Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
461930 | 2e7c RC | 11235 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2e7c
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 2133
_Distance_constraint_stats_list.Viol_count 467
_Distance_constraint_stats_list.Viol_total 167.335
_Distance_constraint_stats_list.Viol_max 0.198
_Distance_constraint_stats_list.Viol_rms 0.0035
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0002
_Distance_constraint_stats_list.Viol_average_violations_only 0.0179
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 8 THR 0.357 0.102 17 0 "[ . 1 . 2]"
1 9 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 GLN 0.077 0.042 20 0 "[ . 1 . 2]"
1 12 PRO 0.077 0.042 20 0 "[ . 1 . 2]"
1 13 VAL 0.050 0.044 14 0 "[ . 1 . 2]"
1 14 THR 0.050 0.044 14 0 "[ . 1 . 2]"
1 15 ILE 0.339 0.139 13 0 "[ . 1 . 2]"
1 16 ARG 1.370 0.139 13 0 "[ . 1 . 2]"
1 17 GLU 0.895 0.123 15 0 "[ . 1 . 2]"
1 18 ILE 0.012 0.004 16 0 "[ . 1 . 2]"
1 19 ALA 0.007 0.007 5 0 "[ . 1 . 2]"
1 20 GLU 0.177 0.027 14 0 "[ . 1 . 2]"
1 21 PRO 0.032 0.029 17 0 "[ . 1 . 2]"
1 22 PRO 0.150 0.064 17 0 "[ . 1 . 2]"
1 23 LYS 0.186 0.079 20 0 "[ . 1 . 2]"
1 24 ILE 0.024 0.013 11 0 "[ . 1 . 2]"
1 25 ARG 0.081 0.034 15 0 "[ . 1 . 2]"
1 26 LEU 0.089 0.021 11 0 "[ . 1 . 2]"
1 27 PRO 0.755 0.177 20 0 "[ . 1 . 2]"
1 28 ARG 0.767 0.177 20 0 "[ . 1 . 2]"
1 29 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 LEU 0.119 0.040 11 0 "[ . 1 . 2]"
1 31 ARG 0.148 0.032 4 0 "[ . 1 . 2]"
1 32 GLN 0.023 0.023 20 0 "[ . 1 . 2]"
1 33 THR 0.002 0.002 9 0 "[ . 1 . 2]"
1 34 TYR 0.016 0.006 17 0 "[ . 1 . 2]"
1 35 ILE 0.058 0.031 7 0 "[ . 1 . 2]"
1 36 ARG 0.056 0.031 7 0 "[ . 1 . 2]"
1 37 LYS 0.095 0.034 17 0 "[ . 1 . 2]"
1 38 VAL 0.462 0.094 17 0 "[ . 1 . 2]"
1 39 GLY 0.042 0.019 3 0 "[ . 1 . 2]"
1 40 GLU 0.201 0.094 17 0 "[ . 1 . 2]"
1 41 GLN 0.002 0.001 18 0 "[ . 1 . 2]"
1 42 LEU 0.131 0.061 6 0 "[ . 1 . 2]"
1 43 ASN 0.074 0.058 18 0 "[ . 1 . 2]"
1 44 LEU 0.050 0.017 18 0 "[ . 1 . 2]"
1 45 VAL 0.126 0.123 18 0 "[ . 1 . 2]"
1 46 VAL 0.088 0.025 18 0 "[ . 1 . 2]"
1 47 PRO 0.031 0.013 14 0 "[ . 1 . 2]"
1 48 PHE 0.038 0.013 14 0 "[ . 1 . 2]"
1 49 GLN 0.207 0.079 20 0 "[ . 1 . 2]"
1 50 GLY 0.029 0.010 17 0 "[ . 1 . 2]"
1 51 LYS 0.707 0.036 2 0 "[ . 1 . 2]"
1 52 PRO 0.490 0.036 2 0 "[ . 1 . 2]"
1 53 ARG 0.013 0.005 7 0 "[ . 1 . 2]"
1 54 PRO 0.244 0.023 14 0 "[ . 1 . 2]"
1 55 GLN 0.093 0.023 14 0 "[ . 1 . 2]"
1 56 VAL 0.003 0.002 17 0 "[ . 1 . 2]"
1 57 VAL 0.017 0.013 14 0 "[ . 1 . 2]"
1 58 TRP 0.069 0.017 17 0 "[ . 1 . 2]"
1 59 THR 0.026 0.017 4 0 "[ . 1 . 2]"
1 60 LYS 0.016 0.015 4 0 "[ . 1 . 2]"
1 61 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 GLY 0.017 0.017 4 0 "[ . 1 . 2]"
1 63 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 PRO 0.016 0.016 4 0 "[ . 1 . 2]"
1 65 LEU 0.130 0.070 9 0 "[ . 1 . 2]"
1 66 ASP 0.002 0.002 19 0 "[ . 1 . 2]"
1 67 THR 0.001 0.001 6 0 "[ . 1 . 2]"
1 68 SER 0.002 0.002 19 0 "[ . 1 . 2]"
1 69 ARG 0.384 0.157 15 0 "[ . 1 . 2]"
1 70 VAL 0.083 0.032 19 0 "[ . 1 . 2]"
1 71 HIS 0.004 0.004 17 0 "[ . 1 . 2]"
1 72 VAL 0.023 0.010 17 0 "[ . 1 . 2]"
1 73 ARG 0.028 0.023 18 0 "[ . 1 . 2]"
1 74 THR 0.000 0.000 4 0 "[ . 1 . 2]"
1 75 SER 0.069 0.066 19 0 "[ . 1 . 2]"
1 76 ASP 0.029 0.017 18 0 "[ . 1 . 2]"
1 77 PHE 0.017 0.017 18 0 "[ . 1 . 2]"
1 78 ASP 0.084 0.066 19 0 "[ . 1 . 2]"
1 79 THR 0.069 0.025 18 0 "[ . 1 . 2]"
1 80 VAL 0.105 0.058 18 0 "[ . 1 . 2]"
1 81 PHE 0.166 0.123 18 0 "[ . 1 . 2]"
1 82 PHE 0.036 0.021 6 0 "[ . 1 . 2]"
1 83 VAL 0.103 0.061 6 0 "[ . 1 . 2]"
1 84 ARG 0.013 0.008 7 0 "[ . 1 . 2]"
1 85 GLN 0.012 0.004 5 0 "[ . 1 . 2]"
1 86 ALA 0.554 0.109 12 0 "[ . 1 . 2]"
1 87 ALA 0.618 0.109 12 0 "[ . 1 . 2]"
1 88 ARG 0.047 0.028 6 0 "[ . 1 . 2]"
1 89 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 ASP 0.000 0.000 2 0 "[ . 1 . 2]"
1 91 SER 0.017 0.007 3 0 "[ . 1 . 2]"
1 92 GLY 0.009 0.007 3 0 "[ . 1 . 2]"
1 93 GLU 0.008 0.005 7 0 "[ . 1 . 2]"
1 94 TYR 0.047 0.009 17 0 "[ . 1 . 2]"
1 95 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 LEU 0.034 0.009 6 0 "[ . 1 . 2]"
1 97 SER 0.328 0.081 18 0 "[ . 1 . 2]"
1 98 VAL 0.234 0.081 18 0 "[ . 1 . 2]"
1 99 GLN 0.007 0.004 18 0 "[ . 1 . 2]"
1 100 ILE 0.371 0.064 17 0 "[ . 1 . 2]"
1 101 GLU 0.012 0.008 5 0 "[ . 1 . 2]"
1 102 ASN 0.008 0.008 5 0 "[ . 1 . 2]"
1 103 MET 0.068 0.017 5 0 "[ . 1 . 2]"
1 104 LYS 0.585 0.081 18 0 "[ . 1 . 2]"
1 105 ASP 0.030 0.010 17 0 "[ . 1 . 2]"
1 106 THR 0.037 0.021 7 0 "[ . 1 . 2]"
1 107 ALA 0.068 0.021 7 0 "[ . 1 . 2]"
1 108 THR 0.048 0.011 11 0 "[ . 1 . 2]"
1 109 ILE 0.022 0.009 17 0 "[ . 1 . 2]"
1 110 ARG 0.002 0.002 9 0 "[ . 1 . 2]"
1 111 ILE 0.028 0.008 17 0 "[ . 1 . 2]"
1 112 ARG 0.034 0.015 17 0 "[ . 1 . 2]"
1 113 VAL 0.064 0.015 3 0 "[ . 1 . 2]"
1 114 VAL 0.063 0.021 3 0 "[ . 1 . 2]"
1 115 GLU 0.243 0.198 16 0 "[ . 1 . 2]"
1 116 LYS 0.034 0.028 3 0 "[ . 1 . 2]"
1 117 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 118 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 8 THR HA 1 8 THR HB . . 2.900 2.569 2.300 3.002 0.102 17 0 "[ . 1 . 2]" 1
2 1 8 THR HA 1 8 THR MG . . 3.730 2.626 2.054 3.206 . 0 0 "[ . 1 . 2]" 1
3 1 9 LEU H 1 9 LEU QB . . 3.630 2.605 2.185 3.168 . 0 0 "[ . 1 . 2]" 1
4 1 9 LEU HA 1 9 LEU QD . . 3.680 2.535 1.878 3.409 . 0 0 "[ . 1 . 2]" 1
5 1 9 LEU HA 1 9 LEU HG . . 3.990 3.041 2.283 3.770 . 0 0 "[ . 1 . 2]" 1
6 1 9 LEU HA 1 10 ALA H . . 3.190 2.338 2.140 3.149 . 0 0 "[ . 1 . 2]" 1
7 1 9 LEU HA 1 10 ALA MB . . 4.800 4.059 3.770 4.615 . 0 0 "[ . 1 . 2]" 1
8 1 10 ALA H 1 10 ALA MB . . 3.420 2.599 2.117 2.861 . 0 0 "[ . 1 . 2]" 1
9 1 10 ALA HA 1 11 GLN H . . 3.070 2.295 2.142 2.831 . 0 0 "[ . 1 . 2]" 1
10 1 10 ALA MB 1 11 GLN H . . 4.380 3.173 2.243 3.698 . 0 0 "[ . 1 . 2]" 1
11 1 11 GLN H 1 11 GLN QB . . 3.470 2.748 2.200 3.381 . 0 0 "[ . 1 . 2]" 1
12 1 11 GLN H 1 11 GLN QG . . 4.250 3.064 1.897 4.239 . 0 0 "[ . 1 . 2]" 1
13 1 11 GLN HA 1 11 GLN QG . . 3.960 2.805 2.240 3.527 . 0 0 "[ . 1 . 2]" 1
14 1 11 GLN HA 1 12 PRO HD2 . . 3.070 2.167 1.916 2.366 . 0 0 "[ . 1 . 2]" 1
15 1 11 GLN HA 1 12 PRO HD3 . . 3.070 2.309 2.251 2.645 . 0 0 "[ . 1 . 2]" 1
16 1 11 GLN QB 1 12 PRO QD . . 3.440 2.653 2.004 3.482 0.042 20 0 "[ . 1 . 2]" 1
17 1 12 PRO HA 1 13 VAL H . . 2.700 2.309 2.151 2.611 . 0 0 "[ . 1 . 2]" 1
18 1 12 PRO HA 1 13 VAL QG . . 4.510 3.569 3.044 4.040 . 0 0 "[ . 1 . 2]" 1
19 1 12 PRO HB2 1 13 VAL H . . 4.140 2.978 2.129 3.682 . 0 0 "[ . 1 . 2]" 1
20 1 12 PRO HB3 1 13 VAL H . . 4.140 3.676 3.231 4.104 . 0 0 "[ . 1 . 2]" 1
21 1 13 VAL H 1 13 VAL HB . . 3.250 2.673 2.415 2.989 . 0 0 "[ . 1 . 2]" 1
22 1 13 VAL H 1 13 VAL QG . . 3.350 2.502 1.877 2.983 . 0 0 "[ . 1 . 2]" 1
23 1 13 VAL HA 1 13 VAL MG1 . . 3.620 2.424 2.079 3.171 . 0 0 "[ . 1 . 2]" 1
24 1 13 VAL HA 1 13 VAL QG . . 3.130 2.102 1.989 2.405 . 0 0 "[ . 1 . 2]" 1
25 1 13 VAL HA 1 13 VAL MG2 . . 3.620 2.367 2.099 2.617 . 0 0 "[ . 1 . 2]" 1
26 1 13 VAL HA 1 14 THR H . . 3.270 2.254 2.139 3.171 . 0 0 "[ . 1 . 2]" 1
27 1 13 VAL HB 1 14 THR H . . 4.380 4.276 4.017 4.424 0.044 14 0 "[ . 1 . 2]" 1
28 1 13 VAL QG 1 14 THR H . . 4.350 2.845 2.128 3.610 . 0 0 "[ . 1 . 2]" 1
29 1 13 VAL MG1 1 14 THR H . . 5.290 2.972 2.138 4.298 . 0 0 "[ . 1 . 2]" 1
30 1 13 VAL MG2 1 14 THR H . . 5.290 4.076 3.225 4.397 . 0 0 "[ . 1 . 2]" 1
31 1 14 THR H 1 14 THR HB . . 3.590 2.945 2.538 3.579 . 0 0 "[ . 1 . 2]" 1
32 1 14 THR H 1 14 THR MG . . 4.370 3.092 1.938 3.913 . 0 0 "[ . 1 . 2]" 1
33 1 14 THR HA 1 14 THR MG . . 3.240 2.776 2.271 3.207 . 0 0 "[ . 1 . 2]" 1
34 1 14 THR HA 1 15 ILE H . . 2.740 2.246 2.142 2.461 . 0 0 "[ . 1 . 2]" 1
35 1 14 THR HA 1 15 ILE HA . . 4.760 4.394 4.315 4.428 . 0 0 "[ . 1 . 2]" 1
36 1 14 THR HA 1 15 ILE HB . . 5.000 4.744 4.535 4.993 . 0 0 "[ . 1 . 2]" 1
37 1 14 THR MG 1 15 ILE H . . 3.900 3.121 2.108 3.852 . 0 0 "[ . 1 . 2]" 1
38 1 14 THR MG 1 15 ILE HA . . 4.100 3.819 3.408 4.090 . 0 0 "[ . 1 . 2]" 1
39 1 15 ILE H 1 15 ILE HB . . 3.170 2.727 2.507 2.982 . 0 0 "[ . 1 . 2]" 1
40 1 15 ILE H 1 15 ILE HG12 . . 4.380 3.627 2.093 4.350 . 0 0 "[ . 1 . 2]" 1
41 1 15 ILE H 1 15 ILE QG . . 3.610 2.726 2.081 3.385 . 0 0 "[ . 1 . 2]" 1
42 1 15 ILE H 1 15 ILE HG13 . . 4.380 3.134 2.264 4.189 . 0 0 "[ . 1 . 2]" 1
43 1 15 ILE H 1 15 ILE MG . . 3.930 3.873 3.770 3.946 0.016 10 0 "[ . 1 . 2]" 1
44 1 15 ILE HA 1 15 ILE MD . . 3.910 3.353 2.009 3.952 0.042 19 0 "[ . 1 . 2]" 1
45 1 15 ILE HA 1 15 ILE HG12 . . 4.050 2.989 2.421 3.622 . 0 0 "[ . 1 . 2]" 1
46 1 15 ILE HA 1 15 ILE QG . . 3.420 2.592 2.328 3.189 . 0 0 "[ . 1 . 2]" 1
47 1 15 ILE HA 1 15 ILE HG13 . . 4.050 3.063 2.360 3.866 . 0 0 "[ . 1 . 2]" 1
48 1 15 ILE HA 1 15 ILE MG . . 3.020 2.292 2.070 2.455 . 0 0 "[ . 1 . 2]" 1
49 1 15 ILE HA 1 16 ARG H . . 2.890 2.233 2.141 2.857 . 0 0 "[ . 1 . 2]" 1
50 1 15 ILE HA 1 16 ARG HA . . 5.130 4.360 4.296 4.533 . 0 0 "[ . 1 . 2]" 1
51 1 15 ILE HB 1 15 ILE MD . . 3.530 2.515 2.128 3.231 . 0 0 "[ . 1 . 2]" 1
52 1 15 ILE HB 1 16 ARG H . . 4.080 3.965 3.537 4.169 0.089 13 0 "[ . 1 . 2]" 1
53 1 15 ILE MG 1 16 ARG H . . 3.900 2.360 1.888 4.039 0.139 13 0 "[ . 1 . 2]" 1
54 1 15 ILE MG 1 16 ARG HA . . 4.580 4.036 3.621 4.467 . 0 0 "[ . 1 . 2]" 1
55 1 16 ARG H 1 16 ARG HB2 . . 4.100 2.724 2.203 3.719 . 0 0 "[ . 1 . 2]" 1
56 1 16 ARG H 1 16 ARG QB . . 3.460 2.391 2.181 2.991 . 0 0 "[ . 1 . 2]" 1
57 1 16 ARG H 1 16 ARG HB3 . . 4.100 3.233 2.434 3.690 . 0 0 "[ . 1 . 2]" 1
58 1 16 ARG H 1 16 ARG HG2 . . 4.630 3.614 2.048 4.684 0.054 10 0 "[ . 1 . 2]" 1
59 1 16 ARG H 1 16 ARG QG . . 3.930 2.961 1.909 4.065 0.135 10 0 "[ . 1 . 2]" 1
60 1 16 ARG H 1 16 ARG HG3 . . 4.630 3.418 1.917 4.461 . 0 0 "[ . 1 . 2]" 1
61 1 16 ARG HA 1 16 ARG QD . . 4.240 3.611 2.472 4.357 0.117 2 0 "[ . 1 . 2]" 1
62 1 16 ARG HA 1 16 ARG QG . . 3.490 2.580 2.156 3.434 . 0 0 "[ . 1 . 2]" 1
63 1 16 ARG HA 1 17 GLU H . . 2.890 2.482 2.149 2.998 0.108 10 0 "[ . 1 . 2]" 1
64 1 16 ARG QB 1 16 ARG QD . . 3.250 2.194 2.031 2.630 . 0 0 "[ . 1 . 2]" 1
65 1 16 ARG QB 1 16 ARG QG . . 2.350 2.046 2.002 2.086 . 0 0 "[ . 1 . 2]" 1
66 1 16 ARG QB 1 17 GLU H . . 3.760 3.049 2.388 3.819 0.059 19 0 "[ . 1 . 2]" 1
67 1 16 ARG HB2 1 17 GLU H . . 4.280 3.723 2.419 4.403 0.123 15 0 "[ . 1 . 2]" 1
68 1 16 ARG HB3 1 17 GLU H . . 4.280 3.581 2.516 4.343 0.063 12 0 "[ . 1 . 2]" 1
69 1 17 GLU H 1 17 GLU HB2 . . 3.870 2.901 2.239 3.891 0.021 14 0 "[ . 1 . 2]" 1
70 1 17 GLU H 1 17 GLU QB . . 3.150 2.419 2.203 3.081 . 0 0 "[ . 1 . 2]" 1
71 1 17 GLU H 1 17 GLU HB3 . . 3.870 2.888 2.307 3.788 . 0 0 "[ . 1 . 2]" 1
72 1 17 GLU H 1 17 GLU HG2 . . 4.640 3.813 2.092 4.578 . 0 0 "[ . 1 . 2]" 1
73 1 17 GLU H 1 17 GLU QG . . 3.960 3.320 2.071 3.977 0.017 18 0 "[ . 1 . 2]" 1
74 1 17 GLU H 1 17 GLU HG3 . . 4.640 3.936 2.880 4.609 . 0 0 "[ . 1 . 2]" 1
75 1 17 GLU HA 1 17 GLU HG2 . . 4.140 3.416 2.511 3.891 . 0 0 "[ . 1 . 2]" 1
76 1 17 GLU HA 1 17 GLU QG . . 3.520 2.769 2.280 3.381 . 0 0 "[ . 1 . 2]" 1
77 1 17 GLU HA 1 17 GLU HG3 . . 4.140 3.058 2.307 4.175 0.035 6 0 "[ . 1 . 2]" 1
78 1 17 GLU HA 1 18 ILE H . . 2.580 2.293 2.227 2.532 . 0 0 "[ . 1 . 2]" 1
79 1 17 GLU HA 1 18 ILE HB . . 4.940 4.808 4.676 4.930 . 0 0 "[ . 1 . 2]" 1
80 1 17 GLU HA 1 18 ILE HG13 . . 4.380 3.680 3.456 4.019 . 0 0 "[ . 1 . 2]" 1
81 1 17 GLU QB 1 18 ILE H . . 3.560 3.024 2.145 3.564 0.004 16 0 "[ . 1 . 2]" 1
82 1 17 GLU HB2 1 18 ILE H . . 4.100 3.607 2.642 4.050 . 0 0 "[ . 1 . 2]" 1
83 1 17 GLU HB3 1 18 ILE H . . 4.100 3.561 2.171 4.101 0.001 4 0 "[ . 1 . 2]" 1
84 1 17 GLU QG 1 18 ILE H . . 4.270 3.056 1.973 4.127 . 0 0 "[ . 1 . 2]" 1
85 1 17 GLU HG2 1 18 ILE H . . 4.960 3.856 2.390 4.811 . 0 0 "[ . 1 . 2]" 1
86 1 17 GLU HG3 1 18 ILE H . . 4.960 3.373 2.000 4.796 . 0 0 "[ . 1 . 2]" 1
87 1 18 ILE H 1 18 ILE HB . . 2.930 2.546 2.453 2.643 . 0 0 "[ . 1 . 2]" 1
88 1 18 ILE H 1 18 ILE MD . . 3.590 3.389 3.160 3.557 . 0 0 "[ . 1 . 2]" 1
89 1 18 ILE H 1 18 ILE HG12 . . 3.840 3.552 3.208 3.836 . 0 0 "[ . 1 . 2]" 1
90 1 18 ILE H 1 18 ILE HG13 . . 3.390 2.151 1.940 2.490 . 0 0 "[ . 1 . 2]" 1
91 1 18 ILE H 1 18 ILE MG . . 3.810 3.770 3.757 3.788 . 0 0 "[ . 1 . 2]" 1
92 1 18 ILE HA 1 18 ILE MD . . 4.100 3.871 3.828 3.915 . 0 0 "[ . 1 . 2]" 1
93 1 18 ILE HA 1 18 ILE HG12 . . 3.670 2.669 2.543 2.792 . 0 0 "[ . 1 . 2]" 1
94 1 18 ILE HA 1 18 ILE HG13 . . 3.870 2.854 2.639 3.052 . 0 0 "[ . 1 . 2]" 1
95 1 18 ILE HA 1 18 ILE MG . . 3.050 2.392 2.282 2.467 . 0 0 "[ . 1 . 2]" 1
96 1 18 ILE HA 1 19 ALA H . . 2.720 2.214 2.142 2.374 . 0 0 "[ . 1 . 2]" 1
97 1 18 ILE HA 1 19 ALA HA . . 4.420 4.350 4.327 4.377 . 0 0 "[ . 1 . 2]" 1
98 1 18 ILE HA 1 19 ALA MB . . 4.090 3.936 3.859 4.029 . 0 0 "[ . 1 . 2]" 1
99 1 18 ILE HA 1 20 GLU H . . 4.390 4.193 3.908 4.393 0.003 14 0 "[ . 1 . 2]" 1
100 1 18 ILE HA 1 52 PRO QD . . 4.090 3.675 3.089 4.033 . 0 0 "[ . 1 . 2]" 1
101 1 18 ILE HB 1 18 ILE MD . . 3.180 2.325 2.198 2.479 . 0 0 "[ . 1 . 2]" 1
102 1 18 ILE HB 1 19 ALA HA . . 5.500 5.137 4.849 5.350 . 0 0 "[ . 1 . 2]" 1
103 1 18 ILE MD 1 21 PRO HA . . 4.570 3.763 3.484 4.102 . 0 0 "[ . 1 . 2]" 1
104 1 18 ILE MD 1 21 PRO QB . . 5.160 4.323 4.109 4.621 . 0 0 "[ . 1 . 2]" 1
105 1 18 ILE MD 1 101 GLU HB2 . . 3.540 3.224 2.758 3.543 0.003 7 0 "[ . 1 . 2]" 1
106 1 18 ILE MD 1 101 GLU HB3 . . 4.750 4.130 3.735 4.390 . 0 0 "[ . 1 . 2]" 1
107 1 18 ILE MD 1 103 MET QB . . 4.780 2.753 2.373 3.336 . 0 0 "[ . 1 . 2]" 1
108 1 18 ILE MD 1 103 MET HG2 . . 4.460 2.437 1.860 3.333 . 0 0 "[ . 1 . 2]" 1
109 1 18 ILE MD 1 103 MET QG . . 3.600 1.868 1.767 2.109 . 0 0 "[ . 1 . 2]" 1
110 1 18 ILE MD 1 103 MET HG3 . . 4.460 2.251 1.784 2.712 . 0 0 "[ . 1 . 2]" 1
111 1 18 ILE HG12 1 18 ILE MG . . 3.160 2.252 2.134 2.366 . 0 0 "[ . 1 . 2]" 1
112 1 18 ILE MG 1 19 ALA H . . 3.430 2.225 1.825 2.731 . 0 0 "[ . 1 . 2]" 1
113 1 18 ILE MG 1 19 ALA HA . . 4.360 3.905 3.625 4.209 . 0 0 "[ . 1 . 2]" 1
114 1 18 ILE MG 1 20 GLU H . . 3.570 2.027 1.785 2.308 . 0 0 "[ . 1 . 2]" 1
115 1 18 ILE MG 1 21 PRO HA . . 3.220 2.970 2.782 3.207 . 0 0 "[ . 1 . 2]" 1
116 1 18 ILE MG 1 21 PRO QB . . 4.650 4.045 3.622 4.410 . 0 0 "[ . 1 . 2]" 1
117 1 18 ILE MG 1 22 PRO HD2 . . 5.120 4.518 4.162 4.983 . 0 0 "[ . 1 . 2]" 1
118 1 18 ILE MG 1 52 PRO QD . . 4.040 3.395 2.611 4.032 . 0 0 "[ . 1 . 2]" 1
119 1 19 ALA H 1 19 ALA MB . . 2.900 2.126 2.025 2.247 . 0 0 "[ . 1 . 2]" 1
120 1 19 ALA H 1 20 GLU H . . 3.250 2.530 2.110 2.862 . 0 0 "[ . 1 . 2]" 1
121 1 19 ALA H 1 52 PRO QD . . 3.850 3.013 2.707 3.336 . 0 0 "[ . 1 . 2]" 1
122 1 19 ALA HA 1 51 LYS QB . . 4.470 4.246 3.916 4.477 0.007 5 0 "[ . 1 . 2]" 1
123 1 19 ALA MB 1 20 GLU H . . 3.160 2.600 2.268 2.899 . 0 0 "[ . 1 . 2]" 1
124 1 19 ALA MB 1 20 GLU QB . . 4.570 3.077 3.012 3.184 . 0 0 "[ . 1 . 2]" 1
125 1 19 ALA MB 1 51 LYS HB2 . . 3.980 2.353 2.016 2.618 . 0 0 "[ . 1 . 2]" 1
126 1 19 ALA MB 1 51 LYS HB3 . . 3.980 2.025 1.821 2.235 . 0 0 "[ . 1 . 2]" 1
127 1 19 ALA MB 1 52 PRO QD . . 3.540 2.938 2.170 3.334 . 0 0 "[ . 1 . 2]" 1
128 1 20 GLU H 1 20 GLU HB2 . . 3.690 3.170 3.027 3.337 . 0 0 "[ . 1 . 2]" 1
129 1 20 GLU H 1 20 GLU HB3 . . 3.690 3.036 2.849 3.130 . 0 0 "[ . 1 . 2]" 1
130 1 20 GLU H 1 20 GLU QG . . 4.330 4.274 4.179 4.357 0.027 14 0 "[ . 1 . 2]" 1
131 1 20 GLU H 1 21 PRO HA . . 5.110 4.790 4.689 4.923 . 0 0 "[ . 1 . 2]" 1
132 1 20 GLU H 1 51 LYS H . . 3.580 2.956 2.707 3.200 . 0 0 "[ . 1 . 2]" 1
133 1 20 GLU H 1 51 LYS HB2 . . 4.360 2.641 2.173 3.109 . 0 0 "[ . 1 . 2]" 1
134 1 20 GLU H 1 51 LYS QB . . 3.670 2.557 2.152 2.994 . 0 0 "[ . 1 . 2]" 1
135 1 20 GLU H 1 51 LYS HB3 . . 4.360 3.469 3.126 3.911 . 0 0 "[ . 1 . 2]" 1
136 1 20 GLU QB 1 21 PRO QD . . 4.080 3.338 3.263 3.404 . 0 0 "[ . 1 . 2]" 1
137 1 20 GLU QB 1 50 GLY H . . 4.400 3.594 3.125 3.865 . 0 0 "[ . 1 . 2]" 1
138 1 20 GLU QB 1 50 GLY HA2 . . 4.300 2.392 2.031 2.654 . 0 0 "[ . 1 . 2]" 1
139 1 20 GLU QB 1 50 GLY HA3 . . 5.340 3.808 3.422 4.051 . 0 0 "[ . 1 . 2]" 1
140 1 20 GLU QB 1 51 LYS QB . . 3.430 1.928 1.803 2.168 . 0 0 "[ . 1 . 2]" 1
141 1 20 GLU QB 1 51 LYS QE . . 4.530 3.471 2.379 4.194 . 0 0 "[ . 1 . 2]" 1
142 1 20 GLU QB 1 51 LYS QG . . 3.740 2.867 1.972 3.274 . 0 0 "[ . 1 . 2]" 1
143 1 20 GLU HB2 1 51 LYS H . . 3.980 3.865 3.654 3.995 0.015 2 0 "[ . 1 . 2]" 1
144 1 20 GLU HB3 1 51 LYS H . . 3.980 2.365 2.218 2.478 . 0 0 "[ . 1 . 2]" 1
145 1 20 GLU QG 1 21 PRO HD2 . . 4.330 2.004 1.854 2.148 . 0 0 "[ . 1 . 2]" 1
146 1 20 GLU QG 1 21 PRO QD . . 3.670 1.992 1.844 2.134 . 0 0 "[ . 1 . 2]" 1
147 1 20 GLU QG 1 21 PRO HD3 . . 4.330 3.496 3.227 3.675 . 0 0 "[ . 1 . 2]" 1
148 1 20 GLU QG 1 50 GLY H . . 3.920 3.346 2.668 3.930 0.010 17 0 "[ . 1 . 2]" 1
149 1 20 GLU QG 1 50 GLY HA2 . . 4.260 2.755 2.358 3.129 . 0 0 "[ . 1 . 2]" 1
150 1 20 GLU QG 1 50 GLY HA3 . . 4.750 4.280 3.845 4.651 . 0 0 "[ . 1 . 2]" 1
151 1 20 GLU QG 1 51 LYS H . . 4.020 3.923 3.758 4.028 0.008 11 0 "[ . 1 . 2]" 1
152 1 20 GLU QG 1 51 LYS QE . . 5.120 4.477 3.109 5.118 . 0 0 "[ . 1 . 2]" 1
153 1 20 GLU QG 1 51 LYS QG . . 4.400 4.063 3.097 4.423 0.023 15 0 "[ . 1 . 2]" 1
154 1 21 PRO HA 1 22 PRO HD2 . . 3.350 2.279 2.229 2.386 . 0 0 "[ . 1 . 2]" 1
155 1 21 PRO HA 1 22 PRO HD3 . . 3.360 2.273 2.264 2.300 . 0 0 "[ . 1 . 2]" 1
156 1 21 PRO HA 1 100 ILE HB . . 5.420 5.268 5.122 5.449 0.029 17 0 "[ . 1 . 2]" 1
157 1 21 PRO HA 1 100 ILE MD . . 4.700 4.400 3.412 4.692 . 0 0 "[ . 1 . 2]" 1
158 1 21 PRO HA 1 103 MET QB . . 4.260 3.412 3.216 3.711 . 0 0 "[ . 1 . 2]" 1
159 1 21 PRO HA 1 103 MET ME . . 3.730 3.440 2.945 3.732 0.002 19 0 "[ . 1 . 2]" 1
160 1 21 PRO QB 1 22 PRO HD3 . . 3.980 3.601 3.448 3.674 . 0 0 "[ . 1 . 2]" 1
161 1 21 PRO HB2 1 22 PRO HD2 . . 3.780 2.659 2.411 2.777 . 0 0 "[ . 1 . 2]" 1
162 1 21 PRO HB2 1 22 PRO HD3 . . 4.650 3.986 3.790 4.078 . 0 0 "[ . 1 . 2]" 1
163 1 21 PRO HB3 1 22 PRO HD2 . . 3.780 3.036 2.894 3.106 . 0 0 "[ . 1 . 2]" 1
164 1 21 PRO HB3 1 22 PRO HD3 . . 4.650 4.105 3.963 4.174 . 0 0 "[ . 1 . 2]" 1
165 1 22 PRO HA 1 23 LYS H . . 2.980 2.218 2.150 2.373 . 0 0 "[ . 1 . 2]" 1
166 1 22 PRO HA 1 23 LYS QB . . 4.750 4.008 3.917 4.243 . 0 0 "[ . 1 . 2]" 1
167 1 22 PRO HA 1 50 GLY HA2 . . 4.060 3.475 3.158 3.775 . 0 0 "[ . 1 . 2]" 1
168 1 22 PRO HA 1 50 GLY HA3 . . 3.780 2.834 2.564 3.084 . 0 0 "[ . 1 . 2]" 1
169 1 22 PRO HA 1 98 VAL MG1 . . 4.230 3.389 3.017 3.835 . 0 0 "[ . 1 . 2]" 1
170 1 22 PRO HA 1 100 ILE MD . . 3.970 3.315 3.025 3.503 . 0 0 "[ . 1 . 2]" 1
171 1 22 PRO QB 1 23 LYS H . . 3.880 3.080 2.599 3.576 . 0 0 "[ . 1 . 2]" 1
172 1 22 PRO QB 1 98 VAL MG1 . . 3.460 2.219 1.941 2.605 . 0 0 "[ . 1 . 2]" 1
173 1 22 PRO QB 1 98 VAL MG2 . . 4.200 3.553 3.262 3.854 . 0 0 "[ . 1 . 2]" 1
174 1 22 PRO QB 1 100 ILE MD . . 3.350 2.459 2.093 2.638 . 0 0 "[ . 1 . 2]" 1
175 1 22 PRO QB 1 100 ILE QG . . 4.000 2.009 1.882 3.383 . 0 0 "[ . 1 . 2]" 1
176 1 22 PRO QB 1 103 MET QB . . 4.790 3.702 3.523 3.868 . 0 0 "[ . 1 . 2]" 1
177 1 22 PRO QB 1 105 ASP H . . 4.870 3.761 3.362 4.525 . 0 0 "[ . 1 . 2]" 1
178 1 22 PRO QB 1 105 ASP HB2 . . 4.410 2.205 1.988 2.469 . 0 0 "[ . 1 . 2]" 1
179 1 22 PRO QB 1 105 ASP HB3 . . 4.670 3.444 2.585 3.960 . 0 0 "[ . 1 . 2]" 1
180 1 22 PRO HD2 1 100 ILE HB . . 4.650 4.646 4.504 4.667 0.017 19 0 "[ . 1 . 2]" 1
181 1 22 PRO HD2 1 100 ILE MD . . 4.980 4.572 3.413 4.818 . 0 0 "[ . 1 . 2]" 1
182 1 22 PRO HD2 1 100 ILE MG . . 4.430 4.313 4.130 4.494 0.064 17 0 "[ . 1 . 2]" 1
183 1 22 PRO HD2 1 103 MET HB2 . . 4.400 3.059 2.832 3.288 . 0 0 "[ . 1 . 2]" 1
184 1 22 PRO HD2 1 103 MET HB3 . . 4.400 2.340 1.996 2.745 . 0 0 "[ . 1 . 2]" 1
185 1 22 PRO HD2 1 103 MET ME . . 3.680 2.117 1.939 2.519 . 0 0 "[ . 1 . 2]" 1
186 1 22 PRO HD3 1 100 ILE HB . . 4.320 3.360 3.235 3.560 . 0 0 "[ . 1 . 2]" 1
187 1 22 PRO HD3 1 100 ILE MD . . 3.630 3.129 1.901 3.375 . 0 0 "[ . 1 . 2]" 1
188 1 22 PRO HD3 1 100 ILE MG . . 4.440 2.843 2.616 3.307 . 0 0 "[ . 1 . 2]" 1
189 1 22 PRO HD3 1 103 MET HB2 . . 4.730 2.292 1.999 2.586 . 0 0 "[ . 1 . 2]" 1
190 1 22 PRO HD3 1 103 MET QB . . 4.150 2.141 1.896 2.458 . 0 0 "[ . 1 . 2]" 1
191 1 22 PRO HD3 1 103 MET HB3 . . 4.730 2.594 2.338 3.070 . 0 0 "[ . 1 . 2]" 1
192 1 22 PRO HD3 1 103 MET ME . . 3.750 3.472 3.312 3.722 . 0 0 "[ . 1 . 2]" 1
193 1 22 PRO QG 1 103 MET QB . . 4.230 2.100 1.921 2.251 . 0 0 "[ . 1 . 2]" 1
194 1 22 PRO QG 1 104 LYS H . . 4.100 2.885 2.663 3.153 . 0 0 "[ . 1 . 2]" 1
195 1 22 PRO QG 1 104 LYS HA . . 3.750 2.978 2.774 3.228 . 0 0 "[ . 1 . 2]" 1
196 1 22 PRO QG 1 104 LYS HB2 . . 5.350 4.853 4.598 5.129 . 0 0 "[ . 1 . 2]" 1
197 1 22 PRO QG 1 104 LYS HB3 . . 5.350 4.944 4.771 5.207 . 0 0 "[ . 1 . 2]" 1
198 1 22 PRO QG 1 105 ASP H . . 4.240 3.816 3.416 4.125 . 0 0 "[ . 1 . 2]" 1
199 1 22 PRO HG2 1 104 LYS H . . 4.770 3.486 3.112 3.785 . 0 0 "[ . 1 . 2]" 1
200 1 22 PRO HG2 1 104 LYS HA . . 4.560 4.122 3.768 4.375 . 0 0 "[ . 1 . 2]" 1
201 1 22 PRO HG3 1 104 LYS H . . 4.770 3.083 2.857 3.374 . 0 0 "[ . 1 . 2]" 1
202 1 22 PRO HG3 1 104 LYS HA . . 4.560 3.056 2.831 3.324 . 0 0 "[ . 1 . 2]" 1
203 1 23 LYS H 1 23 LYS QB . . 3.650 2.763 2.401 2.930 . 0 0 "[ . 1 . 2]" 1
204 1 23 LYS H 1 23 LYS QG . . 4.700 4.248 4.017 4.445 . 0 0 "[ . 1 . 2]" 1
205 1 23 LYS H 1 24 ILE H . . 4.830 3.956 3.628 4.278 . 0 0 "[ . 1 . 2]" 1
206 1 23 LYS H 1 49 GLN H . . 3.840 2.866 2.669 3.217 . 0 0 "[ . 1 . 2]" 1
207 1 23 LYS H 1 49 GLN HB2 . . 4.370 3.626 3.082 4.322 . 0 0 "[ . 1 . 2]" 1
208 1 23 LYS H 1 50 GLY HA2 . . 5.180 4.774 4.039 5.185 0.005 20 0 "[ . 1 . 2]" 1
209 1 23 LYS H 1 50 GLY HA3 . . 4.520 4.209 3.777 4.461 . 0 0 "[ . 1 . 2]" 1
210 1 23 LYS H 1 98 VAL MG1 . . 4.550 3.902 3.567 4.491 . 0 0 "[ . 1 . 2]" 1
211 1 23 LYS H 1 100 ILE MD . . 5.500 4.913 4.705 5.248 . 0 0 "[ . 1 . 2]" 1
212 1 23 LYS HA 1 23 LYS QD . . 3.660 2.401 1.986 3.667 0.007 10 0 "[ . 1 . 2]" 1
213 1 23 LYS HA 1 23 LYS QG . . 3.640 2.619 2.240 2.896 . 0 0 "[ . 1 . 2]" 1
214 1 23 LYS HA 1 24 ILE H . . 3.140 2.150 2.140 2.181 . 0 0 "[ . 1 . 2]" 1
