.541 4.385 0.005 8 0 "[ . 1 . 2]" 1
1965 1 84 VAL MG2 1 97 GLY H . . 4.510 3.585 3.515 3.700 . 0 0 "[ . 1 . 2]" 1
1966 1 84 VAL MG2 1 97 GLY HA2 . . 4.060 2.729 2.645 2.795 . 0 0 "[ . 1 . 2]" 1
1967 1 84 VAL MG2 1 97 GLY HA3 . . 3.700 1.815 1.788 1.874 . 0 0 "[ . 1 . 2]" 1
1968 1 84 VAL MG2 1 98 LEU H . . 4.030 2.391 2.224 2.615 . 0 0 "[ . 1 . 2]" 1
1969 1 84 VAL MG2 1 98 LEU HA . . 3.460 2.742 2.577 2.885 . 0 0 "[ . 1 . 2]" 1
1970 1 84 VAL MG2 1 98 LEU HB2 . . 4.060 3.613 3.450 3.794 . 0 0 "[ . 1 . 2]" 1
1971 1 84 VAL MG2 1 98 LEU HB3 . . 4.630 4.296 4.179 4.465 . 0 0 "[ . 1 . 2]" 1
1972 1 84 VAL MG2 1 101 TYR H . . 4.620 3.514 3.254 3.721 . 0 0 "[ . 1 . 2]" 1
1973 1 84 VAL MG2 1 101 TYR HB2 . . 3.880 2.467 2.293 2.577 . 0 0 "[ . 1 . 2]" 1
1974 1 84 VAL MG2 1 101 TYR HB3 . . 4.090 3.659 3.479 3.830 . 0 0 "[ . 1 . 2]" 1
1975 1 84 VAL MG2 1 101 TYR QD . . 4.460 4.102 3.949 4.167 . 0 0 "[ . 1 . 2]" 1
1976 1 84 VAL MG2 1 101 TYR QE . . 5.500 5.459 5.274 5.508 0.008 20 0 "[ . 1 . 2]" 1
1977 1 85 SER H 1 85 SER HB2 . . 3.710 2.471 2.183 3.642 . 0 0 "[ . 1 . 2]" 1
1978 1 85 SER H 1 85 SER QB . . 3.080 2.323 2.131 2.560 . 0 0 "[ . 1 . 2]" 1
1979 1 85 SER H 1 85 SER HB3 . . 3.710 3.319 2.578 3.625 . 0 0 "[ . 1 . 2]" 1
1980 1 85 SER H 1 86 ALA H . . 4.630 4.547 4.490 4.635 0.005 3 0 "[ . 1 . 2]" 1
1981 1 85 SER H 1 88 ALA H . . 4.550 4.070 3.890 4.476 . 0 0 "[ . 1 . 2]" 1
1982 1 85 SER H 1 88 ALA MB . . 3.410 2.686 2.488 2.949 . 0 0 "[ . 1 . 2]" 1
1983 1 85 SER H 1 89 VAL MG2 . . 4.690 4.061 3.853 4.333 . 0 0 "[ . 1 . 2]" 1
1984 1 85 SER HA 1 86 ALA H . . 2.810 2.179 2.142 2.258 . 0 0 "[ . 1 . 2]" 1
1985 1 85 SER HA 1 86 ALA MB . . 4.020 3.974 3.937 4.017 . 0 0 "[ . 1 . 2]" 1
1986 1 85 SER HA 1 87 GLN H . . 4.200 4.051 3.819 4.205 0.005 19 0 "[ . 1 . 2]" 1
1987 1 85 SER HA 1 88 ALA H . . 4.790 4.565 4.364 4.790 . 0 0 "[ . 1 . 2]" 1
1988 1 85 SER HA 1 88 ALA MB . . 4.660 4.394 4.221 4.564 . 0 0 "[ . 1 . 2]" 1
1989 1 85 SER HA 1 89 VAL H . . 5.500 5.246 5.155 5.330 . 0 0 "[ . 1 . 2]" 1
1990 1 85 SER HA 1 89 VAL MG2 . . 4.840 4.517 4.351 4.706 . 0 0 "[ . 1 . 2]" 1
1991 1 85 SER QB 1 86 ALA H . . 3.370 3.240 3.132 3.382 0.012 19 0 "[ . 1 . 2]" 1
1992 1 85 SER QB 1 86 ALA MB . . 4.670 4.213 4.034 4.511 . 0 0 "[ . 1 . 2]" 1
1993 1 85 SER QB 1 87 GLN H . . 3.500 2.835 2.540 3.048 . 0 0 "[ . 1 . 2]" 1
1994 1 85 SER QB 1 87 GLN HB3 . . 4.020 3.218 2.775 3.533 . 0 0 "[ . 1 . 2]" 1
1995 1 85 SER QB 1 88 ALA H . . 4.720 2.528 2.144 3.390 . 0 0 "[ . 1 . 2]" 1
1996 1 85 SER QB 1 88 ALA MB . . 4.080 2.628 2.259 3.535 . 0 0 "[ . 1 . 2]" 1
1997 1 86 ALA H 1 86 ALA MB . . 2.930 2.079 2.026 2.134 . 0 0 "[ . 1 . 2]" 1
1998 1 86 ALA H 1 87 GLN H . . 3.360 2.957 2.712 3.086 . 0 0 "[ . 1 . 2]" 1
1999 1 86 ALA H 1 88 ALA H . . 4.730 4.570 4.054 4.727 . 0 0 "[ . 1 . 2]" 1
2000 1 86 ALA HA 1 89 VAL H . . 3.870 3.720 3.544 3.876 0.006 19 0 "[ . 1 . 2]" 1
2001 1 86 ALA HA 1 89 VAL HB . . 3.780 3.062 2.736 3.271 . 0 0 "[ . 1 . 2]" 1
2002 1 86 ALA HA 1 89 VAL MG2 . . 3.650 2.856 2.448 3.140 . 0 0 "[ . 1 . 2]" 1
2003 1 86 ALA HA 1 90 VAL H . . 4.470 4.354 4.117 4.473 0.003 9 0 "[ . 1 . 2]" 1
2004 1 86 ALA MB 1 87 GLN H . . 3.140 2.665 2.467 2.818 . 0 0 "[ . 1 . 2]" 1
2005 1 86 ALA MB 1 87 GLN HA . . 4.390 3.715 3.662 3.791 . 0 0 "[ . 1 . 2]" 1
2006 1 86 ALA MB 1 87 GLN HB2 . . 5.060 4.035 3.849 4.271 . 0 0 "[ . 1 . 2]" 1
2007 1 87 GLN H 1 87 GLN HB2 . . 3.250 2.414 2.235 2.742 . 0 0 "[ . 1 . 2]" 1
2008 1 87 GLN H 1 87 GLN HB3 . . 3.060 2.658 2.332 2.857 . 0 0 "[ . 1 . 2]" 1
2009 1 87 GLN H 1 87 GLN HG2 . . 4.850 4.479 4.310 4.632 . 0 0 "[ . 1 . 2]" 1
2010 1 87 GLN H 1 87 GLN QG . . 4.210 3.957 3.869 4.048 . 0 0 "[ . 1 . 2]" 1
2011 1 87 GLN H 1 87 GLN HG3 . . 4.850 4.420 4.181 4.633 . 0 0 "[ . 1 . 2]" 1
2012 1 87 GLN H 1 88 ALA H . . 3.260 2.737 2.445 2.944 . 0 0 "[ . 1 . 2]" 1
2013 1 87 GLN H 1 88 ALA MB . . 4.930 4.345 4.151 4.535 . 0 0 "[ . 1 . 2]" 1
2014 1 87 GLN H 1 89 VAL H . . 4.630 4.173 4.051 4.311 . 0 0 "[ . 1 . 2]" 1
2015 1 87 GLN H 1 90 VAL MG2 . . 5.430 5.151 4.945 5.433 0.003 3 0 "[ . 1 . 2]" 1
2016 1 87 GLN HA 1 87 GLN HG2 . . 4.100 2.859 2.267 3.813 . 0 0 "[ . 1 . 2]" 1
2017 1 87 GLN HA 1 87 GLN QG . . 3.530 2.398 2.240 2.738 . 0 0 "[ . 1 . 2]" 1
2018 1 87 GLN HA 1 87 GLN HG3 . . 4.100 2.889 2.301 3.668 . 0 0 "[ . 1 . 2]" 1
2019 1 87 GLN HA 1 89 VAL H . . 4.710 4.443 4.298 4.531 . 0 0 "[ . 1 . 2]" 1