215 1 23 LYS HA 1 24 ILE HB . . 4.770 4.593 4.501 4.662 . 0 0 "[ . 1 . 2]" 1
216 1 23 LYS HA 1 24 ILE HG13 . . 4.420 3.930 3.571 4.184 . 0 0 "[ . 1 . 2]" 1
217 1 23 LYS HA 1 105 ASP HB2 . . 4.700 4.391 4.039 4.702 0.002 11 0 "[ . 1 . 2]" 1
218 1 23 LYS HA 1 105 ASP HB3 . . 4.970 4.519 3.843 4.936 . 0 0 "[ . 1 . 2]" 1
219 1 23 LYS QB 1 24 ILE H . . 4.250 3.832 3.414 3.944 . 0 0 "[ . 1 . 2]" 1
220 1 23 LYS QB 1 49 GLN H . . 4.280 3.016 2.664 3.293 . 0 0 "[ . 1 . 2]" 1
221 1 23 LYS QB 1 49 GLN HB2 . . 3.770 2.155 1.934 2.425 . 0 0 "[ . 1 . 2]" 1
222 1 23 LYS QB 1 49 GLN HB3 . . 4.040 3.679 3.445 4.006 . 0 0 "[ . 1 . 2]" 1
223 1 23 LYS QB 1 49 GLN HG2 . . 4.470 4.019 3.362 4.409 . 0 0 "[ . 1 . 2]" 1
224 1 23 LYS QB 1 49 GLN QG . . 3.780 3.283 2.570 3.795 0.015 11 0 "[ . 1 . 2]" 1
225 1 23 LYS QB 1 49 GLN HG3 . . 4.470 3.621 2.598 4.549 0.079 20 0 "[ . 1 . 2]" 1
226 1 23 LYS QD 1 24 ILE H . . 4.310 3.419 2.216 4.307 . 0 0 "[ . 1 . 2]" 1
227 1 23 LYS QE 1 23 LYS QG . . 3.270 2.273 2.060 2.609 . 0 0 "[ . 1 . 2]" 1
228 1 23 LYS QE 1 49 GLN HB2 . . 5.500 4.933 2.967 5.543 0.043 20 0 "[ . 1 . 2]" 1
229 1 23 LYS QG 1 24 ILE H . . 3.950 3.214 2.460 3.797 . 0 0 "[ . 1 . 2]" 1
230 1 23 LYS QG 1 25 ARG QD . . 4.210 2.783 1.971 4.043 . 0 0 "[ . 1 . 2]" 1
231 1 23 LYS QG 1 49 GLN HB2 . . 4.400 3.771 3.305 4.101 . 0 0 "[ . 1 . 2]" 1
232 1 24 ILE H 1 24 ILE HB . . 3.430 2.472 2.377 2.599 . 0 0 "[ . 1 . 2]" 1
233 1 24 ILE H 1 24 ILE MD . . 3.940 3.596 3.356 3.894 . 0 0 "[ . 1 . 2]" 1
234 1 24 ILE H 1 24 ILE HG12 . . 4.600 3.810 3.588 4.061 . 0 0 "[ . 1 . 2]" 1
235 1 24 ILE H 1 24 ILE HG13 . . 4.350 2.494 2.288 2.724 . 0 0 "[ . 1 . 2]" 1
236 1 24 ILE H 1 24 ILE MG . . 3.920 3.771 3.727 3.832 . 0 0 "[ . 1 . 2]" 1
237 1 24 ILE H 1 105 ASP HB2 . . 4.650 4.473 4.246 4.651 0.001 6 0 "[ . 1 . 2]" 1
238 1 24 ILE H 1 105 ASP HB3 . . 4.590 3.907 3.550 4.386 . 0 0 "[ . 1 . 2]" 1
239 1 24 ILE HA 1 24 ILE MD . . 4.050 3.849 3.743 3.907 . 0 0 "[ . 1 . 2]" 1
240 1 24 ILE HA 1 24 ILE MG . . 3.420 2.403 2.313 2.471 . 0 0 "[ . 1 . 2]" 1
241 1 24 ILE HA 1 25 ARG H . . 3.180 2.200 2.152 2.279 . 0 0 "[ . 1 . 2]" 1
242 1 24 ILE HA 1 46 VAL MG1 . . 4.540 4.121 3.798 4.496 . 0 0 "[ . 1 . 2]" 1
243 1 24 ILE HA 1 48 PHE HA . . 3.750 2.829 2.635 3.093 . 0 0 "[ . 1 . 2]" 1
244 1 24 ILE HA 1 48 PHE HB2 . . 4.210 3.330 2.532 4.027 . 0 0 "[ . 1 . 2]" 1
245 1 24 ILE HA 1 48 PHE HB3 . . 4.210 2.992 2.500 3.477 . 0 0 "[ . 1 . 2]" 1
246 1 24 ILE HA 1 48 PHE QD . . 5.350 4.815 4.403 5.234 . 0 0 "[ . 1 . 2]" 1
247 1 24 ILE HA 1 49 GLN H . . 4.530 3.885 3.641 4.194 . 0 0 "[ . 1 . 2]" 1
248 1 24 ILE HB 1 24 ILE MD . . 3.270 2.254 2.116 2.431 . 0 0 "[ . 1 . 2]" 1
249 1 24 ILE HB 1 105 ASP HB3 . . 4.620 4.254 3.589 4.630 0.010 17 0 "[ . 1 . 2]" 1
250 1 24 ILE HB 1 107 ALA MB . . 3.650 2.950 2.577 3.334 . 0 0 "[ . 1 . 2]" 1
251 1 24 ILE MD 1 24 ILE MG . . 2.950 2.228 1.908 2.456 . 0 0 "[ . 1 . 2]" 1
252 1 24 ILE MD 1 96 LEU H . . 5.230 4.424 4.162 4.653 . 0 0 "[ . 1 . 2]" 1
253 1 24 ILE MD 1 96 LEU HA . . 5.070 4.542 4.237 4.848 . 0 0 "[ . 1 . 2]" 1
254 1 24 ILE MD 1 96 LEU HB2 . . 5.070 4.521 4.177 4.841 . 0 0 "[ . 1 . 2]" 1
255 1 24 ILE MD 1 96 LEU HB3 . . 4.000 3.189 2.734 3.734 . 0 0 "[ . 1 . 2]" 1
256 1 24 ILE MD 1 96 LEU MD1 . . 4.270 3.552 1.979 4.164 . 0 0 "[ . 1 . 2]" 1
257 1 24 ILE MD 1 96 LEU QD . . 3.360 2.619 1.975 3.181 . 0 0 "[ . 1 . 2]" 1
258 1 24 ILE MD 1 96 LEU MD2 . . 4.270 2.913 2.038 4.165 . 0 0 "[ . 1 . 2]" 1
259 1 24 ILE MD 1 96 LEU HG . . 5.050 3.315 2.021 4.963 . 0 0 "[ . 1 . 2]" 1
260 1 24 ILE MD 1 97 SER H . . 5.500 4.164 3.915 4.435 . 0 0 "[ . 1 . 2]" 1
261 1 24 ILE MD 1 97 SER HA . . 3.850 2.541 2.286 2.817 . 0 0 "[ . 1 . 2]" 1
262 1 24 ILE MD 1 98 VAL H . . 4.040 2.763 2.263 3.542 . 0 0 "[ . 1 . 2]" 1
263 1 24 ILE MD 1 98 VAL HA . . 5.360 4.618 4.207 4.938 . 0 0 "[ . 1 . 2]" 1
264 1 24 ILE MD 1 98 VAL HB . . 4.240 3.540 3.211 3.837 . 0 0 "[ . 1 . 2]" 1
265 1 24 ILE MD 1 98 VAL MG2 . . 3.180 2.479 1.942 2.919 . 0 0 "[ . 1 . 2]" 1
266 1 24 ILE MD 1 105 ASP HB2 . . 4.060 3.384 2.814 4.019 . 0 0 "[ . 1 . 2]" 1
267 1 24 ILE MD 1 105 ASP HB3 . . 4.380 2.205 2.016 2.674 . 0 0 "[ . 1 . 2]" 1
268 1 24 ILE MD 1 106 THR H . . 4.290 2.978 2.530 3.387 . 0 0 "[ . 1 . 2]" 1
269 1 24 ILE MD 1 106 THR HA . . 3.610 2.847 2.641 3.024 . 0 0 "[ . 1 . 2]" 1
270 1 24 ILE MD 1 106 THR HB . . 4.770 4.542 4.309 4.727 . 0 0 "[ . 1 . 2]" 1
271 1 24 ILE MD 1 106 THR MG . . 4.390 4.136 3.969 4.291 . 0 0 "[ . 1 . 2]" 1
272 1 24 ILE MD 1 107 ALA H . . 3.720 3.330 3.066 3.611 . 0 0 "[ . 1 . 2]" 1
273 1 24 ILE MD 1 107 ALA HA . . 4.740 3.695 3.303 4.077 . 0 0 "[ . 1 . 2]" 1
274 1 24 ILE MD 1 107 ALA MB . . 2.960 1.923 1.720 2.132 . 0 0 "[ . 1 . 2]" 1
275 1 24 ILE HG12 1 98 VAL MG2 . . 4.350 2.215 2.009 2.556 . 0 0 "[ . 1 . 2]" 1
276 1 24 ILE HG13 1 24 ILE MG . . 3.480 3.176 3.144 3.202 . 0 0 "[ . 1 . 2]" 1
277 1 24 ILE HG13 1 97 SER HA . . 5.260 4.906 4.575 5.196 . 0 0 "[ . 1 . 2]" 1
278 1 24 ILE HG13 1 98 VAL MG2 . . 3.390 2.421 1.969 2.867 . 0 0 "[ . 1 . 2]" 1
279 1 24 ILE HG13 1 105 ASP HB3 . . 4.760 2.652 2.127 3.021 . 0 0 "[ . 1 . 2]" 1
280 1 24 ILE MG 1 25 ARG H . . 3.380 3.159 2.853 3.377 . 0 0 "[ . 1 . 2]" 1
281 1 24 ILE MG 1 25 ARG HA . . 4.420 4.064 3.834 4.269 . 0 0 "[ . 1 . 2]" 1
282 1 24 ILE MG 1 26 LEU H . . 4.330 3.804 2.946 4.271 . 0 0 "[ . 1 . 2]" 1
283 1 24 ILE MG 1 26 LEU HA . . 4.320 3.842 3.368 4.154 . 0 0 "[ . 1 . 2]" 1
284 1 24 ILE MG 1 26 LEU HG . . 4.450 2.393 2.083 2.745 . 0 0 "[ . 1 . 2]" 1
285 1 24 ILE MG 1 46 VAL HB . . 4.730 4.220 3.820 4.537 . 0 0 "[ . 1 . 2]" 1
286 1 24 ILE MG 1 46 VAL MG1 . . 2.830 2.329 2.093 2.662 . 0 0 "[ . 1 . 2]" 1
287 1 24 ILE MG 1 48 PHE HA . . 4.630 4.327 4.109 4.643 0.013 11 0 "[ . 1 . 2]" 1
288 1 24 ILE MG 1 96 LEU QD . . 3.500 2.231 1.747 2.999 . 0 0 "[ . 1 . 2]" 1
289 1 24 ILE MG 1 98 VAL MG2 . . 4.040 3.750 3.573 4.039 . 0 0 "[ . 1 . 2]" 1
290 1 24 ILE MG 1 107 ALA HA . . 4.820 4.394 4.031 4.688 . 0 0 "[ . 1 . 2]" 1
291 1 24 ILE MG 1 107 ALA MB . . 3.040 2.129 1.817 2.450 . 0 0 "[ . 1 . 2]" 1
292 1 25 ARG H 1 25 ARG QB . . 3.450 2.485 2.222 2.640 . 0 0 "[ . 1 . 2]" 1
293 1 25 ARG H 1 25 ARG QD . . 4.550 3.750 2.344 4.464 . 0 0 "[ . 1 . 2]" 1
294 1 25 ARG H 1 25 ARG HG2 . . 4.160 2.369 1.893 4.147 . 0 0 "[ . 1 . 2]" 1
295 1 25 ARG H 1 25 ARG QG . . 3.590 2.283 1.880 3.547 . 0 0 "[ . 1 . 2]" 1
296 1 25 ARG H 1 25 ARG HG3 . . 4.160 3.437 2.689 3.853 . 0 0 "[ . 1 . 2]" 1
297 1 25 ARG H 1 46 VAL MG1 . . 4.110 4.045 3.755 4.117 0.007 2 0 "[ . 1 . 2]" 1
298 1 25 ARG H 1 48 PHE HA . . 3.600 2.422 2.087 2.799 . 0 0 "[ . 1 . 2]" 1
299 1 25 ARG H 1 49 GLN H . . 4.380 3.970 3.644 4.183 . 0 0 "[ . 1 . 2]" 1
300 1 25 ARG HA 1 25 ARG QD . . 3.580 2.525 1.977 3.614 0.034 15 0 "[ . 1 . 2]" 1
301 1 25 ARG HA 1 25 ARG HG2 . . 3.960 2.938 2.421 3.593 . 0 0 "[ . 1 . 2]" 1
302 1 25 ARG HA 1 25 ARG QG . . 3.340 2.790 2.288 3.061 . 0 0 "[ . 1 . 2]" 1
303 1 25 ARG HA 1 25 ARG HG3 . . 3.960 3.738 2.314 3.923 . 0 0 "[ . 1 . 2]" 1
304 1 25 ARG HA 1 26 LEU H . . 2.980 2.181 2.142 2.339 . 0 0 "[ . 1 . 2]" 1
305 1 25 ARG HA 1 26 LEU QB . . 4.440 4.208 4.146 4.319 . 0 0 "[ . 1 . 2]" 1
306 1 25 ARG HA 1 26 LEU QD . . 5.440 4.810 4.475 4.971 . 0 0 "[ . 1 . 2]" 1
307 1 25 ARG QB 1 25 ARG QD . . 3.170 2.439 2.098 2.644 . 0 0 "[ . 1 . 2]" 1
308 1 25 ARG QB 1 47 PRO QB . . 3.650 2.922 2.641 3.190 . 0 0 "[ . 1 . 2]" 1
309 1 25 ARG QB 1 47 PRO HG2 . . 4.530 2.074 1.949 2.325 . 0 0 "[ . 1 . 2]" 1
310 1 25 ARG QB 1 47 PRO QG . . 3.690 2.060 1.938 2.300 . 0 0 "[ . 1 . 2]" 1
311 1 25 ARG QB 1 47 PRO HG3 . . 4.530 3.537 3.382 3.693 . 0 0 "[ . 1 . 2]" 1
312 1 25 ARG QB 1 48 PHE HA . . 4.750 3.671 2.739 4.260 . 0 0 "[ . 1 . 2]" 1
313 1 25 ARG QD 1 26 LEU H . . 5.200 4.343 3.731 5.192 . 0 0 "[ . 1 . 2]" 1
314 1 25 ARG QD 1 49 GLN HB2 . . 4.840 4.541 3.454 4.855 0.015 17 0 "[ . 1 . 2]" 1
315 1 25 ARG QD 1 49 GLN HG2 . . 4.730 4.186 3.001 4.683 . 0 0 "[ . 1 . 2]" 1
316 1 25 ARG QD 1 49 GLN QG . . 4.110 3.463 2.811 4.032 . 0 0 "[ . 1 . 2]" 1
317 1 25 ARG QD 1 49 GLN HG3 . . 4.730 3.848 2.849 4.746 0.016 11 0 "[ . 1 . 2]" 1
318 1 25 ARG QG 1 49 GLN QG . . 4.600 2.801 2.266 3.913 . 0 0 "[ . 1 . 2]" 1
319 1 25 ARG HG2 1 48 PHE HA . . 4.760 3.409 2.661 4.467 . 0 0 "[ . 1 . 2]" 1
320 1 25 ARG HG3 1 48 PHE HA . . 4.760 4.029 3.130 4.740 . 0 0 "[ . 1 . 2]" 1
321 1 26 LEU H 1 26 LEU QB . . 3.200 2.218 2.154 2.400 . 0 0 "[ . 1 . 2]" 1
322 1 26 LEU H 1 26 LEU MD1 . . 4.310 3.764 3.479 3.970 . 0 0 "[ . 1 . 2]" 1
323 1 26 LEU H 1 26 LEU QD . . 3.710 3.493 3.317 3.629 . 0 0 "[ . 1 . 2]" 1
324 1 26 LEU H 1 26 LEU MD2 . . 4.310 4.156 3.866 4.331 0.021 11 0 "[ . 1 . 2]" 1
325 1 26 LEU H 1 26 LEU HG . . 3.690 3.251 2.800 3.492 . 0 0 "[ . 1 . 2]" 1
326 1 26 LEU HA 1 26 LEU MD1 . . 4.040 3.821 3.794 3.860 . 0 0 "[ . 1 . 2]" 1
327 1 26 LEU HA 1 26 LEU QD . . 3.290 2.194 1.986 2.538 . 0 0 "[ . 1 . 2]" 1
328 1 26 LEU HA 1 26 LEU MD2 . . 4.040 2.209 1.993 2.578 . 0 0 "[ . 1 . 2]" 1
329 1 26 LEU HA 1 27 PRO HD2 . . 3.460 2.160 2.024 2.264 . 0 0 "[ . 1 . 2]" 1
330 1 26 LEU HA 1 27 PRO HD3 . . 3.490 2.259 2.252 2.289 . 0 0 "[ . 1 . 2]" 1
331 1 26 LEU HA 1 27 PRO HG2 . . 4.790 4.320 4.213 4.403 . 0 0 "[ . 1 . 2]" 1
332 1 26 LEU HA 1 27 PRO QG . . 4.060 3.864 3.798 3.920 . 0 0 "[ . 1 . 2]" 1
333 1 26 LEU HA 1 27 PRO HG3 . . 4.790 4.355 4.317 4.398 . 0 0 "[ . 1 . 2]" 1
334 1 26 LEU HA 1 30 LEU QD . . 4.520 3.713 3.342 4.221 . 0 0 "[ . 1 . 2]" 1
335 1 26 LEU HA 1 46 VAL MG1 . . 3.370 2.614 2.088 2.997 . 0 0 "[ . 1 . 2]" 1
336 1 26 LEU HA 1 46 VAL MG2 . . 4.760 4.211 3.733 4.557 . 0 0 "[ . 1 . 2]" 1
337 1 26 LEU QB 1 26 LEU MD1 . . 3.130 2.084 2.055 2.099 . 0 0 "[ . 1 . 2]" 1
338 1 26 LEU QB 1 26 LEU MD2 . . 3.130 2.169 2.001 2.275 . 0 0 "[ . 1 . 2]" 1
339 1 26 LEU QB 1 27 PRO HD2 . . 4.450 2.766 2.528 3.154 . 0 0 "[ . 1 . 2]" 1
340 1 26 LEU QB 1 27 PRO HD3 . . 4.700 3.912 3.755 4.148 . 0 0 "[ . 1 . 2]" 1
341 1 26 LEU QB 1 31 ARG HA . . 5.230 4.551 4.220 4.917 . 0 0 "[ . 1 . 2]" 1
342 1 26 LEU QB 1 31 ARG HG3 . . 4.420 3.917 3.307 4.345 . 0 0 "[ . 1 . 2]" 1
343 1 26 LEU QB 1 46 VAL MG1 . . 4.400 4.027 3.596 4.357 . 0 0 "[ . 1 . 2]" 1
344 1 26 LEU QD 1 27 PRO HD2 . . 3.660 2.033 1.879 2.345 . 0 0 "[ . 1 . 2]" 1
345 1 26 LEU QD 1 27 PRO HD3 . . 3.600 3.068 2.880 3.310 . 0 0 "[ . 1 . 2]" 1
346 1 26 LEU QD 1 30 LEU QB . . 3.460 2.433 1.926 2.887 . 0 0 "[ . 1 . 2]" 1
347 1 26 LEU QD 1 31 ARG HA . . 3.970 3.925 3.775 3.982 0.012 2 0 "[ . 1 . 2]" 1
348 1 26 LEU QD 1 31 ARG HG2 . . 4.120 3.821 3.291 4.117 . 0 0 "[ . 1 . 2]" 1
349 1 26 LEU QD 1 31 ARG HG3 . . 5.400 4.444 3.971 4.825 . 0 0 "[ . 1 . 2]" 1
350 1 26 LEU QD 1 96 LEU QD . . 4.300 3.704 3.094 4.303 0.003 17 0 "[ . 1 . 2]" 1
351 1 26 LEU QD 1 107 ALA HA . . 5.440 3.839 3.522 4.263 . 0 0 "[ . 1 . 2]" 1
352 1 26 LEU QD 1 107 ALA MB . . 2.860 2.392 1.775 2.828 . 0 0 "[ . 1 . 2]" 1
353 1 26 LEU MD1 1 27 PRO HD2 . . 4.470 4.242 4.024 4.432 . 0 0 "[ . 1 . 2]" 1
354 1 26 LEU MD1 1 30 LEU HB2 . . 5.140 4.594 4.353 4.837 . 0 0 "[ . 1 . 2]" 1
355 1 26 LEU MD1 1 30 LEU HB3 . . 5.140 4.481 3.861 5.132 . 0 0 "[ . 1 . 2]" 1
356 1 26 LEU MD1 1 31 ARG HA . . 4.840 4.232 4.054 4.426 . 0 0 "[ . 1 . 2]" 1
357 1 26 LEU MD1 1 31 ARG HG2 . . 5.060 4.041 3.465 4.360 . 0 0 "[ . 1 . 2]" 1
358 1 26 LEU MD1 1 107 ALA MB . . 3.570 2.486 1.780 3.089 . 0 0 "[ . 1 . 2]" 1
359 1 26 LEU MD2 1 27 PRO HD2 . . 4.470 2.037 1.882 2.354 . 0 0 "[ . 1 . 2]" 1
360 1 26 LEU MD2 1 30 LEU HB2 . . 5.140 2.751 2.357 3.124 . 0 0 "[ . 1 . 2]" 1
361 1 26 LEU MD2 1 30 LEU HB3 . . 5.140 2.833 2.039 3.605 . 0 0 "[ . 1 . 2]" 1
362 1 26 LEU MD2 1 31 ARG HA . . 4.840 4.658 4.463 4.825 . 0 0 "[ . 1 . 2]" 1
363 1 26 LEU MD2 1 31 ARG HG2 . . 5.060 4.725 4.105 5.070 0.010 18 0 "[ . 1 . 2]" 1
364 1 26 LEU MD2 1 107 ALA MB . . 3.570 3.331 2.745 3.572 0.002 20 0 "[ . 1 . 2]" 1
365 1 26 LEU HG 1 27 PRO HD2 . . 4.690 3.983 3.709 4.224 . 0 0 "[ . 1 . 2]" 1
366 1 27 PRO HA 1 28 ARG HA . . 4.980 4.388 4.316 4.443 . 0 0 "[ . 1 . 2]" 1
367 1 27 PRO HA 1 28 ARG HB2 . . 5.500 4.766 4.286 5.593 0.093 9 0 "[ . 1 . 2]" 1
368 1 27 PRO HA 1 28 ARG HB3 . . 5.500 5.003 4.164 5.677 0.177 20 0 "[ . 1 . 2]" 1
369 1 27 PRO QB 1 29 HIS HD2 . . 5.340 3.240 2.527 5.099 . 0 0 "[ . 1 . 2]" 1
370 1 27 PRO QB 1 29 HIS HE1 . . 3.540 2.975 2.238 3.440 . 0 0 "[ . 1 . 2]" 1
371 1 27 PRO QB 1 30 LEU H . . 4.660 3.279 2.981 3.626 . 0 0 "[ . 1 . 2]" 1
372 1 27 PRO QB 1 30 LEU QD . . 4.470 3.642 3.402 3.954 . 0 0 "[ . 1 . 2]" 1
373 1 27 PRO QB 1 30 LEU HG . . 4.580 3.762 3.377 4.135 . 0 0 "[ . 1 . 2]" 1
374 1 27 PRO HB2 1 29 HIS HE1 . . 4.030 3.351 2.527 3.811 . 0 0 "[ . 1 . 2]" 1
375 1 27 PRO HB3 1 29 HIS HE1 . . 4.030 3.334 2.498 3.918 . 0 0 "[ . 1 . 2]" 1
376 1 27 PRO HD2 1 30 LEU QB . . 4.370 2.587 2.234 2.961 . 0 0 "[ . 1 . 2]" 1
377 1 27 PRO HD2 1 30 LEU QD . . 3.930 2.135 1.900 2.593 . 0 0 "[ . 1 . 2]" 1
378 1 27 PRO HD2 1 30 LEU HG . . 4.830 3.826 3.514 4.341 . 0 0 "[ . 1 . 2]" 1
379 1 27 PRO HD2 1 46 VAL HA . . 5.080 4.181 3.831 4.421 . 0 0 "[ . 1 . 2]" 1
380 1 27 PRO HD2 1 46 VAL MG1 . . 4.030 3.232 2.895 3.669 . 0 0 "[ . 1 . 2]" 1
381 1 27 PRO HD2 1 46 VAL MG2 . . 4.300 3.635 2.946 3.948 . 0 0 "[ . 1 . 2]" 1
382 1 27 PRO HD2 1 47 PRO HD2 . . 4.650 4.341 3.870 4.651 0.001 7 0 "[ . 1 . 2]" 1
383 1 27 PRO HD3 1 30 LEU QD . . 4.200 2.902 2.592 3.206 . 0 0 "[ . 1 . 2]" 1
384 1 27 PRO HD3 1 46 VAL HA . . 4.290 2.970 2.486 3.443 . 0 0 "[ . 1 . 2]" 1
385 1 27 PRO HD3 1 46 VAL MG1 . . 4.020 2.938 2.338 3.383 . 0 0 "[ . 1 . 2]" 1
386 1 27 PRO HD3 1 46 VAL MG2 . . 4.400 3.578 2.711 3.993 . 0 0 "[ . 1 . 2]" 1
387 1 27 PRO HD3 1 47 PRO HD2 . . 4.090 2.732 2.230 3.221 . 0 0 "[ . 1 . 2]" 1
388 1 27 PRO HD3 1 47 PRO HD3 . . 4.360 3.983 3.448 4.355 . 0 0 "[ . 1 . 2]" 1
389 1 27 PRO QG 1 29 HIS HE1 . . 3.800 2.453 2.026 3.096 . 0 0 "[ . 1 . 2]" 1
390 1 27 PRO QG 1 30 LEU H . . 4.110 2.604 2.265 2.942 . 0 0 "[ . 1 . 2]" 1
391 1 27 PRO QG 1 30 LEU QB . . 4.460 2.045 1.963 2.416 . 0 0 "[ . 1 . 2]" 1
392 1 27 PRO QG 1 30 LEU QD . . 3.320 2.040 1.832 2.367 . 0 0 "[ . 1 . 2]" 1
393 1 27 PRO QG 1 30 LEU HG . . 3.720 2.167 1.965 2.620 . 0 0 "[ . 1 . 2]" 1
394 1 27 PRO QG 1 46 VAL HA . . 4.610 3.895 3.506 4.542 . 0 0 "[ . 1 . 2]" 1
395 1 27 PRO QG 1 46 VAL MG2 . . 4.370 3.608 2.836 4.142 . 0 0 "[ . 1 . 2]" 1
396 1 27 PRO HG2 1 29 HIS HE1 . . 4.340 3.511 2.693 4.060 . 0 0 "[ . 1 . 2]" 1
397 1 27 PRO HG2 1 30 LEU HG . . 4.410 2.249 1.997 2.832 . 0 0 "[ . 1 . 2]" 1
398 1 27 PRO HG2 1 46 VAL MG2 . . 5.210 4.534 3.786 4.969 . 0 0 "[ . 1 . 2]" 1
399 1 27 PRO HG3 1 29 HIS HE1 . . 4.340 2.507 2.075 3.211 . 0 0 "[ . 1 . 2]" 1
400 1 27 PRO HG3 1 30 LEU HG . . 4.410 2.902 2.404 3.398 . 0 0 "[ . 1 . 2]" 1
401 1 27 PRO HG3 1 46 VAL MG2 . . 5.210 3.796 2.930 4.466 . 0 0 "[ . 1 . 2]" 1
402 1 28 ARG HA 1 28 ARG QD . . 4.970 3.756 2.066 4.500 . 0 0 "[ . 1 . 2]" 1
403 1 28 ARG HA 1 28 ARG HG2 . . 4.110 3.133 2.558 3.838 . 0 0 "[ . 1 . 2]" 1
404 1 28 ARG HA 1 28 ARG HG3 . . 4.110 3.052 2.391 3.986 . 0 0 "[ . 1 . 2]" 1
405 1 28 ARG HA 1 29 HIS HA . . 5.500 4.643 4.549 4.845 . 0 0 "[ . 1 . 2]" 1
406 1 28 ARG HA 1 30 LEU H . . 4.660 3.719 3.519 4.191 . 0 0 "[ . 1 . 2]" 1
407 1 28 ARG HA 1 31 ARG H . . 4.420 3.547 3.101 4.253 . 0 0 "[ . 1 . 2]" 1
408 1 28 ARG HA 1 31 ARG QB . . 4.590 3.293 2.692 3.590 . 0 0 "[ . 1 . 2]" 1
409 1 28 ARG HA 1 31 ARG QD . . 3.550 2.702 2.212 3.553 0.003 18 0 "[ . 1 . 2]" 1
410 1 28 ARG HA 1 31 ARG HG2 . . 4.340 3.984 3.526 4.350 0.010 1 0 "[ . 1 . 2]" 1
411 1 28 ARG HA 1 31 ARG HG3 . . 3.400 2.350 2.020 2.693 . 0 0 "[ . 1 . 2]" 1
412 1 28 ARG QB 1 28 ARG QD . . 3.320 2.216 2.034 2.610 . 0 0 "[ . 1 . 2]" 1
413 1 28 ARG QB 1 29 HIS HA . . 5.340 4.285 3.900 4.803 . 0 0 "[ . 1 . 2]" 1
414 1 28 ARG HB2 1 28 ARG QD . . 3.860 2.715 2.062 3.476 . 0 0 "[ . 1 . 2]" 1
415 1 28 ARG HB3 1 28 ARG QD . . 3.860 2.458 2.118 3.220 . 0 0 "[ . 1 . 2]" 1
416 1 29 HIS HA 1 31 ARG H . . 4.850 4.184 3.660 4.850 . 0 0 "[ . 1 . 2]" 1
417 1 29 HIS QB 1 34 TYR QE . . 4.330 3.130 2.261 3.660 . 0 0 "[ . 1 . 2]" 1
418 1 29 HIS HB2 1 34 TYR QE . . 5.160 3.184 2.276 3.751 . 0 0 "[ . 1 . 2]" 1
419 1 29 HIS HB3 1 34 TYR QE . . 5.160 4.663 3.805 5.156 . 0 0 "[ . 1 . 2]" 1
420 1 29 HIS HE1 1 30 LEU HG . . 5.020 3.427 2.287 4.971 . 0 0 "[ . 1 . 2]" 1
421 1 30 LEU H 1 30 LEU HB2 . . 3.930 2.409 2.221 2.767 . 0 0 "[ . 1 . 2]" 1
422 1 30 LEU H 1 30 LEU QB . . 3.390 2.375 2.198 2.707 . 0 0 "[ . 1 . 2]" 1
423 1 30 LEU H 1 30 LEU HB3 . . 3.930 3.629 3.497 3.840 . 0 0 "[ . 1 . 2]" 1
424 1 30 LEU H 1 30 LEU MD1 . . 4.130 4.000 3.705 4.157 0.027 20 0 "[ . 1 . 2]" 1
425 1 30 LEU H 1 30 LEU QD . . 3.600 3.496 3.269 3.640 0.040 11 0 "[ . 1 . 2]" 1
426 1 30 LEU H 1 30 LEU MD2 . . 4.130 3.867 3.555 4.125 . 0 0 "[ . 1 . 2]" 1
427 1 30 LEU H 1 30 LEU HG . . 3.500 3.049 2.596 3.330 . 0 0 "[ . 1 . 2]" 1
428 1 30 LEU H 1 31 ARG H . . 3.190 2.210 1.999 2.465 . 0 0 "[ . 1 . 2]" 1
429 1 30 LEU H 1 31 ARG HG2 . . 5.420 4.897 4.311 5.379 . 0 0 "[ . 1 . 2]" 1
430 1 30 LEU H 1 31 ARG HG3 . . 4.360 3.630 3.101 4.207 . 0 0 "[ . 1 . 2]" 1
431 1 30 LEU HA 1 30 LEU QD . . 3.590 2.072 1.961 2.398 . 0 0 "[ . 1 . 2]" 1
432 1 30 LEU QB 1 46 VAL MG2 . . 5.340 4.176 3.778 4.494 . 0 0 "[ . 1 . 2]" 1
433 1 30 LEU QD 1 34 TYR QB . . 3.850 2.774 1.949 3.466 . 0 0 "[ . 1 . 2]" 1
434 1 30 LEU QD 1 34 TYR QD . . 3.760 2.899 2.144 3.486 . 0 0 "[ . 1 . 2]" 1
435 1 30 LEU QD 1 34 TYR QE . . 4.080 3.525 2.844 4.025 . 0 0 "[ . 1 . 2]" 1
436 1 30 LEU QD 1 44 LEU HB2 . . 5.180 4.068 3.464 4.413 . 0 0 "[ . 1 . 2]" 1
437 1 30 LEU QD 1 44 LEU HB3 . . 4.110 2.799 2.164 3.212 . 0 0 "[ . 1 . 2]" 1
438 1 30 LEU QD 1 44 LEU QD . . 2.740 1.798 1.619 1.997 . 0 0 "[ . 1 . 2]" 1
439 1 30 LEU QD 1 45 VAL H . . 4.560 3.887 3.260 4.466 . 0 0 "[ . 1 . 2]" 1
440 1 30 LEU QD 1 46 VAL HA . . 4.820 3.696 3.190 4.208 . 0 0 "[ . 1 . 2]" 1
441 1 30 LEU QD 1 109 ILE QG . . 4.560 2.917 1.954 3.566 . 0 0 "[ . 1 . 2]" 1
442 1 30 LEU QD 1 109 ILE MG . . 3.390 2.246 1.721 2.848 . 0 0 "[ . 1 . 2]" 1
443 1 30 LEU MD1 1 44 LEU HA . . 4.670 3.912 3.259 4.475 . 0 0 "[ . 1 . 2]" 1
444 1 30 LEU MD1 1 44 LEU MD1 . . 4.130 3.628 1.940 4.044 . 0 0 "[ . 1 . 2]" 1
445 1 30 LEU MD1 1 44 LEU MD2 . . 4.130 2.870 2.378 3.846 . 0 0 "[ . 1 . 2]" 1
446 1 30 LEU MD2 1 44 LEU HA . . 4.670 4.015 3.244 4.556 . 0 0 "[ . 1 . 2]" 1
447 1 30 LEU MD2 1 44 LEU MD1 . . 4.130 2.979 1.891 3.725 . 0 0 "[ . 1 . 2]" 1
448 1 30 LEU MD2 1 44 LEU MD2 . . 4.130 1.930 1.675 3.292 . 0 0 "[ . 1 . 2]" 1
449 1 30 LEU HG 1 34 TYR QE . . 5.420 4.824 4.099 5.311 . 0 0 "[ . 1 . 2]" 1
450 1 31 ARG H 1 31 ARG HB2 . . 3.830 2.494 2.315 2.731 . 0 0 "[ . 1 . 2]" 1
451 1 31 ARG H 1 31 ARG HB3 . . 3.830 3.600 3.558 3.626 . 0 0 "[ . 1 . 2]" 1
452 1 31 ARG H 1 31 ARG HD2 . . 4.950 4.597 4.279 4.899 . 0 0 "[ . 1 . 2]" 1
453 1 31 ARG H 1 31 ARG HD3 . . 4.950 4.465 4.052 4.949 . 0 0 "[ . 1 . 2]" 1
454 1 31 ARG H 1 31 ARG HG2 . . 3.990 3.322 2.815 3.970 . 0 0 "[ . 1 . 2]" 1
455 1 31 ARG H 1 31 ARG HG3 . . 3.520 2.418 1.985 2.973 . 0 0 "[ . 1 . 2]" 1
456 1 31 ARG H 1 32 GLN H . . 3.270 2.724 2.080 3.050 . 0 0 "[ . 1 . 2]" 1
457 1 31 ARG H 1 32 GLN QG . . 4.630 4.172 3.004 4.573 . 0 0 "[ . 1 . 2]" 1
458 1 31 ARG HA 1 31 ARG HD2 . . 4.900 4.732 3.962 4.881 . 0 0 "[ . 1 . 2]" 1
459 1 31 ARG HA 1 31 ARG QD . . 4.200 4.065 3.731 4.232 0.032 4 0 "[ . 1 . 2]" 1
460 1 31 ARG HA 1 31 ARG HD3 . . 4.900 4.447 3.961 4.674 . 0 0 "[ . 1 . 2]" 1
461 1 31 ARG HA 1 31 ARG HG2 . . 3.480 2.425 2.291 2.565 . 0 0 "[ . 1 . 2]" 1
462 1 31 ARG HA 1 31 ARG HG3 . . 3.800 3.180 3.016 3.387 . 0 0 "[ . 1 . 2]" 1
463 1 31 ARG HA 1 32 GLN HA . . 4.680 4.581 4.368 4.703 0.023 20 0 "[ . 1 . 2]" 1
464 1 31 ARG QB 1 31 ARG QD . . 2.890 2.206 2.032 2.367 . 0 0 "[ . 1 . 2]" 1
465 1 31 ARG QB 1 32 GLN H . . 3.790 2.740 2.370 3.767 . 0 0 "[ . 1 . 2]" 1
466 1 31 ARG QB 1 32 GLN QG . . 4.650 3.309 2.500 4.304 . 0 0 "[ . 1 . 2]" 1
467 1 31 ARG HB2 1 31 ARG HD2 . . 3.990 3.439 2.563 3.777 . 0 0 "[ . 1 . 2]" 1
468 1 31 ARG HB2 1 31 ARG HD3 . . 3.990 2.695 2.342 3.876 . 0 0 "[ . 1 . 2]" 1
469 1 31 ARG HB3 1 31 ARG HD2 . . 3.990 3.465 2.277 3.744 . 0 0 "[ . 1 . 2]" 1
470 1 31 ARG HB3 1 31 ARG HD3 . . 3.990 2.638 2.147 3.552 . 0 0 "[ . 1 . 2]" 1
471 1 31 ARG HG3 1 32 GLN H . . 5.500 4.463 4.164 5.109 . 0 0 "[ . 1 . 2]" 1
472 1 32 GLN H 1 32 GLN QB . . 3.300 2.712 2.383 3.240 . 0 0 "[ . 1 . 2]" 1
473 1 32 GLN H 1 32 GLN QG . . 3.270 2.279 1.880 2.800 . 0 0 "[ . 1 . 2]" 1
474 1 32 GLN HA 1 32 GLN QG . . 3.590 2.991 2.370 3.435 . 0 0 "[ . 1 . 2]" 1
475 1 32 GLN HA 1 33 THR HB . . 5.280 5.083 4.825 5.270 . 0 0 "[ . 1 . 2]" 1
476 1 32 GLN QB 1 33 THR H . . 4.220 2.498 1.908 2.976 . 0 0 "[ . 1 . 2]" 1
477 1 32 GLN HB2 1 33 THR H . . 4.860 2.733 1.935 3.870 . 0 0 "[ . 1 . 2]" 1
478 1 32 GLN HB3 1 33 THR H . . 4.860 3.447 2.310 4.150 . 0 0 "[ . 1 . 2]" 1
479 1 33 THR H 1 33 THR MG . . 4.680 3.814 3.673 3.993 . 0 0 "[ . 1 . 2]" 1
480 1 33 THR HA 1 33 THR MG . . 3.120 2.317 2.115 2.496 . 0 0 "[ . 1 . 2]" 1
481 1 33 THR HA 1 34 TYR H . . 3.240 2.188 2.142 2.403 . 0 0 "[ . 1 . 2]" 1
482 1 33 THR HA 1 110 ARG HB2 . . 4.240 2.932 2.449 3.452 . 0 0 "[ . 1 . 2]" 1
483 1 33 THR HA 1 110 ARG HB3 . . 4.270 3.460 2.659 4.176 . 0 0 "[ . 1 . 2]" 1
484 1 33 THR HB 1 34 TYR H . . 4.530 4.142 3.613 4.377 . 0 0 "[ . 1 . 2]" 1
485 1 33 THR HB 1 35 ILE MD . . 3.880 2.884 2.368 3.633 . 0 0 "[ . 1 . 2]" 1
486 1 33 THR HB 1 35 ILE HG12 . . 5.130 3.756 3.346 4.602 . 0 0 "[ . 1 . 2]" 1
487 1 33 THR HB 1 35 ILE QG . . 4.330 3.604 3.224 4.229 . 0 0 "[ . 1 . 2]" 1
488 1 33 THR HB 1 35 ILE HG13 . . 5.130 4.664 4.215 5.093 . 0 0 "[ . 1 . 2]" 1
489 1 33 THR MG 1 34 TYR H . . 3.330 2.663 1.763 3.234 . 0 0 "[ . 1 . 2]" 1
490 1 33 THR MG 1 35 ILE HA . . 4.470 3.883 3.512 4.329 . 0 0 "[ . 1 . 2]" 1
491 1 33 THR MG 1 35 ILE MD . . 2.980 2.162 1.815 2.610 . 0 0 "[ . 1 . 2]" 1
492 1 33 THR MG 1 35 ILE QG . . 3.850 3.336 2.465 3.838 . 0 0 "[ . 1 . 2]" 1
493 1 33 THR MG 1 110 ARG HB2 . . 4.140 3.765 3.381 4.142 0.002 9 0 "[ . 1 . 2]" 1
494 1 33 THR MG 1 110 ARG HB3 . . 3.610 3.153 2.543 3.602 . 0 0 "[ . 1 . 2]" 1
495 1 33 THR MG 1 111 ILE HA . . 4.270 3.806 3.189 4.203 . 0 0 "[ . 1 . 2]" 1
496 1 33 THR MG 1 112 ARG H . . 3.790 3.355 2.928 3.675 . 0 0 "[ . 1 . 2]" 1
497 1 33 THR MG 1 112 ARG HB2 . . 3.210 2.372 2.007 2.889 . 0 0 "[ . 1 . 2]" 1
498 1 33 THR MG 1 112 ARG HB3 . . 3.480 2.336 2.080 2.590 . 0 0 "[ . 1 . 2]" 1
499 1 33 THR MG 1 112 ARG HD2 . . 4.440 2.756 2.338 4.433 . 0 0 "[ . 1 . 2]" 1
500 1 33 THR MG 1 112 ARG QD . . 3.890 2.541 2.244 3.143 . 0 0 "[ . 1 . 2]" 1
501 1 33 THR MG 1 112 ARG HD3 . . 4.440 3.136 2.838 3.478 . 0 0 "[ . 1 . 2]" 1
502 1 33 THR MG 1 112 ARG HG2 . . 4.240 4.011 3.432 4.230 . 0 0 "[ . 1 . 2]" 1
503 1 33 THR MG 1 112 ARG HG3 . . 4.660 4.178 3.899 4.596 . 0 0 "[ . 1 . 2]" 1
504 1 34 TYR H 1 34 TYR HB2 . . 3.870 2.403 2.183 2.810 . 0 0 "[ . 1 . 2]" 1
505 1 34 TYR H 1 34 TYR HB3 . . 3.870 2.806 2.677 2.989 . 0 0 "[ . 1 . 2]" 1
506 1 34 TYR H 1 35 ILE MD . . 5.420 4.418 3.430 5.010 . 0 0 "[ . 1 . 2]" 1
507 1 34 TYR H 1 109 ILE MG . . 5.500 4.701 4.405 5.330 . 0 0 "[ . 1 . 2]" 1
508 1 34 TYR H 1 111 ILE HA . . 4.180 3.032 2.483 3.408 . 0 0 "[ . 1 . 2]" 1
509 1 34 TYR H 1 111 ILE MG . . 5.500 4.700 4.228 5.140 . 0 0 "[ . 1 . 2]" 1
510 1 34 TYR QB 1 35 ILE H . . 4.110 3.881 3.723 3.973 . 0 0 "[ . 1 . 2]" 1
511 1 34 TYR QB 1 109 ILE MG . . 4.560 3.685 3.478 3.911 . 0 0 "[ . 1 . 2]" 1
512 1 34 TYR QB 1 111 ILE HA . . 3.970 2.235 1.992 2.575 . 0 0 "[ . 1 . 2]" 1
513 1 34 TYR QB 1 111 ILE MD . . 4.550 4.058 3.753 4.363 . 0 0 "[ . 1 . 2]" 1
514 1 34 TYR QB 1 111 ILE HG12 . . 4.350 2.761 2.448 3.049 . 0 0 "[ . 1 . 2]" 1
515 1 34 TYR HB2 1 35 ILE H . . 4.710 4.537 4.435 4.615 . 0 0 "[ . 1 . 2]" 1
516 1 34 TYR HB2 1 111 ILE HA . . 4.690 3.227 2.596 3.649 . 0 0 "[ . 1 . 2]" 1
517 1 34 TYR HB2 1 111 ILE MD . . 5.300 4.863 4.396 5.303 0.003 7 0 "[ . 1 . 2]" 1
518 1 34 TYR HB2 1 111 ILE HG12 . . 5.070 3.458 2.828 3.986 . 0 0 "[ . 1 . 2]" 1
519 1 34 TYR HB3 1 35 ILE H . . 4.710 4.219 4.000 4.381 . 0 0 "[ . 1 . 2]" 1
520 1 34 TYR HB3 1 111 ILE HA . . 4.690 2.284 2.055 2.655 . 0 0 "[ . 1 . 2]" 1
521 1 34 TYR HB3 1 111 ILE MD . . 5.300 4.350 4.018 4.656 . 0 0 "[ . 1 . 2]" 1
522 1 34 TYR HB3 1 111 ILE HG12 . . 5.070 2.916 2.590 3.183 . 0 0 "[ . 1 . 2]" 1
523 1 34 TYR QD 1 35 ILE H . . 4.240 3.697 3.283 4.148 . 0 0 "[ . 1 . 2]" 1
524 1 34 TYR QD 1 42 LEU QD . . 3.880 2.869 2.436 3.405 . 0 0 "[ . 1 . 2]" 1
525 1 34 TYR QD 1 44 LEU MD1 . . 4.140 3.766 3.122 4.135 . 0 0 "[ . 1 . 2]" 1
526 1 34 TYR QD 1 44 LEU QD . . 3.530 2.831 2.496 3.187 . 0 0 "[ . 1 . 2]" 1
527 1 34 TYR QD 1 44 LEU MD2 . . 4.140 2.948 2.520 3.359 . 0 0 "[ . 1 . 2]" 1
528 1 34 TYR QD 1 109 ILE MG . . 4.960 4.794 4.616 4.965 0.005 16 0 "[ . 1 . 2]" 1
529 1 34 TYR QD 1 111 ILE HA . . 4.820 3.888 3.619 4.318 . 0 0 "[ . 1 . 2]" 1
530 1 34 TYR QD 1 111 ILE MD . . 4.130 3.856 3.492 4.131 0.001 17 0 "[ . 1 . 2]" 1
531 1 34 TYR QD 1 111 ILE HG12 . . 4.220 3.201 2.836 3.596 . 0 0 "[ . 1 . 2]" 1
532 1 34 TYR QD 1 111 ILE HG13 . . 5.170 4.845 4.518 5.146 . 0 0 "[ . 1 . 2]" 1
533 1 34 TYR QD 1 111 ILE MG . . 3.580 2.634 2.074 3.170 . 0 0 "[ . 1 . 2]" 1
534 1 34 TYR QE 1 36 ARG HB2 . . 4.900 4.271 2.180 4.764 . 0 0 "[ . 1 . 2]" 1
535 1 34 TYR QE 1 36 ARG QD . . 4.420 3.762 2.441 4.368 . 0 0 "[ . 1 . 2]" 1
536 1 34 TYR QE 1 36 ARG HG2 . . 4.160 3.530 2.850 3.992 . 0 0 "[ . 1 . 2]" 1
537 1 34 TYR QE 1 36 ARG HG3 . . 4.160 2.630 2.013 4.166 0.006 17 0 "[ . 1 . 2]" 1
538 1 34 TYR QE 1 42 LEU HB3 . . 4.430 4.028 3.659 4.359 . 0 0 "[ . 1 . 2]" 1
539 1 34 TYR QE 1 42 LEU QD . . 3.210 2.364 1.941 2.791 . 0 0 "[ . 1 . 2]" 1
540 1 34 TYR QE 1 43 ASN H . . 4.430 3.262 2.803 3.909 . 0 0 "[ . 1 . 2]" 1
541 1 34 TYR QE 1 44 LEU MD1 . . 4.560 4.126 3.496 4.528 . 0 0 "[ . 1 . 2]" 1
542 1 34 TYR QE 1 44 LEU QD . . 3.520 2.575 2.139 2.936 . 0 0 "[ . 1 . 2]" 1
543 1 34 TYR QE 1 44 LEU MD2 . . 4.560 2.609 2.145 2.990 . 0 0 "[ . 1 . 2]" 1
544 1 34 TYR QE 1 111 ILE MG . . 4.900 4.386 4.042 4.884 . 0 0 "[ . 1 . 2]" 1
545 1 35 ILE H 1 35 ILE HB . . 3.310 2.597 2.381 2.699 . 0 0 "[ . 1 . 2]" 1
546 1 35 ILE H 1 35 ILE MD . . 3.750 3.331 2.021 3.711 . 0 0 "[ . 1 . 2]" 1
547 1 35 ILE H 1 35 ILE HG12 . . 4.100 2.393 2.049 3.618 . 0 0 "[ . 1 . 2]" 1
548 1 35 ILE H 1 35 ILE QG . . 3.590 2.360 2.037 3.372 . 0 0 "[ . 1 . 2]" 1
549 1 35 ILE H 1 35 ILE HG13 . . 4.100 3.747 3.475 4.047 . 0 0 "[ . 1 . 2]" 1
550 1 35 ILE H 1 35 ILE MG . . 3.910 3.812 3.728 3.870 . 0 0 "[ . 1 . 2]" 1
551 1 35 ILE HA 1 35 ILE MD . . 3.390 2.131 1.986 2.429 . 0 0 "[ . 1 . 2]" 1
552 1 35 ILE HA 1 35 ILE HG12 . . 4.230 3.133 2.920 3.687 . 0 0 "[ . 1 . 2]" 1
553 1 35 ILE HA 1 35 ILE QG . . 3.660 2.946 2.665 3.090 . 0 0 "[ . 1 . 2]" 1
554 1 35 ILE HA 1 35 ILE HG13 . . 4.230 3.716 2.734 3.869 . 0 0 "[ . 1 . 2]" 1
555 1 35 ILE HA 1 35 ILE MG . . 3.110 2.291 2.176 2.440 . 0 0 "[ . 1 . 2]" 1
556 1 35 ILE HA 1 36 ARG H . . 2.980 2.145 2.139 2.162 . 0 0 "[ . 1 . 2]" 1
557 1 35 ILE HA 1 36 ARG HA . . 4.820 4.401 4.390 4.420 . 0 0 "[ . 1 . 2]" 1
558 1 35 ILE HA 1 112 ARG H . . 4.050 3.753 3.559 3.964 . 0 0 "[ . 1 . 2]" 1
559 1 35 ILE HA 1 112 ARG HB3 . . 4.330 2.885 2.026 3.229 . 0 0 "[ . 1 . 2]" 1
560 1 35 ILE HA 1 114 VAL MG1 . . 4.580 3.869 3.570 4.101 . 0 0 "[ . 1 . 2]" 1
561 1 35 ILE HA 1 114 VAL MG2 . . 4.830 4.524 4.219 4.789 . 0 0 "[ . 1 . 2]" 1
562 1 35 ILE HB 1 36 ARG H . . 4.810 4.176 4.069 4.244 . 0 0 "[ . 1 . 2]" 1
563 1 35 ILE MD 1 36 ARG H . . 3.990 3.765 3.596 4.021 0.031 7 0 "[ . 1 . 2]" 1
564 1 35 ILE MD 1 112 ARG H . . 4.690 4.064 3.364 4.618 . 0 0 "[ . 1 . 2]" 1
565 1 35 ILE MD 1 112 ARG HB2 . . 3.830 3.402 2.851 3.718 . 0 0 "[ . 1 . 2]" 1
566 1 35 ILE MD 1 112 ARG HB3 . . 3.550 2.261 1.874 2.633 . 0 0 "[ . 1 . 2]" 1
567 1 35 ILE MD 1 112 ARG QD . . 3.730 2.115 1.842 3.702 . 0 0 "[ . 1 . 2]" 1
568 1 35 ILE MD 1 112 ARG HG2 . . 3.760 2.809 2.208 3.465 . 0 0 "[ . 1 . 2]" 1
569 1 35 ILE QG 1 112 ARG QD . . 4.780 3.946 3.524 4.336 . 0 0 "[ . 1 . 2]" 1
570 1 35 ILE MG 1 36 ARG H . . 3.260 2.620 2.376 2.813 . 0 0 "[ . 1 . 2]" 1
571 1 35 ILE MG 1 36 ARG HA . . 4.350 3.556 3.227 3.738 . 0 0 "[ . 1 . 2]" 1
572 1 35 ILE MG 1 37 LYS HA . . 5.500 4.901 4.716 5.128 . 0 0 "[ . 1 . 2]" 1
573 1 35 ILE MG 1 112 ARG H . . 5.500 5.379 5.172 5.515 0.015 17 0 "[ . 1 . 2]" 1
574 1 35 ILE MG 1 112 ARG HB3 . . 4.650 4.059 3.753 4.292 . 0 0 "[ . 1 . 2]" 1
575 1 35 ILE MG 1 112 ARG HD2 . . 5.500 5.141 4.695 5.508 0.008 7 0 "[ . 1 . 2]" 1
576 1 35 ILE MG 1 112 ARG HD3 . . 5.500 3.793 3.188 5.367 . 0 0 "[ . 1 . 2]" 1
577 1 35 ILE MG 1 112 ARG HG2 . . 4.550 3.600 3.095 4.341 . 0 0 "[ . 1 . 2]" 1
578 1 35 ILE MG 1 113 VAL HA . . 5.500 4.645 4.315 4.987 . 0 0 "[ . 1 . 2]" 1
579 1 35 ILE MG 1 114 VAL H . . 4.740 4.188 3.836 4.506 . 0 0 "[ . 1 . 2]" 1
580 1 36 ARG H 1 36 ARG HB2 . . 4.070 2.738 2.605 3.083 . 0 0 "[ . 1 . 2]" 1
581 1 36 ARG H 1 42 LEU QD . . 5.420 4.837 4.362 5.424 0.004 3 0 "[ . 1 . 2]" 1
582 1 36 ARG H 1 112 ARG H . . 4.770 4.399 4.194 4.620 . 0 0 "[ . 1 . 2]" 1
583 1 36 ARG H 1 112 ARG HB3 . . 4.570 4.227 3.483 4.574 0.004 8 0 "[ . 1 . 2]" 1
584 1 36 ARG H 1 112 ARG HG2 . . 4.990 4.146 3.766 4.678 . 0 0 "[ . 1 . 2]" 1
585 1 36 ARG H 1 113 VAL HA . . 3.930 3.081 2.749 3.390 . 0 0 "[ . 1 . 2]" 1
586 1 36 ARG H 1 114 VAL H . . 3.860 3.554 3.298 3.833 . 0 0 "[ . 1 . 2]" 1
587 1 36 ARG H 1 114 VAL MG1 . . 4.230 3.593 3.204 3.939 . 0 0 "[ . 1 . 2]" 1
588 1 36 ARG H 1 114 VAL MG2 . . 3.860 3.482 3.147 3.788 . 0 0 "[ . 1 . 2]" 1
589 1 36 ARG HA 1 36 ARG QD . . 3.230 2.593 1.988 3.221 . 0 0 "[ . 1 . 2]" 1
590 1 36 ARG HA 1 37 LYS H . . 3.370 2.289 2.198 2.458 . 0 0 "[ . 1 . 2]" 1
591 1 36 ARG HA 1 37 LYS HA . . 4.820 4.342 4.321 4.383 . 0 0 "[ . 1 . 2]" 1
592 1 36 ARG HA 1 37 LYS HG3 . . 4.850 4.330 4.013 4.524 . 0 0 "[ . 1 . 2]" 1
593 1 36 ARG HB2 1 37 LYS H . . 4.340 4.073 3.710 4.234 . 0 0 "[ . 1 . 2]" 1
594 1 36 ARG HB2 1 42 LEU QD . . 3.370 2.719 2.102 3.358 . 0 0 "[ . 1 . 2]" 1
595 1 36 ARG HB3 1 37 LYS H . . 3.590 2.849 2.320 3.599 0.009 17 0 "[ . 1 . 2]" 1
596 1 36 ARG HB3 1 40 GLU HB2 . . 4.730 4.009 3.634 4.437 . 0 0 "[ . 1 . 2]" 1
597 1 36 ARG HB3 1 40 GLU HB3 . . 5.080 4.617 4.064 5.041 . 0 0 "[ . 1 . 2]" 1
598 1 36 ARG HB3 1 42 LEU QD . . 3.630 2.830 2.183 3.209 . 0 0 "[ . 1 . 2]" 1
599 1 36 ARG QD 1 37 LYS H . . 4.120 2.965 2.577 4.024 . 0 0 "[ . 1 . 2]" 1
600 1 36 ARG QD 1 40 GLU HB2 . . 4.440 3.702 3.144 4.436 . 0 0 "[ . 1 . 2]" 1
601 1 36 ARG QD 1 40 GLU HB3 . . 4.640 3.429 2.979 4.219 . 0 0 "[ . 1 . 2]" 1
602 1 36 ARG QD 1 40 GLU QG . . 4.960 4.223 3.636 4.680 . 0 0 "[ . 1 . 2]" 1
603 1 36 ARG QD 1 42 LEU QD . . 4.150 3.058 2.182 3.764 . 0 0 "[ . 1 . 2]" 1
604 1 36 ARG QG 1 37 LYS H . . 4.340 3.965 2.117 4.332 . 0 0 "[ . 1 . 2]" 1
605 1 36 ARG QG 1 42 LEU QD . . 3.310 2.223 1.843 2.635 . 0 0 "[ . 1 . 2]" 1
606 1 36 ARG HG2 1 37 LYS H . . 5.180 4.340 3.812 4.697 . 0 0 "[ . 1 . 2]" 1
607 1 36 ARG HG3 1 37 LYS H . . 5.180 4.717 2.127 5.082 . 0 0 "[ . 1 . 2]" 1
608 1 37 LYS H 1 37 LYS HB2 . . 3.880 2.262 2.177 2.454 . 0 0 "[ . 1 . 2]" 1
609 1 37 LYS H 1 37 LYS QB . . 3.280 2.237 2.156 2.415 . 0 0 "[ . 1 . 2]" 1
610 1 37 LYS H 1 37 LYS HB3 . . 3.880 3.536 3.485 3.610 . 0 0 "[ . 1 . 2]" 1
611 1 37 LYS H 1 37 LYS QD . . 4.990 4.509 3.592 4.837 . 0 0 "[ . 1 . 2]" 1
612 1 37 LYS H 1 37 LYS HG2 . . 4.130 3.824 3.236 4.134 0.004 17 0 "[ . 1 . 2]" 1
613 1 37 LYS H 1 37 LYS HG3 . . 3.800 3.020 2.500 3.338 . 0 0 "[ . 1 . 2]" 1
614 1 37 LYS H 1 38 VAL H . . 4.730 4.595 4.538 4.623 . 0 0 "[ . 1 . 2]" 1
615 1 37 LYS H 1 40 GLU HB2 . . 4.200 3.504 3.013 3.957 . 0 0 "[ . 1 . 2]" 1
616 1 37 LYS H 1 40 GLU QG . . 4.320 3.668 2.978 4.190 . 0 0 "[ . 1 . 2]" 1
617 1 37 LYS H 1 42 LEU QD . . 5.420 5.082 4.536 5.408 . 0 0 "[ . 1 . 2]" 1
618 1 37 LYS H 1 114 VAL MG2 . . 4.020 3.729 3.342 4.022 0.002 3 0 "[ . 1 . 2]" 1
619 1 37 LYS HA 1 37 LYS QD . . 4.670 3.802 3.643 4.089 . 0 0 "[ . 1 . 2]" 1
620 1 37 LYS HA 1 37 LYS QE . . 4.720 4.479 4.089 4.700 . 0 0 "[ . 1 . 2]" 1
621 1 37 LYS HA 1 37 LYS HG2 . . 4.110 2.307 2.179 2.671 . 0 0 "[ . 1 . 2]" 1
622 1 37 LYS HA 1 37 LYS HG3 . . 4.140 3.050 2.570 3.350 . 0 0 "[ . 1 . 2]" 1
623 1 37 LYS HA 1 38 VAL H . . 3.090 2.344 2.252 2.429 . 0 0 "[ . 1 . 2]" 1
624 1 37 LYS HA 1 38 VAL QG . . 3.850 3.508 3.188 3.884 0.034 17 0 "[ . 1 . 2]" 1
625 1 37 LYS HA 1 114 VAL MG2 . . 3.170 2.005 1.800 2.159 . 0 0 "[ . 1 . 2]" 1
626 1 37 LYS QB 1 37 LYS QE . . 4.100 2.219 1.933 2.488 . 0 0 "[ . 1 . 2]" 1
627 1 37 LYS QB 1 38 VAL H . . 3.470 2.591 2.367 2.866 . 0 0 "[ . 1 . 2]" 1
628 1 37 LYS QB 1 40 GLU HB2 . . 4.920 3.170 2.738 3.610 . 0 0 "[ . 1 . 2]" 1
629 1 37 LYS QB 1 40 GLU QG . . 3.680 2.459 1.906 3.022 . 0 0 "[ . 1 . 2]" 1
630 1 37 LYS QB 1 114 VAL MG2 . . 4.130 3.567 3.302 3.731 . 0 0 "[ . 1 . 2]" 1
631 1 37 LYS QB 1 116 LYS HA . . 4.390 3.634 2.656 4.379 . 0 0 "[ . 1 . 2]" 1
632 1 37 LYS QB 1 116 LYS QB . . 4.310 3.362 2.242 4.283 . 0 0 "[ . 1 . 2]" 1
633 1 37 LYS HB2 1 38 VAL H . . 4.230 3.932 3.667 4.146 . 0 0 "[ . 1 . 2]" 1
634 1 37 LYS HB3 1 38 VAL H . . 4.230 2.629 2.392 2.922 . 0 0 "[ . 1 . 2]" 1
635 1 37 LYS QD 1 114 VAL MG2 . . 3.860 3.572 3.235 3.844 . 0 0 "[ . 1 . 2]" 1
636 1 37 LYS QD 1 116 LYS HA . . 3.590 2.550 2.029 3.592 0.002 17 0 "[ . 1 . 2]" 1
637 1 37 LYS HD2 1 114 VAL MG2 . . 4.560 4.194 3.894 4.509 . 0 0 "[ . 1 . 2]" 1
638 1 37 LYS HD2 1 116 LYS HA . . 4.190 2.729 2.080 3.907 . 0 0 "[ . 1 . 2]" 1
639 1 37 LYS HD3 1 114 VAL MG2 . . 4.560 3.908 3.450 4.554 . 0 0 "[ . 1 . 2]" 1
640 1 37 LYS HD3 1 116 LYS HA . . 4.190 3.191 2.326 4.192 0.002 17 0 "[ . 1 . 2]" 1
641 1 37 LYS QE 1 37 LYS HG2 . . 3.570 3.185 2.249 3.473 . 0 0 "[ . 1 . 2]" 1
642 1 37 LYS QE 1 37 LYS HG3 . . 3.480 2.505 2.161 3.304 . 0 0 "[ . 1 . 2]" 1
643 1 37 LYS QE 1 40 GLU HG2 . . 4.630 4.054 3.397 4.574 . 0 0 "[ . 1 . 2]" 1
644 1 37 LYS QE 1 40 GLU QG . . 4.060 3.189 2.768 3.885 . 0 0 "[ . 1 . 2]" 1
645 1 37 LYS QE 1 40 GLU HG3 . . 4.630 3.373 2.831 4.482 . 0 0 "[ . 1 . 2]" 1
646 1 37 LYS QE 1 114 VAL MG2 . . 4.690 4.549 3.980 4.711 0.021 3 0 "[ . 1 . 2]" 1
647 1 37 LYS QE 1 116 LYS HA . . 4.790 4.012 1.804 4.778 . 0 0 "[ . 1 . 2]" 1
648 1 37 LYS HG2 1 38 VAL H . . 4.260 3.656 3.381 4.130 . 0 0 "[ . 1 . 2]" 1
649 1 37 LYS HG2 1 114 VAL MG2 . . 3.440 2.242 1.966 2.605 . 0 0 "[ . 1 . 2]" 1
650 1 37 LYS HG2 1 116 LYS HA . . 4.380 3.317 2.192 4.006 . 0 0 "[ . 1 . 2]" 1
651 1 37 LYS HG3 1 38 VAL H . . 5.500 4.763 4.369 5.001 . 0 0 "[ . 1 . 2]" 1
652 1 37 LYS HG3 1 114 VAL MG2 . . 3.520 3.074 2.460 3.391 . 0 0 "[ . 1 . 2]" 1
653 1 38 VAL H 1 38 VAL HB . . 3.620 2.993 2.341 3.645 0.025 7 0 "[ . 1 . 2]" 1
654 1 38 VAL H 1 38 VAL MG1 . . 3.800 2.762 1.879 3.767 . 0 0 "[ . 1 . 2]" 1
655 1 38 VAL H 1 38 VAL QG . . 2.920 2.065 1.805 2.570 . 0 0 "[ . 1 . 2]" 1
656 1 38 VAL H 1 38 VAL MG2 . . 3.800 2.450 2.068 3.772 . 0 0 "[ . 1 . 2]" 1
657 1 38 VAL H 1 86 ALA MB . . 5.500 4.839 4.250 5.456 . 0 0 "[ . 1 . 2]" 1
658 1 38 VAL H 1 113 VAL MG1 . . 3.620 3.309 3.016 3.581 . 0 0 "[ . 1 . 2]" 1
659 1 38 VAL H 1 114 VAL H . . 4.220 3.999 3.564 4.225 0.005 18 0 "[ . 1 . 2]" 1
660 1 38 VAL H 1 114 VAL MG2 . . 4.040 3.561 3.155 3.762 . 0 0 "[ . 1 . 2]" 1
661 1 38 VAL H 1 115 GLU HA . . 4.040 3.371 3.005 4.052 0.012 8 0 "[ . 1 . 2]" 1
662 1 38 VAL H 1 116 LYS HA . . 4.900 4.284 3.518 4.902 0.002 3 0 "[ . 1 . 2]" 1
663 1 38 VAL HA 1 38 VAL MG1 . . 3.270 2.547 2.298 3.202 . 0 0 "[ . 1 . 2]" 1
664 1 38 VAL HA 1 38 VAL MG2 . . 3.270 2.708 2.184 3.195 . 0 0 "[ . 1 . 2]" 1
665 1 38 VAL HA 1 39 GLY H . . 3.210 2.286 2.221 2.373 . 0 0 "[ . 1 . 2]" 1
666 1 38 VAL HA 1 39 GLY HA2 . . 4.590 4.510 4.463 4.572 . 0 0 "[ . 1 . 2]" 1
667 1 38 VAL HA 1 39 GLY HA3 . . 4.880 4.489 4.453 4.525 . 0 0 "[ . 1 . 2]" 1
668 1 38 VAL HA 1 40 GLU H . . 4.160 3.605 3.246 3.866 . 0 0 "[ . 1 . 2]" 1
669 1 38 VAL HA 1 86 ALA MB . . 3.620 2.798 2.084 3.332 . 0 0 "[ . 1 . 2]" 1
670 1 38 VAL HA 1 87 ALA MB . . 5.500 5.114 4.714 5.454 . 0 0 "[ . 1 . 2]" 1
671 1 38 VAL HA 1 113 VAL MG1 . . 3.420 2.553 1.938 2.725 . 0 0 "[ . 1 . 2]" 1
672 1 38 VAL HA 1 113 VAL MG2 . . 4.880 4.048 3.346 4.529 . 0 0 "[ . 1 . 2]" 1
673 1 38 VAL HA 1 114 VAL MG2 . . 5.500 5.378 5.055 5.516 0.016 7 0 "[ . 1 . 2]" 1
674 1 38 VAL HB 1 39 GLY H . . 4.560 3.367 2.517 4.072 . 0 0 "[ . 1 . 2]" 1
675 1 38 VAL HB 1 40 GLU H . . 5.220 5.003 4.799 5.314 0.094 17 0 "[ . 1 . 2]" 1
676 1 38 VAL HB 1 115 GLU HA . . 4.600 3.714 2.555 4.601 0.001 6 0 "[ . 1 . 2]" 1
677 1 38 VAL QG 1 39 GLY H . . 3.150 2.531 1.870 3.155 0.005 7 0 "[ . 1 . 2]" 1
678 1 38 VAL QG 1 39 GLY HA2 . . 4.210 3.577 3.077 4.040 . 0 0 "[ . 1 . 2]" 1
679 1 38 VAL QG 1 39 GLY HA3 . . 4.060 3.179 2.968 3.336 . 0 0 "[ . 1 . 2]" 1
680 1 38 VAL QG 1 40 GLU H . . 4.520 3.970 3.732 4.143 . 0 0 "[ . 1 . 2]" 1
681 1 38 VAL QG 1 86 ALA MB . . 4.370 3.768 3.398 4.168 . 0 0 "[ . 1 . 2]" 1
682 1 38 VAL QG 1 87 ALA MB . . 4.270 3.645 2.809 4.073 . 0 0 "[ . 1 . 2]" 1
683 1 38 VAL QG 1 88 ARG H . . 3.720 2.665 1.964 3.411 . 0 0 "[ . 1 . 2]" 1
684 1 38 VAL QG 1 88 ARG HA . . 4.250 3.486 2.947 3.955 . 0 0 "[ . 1 . 2]" 1
685 1 38 VAL QG 1 88 ARG QD . . 3.750 3.123 1.714 3.758 0.008 17 0 "[ . 1 . 2]" 1
686 1 38 VAL QG 1 88 ARG QG . . 3.480 2.437 1.888 3.103 . 0 0 "[ . 1 . 2]" 1
687 1 38 VAL QG 1 113 VAL MG1 . . 2.810 1.892 1.688 2.820 0.010 3 0 "[ . 1 . 2]" 1
688 1 38 VAL QG 1 115 GLU HA . . 3.180 1.994 1.838 2.291 . 0 0 "[ . 1 . 2]" 1
689 1 38 VAL QG 1 115 GLU QB . . 3.930 3.354 2.657 3.816 . 0 0 "[ . 1 . 2]" 1
690 1 38 VAL QG 1 115 GLU QG . . 4.170 3.020 2.124 4.169 . 0 0 "[ . 1 . 2]" 1
691 1 38 VAL QG 1 116 LYS H . . 3.910 2.566 1.772 3.538 . 0 0 "[ . 1 . 2]" 1
692 1 38 VAL MG1 1 39 GLY H . . 4.160 3.083 1.928 4.008 . 0 0 "[ . 1 . 2]" 1
693 1 38 VAL MG1 1 87 ALA MB . . 4.930 4.054 3.324 4.972 0.042 17 0 "[ . 1 . 2]" 1
694 1 38 VAL MG1 1 88 ARG H . . 4.830 3.241 2.440 4.479 . 0 0 "[ . 1 . 2]" 1
695 1 38 VAL MG1 1 113 VAL MG1 . . 3.940 2.679 1.690 3.602 . 0 0 "[ . 1 . 2]" 1
696 1 38 VAL MG1 1 115 GLU HA . . 4.320 2.954 1.852 4.339 0.019 8 0 "[ . 1 . 2]" 1
697 1 38 VAL MG1 1 116 LYS H . . 4.650 3.613 1.773 4.594 . 0 0 "[ . 1 . 2]" 1
698 1 38 VAL MG2 1 39 GLY H . . 4.160 3.357 1.874 3.928 . 0 0 "[ . 1 . 2]" 1
699 1 38 VAL MG2 1 87 ALA MB . . 4.930 4.452 2.825 4.934 0.004 7 0 "[ . 1 . 2]" 1
700 1 38 VAL MG2 1 88 ARG H . . 4.830 3.631 1.967 4.833 0.003 6 0 "[ . 1 . 2]" 1
701 1 38 VAL MG2 1 113 VAL MG1 . . 3.940 2.858 1.794 3.924 . 0 0 "[ . 1 . 2]" 1
702 1 38 VAL MG2 1 115 GLU HA . . 4.320 2.471 1.905 4.132 . 0 0 "[ . 1 . 2]" 1
703 1 38 VAL MG2 1 116 LYS H . . 4.650 2.893 1.909 4.605 . 0 0 "[ . 1 . 2]" 1
704 1 39 GLY H 1 40 GLU H . . 3.470 3.160 2.760 3.431 . 0 0 "[ . 1 . 2]" 1
705 1 39 GLY H 1 86 ALA H . . 3.890 2.836 2.616 3.086 . 0 0 "[ . 1 . 2]" 1
706 1 39 GLY H 1 86 ALA MB . . 3.550 3.164 2.470 3.569 0.019 3 0 "[ . 1 . 2]" 1
707 1 39 GLY H 1 113 VAL MG1 . . 4.310 4.140 3.380 4.314 0.004 8 0 "[ . 1 . 2]" 1
708 1 39 GLY HA2 1 85 GLN HA . . 4.330 3.162 2.720 3.354 . 0 0 "[ . 1 . 2]" 1
709 1 39 GLY HA2 1 85 GLN HB2 . . 4.530 2.986 2.002 4.177 . 0 0 "[ . 1 . 2]" 1
710 1 39 GLY HA2 1 85 GLN QB . . 3.820 2.174 1.981 2.416 . 0 0 "[ . 1 . 2]" 1
711 1 39 GLY HA2 1 85 GLN HB3 . . 4.530 2.738 2.257 3.358 . 0 0 "[ . 1 . 2]" 1
712 1 39 GLY HA2 1 85 GLN HG2 . . 5.040 4.326 2.706 5.042 0.002 2 0 "[ . 1 . 2]" 1
713 1 39 GLY HA2 1 85 GLN QG . . 4.310 3.808 2.677 4.312 0.002 20 0 "[ . 1 . 2]" 1
714 1 39 GLY HA2 1 85 GLN HG3 . . 5.040 4.520 4.079 4.881 . 0 0 "[ . 1 . 2]" 1
715 1 39 GLY HA2 1 86 ALA H . . 4.670 3.270 2.619 3.571 . 0 0 "[ . 1 . 2]" 1
716 1 39 GLY HA3 1 85 GLN HA . . 4.680 4.577 4.150 4.684 0.004 5 0 "[ . 1 . 2]" 1
717 1 39 GLY HA3 1 85 GLN QB . . 4.100 3.781 3.405 4.068 . 0 0 "[ . 1 . 2]" 1
718 1 40 GLU H 1 40 GLU HB2 . . 3.070 2.261 2.189 2.492 . 0 0 "[ . 1 . 2]" 1
719 1 40 GLU H 1 40 GLU HB3 . . 3.710 3.528 3.494 3.589 . 0 0 "[ . 1 . 2]" 1
720 1 40 GLU H 1 40 GLU HG2 . . 3.970 2.880 2.721 3.261 . 0 0 "[ . 1 . 2]" 1
721 1 40 GLU H 1 40 GLU QG . . 3.340 2.699 2.313 2.973 . 0 0 "[ . 1 . 2]" 1
722 1 40 GLU H 1 40 GLU HG3 . . 3.970 3.559 2.397 3.951 . 0 0 "[ . 1 . 2]" 1
723 1 40 GLU H 1 41 GLN H . . 4.720 4.622 4.580 4.649 . 0 0 "[ . 1 . 2]" 1
724 1 40 GLU H 1 85 GLN HA . . 5.210 4.740 4.299 5.054 . 0 0 "[ . 1 . 2]" 1
725 1 40 GLU H 1 86 ALA H . . 3.930 3.735 3.352 3.928 . 0 0 "[ . 1 . 2]" 1
726 1 40 GLU H 1 86 ALA MB . . 3.920 3.612 3.191 3.915 . 0 0 "[ . 1 . 2]" 1
727 1 40 GLU HA 1 40 GLU HG2 . . 4.030 2.524 2.325 2.745 . 0 0 "[ . 1 . 2]" 1
728 1 40 GLU HA 1 40 GLU QG . . 3.240 2.476 2.278 2.668 . 0 0 "[ . 1 . 2]" 1
729 1 40 GLU HA 1 40 GLU HG3 . . 4.030 3.593 3.270 3.658 . 0 0 "[ . 1 . 2]" 1
730 1 40 GLU HA 1 41 GLN H . . 2.960 2.308 2.172 2.567 . 0 0 "[ . 1 . 2]" 1
731 1 40 GLU HB2 1 41 GLN H . . 4.210 4.015 3.576 4.209 . 0 0 "[ . 1 . 2]" 1
732 1 40 GLU HB2 1 86 ALA MB . . 4.630 3.706 3.266 4.282 . 0 0 "[ . 1 . 2]" 1
733 1 40 GLU HB3 1 41 GLN H . . 3.560 2.757 2.105 3.154 . 0 0 "[ . 1 . 2]" 1
734 1 40 GLU HB3 1 86 ALA H . . 5.500 5.408 5.127 5.506 0.006 17 0 "[ . 1 . 2]" 1
735 1 40 GLU QG 1 41 GLN H . . 4.180 4.046 3.779 4.180 0.000 8 0 "[ . 1 . 2]" 1
736 1 41 GLN H 1 41 GLN QB . . 3.200 2.324 2.221 2.538 . 0 0 "[ . 1 . 2]" 1
737 1 41 GLN H 1 41 GLN HG2 . . 4.430 3.993 3.734 4.296 . 0 0 "[ . 1 . 2]" 1
738 1 41 GLN H 1 41 GLN QG . . 3.620 2.866 2.397 3.460 . 0 0 "[ . 1 . 2]" 1
739 1 41 GLN H 1 41 GLN HG3 . . 4.430 2.958 2.422 3.668 . 0 0 "[ . 1 . 2]" 1
740 1 41 GLN HA 1 41 GLN HG2 . . 3.990 3.009 2.461 3.707 . 0 0 "[ . 1 . 2]" 1
741 1 41 GLN HA 1 41 GLN HG3 . . 3.990 2.562 2.231 2.883 . 0 0 "[ . 1 . 2]" 1
742 1 41 GLN HA 1 42 LEU H . . 2.930 2.221 2.148 2.393 . 0 0 "[ . 1 . 2]" 1
743 1 41 GLN HA 1 42 LEU HG . . 4.850 4.123 3.698 4.601 . 0 0 "[ . 1 . 2]" 1
744 1 41 GLN HA 1 83 VAL H . . 4.400 4.176 3.950 4.392 . 0 0 "[ . 1 . 2]" 1
745 1 41 GLN HA 1 84 ARG HA . . 4.650 4.366 4.013 4.642 . 0 0 "[ . 1 . 2]" 1
746 1 41 GLN HA 1 85 GLN HA . . 4.320 3.728 3.237 4.147 . 0 0 "[ . 1 . 2]" 1
747 1 41 GLN HA 1 86 ALA H . . 4.570 4.119 3.624 4.474 . 0 0 "[ . 1 . 2]" 1
748 1 41 GLN HA 1 86 ALA MB . . 4.660 4.196 3.808 4.458 . 0 0 "[ . 1 . 2]" 1
749 1 41 GLN QB 1 42 LEU H . . 3.680 2.941 2.415 3.261 . 0 0 "[ . 1 . 2]" 1
750 1 41 GLN QB 1 43 ASN QB . . 4.390 4.279 3.850 4.391 0.001 18 0 "[ . 1 . 2]" 1
751 1 41 GLN QB 1 82 PHE QE . . 4.070 2.164 1.981 2.768 . 0 0 "[ . 1 . 2]" 1
752 1 41 GLN QB 1 84 ARG HA . . 5.110 4.702 4.294 5.107 . 0 0 "[ . 1 . 2]" 1
753 1 41 GLN QG 1 42 LEU H . . 4.250 3.852 3.514 4.090 . 0 0 "[ . 1 . 2]" 1
754 1 41 GLN QG 1 82 PHE QE . . 4.070 2.367 1.984 2.800 . 0 0 "[ . 1 . 2]" 1
755 1 41 GLN QG 1 84 ARG HA . . 3.790 3.055 2.653 3.519 . 0 0 "[ . 1 . 2]" 1
756 1 41 GLN HG2 1 42 LEU H . . 4.950 4.333 3.930 4.948 . 0 0 "[ . 1 . 2]" 1
757 1 41 GLN HG2 1 82 PHE QE . . 4.660 2.403 2.068 2.849 . 0 0 "[ . 1 . 2]" 1
758 1 41 GLN HG2 1 82 PHE HZ . . 5.170 2.625 2.097 3.372 . 0 0 "[ . 1 . 2]" 1
759 1 41 GLN HG2 1 84 ARG HA . . 4.630 3.471 2.714 4.517 . 0 0 "[ . 1 . 2]" 1
760 1 41 GLN HG3 1 42 LEU H . . 4.950 4.455 3.701 4.895 . 0 0 "[ . 1 . 2]" 1
761 1 41 GLN HG3 1 82 PHE QE . . 4.660 3.657 2.557 4.208 . 0 0 "[ . 1 . 2]" 1
762 1 41 GLN HG3 1 82 PHE HZ . . 5.170 3.840 2.432 4.551 . 0 0 "[ . 1 . 2]" 1
763 1 41 GLN HG3 1 84 ARG HA . . 4.630 3.888 2.738 4.620 . 0 0 "[ . 1 . 2]" 1
764 1 42 LEU H 1 42 LEU HB2 . . 4.130 2.357 2.180 2.530 . 0 0 "[ . 1 . 2]" 1
765 1 42 LEU H 1 42 LEU MD1 . . 4.550 3.708 3.353 3.930 . 0 0 "[ . 1 . 2]" 1
766 1 42 LEU H 1 42 LEU QD . . 3.920 3.429 3.189 3.627 . 0 0 "[ . 1 . 2]" 1
767 1 42 LEU H 1 42 LEU MD2 . . 4.550 4.059 3.703 4.324 . 0 0 "[ . 1 . 2]" 1