2020 1 87 GLN HA 1 90 VAL H . . 4.080 3.743 3.528 3.913 . 0 0 "[ . 1 . 2]" 1
2021 1 87 GLN HA 1 90 VAL HB . . 4.000 3.301 2.930 3.543 . 0 0 "[ . 1 . 2]" 1
2022 1 87 GLN HA 1 90 VAL MG2 . . 4.270 3.742 3.408 4.100 . 0 0 "[ . 1 . 2]" 1
2023 1 87 GLN HA 1 91 ALA H . . 4.400 3.493 3.217 3.872 . 0 0 "[ . 1 . 2]" 1
2024 1 87 GLN HB2 1 88 ALA H . . 3.860 3.655 3.422 3.862 0.002 6 0 "[ . 1 . 2]" 1
2025 1 87 GLN HB3 1 88 ALA H . . 3.660 2.384 2.204 2.975 . 0 0 "[ . 1 . 2]" 1
2026 1 87 GLN HB3 1 88 ALA HA . . 4.620 4.070 3.855 4.402 . 0 0 "[ . 1 . 2]" 1
2027 1 87 GLN HB3 1 88 ALA MB . . 4.450 3.859 3.742 4.025 . 0 0 "[ . 1 . 2]" 1
2028 1 87 GLN HB3 1 89 VAL H . . 5.440 4.948 4.793 5.327 . 0 0 "[ . 1 . 2]" 1
2029 1 87 GLN HB3 1 91 ALA MB . . 4.810 4.209 3.845 4.688 . 0 0 "[ . 1 . 2]" 1
2030 1 87 GLN QE 1 91 ALA MB . . 4.730 3.300 1.845 4.258 . 0 0 "[ . 1 . 2]" 1
2031 1 87 GLN QG 1 88 ALA H . . 4.710 3.814 3.356 4.289 . 0 0 "[ . 1 . 2]" 1
2032 1 87 GLN QG 1 90 VAL MG1 . . 5.340 4.981 4.448 5.336 . 0 0 "[ . 1 . 2]" 1
2033 1 87 GLN QG 1 91 ALA H . . 4.630 3.724 3.455 4.098 . 0 0 "[ . 1 . 2]" 1
2034 1 87 GLN QG 1 91 ALA MB . . 4.440 2.604 2.036 3.123 . 0 0 "[ . 1 . 2]" 1
2035 1 88 ALA H 1 88 ALA MB . . 2.880 2.222 2.195 2.255 . 0 0 "[ . 1 . 2]" 1
2036 1 88 ALA H 1 89 VAL H . . 3.270 2.820 2.554 2.948 . 0 0 "[ . 1 . 2]" 1
2037 1 88 ALA H 1 89 VAL MG2 . . 4.290 4.213 3.964 4.291 0.001 17 0 "[ . 1 . 2]" 1
2038 1 88 ALA HA 1 89 VAL MG2 . . 5.260 5.023 4.930 5.162 . 0 0 "[ . 1 . 2]" 1
2039 1 88 ALA HA 1 91 ALA H . . 4.270 4.079 3.661 4.270 . 11 0 "[ . 1 . 2]" 1
2040 1 88 ALA HA 1 93 SER H . . 3.550 3.207 2.936 3.553 0.003 4 0 "[ . 1 . 2]" 1
2041 1 88 ALA HA 1 94 ASP H . . 5.070 3.616 3.399 4.158 . 0 0 "[ . 1 . 2]" 1
2042 1 88 ALA MB 1 89 VAL H . . 3.390 2.477 2.377 2.556 . 0 0 "[ . 1 . 2]" 1
2043 1 88 ALA MB 1 89 VAL HA . . 4.730 3.787 3.748 3.815 . 0 0 "[ . 1 . 2]" 1
2044 1 88 ALA MB 1 89 VAL MG2 . . 4.020 3.160 2.996 3.346 . 0 0 "[ . 1 . 2]" 1
2045 1 88 ALA MB 1 94 ASP H . . 4.060 2.857 2.607 3.414 . 0 0 "[ . 1 . 2]" 1
2046 1 88 ALA MB 1 94 ASP HA . . 4.640 4.577 4.363 4.648 0.008 8 0 "[ . 1 . 2]" 1
2047 1 88 ALA MB 1 94 ASP HB2 . . 3.360 2.342 2.111 2.519 . 0 0 "[ . 1 . 2]" 1
2048 1 88 ALA MB 1 94 ASP HB3 . . 3.910 3.790 3.427 3.911 0.001 20 0 "[ . 1 . 2]" 1
2049 1 89 VAL H 1 89 VAL HB . . 3.060 2.549 2.481 2.624 . 0 0 "[ . 1 . 2]" 1
2050 1 89 VAL H 1 89 VAL MG1 . . 3.940 3.763 3.756 3.768 . 0 0 "[ . 1 . 2]" 1
2051 1 89 VAL H 1 89 VAL MG2 . . 2.960 2.062 1.893 2.250 . 0 0 "[ . 1 . 2]" 1
2052 1 89 VAL H 1 90 VAL H . . 3.300 2.933 2.772 3.002 . 0 0 "[ . 1 . 2]" 1
2053 1 89 VAL H 1 90 VAL HA . . 5.500 5.466 5.366 5.516 0.016 14 0 "[ . 1 . 2]" 1
2054 1 89 VAL H 1 90 VAL HB . . 5.420 5.124 4.943 5.235 . 0 0 "[ . 1 . 2]" 1
2055 1 89 VAL HA 1 89 VAL MG1 . . 3.180 2.398 2.311 2.466 . 0 0 "[ . 1 . 2]" 1
2056 1 89 VAL HA 1 89 VAL MG2 . . 3.090 2.362 2.229 2.432 . 0 0 "[ . 1 . 2]" 1
2057 1 89 VAL HA 1 91 ALA H . . 5.500 5.230 4.809 5.500 . 0 0 "[ . 1 . 2]" 1
2058 1 89 VAL HA 1 92 GLY H . . 4.350 4.106 3.763 4.300 . 0 0 "[ . 1 . 2]" 1
2059 1 89 VAL HA 1 92 GLY QA . . 4.860 4.255 3.629 4.507 . 0 0 "[ . 1 . 2]" 1
2060 1 89 VAL HA 1 98 LEU H . . 4.980 4.959 4.841 4.986 0.006 11 0 "[ . 1 . 2]" 1
2061 1 89 VAL HA 1 98 LEU HB2 . . 4.480 3.371 3.228 3.558 . 0 0 "[ . 1 . 2]" 1
2062 1 89 VAL HA 1 98 LEU MD1 . . 4.160 3.806 3.480 4.090 . 0 0 "[ . 1 . 2]" 1
2063 1 89 VAL HB 1 90 VAL H . . 3.200 2.258 2.122 2.475 . 0 0 "[ . 1 . 2]" 1
2064 1 89 VAL HB 1 90 VAL MG1 . . 5.500 5.318 5.271 5.421 . 0 0 "[ . 1 . 2]" 1
2065 1 89 VAL MG1 1 92 GLY H . . 5.500 4.910 4.482 5.213 . 0 0 "[ . 1 . 2]" 1
2066 1 89 VAL MG2 1 90 VAL H . . 4.100 3.726 3.682 3.797 . 0 0 "[ . 1 . 2]" 1
2067 1 89 VAL MG2 1 98 LEU H . . 4.810 4.453 4.168 4.761 . 0 0 "[ . 1 . 2]" 1
2068 1 89 VAL MG2 1 98 LEU HA . . 4.600 3.502 3.231 3.714 . 0 0 "[ . 1 . 2]" 1
2069 1 89 VAL MG2 1 98 LEU HB3 . . 5.060 4.749 4.304 5.054 . 0 0 "[ . 1 . 2]" 1
2070 1 89 VAL MG2 1 101 TYR QD . . 5.030 3.800 3.500 4.026 . 0 0 "[ . 1 . 2]" 1
2071 1 90 VAL H 1 90 VAL HB . . 3.030 2.523 2.415 2.618 . 0 0 "[ . 1 . 2]" 1
2072 1 90 VAL H 1 90 VAL MG1 . . 3.890 3.763 3.746 3.773 . 0 0 "[ . 1 . 2]" 1
2073 1 90 VAL H 1 90 VAL MG2 . . 2.850 2.279 2.085 2.490 . 0 0 "[ . 1 . 2]" 1
2074 1 90 VAL H 1 91 ALA H . . 3.220 2.808 2.664 2.993 . 0 0 "[ . 1 . 2]" 1
2075 1 90 VAL H 1 91 ALA MB . . 4.460 4.283 4.157 4.459 . 0 0 "[ . 1 . 2]" 1
2076 1 90 VAL H 1 92 GLY H . . 4.720 3.979 3.803 4.233 . 0 0 "[ . 1 . 2]" 1
2077 1 90 VAL HA 1 90 VAL MG1 . . 3.190 2.375 2.286 2.454 . 0 0 "[ . 1 . 2]" 1
2078 1 90 VAL HA 1 90 VAL MG2 . . 3.200 2.294 2.207 2.414 . 0 0 "[ . 1 . 2]" 1
2079 1 90 VAL HB 1 91 ALA H . . 3.260 2.203 2.073 2.409 . 0 0 "[ . 1 . 2]" 1
2080 1 90 VAL HB 1 91 ALA MB . . 4.990 3.826 3.639 3.920 . 0 0 "[ . 1 . 2]" 1
2081 1 90 VAL HB 1 92 GLY H . . 4.980 4.668 4.407 4.890 . 0 0 "[ . 1 . 2]" 1
2082 1 90 VAL MG1 1 91 ALA H . . 3.670 3.084 2.669 3.429 . 0 0 "[ . 1 . 2]" 1
2083 1 90 VAL MG1 1 91 ALA HA . . 4.470 3.344 3.018 3.563 . 0 0 "[ . 1 . 2]" 1
2084 1 90 VAL MG1 1 92 GLY H . . 4.930 4.542 4.276 4.791 . 0 0 "[ . 1 . 2]" 1
2085 1 90 VAL MG2 1 91 ALA H . . 3.700 3.680 3.607 3.705 0.005 8 0 "[ . 1 . 2]" 1
2086 1 90 VAL MG2 1 92 GLY H . . 5.500 5.132 4.857 5.375 . 0 0 "[ . 1 . 2]" 1
2087 1 91 ALA H 1 91 ALA MB . . 2.830 2.122 2.026 2.258 . 0 0 "[ . 1 . 2]" 1
2088 1 91 ALA H 1 92 GLY H . . 3.100 2.902 2.658 3.030 . 0 0 "[ . 1 . 2]" 1
2089 1 91 ALA H 1 92 GLY QA . . 4.720 4.670 4.474 4.729 0.009 6 0 "[ . 1 . 2]" 1
2090 1 91 ALA HA 1 92 GLY QA . . 4.920 4.310 4.249 4.328 . 0 0 "[ . 1 . 2]" 1
2091 1 91 ALA MB 1 92 GLY H . . 3.610 2.786 2.443 3.337 . 0 0 "[ . 1 . 2]" 1
2092 1 91 ALA MB 1 92 GLY QA . . 4.710 3.910 3.795 4.148 . 0 0 "[ . 1 . 2]" 1
2093 1 91 ALA MB 1 93 SER H . . 3.360 2.769 2.284 3.209 . 0 0 "[ . 1 . 2]" 1
2094 1 91 ALA MB 1 93 SER HA . . 4.710 4.405 4.088 4.693 . 0 0 "[ . 1 . 2]" 1
2095 1 91 ALA MB 1 93 SER HB2 . . 3.890 3.316 2.310 3.900 0.010 9 0 "[ . 1 . 2]" 1
2096 1 91 ALA MB 1 93 SER QB . . 3.320 2.774 2.267 3.063 . 0 0 "[ . 1 . 2]" 1
2097 1 91 ALA MB 1 93 SER HB3 . . 3.890 3.316 2.282 3.930 0.040 8 0 "[ . 1 . 2]" 1
2098 1 92 GLY H 1 92 GLY QA . . 2.770 2.225 2.189 2.262 . 0 0 "[ . 1 . 2]" 1
2099 1 92 GLY H 1 94 ASP H . . 4.580 4.258 4.025 4.452 . 0 0 "[ . 1 . 2]" 1
2100 1 92 GLY QA 1 93 SER H . . 3.440 2.770 2.617 2.901 . 0 0 "[ . 1 . 2]" 1
2101 1 92 GLY QA 1 93 SER HA . . 5.270 4.075 4.018 4.175 . 0 0 "[ . 1 . 2]" 1
2102 1 92 GLY QA 1 94 ASP H . . 4.750 3.773 3.159 4.036 . 0 0 "[ . 1 . 2]" 1
2103 1 92 GLY QA 1 95 PRO HD3 . . 4.820 4.625 4.103 4.815 . 0 0 "[ . 1 . 2]" 1
2104 1 93 SER H 1 93 SER HB2 . . 3.830 2.992 2.194 3.566 . 0 0 "[ . 1 . 2]" 1
2105 1 93 SER H 1 93 SER QB . . 3.240 2.333 2.172 2.572 . 0 0 "[ . 1 . 2]" 1
2106 1 93 SER H 1 93 SER HB3 . . 3.830 2.598 2.222 3.606 . 0 0 "[ . 1 . 2]" 1
2107 1 93 SER H 1 94 ASP H . . 3.350 2.353 2.087 2.686 . 0 0 "[ . 1 . 2]" 1
2108 1 93 SER H 1 94 ASP HA . . 5.500 5.011 4.771 5.299 . 0 0 "[ . 1 . 2]" 1
2109 1 93 SER H 1 95 PRO HD3 . . 5.470 4.896 4.658 5.236 . 0 0 "[ . 1 . 2]" 1
2110 1 93 SER HA 1 95 PRO HD3 . . 4.680 3.917 3.820 4.124 . 0 0 "[ . 1 . 2]" 1
2111 1 94 ASP H 1 95 PRO HD2 . . 4.560 4.349 4.211 4.399 . 0 0 "[ . 1 . 2]" 1
2112 1 94 ASP H 1 95 PRO HD3 . . 4.190 3.757 3.524 3.833 . 0 0 "[ . 1 . 2]" 1
2113 1 94 ASP HA 1 95 PRO HD2 . . 3.080 1.954 1.942 1.965 . 0 0 "[ . 1 . 2]" 1
2114 1 94 ASP HA 1 95 PRO HD3 . . 3.390 2.686 2.652 2.715 . 0 0 "[ . 1 . 2]" 1
2115 1 94 ASP HA 1 95 PRO QG . . 4.340 3.820 3.808 3.830 . 0 0 "[ . 1 . 2]" 1
2116 1 94 ASP HA 1 96 LEU H . . 4.260 3.521 3.307 3.917 . 0 0 "[ . 1 . 2]" 1
2117 1 94 ASP HA 1 97 GLY H . . 4.660 4.173 4.017 4.306 . 0 0 "[ . 1 . 2]" 1
2118 1 94 ASP HB2 1 97 GLY H . . 4.660 3.895 3.610 4.141 . 0 0 "[ . 1 . 2]" 1
2119 1 94 ASP HB2 1 98 LEU H . . 5.420 4.290 3.876 4.635 . 0 0 "[ . 1 . 2]" 1
2120 1 94 ASP HB3 1 95 PRO HD2 . . 3.940 3.963 3.953 3.987 0.047 8 0 "[ . 1 . 2]" 1
2121 1 94 ASP HB3 1 97 GLY H . . 4.860 2.915 2.681 3.268 . 0 0 "[ . 1 . 2]" 1
2122 1 94 ASP HB3 1 97 GLY HA2 . . 5.500 4.827 4.632 5.164 . 0 0 "[ . 1 . 2]" 1
2123 1 95 PRO HA 1 96 LEU MD1 . . 5.070 4.787 4.608 4.966 . 0 0 "[ . 1 . 2]" 1
2124 1 95 PRO HA 1 97 GLY H . . 4.840 4.686 4.463 4.842 0.002 1 0 "[ . 1 . 2]" 1
2125 1 95 PRO HA 1 98 LEU H . . 4.000 3.918 3.730 4.003 0.003 19 0 "[ . 1 . 2]" 1
2126 1 95 PRO HA 1 98 LEU HB2 . . 4.330 4.128 3.935 4.334 0.004 6 0 "[ . 1 . 2]" 1
2127 1 95 PRO HA 1 98 LEU HB3 . . 4.260 3.377 3.128 3.645 . 0 0 "[ . 1 . 2]" 1
2128 1 95 PRO HA 1 98 LEU MD2 . . 4.360 3.782 3.549 4.050 . 0 0 "[ . 1 . 2]" 1
2129 1 95 PRO QB 1 96 LEU H . . 3.830 3.171 2.801 3.400 . 0 0 "[ . 1 . 2]" 1