768 1 42 LEU H 1 42 LEU HG . . 4.050 3.036 2.578 3.478 . 0 0 "[ . 1 . 2]" 1
769 1 42 LEU H 1 82 PHE HA . . 4.420 4.142 3.847 4.400 . 0 0 "[ . 1 . 2]" 1
770 1 42 LEU H 1 83 VAL H . . 3.650 2.592 2.316 2.806 . 0 0 "[ . 1 . 2]" 1
771 1 42 LEU H 1 83 VAL HB . . 4.040 3.100 2.318 3.811 . 0 0 "[ . 1 . 2]" 1
772 1 42 LEU H 1 83 VAL MG1 . . 4.560 4.047 1.863 4.523 . 0 0 "[ . 1 . 2]" 1
773 1 42 LEU H 1 83 VAL MG2 . . 4.560 4.262 3.206 4.621 0.061 6 0 "[ . 1 . 2]" 1
774 1 42 LEU H 1 84 ARG HA . . 5.500 5.226 4.838 5.479 . 0 0 "[ . 1 . 2]" 1
775 1 42 LEU H 1 86 ALA MB . . 4.520 4.075 3.668 4.523 0.003 19 0 "[ . 1 . 2]" 1
776 1 42 LEU HB2 1 42 LEU MD1 . . 3.670 2.197 2.053 2.293 . 0 0 "[ . 1 . 2]" 1
777 1 42 LEU HB2 1 42 LEU MD2 . . 3.670 3.168 3.145 3.192 . 0 0 "[ . 1 . 2]" 1
778 1 42 LEU HB2 1 43 ASN H . . 4.760 4.113 3.897 4.556 . 0 0 "[ . 1 . 2]" 1
779 1 42 LEU HB2 1 81 PHE QD . . 5.210 4.230 3.836 4.707 . 0 0 "[ . 1 . 2]" 1
780 1 42 LEU HB2 1 82 PHE HA . . 5.490 3.624 3.086 4.235 . 0 0 "[ . 1 . 2]" 1
781 1 42 LEU HB2 1 83 VAL H . . 4.350 2.837 2.285 3.592 . 0 0 "[ . 1 . 2]" 1
782 1 42 LEU HB2 1 83 VAL HB . . 3.820 2.260 1.999 2.861 . 0 0 "[ . 1 . 2]" 1
783 1 42 LEU HB2 1 83 VAL QG . . 3.960 2.690 1.862 3.082 . 0 0 "[ . 1 . 2]" 1
784 1 42 LEU HB3 1 43 ASN H . . 4.460 2.993 2.784 3.830 . 0 0 "[ . 1 . 2]" 1
785 1 42 LEU HB3 1 44 LEU QD . . 4.880 3.490 2.835 3.927 . 0 0 "[ . 1 . 2]" 1
786 1 42 LEU HB3 1 81 PHE QD . . 5.420 3.422 2.923 3.780 . 0 0 "[ . 1 . 2]" 1
787 1 42 LEU HB3 1 81 PHE QE . . 4.740 2.746 2.001 3.528 . 0 0 "[ . 1 . 2]" 1
788 1 42 LEU HB3 1 82 PHE HA . . 5.500 4.039 3.512 4.982 . 0 0 "[ . 1 . 2]" 1
789 1 42 LEU HB3 1 83 VAL HB . . 4.220 3.866 3.654 4.230 0.010 6 0 "[ . 1 . 2]" 1
790 1 42 LEU HB3 1 83 VAL QG . . 3.910 3.558 2.807 3.892 . 0 0 "[ . 1 . 2]" 1
791 1 42 LEU QD 1 43 ASN H . . 3.890 3.096 2.698 3.860 . 0 0 "[ . 1 . 2]" 1
792 1 42 LEU QD 1 44 LEU QD . . 3.710 3.058 2.550 3.434 . 0 0 "[ . 1 . 2]" 1
793 1 42 LEU QD 1 81 PHE QD . . 4.490 3.935 3.624 4.251 . 0 0 "[ . 1 . 2]" 1
794 1 42 LEU QD 1 81 PHE QE . . 3.490 2.398 1.989 2.962 . 0 0 "[ . 1 . 2]" 1
795 1 42 LEU QD 1 81 PHE HZ . . 4.510 3.352 2.192 4.164 . 0 0 "[ . 1 . 2]" 1
796 1 42 LEU QD 1 83 VAL H . . 5.440 4.116 3.704 4.673 . 0 0 "[ . 1 . 2]" 1
797 1 42 LEU QD 1 83 VAL HA . . 5.350 4.718 4.295 5.278 . 0 0 "[ . 1 . 2]" 1
798 1 42 LEU QD 1 83 VAL HB . . 3.930 2.300 1.893 3.104 . 0 0 "[ . 1 . 2]" 1
799 1 42 LEU QD 1 83 VAL QG . . 2.980 2.214 1.884 2.721 . 0 0 "[ . 1 . 2]" 1
800 1 42 LEU QD 1 86 ALA HA . . 4.020 2.665 2.059 3.004 . 0 0 "[ . 1 . 2]" 1
801 1 42 LEU QD 1 86 ALA MB . . 2.750 1.970 1.713 2.310 . 0 0 "[ . 1 . 2]" 1
802 1 42 LEU QD 1 87 ALA H . . 4.620 4.273 3.637 4.661 0.041 17 0 "[ . 1 . 2]" 1
803 1 42 LEU QD 1 90 ASP QB . . 3.720 2.997 2.439 3.412 . 0 0 "[ . 1 . 2]" 1
804 1 42 LEU QD 1 111 ILE MD . . 3.240 3.002 2.697 3.226 . 0 0 "[ . 1 . 2]" 1
805 1 42 LEU MD1 1 81 PHE QE . . 4.620 2.428 2.020 3.020 . 0 0 "[ . 1 . 2]" 1
806 1 42 LEU MD1 1 86 ALA HA . . 5.310 2.685 2.063 3.030 . 0 0 "[ . 1 . 2]" 1
807 1 42 LEU MD1 1 86 ALA MB . . 3.140 2.063 1.745 2.578 . 0 0 "[ . 1 . 2]" 1
808 1 42 LEU MD1 1 111 ILE MD . . 4.210 3.316 2.961 3.670 . 0 0 "[ . 1 . 2]" 1
809 1 42 LEU MD2 1 81 PHE QE . . 4.620 3.766 2.984 4.274 . 0 0 "[ . 1 . 2]" 1
810 1 42 LEU MD2 1 86 ALA HA . . 5.310 4.611 3.866 5.203 . 0 0 "[ . 1 . 2]" 1
811 1 42 LEU MD2 1 86 ALA MB . . 3.140 2.706 2.219 3.116 . 0 0 "[ . 1 . 2]" 1
812 1 42 LEU MD2 1 111 ILE MD . . 4.210 3.478 3.038 3.934 . 0 0 "[ . 1 . 2]" 1
813 1 42 LEU HG 1 86 ALA HA . . 5.110 3.917 3.107 4.395 . 0 0 "[ . 1 . 2]" 1
814 1 42 LEU HG 1 86 ALA MB . . 3.410 2.038 1.924 2.226 . 0 0 "[ . 1 . 2]" 1
815 1 43 ASN H 1 43 ASN HB2 . . 4.020 3.404 3.165 3.956 . 0 0 "[ . 1 . 2]" 1
816 1 43 ASN H 1 43 ASN QB . . 3.510 2.703 2.417 3.074 . 0 0 "[ . 1 . 2]" 1
817 1 43 ASN H 1 43 ASN HB3 . . 4.020 2.859 2.501 3.205 . 0 0 "[ . 1 . 2]" 1
818 1 43 ASN H 1 44 LEU H . . 4.440 3.980 3.847 4.362 . 0 0 "[ . 1 . 2]" 1
819 1 43 ASN H 1 44 LEU MD1 . . 5.120 4.785 4.494 5.080 . 0 0 "[ . 1 . 2]" 1
820 1 43 ASN H 1 44 LEU QD . . 4.200 3.647 2.827 4.168 . 0 0 "[ . 1 . 2]" 1
821 1 43 ASN H 1 44 LEU MD2 . . 5.120 3.822 2.841 4.500 . 0 0 "[ . 1 . 2]" 1
822 1 43 ASN HA 1 44 LEU H . . 3.080 2.153 2.140 2.166 . 0 0 "[ . 1 . 2]" 1
823 1 43 ASN HA 1 80 VAL QG . . 4.430 3.977 3.644 4.488 0.058 18 0 "[ . 1 . 2]" 1
824 1 43 ASN HA 1 82 PHE HA . . 3.720 3.049 2.832 3.431 . 0 0 "[ . 1 . 2]" 1
825 1 43 ASN HA 1 82 PHE QD . . 4.070 3.982 3.682 4.078 0.008 6 0 "[ . 1 . 2]" 1
826 1 43 ASN HA 1 83 VAL H . . 4.910 4.749 4.559 4.912 0.002 17 0 "[ . 1 . 2]" 1
827 1 43 ASN QB 1 82 PHE QD . . 3.870 3.631 3.259 3.869 . 0 0 "[ . 1 . 2]" 1
828 1 43 ASN HB2 1 44 LEU H . . 4.610 4.273 3.526 4.532 . 0 0 "[ . 1 . 2]" 1
829 1 43 ASN HB3 1 44 LEU H . . 4.610 4.392 4.142 4.549 . 0 0 "[ . 1 . 2]" 1
830 1 43 ASN QD 1 45 VAL QG . . 3.660 2.861 1.964 3.455 . 0 0 "[ . 1 . 2]" 1
831 1 43 ASN QD 1 80 VAL QG . . 4.720 3.586 2.573 4.643 . 0 0 "[ . 1 . 2]" 1
832 1 44 LEU H 1 44 LEU HB2 . . 3.870 2.653 2.307 2.819 . 0 0 "[ . 1 . 2]" 1
833 1 44 LEU H 1 44 LEU MD1 . . 4.380 4.007 3.689 4.280 . 0 0 "[ . 1 . 2]" 1
834 1 44 LEU H 1 44 LEU QD . . 3.830 3.477 2.451 3.765 . 0 0 "[ . 1 . 2]" 1
835 1 44 LEU H 1 44 LEU MD2 . . 4.380 3.873 2.465 4.294 . 0 0 "[ . 1 . 2]" 1
836 1 44 LEU H 1 44 LEU HG . . 4.050 3.070 2.563 4.056 0.006 14 0 "[ . 1 . 2]" 1
837 1 44 LEU H 1 45 VAL H . . 4.570 4.078 3.911 4.261 . 0 0 "[ . 1 . 2]" 1
838 1 44 LEU H 1 80 VAL HA . . 4.730 4.615 4.443 4.721 . 0 0 "[ . 1 . 2]" 1
839 1 44 LEU H 1 80 VAL QG . . 4.340 3.551 2.971 4.357 0.017 18 0 "[ . 1 . 2]" 1
840 1 44 LEU H 1 81 PHE H . . 3.940 2.832 2.636 2.969 . 0 0 "[ . 1 . 2]" 1
841 1 44 LEU H 1 81 PHE HB2 . . 4.890 4.720 4.234 4.886 . 0 0 "[ . 1 . 2]" 1
842 1 44 LEU H 1 81 PHE HB3 . . 4.560 3.120 2.583 3.365 . 0 0 "[ . 1 . 2]" 1
843 1 44 LEU H 1 81 PHE QD . . 4.360 3.119 2.558 3.806 . 0 0 "[ . 1 . 2]" 1
844 1 44 LEU H 1 82 PHE HA . . 4.790 4.013 3.804 4.488 . 0 0 "[ . 1 . 2]" 1
845 1 44 LEU HA 1 44 LEU MD1 . . 4.160 3.835 2.438 3.988 . 0 0 "[ . 1 . 2]" 1
846 1 44 LEU HA 1 44 LEU QD . . 3.220 2.161 2.012 2.460 . 0 0 "[ . 1 . 2]" 1
847 1 44 LEU HA 1 44 LEU MD2 . . 4.160 2.180 2.019 2.483 . 0 0 "[ . 1 . 2]" 1
848 1 44 LEU HA 1 44 LEU HG . . 4.200 3.080 2.809 3.720 . 0 0 "[ . 1 . 2]" 1
849 1 44 LEU HA 1 45 VAL H . . 3.030 2.162 2.139 2.188 . 0 0 "[ . 1 . 2]" 1
850 1 44 LEU HA 1 45 VAL QG . . 4.280 3.793 3.488 3.914 . 0 0 "[ . 1 . 2]" 1
851 1 44 LEU HB2 1 46 VAL MG2 . . 4.510 3.827 3.405 4.201 . 0 0 "[ . 1 . 2]" 1
852 1 44 LEU HB2 1 58 TRP HH2 . . 4.850 4.271 3.249 4.737 . 0 0 "[ . 1 . 2]" 1
853 1 44 LEU HB2 1 81 PHE H . . 4.360 3.410 3.156 3.876 . 0 0 "[ . 1 . 2]" 1
854 1 44 LEU HB2 1 81 PHE HB2 . . 4.300 3.640 3.449 3.834 . 0 0 "[ . 1 . 2]" 1
855 1 44 LEU HB2 1 81 PHE HB3 . . 4.110 2.050 1.993 2.248 . 0 0 "[ . 1 . 2]" 1
856 1 44 LEU HB2 1 109 ILE MD . . 5.500 4.726 4.138 5.109 . 0 0 "[ . 1 . 2]" 1
857 1 44 LEU HB3 1 44 LEU MD1 . . 3.510 2.406 2.089 2.648 . 0 0 "[ . 1 . 2]" 1
858 1 44 LEU HB3 1 44 LEU QD . . 3.070 2.073 2.008 2.138 . 0 0 "[ . 1 . 2]" 1
859 1 44 LEU HB3 1 44 LEU MD2 . . 3.510 2.309 2.134 3.170 . 0 0 "[ . 1 . 2]" 1
860 1 44 LEU HB3 1 45 VAL H . . 4.160 3.689 3.372 3.861 . 0 0 "[ . 1 . 2]" 1
861 1 44 LEU HB3 1 46 VAL MG1 . . 5.500 5.450 5.221 5.512 0.012 18 0 "[ . 1 . 2]" 1
862 1 44 LEU HB3 1 46 VAL MG2 . . 3.990 2.955 2.581 3.149 . 0 0 "[ . 1 . 2]" 1
863 1 44 LEU HB3 1 81 PHE HB2 . . 5.350 5.028 4.562 5.343 . 0 0 "[ . 1 . 2]" 1
864 1 44 LEU HB3 1 81 PHE HB3 . . 4.400 3.631 3.345 3.944 . 0 0 "[ . 1 . 2]" 1
865 1 44 LEU QD 1 45 VAL H . . 4.040 3.721 3.480 3.961 . 0 0 "[ . 1 . 2]" 1
866 1 44 LEU QD 1 46 VAL MG2 . . 4.410 3.484 2.779 3.702 . 0 0 "[ . 1 . 2]" 1
867 1 44 LEU QD 1 58 TRP HH2 . . 3.860 3.752 3.336 3.864 0.004 18 0 "[ . 1 . 2]" 1
868 1 44 LEU QD 1 58 TRP HZ2 . . 5.440 5.129 4.603 5.370 . 0 0 "[ . 1 . 2]" 1
869 1 44 LEU QD 1 58 TRP HZ3 . . 4.810 4.102 3.460 4.466 . 0 0 "[ . 1 . 2]" 1
870 1 44 LEU QD 1 81 PHE HB3 . . 3.940 3.073 2.203 3.587 . 0 0 "[ . 1 . 2]" 1
871 1 44 LEU QD 1 81 PHE QD . . 3.610 2.407 1.940 2.937 . 0 0 "[ . 1 . 2]" 1
872 1 44 LEU QD 1 81 PHE QE . . 3.960 3.033 2.511 3.642 . 0 0 "[ . 1 . 2]" 1
873 1 44 LEU QD 1 109 ILE MD . . 3.700 3.190 2.621 3.538 . 0 0 "[ . 1 . 2]" 1
874 1 44 LEU QD 1 109 ILE MG . . 2.970 2.648 1.760 2.955 . 0 0 "[ . 1 . 2]" 1
875 1 44 LEU QD 1 111 ILE MD . . 3.080 2.040 1.738 2.530 . 0 0 "[ . 1 . 2]" 1
876 1 44 LEU QD 1 111 ILE HG12 . . 3.820 2.724 2.036 3.106 . 0 0 "[ . 1 . 2]" 1
877 1 44 LEU MD1 1 81 PHE QD . . 4.740 2.522 1.944 4.541 . 0 0 "[ . 1 . 2]" 1
878 1 44 LEU MD1 1 109 ILE MD . . 4.560 3.320 2.640 3.768 . 0 0 "[ . 1 . 2]" 1
879 1 44 LEU MD1 1 109 ILE MG . . 3.490 2.805 1.765 3.291 . 0 0 "[ . 1 . 2]" 1
880 1 44 LEU MD2 1 81 PHE QD . . 4.740 4.138 2.559 4.664 . 0 0 "[ . 1 . 2]" 1
881 1 44 LEU MD2 1 109 ILE MD . . 4.560 4.226 3.869 4.468 . 0 0 "[ . 1 . 2]" 1
882 1 44 LEU MD2 1 109 ILE MG . . 3.490 3.356 2.852 3.491 0.001 14 0 "[ . 1 . 2]" 1
883 1 44 LEU HG 1 81 PHE HB3 . . 4.720 3.914 3.157 4.335 . 0 0 "[ . 1 . 2]" 1
884 1 44 LEU HG 1 81 PHE QD . . 4.520 2.799 2.271 3.321 . 0 0 "[ . 1 . 2]" 1
885 1 45 VAL H 1 45 VAL HB . . 3.500 2.618 2.497 3.085 . 0 0 "[ . 1 . 2]" 1
886 1 45 VAL H 1 45 VAL MG1 . . 4.010 3.444 1.840 3.847 . 0 0 "[ . 1 . 2]" 1
887 1 45 VAL H 1 45 VAL QG . . 3.310 2.490 1.835 2.774 . 0 0 "[ . 1 . 2]" 1
888 1 45 VAL H 1 45 VAL MG2 . . 4.010 2.899 2.513 3.846 . 0 0 "[ . 1 . 2]" 1
889 1 45 VAL H 1 46 VAL MG2 . . 4.610 3.909 3.730 4.194 . 0 0 "[ . 1 . 2]" 1
890 1 45 VAL HA 1 45 VAL MG1 . . 3.280 2.545 2.310 3.193 . 0 0 "[ . 1 . 2]" 1
891 1 45 VAL HA 1 45 VAL QG . . 2.870 2.126 2.041 2.402 . 0 0 "[ . 1 . 2]" 1
892 1 45 VAL HA 1 45 VAL MG2 . . 3.280 2.318 2.231 2.486 . 0 0 "[ . 1 . 2]" 1
893 1 45 VAL HA 1 46 VAL H . . 3.170 2.212 2.150 2.249 . 0 0 "[ . 1 . 2]" 1
894 1 45 VAL HA 1 46 VAL HB . . 5.150 4.924 4.834 5.028 . 0 0 "[ . 1 . 2]" 1
895 1 45 VAL HA 1 80 VAL HA . . 3.740 2.591 1.951 3.237 . 0 0 "[ . 1 . 2]" 1
896 1 45 VAL HA 1 80 VAL MG1 . . 4.490 3.471 2.711 3.875 . 0 0 "[ . 1 . 2]" 1
897 1 45 VAL HA 1 80 VAL QG . . 3.440 2.941 2.325 3.274 . 0 0 "[ . 1 . 2]" 1
898 1 45 VAL HA 1 80 VAL MG2 . . 4.490 3.222 2.465 4.471 . 0 0 "[ . 1 . 2]" 1
899 1 45 VAL HA 1 81 PHE H . . 4.440 3.672 3.264 4.245 . 0 0 "[ . 1 . 2]" 1
900 1 45 VAL QG 1 46 VAL H . . 3.450 3.124 2.975 3.259 . 0 0 "[ . 1 . 2]" 1
901 1 45 VAL QG 1 47 PRO HD2 . . 4.710 4.119 3.818 4.256 . 0 0 "[ . 1 . 2]" 1
902 1 45 VAL QG 1 47 PRO HD3 . . 4.500 2.766 2.502 2.921 . 0 0 "[ . 1 . 2]" 1
903 1 45 VAL QG 1 78 ASP QB . . 3.660 3.127 2.773 3.633 . 0 0 "[ . 1 . 2]" 1
904 1 45 VAL QG 1 80 VAL HA . . 4.150 3.144 2.447 3.685 . 0 0 "[ . 1 . 2]" 1
905 1 45 VAL QG 1 81 PHE H . . 4.330 3.919 3.205 4.453 0.123 18 0 "[ . 1 . 2]" 1
906 1 45 VAL MG1 1 46 VAL H . . 4.310 3.416 3.134 4.279 . 0 0 "[ . 1 . 2]" 1
907 1 45 VAL MG1 1 80 VAL HA . . 5.210 4.138 3.526 4.904 . 0 0 "[ . 1 . 2]" 1
908 1 45 VAL MG2 1 46 VAL H . . 4.310 4.007 3.066 4.269 . 0 0 "[ . 1 . 2]" 1
909 1 45 VAL MG2 1 80 VAL HA . . 5.210 3.283 2.496 3.874 . 0 0 "[ . 1 . 2]" 1
910 1 46 VAL H 1 46 VAL HB . . 3.730 2.718 2.634 2.838 . 0 0 "[ . 1 . 2]" 1
911 1 46 VAL H 1 46 VAL MG1 . . 4.340 3.848 3.832 3.882 . 0 0 "[ . 1 . 2]" 1
912 1 46 VAL H 1 46 VAL MG2 . . 3.630 2.316 2.032 2.553 . 0 0 "[ . 1 . 2]" 1
913 1 46 VAL H 1 58 TRP HZ2 . . 4.720 4.024 3.371 4.625 . 0 0 "[ . 1 . 2]" 1
914 1 46 VAL H 1 79 THR H . . 4.340 4.206 3.931 4.344 0.004 2 0 "[ . 1 . 2]" 1
915 1 46 VAL H 1 79 THR MG . . 4.190 2.797 2.281 3.327 . 0 0 "[ . 1 . 2]" 1
916 1 46 VAL H 1 80 VAL HA . . 4.410 3.597 3.106 3.953 . 0 0 "[ . 1 . 2]" 1
917 1 46 VAL H 1 80 VAL QG . . 4.640 4.125 3.628 4.495 . 0 0 "[ . 1 . 2]" 1
918 1 46 VAL H 1 81 PHE H . . 4.890 4.645 4.305 4.881 . 0 0 "[ . 1 . 2]" 1
919 1 46 VAL HA 1 46 VAL MG1 . . 3.410 2.219 2.091 2.380 . 0 0 "[ . 1 . 2]" 1
920 1 46 VAL HA 1 46 VAL MG2 . . 3.410 2.490 2.377 2.615 . 0 0 "[ . 1 . 2]" 1
921 1 46 VAL HA 1 47 PRO HD2 . . 3.500 1.912 1.911 1.913 . 0 0 "[ . 1 . 2]" 1
922 1 46 VAL HA 1 47 PRO HD3 . . 3.420 2.497 2.478 2.500 . 0 0 "[ . 1 . 2]" 1
923 1 46 VAL HA 1 47 PRO QG . . 4.790 3.772 3.770 3.773 . 0 0 "[ . 1 . 2]" 1
924 1 46 VAL HA 1 79 THR MG . . 4.880 4.401 4.175 4.692 . 0 0 "[ . 1 . 2]" 1
925 1 46 VAL HB 1 58 TRP HZ2 . . 4.680 3.419 2.778 4.193 . 0 0 "[ . 1 . 2]" 1
926 1 46 VAL HB 1 79 THR H . . 4.870 4.478 4.206 4.699 . 0 0 "[ . 1 . 2]" 1
927 1 46 VAL HB 1 79 THR MG . . 3.270 2.541 2.269 2.833 . 0 0 "[ . 1 . 2]" 1
928 1 46 VAL HB 1 96 LEU MD1 . . 4.700 3.596 2.049 4.559 . 0 0 "[ . 1 . 2]" 1
929 1 46 VAL HB 1 96 LEU QD . . 3.910 2.562 2.045 3.582 . 0 0 "[ . 1 . 2]" 1
930 1 46 VAL HB 1 96 LEU MD2 . . 4.700 3.282 2.161 4.677 . 0 0 "[ . 1 . 2]" 1
931 1 46 VAL MG1 1 47 PRO HD2 . . 4.030 2.734 2.614 2.894 . 0 0 "[ . 1 . 2]" 1
932 1 46 VAL MG1 1 47 PRO HD3 . . 4.090 3.977 3.896 4.061 . 0 0 "[ . 1 . 2]" 1
933 1 46 VAL MG1 1 47 PRO QG . . 4.290 3.879 3.757 3.975 . 0 0 "[ . 1 . 2]" 1
934 1 46 VAL MG1 1 48 PHE QD . . 4.570 4.345 3.816 4.570 . 0 0 "[ . 1 . 2]" 1
935 1 46 VAL MG1 1 79 THR H . . 5.500 5.140 4.829 5.365 . 0 0 "[ . 1 . 2]" 1
936 1 46 VAL MG1 1 79 THR MG . . 3.800 3.586 3.242 3.825 0.025 18 0 "[ . 1 . 2]" 1
937 1 46 VAL MG1 1 96 LEU MD1 . . 4.470 3.543 1.808 4.440 . 0 0 "[ . 1 . 2]" 1
938 1 46 VAL MG1 1 96 LEU QD . . 3.060 2.279 1.805 3.061 0.001 20 0 "[ . 1 . 2]" 1
939 1 46 VAL MG1 1 96 LEU MD2 . . 4.470 2.894 1.851 4.421 . 0 0 "[ . 1 . 2]" 1
940 1 46 VAL MG1 1 107 ALA MB . . 4.170 3.919 3.669 4.154 . 0 0 "[ . 1 . 2]" 1
941 1 46 VAL MG2 1 47 PRO HD2 . . 5.090 4.019 3.910 4.148 . 0 0 "[ . 1 . 2]" 1
942 1 46 VAL MG2 1 47 PRO HD3 . . 4.600 4.501 4.433 4.586 . 0 0 "[ . 1 . 2]" 1
943 1 46 VAL MG2 1 58 TRP HH2 . . 3.670 2.496 1.964 3.149 . 0 0 "[ . 1 . 2]" 1
944 1 46 VAL MG2 1 58 TRP HZ2 . . 4.010 3.061 2.386 3.705 . 0 0 "[ . 1 . 2]" 1
945 1 46 VAL MG2 1 79 THR H . . 5.500 5.380 5.142 5.522 0.022 18 0 "[ . 1 . 2]" 1
946 1 46 VAL MG2 1 79 THR MG . . 3.850 3.275 2.883 3.746 . 0 0 "[ . 1 . 2]" 1
947 1 46 VAL MG2 1 96 LEU QD . . 3.690 2.948 2.438 3.688 . 0 0 "[ . 1 . 2]" 1
948 1 47 PRO HA 1 48 PHE H . . 3.050 2.236 2.176 2.348 . 0 0 "[ . 1 . 2]" 1
949 1 47 PRO HA 1 78 ASP HA . . 3.610 3.020 2.637 3.145 . 0 0 "[ . 1 . 2]" 1
950 1 47 PRO HA 1 78 ASP HB2 . . 4.080 2.166 2.003 2.543 . 0 0 "[ . 1 . 2]" 1
951 1 47 PRO HA 1 78 ASP HB3 . . 4.080 2.262 1.999 3.653 . 0 0 "[ . 1 . 2]" 1
952 1 47 PRO HA 1 79 THR H . . 4.180 3.379 3.117 3.528 . 0 0 "[ . 1 . 2]" 1
953 1 47 PRO QB 1 78 ASP QB . . 4.220 2.738 2.501 3.007 . 0 0 "[ . 1 . 2]" 1
954 1 47 PRO HB2 1 48 PHE H . . 3.870 3.118 2.751 3.357 . 0 0 "[ . 1 . 2]" 1
955 1 47 PRO HB2 1 78 ASP HA . . 5.330 5.250 4.867 5.337 0.007 18 0 "[ . 1 . 2]" 1
956 1 47 PRO HB3 1 48 PHE H . . 3.870 3.738 3.525 3.883 0.013 14 0 "[ . 1 . 2]" 1
957 1 47 PRO HB3 1 78 ASP HA . . 5.330 4.900 4.380 5.099 . 0 0 "[ . 1 . 2]" 1
958 1 48 PHE H 1 48 PHE QD . . 3.950 3.225 2.947 3.480 . 0 0 "[ . 1 . 2]" 1
959 1 48 PHE H 1 49 GLN H . . 4.520 4.386 4.284 4.471 . 0 0 "[ . 1 . 2]" 1
960 1 48 PHE H 1 78 ASP HA . . 3.580 2.864 2.501 3.262 . 0 0 "[ . 1 . 2]" 1
961 1 48 PHE H 1 78 ASP HB2 . . 4.390 3.728 2.771 4.348 . 0 0 "[ . 1 . 2]" 1
962 1 48 PHE H 1 78 ASP QB . . 3.740 2.912 2.578 3.506 . 0 0 "[ . 1 . 2]" 1
963 1 48 PHE H 1 78 ASP HB3 . . 4.390 3.115 2.672 4.386 . 0 0 "[ . 1 . 2]" 1
964 1 48 PHE H 1 79 THR H . . 4.710 4.230 3.772 4.652 . 0 0 "[ . 1 . 2]" 1
965 1 48 PHE HA 1 48 PHE QD . . 4.430 3.705 3.662 3.726 . 0 0 "[ . 1 . 2]" 1
966 1 48 PHE HA 1 49 GLN H . . 3.210 2.308 2.209 2.457 . 0 0 "[ . 1 . 2]" 1
967 1 48 PHE QB 1 49 GLN H . . 3.510 2.645 2.287 2.915 . 0 0 "[ . 1 . 2]" 1
968 1 48 PHE QB 1 98 VAL MG1 . . 4.520 3.666 3.200 4.329 . 0 0 "[ . 1 . 2]" 1
969 1 48 PHE HB2 1 49 GLN H . . 4.160 2.695 2.311 2.993 . 0 0 "[ . 1 . 2]" 1
970 1 48 PHE HB2 1 98 VAL MG2 . . 4.490 2.867 2.507 3.356 . 0 0 "[ . 1 . 2]" 1
971 1 48 PHE HB3 1 49 GLN H . . 4.160 3.878 3.623 4.073 . 0 0 "[ . 1 . 2]" 1
972 1 48 PHE HB3 1 98 VAL MG2 . . 4.490 3.319 2.882 3.970 . 0 0 "[ . 1 . 2]" 1
973 1 48 PHE QD 1 49 GLN H . . 4.210 3.533 3.139 3.972 . 0 0 "[ . 1 . 2]" 1
974 1 48 PHE QD 1 54 PRO HG2 . . 4.750 2.983 2.225 3.583 . 0 0 "[ . 1 . 2]" 1
975 1 48 PHE QD 1 54 PRO HG3 . . 4.620 2.927 2.233 3.371 . 0 0 "[ . 1 . 2]" 1
976 1 48 PHE QD 1 56 VAL MG2 . . 4.640 3.220 2.506 3.873 . 0 0 "[ . 1 . 2]" 1
977 1 48 PHE QD 1 78 ASP HA . . 4.320 3.207 2.840 3.770 . 0 0 "[ . 1 . 2]" 1
978 1 48 PHE QD 1 79 THR H . . 4.460 2.913 2.633 3.912 . 0 0 "[ . 1 . 2]" 1
979 1 48 PHE QD 1 79 THR MG . . 3.800 2.460 1.967 3.044 . 0 0 "[ . 1 . 2]" 1
980 1 48 PHE QD 1 98 VAL MG1 . . 4.080 3.993 3.711 4.084 0.004 2 0 "[ . 1 . 2]" 1
981 1 48 PHE QD 1 98 VAL MG2 . . 4.310 3.665 3.291 3.946 . 0 0 "[ . 1 . 2]" 1
982 1 48 PHE QE 1 54 PRO HD2 . . 4.600 3.536 2.861 4.024 . 0 0 "[ . 1 . 2]" 1
983 1 48 PHE QE 1 54 PRO HD3 . . 4.820 4.588 4.014 4.823 0.003 13 0 "[ . 1 . 2]" 1
984 1 48 PHE QE 1 54 PRO HG2 . . 4.790 2.123 1.996 2.373 . 0 0 "[ . 1 . 2]" 1
985 1 48 PHE QE 1 54 PRO HG3 . . 4.100 3.181 2.418 3.651 . 0 0 "[ . 1 . 2]" 1
986 1 48 PHE QE 1 56 VAL MG1 . . 4.630 3.546 2.969 4.111 . 0 0 "[ . 1 . 2]" 1
987 1 48 PHE QE 1 56 VAL MG2 . . 4.020 2.413 1.973 2.826 . 0 0 "[ . 1 . 2]" 1
988 1 48 PHE QE 1 74 THR MG . . 3.720 3.014 2.594 3.435 . 0 0 "[ . 1 . 2]" 1
989 1 48 PHE QE 1 77 PHE HA . . 4.950 4.238 3.000 4.854 . 0 0 "[ . 1 . 2]" 1
990 1 48 PHE QE 1 78 ASP H . . 4.590 4.380 3.807 4.583 . 0 0 "[ . 1 . 2]" 1
991 1 48 PHE QE 1 78 ASP HA . . 4.830 2.836 2.564 3.471 . 0 0 "[ . 1 . 2]" 1
992 1 48 PHE QE 1 79 THR HB . . 4.150 2.100 2.000 2.323 . 0 0 "[ . 1 . 2]" 1
993 1 48 PHE QE 1 79 THR MG . . 3.950 2.792 2.349 3.342 . 0 0 "[ . 1 . 2]" 1
994 1 48 PHE HZ 1 56 VAL MG2 . . 4.280 2.762 2.296 3.421 . 0 0 "[ . 1 . 2]" 1
995 1 48 PHE HZ 1 74 THR MG . . 3.830 3.121 2.770 3.637 . 0 0 "[ . 1 . 2]" 1
996 1 49 GLN H 1 49 GLN HB2 . . 3.880 2.589 2.398 2.821 . 0 0 "[ . 1 . 2]" 1
997 1 49 GLN H 1 49 GLN HB3 . . 4.150 3.733 3.629 3.859 . 0 0 "[ . 1 . 2]" 1
998 1 49 GLN H 1 49 GLN HG2 . . 4.330 3.303 2.861 4.312 . 0 0 "[ . 1 . 2]" 1
999 1 49 GLN H 1 49 GLN HG3 . . 4.330 3.707 2.611 4.298 . 0 0 "[ . 1 . 2]" 1
1000 1 49 GLN H 1 50 GLY H . . 4.750 4.496 4.437 4.541 . 0 0 "[ . 1 . 2]" 1
1001 1 49 GLN HA 1 49 GLN QG . . 3.680 2.665 2.304 2.970 . 0 0 "[ . 1 . 2]" 1
1002 1 49 GLN HA 1 50 GLY H . . 3.040 2.394 2.299 2.527 . 0 0 "[ . 1 . 2]" 1
1003 1 49 GLN HB2 1 50 GLY H . . 3.860 3.649 3.186 3.853 . 0 0 "[ . 1 . 2]" 1
1004 1 49 GLN HB2 1 50 GLY HA2 . . 5.500 4.643 4.278 4.912 . 0 0 "[ . 1 . 2]" 1
1005 1 49 GLN HB2 1 50 GLY HA3 . . 5.500 4.958 4.640 5.157 . 0 0 "[ . 1 . 2]" 1
1006 1 49 GLN HB3 1 50 GLY H . . 3.730 2.488 2.195 2.734 . 0 0 "[ . 1 . 2]" 1
1007 1 49 GLN QG 1 50 GLY H . . 4.370 4.150 3.771 4.371 0.001 4 0 "[ . 1 . 2]" 1
1008 1 49 GLN HG2 1 50 GLY H . . 5.150 4.601 4.266 4.932 . 0 0 "[ . 1 . 2]" 1
1009 1 49 GLN HG3 1 50 GLY H . . 5.150 4.786 4.000 5.128 . 0 0 "[ . 1 . 2]" 1
1010 1 50 GLY HA2 1 51 LYS H . . 3.260 2.351 2.242 2.455 . 0 0 "[ . 1 . 2]" 1
1011 1 50 GLY HA2 1 51 LYS HA . . 4.900 4.496 4.444 4.551 . 0 0 "[ . 1 . 2]" 1
1012 1 50 GLY HA2 1 100 ILE MD . . 4.240 4.038 3.677 4.245 0.005 2 0 "[ . 1 . 2]" 1
1013 1 50 GLY HA3 1 51 LYS H . . 3.520 2.803 2.676 2.953 . 0 0 "[ . 1 . 2]" 1
1014 1 50 GLY HA3 1 100 ILE MD . . 3.530 3.050 2.802 3.301 . 0 0 "[ . 1 . 2]" 1
1015 1 51 LYS H 1 51 LYS QB . . 3.690 2.727 2.606 2.839 . 0 0 "[ . 1 . 2]" 1
1016 1 51 LYS H 1 51 LYS QG . . 4.610 3.707 3.293 4.057 . 0 0 "[ . 1 . 2]" 1
1017 1 51 LYS H 1 100 ILE MD . . 3.560 3.515 3.343 3.570 0.010 18 0 "[ . 1 . 2]" 1
1018 1 51 LYS HA 1 51 LYS HD2 . . 4.520 3.944 3.032 4.538 0.018 10 0 "[ . 1 . 2]" 1
1019 1 51 LYS HA 1 51 LYS QD . . 3.920 3.433 1.971 3.928 0.008 18 0 "[ . 1 . 2]" 1
1020 1 51 LYS HA 1 51 LYS HD3 . . 4.520 3.947 1.997 4.524 0.004 13 0 "[ . 1 . 2]" 1
1021 1 51 LYS HA 1 51 LYS HG2 . . 4.190 2.631 2.180 3.506 . 0 0 "[ . 1 . 2]" 1
1022 1 51 LYS HA 1 51 LYS QG . . 3.620 2.278 2.139 2.879 . 0 0 "[ . 1 . 2]" 1
1023 1 51 LYS HA 1 51 LYS HG3 . . 4.190 2.879 2.163 3.736 . 0 0 "[ . 1 . 2]" 1
1024 1 51 LYS HA 1 52 PRO HA . . 3.030 2.470 2.372 2.500 . 0 0 "[ . 1 . 2]" 1
1025 1 51 LYS HA 1 52 PRO HB3 . . 4.550 4.561 4.480 4.586 0.036 2 0 "[ . 1 . 2]" 1
1026 1 51 LYS HA 1 52 PRO QD . . 4.450 4.027 4.016 4.031 . 0 0 "[ . 1 . 2]" 1
1027 1 51 LYS HA 1 53 ARG H . . 3.860 3.499 3.397 3.556 . 0 0 "[ . 1 . 2]" 1
1028 1 51 LYS HA 1 54 PRO HD3 . . 4.440 2.592 2.332 3.059 . 0 0 "[ . 1 . 2]" 1
1029 1 51 LYS HA 1 100 ILE MD . . 4.900 4.708 4.533 4.867 . 0 0 "[ . 1 . 2]" 1
1030 1 51 LYS QB 1 51 LYS QD . . 3.190 2.154 2.027 2.330 . 0 0 "[ . 1 . 2]" 1
1031 1 51 LYS QB 1 51 LYS QE . . 4.030 3.102 2.065 3.854 . 0 0 "[ . 1 . 2]" 1
1032 1 51 LYS QB 1 52 PRO HA . . 3.300 1.980 1.961 1.999 . 0 0 "[ . 1 . 2]" 1
1033 1 51 LYS HB2 1 52 PRO HA . . 3.920 3.561 3.538 3.594 . 0 0 "[ . 1 . 2]" 1
1034 1 51 LYS HB3 1 52 PRO HA . . 3.920 1.989 1.971 2.009 . 0 0 "[ . 1 . 2]" 1
1035 1 51 LYS QD 1 52 PRO HA . . 4.240 3.223 2.271 4.272 0.032 7 0 "[ . 1 . 2]" 1
1036 1 51 LYS QE 1 51 LYS HG2 . . 3.550 2.749 2.075 3.500 . 0 0 "[ . 1 . 2]" 1
1037 1 51 LYS QE 1 51 LYS QG . . 3.010 2.248 2.052 2.773 . 0 0 "[ . 1 . 2]" 1
1038 1 51 LYS QE 1 51 LYS HG3 . . 3.550 2.578 2.117 3.407 . 0 0 "[ . 1 . 2]" 1
1039 1 51 LYS QG 1 52 PRO HA . . 4.180 2.664 2.275 3.723 . 0 0 "[ . 1 . 2]" 1
1040 1 51 LYS HG2 1 52 PRO HA . . 4.760 2.860 2.309 4.339 . 0 0 "[ . 1 . 2]" 1
1041 1 51 LYS HG3 1 52 PRO HA . . 4.760 3.662 2.598 4.081 . 0 0 "[ . 1 . 2]" 1
1042 1 52 PRO HB2 1 53 ARG H . . 3.300 2.928 2.867 3.045 . 0 0 "[ . 1 . 2]" 1
1043 1 52 PRO HB3 1 53 ARG H . . 3.970 3.907 3.871 3.973 0.003 20 0 "[ . 1 . 2]" 1