2130 1 95 PRO HB2 1 96 LEU H . . 4.360 3.299 2.873 3.568 . 0 0 "[ . 1 . 2]" 1
2131 1 95 PRO HB2 1 96 LEU MD1 . . 4.850 3.590 3.342 3.817 . 0 0 "[ . 1 . 2]" 1
2132 1 95 PRO HB3 1 96 LEU H . . 4.360 4.121 3.876 4.277 . 0 0 "[ . 1 . 2]" 1
2133 1 95 PRO HB3 1 96 LEU MD1 . . 4.850 4.537 4.392 4.614 . 0 0 "[ . 1 . 2]" 1
2134 1 95 PRO HD2 1 96 LEU H . . 3.780 2.672 2.646 2.768 . 0 0 "[ . 1 . 2]" 1
2135 1 95 PRO HD2 1 96 LEU MD1 . . 4.780 2.839 2.356 3.234 . 0 0 "[ . 1 . 2]" 1
2136 1 95 PRO HD3 1 96 LEU H . . 4.440 3.848 3.837 3.880 . 0 0 "[ . 1 . 2]" 1
2137 1 95 PRO QG 1 96 LEU H . . 3.230 2.324 1.892 2.651 . 0 0 "[ . 1 . 2]" 1
2138 1 95 PRO QG 1 96 LEU HA . . 4.800 4.123 4.041 4.227 . 0 0 "[ . 1 . 2]" 1
2139 1 95 PRO QG 1 96 LEU MD2 . . 5.080 4.549 4.332 4.692 . 0 0 "[ . 1 . 2]" 1
2140 1 96 LEU H 1 96 LEU HB2 . . 3.150 2.313 2.220 2.506 . 0 0 "[ . 1 . 2]" 1
2141 1 96 LEU H 1 96 LEU HB3 . . 3.870 3.552 3.515 3.587 . 0 0 "[ . 1 . 2]" 1
2142 1 96 LEU H 1 96 LEU MD1 . . 3.670 1.990 1.854 2.332 . 0 0 "[ . 1 . 2]" 1
2143 1 96 LEU H 1 96 LEU MD2 . . 4.170 4.108 3.968 4.169 . 0 0 "[ . 1 . 2]" 1
2144 1 96 LEU H 1 96 LEU HG . . 3.610 3.386 2.942 3.576 . 0 0 "[ . 1 . 2]" 1
2145 1 96 LEU H 1 97 GLY H . . 3.120 2.708 2.483 2.955 . 0 0 "[ . 1 . 2]" 1
2146 1 96 LEU H 1 97 GLY HA3 . . 5.500 4.923 4.718 5.164 . 0 0 "[ . 1 . 2]" 1
2147 1 96 LEU H 1 98 LEU H . . 4.720 4.459 4.193 4.685 . 0 0 "[ . 1 . 2]" 1
2148 1 96 LEU H 1 99 ILE H . . 5.500 5.140 4.905 5.268 . 0 0 "[ . 1 . 2]" 1
2149 1 96 LEU HA 1 96 LEU MD1 . . 3.420 3.225 3.088 3.429 0.009 8 0 "[ . 1 . 2]" 1
2150 1 96 LEU HA 1 96 LEU MD2 . . 3.960 3.547 3.518 3.613 . 0 0 "[ . 1 . 2]" 1
2151 1 96 LEU HA 1 96 LEU HG . . 3.490 2.338 2.269 2.486 . 0 0 "[ . 1 . 2]" 1
2152 1 96 LEU HA 1 99 ILE H . . 4.070 3.749 3.578 3.934 . 0 0 "[ . 1 . 2]" 1
2153 1 96 LEU HA 1 99 ILE HB . . 3.650 3.105 2.778 3.310 . 0 0 "[ . 1 . 2]" 1
2154 1 96 LEU HA 1 99 ILE MD . . 3.540 2.317 2.052 2.653 . 0 0 "[ . 1 . 2]" 1
2155 1 96 LEU HA 1 99 ILE MG . . 4.560 4.335 4.026 4.554 . 0 0 "[ . 1 . 2]" 1
2156 1 96 LEU HA 1 100 ALA H . . 4.880 4.349 4.071 4.512 . 0 0 "[ . 1 . 2]" 1
2157 1 96 LEU HB2 1 96 LEU MD2 . . 3.530 2.640 2.601 2.718 . 0 0 "[ . 1 . 2]" 1
2158 1 96 LEU HB2 1 97 GLY H . . 3.570 2.514 2.311 2.611 . 0 0 "[ . 1 . 2]" 1
2159 1 96 LEU HB3 1 96 LEU MD2 . . 3.510 2.075 1.979 2.151 . 0 0 "[ . 1 . 2]" 1
2160 1 96 LEU HB3 1 97 GLY H . . 3.820 3.293 3.121 3.515 . 0 0 "[ . 1 . 2]" 1
2161 1 96 LEU HB3 1 99 ILE HB . . 4.950 4.688 4.439 4.903 . 0 0 "[ . 1 . 2]" 1
2162 1 96 LEU HB3 1 99 ILE MD . . 4.620 4.376 4.080 4.621 0.001 3 0 "[ . 1 . 2]" 1
2163 1 96 LEU MD1 1 97 GLY H . . 4.630 3.847 3.530 4.057 . 0 0 "[ . 1 . 2]" 1
2164 1 96 LEU MD2 1 97 GLY H . . 4.790 4.629 4.528 4.744 . 0 0 "[ . 1 . 2]" 1
2165 1 96 LEU HG 1 97 GLY H . . 4.900 4.869 4.698 4.909 0.009 3 0 "[ . 1 . 2]" 1
2166 1 97 GLY H 1 98 LEU H . . 3.210 3.005 2.883 3.097 . 0 0 "[ . 1 . 2]" 1
2167 1 97 GLY H 1 98 LEU HB2 . . 5.500 5.449 5.242 5.503 0.003 11 0 "[ . 1 . 2]" 1
2168 1 97 GLY H 1 98 LEU HB3 . . 5.290 5.012 4.872 5.096 . 0 0 "[ . 1 . 2]" 1
2169 1 97 GLY HA2 1 99 ILE HB . . 5.410 5.281 5.165 5.419 0.009 14 0 "[ . 1 . 2]" 1
2170 1 97 GLY HA2 1 100 ALA H . . 4.080 3.680 3.583 3.797 . 0 0 "[ . 1 . 2]" 1
2171 1 97 GLY HA2 1 100 ALA MB . . 3.720 2.772 2.644 2.864 . 0 0 "[ . 1 . 2]" 1
2172 1 97 GLY HA2 1 101 TYR H . . 4.880 4.149 4.021 4.330 . 0 0 "[ . 1 . 2]" 1
2173 1 97 GLY HA3 1 99 ILE H . . 5.100 4.915 4.813 5.050 . 0 0 "[ . 1 . 2]" 1
2174 1 97 GLY HA3 1 100 ALA H . . 5.140 4.799 4.673 4.890 . 0 0 "[ . 1 . 2]" 1
2175 1 97 GLY HA3 1 100 ALA MB . . 4.310 4.214 4.087 4.289 . 0 0 "[ . 1 . 2]" 1
2176 1 98 LEU H 1 98 LEU HB2 . . 3.110 2.544 2.471 2.641 . 0 0 "[ . 1 . 2]" 1
2177 1 98 LEU H 1 98 LEU HB3 . . 3.160 2.479 2.384 2.560 . 0 0 "[ . 1 . 2]" 1
2178 1 98 LEU H 1 98 LEU MD1 . . 4.210 4.085 4.024 4.143 . 0 0 "[ . 1 . 2]" 1
2179 1 98 LEU H 1 98 LEU MD2 . . 4.470 4.207 4.172 4.260 . 0 0 "[ . 1 . 2]" 1
2180 1 98 LEU H 1 98 LEU HG . . 4.530 4.470 4.405 4.521 . 0 0 "[ . 1 . 2]" 1
2181 1 98 LEU H 1 99 ILE H . . 3.260 2.985 2.860 3.094 . 0 0 "[ . 1 . 2]" 1
2182 1 98 LEU H 1 99 ILE HG13 . . 5.170 4.585 4.366 4.787 . 0 0 "[ . 1 . 2]" 1
2183 1 98 LEU HA 1 98 LEU MD1 . . 2.750 2.050 1.970 2.197 . 0 0 "[ . 1 . 2]" 1
2184 1 98 LEU HA 1 98 LEU MD2 . . 4.610 3.892 3.839 3.942 . 0 0 "[ . 1 . 2]" 1
2185 1 98 LEU HA 1 98 LEU HG . . 4.270 3.274 3.191 3.400 . 0 0 "[ . 1 . 2]" 1
2186 1 98 LEU HA 1 100 ALA H . . 5.340 4.552 4.172 4.763 . 0 0 "[ . 1 . 2]" 1
2187 1 98 LEU HA 1 101 TYR H . . 4.230 3.391 3.273 3.503 . 0 0 "[ . 1 . 2]" 1
2188 1 98 LEU HA 1 101 TYR HB2 . . 4.090 3.053 2.908 3.140 . 0 0 "[ . 1 . 2]" 1
2189 1 98 LEU HA 1 101 TYR HB3 . . 3.730 2.620 2.432 2.781 . 0 0 "[ . 1 . 2]" 1
2190 1 98 LEU HA 1 101 TYR QD . . 4.490 3.690 3.487 3.901 . 0 0 "[ . 1 . 2]" 1
2191 1 98 LEU HB2 1 98 LEU MD2 . . 3.540 2.379 2.274 2.474 . 0 0 "[ . 1 . 2]" 1
2192 1 98 LEU HB2 1 99 ILE H . . 4.210 3.759 3.697 3.855 . 0 0 "[ . 1 . 2]" 1
2193 1 98 LEU HB3 1 98 LEU MD1 . . 3.520 3.193 3.191 3.196 . 0 0 "[ . 1 . 2]" 1
2194 1 98 LEU HB3 1 98 LEU MD2 . . 3.480 2.284 2.176 2.418 . 0 0 "[ . 1 . 2]" 1
2195 1 98 LEU HB3 1 99 ILE H . . 3.510 2.312 2.229 2.441 . 0 0 "[ . 1 . 2]" 1
2196 1 98 LEU HB3 1 99 ILE MD . . 5.500 4.577 4.473 4.699 . 0 0 "[ . 1 . 2]" 1
2197 1 98 LEU MD1 1 99 ILE H . . 4.370 4.176 4.012 4.285 . 0 0 "[ . 1 . 2]" 1
2198 1 98 LEU MD1 1 101 TYR H . . 4.670 4.350 4.256 4.535 . 0 0 "[ . 1 . 2]" 1
2199 1 98 LEU MD1 1 101 TYR HA . . 5.500 5.442 5.326 5.504 0.004 6 0 "[ . 1 . 2]" 1
2200 1 98 LEU MD1 1 101 TYR HB2 . . 4.160 3.906 3.651 4.012 . 0 0 "[ . 1 . 2]" 1
2201 1 98 LEU MD1 1 101 TYR HB3 . . 3.830 2.745 2.631 2.827 . 0 0 "[ . 1 . 2]" 1
2202 1 98 LEU MD1 1 101 TYR QD . . 3.480 2.734 2.445 2.982 . 0 0 "[ . 1 . 2]" 1
2203 1 98 LEU MD1 1 101 TYR QE . . 4.720 4.430 4.114 4.690 . 0 0 "[ . 1 . 2]" 1
2204 1 98 LEU MD1 1 102 LEU HA . . 5.150 4.763 4.573 4.905 . 0 0 "[ . 1 . 2]" 1
2205 1 98 LEU MD1 1 102 LEU MD1 . . 3.560 2.730 2.342 3.091 . 0 0 "[ . 1 . 2]" 1
2206 1 98 LEU MD2 1 99 ILE H . . 4.890 3.943 3.668 4.187 . 0 0 "[ . 1 . 2]" 1
2207 1 98 LEU MD2 1 102 LEU MD1 . . 4.790 3.212 2.932 3.593 . 0 0 "[ . 1 . 2]" 1
2208 1 98 LEU HG 1 99 ILE H . . 4.370 3.250 3.017 3.478 . 0 0 "[ . 1 . 2]" 1
2209 1 98 LEU HG 1 99 ILE HA . . 4.680 3.378 3.182 3.563 . 0 0 "[ . 1 . 2]" 1
2210 1 98 LEU HG 1 102 LEU H . . 4.820 4.412 4.054 4.745 . 0 0 "[ . 1 . 2]" 1
2211 1 98 LEU HG 1 102 LEU MD1 . . 3.760 2.556 2.355 2.931 . 0 0 "[ . 1 . 2]" 1
2212 1 98 LEU HG 1 102 LEU MD2 . . 4.550 4.032 3.728 4.313 . 0 0 "[ . 1 . 2]" 1
2213 1 98 LEU HG 1 102 LEU HG . . 4.250 3.153 2.845 3.588 . 0 0 "[ . 1 . 2]" 1
2214 1 99 ILE H 1 99 ILE HB . . 2.910 2.610 2.542 2.677 . 0 0 "[ . 1 . 2]" 1
2215 1 99 ILE H 1 99 ILE MD . . 3.600 3.385 3.297 3.520 . 0 0 "[ . 1 . 2]" 1
2216 1 99 ILE H 1 99 ILE HG12 . . 3.720 3.367 3.143 3.509 . 0 0 "[ . 1 . 2]" 1
2217 1 99 ILE H 1 99 ILE HG13 . . 3.630 1.969 1.904 2.072 . 0 0 "[ . 1 . 2]" 1
2218 1 99 ILE H 1 99 ILE MG . . 4.070 3.768 3.764 3.775 . 0 0 "[ . 1 . 2]" 1
2219 1 99 ILE H 1 100 ALA H . . 3.360 2.935 2.846 2.967 . 0 0 "[ . 1 . 2]" 1
2220 1 99 ILE H 1 100 ALA HA . . 5.500 5.485 5.422 5.507 0.007 6 0 "[ . 1 . 2]" 1
2221 1 99 ILE H 1 100 ALA MB . . 4.690 4.530 4.467 4.587 . 0 0 "[ . 1 . 2]" 1
2222 1 99 ILE H 1 101 TYR H . . 4.640 4.162 3.936 4.614 . 0 0 "[ . 1 . 2]" 1
2223 1 99 ILE H 1 102 LEU H . . 5.500 4.979 4.876 5.110 . 0 0 "[ . 1 . 2]" 1
2224 1 99 ILE HA 1 99 ILE MD . . 3.960 3.862 3.839 3.881 . 0 0 "[ . 1 . 2]" 1
2225 1 99 ILE HA 1 99 ILE HG12 . . 3.270 2.626 2.552 2.698 . 0 0 "[ . 1 . 2]" 1
2226 1 99 ILE HA 1 99 ILE HG13 . . 3.800 2.873 2.762 3.045 . 0 0 "[ . 1 . 2]" 1
2227 1 99 ILE HA 1 99 ILE MG . . 3.160 2.411 2.291 2.478 . 0 0 "[ . 1 . 2]" 1
2228 1 99 ILE HA 1 102 LEU H . . 4.060 3.842 3.669 4.061 0.001 6 0 "[ . 1 . 2]" 1
2229 1 99 ILE HA 1 102 LEU HB2 . . 3.970 3.428 3.234 3.615 . 0 0 "[ . 1 . 2]" 1
2230 1 99 ILE HA 1 102 LEU MD1 . . 3.840 2.914 2.125 3.470 . 0 0 "[ . 1 . 2]" 1
2231 1 99 ILE HA 1 102 LEU HG . . 4.370 3.773 3.541 4.029 . 0 0 "[ . 1 . 2]" 1
2232 1 99 ILE HA 1 103 SER H . . 4.920 4.427 4.138 4.923 0.003 6 0 "[ . 1 . 2]" 1
2233 1 99 ILE HB 1 100 ALA H . . 3.330 2.430 2.284 2.633 . 0 0 "[ . 1 . 2]" 1
2234 1 99 ILE MD 1 100 ALA H . . 4.700 4.318 4.144 4.528 . 0 0 "[ . 1 . 2]" 1
2235 1 99 ILE HG12 1 100 ALA H . . 5.050 4.956 4.877 5.028 . 0 0 "[ . 1 . 2]" 1
2236 1 99 ILE MG 1 100 ALA H . . 3.690 3.285 3.123 3.497 . 0 0 "[ . 1 . 2]" 1
2237 1 99 ILE MG 1 100 ALA HA . . 4.050 3.386 3.164 3.577 . 0 0 "[ . 1 . 2]" 1
2238 1 99 ILE MG 1 103 SER H . . 4.770 4.236 3.994 4.597 . 0 0 "[ . 1 . 2]" 1
2239 1 100 ALA H 1 100 ALA MB . . 2.880 2.155 2.100 2.211 . 0 0 "[ . 1 . 2]" 1