1044 1 52 PRO QD 1 53 ARG H . . 4.810 2.689 2.646 2.714 . 0 0 "[ . 1 . 2]" 1
1045 1 52 PRO QD 1 100 ILE MD . . 4.860 4.491 4.366 4.725 . 0 0 "[ . 1 . 2]" 1
1046 1 52 PRO QG 1 53 ARG H . . 3.280 1.937 1.886 2.039 . 0 0 "[ . 1 . 2]" 1
1047 1 53 ARG H 1 53 ARG HB2 . . 3.820 2.876 2.577 3.223 . 0 0 "[ . 1 . 2]" 1
1048 1 53 ARG H 1 53 ARG QB . . 3.300 2.593 2.527 2.697 . 0 0 "[ . 1 . 2]" 1
1049 1 53 ARG H 1 53 ARG HB3 . . 3.820 3.127 2.709 3.685 . 0 0 "[ . 1 . 2]" 1
1050 1 53 ARG H 1 53 ARG QG . . 4.400 4.013 3.463 4.281 . 0 0 "[ . 1 . 2]" 1
1051 1 53 ARG H 1 54 PRO HD2 . . 4.570 4.421 4.339 4.512 . 0 0 "[ . 1 . 2]" 1
1052 1 53 ARG H 1 54 PRO HD3 . . 4.110 3.856 3.724 4.009 . 0 0 "[ . 1 . 2]" 1
1053 1 53 ARG HA 1 53 ARG HD2 . . 4.810 4.164 3.243 4.760 . 0 0 "[ . 1 . 2]" 1
1054 1 53 ARG HA 1 53 ARG QD . . 4.180 3.674 2.934 4.053 . 0 0 "[ . 1 . 2]" 1
1055 1 53 ARG HA 1 53 ARG HD3 . . 4.810 4.222 3.015 4.723 . 0 0 "[ . 1 . 2]" 1
1056 1 53 ARG HA 1 53 ARG QG . . 3.410 2.288 2.168 2.420 . 0 0 "[ . 1 . 2]" 1
1057 1 53 ARG HA 1 54 PRO HD2 . . 3.200 1.919 1.913 1.932 . 0 0 "[ . 1 . 2]" 1
1058 1 53 ARG HA 1 54 PRO HD3 . . 3.250 2.545 2.439 2.625 . 0 0 "[ . 1 . 2]" 1
1059 1 53 ARG HA 1 54 PRO HG2 . . 4.560 4.118 4.116 4.125 . 0 0 "[ . 1 . 2]" 1
1060 1 53 ARG QB 1 53 ARG QD . . 3.220 2.213 2.065 2.528 . 0 0 "[ . 1 . 2]" 1
1061 1 53 ARG QG 1 54 PRO HD2 . . 4.070 3.229 2.744 3.648 . 0 0 "[ . 1 . 2]" 1
1062 1 53 ARG QG 1 54 PRO HD3 . . 4.590 4.372 4.126 4.483 . 0 0 "[ . 1 . 2]" 1
1063 1 53 ARG QG 1 76 ASP HA . . 4.030 3.704 2.730 4.035 0.005 7 0 "[ . 1 . 2]" 1
1064 1 54 PRO HA 1 55 GLN H . . 3.070 2.171 2.151 2.286 . 0 0 "[ . 1 . 2]" 1
1065 1 54 PRO HA 1 98 VAL MG1 . . 4.530 3.296 3.146 3.504 . 0 0 "[ . 1 . 2]" 1
1066 1 54 PRO HA 1 100 ILE HA . . 4.210 3.557 3.427 4.153 . 0 0 "[ . 1 . 2]" 1
1067 1 54 PRO HA 1 100 ILE HB . . 5.500 5.481 5.026 5.518 0.018 13 0 "[ . 1 . 2]" 1
1068 1 54 PRO HA 1 100 ILE MD . . 3.280 1.867 1.779 2.586 . 0 0 "[ . 1 . 2]" 1
1069 1 54 PRO HA 1 100 ILE QG . . 3.790 3.652 2.145 3.808 0.018 2 0 "[ . 1 . 2]" 1
1070 1 54 PRO HB2 1 55 GLN H . . 4.220 3.504 2.931 3.696 . 0 0 "[ . 1 . 2]" 1
1071 1 54 PRO HB2 1 56 VAL MG2 . . 4.360 3.920 3.657 4.133 . 0 0 "[ . 1 . 2]" 1
1072 1 54 PRO HB2 1 98 VAL HA . . 5.060 4.836 4.584 5.062 0.002 3 0 "[ . 1 . 2]" 1
1073 1 54 PRO HB2 1 98 VAL MG1 . . 3.640 2.044 1.905 2.181 . 0 0 "[ . 1 . 2]" 1
1074 1 54 PRO HB2 1 98 VAL MG2 . . 4.480 3.593 3.179 3.893 . 0 0 "[ . 1 . 2]" 1
1075 1 54 PRO HB2 1 100 ILE MD . . 3.700 2.626 2.394 2.988 . 0 0 "[ . 1 . 2]" 1
1076 1 54 PRO HB2 1 100 ILE HG12 . . 5.480 4.627 4.053 4.765 . 0 0 "[ . 1 . 2]" 1
1077 1 54 PRO HB2 1 100 ILE HG13 . . 5.480 5.078 3.535 5.386 . 0 0 "[ . 1 . 2]" 1
1078 1 54 PRO HB3 1 55 GLN H . . 4.090 3.986 3.625 4.113 0.023 14 0 "[ . 1 . 2]" 1
1079 1 54 PRO HB3 1 98 VAL MG1 . . 3.540 2.766 2.534 2.966 . 0 0 "[ . 1 . 2]" 1
1080 1 54 PRO HB3 1 98 VAL MG2 . . 5.020 4.689 4.386 4.963 . 0 0 "[ . 1 . 2]" 1
1081 1 54 PRO HB3 1 100 ILE MD . . 4.490 1.866 1.783 1.940 . 0 0 "[ . 1 . 2]" 1
1082 1 54 PRO HD3 1 100 ILE MD . . 4.050 3.751 3.647 3.918 . 0 0 "[ . 1 . 2]" 1
1083 1 54 PRO HG2 1 56 VAL MG2 . . 4.190 4.047 3.774 4.191 0.001 5 0 "[ . 1 . 2]" 1
1084 1 54 PRO HG2 1 98 VAL MG1 . . 4.370 3.846 3.512 4.074 . 0 0 "[ . 1 . 2]" 1
1085 1 54 PRO HG2 1 100 ILE MD . . 4.580 4.216 4.075 4.452 . 0 0 "[ . 1 . 2]" 1
1086 1 54 PRO HG3 1 56 VAL MG2 . . 5.500 5.293 5.065 5.449 . 0 0 "[ . 1 . 2]" 1
1087 1 54 PRO HG3 1 98 VAL MG1 . . 4.140 3.945 3.746 4.119 . 0 0 "[ . 1 . 2]" 1
1088 1 54 PRO HG3 1 98 VAL MG2 . . 5.500 5.185 4.897 5.459 . 0 0 "[ . 1 . 2]" 1
1089 1 54 PRO HG3 1 100 ILE MD . . 4.130 3.760 3.650 3.887 . 0 0 "[ . 1 . 2]" 1
1090 1 55 GLN H 1 55 GLN QB . . 3.270 2.253 2.172 2.363 . 0 0 "[ . 1 . 2]" 1
1091 1 55 GLN H 1 55 GLN HG2 . . 4.900 4.605 4.424 4.686 . 0 0 "[ . 1 . 2]" 1
1092 1 55 GLN H 1 55 GLN QG . . 4.210 4.011 3.882 4.100 . 0 0 "[ . 1 . 2]" 1
1093 1 55 GLN H 1 55 GLN HG3 . . 4.900 4.417 4.200 4.528 . 0 0 "[ . 1 . 2]" 1
1094 1 55 GLN H 1 100 ILE HA . . 4.630 3.490 3.169 3.768 . 0 0 "[ . 1 . 2]" 1
1095 1 55 GLN H 1 100 ILE MD . . 3.920 2.887 2.524 3.923 0.003 17 0 "[ . 1 . 2]" 1
1096 1 55 GLN H 1 100 ILE QG . . 4.440 3.945 2.653 4.281 . 0 0 "[ . 1 . 2]" 1
1097 1 55 GLN HA 1 55 GLN HG2 . . 3.880 3.396 2.810 3.817 . 0 0 "[ . 1 . 2]" 1
1098 1 55 GLN HA 1 55 GLN HG3 . . 3.880 2.587 2.250 2.966 . 0 0 "[ . 1 . 2]" 1
1099 1 55 GLN HA 1 56 VAL H . . 2.920 2.253 2.155 2.403 . 0 0 "[ . 1 . 2]" 1
1100 1 55 GLN HA 1 56 VAL HB . . 4.950 4.567 4.430 4.644 . 0 0 "[ . 1 . 2]" 1
1101 1 55 GLN HA 1 56 VAL MG2 . . 3.800 3.540 3.211 3.729 . 0 0 "[ . 1 . 2]" 1
1102 1 55 GLN QB 1 56 VAL H . . 3.840 3.459 3.094 3.689 . 0 0 "[ . 1 . 2]" 1
1103 1 55 GLN QB 1 57 VAL QG . . 4.030 3.661 3.337 3.925 . 0 0 "[ . 1 . 2]" 1
1104 1 55 GLN QG 1 57 VAL QG . . 3.270 2.983 2.665 3.266 . 0 0 "[ . 1 . 2]" 1
1105 1 55 GLN HG2 1 56 VAL H . . 4.400 3.340 2.008 4.377 . 0 0 "[ . 1 . 2]" 1
1106 1 55 GLN HG3 1 56 VAL H . . 4.400 2.602 1.899 3.276 . 0 0 "[ . 1 . 2]" 1
1107 1 56 VAL H 1 56 VAL HB . . 3.560 2.621 2.465 2.834 . 0 0 "[ . 1 . 2]" 1
1108 1 56 VAL H 1 56 VAL MG1 . . 4.120 3.837 3.767 3.925 . 0 0 "[ . 1 . 2]" 1
1109 1 56 VAL H 1 56 VAL MG2 . . 3.550 2.775 2.567 3.105 . 0 0 "[ . 1 . 2]" 1
1110 1 56 VAL H 1 57 VAL QG . . 4.490 3.951 3.516 4.284 . 0 0 "[ . 1 . 2]" 1
1111 1 56 VAL H 1 74 THR MG . . 4.690 3.865 3.400 4.680 . 0 0 "[ . 1 . 2]" 1
1112 1 56 VAL HA 1 56 VAL MG1 . . 3.440 2.385 2.299 2.468 . 0 0 "[ . 1 . 2]" 1
1113 1 56 VAL HA 1 56 VAL MG2 . . 3.410 2.344 2.182 2.492 . 0 0 "[ . 1 . 2]" 1
1114 1 56 VAL HA 1 57 VAL H . . 3.200 2.193 2.141 2.306 . 0 0 "[ . 1 . 2]" 1
1115 1 56 VAL HA 1 98 VAL HA . . 3.910 2.821 2.458 3.207 . 0 0 "[ . 1 . 2]" 1
1116 1 56 VAL HA 1 98 VAL MG1 . . 4.350 3.677 3.227 4.168 . 0 0 "[ . 1 . 2]" 1
1117 1 56 VAL HA 1 98 VAL MG2 . . 4.520 3.187 2.918 3.563 . 0 0 "[ . 1 . 2]" 1
1118 1 56 VAL HB 1 57 VAL HA . . 5.410 4.744 4.598 4.887 . 0 0 "[ . 1 . 2]" 1
1119 1 56 VAL HB 1 74 THR MG . . 3.410 2.215 1.989 2.525 . 0 0 "[ . 1 . 2]" 1
1120 1 56 VAL MG1 1 57 VAL H . . 3.900 2.308 1.918 2.717 . 0 0 "[ . 1 . 2]" 1
1121 1 56 VAL MG1 1 58 TRP HD1 . . 3.830 2.679 2.133 3.074 . 0 0 "[ . 1 . 2]" 1
1122 1 56 VAL MG1 1 58 TRP HE1 . . 3.830 2.586 2.246 2.928 . 0 0 "[ . 1 . 2]" 1
1123 1 56 VAL MG1 1 74 THR MG . . 3.550 2.613 2.009 3.177 . 0 0 "[ . 1 . 2]" 1
1124 1 56 VAL MG1 1 79 THR HB . . 3.840 2.594 2.095 3.103 . 0 0 "[ . 1 . 2]" 1
1125 1 56 VAL MG1 1 79 THR HG1 . . 4.000 3.163 2.263 3.776 . 0 0 "[ . 1 . 2]" 1
1126 1 56 VAL MG1 1 79 THR MG . . 3.410 2.731 2.094 3.209 . 0 0 "[ . 1 . 2]" 1
1127 1 56 VAL MG1 1 96 LEU HA . . 5.310 4.458 4.195 4.685 . 0 0 "[ . 1 . 2]" 1
1128 1 56 VAL MG1 1 96 LEU QD . . 2.860 2.019 1.736 2.326 . 0 0 "[ . 1 . 2]" 1
1129 1 56 VAL MG1 1 98 VAL HA . . 5.500 4.424 4.006 4.922 . 0 0 "[ . 1 . 2]" 1
1130 1 56 VAL MG2 1 57 VAL H . . 4.650 3.940 3.709 4.153 . 0 0 "[ . 1 . 2]" 1
1131 1 56 VAL MG2 1 74 THR MG . . 3.100 2.157 1.822 2.562 . 0 0 "[ . 1 . 2]" 1
1132 1 56 VAL MG2 1 78 ASP HA . . 4.980 4.717 4.374 4.982 0.002 17 0 "[ . 1 . 2]" 1
1133 1 56 VAL MG2 1 79 THR HB . . 4.740 2.714 1.996 3.102 . 0 0 "[ . 1 . 2]" 1
1134 1 56 VAL MG2 1 79 THR MG . . 3.950 3.377 2.778 3.937 . 0 0 "[ . 1 . 2]" 1
1135 1 56 VAL MG2 1 96 LEU QD . . 4.070 3.226 2.907 3.555 . 0 0 "[ . 1 . 2]" 1
1136 1 56 VAL MG2 1 96 LEU HG . . 5.500 5.186 4.753 5.425 . 0 0 "[ . 1 . 2]" 1
1137 1 56 VAL MG2 1 98 VAL HA . . 5.240 4.011 3.726 4.284 . 0 0 "[ . 1 . 2]" 1
1138 1 57 VAL H 1 57 VAL HB . . 3.670 2.712 2.575 2.928 . 0 0 "[ . 1 . 2]" 1
1139 1 57 VAL H 1 57 VAL MG1 . . 4.100 3.872 3.823 3.944 . 0 0 "[ . 1 . 2]" 1
1140 1 57 VAL H 1 57 VAL QG . . 3.380 2.776 2.573 2.956 . 0 0 "[ . 1 . 2]" 1
1141 1 57 VAL H 1 57 VAL MG2 . . 4.100 2.846 2.615 3.054 . 0 0 "[ . 1 . 2]" 1
1142 1 57 VAL H 1 96 LEU QD . . 3.980 2.741 2.366 3.489 . 0 0 "[ . 1 . 2]" 1
1143 1 57 VAL H 1 97 SER H . . 3.940 3.231 2.754 3.487 . 0 0 "[ . 1 . 2]" 1
1144 1 57 VAL H 1 97 SER QB . . 4.880 4.369 3.892 4.705 . 0 0 "[ . 1 . 2]" 1
1145 1 57 VAL H 1 98 VAL HA . . 4.310 3.613 3.136 4.010 . 0 0 "[ . 1 . 2]" 1
1146 1 57 VAL H 1 98 VAL MG2 . . 4.520 3.985 3.752 4.420 . 0 0 "[ . 1 . 2]" 1
1147 1 57 VAL HA 1 57 VAL MG1 . . 3.220 2.398 2.305 2.481 . 0 0 "[ . 1 . 2]" 1
1148 1 57 VAL HA 1 57 VAL MG2 . . 3.220 2.384 2.304 2.450 . 0 0 "[ . 1 . 2]" 1
1149 1 57 VAL HA 1 58 TRP H . . 2.930 2.160 2.140 2.243 . 0 0 "[ . 1 . 2]" 1
1150 1 57 VAL HA 1 58 TRP QB . . 4.440 4.181 4.094 4.261 . 0 0 "[ . 1 . 2]" 1
1151 1 57 VAL HA 1 58 TRP HD1 . . 4.710 4.455 4.146 4.714 0.004 19 0 "[ . 1 . 2]" 1
1152 1 57 VAL HB 1 58 TRP H . . 4.390 4.173 3.905 4.327 . 0 0 "[ . 1 . 2]" 1
1153 1 57 VAL HB 1 97 SER H . . 4.930 3.004 2.325 3.578 . 0 0 "[ . 1 . 2]" 1
1154 1 57 VAL HB 1 97 SER HB2 . . 4.470 2.902 2.211 3.653 . 0 0 "[ . 1 . 2]" 1
1155 1 57 VAL HB 1 97 SER QB . . 3.670 2.845 2.199 3.496 . 0 0 "[ . 1 . 2]" 1
1156 1 57 VAL HB 1 97 SER HB3 . . 4.470 4.282 3.893 4.483 0.013 14 0 "[ . 1 . 2]" 1
1157 1 57 VAL QG 1 58 TRP H . . 3.180 2.438 2.013 2.808 . 0 0 "[ . 1 . 2]" 1
1158 1 57 VAL QG 1 58 TRP HA . . 4.430 3.620 3.389 3.817 . 0 0 "[ . 1 . 2]" 1
1159 1 57 VAL QG 1 97 SER H . . 4.620 3.670 3.264 4.007 . 0 0 "[ . 1 . 2]" 1
1160 1 57 VAL QG 1 97 SER QB . . 4.220 3.172 2.633 3.667 . 0 0 "[ . 1 . 2]" 1
1161 1 57 VAL MG1 1 58 TRP H . . 4.130 2.462 2.020 2.862 . 0 0 "[ . 1 . 2]" 1
1162 1 57 VAL MG2 1 58 TRP H . . 4.130 4.022 3.889 4.106 . 0 0 "[ . 1 . 2]" 1
1163 1 58 TRP H 1 58 TRP QB . . 3.660 2.387 2.286 2.536 . 0 0 "[ . 1 . 2]" 1
1164 1 58 TRP H 1 58 TRP HD1 . . 4.560 3.648 3.267 4.144 . 0 0 "[ . 1 . 2]" 1
1165 1 58 TRP H 1 58 TRP HE3 . . 5.500 5.435 5.258 5.517 0.017 17 0 "[ . 1 . 2]" 1
1166 1 58 TRP H 1 59 THR MG . . 4.710 3.810 3.471 4.039 . 0 0 "[ . 1 . 2]" 1
1167 1 58 TRP H 1 65 LEU QD . . 5.160 4.281 3.602 5.113 . 0 0 "[ . 1 . 2]" 1
1168 1 58 TRP HA 1 58 TRP HE3 . . 4.350 2.863 2.505 3.077 . 0 0 "[ . 1 . 2]" 1
1169 1 58 TRP HA 1 59 THR H . . 3.100 2.153 2.139 2.203 . 0 0 "[ . 1 . 2]" 1
1170 1 58 TRP HA 1 59 THR MG . . 5.000 3.994 3.778 4.226 . 0 0 "[ . 1 . 2]" 1
1171 1 58 TRP HA 1 65 LEU MD1 . . 5.500 4.187 3.689 4.633 . 0 0 "[ . 1 . 2]" 1
1172 1 58 TRP HA 1 65 LEU QD . . 4.510 4.027 3.635 4.370 . 0 0 "[ . 1 . 2]" 1
1173 1 58 TRP HA 1 65 LEU MD2 . . 5.500 5.309 4.949 5.511 0.011 4 0 "[ . 1 . 2]" 1
1174 1 58 TRP HA 1 96 LEU HA . . 3.810 3.262 2.837 3.677 . 0 0 "[ . 1 . 2]" 1
1175 1 58 TRP HA 1 96 LEU QD . . 4.180 3.603 2.948 4.183 0.003 9 0 "[ . 1 . 2]" 1
1176 1 58 TRP HA 1 97 SER H . . 4.710 4.238 3.839 4.637 . 0 0 "[ . 1 . 2]" 1
1177 1 58 TRP QB 1 59 THR H . . 3.940 3.280 2.970 3.438 . 0 0 "[ . 1 . 2]" 1
1178 1 58 TRP QB 1 65 LEU MD1 . . 3.720 2.027 1.839 3.087 . 0 0 "[ . 1 . 2]" 1
1179 1 58 TRP QB 1 65 LEU QD . . 3.090 2.004 1.832 2.856 . 0 0 "[ . 1 . 2]" 1
1180 1 58 TRP QB 1 65 LEU MD2 . . 3.720 3.486 3.159 3.718 . 0 0 "[ . 1 . 2]" 1
1181 1 58 TRP QB 1 72 VAL QG . . 4.140 3.182 2.925 3.590 . 0 0 "[ . 1 . 2]" 1
1182 1 58 TRP HD1 1 72 VAL MG1 . . 4.120 2.820 2.164 4.011 . 0 0 "[ . 1 . 2]" 1
1183 1 58 TRP HD1 1 72 VAL QG . . 3.160 2.669 2.150 3.158 . 0 0 "[ . 1 . 2]" 1
1184 1 58 TRP HD1 1 72 VAL MG2 . . 4.120 3.866 3.007 4.122 0.002 6 0 "[ . 1 . 2]" 1
1185 1 58 TRP HD1 1 79 THR MG . . 5.130 4.692 3.765 5.135 0.005 4 0 "[ . 1 . 2]" 1
1186 1 58 TRP HD1 1 96 LEU QD . . 5.000 4.105 3.514 4.632 . 0 0 "[ . 1 . 2]" 1
1187 1 58 TRP HE1 1 72 VAL MG1 . . 4.900 3.235 2.333 4.870 . 0 0 "[ . 1 . 2]" 1
1188 1 58 TRP HE1 1 72 VAL QG . . 3.480 2.939 2.322 3.255 . 0 0 "[ . 1 . 2]" 1
1189 1 58 TRP HE1 1 72 VAL MG2 . . 4.900 4.359 2.973 4.906 0.006 19 0 "[ . 1 . 2]" 1
1190 1 58 TRP HE1 1 79 THR HB . . 4.740 3.384 3.053 3.713 . 0 0 "[ . 1 . 2]" 1
1191 1 58 TRP HE1 1 79 THR HG1 . . 3.980 2.302 1.906 3.031 . 0 0 "[ . 1 . 2]" 1
1192 1 58 TRP HE1 1 79 THR MG . . 3.360 2.593 1.838 3.063 . 0 0 "[ . 1 . 2]" 1
1193 1 58 TRP HE1 1 96 LEU QD . . 4.250 3.204 2.473 3.574 . 0 0 "[ . 1 . 2]" 1
1194 1 58 TRP HE3 1 59 THR H . . 4.500 3.116 2.724 3.553 . 0 0 "[ . 1 . 2]" 1
1195 1 58 TRP HE3 1 94 TYR HB2 . . 4.830 4.505 4.070 4.780 . 0 0 "[ . 1 . 2]" 1
1196 1 58 TRP HE3 1 94 TYR QB . . 4.100 2.787 2.361 3.045 . 0 0 "[ . 1 . 2]" 1
1197 1 58 TRP HE3 1 94 TYR HB3 . . 4.830 2.814 2.377 3.081 . 0 0 "[ . 1 . 2]" 1
1198 1 58 TRP HE3 1 94 TYR QD . . 4.890 2.560 2.006 3.057 . 0 0 "[ . 1 . 2]" 1
1199 1 58 TRP HE3 1 95 GLU H . . 5.500 4.325 3.600 4.854 . 0 0 "[ . 1 . 2]" 1
1200 1 58 TRP HH2 1 79 THR MG . . 4.540 3.999 3.533 4.544 0.004 18 0 "[ . 1 . 2]" 1
1201 1 58 TRP HH2 1 96 LEU MD1 . . 5.500 3.850 2.503 5.371 . 0 0 "[ . 1 . 2]" 1
1202 1 58 TRP HH2 1 96 LEU QD . . 4.590 3.255 2.497 3.914 . 0 0 "[ . 1 . 2]" 1
1203 1 58 TRP HH2 1 96 LEU MD2 . . 5.500 4.133 3.191 5.493 . 0 0 "[ . 1 . 2]" 1
1204 1 58 TRP HH2 1 109 ILE MD . . 3.480 2.417 1.979 2.825 . 0 0 "[ . 1 . 2]" 1
1205 1 58 TRP HZ2 1 72 VAL QG . . 4.820 4.292 3.652 4.736 . 0 0 "[ . 1 . 2]" 1
1206 1 58 TRP HZ2 1 79 THR MG . . 3.090 2.093 1.796 2.452 . 0 0 "[ . 1 . 2]" 1
1207 1 58 TRP HZ2 1 96 LEU MD1 . . 4.800 3.127 2.139 4.789 . 0 0 "[ . 1 . 2]" 1
1208 1 58 TRP HZ2 1 96 LEU MD2 . . 4.800 3.670 2.595 4.760 . 0 0 "[ . 1 . 2]" 1
1209 1 58 TRP HZ2 1 109 ILE MD . . 4.860 4.219 3.755 4.605 . 0 0 "[ . 1 . 2]" 1
1210 1 58 TRP HZ3 1 109 ILE MD . . 3.520 2.446 1.978 2.842 . 0 0 "[ . 1 . 2]" 1
1211 1 58 TRP HZ3 1 109 ILE MG . . 4.540 4.235 3.883 4.474 . 0 0 "[ . 1 . 2]" 1
1212 1 59 THR H 1 59 THR MG . . 4.110 3.258 3.142 3.495 . 0 0 "[ . 1 . 2]" 1
1213 1 59 THR H 1 94 TYR HA . . 4.730 4.498 3.984 4.739 0.009 17 0 "[ . 1 . 2]" 1
1214 1 59 THR H 1 95 GLU H . . 3.710 3.301 2.938 3.643 . 0 0 "[ . 1 . 2]" 1
1215 1 59 THR H 1 96 LEU HA . . 4.580 4.039 3.549 4.475 . 0 0 "[ . 1 . 2]" 1
1216 1 59 THR HB 1 60 LYS H . . 3.510 2.951 2.352 3.413 . 0 0 "[ . 1 . 2]" 1
1217 1 59 THR HB 1 62 GLY H . . 4.600 2.966 2.011 3.285 . 0 0 "[ . 1 . 2]" 1
1218 1 59 THR HB 1 62 GLY HA2 . . 4.740 3.270 3.009 3.805 . 0 0 "[ . 1 . 2]" 1
1219 1 59 THR HB 1 62 GLY QA . . 4.130 3.206 2.954 3.655 . 0 0 "[ . 1 . 2]" 1
1220 1 59 THR HB 1 62 GLY HA3 . . 4.740 4.659 4.299 4.757 0.017 4 0 "[ . 1 . 2]" 1
1221 1 59 THR HB 1 63 ALA H . . 3.680 2.376 1.945 3.582 . 0 0 "[ . 1 . 2]" 1
1222 1 59 THR MG 1 60 LYS H . . 3.870 3.703 3.505 3.824 . 0 0 "[ . 1 . 2]" 1
1223 1 59 THR MG 1 62 GLY QA . . 4.370 3.724 3.219 4.164 . 0 0 "[ . 1 . 2]" 1
1224 1 59 THR MG 1 63 ALA H . . 4.170 3.276 2.404 4.166 . 0 0 "[ . 1 . 2]" 1
1225 1 59 THR MG 1 63 ALA HA . . 4.390 3.682 3.009 4.148 . 0 0 "[ . 1 . 2]" 1
1226 1 59 THR MG 1 63 ALA MB . . 4.520 4.350 4.033 4.492 . 0 0 "[ . 1 . 2]" 1
1227 1 59 THR MG 1 64 PRO HA . . 3.750 2.715 1.966 3.592 . 0 0 "[ . 1 . 2]" 1
1228 1 60 LYS H 1 60 LYS QB . . 3.700 2.415 2.187 2.952 . 0 0 "[ . 1 . 2]" 1
1229 1 60 LYS H 1 63 ALA H . . 3.790 3.131 2.709 3.722 . 0 0 "[ . 1 . 2]" 1
1230 1 60 LYS H 1 63 ALA MB . . 4.480 3.896 3.310 4.421 . 0 0 "[ . 1 . 2]" 1
1231 1 60 LYS H 1 65 LEU QD . . 4.110 3.169 2.127 3.836 . 0 0 "[ . 1 . 2]" 1
1232 1 60 LYS HA 1 94 TYR HA . . 3.590 2.510 2.033 3.052 . 0 0 "[ . 1 . 2]" 1
1233 1 60 LYS HA 1 95 GLU H . . 4.270 3.329 2.855 4.008 . 0 0 "[ . 1 . 2]" 1
1234 1 60 LYS QB 1 60 LYS QD . . 3.210 2.195 2.028 2.422 . 0 0 "[ . 1 . 2]" 1
1235 1 60 LYS QB 1 60 LYS QE . . 4.150 3.283 1.938 3.808 . 0 0 "[ . 1 . 2]" 1
1236 1 60 LYS QB 1 65 LEU QD . . 3.380 2.484 1.764 3.191 . 0 0 "[ . 1 . 2]" 1
1237 1 60 LYS QB 1 94 TYR QD . . 5.320 4.089 2.540 4.776 . 0 0 "[ . 1 . 2]" 1
1238 1 60 LYS QB 1 94 TYR QE . . 4.700 3.853 2.653 4.640 . 0 0 "[ . 1 . 2]" 1
1239 1 60 LYS HB2 1 94 TYR QE . . 5.500 4.104 2.929 5.432 . 0 0 "[ . 1 . 2]" 1
1240 1 60 LYS HB3 1 94 TYR QE . . 5.500 4.988 3.032 5.486 . 0 0 "[ . 1 . 2]" 1
1241 1 60 LYS QD 1 65 LEU QD . . 3.680 3.224 2.279 3.680 0.000 4 0 "[ . 1 . 2]" 1
1242 1 60 LYS QD 1 94 TYR QD . . 5.000 3.742 2.440 4.881 . 0 0 "[ . 1 . 2]" 1
1243 1 60 LYS QD 1 94 TYR QE . . 4.150 2.837 2.087 4.139 . 0 0 "[ . 1 . 2]" 1
1244 1 60 LYS HD2 1 94 TYR QE . . 4.810 3.158 2.234 4.752 . 0 0 "[ . 1 . 2]" 1
1245 1 60 LYS HD3 1 94 TYR QE . . 4.810 3.717 2.199 4.810 0.000 3 0 "[ . 1 . 2]" 1
1246 1 60 LYS QE 1 60 LYS QG . . 3.070 2.270 2.075 2.442 . 0 0 "[ . 1 . 2]" 1
1247 1 60 LYS QE 1 90 ASP HA . . 4.420 3.636 2.892 4.381 . 0 0 "[ . 1 . 2]" 1
1248 1 60 LYS QE 1 92 GLY QA . . 3.610 2.318 1.817 2.998 . 0 0 "[ . 1 . 2]" 1
1249 1 60 LYS QE 1 93 GLU H . . 4.250 3.150 2.005 4.201 . 0 0 "[ . 1 . 2]" 1
1250 1 60 LYS QE 1 94 TYR HH . . 4.170 3.148 2.003 3.747 . 0 0 "[ . 1 . 2]" 1
1251 1 60 LYS HE2 1 60 LYS HG2 . . 3.930 3.005 2.222 3.909 . 0 0 "[ . 1 . 2]" 1
1252 1 60 LYS HE2 1 60 LYS HG3 . . 3.930 3.142 2.406 3.945 0.015 4 0 "[ . 1 . 2]" 1
1253 1 60 LYS HE2 1 92 GLY HA2 . . 5.140 4.256 3.386 5.136 . 0 0 "[ . 1 . 2]" 1
1254 1 60 LYS HE2 1 92 GLY HA3 . . 5.140 2.636 2.000 3.688 . 0 0 "[ . 1 . 2]" 1
1255 1 60 LYS HE2 1 93 GLU H . . 4.870 3.471 2.082 4.858 . 0 0 "[ . 1 . 2]" 1
1256 1 60 LYS HE2 1 94 TYR QE . . 4.470 3.483 2.260 4.379 . 0 0 "[ . 1 . 2]" 1
1257 1 60 LYS HE3 1 60 LYS HG2 . . 3.930 3.093 2.205 3.819 . 0 0 "[ . 1 . 2]" 1
1258 1 60 LYS HE3 1 60 LYS HG3 . . 3.930 3.315 2.477 3.810 . 0 0 "[ . 1 . 2]" 1
1259 1 60 LYS HE3 1 92 GLY HA2 . . 5.140 4.560 3.745 5.136 . 0 0 "[ . 1 . 2]" 1
1260 1 60 LYS HE3 1 92 GLY HA3 . . 5.140 2.930 2.094 3.441 . 0 0 "[ . 1 . 2]" 1
1261 1 60 LYS HE3 1 93 GLU H . . 4.870 4.041 2.619 4.832 . 0 0 "[ . 1 . 2]" 1
1262 1 60 LYS HE3 1 94 TYR QE . . 4.470 2.827 2.013 4.265 . 0 0 "[ . 1 . 2]" 1
1263 1 60 LYS QG 1 94 TYR QE . . 5.190 3.601 2.498 4.340 . 0 0 "[ . 1 . 2]" 1
1264 1 61 GLY H 1 62 GLY H . . 4.040 2.673 2.118 3.213 . 0 0 "[ . 1 . 2]" 1
1265 1 61 GLY H 1 94 TYR HA . . 4.340 3.719 3.141 4.220 . 0 0 "[ . 1 . 2]" 1
1266 1 62 GLY H 1 63 ALA H . . 3.790 2.351 1.882 3.030 . 0 0 "[ . 1 . 2]" 1
1267 1 63 ALA H 1 63 ALA MB . . 3.000 2.728 2.208 2.889 . 0 0 "[ . 1 . 2]" 1
1268 1 63 ALA HA 1 64 PRO HD2 . . 3.440 2.352 2.260 2.590 . 0 0 "[ . 1 . 2]" 1
1269 1 63 ALA HA 1 64 PRO QD . . 2.930 2.064 2.014 2.208 . 0 0 "[ . 1 . 2]" 1
1270 1 63 ALA HA 1 64 PRO HD3 . . 3.440 2.287 2.260 2.393 . 0 0 "[ . 1 . 2]" 1
1271 1 63 ALA HA 1 64 PRO HG2 . . 5.260 4.474 4.400 4.670 . 0 0 "[ . 1 . 2]" 1
1272 1 63 ALA HA 1 64 PRO QG . . 4.430 3.973 3.918 4.128 . 0 0 "[ . 1 . 2]" 1
1273 1 63 ALA HA 1 64 PRO HG3 . . 5.260 4.446 4.396 4.598 . 0 0 "[ . 1 . 2]" 1
1274 1 63 ALA MB 1 64 PRO HA . . 4.740 4.437 4.327 4.488 . 0 0 "[ . 1 . 2]" 1
1275 1 63 ALA MB 1 64 PRO HD2 . . 3.430 2.166 1.974 2.356 . 0 0 "[ . 1 . 2]" 1
1276 1 63 ALA MB 1 64 PRO QD . . 2.910 2.139 1.951 2.316 . 0 0 "[ . 1 . 2]" 1
1277 1 63 ALA MB 1 64 PRO HD3 . . 3.430 3.317 3.039 3.419 . 0 0 "[ . 1 . 2]" 1
1278 1 63 ALA MB 1 64 PRO HG2 . . 4.770 3.822 3.550 3.980 . 0 0 "[ . 1 . 2]" 1
1279 1 63 ALA MB 1 64 PRO QG . . 3.920 3.628 3.376 3.766 . 0 0 "[ . 1 . 2]" 1
1280 1 63 ALA MB 1 64 PRO HG3 . . 4.770 4.519 4.227 4.652 . 0 0 "[ . 1 . 2]" 1
1281 1 64 PRO HA 1 65 LEU H . . 3.040 2.297 2.152 2.553 . 0 0 "[ . 1 . 2]" 1
1282 1 64 PRO HA 1 65 LEU QD . . 4.650 3.966 2.776 4.435 . 0 0 "[ . 1 . 2]" 1
1283 1 64 PRO HB2 1 65 LEU H . . 4.170 2.997 2.254 3.798 . 0 0 "[ . 1 . 2]" 1
1284 1 64 PRO HB3 1 65 LEU H . . 4.170 3.682 3.285 4.186 0.016 4 0 "[ . 1 . 2]" 1
1285 1 65 LEU H 1 65 LEU HB2 . . 4.140 2.594 2.242 2.723 . 0 0 "[ . 1 . 2]" 1
1286 1 65 LEU H 1 65 LEU QB . . 3.550 2.541 2.218 2.657 . 0 0 "[ . 1 . 2]" 1
1287 1 65 LEU H 1 65 LEU HB3 . . 4.140 3.644 3.529 3.785 . 0 0 "[ . 1 . 2]" 1
1288 1 65 LEU H 1 65 LEU MD1 . . 4.090 3.219 1.856 3.647 . 0 0 "[ . 1 . 2]" 1
1289 1 65 LEU H 1 65 LEU QD . . 3.560 2.918 1.853 3.328 . 0 0 "[ . 1 . 2]" 1
1290 1 65 LEU H 1 65 LEU MD2 . . 4.090 3.623 3.138 4.068 . 0 0 "[ . 1 . 2]" 1
1291 1 65 LEU H 1 65 LEU HG . . 4.030 2.441 1.927 3.778 . 0 0 "[ . 1 . 2]" 1
1292 1 65 LEU H 1 66 ASP H . . 5.050 4.566 4.445 4.646 . 0 0 "[ . 1 . 2]" 1
1293 1 65 LEU H 1 67 THR MG . . 4.880 4.373 3.471 4.872 . 0 0 "[ . 1 . 2]" 1
1294 1 65 LEU HA 1 65 LEU MD1 . . 4.060 3.841 2.771 4.006 . 0 0 "[ . 1 . 2]" 1
1295 1 65 LEU HA 1 65 LEU QD . . 3.100 2.386 1.985 3.170 0.070 9 0 "[ . 1 . 2]" 1
1296 1 65 LEU HA 1 65 LEU MD2 . . 4.060 2.494 1.991 3.731 . 0 0 "[ . 1 . 2]" 1
1297 1 65 LEU HA 1 65 LEU HG . . 4.240 2.969 2.379 3.188 . 0 0 "[ . 1 . 2]" 1
1298 1 65 LEU HA 1 66 ASP H . . 3.270 2.411 2.207 2.574 . 0 0 "[ . 1 . 2]" 1
1299 1 65 LEU HA 1 66 ASP QB . . 4.820 4.445 4.028 4.741 . 0 0 "[ . 1 . 2]" 1
1300 1 65 LEU QB 1 65 LEU QD . . 2.770 1.874 1.779 1.946 . 0 0 "[ . 1 . 2]" 1
1301 1 65 LEU QB 1 66 ASP H . . 3.740 2.424 2.110 2.890 . 0 0 "[ . 1 . 2]" 1
1302 1 65 LEU QB 1 67 THR MG . . 3.770 3.015 2.154 3.758 . 0 0 "[ . 1 . 2]" 1
1303 1 65 LEU QB 1 70 VAL HB . . 4.280 3.292 2.762 3.570 . 0 0 "[ . 1 . 2]" 1
1304 1 65 LEU QB 1 70 VAL MG1 . . 4.590 3.337 2.714 3.768 . 0 0 "[ . 1 . 2]" 1
1305 1 65 LEU QB 1 70 VAL MG2 . . 4.130 2.903 1.989 3.503 . 0 0 "[ . 1 . 2]" 1
1306 1 65 LEU HB2 1 66 ASP H . . 4.450 3.499 3.064 4.031 . 0 0 "[ . 1 . 2]" 1
1307 1 65 LEU HB2 1 70 VAL HB . . 5.130 4.159 3.529 4.799 . 0 0 "[ . 1 . 2]" 1
1308 1 65 LEU HB3 1 66 ASP H . . 4.450 2.473 2.145 2.971 . 0 0 "[ . 1 . 2]" 1
1309 1 65 LEU HB3 1 70 VAL HB . . 5.130 3.466 2.860 3.724 . 0 0 "[ . 1 . 2]" 1
1310 1 65 LEU QD 1 66 ASP H . . 4.010 3.485 3.184 3.894 . 0 0 "[ . 1 . 2]" 1
1311 1 65 LEU QD 1 67 THR MG . . 4.300 3.840 3.282 4.300 . 0 0 "[ . 1 . 2]" 1
1312 1 65 LEU QD 1 70 VAL HB . . 4.040 3.477 2.279 3.982 . 0 0 "[ . 1 . 2]" 1
1313 1 65 LEU QD 1 70 VAL MG1 . . 3.070 2.490 1.819 3.013 . 0 0 "[ . 1 . 2]" 1
1314 1 65 LEU QD 1 70 VAL MG2 . . 3.540 2.930 1.786 3.350 . 0 0 "[ . 1 . 2]" 1
1315 1 65 LEU QD 1 72 VAL QG . . 3.260 2.511 1.907 3.146 . 0 0 "[ . 1 . 2]" 1
1316 1 65 LEU QD 1 81 PHE QD . . 4.350 3.363 3.058 3.842 . 0 0 "[ . 1 . 2]" 1