2240 1 100 ALA H 1 101 TYR H . . 3.330 2.641 2.513 2.711 . 0 0 "[ . 1 . 2]" 1
2241 1 100 ALA H 1 101 TYR HB3 . . 5.190 4.913 4.751 5.023 . 0 0 "[ . 1 . 2]" 1
2242 1 100 ALA H 1 102 LEU H . . 4.650 4.487 4.148 4.657 0.007 14 0 "[ . 1 . 2]" 1
2243 1 100 ALA MB 1 101 TYR H . . 3.310 2.695 2.401 2.874 . 0 0 "[ . 1 . 2]" 1
2244 1 100 ALA MB 1 101 TYR HA . . 4.730 3.817 3.715 3.899 . 0 0 "[ . 1 . 2]" 1
2245 1 100 ALA MB 1 101 TYR HB2 . . 4.600 4.240 4.147 4.325 . 0 0 "[ . 1 . 2]" 1
2246 1 101 TYR H 1 101 TYR HB2 . . 3.070 2.476 2.381 2.613 . 0 0 "[ . 1 . 2]" 1
2247 1 101 TYR H 1 101 TYR HB3 . . 3.130 2.593 2.469 2.737 . 0 0 "[ . 1 . 2]" 1
2248 1 101 TYR H 1 101 TYR QD . . 4.340 4.165 4.117 4.198 . 0 0 "[ . 1 . 2]" 1
2249 1 101 TYR H 1 102 LEU H . . 3.640 2.829 2.595 2.977 . 0 0 "[ . 1 . 2]" 1
2250 1 101 TYR H 1 102 LEU HB2 . . 5.500 4.957 4.719 5.225 . 0 0 "[ . 1 . 2]" 1
2251 1 101 TYR HA 1 101 TYR QD . . 3.150 2.092 1.991 2.202 . 0 0 "[ . 1 . 2]" 1
2252 1 101 TYR HA 1 101 TYR QE . . 4.540 4.354 4.280 4.434 . 0 0 "[ . 1 . 2]" 1
2253 1 101 TYR HA 1 104 HIS H . . 4.430 3.808 3.641 3.956 . 0 0 "[ . 1 . 2]" 1
2254 1 101 TYR HA 1 104 HIS HB2 . . 4.540 3.895 3.433 4.141 . 0 0 "[ . 1 . 2]" 1
2255 1 101 TYR HA 1 104 HIS HB3 . . 5.500 5.263 4.942 5.442 . 0 0 "[ . 1 . 2]" 1
2256 1 101 TYR HA 1 104 HIS HD2 . . 4.360 3.872 2.102 4.249 . 0 0 "[ . 1 . 2]" 1
2257 1 101 TYR HB2 1 102 LEU H . . 4.030 3.713 3.601 3.895 . 0 0 "[ . 1 . 2]" 1
2258 1 101 TYR HB3 1 102 LEU H . . 3.400 2.333 2.171 2.587 . 0 0 "[ . 1 . 2]" 1
2259 1 101 TYR HB3 1 102 LEU MD2 . . 5.220 3.805 3.452 4.156 . 0 0 "[ . 1 . 2]" 1
2260 1 101 TYR HB3 1 102 LEU HG . . 4.600 3.262 3.049 3.441 . 0 0 "[ . 1 . 2]" 1
2261 1 101 TYR QD 1 102 LEU H . . 4.140 3.822 3.548 4.051 . 0 0 "[ . 1 . 2]" 1
2262 1 101 TYR QD 1 102 LEU MD2 . . 3.990 3.282 2.854 3.681 . 0 0 "[ . 1 . 2]" 1
2263 1 101 TYR QD 1 102 LEU HG . . 4.320 3.874 3.516 4.276 . 0 0 "[ . 1 . 2]" 1
2264 1 101 TYR QD 1 104 HIS HB2 . . 5.500 4.022 3.539 4.377 . 0 0 "[ . 1 . 2]" 1
2265 1 101 TYR QE 1 101 TYR HH . . 3.220 2.380 2.195 2.636 . 0 0 "[ . 1 . 2]" 1
2266 1 101 TYR QE 1 102 LEU MD2 . . 4.870 4.212 3.795 4.669 . 0 0 "[ . 1 . 2]" 1
2267 1 102 LEU H 1 102 LEU HB2 . . 3.200 2.547 2.437 2.651 . 0 0 "[ . 1 . 2]" 1
2268 1 102 LEU H 1 102 LEU HB3 . . 3.780 3.584 3.581 3.590 . 0 0 "[ . 1 . 2]" 1
2269 1 102 LEU H 1 102 LEU MD1 . . 3.950 3.524 3.186 3.737 . 0 0 "[ . 1 . 2]" 1
2270 1 102 LEU H 1 102 LEU MD2 . . 3.880 3.250 2.978 3.517 . 0 0 "[ . 1 . 2]" 1
2271 1 102 LEU H 1 102 LEU HG . . 3.090 2.144 1.952 2.333 . 0 0 "[ . 1 . 2]" 1
2272 1 102 LEU H 1 104 HIS H . . 5.500 4.317 4.111 4.469 . 0 0 "[ . 1 . 2]" 1
2273 1 102 LEU HA 1 102 LEU MD1 . . 4.340 3.891 3.808 3.965 . 0 0 "[ . 1 . 2]" 1
2274 1 102 LEU HA 1 102 LEU MD2 . . 3.050 2.195 2.003 2.544 . 0 0 "[ . 1 . 2]" 1
2275 1 102 LEU HA 1 104 HIS H . . 4.590 3.996 3.643 4.206 . 0 0 "[ . 1 . 2]" 1
2276 1 102 LEU HA 1 105 PHE HB2 . . 4.450 3.014 2.781 3.145 . 0 0 "[ . 1 . 2]" 1
2277 1 102 LEU HA 1 105 PHE HB3 . . 4.770 4.638 4.422 4.744 . 0 0 "[ . 1 . 2]" 1
2278 1 102 LEU HA 1 105 PHE QD . . 3.560 2.389 2.062 2.878 . 0 0 "[ . 1 . 2]" 1
2279 1 102 LEU HA 1 105 PHE QE . . 4.950 3.897 3.516 4.235 . 0 0 "[ . 1 . 2]" 1
2280 1 102 LEU HA 1 106 HIS H . . 4.750 4.516 4.369 4.699 . 0 0 "[ . 1 . 2]" 1
2281 1 102 LEU HB2 1 102 LEU MD1 . . 3.440 2.256 2.048 2.409 . 0 0 "[ . 1 . 2]" 1
2282 1 102 LEU HB2 1 102 LEU MD2 . . 3.660 3.181 3.137 3.194 . 0 0 "[ . 1 . 2]" 1
2283 1 102 LEU HB2 1 103 SER H . . 3.630 2.537 2.356 2.702 . 0 0 "[ . 1 . 2]" 1
2284 1 102 LEU HB3 1 102 LEU MD1 . . 3.630 2.402 2.208 2.623 . 0 0 "[ . 1 . 2]" 1
2285 1 102 LEU HB3 1 102 LEU MD2 . . 3.200 2.282 2.082 2.406 . 0 0 "[ . 1 . 2]" 1
2286 1 102 LEU HB3 1 103 SER H . . 3.920 3.623 3.428 3.807 . 0 0 "[ . 1 . 2]" 1
2287 1 102 LEU MD1 1 103 SER H . . 4.890 4.375 3.940 4.573 . 0 0 "[ . 1 . 2]" 1
2288 1 102 LEU MD2 1 105 PHE HB2 . . 5.500 3.827 3.460 4.194 . 0 0 "[ . 1 . 2]" 1
2289 1 102 LEU MD2 1 105 PHE QD . . 4.200 3.614 3.251 4.048 . 0 0 "[ . 1 . 2]" 1
2290 1 102 LEU MD2 1 105 PHE QE . . 4.380 4.004 3.584 4.361 . 0 0 "[ . 1 . 2]" 1
2291 1 102 LEU HG 1 103 SER H . . 4.420 4.265 4.104 4.395 . 0 0 "[ . 1 . 2]" 1
2292 1 103 SER H 1 103 SER HB2 . . 3.730 2.612 2.224 3.504 . 0 0 "[ . 1 . 2]" 1
2293 1 103 SER H 1 103 SER QB . . 3.070 2.255 2.162 2.477 . 0 0 "[ . 1 . 2]" 1
2294 1 103 SER H 1 103 SER HB3 . . 3.730 2.819 2.183 3.608 . 0 0 "[ . 1 . 2]" 1
2295 1 103 SER H 1 104 HIS H . . 3.390 2.893 2.795 3.009 . 0 0 "[ . 1 . 2]" 1
2296 1 103 SER H 1 105 PHE H . . 4.640 4.418 4.276 4.562 . 0 0 "[ . 1 . 2]" 1
2297 1 103 SER HA 1 106 HIS H . . 3.930 3.633 3.471 3.844 . 0 0 "[ . 1 . 2]" 1
2298 1 103 SER HA 1 106 HIS HB2 . . 4.180 4.075 3.901 4.180 0.000 2 0 "[ . 1 . 2]" 1
2299 1 103 SER HA 1 106 HIS HB3 . . 4.080 3.087 2.865 3.289 . 0 0 "[ . 1 . 2]" 1
2300 1 103 SER HA 1 107 SER H . . 4.390 3.557 3.310 3.854 . 0 0 "[ . 1 . 2]" 1
2301 1 103 SER QB 1 104 HIS H . . 3.390 2.789 2.498 3.391 0.001 12 0 "[ . 1 . 2]" 1
2302 1 104 HIS H 1 104 HIS HB2 . . 3.110 2.500 2.347 2.626 . 0 0 "[ . 1 . 2]" 1
2303 1 104 HIS H 1 104 HIS HB3 . . 3.600 3.587 3.567 3.593 . 0 0 "[ . 1 . 2]" 1
2304 1 104 HIS H 1 104 HIS HD2 . . 4.390 2.118 1.940 2.470 . 0 0 "[ . 1 . 2]" 1
2305 1 104 HIS H 1 105 PHE H . . 3.170 2.715 2.540 2.789 . 0 0 "[ . 1 . 2]" 1
2306 1 104 HIS H 1 105 PHE HB2 . . 5.230 4.708 4.528 4.794 . 0 0 "[ . 1 . 2]" 1
2307 1 104 HIS H 1 105 PHE QD . . 4.870 3.828 3.573 4.029 . 0 0 "[ . 1 . 2]" 1
2308 1 104 HIS HA 1 104 HIS HD2 . . 4.010 2.993 2.809 4.014 0.004 6 0 "[ . 1 . 2]" 1
2309 1 104 HIS HA 1 107 SER H . . 4.500 4.053 3.779 4.302 . 0 0 "[ . 1 . 2]" 1
2310 1 104 HIS HA 1 107 SER QB . . 3.980 2.766 2.490 3.571 . 0 0 "[ . 1 . 2]" 1
2311 1 104 HIS HA 1 108 ALA H . . 4.680 4.262 4.051 4.597 . 0 0 "[ . 1 . 2]" 1
2312 1 104 HIS HB2 1 105 PHE H . . 3.720 2.585 2.422 2.750 . 0 0 "[ . 1 . 2]" 1
2313 1 104 HIS HB3 1 105 PHE H . . 3.830 3.612 3.373 3.780 . 0 0 "[ . 1 . 2]" 1
2314 1 105 PHE H 1 105 PHE HB2 . . 3.560 2.331 2.290 2.395 . 0 0 "[ . 1 . 2]" 1
2315 1 105 PHE H 1 105 PHE HB3 . . 3.760 3.562 3.550 3.579 . 0 0 "[ . 1 . 2]" 1
2316 1 105 PHE H 1 105 PHE QD . . 3.430 2.058 1.902 2.383 . 0 0 "[ . 1 . 2]" 1
2317 1 105 PHE H 1 105 PHE QE . . 4.510 4.299 4.140 4.459 . 0 0 "[ . 1 . 2]" 1
2318 1 105 PHE H 1 106 HIS HB3 . . 5.210 5.023 4.851 5.207 . 0 0 "[ . 1 . 2]" 1
2319 1 105 PHE H 1 107 SER H . . 4.850 4.525 4.404 4.669 . 0 0 "[ . 1 . 2]" 1
2320 1 105 PHE HA 1 105 PHE QD . . 4.290 3.061 2.903 3.104 . 0 0 "[ . 1 . 2]" 1
2321 1 105 PHE HA 1 108 ALA H . . 4.460 4.003 3.806 4.124 . 0 0 "[ . 1 . 2]" 1
2322 1 105 PHE HA 1 109 PHE QD . . 3.810 3.129 2.759 3.415 . 0 0 "[ . 1 . 2]" 1
2323 1 105 PHE HA 1 109 PHE QE . . 4.700 4.178 3.802 4.536 . 0 0 "[ . 1 . 2]" 1
2324 1 105 PHE HB2 1 106 HIS H . . 3.780 2.465 2.235 2.598 . 0 0 "[ . 1 . 2]" 1
2325 1 105 PHE HB2 1 106 HIS HB2 . . 4.940 4.273 4.168 4.405 . 0 0 "[ . 1 . 2]" 1
2326 1 105 PHE HB3 1 106 HIS H . . 3.340 3.206 2.853 3.341 0.001 11 0 "[ . 1 . 2]" 1
2327 1 105 PHE QD 1 106 HIS H . . 5.220 4.186 4.109 4.250 . 0 0 "[ . 1 . 2]" 1
2328 1 105 PHE QD 1 109 PHE QD . . 4.620 4.265 3.567 4.626 0.006 17 0 "[ . 1 . 2]" 1
2329 1 106 HIS H 1 106 HIS HB2 . . 3.200 2.511 2.411 2.649 . 0 0 "[ . 1 . 2]" 1
2330 1 106 HIS H 1 106 HIS HB3 . . 3.070 2.563 2.441 2.660 . 0 0 "[ . 1 . 2]" 1
2331 1 106 HIS H 1 107 SER H . . 3.450 2.866 2.781 3.039 . 0 0 "[ . 1 . 2]" 1
2332 1 106 HIS HA 1 106 HIS HD2 . . 3.810 2.502 2.297 2.778 . 0 0 "[ . 1 . 2]" 1
2333 1 106 HIS HA 1 109 PHE H . . 4.440 3.019 2.818 3.347 . 0 0 "[ . 1 . 2]" 1
2334 1 106 HIS HA 1 109 PHE HB2 . . 4.980 3.059 2.831 3.315 . 0 0 "[ . 1 . 2]" 1
2335 1 106 HIS HA 1 109 PHE QB . . 4.350 2.999 2.786 3.230 . 0 0 "[ . 1 . 2]" 1
2336 1 106 HIS HA 1 109 PHE HB3 . . 4.980 4.321 4.156 4.484 . 0 0 "[ . 1 . 2]" 1
2337 1 106 HIS HA 1 110 LYS H . . 4.410 4.317 4.160 4.407 . 0 0 "[ . 1 . 2]" 1
2338 1 106 HIS HA 1 110 LYS HA . . 4.750 4.038 3.707 4.362 . 0 0 "[ . 1 . 2]" 1
2339 1 106 HIS HB2 1 107 SER H . . 3.810 3.611 3.515 3.734 . 0 0 "[ . 1 . 2]" 1
2340 1 106 HIS HB3 1 107 SER H . . 3.630 2.147 2.063 2.284 . 0 0 "[ . 1 . 2]" 1
2341 1 106 HIS HB3 1 108 ALA H . . 4.920 4.595 4.462 4.762 . 0 0 "[ . 1 . 2]" 1
2342 1 106 HIS HD2 1 110 LYS HA . . 4.790 2.498 2.009 3.189 . 0 0 "[ . 1 . 2]" 1
2343 1 106 HIS HD2 1 110 LYS HB2 . . 4.820 4.044 3.246 4.833 0.013 2 0 "[ . 1 . 2]" 1
2344 1 106 HIS HD2 1 110 LYS QB . . 4.200 3.274 2.471 4.197 . 0 0 "[ . 1 . 2]" 1
2345 1 106 HIS HD2 1 110 LYS HB3 . . 4.820 3.494 2.561 4.624 . 0 0 "[ . 1 . 2]" 1
2346 1 106 HIS HE1 1 110 LYS HD2 . . 4.980 4.107 3.293 4.993 0.013 2 0 "[ . 1 . 2]" 1
2347 1 106 HIS HE1 1 110 LYS HD3 . . 4.980 3.896 3.213 4.957 . 0 0 "[ . 1 . 2]" 1