1317 1 65 LEU QD 1 81 PHE QE . . 3.620 2.819 2.206 3.456 . 0 0 "[ . 1 . 2]" 1
1318 1 65 LEU QD 1 81 PHE HZ . . 5.440 4.253 3.648 5.128 . 0 0 "[ . 1 . 2]" 1
1319 1 65 LEU QD 1 94 TYR QD . . 3.580 3.285 2.889 3.569 . 0 0 "[ . 1 . 2]" 1
1320 1 65 LEU QD 1 94 TYR QE . . 3.260 2.672 2.271 2.839 . 0 0 "[ . 1 . 2]" 1
1321 1 65 LEU MD1 1 66 ASP H . . 4.970 4.565 4.185 4.924 . 0 0 "[ . 1 . 2]" 1
1322 1 65 LEU MD1 1 70 VAL MG1 . . 3.840 2.821 2.335 3.855 0.015 4 0 "[ . 1 . 2]" 1
1323 1 65 LEU MD1 1 70 VAL MG2 . . 4.140 3.811 3.262 4.142 0.002 19 0 "[ . 1 . 2]" 1
1324 1 65 LEU MD1 1 81 PHE QE . . 4.160 3.297 2.253 4.167 0.007 2 0 "[ . 1 . 2]" 1
1325 1 65 LEU MD1 1 94 TYR QD . . 4.140 3.764 3.110 4.122 . 0 0 "[ . 1 . 2]" 1
1326 1 65 LEU MD1 1 94 TYR QE . . 4.290 3.380 2.887 4.254 . 0 0 "[ . 1 . 2]" 1
1327 1 65 LEU MD2 1 66 ASP H . . 4.970 3.633 3.245 4.127 . 0 0 "[ . 1 . 2]" 1
1328 1 65 LEU MD2 1 70 VAL MG1 . . 3.840 3.263 1.822 3.814 . 0 0 "[ . 1 . 2]" 1
1329 1 65 LEU MD2 1 70 VAL MG2 . . 4.140 3.118 1.789 3.635 . 0 0 "[ . 1 . 2]" 1
1330 1 65 LEU MD2 1 81 PHE QE . . 4.160 3.311 2.241 4.034 . 0 0 "[ . 1 . 2]" 1
1331 1 65 LEU MD2 1 94 TYR QD . . 4.140 3.650 3.109 3.910 . 0 0 "[ . 1 . 2]" 1
1332 1 65 LEU MD2 1 94 TYR QE . . 4.290 2.835 2.349 3.071 . 0 0 "[ . 1 . 2]" 1
1333 1 65 LEU HG 1 66 ASP H . . 5.090 4.729 3.466 5.066 . 0 0 "[ . 1 . 2]" 1
1334 1 65 LEU HG 1 94 TYR QE . . 5.500 5.251 4.214 5.493 . 0 0 "[ . 1 . 2]" 1
1335 1 66 ASP H 1 66 ASP HB2 . . 3.730 2.576 2.264 3.634 . 0 0 "[ . 1 . 2]" 1
1336 1 66 ASP H 1 66 ASP QB . . 3.270 2.457 2.239 3.033 . 0 0 "[ . 1 . 2]" 1
1337 1 66 ASP H 1 66 ASP HB3 . . 3.730 3.505 2.659 3.716 . 0 0 "[ . 1 . 2]" 1
1338 1 66 ASP H 1 67 THR H . . 4.590 3.347 2.438 4.292 . 0 0 "[ . 1 . 2]" 1
1339 1 66 ASP H 1 68 SER H . . 5.360 4.835 3.540 5.362 0.002 19 0 "[ . 1 . 2]" 1
1340 1 66 ASP H 1 70 VAL MG2 . . 4.390 3.274 2.089 4.182 . 0 0 "[ . 1 . 2]" 1
1341 1 66 ASP QB 1 67 THR H . . 4.040 3.467 2.794 3.869 . 0 0 "[ . 1 . 2]" 1
1342 1 66 ASP HB2 1 67 THR H . . 4.770 3.949 2.851 4.579 . 0 0 "[ . 1 . 2]" 1
1343 1 66 ASP HB3 1 67 THR H . . 4.770 4.032 3.720 4.499 . 0 0 "[ . 1 . 2]" 1
1344 1 67 THR H 1 67 THR MG . . 3.160 2.279 1.931 2.704 . 0 0 "[ . 1 . 2]" 1
1345 1 67 THR H 1 68 SER H . . 3.670 2.887 2.664 3.395 . 0 0 "[ . 1 . 2]" 1
1346 1 67 THR HA 1 67 THR MG . . 3.010 2.326 2.170 2.469 . 0 0 "[ . 1 . 2]" 1
1347 1 67 THR HA 1 69 ARG H . . 4.370 4.176 3.439 4.348 . 0 0 "[ . 1 . 2]" 1
1348 1 67 THR HA 1 70 VAL H . . 3.910 3.519 3.084 3.867 . 0 0 "[ . 1 . 2]" 1
1349 1 67 THR HA 1 70 VAL HB . . 4.030 3.077 2.417 3.515 . 0 0 "[ . 1 . 2]" 1
1350 1 67 THR MG 1 68 SER H . . 5.230 4.146 3.878 4.342 . 0 0 "[ . 1 . 2]" 1
1351 1 67 THR MG 1 70 VAL MG2 . . 5.090 4.944 4.655 5.091 0.001 6 0 "[ . 1 . 2]" 1
1352 1 67 THR MG 1 72 VAL QG . . 4.460 3.930 3.285 4.430 . 0 0 "[ . 1 . 2]" 1
1353 1 68 SER H 1 68 SER HB2 . . 4.050 2.830 2.186 3.802 . 0 0 "[ . 1 . 2]" 1
1354 1 68 SER H 1 68 SER QB . . 3.510 2.461 2.137 2.983 . 0 0 "[ . 1 . 2]" 1
1355 1 68 SER H 1 68 SER HB3 . . 4.050 3.070 2.410 3.791 . 0 0 "[ . 1 . 2]" 1
1356 1 68 SER H 1 69 ARG H . . 3.400 2.397 1.811 3.031 . 0 0 "[ . 1 . 2]" 1
1357 1 68 SER H 1 70 VAL H . . 4.250 3.395 2.629 4.187 . 0 0 "[ . 1 . 2]" 1
1358 1 69 ARG H 1 69 ARG HB2 . . 3.940 3.080 2.516 3.827 . 0 0 "[ . 1 . 2]" 1
1359 1 69 ARG H 1 69 ARG HB3 . . 3.940 3.453 2.839 3.861 . 0 0 "[ . 1 . 2]" 1
1360 1 69 ARG H 1 69 ARG HG2 . . 4.210 2.952 2.196 3.738 . 0 0 "[ . 1 . 2]" 1
1361 1 69 ARG H 1 69 ARG QG . . 3.660 2.485 2.105 2.910 . 0 0 "[ . 1 . 2]" 1
1362 1 69 ARG H 1 69 ARG HG3 . . 4.210 3.075 2.401 4.091 . 0 0 "[ . 1 . 2]" 1
1363 1 69 ARG H 1 70 VAL H . . 3.120 1.987 1.816 2.253 . 0 0 "[ . 1 . 2]" 1
1364 1 69 ARG H 1 70 VAL MG2 . . 4.510 3.606 3.251 3.956 . 0 0 "[ . 1 . 2]" 1
1365 1 69 ARG HA 1 69 ARG QD . . 4.430 3.815 2.392 4.439 0.009 1 0 "[ . 1 . 2]" 1
1366 1 69 ARG HA 1 69 ARG HG2 . . 4.010 3.112 2.443 3.932 . 0 0 "[ . 1 . 2]" 1
1367 1 69 ARG HA 1 69 ARG HG3 . . 4.010 3.607 2.800 4.167 0.157 15 0 "[ . 1 . 2]" 1
1368 1 69 ARG HB2 1 70 VAL H . . 4.210 3.289 2.515 4.231 0.021 15 0 "[ . 1 . 2]" 1
1369 1 69 ARG HB2 1 70 VAL MG2 . . 4.650 3.363 2.665 4.459 . 0 0 "[ . 1 . 2]" 1
1370 1 69 ARG HB3 1 70 VAL H . . 4.210 4.001 3.619 4.188 . 0 0 "[ . 1 . 2]" 1
1371 1 69 ARG HB3 1 70 VAL MG2 . . 4.650 4.248 3.608 4.650 0.000 14 0 "[ . 1 . 2]" 1
1372 1 69 ARG QG 1 70 VAL H . . 3.930 3.401 2.298 3.962 0.032 19 0 "[ . 1 . 2]" 1
1373 1 69 ARG QG 1 70 VAL MG2 . . 4.520 3.571 2.032 4.479 . 0 0 "[ . 1 . 2]" 1
1374 1 70 VAL H 1 70 VAL HB . . 3.960 2.538 2.440 2.648 . 0 0 "[ . 1 . 2]" 1
1375 1 70 VAL H 1 70 VAL MG1 . . 4.390 3.788 3.761 3.838 . 0 0 "[ . 1 . 2]" 1
1376 1 70 VAL H 1 70 VAL MG2 . . 3.520 2.353 2.032 2.621 . 0 0 "[ . 1 . 2]" 1
1377 1 70 VAL HA 1 70 VAL MG1 . . 3.410 2.398 2.298 2.468 . 0 0 "[ . 1 . 2]" 1
1378 1 70 VAL HA 1 70 VAL MG2 . . 3.530 2.408 2.246 2.540 . 0 0 "[ . 1 . 2]" 1
1379 1 70 VAL HA 1 71 HIS H . . 3.160 2.186 2.140 2.245 . 0 0 "[ . 1 . 2]" 1
1380 1 70 VAL HA 1 83 VAL QG . . 3.590 3.116 2.592 3.546 . 0 0 "[ . 1 . 2]" 1
1381 1 70 VAL HB 1 71 HIS H . . 4.950 4.049 3.811 4.348 . 0 0 "[ . 1 . 2]" 1
1382 1 70 VAL HB 1 72 VAL QG . . 4.470 3.660 3.185 4.257 . 0 0 "[ . 1 . 2]" 1
1383 1 70 VAL MG1 1 71 HIS H . . 3.650 2.329 1.883 2.997 . 0 0 "[ . 1 . 2]" 1
1384 1 70 VAL MG1 1 72 VAL MG1 . . 4.590 4.075 2.887 4.549 . 0 0 "[ . 1 . 2]" 1
1385 1 70 VAL MG1 1 72 VAL QG . . 3.050 2.209 1.825 3.017 . 0 0 "[ . 1 . 2]" 1
1386 1 70 VAL MG1 1 72 VAL MG2 . . 4.590 2.400 1.827 4.266 . 0 0 "[ . 1 . 2]" 1
1387 1 70 VAL MG1 1 81 PHE HA . . 5.040 4.416 3.865 4.792 . 0 0 "[ . 1 . 2]" 1
1388 1 70 VAL MG1 1 81 PHE QD . . 4.140 3.065 2.559 3.409 . 0 0 "[ . 1 . 2]" 1
1389 1 70 VAL MG1 1 81 PHE QE . . 4.090 2.092 1.853 2.434 . 0 0 "[ . 1 . 2]" 1
1390 1 70 VAL MG1 1 81 PHE HZ . . 4.480 3.328 2.717 3.964 . 0 0 "[ . 1 . 2]" 1
1391 1 70 VAL MG1 1 82 PHE H . . 4.170 3.609 3.260 4.125 . 0 0 "[ . 1 . 2]" 1
1392 1 70 VAL MG1 1 83 VAL QG . . 3.170 2.463 1.945 3.062 . 0 0 "[ . 1 . 2]" 1
1393 1 70 VAL MG2 1 71 HIS H . . 4.320 4.008 3.807 4.143 . 0 0 "[ . 1 . 2]" 1
1394 1 70 VAL MG2 1 81 PHE QE . . 4.480 3.253 2.639 3.685 . 0 0 "[ . 1 . 2]" 1
1395 1 70 VAL MG2 1 81 PHE HZ . . 4.410 3.760 3.108 4.392 . 0 0 "[ . 1 . 2]" 1
1396 1 70 VAL MG2 1 94 TYR QE . . 4.750 4.489 3.778 4.752 0.002 19 0 "[ . 1 . 2]" 1
1397 1 71 HIS H 1 71 HIS HB2 . . 3.870 2.675 2.428 3.117 . 0 0 "[ . 1 . 2]" 1
1398 1 71 HIS H 1 71 HIS HB3 . . 3.870 3.253 2.490 3.821 . 0 0 "[ . 1 . 2]" 1
1399 1 71 HIS H 1 82 PHE H . . 4.310 4.028 3.432 4.303 . 0 0 "[ . 1 . 2]" 1
1400 1 71 HIS H 1 83 VAL HA . . 4.660 3.427 2.805 3.782 . 0 0 "[ . 1 . 2]" 1
1401 1 71 HIS H 1 83 VAL QG . . 4.050 3.625 2.841 4.012 . 0 0 "[ . 1 . 2]" 1
1402 1 71 HIS H 1 84 ARG H . . 5.220 4.600 3.894 5.096 . 0 0 "[ . 1 . 2]" 1
1403 1 71 HIS HA 1 72 VAL H . . 2.930 2.213 2.140 2.318 . 0 0 "[ . 1 . 2]" 1
1404 1 71 HIS HA 1 72 VAL HB . . 4.920 4.725 4.502 4.924 0.004 17 0 "[ . 1 . 2]" 1
1405 1 71 HIS HA 1 72 VAL QG . . 4.410 3.898 3.645 4.057 . 0 0 "[ . 1 . 2]" 1
1406 1 71 HIS QB 1 72 VAL H . . 4.390 3.813 3.518 4.011 . 0 0 "[ . 1 . 2]" 1
1407 1 71 HIS QB 1 82 PHE QD . . 3.780 2.206 2.006 2.845 . 0 0 "[ . 1 . 2]" 1
1408 1 71 HIS HB2 1 82 PHE QD . . 4.470 2.720 2.018 3.659 . 0 0 "[ . 1 . 2]" 1
1409 1 71 HIS HB3 1 82 PHE QD . . 4.470 3.034 2.044 4.422 . 0 0 "[ . 1 . 2]" 1
1410 1 71 HIS HD2 1 82 PHE QD . . 4.690 4.153 3.161 4.662 . 0 0 "[ . 1 . 2]" 1
1411 1 72 VAL H 1 72 VAL HB . . 3.430 2.641 2.455 3.311 . 0 0 "[ . 1 . 2]" 1
1412 1 72 VAL H 1 72 VAL MG1 . . 4.270 3.527 1.885 3.870 . 0 0 "[ . 1 . 2]" 1
1413 1 72 VAL H 1 72 VAL QG . . 3.360 2.524 1.881 2.968 . 0 0 "[ . 1 . 2]" 1
1414 1 72 VAL H 1 72 VAL MG2 . . 4.270 2.852 2.455 3.863 . 0 0 "[ . 1 . 2]" 1
1415 1 72 VAL H 1 73 ARG H . . 4.480 4.305 4.136 4.476 . 0 0 "[ . 1 . 2]" 1
1416 1 72 VAL HA 1 72 VAL MG1 . . 3.430 2.515 2.309 3.203 . 0 0 "[ . 1 . 2]" 1
1417 1 72 VAL HA 1 72 VAL QG . . 3.000 2.124 2.037 2.380 . 0 0 "[ . 1 . 2]" 1
1418 1 72 VAL HA 1 72 VAL MG2 . . 3.430 2.314 2.205 2.457 . 0 0 "[ . 1 . 2]" 1
1419 1 72 VAL HA 1 73 ARG H . . 3.010 2.157 2.140 2.243 . 0 0 "[ . 1 . 2]" 1
1420 1 72 VAL HA 1 81 PHE HA . . 3.750 2.617 2.353 2.920 . 0 0 "[ . 1 . 2]" 1
1421 1 72 VAL HA 1 82 PHE H . . 4.320 3.128 2.451 3.504 . 0 0 "[ . 1 . 2]" 1
1422 1 72 VAL HB 1 73 ARG H . . 4.830 4.302 4.056 4.453 . 0 0 "[ . 1 . 2]" 1
1423 1 72 VAL QG 1 73 ARG H . . 3.360 2.697 2.130 3.098 . 0 0 "[ . 1 . 2]" 1
1424 1 72 VAL QG 1 74 THR HG1 . . 4.430 2.681 2.075 3.579 . 0 0 "[ . 1 . 2]" 1
1425 1 72 VAL QG 1 74 THR MG . . 4.610 4.035 3.764 4.577 . 0 0 "[ . 1 . 2]" 1
1426 1 72 VAL QG 1 79 THR HG1 . . 3.570 2.985 2.540 3.351 . 0 0 "[ . 1 . 2]" 1
1427 1 72 VAL QG 1 79 THR MG . . 4.850 4.192 3.486 4.685 . 0 0 "[ . 1 . 2]" 1
1428 1 72 VAL QG 1 81 PHE HA . . 3.830 2.583 1.991 2.966 . 0 0 "[ . 1 . 2]" 1
1429 1 72 VAL QG 1 81 PHE HB2 . . 4.890 2.944 2.367 3.353 . 0 0 "[ . 1 . 2]" 1
1430 1 72 VAL QG 1 81 PHE QD . . 4.050 2.241 1.875 3.158 . 0 0 "[ . 1 . 2]" 1
1431 1 72 VAL QG 1 82 PHE H . . 4.250 3.266 2.611 3.972 . 0 0 "[ . 1 . 2]" 1
1432 1 72 VAL MG1 1 73 ARG H . . 4.200 2.962 2.145 4.147 . 0 0 "[ . 1 . 2]" 1
1433 1 72 VAL MG1 1 81 PHE HA . . 4.360 3.303 2.367 4.370 0.010 17 0 "[ . 1 . 2]" 1
1434 1 72 VAL MG1 1 82 PHE H . . 4.830 4.558 3.823 4.812 . 0 0 "[ . 1 . 2]" 1
1435 1 72 VAL MG2 1 73 ARG H . . 4.200 3.846 2.367 4.194 . 0 0 "[ . 1 . 2]" 1
1436 1 72 VAL MG2 1 81 PHE HA . . 4.360 2.791 1.994 3.209 . 0 0 "[ . 1 . 2]" 1
1437 1 72 VAL MG2 1 82 PHE H . . 4.830 3.359 2.636 4.321 . 0 0 "[ . 1 . 2]" 1
1438 1 73 ARG H 1 73 ARG HB2 . . 4.200 2.540 2.254 3.648 . 0 0 "[ . 1 . 2]" 1
1439 1 73 ARG H 1 73 ARG QB . . 3.540 2.389 2.230 2.726 . 0 0 "[ . 1 . 2]" 1
1440 1 73 ARG H 1 73 ARG HB3 . . 4.200 3.282 2.570 3.765 . 0 0 "[ . 1 . 2]" 1
1441 1 73 ARG H 1 73 ARG QG . . 4.420 3.260 1.882 4.189 . 0 0 "[ . 1 . 2]" 1
1442 1 73 ARG H 1 80 VAL HB . . 4.750 3.290 2.754 4.773 0.023 18 0 "[ . 1 . 2]" 1
1443 1 73 ARG H 1 80 VAL MG1 . . 4.860 3.776 3.536 4.044 . 0 0 "[ . 1 . 2]" 1
1444 1 73 ARG H 1 80 VAL QG . . 4.060 3.525 1.867 3.837 . 0 0 "[ . 1 . 2]" 1
1445 1 73 ARG H 1 80 VAL MG2 . . 4.860 4.530 1.871 4.853 . 0 0 "[ . 1 . 2]" 1
1446 1 73 ARG H 1 81 PHE HA . . 4.490 3.611 3.236 3.918 . 0 0 "[ . 1 . 2]" 1
1447 1 73 ARG QB 1 80 VAL HB . . 4.100 2.581 2.032 3.863 . 0 0 "[ . 1 . 2]" 1
1448 1 73 ARG QB 1 80 VAL QG . . 3.740 2.996 1.645 3.745 0.005 6 0 "[ . 1 . 2]" 1
1449 1 73 ARG HB2 1 80 VAL HB . . 4.780 3.083 2.048 4.725 . 0 0 "[ . 1 . 2]" 1
1450 1 73 ARG HB2 1 80 VAL MG1 . . 5.170 3.787 3.005 4.864 . 0 0 "[ . 1 . 2]" 1
1451 1 73 ARG HB2 1 80 VAL MG2 . . 5.170 4.011 1.981 5.138 . 0 0 "[ . 1 . 2]" 1
1452 1 73 ARG HB3 1 80 VAL HB . . 4.780 3.391 2.289 4.323 . 0 0 "[ . 1 . 2]" 1
1453 1 73 ARG HB3 1 80 VAL MG1 . . 5.170 4.253 2.054 5.135 . 0 0 "[ . 1 . 2]" 1
1454 1 73 ARG HB3 1 80 VAL MG2 . . 5.170 3.916 1.920 5.109 . 0 0 "[ . 1 . 2]" 1
1455 1 73 ARG QG 1 80 VAL QG . . 5.000 3.963 2.168 4.677 . 0 0 "[ . 1 . 2]" 1
1456 1 74 THR H 1 74 THR HB . . 4.120 2.633 2.529 2.770 . 0 0 "[ . 1 . 2]" 1
1457 1 74 THR HA 1 74 THR MG . . 3.430 2.301 2.150 2.427 . 0 0 "[ . 1 . 2]" 1
1458 1 74 THR HA 1 75 SER H . . 3.370 2.170 2.141 2.248 . 0 0 "[ . 1 . 2]" 1
1459 1 74 THR HA 1 79 THR HA . . 3.510 2.177 2.010 2.508 . 0 0 "[ . 1 . 2]" 1
1460 1 74 THR HA 1 79 THR HB . . 4.450 3.487 2.861 4.049 . 0 0 "[ . 1 . 2]" 1
1461 1 74 THR HA 1 80 VAL H . . 4.100 2.864 2.269 3.517 . 0 0 "[ . 1 . 2]" 1
1462 1 74 THR MG 1 75 SER H . . 3.600 2.459 1.973 2.918 . 0 0 "[ . 1 . 2]" 1
1463 1 74 THR MG 1 78 ASP H . . 5.500 5.180 4.688 5.500 0.000 4 0 "[ . 1 . 2]" 1
1464 1 74 THR MG 1 79 THR HA . . 3.930 3.004 2.438 3.828 . 0 0 "[ . 1 . 2]" 1
1465 1 74 THR MG 1 79 THR HB . . 3.560 2.529 2.127 3.560 . 0 0 "[ . 1 . 2]" 1
1466 1 74 THR MG 1 79 THR HG1 . . 3.720 2.989 2.197 3.683 . 0 0 "[ . 1 . 2]" 1
1467 1 74 THR MG 1 80 VAL H . . 5.420 4.315 3.850 5.102 . 0 0 "[ . 1 . 2]" 1
1468 1 75 SER H 1 77 PHE H . . 5.100 4.614 3.870 4.989 . 0 0 "[ . 1 . 2]" 1
1469 1 75 SER H 1 78 ASP H . . 4.120 3.836 3.566 4.085 . 0 0 "[ . 1 . 2]" 1
1470 1 75 SER H 1 79 THR HA . . 4.190 2.503 2.144 2.960 . 0 0 "[ . 1 . 2]" 1
1471 1 75 SER H 1 79 THR HB . . 4.670 4.017 3.536 4.458 . 0 0 "[ . 1 . 2]" 1
1472 1 75 SER QB 1 76 ASP H . . 3.590 3.142 2.145 3.592 0.002 6 0 "[ . 1 . 2]" 1
1473 1 75 SER HB2 1 76 ASP H . . 4.330 3.757 2.639 4.330 0.000 4 0 "[ . 1 . 2]" 1
1474 1 75 SER HB2 1 77 PHE H . . 4.690 3.756 2.335 4.541 . 0 0 "[ . 1 . 2]" 1
1475 1 75 SER HB3 1 76 ASP H . . 4.330 3.633 2.192 4.269 . 0 0 "[ . 1 . 2]" 1
1476 1 75 SER HB3 1 77 PHE H . . 4.690 3.215 2.158 4.493 . 0 0 "[ . 1 . 2]" 1
1477 1 75 SER HG 1 77 PHE H . . 4.440 3.200 2.160 4.431 . 0 0 "[ . 1 . 2]" 1
1478 1 75 SER HG 1 78 ASP H . . 4.350 3.512 2.041 4.416 0.066 19 0 "[ . 1 . 2]" 1
1479 1 76 ASP H 1 76 ASP HB2 . . 3.960 2.977 2.208 3.622 . 0 0 "[ . 1 . 2]" 1
1480 1 76 ASP H 1 76 ASP QB . . 3.410 2.447 2.155 2.865 . 0 0 "[ . 1 . 2]" 1
1481 1 76 ASP H 1 76 ASP HB3 . . 3.960 2.862 2.207 3.610 . 0 0 "[ . 1 . 2]" 1
1482 1 76 ASP H 1 77 PHE H . . 3.710 2.835 2.376 3.023 . 0 0 "[ . 1 . 2]" 1
1483 1 76 ASP QB 1 77 PHE H . . 3.840 3.142 2.551 3.857 0.017 18 0 "[ . 1 . 2]" 1
1484 1 76 ASP QB 1 77 PHE QD . . 4.250 3.735 2.458 4.244 . 0 0 "[ . 1 . 2]" 1
1485 1 76 ASP HB2 1 77 PHE H . . 4.620 3.681 2.611 4.506 . 0 0 "[ . 1 . 2]" 1
1486 1 76 ASP HB3 1 77 PHE H . . 4.620 3.677 2.599 4.571 . 0 0 "[ . 1 . 2]" 1
1487 1 77 PHE H 1 77 PHE QB . . 3.570 2.451 2.184 3.115 . 0 0 "[ . 1 . 2]" 1
1488 1 77 PHE H 1 77 PHE QD . . 4.170 2.651 2.199 3.344 . 0 0 "[ . 1 . 2]" 1
1489 1 77 PHE H 1 78 ASP H . . 2.990 2.645 1.907 2.974 . 0 0 "[ . 1 . 2]" 1
1490 1 77 PHE HA 1 77 PHE QD . . 3.990 2.868 2.257 3.693 . 0 0 "[ . 1 . 2]" 1
1491 1 77 PHE HB2 1 78 ASP H . . 4.780 2.382 1.959 3.512 . 0 0 "[ . 1 . 2]" 1
1492 1 77 PHE HB3 1 78 ASP H . . 4.780 3.174 2.602 4.108 . 0 0 "[ . 1 . 2]" 1
1493 1 78 ASP HA 1 79 THR H . . 3.330 2.410 2.342 2.434 . 0 0 "[ . 1 . 2]" 1
1494 1 78 ASP HA 1 79 THR MG . . 4.170 3.936 3.658 4.153 . 0 0 "[ . 1 . 2]" 1
1495 1 78 ASP HB2 1 79 THR H . . 3.880 2.470 2.369 3.408 . 0 0 "[ . 1 . 2]" 1
1496 1 78 ASP HB3 1 79 THR H . . 3.880 3.688 3.563 3.867 . 0 0 "[ . 1 . 2]" 1
1497 1 79 THR H 1 79 THR MG . . 3.390 2.048 1.905 2.164 . 0 0 "[ . 1 . 2]" 1
1498 1 79 THR H 1 80 VAL QG . . 4.480 4.216 4.091 4.454 . 0 0 "[ . 1 . 2]" 1
1499 1 79 THR HA 1 79 THR HG1 . . 3.930 2.658 2.179 3.493 . 0 0 "[ . 1 . 2]" 1
1500 1 79 THR HA 1 80 VAL H . . 3.310 2.280 2.160 2.404 . 0 0 "[ . 1 . 2]" 1
1501 1 79 THR HA 1 80 VAL QG . . 4.000 3.401 3.105 3.669 . 0 0 "[ . 1 . 2]" 1
1502 1 79 THR HB 1 80 VAL H . . 4.320 3.945 3.729 4.102 . 0 0 "[ . 1 . 2]" 1
1503 1 79 THR HG1 1 80 VAL H . . 4.050 2.594 1.950 3.438 . 0 0 "[ . 1 . 2]" 1
1504 1 79 THR MG 1 80 VAL H . . 4.650 3.654 3.339 4.080 . 0 0 "[ . 1 . 2]" 1
1505 1 79 THR MG 1 96 LEU MD1 . . 3.410 2.462 1.909 3.394 . 0 0 "[ . 1 . 2]" 1
1506 1 79 THR MG 1 96 LEU QD . . 2.890 2.204 1.892 2.745 . 0 0 "[ . 1 . 2]" 1
1507 1 79 THR MG 1 96 LEU MD2 . . 3.410 2.773 2.057 3.417 0.007 17 0 "[ . 1 . 2]" 1
1508 1 80 VAL H 1 80 VAL HB . . 3.910 2.824 2.602 3.820 . 0 0 "[ . 1 . 2]" 1
1509 1 80 VAL H 1 80 VAL MG1 . . 4.290 3.821 2.289 3.932 . 0 0 "[ . 1 . 2]" 1
1510 1 80 VAL H 1 80 VAL QG . . 3.360 2.769 2.149 2.965 . 0 0 "[ . 1 . 2]" 1
1511 1 80 VAL H 1 80 VAL MG2 . . 4.290 2.860 2.603 3.076 . 0 0 "[ . 1 . 2]" 1
1512 1 80 VAL HA 1 80 VAL MG1 . . 3.330 2.367 2.239 2.636 . 0 0 "[ . 1 . 2]" 1
1513 1 80 VAL HA 1 80 VAL MG2 . . 3.330 2.418 2.250 3.127 . 0 0 "[ . 1 . 2]" 1
1514 1 80 VAL HA 1 81 PHE H . . 3.190 2.194 2.147 2.309 . 0 0 "[ . 1 . 2]" 1
1515 1 80 VAL HA 1 81 PHE HB3 . . 4.850 4.391 4.261 4.542 . 0 0 "[ . 1 . 2]" 1
1516 1 80 VAL QG 1 81 PHE H . . 3.550 2.327 1.949 2.906 . 0 0 "[ . 1 . 2]" 1
1517 1 80 VAL QG 1 82 PHE H . . 4.330 4.194 3.899 4.332 0.002 6 0 "[ . 1 . 2]" 1
1518 1 80 VAL QG 1 82 PHE HA . . 4.800 4.557 4.398 4.755 . 0 0 "[ . 1 . 2]" 1
1519 1 80 VAL QG 1 82 PHE QB . . 3.500 3.318 3.158 3.443 . 0 0 "[ . 1 . 2]" 1
1520 1 80 VAL QG 1 82 PHE QD . . 5.160 4.831 4.577 5.066 . 0 0 "[ . 1 . 2]" 1
1521 1 80 VAL MG1 1 81 PHE H . . 4.250 2.401 1.955 4.109 . 0 0 "[ . 1 . 2]" 1
1522 1 80 VAL MG2 1 81 PHE H . . 4.250 3.941 2.971 4.085 . 0 0 "[ . 1 . 2]" 1
1523 1 81 PHE H 1 81 PHE HB2 . . 4.190 3.231 3.083 3.338 . 0 0 "[ . 1 . 2]" 1
1524 1 81 PHE H 1 81 PHE HB3 . . 3.860 2.530 2.425 2.632 . 0 0 "[ . 1 . 2]" 1
1525 1 81 PHE HA 1 81 PHE QD . . 4.460 2.964 2.565 3.178 . 0 0 "[ . 1 . 2]" 1
1526 1 81 PHE HA 1 82 PHE H . . 3.140 2.166 2.155 2.197 . 0 0 "[ . 1 . 2]" 1
1527 1 81 PHE HB2 1 82 PHE H . . 4.820 4.058 3.953 4.176 . 0 0 "[ . 1 . 2]" 1
1528 1 81 PHE HB2 1 94 TYR QD . . 4.960 4.928 4.870 4.968 0.008 18 0 "[ . 1 . 2]" 1
1529 1 81 PHE QD 1 82 PHE H . . 4.450 3.427 2.969 3.580 . 0 0 "[ . 1 . 2]" 1
1530 1 81 PHE QD 1 83 VAL QG . . 4.460 3.550 3.200 4.440 . 0 0 "[ . 1 . 2]" 1
1531 1 81 PHE QD 1 111 ILE MD . . 4.530 4.162 3.820 4.430 . 0 0 "[ . 1 . 2]" 1
1532 1 81 PHE QE 1 83 VAL QG . . 3.790 2.271 1.919 3.079 . 0 0 "[ . 1 . 2]" 1
1533 1 81 PHE QE 1 94 TYR QD . . 4.780 4.177 3.767 4.551 . 0 0 "[ . 1 . 2]" 1
1534 1 81 PHE QE 1 94 TYR QE . . 4.540 2.413 2.033 2.906 . 0 0 "[ . 1 . 2]" 1
1535 1 81 PHE QE 1 111 ILE MD . . 4.120 3.466 2.936 3.867 . 0 0 "[ . 1 . 2]" 1
1536 1 81 PHE HZ 1 83 VAL QG . . 4.460 2.026 1.852 2.726 . 0 0 "[ . 1 . 2]" 1
1537 1 81 PHE HZ 1 94 TYR QE . . 4.520 3.011 2.420 3.571 . 0 0 "[ . 1 . 2]" 1
1538 1 81 PHE HZ 1 111 ILE MD . . 4.610 4.271 3.383 4.618 0.008 6 0 "[ . 1 . 2]" 1
1539 1 82 PHE H 1 82 PHE HB2 . . 3.840 3.469 3.270 3.647 . 0 0 "[ . 1 . 2]" 1
1540 1 82 PHE H 1 82 PHE HB3 . . 3.840 2.692 2.609 2.803 . 0 0 "[ . 1 . 2]" 1
1541 1 82 PHE H 1 83 VAL QG . . 4.850 3.780 3.596 4.871 0.021 6 0 "[ . 1 . 2]" 1
1542 1 82 PHE HA 1 82 PHE QD . . 3.900 3.105 2.762 3.343 . 0 0 "[ . 1 . 2]" 1
1543 1 82 PHE HA 1 83 VAL H . . 3.100 2.298 2.186 2.348 . 0 0 "[ . 1 . 2]" 1
1544 1 82 PHE HA 1 83 VAL QG . . 4.670 3.492 3.110 4.099 . 0 0 "[ . 1 . 2]" 1
1545 1 82 PHE QB 1 83 VAL H . . 4.420 3.420 3.309 3.649 . 0 0 "[ . 1 . 2]" 1
1546 1 82 PHE QD 1 83 VAL H . . 4.150 3.044 2.631 3.241 . 0 0 "[ . 1 . 2]" 1
1547 1 82 PHE QE 1 83 VAL H . . 5.500 3.883 3.602 4.197 . 0 0 "[ . 1 . 2]" 1
1548 1 82 PHE QE 1 84 ARG H . . 4.680 3.231 2.592 4.144 . 0 0 "[ . 1 . 2]" 1
1549 1 82 PHE QE 1 84 ARG HA . . 3.920 2.923 2.426 3.610 . 0 0 "[ . 1 . 2]" 1
1550 1 82 PHE QE 1 84 ARG QB . . 4.000 3.454 3.043 3.981 . 0 0 "[ . 1 . 2]" 1
1551 1 82 PHE HZ 1 84 ARG HA . . 4.100 2.648 2.132 3.377 . 0 0 "[ . 1 . 2]" 1
1552 1 82 PHE HZ 1 84 ARG QB . . 4.850 4.325 3.854 4.825 . 0 0 "[ . 1 . 2]" 1
1553 1 82 PHE HZ 1 84 ARG QG . . 4.980 4.341 3.165 4.975 . 0 0 "[ . 1 . 2]" 1
1554 1 83 VAL H 1 83 VAL HB . . 4.010 2.835 2.722 2.989 . 0 0 "[ . 1 . 2]" 1
1555 1 83 VAL H 1 83 VAL QG . . 3.750 2.922 2.570 3.062 . 0 0 "[ . 1 . 2]" 1
1556 1 83 VAL HA 1 83 VAL MG1 . . 3.340 2.432 2.227 3.141 . 0 0 "[ . 1 . 2]" 1
1557 1 83 VAL HA 1 83 VAL QG . . 2.900 2.100 1.977 2.179 . 0 0 "[ . 1 . 2]" 1
1558 1 83 VAL HA 1 83 VAL MG2 . . 3.340 2.332 1.998 2.509 . 0 0 "[ . 1 . 2]" 1
1559 1 83 VAL HA 1 84 ARG H . . 3.040 2.164 2.140 2.269 . 0 0 "[ . 1 . 2]" 1
1560 1 83 VAL HA 1 84 ARG HA . . 4.560 4.353 4.306 4.408 . 0 0 "[ . 1 . 2]" 1
1561 1 83 VAL HA 1 84 ARG QB . . 4.270 4.096 4.039 4.174 . 0 0 "[ . 1 . 2]" 1
1562 1 83 VAL HA 1 85 GLN H . . 4.570 4.441 4.127 4.573 0.003 7 0 "[ . 1 . 2]" 1
1563 1 83 VAL QG 1 84 ARG H . . 3.550 2.478 1.932 2.833 . 0 0 "[ . 1 . 2]" 1
1564 1 83 VAL QG 1 84 ARG HA . . 4.620 4.065 3.821 4.226 . 0 0 "[ . 1 . 2]" 1
1565 1 83 VAL QG 1 85 GLN H . . 3.280 2.297 1.847 2.669 . 0 0 "[ . 1 . 2]" 1
1566 1 83 VAL QG 1 85 GLN HA . . 4.780 3.767 3.403 4.133 . 0 0 "[ . 1 . 2]" 1
1567 1 83 VAL QG 1 86 ALA H . . 4.190 3.880 3.306 4.130 . 0 0 "[ . 1 . 2]" 1
1568 1 83 VAL QG 1 86 ALA HA . . 3.380 2.878 2.403 3.354 . 0 0 "[ . 1 . 2]" 1
1569 1 83 VAL QG 1 86 ALA MB . . 4.010 3.506 2.472 3.989 . 0 0 "[ . 1 . 2]" 1
1570 1 83 VAL QG 1 87 ALA H . . 4.240 3.913 3.468 4.241 0.001 11 0 "[ . 1 . 2]" 1
1571 1 83 VAL QG 1 87 ALA MB . . 4.960 4.569 4.218 4.964 0.004 3 0 "[ . 1 . 2]" 1
1572 1 84 ARG H 1 84 ARG QB . . 3.180 2.231 2.133 2.284 . 0 0 "[ . 1 . 2]" 1
1573 1 84 ARG H 1 84 ARG QD . . 4.510 4.295 3.808 4.518 0.008 7 0 "[ . 1 . 2]" 1
1574 1 84 ARG H 1 84 ARG HG2 . . 4.760 4.538 4.360 4.662 . 0 0 "[ . 1 . 2]" 1
1575 1 84 ARG H 1 84 ARG QG . . 4.120 3.972 3.749 4.079 . 0 0 "[ . 1 . 2]" 1
1576 1 84 ARG H 1 84 ARG HG3 . . 4.760 4.397 4.004 4.550 . 0 0 "[ . 1 . 2]" 1
1577 1 84 ARG H 1 85 GLN H . . 3.380 3.076 2.769 3.307 . 0 0 "[ . 1 . 2]" 1
1578 1 84 ARG HA 1 84 ARG QD . . 4.240 3.524 2.176 4.202 . 0 0 "[ . 1 . 2]" 1
1579 1 84 ARG HA 1 84 ARG HG2 . . 3.950 3.335 2.586 3.882 . 0 0 "[ . 1 . 2]" 1
1580 1 84 ARG HA 1 84 ARG QG . . 3.340 2.536 2.222 3.060 . 0 0 "[ . 1 . 2]" 1
1581 1 84 ARG HA 1 84 ARG HG3 . . 3.950 2.659 2.284 3.232 . 0 0 "[ . 1 . 2]" 1
1582 1 84 ARG QB 1 84 ARG QD . . 3.240 2.141 2.050 2.293 . 0 0 "[ . 1 . 2]" 1
1583 1 84 ARG QB 1 84 ARG HE . . 4.530 3.665 2.636 4.285 . 0 0 "[ . 1 . 2]" 1
1584 1 84 ARG QB 1 85 GLN H . . 3.360 2.184 1.952 2.578 . 0 0 "[ . 1 . 2]" 1
1585 1 84 ARG QB 1 85 GLN QG . . 3.980 2.947 2.401 3.600 . 0 0 "[ . 1 . 2]" 1
1586 1 84 ARG QD 1 85 GLN QG . . 4.360 3.680 2.247 4.306 . 0 0 "[ . 1 . 2]" 1
1587 1 84 ARG QG 1 85 GLN H . . 4.210 3.283 2.851 3.838 . 0 0 "[ . 1 . 2]" 1
1588 1 84 ARG QG 1 85 GLN QG . . 3.350 2.658 2.003 3.348 . 0 0 "[ . 1 . 2]" 1
1589 1 85 GLN H 1 85 GLN HB2 . . 3.960 3.344 2.608 3.906 . 0 0 "[ . 1 . 2]" 1
1590 1 85 GLN H 1 85 GLN QB . . 3.200 2.919 2.561 3.192 . 0 0 "[ . 1 . 2]" 1
1591 1 85 GLN H 1 85 GLN HB3 . . 3.960 3.527 3.071 3.886 . 0 0 "[ . 1 . 2]" 1
1592 1 85 GLN H 1 85 GLN HG2 . . 4.320 3.054 2.125 4.231 . 0 0 "[ . 1 . 2]" 1
1593 1 85 GLN H 1 85 GLN QG . . 3.720 2.572 2.100 3.340 . 0 0 "[ . 1 . 2]" 1
1594 1 85 GLN H 1 85 GLN HG3 . . 4.320 3.090 2.256 4.196 . 0 0 "[ . 1 . 2]" 1
1595 1 85 GLN H 1 86 ALA H . . 4.460 4.281 4.127 4.396 . 0 0 "[ . 1 . 2]" 1
1596 1 85 GLN HA 1 85 GLN HG2 . . 3.950 3.261 2.328 3.778 . 0 0 "[ . 1 . 2]" 1
1597 1 85 GLN HA 1 85 GLN QG . . 3.420 2.951 2.258 3.340 . 0 0 "[ . 1 . 2]" 1
1598 1 85 GLN HA 1 85 GLN HG3 . . 3.950 3.513 2.685 3.922 . 0 0 "[ . 1 . 2]" 1
1599 1 85 GLN HA 1 86 ALA H . . 2.870 2.160 2.142 2.200 . 0 0 "[ . 1 . 2]" 1
1600 1 85 GLN HA 1 86 ALA MB . . 4.260 3.959 3.890 3.998 . 0 0 "[ . 1 . 2]" 1
1601 1 85 GLN HB2 1 86 ALA H . . 4.320 3.644 3.025 4.321 0.001 13 0 "[ . 1 . 2]" 1
1602 1 85 GLN HB3 1 86 ALA H . . 4.320 3.758 3.175 4.271 . 0 0 "[ . 1 . 2]" 1
1603 1 85 GLN QG 1 86 ALA H . . 4.460 4.202 3.850 4.458 . 0 0 "[ . 1 . 2]" 1
1604 1 86 ALA H 1 86 ALA MB . . 3.040 2.228 2.053 2.329 . 0 0 "[ . 1 . 2]" 1
1605 1 86 ALA H 1 87 ALA H . . 4.680 4.060 3.256 4.633 . 0 0 "[ . 1 . 2]" 1
1606 1 86 ALA HA 1 87 ALA H . . 3.270 2.330 2.157 2.748 . 0 0 "[ . 1 . 2]" 1
1607 1 86 ALA HA 1 87 ALA MB . . 4.230 4.058 3.706 4.276 0.046 9 0 "[ . 1 . 2]" 1
1608 1 86 ALA HA 1 113 VAL MG1 . . 4.840 4.506 4.213 4.730 . 0 0 "[ . 1 . 2]" 1
1609 1 86 ALA MB 1 87 ALA H . . 3.610 3.436 2.446 3.719 0.109 12 0 "[ . 1 . 2]" 1
1610 1 86 ALA MB 1 113 VAL HA . . 4.680 4.420 4.146 4.695 0.015 3 0 "[ . 1 . 2]" 1
1611 1 86 ALA MB 1 113 VAL MG1 . . 3.110 2.874 2.472 3.125 0.015 17 0 "[ . 1 . 2]" 1
1612 1 86 ALA MB 1 113 VAL MG2 . . 3.290 2.399 1.949 2.989 . 0 0 "[ . 1 . 2]" 1
1613 1 87 ALA H 1 87 ALA MB . . 3.250 2.206 2.044 2.765 . 0 0 "[ . 1 . 2]" 1
1614 1 87 ALA H 1 90 ASP H . . 4.820 3.751 3.405 4.444 . 0 0 "[ . 1 . 2]" 1
1615 1 87 ALA H 1 90 ASP QB . . 4.560 3.119 2.493 4.143 . 0 0 "[ . 1 . 2]" 1
1616 1 87 ALA H 1 113 VAL MG1 . . 4.600 4.196 3.025 4.594 . 0 0 "[ . 1 . 2]" 1
1617 1 87 ALA H 1 113 VAL MG2 . . 4.730 4.065 2.866 4.672 . 0 0 "[ . 1 . 2]" 1
1618 1 87 ALA MB 1 88 ARG H . . 3.450 2.791 2.206 3.017 . 0 0 "[ . 1 . 2]" 1
1619 1 87 ALA MB 1 88 ARG HA . . 4.570 4.476 4.206 4.562 . 0 0 "[ . 1 . 2]" 1
1620 1 87 ALA MB 1 89 SER H . . 4.280 2.389 2.181 2.725 . 0 0 "[ . 1 . 2]" 1
1621 1 87 ALA MB 1 90 ASP H . . 3.870 2.974 2.684 3.180 . 0 0 "[ . 1 . 2]" 1
1622 1 87 ALA MB 1 113 VAL MG1 . . 4.370 4.222 3.933 4.371 0.001 18 0 "[ . 1 . 2]" 1
1623 1 88 ARG H 1 88 ARG HB2 . . 4.020 2.532 2.218 2.940 . 0 0 "[ . 1 . 2]" 1
1624 1 88 ARG H 1 88 ARG HB3 . . 4.020 3.589 3.514 3.621 . 0 0 "[ . 1 . 2]" 1
1625 1 88 ARG H 1 88 ARG QD . . 4.540 3.717 1.994 4.323 . 0 0 "[ . 1 . 2]" 1
1626 1 88 ARG H 1 88 ARG HG2 . . 4.300 3.143 1.925 4.153 . 0 0 "[ . 1 . 2]" 1
1627 1 88 ARG H 1 88 ARG QG . . 3.720 2.347 1.904 3.387 . 0 0 "[ . 1 . 2]" 1
1628 1 88 ARG H 1 88 ARG HG3 . . 4.300 2.615 1.993 3.589 . 0 0 "[ . 1 . 2]" 1
1629 1 88 ARG HA 1 88 ARG QD . . 4.240 3.619 2.025 4.162 . 0 0 "[ . 1 . 2]" 1
1630 1 88 ARG HA 1 88 ARG HG2 . . 4.250 2.647 2.332 3.488 . 0 0 "[ . 1 . 2]" 1
1631 1 88 ARG HA 1 88 ARG QG . . 3.540 2.405 2.164 2.840 . 0 0 "[ . 1 . 2]" 1
1632 1 88 ARG HA 1 88 ARG HG3 . . 4.250 3.097 2.186 3.883 . 0 0 "[ . 1 . 2]" 1
1633 1 88 ARG HA 1 90 ASP H . . 4.880 4.513 3.868 4.765 . 0 0 "[ . 1 . 2]" 1
1634 1 88 ARG HA 1 91 SER H . . 4.340 3.701 3.413 4.178 . 0 0 "[ . 1 . 2]" 1
1635 1 88 ARG HA 1 113 VAL H . . 4.510 4.411 4.214 4.516 0.006 7 0 "[ . 1 . 2]" 1
1636 1 88 ARG HA 1 113 VAL HB . . 3.170 2.154 1.998 2.422 . 0 0 "[ . 1 . 2]" 1
1637 1 88 ARG HA 1 113 VAL MG1 . . 3.690 2.288 1.959 2.793 . 0 0 "[ . 1 . 2]" 1
1638 1 88 ARG HA 1 113 VAL MG2 . . 4.140 3.253 2.846 3.671 . 0 0 "[ . 1 . 2]" 1
1639 1 88 ARG QB 1 88 ARG QD . . 3.000 2.285 2.096 2.595 . 0 0 "[ . 1 . 2]" 1
1640 1 88 ARG HB2 1 88 ARG QD . . 3.470 2.791 2.203 3.457 . 0 0 "[ . 1 . 2]" 1
1641 1 88 ARG HB3 1 88 ARG QD . . 3.470 2.638 2.156 3.498 0.028 6 0 "[ . 1 . 2]" 1
1642 1 88 ARG QD 1 113 VAL MG1 . . 4.320 3.727 2.529 4.277 . 0 0 "[ . 1 . 2]" 1
1643 1 88 ARG QD 1 115 GLU H . . 4.560 3.899 3.166 4.496 . 0 0 "[ . 1 . 2]" 1
1644 1 88 ARG QD 1 115 GLU HB2 . . 4.840 4.427 3.691 4.831 . 0 0 "[ . 1 . 2]" 1
1645 1 88 ARG QD 1 115 GLU QB . . 4.230 3.731 2.116 4.229 . 0 0 "[ . 1 . 2]" 1
1646 1 88 ARG QD 1 115 GLU HB3 . . 4.840 4.164 2.129 4.818 . 0 0 "[ . 1 . 2]" 1
1647 1 88 ARG QD 1 115 GLU HG2 . . 4.310 2.505 2.096 3.529 . 0 0 "[ . 1 . 2]" 1
1648 1 88 ARG QD 1 115 GLU QG . . 3.640 2.217 1.872 3.378 . 0 0 "[ . 1 . 2]" 1
1649 1 88 ARG QD 1 115 GLU HG3 . . 4.310 2.770 2.077 4.310 0.000 3 0 "[ . 1 . 2]" 1
1650 1 88 ARG QG 1 113 VAL MG1 . . 4.620 2.602 2.158 3.410 . 0 0 "[ . 1 . 2]" 1
1651 1 88 ARG QG 1 113 VAL MG2 . . 5.200 4.576 4.223 5.186 . 0 0 "[ . 1 . 2]" 1
1652 1 89 SER HA 1 91 SER H . . 4.360 4.108 3.653 4.340 . 0 0 "[ . 1 . 2]" 1
1653 1 90 ASP H 1 90 ASP HB2 . . 4.000 2.475 2.216 2.811 . 0 0 "[ . 1 . 2]" 1
1654 1 90 ASP H 1 90 ASP QB . . 3.450 2.407 2.150 2.716 . 0 0 "[ . 1 . 2]" 1
1655 1 90 ASP H 1 90 ASP HB3 . . 4.000 3.427 2.551 3.622 . 0 0 "[ . 1 . 2]" 1
1656 1 90 ASP H 1 91 SER H . . 3.420 2.910 2.510 3.073 . 0 0 "[ . 1 . 2]" 1
1657 1 90 ASP H 1 113 VAL MG2 . . 4.550 4.022 3.412 4.425 . 0 0 "[ . 1 . 2]" 1
1658 1 90 ASP HA 1 94 TYR HH . . 3.900 3.501 2.820 3.900 0.000 2 0 "[ . 1 . 2]" 1
1659 1 90 ASP QB 1 91 SER H . . 4.070 2.611 2.390 2.831 . 0 0 "[ . 1 . 2]" 1
1660 1 90 ASP QB 1 113 VAL MG2 . . 3.610 2.556 2.112 3.007 . 0 0 "[ . 1 . 2]" 1
1661 1 90 ASP HB2 1 91 SER H . . 4.700 2.919 2.424 3.873 . 0 0 "[ . 1 . 2]" 1
1662 1 90 ASP HB2 1 113 VAL MG2 . . 4.270 2.884 2.138 4.257 . 0 0 "[ . 1 . 2]" 1
1663 1 90 ASP HB3 1 91 SER H . . 4.700 3.373 2.479 3.819 . 0 0 "[ . 1 . 2]" 1
1664 1 90 ASP HB3 1 113 VAL MG2 . . 4.270 3.385 2.222 4.034 . 0 0 "[ . 1 . 2]" 1
1665 1 91 SER H 1 91 SER HB2 . . 3.860 3.049 2.181 3.606 . 0 0 "[ . 1 . 2]" 1
1666 1 91 SER H 1 91 SER QB . . 3.350 2.333 2.133 2.809 . 0 0 "[ . 1 . 2]" 1
1667 1 91 SER H 1 91 SER HB3 . . 3.860 2.720 2.205 3.611 . 0 0 "[ . 1 . 2]" 1
1668 1 91 SER H 1 91 SER HG . . 4.050 3.245 2.262 4.044 . 0 0 "[ . 1 . 2]" 1
1669 1 91 SER H 1 92 GLY H . . 4.900 4.476 4.357 4.633 . 0 0 "[ . 1 . 2]" 1
1670 1 91 SER H 1 113 VAL HB . . 4.490 3.503 3.188 3.975 . 0 0 "[ . 1 . 2]" 1
1671 1 91 SER H 1 113 VAL MG2 . . 4.500 2.539 1.931 3.192 . 0 0 "[ . 1 . 2]" 1
1672 1 91 SER HA 1 92 GLY H . . 3.080 2.169 2.142 2.246 . 0 0 "[ . 1 . 2]" 1
1673 1 91 SER HA 1 92 GLY QA . . 4.440 3.919 3.910 3.939 . 0 0 "[ . 1 . 2]" 1
1674 1 91 SER HA 1 94 TYR QE . . 5.310 4.682 3.790 5.110 . 0 0 "[ . 1 . 2]" 1
1675 1 91 SER HA 1 111 ILE H . . 5.010 4.772 4.303 5.000 . 0 0 "[ . 1 . 2]" 1
1676 1 91 SER HA 1 111 ILE HB . . 4.120 3.234 2.624 3.595 . 0 0 "[ . 1 . 2]" 1
1677 1 91 SER HA 1 111 ILE MG . . 3.800 2.751 2.132 3.417 . 0 0 "[ . 1 . 2]" 1
1678 1 91 SER HA 1 112 ARG HA . . 4.340 3.547 3.085 4.152 . 0 0 "[ . 1 . 2]" 1
1679 1 91 SER HA 1 113 VAL H . . 4.210 3.885 3.428 4.217 0.007 3 0 "[ . 1 . 2]" 1
1680 1 91 SER HA 1 113 VAL MG2 . . 4.360 2.919 2.369 3.558 . 0 0 "[ . 1 . 2]" 1
1681 1 91 SER QB 1 92 GLY H . . 3.550 3.476 3.355 3.557 0.007 3 0 "[ . 1 . 2]" 1
1682 1 91 SER QB 1 92 GLY QA . . 4.680 4.091 3.856 4.325 . 0 0 "[ . 1 . 2]" 1
1683 1 91 SER QB 1 112 ARG HA . . 3.810 2.784 2.089 3.813 0.003 3 0 "[ . 1 . 2]" 1
1684 1 91 SER QB 1 113 VAL H . . 4.380 2.508 1.955 3.305 . 0 0 "[ . 1 . 2]" 1
1685 1 91 SER HB2 1 112 ARG HA . . 4.470 3.268 2.102 4.465 . 0 0 "[ . 1 . 2]" 1
1686 1 91 SER HB3 1 112 ARG HA . . 4.470 3.565 2.431 4.413 . 0 0 "[ . 1 . 2]" 1
1687 1 92 GLY H 1 93 GLU H . . 4.450 4.223 4.097 4.308 . 0 0 "[ . 1 . 2]" 1
1688 1 92 GLY H 1 94 TYR QE . . 5.000 3.847 3.158 4.243 . 0 0 "[ . 1 . 2]" 1
1689 1 92 GLY H 1 111 ILE H . . 3.750 3.260 2.711 3.752 0.002 2 0 "[ . 1 . 2]" 1
1690 1 92 GLY H 1 111 ILE HB . . 3.990 2.521 2.255 2.876 . 0 0 "[ . 1 . 2]" 1
1691 1 92 GLY H 1 111 ILE MG . . 4.240 3.428 2.840 3.855 . 0 0 "[ . 1 . 2]" 1
1692 1 92 GLY H 1 112 ARG HA . . 5.250 4.319 3.917 4.884 . 0 0 "[ . 1 . 2]" 1
1693 1 92 GLY QA 1 93 GLU QB . . 4.110 3.696 3.658 3.742 . 0 0 "[ . 1 . 2]" 1
1694 1 92 GLY QA 1 94 TYR QE . . 5.340 3.759 3.488 3.931 . 0 0 "[ . 1 . 2]" 1
1695 1 92 GLY HA2 1 93 GLU H . . 3.240 2.965 2.858 3.092 . 0 0 "[ . 1 . 2]" 1
1696 1 92 GLY HA2 1 93 GLU QB . . 4.740 4.039 3.963 4.110 . 0 0 "[ . 1 . 2]" 1
1697 1 92 GLY HA3 1 93 GLU H . . 3.240 2.239 2.172 2.308 . 0 0 "[ . 1 . 2]" 1
1698 1 92 GLY HA3 1 93 GLU QB . . 4.740 4.285 4.201 4.367 . 0 0 "[ . 1 . 2]" 1
1699 1 93 GLU H 1 93 GLU QB . . 3.210 2.583 2.495 2.620 . 0 0 "[ . 1 . 2]" 1
1700 1 93 GLU H 1 93 GLU HG2 . . 5.240 4.657 4.544 4.974 . 0 0 "[ . 1 . 2]" 1
1701 1 93 GLU H 1 93 GLU QG . . 4.390 4.189 4.129 4.275 . 0 0 "[ . 1 . 2]" 1
1702 1 93 GLU H 1 93 GLU HG3 . . 5.240 4.770 4.582 4.997 . 0 0 "[ . 1 . 2]" 1
1703 1 93 GLU H 1 94 TYR H . . 4.520 4.095 3.959 4.221 . 0 0 "[ . 1 . 2]" 1
1704 1 93 GLU HA 1 93 GLU HG2 . . 4.140 2.794 2.347 3.636 . 0 0 "[ . 1 . 2]" 1
1705 1 93 GLU HA 1 93 GLU HG3 . . 4.140 2.854 2.229 3.681 . 0 0 "[ . 1 . 2]" 1
1706 1 93 GLU HA 1 94 TYR H . . 3.150 2.149 2.138 2.171 . 0 0 "[ . 1 . 2]" 1
1707 1 93 GLU HA 1 94 TYR QD . . 4.480 3.269 3.134 3.471 . 0 0 "[ . 1 . 2]" 1
1708 1 93 GLU HA 1 108 THR MG . . 4.270 4.151 3.967 4.268 . 0 0 "[ . 1 . 2]" 1
1709 1 93 GLU HA 1 110 ARG HA . . 3.680 2.592 2.347 2.876 . 0 0 "[ . 1 . 2]" 1
1710 1 93 GLU HA 1 110 ARG QG . . 4.510 3.813 3.345 4.211 . 0 0 "[ . 1 . 2]" 1
1711 1 93 GLU HA 1 111 ILE H . . 4.130 3.222 2.941 3.442 . 0 0 "[ . 1 . 2]" 1
1712 1 93 GLU QB 1 94 TYR H . . 3.990 3.871 3.778 3.940 . 0 0 "[ . 1 . 2]" 1
1713 1 93 GLU QB 1 108 THR MG . . 3.800 3.621 3.406 3.772 . 0 0 "[ . 1 . 2]" 1
1714 1 93 GLU QB 1 110 ARG HA . . 4.420 3.870 3.413 4.233 . 0 0 "[ . 1 . 2]" 1
1715 1 93 GLU QB 1 110 ARG QG . . 4.340 3.684 3.278 4.297 . 0 0 "[ . 1 . 2]" 1
1716 1 93 GLU QG 1 94 TYR H . . 4.270 3.157 2.816 3.408 . 0 0 "[ . 1 . 2]" 1
1717 1 93 GLU QG 1 94 TYR HA . . 5.340 4.611 4.386 4.863 . 0 0 "[ . 1 . 2]" 1
1718 1 93 GLU QG 1 108 THR HB . . 4.700 4.496 4.247 4.645 . 0 0 "[ . 1 . 2]" 1
1719 1 93 GLU QG 1 108 THR MG . . 3.230 1.975 1.830 2.168 . 0 0 "[ . 1 . 2]" 1
1720 1 93 GLU QG 1 110 ARG HA . . 4.660 3.102 2.627 3.574 . 0 0 "[ . 1 . 2]" 1
1721 1 93 GLU QG 1 110 ARG QG . . 3.590 2.698 1.978 3.488 . 0 0 "[ . 1 . 2]" 1
1722 1 93 GLU HG2 1 94 TYR H . . 4.890 3.464 2.845 4.785 . 0 0 "[ . 1 . 2]" 1
1723 1 93 GLU HG2 1 108 THR HB . . 5.330 4.921 4.471 5.217 . 0 0 "[ . 1 . 2]" 1
1724 1 93 GLU HG2 1 108 THR MG . . 3.790 2.097 1.856 2.360 . 0 0 "[ . 1 . 2]" 1
1725 1 93 GLU HG2 1 110 ARG HA . . 5.500 4.006 3.039 4.806 . 0 0 "[ . 1 . 2]" 1
1726 1 93 GLU HG2 1 110 ARG HG2 . . 4.700 4.199 2.836 4.693 . 0 0 "[ . 1 . 2]" 1
1727 1 93 GLU HG2 1 110 ARG HG3 . . 4.700 4.228 2.841 4.690 . 0 0 "[ . 1 . 2]" 1
1728 1 93 GLU HG3 1 94 TYR H . . 4.890 4.098 3.185 4.840 . 0 0 "[ . 1 . 2]" 1
1729 1 93 GLU HG3 1 108 THR HB . . 5.330 5.221 4.918 5.335 0.005 7 0 "[ . 1 . 2]" 1
1730 1 93 GLU HG3 1 108 THR MG . . 3.790 2.490 2.194 2.793 . 0 0 "[ . 1 . 2]" 1
1731 1 93 GLU HG3 1 110 ARG HA . . 5.500 3.548 2.660 4.754 . 0 0 "[ . 1 . 2]" 1
1732 1 93 GLU HG3 1 110 ARG HG2 . . 4.700 3.277 2.050 4.583 . 0 0 "[ . 1 . 2]" 1
1733 1 93 GLU HG3 1 110 ARG HG3 . . 4.700 3.500 2.016 4.661 . 0 0 "[ . 1 . 2]" 1
1734 1 94 TYR H 1 94 TYR QB . . 3.690 2.314 2.264 2.355 . 0 0 "[ . 1 . 2]" 1
1735 1 94 TYR H 1 94 TYR QD . . 3.930 2.250 2.020 2.457 . 0 0 "[ . 1 . 2]" 1
1736 1 94 TYR H 1 108 THR MG . . 4.690 4.279 3.901 4.499 . 0 0 "[ . 1 . 2]" 1
1737 1 94 TYR H 1 109 ILE HB . . 4.100 2.955 2.634 3.537 . 0 0 "[ . 1 . 2]" 1
1738 1 94 TYR H 1 109 ILE MG . . 4.310 3.500 3.229 3.806 . 0 0 "[ . 1 . 2]" 1
1739 1 94 TYR H 1 110 ARG HA . . 4.350 3.675 3.331 4.007 . 0 0 "[ . 1 . 2]" 1
1740 1 94 TYR H 1 111 ILE H . . 4.590 4.170 3.934 4.411 . 0 0 "[ . 1 . 2]" 1
1741 1 94 TYR HA 1 94 TYR QD . . 4.270 2.943 2.708 3.095 . 0 0 "[ . 1 . 2]" 1
1742 1 94 TYR HA 1 95 GLU H . . 3.170 2.158 2.138 2.344 . 0 0 "[ . 1 . 2]" 1
1743 1 94 TYR HA 1 109 ILE MG . . 5.500 5.362 5.185 5.509 0.009 17 0 "[ . 1 . 2]" 1
1744 1 94 TYR QB 1 95 GLU H . . 3.900 3.275 2.536 3.445 . 0 0 "[ . 1 . 2]" 1
1745 1 94 TYR QB 1 109 ILE HB . . 4.110 2.090 1.981 2.325 . 0 0 "[ . 1 . 2]" 1
1746 1 94 TYR QB 1 109 ILE MD . . 4.650 2.763 2.456 3.163 . 0 0 "[ . 1 . 2]" 1
1747 1 94 TYR QB 1 109 ILE MG . . 4.260 2.902 2.666 3.120 . 0 0 "[ . 1 . 2]" 1
1748 1 94 TYR QB 1 111 ILE MD . . 5.340 3.036 2.576 3.457 . 0 0 "[ . 1 . 2]" 1
1749 1 94 TYR HB2 1 95 GLU H . . 4.610 4.334 3.837 4.427 . 0 0 "[ . 1 . 2]" 1
1750 1 94 TYR HB2 1 109 ILE HB . . 4.680 2.113 1.996 2.353 . 0 0 "[ . 1 . 2]" 1
1751 1 94 TYR HB3 1 95 GLU H . . 4.610 3.393 2.574 3.593 . 0 0 "[ . 1 . 2]" 1
1752 1 94 TYR HB3 1 109 ILE HB . . 4.680 3.316 3.075 3.635 . 0 0 "[ . 1 . 2]" 1
1753 1 94 TYR QD 1 95 GLU H . . 5.250 4.501 4.039 4.622 . 0 0 "[ . 1 . 2]" 1
1754 1 94 TYR QD 1 109 ILE MD . . 5.230 4.284 4.013 4.657 . 0 0 "[ . 1 . 2]" 1
1755 1 94 TYR QD 1 109 ILE MG . . 4.490 4.140 3.889 4.320 . 0 0 "[ . 1 . 2]" 1
1756 1 94 TYR QD 1 111 ILE H . . 4.760 4.367 4.072 4.582 . 0 0 "[ . 1 . 2]" 1
1757 1 94 TYR QD 1 111 ILE HB . . 4.760 3.771 3.468 4.043 . 0 0 "[ . 1 . 2]" 1
1758 1 94 TYR QD 1 111 ILE MD . . 3.920 2.687 2.379 3.188 . 0 0 "[ . 1 . 2]" 1
1759 1 94 TYR QD 1 111 ILE HG13 . . 4.950 3.634 3.314 3.942 . 0 0 "[ . 1 . 2]" 1
1760 1 94 TYR QE 1 111 ILE H . . 5.500 5.306 4.945 5.499 . 0 0 "[ . 1 . 2]" 1
1761 1 94 TYR QE 1 111 ILE HB . . 3.920 3.615 3.286 3.852 . 0 0 "[ . 1 . 2]" 1
1762 1 94 TYR QE 1 111 ILE MD . . 3.660 2.664 2.308 2.908 . 0 0 "[ . 1 . 2]" 1
1763 1 94 TYR QE 1 111 ILE HG12 . . 5.500 5.392 5.131 5.508 0.008 17 0 "[ . 1 . 2]" 1
1764 1 94 TYR QE 1 111 ILE HG13 . . 4.980 4.634 4.428 4.839 . 0 0 "[ . 1 . 2]" 1
1765 1 94 TYR QE 1 111 ILE MG . . 5.230 4.090 3.807 4.430 . 0 0 "[ . 1 . 2]" 1
1766 1 94 TYR HH 1 111 ILE MD . . 4.880 3.812 3.466 4.166 . 0 0 "[ . 1 . 2]" 1
1767 1 95 GLU H 1 95 GLU HG3 . . 5.340 4.600 4.337 4.762 . 0 0 "[ . 1 . 2]" 1
1768 1 95 GLU HA 1 96 LEU H . . 3.110 2.144 2.139 2.177 . 0 0 "[ . 1 . 2]" 1
1769 1 95 GLU HA 1 96 LEU HB3 . . 5.140 4.612 4.315 4.959 . 0 0 "[ . 1 . 2]" 1
1770 1 95 GLU HA 1 108 THR MG . . 4.660 3.812 3.525 4.151 . 0 0 "[ . 1 . 2]" 1
1771 1 95 GLU HA 1 109 ILE H . . 4.150 3.217 2.818 3.594 . 0 0 "[ . 1 . 2]" 1
1772 1 95 GLU QB 1 96 LEU H . . 4.240 3.809 3.613 3.918 . 0 0 "[ . 1 . 2]" 1
1773 1 95 GLU HG2 1 96 LEU H . . 4.310 3.123 2.525 3.707 . 0 0 "[ . 1 . 2]" 1
1774 1 95 GLU HG2 1 106 THR MG . . 4.790 4.307 3.809 4.774 . 0 0 "[ . 1 . 2]" 1
1775 1 95 GLU HG2 1 107 ALA H . . 4.840 3.082 2.701 3.761 . 0 0 "[ . 1 . 2]" 1
1776 1 95 GLU HG2 1 108 THR HA . . 4.710 4.067 2.832 4.528 . 0 0 "[ . 1 . 2]" 1
1777 1 95 GLU HG2 1 108 THR MG . . 5.500 5.156 3.850 5.478 . 0 0 "[ . 1 . 2]" 1
1778 1 95 GLU HG3 1 96 LEU H . . 4.880 3.891 3.389 4.801 . 0 0 "[ . 1 . 2]" 1
1779 1 95 GLU HG3 1 106 THR MG . . 5.460 4.929 4.429 5.439 . 0 0 "[ . 1 . 2]" 1
1780 1 95 GLU HG3 1 107 ALA H . . 5.500 3.810 3.069 5.002 . 0 0 "[ . 1 . 2]" 1
1781 1 95 GLU HG3 1 108 THR MG . . 4.470 4.061 3.668 4.469 . 0 0 "[ . 1 . 2]" 1
1782 1 96 LEU H 1 96 LEU HB2 . . 3.980 2.867 2.474 3.284 . 0 0 "[ . 1 . 2]" 1
1783 1 96 LEU H 1 96 LEU HB3 . . 3.730 2.558 2.301 2.847 . 0 0 "[ . 1 . 2]" 1
1784 1 96 LEU H 1 96 LEU MD1 . . 5.140 4.332 4.186 4.513 . 0 0 "[ . 1 . 2]" 1
1785 1 96 LEU H 1 96 LEU QD . . 4.280 3.807 3.651 3.922 . 0 0 "[ . 1 . 2]" 1
1786 1 96 LEU H 1 96 LEU MD2 . . 5.140 4.225 4.018 4.391 . 0 0 "[ . 1 . 2]" 1
1787 1 96 LEU H 1 96 LEU HG . . 4.870 4.406 4.186 4.732 . 0 0 "[ . 1 . 2]" 1
1788 1 96 LEU H 1 107 ALA H . . 3.730 3.371 3.091 3.577 . 0 0 "[ . 1 . 2]" 1
1789 1 96 LEU H 1 107 ALA MB . . 4.280 2.991 2.675 3.212 . 0 0 "[ . 1 . 2]" 1
1790 1 96 LEU H 1 108 THR HA . . 4.100 3.417 3.136 3.795 . 0 0 "[ . 1 . 2]" 1
1791 1 96 LEU H 1 109 ILE MD . . 5.090 3.748 3.124 4.248 . 0 0 "[ . 1 . 2]" 1
1792 1 96 LEU HA 1 96 LEU MD1 . . 4.410 2.801 1.982 3.828 . 0 0 "[ . 1 . 2]" 1
1793 1 96 LEU HA 1 96 LEU QD . . 3.170 2.309 1.912 2.800 . 0 0 "[ . 1 . 2]" 1
1794 1 96 LEU HA 1 96 LEU MD2 . . 4.410 3.345 1.928 4.017 . 0 0 "[ . 1 . 2]" 1
1795 1 96 LEU HA 1 97 SER H . . 3.100 2.146 2.139 2.198 . 0 0 "[ . 1 . 2]" 1
1796 1 96 LEU HA 1 97 SER HA . . 5.190 4.395 4.389 4.426 . 0 0 "[ . 1 . 2]" 1
1797 1 96 LEU HA 1 97 SER QB . . 4.950 4.528 4.335 4.738 . 0 0 "[ . 1 . 2]" 1
1798 1 96 LEU HB2 1 107 ALA MB . . 4.500 3.783 3.389 4.113 . 0 0 "[ . 1 . 2]" 1
1799 1 96 LEU HB2 1 109 ILE MD . . 4.160 2.786 2.055 3.268 . 0 0 "[ . 1 . 2]" 1
1800 1 96 LEU HB3 1 96 LEU MD1 . . 3.630 2.838 2.066 3.194 . 0 0 "[ . 1 . 2]" 1
1801 1 96 LEU HB3 1 96 LEU MD2 . . 3.630 2.326 2.081 3.179 . 0 0 "[ . 1 . 2]" 1
1802 1 96 LEU HB3 1 107 ALA H . . 4.580 4.332 3.846 4.583 0.003 8 0 "[ . 1 . 2]" 1
1803 1 96 LEU HB3 1 107 ALA MB . . 3.640 2.390 2.132 2.646 . 0 0 "[ . 1 . 2]" 1
1804 1 96 LEU QD 1 97 SER H . . 3.220 2.535 2.045 3.027 . 0 0 "[ . 1 . 2]" 1
1805 1 96 LEU QD 1 98 VAL MG1 . . 4.890 4.505 4.076 4.899 0.009 6 0 "[ . 1 . 2]" 1
1806 1 96 LEU QD 1 98 VAL MG2 . . 3.220 2.708 2.174 3.130 . 0 0 "[ . 1 . 2]" 1
1807 1 96 LEU QD 1 107 ALA MB . . 3.920 3.058 2.596 3.363 . 0 0 "[ . 1 . 2]" 1
1808 1 96 LEU QD 1 109 ILE MD . . 4.130 3.011 2.533 3.565 . 0 0 "[ . 1 . 2]" 1
1809 1 96 LEU MD1 1 98 VAL MG2 . . 3.850 3.270 2.340 3.855 0.005 17 0 "[ . 1 . 2]" 1
1810 1 96 LEU MD2 1 98 VAL MG2 . . 3.850 3.224 2.186 3.853 0.003 3 0 "[ . 1 . 2]" 1
1811 1 96 LEU HG 1 97 SER H . . 5.500 3.662 2.763 4.921 . 0 0 "[ . 1 . 2]" 1
1812 1 96 LEU HG 1 98 VAL MG2 . . 5.500 3.856 2.910 5.201 . 0 0 "[ . 1 . 2]" 1
1813 1 97 SER H 1 97 SER HB2 . . 3.820 2.951 2.537 3.671 . 0 0 "[ . 1 . 2]" 1
1814 1 97 SER H 1 97 SER HB3 . . 3.820 3.720 3.395 3.833 0.013 11 0 "[ . 1 . 2]" 1
1815 1 97 SER HA 1 98 VAL H . . 3.090 2.224 2.138 2.447 . 0 0 "[ . 1 . 2]" 1
1816 1 97 SER HA 1 98 VAL HA . . 5.500 4.404 4.374 4.506 . 0 0 "[ . 1 . 2]" 1
1817 1 97 SER HA 1 98 VAL HB . . 5.500 4.602 4.418 4.770 . 0 0 "[ . 1 . 2]" 1
1818 1 97 SER HA 1 98 VAL MG2 . . 4.280 3.586 3.271 3.842 . 0 0 "[ . 1 . 2]" 1
1819 1 97 SER HA 1 104 LYS QG . . 5.190 4.939 4.658 5.199 0.009 17 0 "[ . 1 . 2]" 1
1820 1 97 SER HA 1 105 ASP H . . 4.710 4.521 4.297 4.702 . 0 0 "[ . 1 . 2]" 1
1821 1 97 SER HA 1 106 THR HA . . 3.490 2.052 1.995 2.180 . 0 0 "[ . 1 . 2]" 1
1822 1 97 SER HA 1 106 THR HB . . 4.590 4.421 4.237 4.530 . 0 0 "[ . 1 . 2]" 1
1823 1 97 SER HA 1 106 THR MG . . 3.630 3.267 2.860 3.592 . 0 0 "[ . 1 . 2]" 1
1824 1 97 SER HA 1 107 ALA H . . 4.230 3.513 3.187 3.703 . 0 0 "[ . 1 . 2]" 1
1825 1 97 SER QB 1 98 VAL H . . 3.650 2.954 2.358 3.353 . 0 0 "[ . 1 . 2]" 1
1826 1 97 SER QB 1 98 VAL HA . . 4.780 4.257 3.967 4.417 . 0 0 "[ . 1 . 2]" 1
1827 1 97 SER QB 1 104 LYS QD . . 4.050 3.756 2.236 4.061 0.011 6 0 "[ . 1 . 2]" 1
1828 1 97 SER QB 1 104 LYS QE . . 3.980 3.483 2.879 3.983 0.003 5 0 "[ . 1 . 2]" 1
1829 1 97 SER QB 1 104 LYS QG . . 4.030 3.535 3.270 3.891 . 0 0 "[ . 1 . 2]" 1
1830 1 97 SER QB 1 105 ASP H . . 4.330 4.117 3.824 4.338 0.008 18 0 "[ . 1 . 2]" 1
1831 1 97 SER QB 1 106 THR HA . . 4.380 2.886 2.384 3.246 . 0 0 "[ . 1 . 2]" 1
1832 1 97 SER QB 1 106 THR MG . . 3.360 2.310 1.979 2.733 . 0 0 "[ . 1 . 2]" 1
1833 1 97 SER HB2 1 98 VAL H . . 4.390 3.705 2.407 4.310 . 0 0 "[ . 1 . 2]" 1
1834 1 97 SER HB2 1 98 VAL HA . . 5.500 4.696 4.067 5.106 . 0 0 "[ . 1 . 2]" 1
1835 1 97 SER HB2 1 106 THR HA . . 5.060 4.055 3.582 4.431 . 0 0 "[ . 1 . 2]" 1
1836 1 97 SER HB2 1 106 THR MG . . 3.900 3.509 2.925 3.818 . 0 0 "[ . 1 . 2]" 1
1837 1 97 SER HB3 1 98 VAL H . . 4.390 3.275 2.928 3.543 . 0 0 "[ . 1 . 2]" 1
1838 1 97 SER HB3 1 98 VAL HA . . 5.500 5.037 4.611 5.581 0.081 18 0 "[ . 1 . 2]" 1
1839 1 97 SER HB3 1 106 THR HA . . 5.060 2.957 2.420 3.368 . 0 0 "[ . 1 . 2]" 1
1840 1 97 SER HB3 1 106 THR MG . . 3.900 2.346 1.990 2.804 . 0 0 "[ . 1 . 2]" 1
1841 1 98 VAL H 1 98 VAL HB . . 3.750 2.614 2.404 2.855 . 0 0 "[ . 1 . 2]" 1
1842 1 98 VAL H 1 98 VAL MG1 . . 4.370 3.826 3.703 3.926 . 0 0 "[ . 1 . 2]" 1
1843 1 98 VAL H 1 98 VAL MG2 . . 3.770 2.681 2.265 3.153 . 0 0 "[ . 1 . 2]" 1
1844 1 98 VAL H 1 104 LYS QG . . 4.800 3.855 3.044 4.483 . 0 0 "[ . 1 . 2]" 1
1845 1 98 VAL H 1 105 ASP H . . 3.890 2.852 2.615 3.196 . 0 0 "[ . 1 . 2]" 1
1846 1 98 VAL H 1 106 THR HA . . 4.160 3.543 3.449 3.757 . 0 0 "[ . 1 . 2]" 1
1847 1 98 VAL H 1 106 THR MG . . 4.670 4.036 3.537 4.408 . 0 0 "[ . 1 . 2]" 1
1848 1 98 VAL HA 1 98 VAL MG1 . . 3.470 2.377 2.245 2.543 . 0 0 "[ . 1 . 2]" 1
1849 1 98 VAL HA 1 98 VAL MG2 . . 3.510 2.354 2.244 2.458 . 0 0 "[ . 1 . 2]" 1
1850 1 98 VAL HA 1 99 GLN H . . 3.140 2.148 2.140 2.162 . 0 0 "[ . 1 . 2]" 1
1851 1 98 VAL HA 1 99 GLN HA . . 4.620 4.399 4.380 4.418 . 0 0 "[ . 1 . 2]" 1
1852 1 98 VAL HA 1 99 GLN QB . . 4.460 4.074 4.005 4.135 . 0 0 "[ . 1 . 2]" 1
1853 1 98 VAL HB 1 99 GLN H . . 4.560 4.307 4.205 4.414 . 0 0 "[ . 1 . 2]" 1
1854 1 98 VAL HB 1 105 ASP H . . 4.150 3.188 2.957 3.464 . 0 0 "[ . 1 . 2]" 1
1855 1 98 VAL HB 1 105 ASP HB2 . . 4.580 2.515 2.002 3.330 . 0 0 "[ . 1 . 2]" 1
1856 1 98 VAL HB 1 105 ASP HB3 . . 5.310 3.016 2.095 3.968 . 0 0 "[ . 1 . 2]" 1
1857 1 98 VAL MG1 1 99 GLN H . . 3.770 2.849 2.553 3.032 . 0 0 "[ . 1 . 2]" 1
1858 1 98 VAL MG1 1 100 ILE MD . . 3.730 2.150 1.977 2.701 . 0 0 "[ . 1 . 2]" 1
1859 1 98 VAL MG1 1 100 ILE MG . . 4.710 4.434 4.213 4.710 . 0 0 "[ . 1 . 2]" 1
1860 1 98 VAL MG1 1 105 ASP H . . 4.380 4.049 3.731 4.374 . 0 0 "[ . 1 . 2]" 1
1861 1 98 VAL MG1 1 105 ASP HB2 . . 4.520 3.816 3.318 4.428 . 0 0 "[ . 1 . 2]" 1
1862 1 98 VAL MG2 1 99 GLN H . . 4.250 4.114 3.877 4.244 . 0 0 "[ . 1 . 2]" 1
1863 1 98 VAL MG2 1 105 ASP H . . 4.760 4.414 4.161 4.696 . 0 0 "[ . 1 . 2]" 1
1864 1 98 VAL MG2 1 105 ASP HB2 . . 4.150 3.534 2.804 4.092 . 0 0 "[ . 1 . 2]" 1