2348 1 106 HIS HE1 1 110 LYS QE . . 5.340 4.469 2.059 5.336 . 0 0 "[ . 1 . 2]" 1
2349 1 107 SER H 1 107 SER HB2 . . 3.780 2.503 2.229 3.595 . 0 0 "[ . 1 . 2]" 1
2350 1 107 SER H 1 107 SER QB . . 3.020 2.376 2.167 2.633 . 0 0 "[ . 1 . 2]" 1
2351 1 107 SER H 1 107 SER HB3 . . 3.780 3.259 2.374 3.620 . 0 0 "[ . 1 . 2]" 1
2352 1 107 SER H 1 108 ALA H . . 3.400 2.923 2.785 3.018 . 0 0 "[ . 1 . 2]" 1
2353 1 107 SER H 1 108 ALA MB . . 4.860 4.658 4.524 4.745 . 0 0 "[ . 1 . 2]" 1
2354 1 107 SER H 1 109 PHE H . . 4.970 4.340 4.089 4.731 . 0 0 "[ . 1 . 2]" 1
2355 1 107 SER HA 1 110 LYS H . . 4.780 4.485 4.261 4.643 . 0 0 "[ . 1 . 2]" 1
2356 1 107 SER HA 1 110 LYS QD . . 4.550 2.758 1.818 3.983 . 0 0 "[ . 1 . 2]" 1
2357 1 107 SER HA 1 110 LYS HE2 . . 4.520 3.661 2.003 4.478 . 0 0 "[ . 1 . 2]" 1
2358 1 107 SER HA 1 110 LYS HE3 . . 4.520 3.368 2.097 4.484 . 0 0 "[ . 1 . 2]" 1
2359 1 107 SER HA 1 110 LYS HG2 . . 4.590 2.840 2.169 3.449 . 0 0 "[ . 1 . 2]" 1
2360 1 107 SER HA 1 110 LYS HG3 . . 4.590 3.362 1.999 4.528 . 0 0 "[ . 1 . 2]" 1
2361 1 107 SER QB 1 108 ALA H . . 3.460 2.837 2.582 3.455 . 0 0 "[ . 1 . 2]" 1
2362 1 107 SER QB 1 108 ALA MB . . 4.390 3.670 3.535 4.337 . 0 0 "[ . 1 . 2]" 1
2363 1 107 SER HB2 1 108 ALA H . . 3.960 3.350 2.828 3.945 . 0 0 "[ . 1 . 2]" 1
2364 1 107 SER HB2 1 108 ALA MB . . 5.190 4.403 3.753 5.133 . 0 0 "[ . 1 . 2]" 1
2365 1 107 SER HB3 1 108 ALA H . . 3.960 3.406 2.621 3.941 . 0 0 "[ . 1 . 2]" 1
2366 1 107 SER HB3 1 108 ALA MB . . 5.190 4.184 3.614 5.092 . 0 0 "[ . 1 . 2]" 1
2367 1 108 ALA H 1 108 ALA MB . . 2.900 2.312 2.242 2.371 . 0 0 "[ . 1 . 2]" 1
2368 1 108 ALA H 1 109 PHE H . . 3.220 2.287 2.102 2.531 . 0 0 "[ . 1 . 2]" 1
2369 1 108 ALA MB 1 109 PHE H . . 3.430 2.553 2.205 2.830 . 0 0 "[ . 1 . 2]" 1
2370 1 108 ALA MB 1 109 PHE QB . . 4.670 3.848 3.702 3.927 . 0 0 "[ . 1 . 2]" 1
2371 1 108 ALA MB 1 109 PHE QD . . 3.620 2.445 1.979 3.329 . 0 0 "[ . 1 . 2]" 1
2372 1 108 ALA MB 1 109 PHE QE . . 3.920 3.296 2.864 3.912 . 0 0 "[ . 1 . 2]" 1
2373 1 109 PHE H 1 109 PHE HB2 . . 3.760 2.429 2.307 2.548 . 0 0 "[ . 1 . 2]" 1
2374 1 109 PHE H 1 109 PHE QB . . 3.090 2.395 2.281 2.507 . 0 0 "[ . 1 . 2]" 1
2375 1 109 PHE H 1 109 PHE HB3 . . 3.760 3.649 3.575 3.722 . 0 0 "[ . 1 . 2]" 1
2376 1 109 PHE H 1 109 PHE QD . . 3.620 2.691 2.152 3.229 . 0 0 "[ . 1 . 2]" 1
2377 1 109 PHE H 1 110 LYS H . . 3.120 2.996 2.819 3.122 0.002 13 0 "[ . 1 . 2]" 1
2378 1 109 PHE H 1 110 LYS QB . . 4.990 4.368 3.841 4.949 . 0 0 "[ . 1 . 2]" 1
2379 1 109 PHE QB 1 110 LYS H . . 4.070 3.861 3.765 3.893 . 0 0 "[ . 1 . 2]" 1
2380 1 110 LYS H 1 110 LYS HB2 . . 3.750 3.125 2.176 3.772 0.022 16 0 "[ . 1 . 2]" 1
2381 1 110 LYS H 1 110 LYS QB . . 3.070 2.566 2.155 2.950 . 0 0 "[ . 1 . 2]" 1
2382 1 110 LYS H 1 110 LYS HB3 . . 3.750 3.156 2.824 3.524 . 0 0 "[ . 1 . 2]" 1
2383 1 110 LYS H 1 110 LYS HG2 . . 3.770 2.816 2.059 3.717 . 0 0 "[ . 1 . 2]" 1
2384 1 110 LYS H 1 110 LYS QG . . 3.160 2.498 2.013 2.933 . 0 0 "[ . 1 . 2]" 1
2385 1 110 LYS H 1 110 LYS HG3 . . 3.770 3.021 2.564 3.626 . 0 0 "[ . 1 . 2]" 1
2386 1 110 LYS H 1 111 SER H . . 4.590 3.768 1.910 4.609 0.019 13 0 "[ . 1 . 2]" 1
2387 1 110 LYS H 1 111 SER QB . . 5.180 4.771 3.803 5.179 . 0 0 "[ . 1 . 2]" 1
2388 1 110 LYS HA 1 110 LYS QG . . 3.700 2.882 2.129 3.343 . 0 0 "[ . 1 . 2]" 1
2389 1 110 LYS QB 1 110 LYS QD . . 3.340 2.118 2.016 2.257 . 0 0 "[ . 1 . 2]" 1
2390 1 110 LYS QE 1 110 LYS QG . . 3.240 2.244 2.093 2.580 . 0 0 "[ . 1 . 2]" 1
2391 1 110 LYS QG 1 111 SER H . . 4.490 3.660 2.011 4.404 . 0 0 "[ . 1 . 2]" 1
2392 1 110 LYS HG2 1 111 SER H . . 5.140 4.374 2.411 5.081 . 0 0 "[ . 1 . 2]" 1
2393 1 110 LYS HG3 1 111 SER H . . 5.140 4.168 2.153 5.139 . 0 0 "[ . 1 . 2]" 1
2394 1 111 SER H 1 111 SER QB . . 3.620 2.784 2.220 3.319 . 0 0 "[ . 1 . 2]" 1
2395 1 111 SER H 1 112 GLY H . . 4.770 3.789 2.506 4.580 . 0 0 "[ . 1 . 2]" 1
2396 1 112 GLY QA 1 113 PRO QD . . 2.720 1.972 1.885 2.035 . 0 0 "[ . 1 . 2]" 1
2397 1 112 GLY QA 1 113 PRO QG . . 4.860 3.679 3.651 3.700 . 0 0 "[ . 1 . 2]" 1
2398 1 112 GLY HA2 1 113 PRO HD2 . . 3.490 2.884 2.451 3.207 . 0 0 "[ . 1 . 2]" 1
2399 1 112 GLY HA2 1 113 PRO HD3 . . 3.490 2.632 2.318 2.922 . 0 0 "[ . 1 . 2]" 1
2400 1 112 GLY HA3 1 113 PRO HD2 . . 3.490 2.198 1.967 2.575 . 0 0 "[ . 1 . 2]" 1
2401 1 112 GLY HA3 1 113 PRO HD3 . . 3.490 3.035 2.714 3.452 . 0 0 "[ . 1 . 2]" 1
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