1865 1 99 GLN H 1 99 GLN QB . . 3.680 2.314 2.286 2.381 . 0 0 "[ . 1 . 2]" 1
1866 1 99 GLN H 1 99 GLN HG2 . . 4.860 4.605 4.373 4.668 . 0 0 "[ . 1 . 2]" 1
1867 1 99 GLN HA 1 99 GLN HG2 . . 4.220 3.006 2.814 3.278 . 0 0 "[ . 1 . 2]" 1
1868 1 99 GLN HA 1 99 GLN HG3 . . 4.130 2.320 2.217 2.543 . 0 0 "[ . 1 . 2]" 1
1869 1 99 GLN HA 1 100 ILE H . . 3.110 2.163 2.138 2.239 . 0 0 "[ . 1 . 2]" 1
1870 1 99 GLN HA 1 104 LYS HB2 . . 4.650 3.441 2.759 3.693 . 0 0 "[ . 1 . 2]" 1
1871 1 99 GLN HA 1 104 LYS HB3 . . 5.330 4.726 4.354 4.945 . 0 0 "[ . 1 . 2]" 1
1872 1 99 GLN HA 1 104 LYS QD . . 5.490 4.328 2.774 5.012 . 0 0 "[ . 1 . 2]" 1
1873 1 99 GLN HA 1 105 ASP H . . 4.420 3.753 3.377 4.289 . 0 0 "[ . 1 . 2]" 1
1874 1 99 GLN QB 1 100 ILE H . . 3.850 3.681 3.420 3.843 . 0 0 "[ . 1 . 2]" 1
1875 1 99 GLN QB 1 104 LYS HB2 . . 5.500 5.123 4.279 5.463 . 0 0 "[ . 1 . 2]" 1
1876 1 99 GLN QB 1 104 LYS QG . . 4.120 3.750 3.414 4.087 . 0 0 "[ . 1 . 2]" 1
1877 1 99 GLN HG2 1 100 ILE H . . 4.110 3.201 2.782 3.624 . 0 0 "[ . 1 . 2]" 1
1878 1 99 GLN HG2 1 100 ILE HA . . 4.810 4.477 3.602 4.776 . 0 0 "[ . 1 . 2]" 1
1879 1 99 GLN HG2 1 104 LYS HB2 . . 5.330 4.822 4.363 5.223 . 0 0 "[ . 1 . 2]" 1
1880 1 99 GLN HG3 1 100 ILE H . . 4.040 3.309 2.482 3.779 . 0 0 "[ . 1 . 2]" 1
1881 1 99 GLN HG3 1 104 LYS HB2 . . 4.510 3.720 3.206 4.134 . 0 0 "[ . 1 . 2]" 1
1882 1 99 GLN HG3 1 104 LYS HB3 . . 5.500 5.175 4.840 5.504 0.004 18 0 "[ . 1 . 2]" 1
1883 1 99 GLN HG3 1 104 LYS QG . . 4.620 2.973 2.248 4.450 . 0 0 "[ . 1 . 2]" 1
1884 1 100 ILE H 1 100 ILE HB . . 4.020 2.719 2.595 2.915 . 0 0 "[ . 1 . 2]" 1
1885 1 100 ILE H 1 100 ILE MD . . 4.680 3.940 3.832 4.424 . 0 0 "[ . 1 . 2]" 1
1886 1 100 ILE H 1 101 GLU H . . 5.280 4.484 4.411 4.536 . 0 0 "[ . 1 . 2]" 1
1887 1 100 ILE H 1 103 MET QB . . 4.720 4.271 4.078 4.503 . 0 0 "[ . 1 . 2]" 1
1888 1 100 ILE H 1 104 LYS HA . . 3.920 2.876 2.483 3.447 . 0 0 "[ . 1 . 2]" 1
1889 1 100 ILE H 1 104 LYS HB2 . . 4.120 3.430 3.008 3.681 . 0 0 "[ . 1 . 2]" 1
1890 1 100 ILE H 1 104 LYS QG . . 4.480 3.759 3.386 4.445 . 0 0 "[ . 1 . 2]" 1
1891 1 100 ILE HA 1 100 ILE MD . . 3.920 2.305 2.089 3.737 . 0 0 "[ . 1 . 2]" 1
1892 1 100 ILE HA 1 100 ILE MG . . 3.220 2.292 2.219 2.596 . 0 0 "[ . 1 . 2]" 1
1893 1 100 ILE HA 1 101 GLU H . . 3.120 2.367 2.361 2.372 . 0 0 "[ . 1 . 2]" 1
1894 1 100 ILE HA 1 101 GLU HA . . 4.430 4.297 4.295 4.301 . 0 0 "[ . 1 . 2]" 1
1895 1 100 ILE HA 1 101 GLU QG . . 4.850 4.345 3.970 4.513 . 0 0 "[ . 1 . 2]" 1
1896 1 100 ILE HB 1 100 ILE MD . . 3.360 3.162 2.409 3.213 . 0 0 "[ . 1 . 2]" 1
1897 1 100 ILE HB 1 101 GLU HB2 . . 5.500 4.770 4.613 5.064 . 0 0 "[ . 1 . 2]" 1
1898 1 100 ILE HB 1 103 MET H . . 4.810 2.391 2.212 2.913 . 0 0 "[ . 1 . 2]" 1
1899 1 100 ILE HB 1 103 MET QB . . 4.300 2.096 1.971 2.250 . 0 0 "[ . 1 . 2]" 1
1900 1 100 ILE HB 1 103 MET ME . . 5.500 5.013 4.747 5.232 . 0 0 "[ . 1 . 2]" 1
1901 1 100 ILE QG 1 101 GLU H . . 4.630 4.305 3.462 4.379 . 0 0 "[ . 1 . 2]" 1
1902 1 100 ILE MG 1 101 GLU H . . 3.810 1.855 1.816 1.891 . 0 0 "[ . 1 . 2]" 1
1903 1 100 ILE MG 1 101 GLU HA . . 4.630 3.888 3.662 3.952 . 0 0 "[ . 1 . 2]" 1
1904 1 100 ILE MG 1 101 GLU HB2 . . 4.610 2.594 2.446 2.720 . 0 0 "[ . 1 . 2]" 1
1905 1 100 ILE MG 1 101 GLU HB3 . . 5.140 3.994 3.736 4.132 . 0 0 "[ . 1 . 2]" 1
1906 1 100 ILE MG 1 101 GLU QG . . 3.360 3.221 2.910 3.322 . 0 0 "[ . 1 . 2]" 1
1907 1 100 ILE MG 1 103 MET H . . 3.960 2.601 1.908 3.021 . 0 0 "[ . 1 . 2]" 1
1908 1 100 ILE MG 1 103 MET QB . . 5.020 2.555 2.101 2.853 . 0 0 "[ . 1 . 2]" 1
1909 1 101 GLU H 1 101 GLU HB3 . . 3.910 3.625 3.613 3.650 . 0 0 "[ . 1 . 2]" 1
1910 1 101 GLU H 1 101 GLU HG2 . . 3.980 2.719 1.993 3.368 . 0 0 "[ . 1 . 2]" 1
1911 1 101 GLU H 1 101 GLU QG . . 3.390 2.385 1.976 2.531 . 0 0 "[ . 1 . 2]" 1
1912 1 101 GLU H 1 101 GLU HG3 . . 3.980 3.211 2.416 3.930 . 0 0 "[ . 1 . 2]" 1
1913 1 101 GLU H 1 103 MET H . . 5.480 4.103 3.855 4.293 . 0 0 "[ . 1 . 2]" 1
1914 1 101 GLU HA 1 101 GLU HG2 . . 3.870 2.578 2.221 3.050 . 0 0 "[ . 1 . 2]" 1
1915 1 101 GLU HA 1 101 GLU QG . . 3.170 2.506 2.180 2.890 . 0 0 "[ . 1 . 2]" 1
1916 1 101 GLU HA 1 101 GLU HG3 . . 3.870 3.462 3.063 3.777 . 0 0 "[ . 1 . 2]" 1
1917 1 101 GLU HA 1 103 MET H . . 5.220 4.950 4.503 5.215 . 0 0 "[ . 1 . 2]" 1
1918 1 101 GLU HB2 1 102 ASN H . . 3.290 2.394 2.149 2.601 . 0 0 "[ . 1 . 2]" 1
1919 1 101 GLU HB2 1 102 ASN QB . . 4.590 3.939 3.684 4.445 . 0 0 "[ . 1 . 2]" 1
1920 1 101 GLU HB2 1 103 MET H . . 4.430 4.058 3.735 4.226 . 0 0 "[ . 1 . 2]" 1
1921 1 101 GLU HB3 1 102 ASN H . . 3.640 3.052 2.659 3.288 . 0 0 "[ . 1 . 2]" 1
1922 1 101 GLU HB3 1 102 ASN QB . . 4.630 3.755 3.257 4.392 . 0 0 "[ . 1 . 2]" 1
1923 1 101 GLU HB3 1 103 MET H . . 5.070 4.923 4.637 5.063 . 0 0 "[ . 1 . 2]" 1
1924 1 101 GLU QG 1 102 ASN H . . 4.220 4.095 3.885 4.228 0.008 5 0 "[ . 1 . 2]" 1
1925 1 101 GLU HG2 1 102 ASN H . . 4.950 4.613 4.293 4.914 . 0 0 "[ . 1 . 2]" 1
1926 1 101 GLU HG3 1 102 ASN H . . 4.950 4.607 4.385 4.934 . 0 0 "[ . 1 . 2]" 1
1927 1 102 ASN H 1 102 ASN QB . . 3.840 2.585 2.486 2.783 . 0 0 "[ . 1 . 2]" 1
1928 1 102 ASN H 1 103 MET H . . 3.480 1.950 1.782 2.472 . 0 0 "[ . 1 . 2]" 1
1929 1 102 ASN QB 1 103 MET H . . 4.340 3.083 2.749 3.771 . 0 0 "[ . 1 . 2]" 1
1930 1 103 MET H 1 103 MET HB2 . . 3.890 2.437 2.274 2.789 . 0 0 "[ . 1 . 2]" 1
1931 1 103 MET H 1 103 MET QB . . 3.410 2.401 2.249 2.728 . 0 0 "[ . 1 . 2]" 1
1932 1 103 MET H 1 103 MET HB3 . . 3.890 3.645 3.552 3.860 . 0 0 "[ . 1 . 2]" 1
1933 1 103 MET H 1 103 MET HG2 . . 4.010 3.184 2.651 4.017 0.007 10 0 "[ . 1 . 2]" 1
1934 1 103 MET H 1 103 MET QG . . 3.350 2.840 2.603 3.354 0.004 10 0 "[ . 1 . 2]" 1
1935 1 103 MET H 1 103 MET HG3 . . 4.010 3.625 2.717 4.014 0.004 18 0 "[ . 1 . 2]" 1
1936 1 103 MET HA 1 103 MET HG2 . . 3.720 2.649 2.267 3.017 . 0 0 "[ . 1 . 2]" 1
1937 1 103 MET HA 1 103 MET QG . . 3.240 2.574 2.228 2.891 . 0 0 "[ . 1 . 2]" 1
1938 1 103 MET HA 1 103 MET HG3 . . 3.720 3.523 3.108 3.728 0.008 16 0 "[ . 1 . 2]" 1
1939 1 103 MET HA 1 104 LYS H . . 2.800 2.407 2.337 2.449 . 0 0 "[ . 1 . 2]" 1
1940 1 103 MET HA 1 104 LYS HA . . 4.740 4.534 4.503 4.552 . 0 0 "[ . 1 . 2]" 1
1941 1 103 MET HA 1 104 LYS HB2 . . 4.600 4.274 4.134 4.604 0.004 10 0 "[ . 1 . 2]" 1
1942 1 103 MET HA 1 104 LYS HB3 . . 4.610 4.492 4.192 4.627 0.017 5 0 "[ . 1 . 2]" 1
1943 1 103 MET QB 1 104 LYS H . . 3.390 2.396 2.304 2.554 . 0 0 "[ . 1 . 2]" 1
1944 1 103 MET QB 1 104 LYS HA . . 4.720 3.872 3.830 3.914 . 0 0 "[ . 1 . 2]" 1
1945 1 103 MET QB 1 104 LYS HB2 . . 5.340 4.836 4.750 4.979 . 0 0 "[ . 1 . 2]" 1
1946 1 103 MET HB2 1 104 LYS H . . 3.870 3.722 3.632 3.825 . 0 0 "[ . 1 . 2]" 1
1947 1 103 MET HB3 1 104 LYS H . . 3.870 2.426 2.328 2.594 . 0 0 "[ . 1 . 2]" 1
1948 1 103 MET ME 1 103 MET QG . . 3.560 2.324 2.199 2.458 . 0 0 "[ . 1 . 2]" 1
1949 1 103 MET ME 1 104 LYS H . . 3.330 3.026 2.496 3.264 . 0 0 "[ . 1 . 2]" 1
1950 1 103 MET QG 1 104 LYS H . . 4.490 4.007 3.630 4.293 . 0 0 "[ . 1 . 2]" 1
1951 1 104 LYS H 1 104 LYS HB2 . . 3.740 3.363 3.255 3.595 . 0 0 "[ . 1 . 2]" 1
1952 1 104 LYS H 1 104 LYS HB3 . . 3.920 3.018 2.899 3.106 . 0 0 "[ . 1 . 2]" 1
1953 1 104 LYS H 1 104 LYS QG . . 4.270 4.257 4.033 4.351 0.081 18 0 "[ . 1 . 2]" 1
1954 1 104 LYS HA 1 104 LYS QD . . 4.680 3.836 3.339 4.183 . 0 0 "[ . 1 . 2]" 1
1955 1 104 LYS HA 1 104 LYS QG . . 3.810 2.423 2.266 2.581 . 0 0 "[ . 1 . 2]" 1
1956 1 104 LYS HA 1 105 ASP H . . 3.160 2.268 2.161 2.377 . 0 0 "[ . 1 . 2]" 1
1957 1 104 LYS HA 1 105 ASP HB2 . . 5.140 4.148 4.038 4.252 . 0 0 "[ . 1 . 2]" 1
1958 1 104 LYS HB2 1 104 LYS QE . . 4.300 3.810 3.298 4.325 0.025 3 0 "[ . 1 . 2]" 1
1959 1 104 LYS HB2 1 105 ASP H . . 4.180 4.022 3.787 4.187 0.007 8 0 "[ . 1 . 2]" 1
1960 1 104 LYS HB3 1 104 LYS QE . . 4.660 3.206 2.035 4.112 . 0 0 "[ . 1 . 2]" 1
1961 1 104 LYS HB3 1 105 ASP H . . 4.390 3.819 3.496 4.232 . 0 0 "[ . 1 . 2]" 1
1962 1 104 LYS HB3 1 106 THR MG . . 5.320 4.872 4.551 5.275 . 0 0 "[ . 1 . 2]" 1
1963 1 104 LYS QD 1 106 THR MG . . 5.350 3.075 2.287 4.095 . 0 0 "[ . 1 . 2]" 1
1964 1 104 LYS QE 1 104 LYS QG . . 3.090 2.191 2.025 2.430 . 0 0 "[ . 1 . 2]" 1
1965 1 104 LYS QE 1 106 THR MG . . 3.330 2.393 1.740 3.339 0.009 11 0 "[ . 1 . 2]" 1
1966 1 104 LYS QG 1 105 ASP H . . 3.940 2.101 1.880 2.546 . 0 0 "[ . 1 . 2]" 1
1967 1 105 ASP H 1 105 ASP HB2 . . 4.120 2.765 2.447 3.057 . 0 0 "[ . 1 . 2]" 1
1968 1 105 ASP H 1 105 ASP HB3 . . 4.200 3.375 2.877 3.717 . 0 0 "[ . 1 . 2]" 1
1969 1 105 ASP H 1 106 THR H . . 4.690 4.432 4.342 4.488 . 0 0 "[ . 1 . 2]" 1
1970 1 105 ASP H 1 106 THR MG . . 4.440 4.098 3.856 4.351 . 0 0 "[ . 1 . 2]" 1
1971 1 105 ASP HA 1 106 THR H . . 2.820 2.364 2.225 2.414 . 0 0 "[ . 1 . 2]" 1
1972 1 105 ASP HA 1 106 THR MG . . 4.430 3.721 3.411 4.041 . 0 0 "[ . 1 . 2]" 1
1973 1 105 ASP HB2 1 106 THR H . . 4.360 3.979 3.858 4.208 . 0 0 "[ . 1 . 2]" 1
1974 1 105 ASP HB3 1 106 THR H . . 4.300 2.943 2.470 3.552 . 0 0 "[ . 1 . 2]" 1
1975 1 106 THR H 1 106 THR HB . . 3.900 3.835 3.735 3.893 . 0 0 "[ . 1 . 2]" 1
1976 1 106 THR H 1 106 THR MG . . 3.500 3.219 2.960 3.444 . 0 0 "[ . 1 . 2]" 1
1977 1 106 THR H 1 107 ALA H . . 4.440 4.420 4.363 4.461 0.021 7 0 "[ . 1 . 2]" 1
1978 1 106 THR HA 1 106 THR MG . . 3.300 2.229 2.054 2.401 . 0 0 "[ . 1 . 2]" 1
1979 1 106 THR HA 1 107 ALA H . . 3.070 2.355 2.257 2.429 . 0 0 "[ . 1 . 2]" 1
1980 1 106 THR HA 1 107 ALA MB . . 4.260 3.802 3.724 3.882 . 0 0 "[ . 1 . 2]" 1
1981 1 106 THR HB 1 107 ALA H . . 3.520 2.518 2.336 2.794 . 0 0 "[ . 1 . 2]" 1
1982 1 106 THR HB 1 107 ALA MB . . 4.700 4.585 4.493 4.695 . 0 0 "[ . 1 . 2]" 1
1983 1 106 THR MG 1 107 ALA H . . 3.720 3.575 3.351 3.716 . 0 0 "[ . 1 . 2]" 1
1984 1 107 ALA H 1 107 ALA MB . . 3.430 2.744 2.582 2.804 . 0 0 "[ . 1 . 2]" 1
1985 1 107 ALA H 1 108 THR H . . 4.590 4.331 4.265 4.412 . 0 0 "[ . 1 . 2]" 1
1986 1 107 ALA HA 1 108 THR H . . 2.860 2.320 2.227 2.447 . 0 0 "[ . 1 . 2]" 1
1987 1 107 ALA HA 1 108 THR HA . . 4.840 4.426 4.392 4.456 . 0 0 "[ . 1 . 2]" 1
1988 1 107 ALA HA 1 108 THR HB . . 4.610 4.594 4.503 4.621 0.011 11 0 "[ . 1 . 2]" 1
1989 1 107 ALA HA 1 108 THR MG . . 5.500 5.437 5.424 5.451 . 0 0 "[ . 1 . 2]" 1
1990 1 107 ALA MB 1 108 THR H . . 3.170 2.606 2.297 2.852 . 0 0 "[ . 1 . 2]" 1
1991 1 107 ALA MB 1 108 THR HB . . 5.010 4.895 4.672 5.013 0.003 6 0 "[ . 1 . 2]" 1
1992 1 107 ALA MB 1 109 ILE MD . . 4.140 3.779 3.602 4.037 . 0 0 "[ . 1 . 2]" 1
1993 1 107 ALA MB 1 109 ILE HG12 . . 4.650 4.495 4.263 4.646 . 0 0 "[ . 1 . 2]" 1
1994 1 107 ALA MB 1 109 ILE HG13 . . 4.650 3.572 3.385 3.751 . 0 0 "[ . 1 . 2]" 1
1995 1 108 THR H 1 108 THR HB . . 3.240 2.698 2.596 2.768 . 0 0 "[ . 1 . 2]" 1
1996 1 108 THR H 1 108 THR MG . . 4.150 3.878 3.834 3.913 . 0 0 "[ . 1 . 2]" 1
1997 1 108 THR HA 1 108 THR MG . . 3.260 2.368 2.259 2.464 . 0 0 "[ . 1 . 2]" 1
1998 1 108 THR HA 1 109 ILE H . . 3.080 2.198 2.143 2.289 . 0 0 "[ . 1 . 2]" 1
1999 1 108 THR HA 1 109 ILE HB . . 4.610 4.546 4.477 4.600 . 0 0 "[ . 1 . 2]" 1
2000 1 108 THR HA 1 109 ILE MG . . 5.500 5.444 5.428 5.481 . 0 0 "[ . 1 . 2]" 1
2001 1 108 THR HB 1 109 ILE H . . 4.330 4.035 3.770 4.337 0.007 11 0 "[ . 1 . 2]" 1
2002 1 108 THR MG 1 109 ILE H . . 3.390 2.265 1.929 2.885 . 0 0 "[ . 1 . 2]" 1
2003 1 108 THR MG 1 109 ILE HA . . 4.490 3.579 3.406 4.122 . 0 0 "[ . 1 . 2]" 1
2004 1 108 THR MG 1 109 ILE HB . . 4.870 4.506 4.362 4.748 . 0 0 "[ . 1 . 2]" 1
2005 1 108 THR MG 1 110 ARG QD . . 4.670 4.093 2.741 4.623 . 0 0 "[ . 1 . 2]" 1
2006 1 108 THR MG 1 110 ARG HG2 . . 4.410 3.819 3.003 4.163 . 0 0 "[ . 1 . 2]" 1
2007 1 108 THR MG 1 110 ARG QG . . 3.830 2.976 2.507 3.177 . 0 0 "[ . 1 . 2]" 1
2008 1 108 THR MG 1 110 ARG HG3 . . 4.410 3.203 2.561 4.124 . 0 0 "[ . 1 . 2]" 1
2009 1 109 ILE H 1 109 ILE HB . . 3.800 2.700 2.457 2.819 . 0 0 "[ . 1 . 2]" 1
2010 1 109 ILE H 1 109 ILE MD . . 4.130 3.940 3.454 4.129 . 0 0 "[ . 1 . 2]" 1
2011 1 109 ILE H 1 109 ILE HG12 . . 4.670 4.189 4.002 4.373 . 0 0 "[ . 1 . 2]" 1
2012 1 109 ILE H 1 109 ILE QG . . 3.990 2.893 2.611 3.054 . 0 0 "[ . 1 . 2]" 1
2013 1 109 ILE H 1 109 ILE HG13 . . 4.670 2.949 2.646 3.125 . 0 0 "[ . 1 . 2]" 1
2014 1 109 ILE H 1 109 ILE MG . . 4.640 3.864 3.769 3.908 . 0 0 "[ . 1 . 2]" 1
2015 1 109 ILE HA 1 109 ILE MD . . 3.980 3.868 3.847 3.895 . 0 0 "[ . 1 . 2]" 1
2016 1 109 ILE HA 1 109 ILE HG12 . . 3.860 2.659 2.567 2.765 . 0 0 "[ . 1 . 2]" 1
2017 1 109 ILE HA 1 109 ILE HG13 . . 3.860 2.835 2.696 2.941 . 0 0 "[ . 1 . 2]" 1
2018 1 109 ILE HA 1 109 ILE MG . . 3.330 2.371 2.319 2.453 . 0 0 "[ . 1 . 2]" 1
2019 1 109 ILE HA 1 110 ARG H . . 2.910 2.184 2.140 2.324 . 0 0 "[ . 1 . 2]" 1
2020 1 109 ILE HA 1 110 ARG HA . . 4.640 4.391 4.378 4.435 . 0 0 "[ . 1 . 2]" 1
2021 1 109 ILE HA 1 110 ARG HB2 . . 4.720 4.461 4.293 4.654 . 0 0 "[ . 1 . 2]" 1
2022 1 109 ILE HB 1 109 ILE MD . . 3.210 2.281 2.186 2.389 . 0 0 "[ . 1 . 2]" 1
2023 1 109 ILE HB 1 110 ARG H . . 4.500 4.115 3.756 4.355 . 0 0 "[ . 1 . 2]" 1
2024 1 109 ILE MD 1 109 ILE MG . . 2.840 2.162 1.959 2.316 . 0 0 "[ . 1 . 2]" 1
2025 1 109 ILE MD 1 110 ARG H . . 5.500 5.099 4.711 5.387 . 0 0 "[ . 1 . 2]" 1
2026 1 109 ILE MD 1 111 ILE MD . . 4.340 4.168 3.949 4.332 . 0 0 "[ . 1 . 2]" 1
2027 1 109 ILE QG 1 109 ILE MG . . 2.880 2.231 2.108 2.314 . 0 0 "[ . 1 . 2]" 1
2028 1 109 ILE QG 1 110 ARG H . . 4.650 4.068 3.854 4.258 . 0 0 "[ . 1 . 2]" 1
2029 1 109 ILE HG12 1 109 ILE MG . . 3.410 2.280 2.141 2.375 . 0 0 "[ . 1 . 2]" 1
2030 1 109 ILE HG13 1 109 ILE MG . . 3.410 3.182 3.153 3.197 . 0 0 "[ . 1 . 2]" 1
2031 1 109 ILE MG 1 110 ARG H . . 3.510 2.420 1.942 2.893 . 0 0 "[ . 1 . 2]" 1
2032 1 109 ILE MG 1 111 ILE H . . 4.750 4.113 3.817 4.362 . 0 0 "[ . 1 . 2]" 1
2033 1 109 ILE MG 1 111 ILE MD . . 3.620 2.895 2.452 3.183 . 0 0 "[ . 1 . 2]" 1
2034 1 110 ARG H 1 110 ARG HB2 . . 3.660 2.458 2.301 2.615 . 0 0 "[ . 1 . 2]" 1
2035 1 110 ARG H 1 110 ARG HB3 . . 3.930 3.656 3.568 3.757 . 0 0 "[ . 1 . 2]" 1
2036 1 110 ARG H 1 110 ARG QG . . 3.860 2.935 2.506 3.212 . 0 0 "[ . 1 . 2]" 1
2037 1 110 ARG HA 1 110 ARG HG2 . . 4.090 2.653 2.312 3.600 . 0 0 "[ . 1 . 2]" 1
2038 1 110 ARG HA 1 110 ARG HG3 . . 4.090 2.958 2.450 3.740 . 0 0 "[ . 1 . 2]" 1
2039 1 110 ARG HA 1 111 ILE H . . 3.070 2.150 2.140 2.177 . 0 0 "[ . 1 . 2]" 1
2040 1 110 ARG HA 1 111 ILE HB . . 5.500 4.572 4.468 4.622 . 0 0 "[ . 1 . 2]" 1
2041 1 110 ARG HB2 1 111 ILE H . . 4.480 4.294 4.106 4.436 . 0 0 "[ . 1 . 2]" 1
2042 1 110 ARG HB3 1 111 ILE H . . 4.540 3.359 3.150 3.547 . 0 0 "[ . 1 . 2]" 1
2043 1 110 ARG QG 1 111 ILE H . . 4.690 4.087 3.829 4.512 . 0 0 "[ . 1 . 2]" 1
2044 1 111 ILE H 1 111 ILE HB . . 3.710 2.630 2.459 2.741 . 0 0 "[ . 1 . 2]" 1
2045 1 111 ILE H 1 111 ILE MD . . 4.560 4.006 3.687 4.299 . 0 0 "[ . 1 . 2]" 1
2046 1 111 ILE H 1 111 ILE HG12 . . 5.140 4.049 3.893 4.214 . 0 0 "[ . 1 . 2]" 1
2047 1 111 ILE H 1 111 ILE HG13 . . 4.060 2.893 2.768 3.190 . 0 0 "[ . 1 . 2]" 1
2048 1 111 ILE H 1 111 ILE MG . . 4.120 3.833 3.759 3.883 . 0 0 "[ . 1 . 2]" 1
2049 1 111 ILE HA 1 111 ILE MD . . 4.050 3.834 3.750 3.881 . 0 0 "[ . 1 . 2]" 1
2050 1 111 ILE HA 1 111 ILE HG12 . . 3.960 2.552 2.379 2.658 . 0 0 "[ . 1 . 2]" 1
2051 1 111 ILE HA 1 111 ILE HG13 . . 4.040 2.936 2.743 3.055 . 0 0 "[ . 1 . 2]" 1
2052 1 111 ILE HA 1 111 ILE MG . . 3.420 2.432 2.356 2.508 . 0 0 "[ . 1 . 2]" 1
2053 1 111 ILE HA 1 112 ARG H . . 3.150 2.182 2.141 2.289 . 0 0 "[ . 1 . 2]" 1
2054 1 111 ILE HB 1 111 ILE MD . . 3.510 2.345 2.218 2.463 . 0 0 "[ . 1 . 2]" 1
2055 1 111 ILE MD 1 111 ILE MG . . 2.710 2.093 1.943 2.311 . 0 0 "[ . 1 . 2]" 1
2056 1 111 ILE MD 1 112 ARG H . . 5.220 5.001 4.746 5.185 . 0 0 "[ . 1 . 2]" 1
2057 1 111 ILE HG12 1 112 ARG H . . 5.030 4.271 4.033 4.427 . 0 0 "[ . 1 . 2]" 1
2058 1 111 ILE HG13 1 111 ILE MG . . 3.680 3.195 3.183 3.203 . 0 0 "[ . 1 . 2]" 1
2059 1 111 ILE MG 1 112 ARG H . . 3.320 2.417 2.013 2.796 . 0 0 "[ . 1 . 2]" 1
2060 1 111 ILE MG 1 112 ARG HA . . 4.150 3.452 3.262 3.637 . 0 0 "[ . 1 . 2]" 1
2061 1 111 ILE MG 1 113 VAL H . . 4.240 4.109 3.929 4.233 . 0 0 "[ . 1 . 2]" 1
2062 1 112 ARG H 1 112 ARG HB2 . . 4.090 3.221 3.066 3.368 . 0 0 "[ . 1 . 2]" 1
2063 1 112 ARG H 1 112 ARG HB3 . . 3.910 2.606 2.423 2.703 . 0 0 "[ . 1 . 2]" 1
2064 1 112 ARG H 1 112 ARG HD2 . . 5.500 5.249 5.024 5.418 . 0 0 "[ . 1 . 2]" 1
2065 1 112 ARG H 1 112 ARG HD3 . . 5.500 5.363 5.219 5.496 . 0 0 "[ . 1 . 2]" 1
2066 1 112 ARG H 1 112 ARG HG3 . . 4.880 4.649 4.283 4.751 . 0 0 "[ . 1 . 2]" 1
2067 1 112 ARG H 1 113 VAL H . . 5.130 4.352 4.293 4.425 . 0 0 "[ . 1 . 2]" 1
2068 1 112 ARG HA 1 112 ARG HD2 . . 5.300 4.125 2.693 4.438 . 0 0 "[ . 1 . 2]" 1
2069 1 112 ARG HA 1 112 ARG QD . . 4.500 3.882 2.584 4.103 . 0 0 "[ . 1 . 2]" 1
2070 1 112 ARG HA 1 112 ARG HD3 . . 5.300 4.738 3.326 4.924 . 0 0 "[ . 1 . 2]" 1
2071 1 112 ARG HA 1 112 ARG HG2 . . 4.190 3.365 3.082 3.891 . 0 0 "[ . 1 . 2]" 1
2072 1 112 ARG HA 1 112 ARG HG3 . . 3.670 2.619 2.436 2.963 . 0 0 "[ . 1 . 2]" 1
2073 1 112 ARG HA 1 113 VAL H . . 3.140 2.169 2.152 2.236 . 0 0 "[ . 1 . 2]" 1
2074 1 112 ARG HA 1 113 VAL HB . . 4.770 4.526 4.426 4.676 . 0 0 "[ . 1 . 2]" 1
2075 1 112 ARG HA 1 113 VAL MG2 . . 4.420 3.718 3.440 3.904 . 0 0 "[ . 1 . 2]" 1
2076 1 112 ARG HB2 1 113 VAL H . . 5.190 4.101 3.915 4.261 . 0 0 "[ . 1 . 2]" 1
2077 1 112 ARG HB3 1 113 VAL H . . 4.990 4.203 4.056 4.320 . 0 0 "[ . 1 . 2]" 1
2078 1 112 ARG HB3 1 114 VAL MG1 . . 4.560 4.356 4.011 4.536 . 0 0 "[ . 1 . 2]" 1
2079 1 112 ARG QD 1 114 VAL MG1 . . 3.690 3.424 3.020 3.692 0.002 3 0 "[ . 1 . 2]" 1
2080 1 112 ARG HD2 1 113 VAL H . . 5.500 5.089 2.459 5.482 . 0 0 "[ . 1 . 2]" 1
2081 1 112 ARG HD3 1 113 VAL H . . 5.500 5.318 3.955 5.497 . 0 0 "[ . 1 . 2]" 1
2082 1 112 ARG HG2 1 113 VAL H . . 5.160 3.304 2.981 3.971 . 0 0 "[ . 1 . 2]" 1
2083 1 112 ARG HG2 1 114 VAL MG1 . . 3.370 2.624 2.365 2.974 . 0 0 "[ . 1 . 2]" 1
2084 1 112 ARG HG2 1 114 VAL MG2 . . 5.070 4.616 4.288 4.909 . 0 0 "[ . 1 . 2]" 1
2085 1 112 ARG HG3 1 113 VAL H . . 4.420 2.789 2.326 3.218 . 0 0 "[ . 1 . 2]" 1
2086 1 112 ARG HG3 1 114 VAL MG1 . . 3.980 3.628 2.683 3.960 . 0 0 "[ . 1 . 2]" 1
2087 1 113 VAL H 1 113 VAL HB . . 3.710 2.552 2.474 2.776 . 0 0 "[ . 1 . 2]" 1
2088 1 113 VAL H 1 113 VAL MG1 . . 4.090 3.798 3.741 3.899 . 0 0 "[ . 1 . 2]" 1
2089 1 113 VAL H 1 113 VAL MG2 . . 3.510 2.803 2.398 2.981 . 0 0 "[ . 1 . 2]" 1
2090 1 113 VAL H 1 114 VAL H . . 4.890 4.397 4.175 4.530 . 0 0 "[ . 1 . 2]" 1
2091 1 113 VAL H 1 114 VAL MG1 . . 4.790 4.267 3.872 4.596 . 0 0 "[ . 1 . 2]" 1
2092 1 113 VAL HA 1 113 VAL MG1 . . 3.320 2.419 2.300 2.490 . 0 0 "[ . 1 . 2]" 1
2093 1 113 VAL HA 1 113 VAL MG2 . . 3.470 2.319 2.191 2.479 . 0 0 "[ . 1 . 2]" 1
2094 1 113 VAL HA 1 114 VAL H . . 3.130 2.169 2.141 2.288 . 0 0 "[ . 1 . 2]" 1
2095 1 113 VAL HA 1 114 VAL HA . . 4.610 4.401 4.388 4.450 . 0 0 "[ . 1 . 2]" 1
2096 1 113 VAL HA 1 114 VAL MG1 . . 4.030 3.678 3.262 3.876 . 0 0 "[ . 1 . 2]" 1
2097 1 113 VAL MG1 1 114 VAL H . . 3.540 2.465 1.939 2.762 . 0 0 "[ . 1 . 2]" 1
2098 1 113 VAL MG1 1 114 VAL MG2 . . 4.190 3.756 3.573 3.940 . 0 0 "[ . 1 . 2]" 1
2099 1 113 VAL MG2 1 114 VAL H . . 4.200 3.929 3.666 4.098 . 0 0 "[ . 1 . 2]" 1
2100 1 114 VAL H 1 114 VAL MG1 . . 3.610 2.761 2.474 2.991 . 0 0 "[ . 1 . 2]" 1
2101 1 114 VAL H 1 114 VAL MG2 . . 2.990 2.065 1.914 2.329 . 0 0 "[ . 1 . 2]" 1
2102 1 114 VAL HA 1 114 VAL MG1 . . 3.100 2.341 2.250 2.484 . 0 0 "[ . 1 . 2]" 1
2103 1 114 VAL HA 1 114 VAL MG2 . . 3.500 3.193 3.186 3.202 . 0 0 "[ . 1 . 2]" 1
2104 1 114 VAL HA 1 115 GLU H . . 2.970 2.232 2.157 2.396 . 0 0 "[ . 1 . 2]" 1
2105 1 114 VAL HA 1 115 GLU HA . . 4.510 4.330 4.318 4.354 . 0 0 "[ . 1 . 2]" 1
2106 1 114 VAL HA 1 115 GLU QB . . 4.770 4.458 4.287 4.661 . 0 0 "[ . 1 . 2]" 1
2107 1 114 VAL HA 1 115 GLU QG . . 4.240 3.833 3.477 4.221 . 0 0 "[ . 1 . 2]" 1
2108 1 114 VAL HB 1 115 GLU H . . 3.400 2.889 2.417 3.223 . 0 0 "[ . 1 . 2]" 1
2109 1 114 VAL MG1 1 115 GLU H . . 3.910 3.869 3.747 3.920 0.010 3 0 "[ . 1 . 2]" 1
2110 1 114 VAL MG2 1 115 GLU H . . 4.070 3.730 3.323 4.016 . 0 0 "[ . 1 . 2]" 1
2111 1 114 VAL MG2 1 116 LYS HA . . 4.640 4.147 3.728 4.496 . 0 0 "[ . 1 . 2]" 1
2112 1 115 GLU H 1 115 GLU HB2 . . 3.830 2.640 2.277 3.593 . 0 0 "[ . 1 . 2]" 1
2113 1 115 GLU H 1 115 GLU QB . . 3.180 2.450 2.251 2.961 . 0 0 "[ . 1 . 2]" 1
2114 1 115 GLU H 1 115 GLU HB3 . . 3.830 3.438 2.677 3.599 . 0 0 "[ . 1 . 2]" 1
2115 1 115 GLU H 1 115 GLU HG2 . . 3.930 3.197 1.899 3.884 . 0 0 "[ . 1 . 2]" 1
2116 1 115 GLU H 1 115 GLU QG . . 3.450 2.299 1.854 2.666 . 0 0 "[ . 1 . 2]" 1
2117 1 115 GLU H 1 115 GLU HG3 . . 3.930 2.501 1.886 3.479 . 0 0 "[ . 1 . 2]" 1
2118 1 115 GLU HA 1 115 GLU HG2 . . 3.970 2.749 2.221 4.168 0.198 16 0 "[ . 1 . 2]" 1
2119 1 115 GLU HA 1 115 GLU HG3 . . 3.970 3.229 2.627 3.944 . 0 0 "[ . 1 . 2]" 1
2120 1 115 GLU HA 1 116 LYS H . . 3.170 2.224 2.139 2.510 . 0 0 "[ . 1 . 2]" 1
2121 1 115 GLU QB 1 116 LYS H . . 3.590 2.928 2.167 3.342 . 0 0 "[ . 1 . 2]" 1
2122 1 115 GLU HB2 1 116 LYS H . . 4.450 3.887 3.224 4.405 . 0 0 "[ . 1 . 2]" 1
2123 1 115 GLU HB3 1 116 LYS H . . 4.450 3.161 2.188 4.220 . 0 0 "[ . 1 . 2]" 1
2124 1 116 LYS H 1 116 LYS HB2 . . 4.080 3.115 2.293 3.690 . 0 0 "[ . 1 . 2]" 1
2125 1 116 LYS H 1 116 LYS QB . . 3.470 2.453 2.190 2.772 . 0 0 "[ . 1 . 2]" 1
2126 1 116 LYS H 1 116 LYS HB3 . . 4.080 2.801 2.319 3.614 . 0 0 "[ . 1 . 2]" 1
2127 1 116 LYS H 1 116 LYS QD . . 4.430 3.821 1.976 4.458 0.028 3 0 "[ . 1 . 2]" 1
2128 1 116 LYS H 1 116 LYS QG . . 4.140 2.676 1.840 3.978 . 0 0 "[ . 1 . 2]" 1
2129 1 116 LYS HA 1 116 LYS QD . . 4.970 3.940 3.163 4.415 . 0 0 "[ . 1 . 2]" 1
2130 1 116 LYS HA 1 116 LYS QG . . 3.630 2.937 2.265 3.456 . 0 0 "[ . 1 . 2]" 1
2131 1 117 ALA HA 1 118 GLY H . . 3.100 2.307 2.145 2.732 . 0 0 "[ . 1 . 2]" 1
2132 1 117 ALA MB 1 118 GLY H . . 3.870 2.951 2.208 3.709 . 0 0 "[ . 1 . 2]" 1
2133 1 117 ALA MB 1 118 GLY QA . . 4.780 3.721 3.364 3.978 . 0 0 "[ . 1 . 2]" 1
stop_
save_