Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
563153 | 2lu3 RC | 18507 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lu3
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 2074
_Distance_constraint_stats_list.Viol_count 1866
_Distance_constraint_stats_list.Viol_total 642.941
_Distance_constraint_stats_list.Viol_max 0.302
_Distance_constraint_stats_list.Viol_rms 0.0069
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0008
_Distance_constraint_stats_list.Viol_average_violations_only 0.0172
_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 3 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 4 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 5 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 6 ARG 0.000 0.000 6 0 "[ . 1 . 2]"
1 9 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 SER 0.166 0.106 19 0 "[ . 1 . 2]"
1 11 VAL 0.248 0.106 19 0 "[ . 1 . 2]"
1 12 LYS 0.383 0.302 19 0 "[ . 1 . 2]"
1 13 PRO 0.307 0.302 19 0 "[ . 1 . 2]"
1 14 THR 0.343 0.168 20 0 "[ . 1 . 2]"
1 15 GLN 0.432 0.168 20 0 "[ . 1 . 2]"
1 16 GLN 0.768 0.213 11 0 "[ . 1 . 2]"
1 17 ALA 0.088 0.064 13 0 "[ . 1 . 2]"
1 18 ARG 0.791 0.121 7 0 "[ . 1 . 2]"
1 19 PRO 0.765 0.121 7 0 "[ . 1 . 2]"
1 20 THR 1.039 0.050 7 0 "[ . 1 . 2]"
1 21 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 ILE 0.795 0.032 15 0 "[ . 1 . 2]"
1 23 ARG 1.115 0.069 9 0 "[ . 1 . 2]"
1 24 TRP 0.878 0.069 9 0 "[ . 1 . 2]"
1 25 SER 0.087 0.020 16 0 "[ . 1 . 2]"
1 26 GLU 0.099 0.020 16 0 "[ . 1 . 2]"
1 27 GLY 0.062 0.017 17 0 "[ . 1 . 2]"
1 28 GLY 0.028 0.008 17 0 "[ . 1 . 2]"
1 29 LYS 0.359 0.285 15 0 "[ . 1 . 2]"
1 30 GLU 0.111 0.040 15 0 "[ . 1 . 2]"
1 31 VAL 1.024 0.236 16 0 "[ . 1 . 2]"
1 32 PHE 0.295 0.021 12 0 "[ . 1 . 2]"
1 33 ILE 1.070 0.048 17 0 "[ . 1 . 2]"
1 34 SER 0.732 0.083 17 0 "[ . 1 . 2]"
1 35 GLY 0.223 0.025 12 0 "[ . 1 . 2]"
1 36 SER 0.008 0.008 13 0 "[ . 1 . 2]"
1 37 PHE 0.896 0.028 20 0 "[ . 1 . 2]"
1 38 ASN 0.099 0.010 18 0 "[ . 1 . 2]"
1 39 ASN 0.131 0.009 20 0 "[ . 1 . 2]"
1 40 TRP 0.705 0.025 12 0 "[ . 1 . 2]"
1 41 SER 0.021 0.021 17 0 "[ . 1 . 2]"
1 42 THR 0.069 0.021 17 0 "[ . 1 . 2]"
1 43 LYS 2.172 0.204 13 0 "[ . 1 . 2]"
1 44 ILE 1.690 0.054 16 0 "[ . 1 . 2]"
1 45 PRO 1.149 0.054 16 0 "[ . 1 . 2]"
1 46 LEU 0.565 0.099 16 0 "[ . 1 . 2]"
1 47 ILE 0.285 0.093 20 0 "[ . 1 . 2]"
1 48 LYS 0.980 0.121 20 0 "[ . 1 . 2]"
1 49 SER 0.207 0.121 20 0 "[ . 1 . 2]"
1 50 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 51 ASN 0.001 0.001 10 0 "[ . 1 . 2]"
1 52 ASP 0.053 0.015 16 0 "[ . 1 . 2]"
1 53 PHE 0.928 0.236 16 0 "[ . 1 . 2]"
1 54 VAL 0.661 0.075 16 0 "[ . 1 . 2]"
1 55 ALA 0.012 0.010 2 0 "[ . 1 . 2]"
1 56 ILE 0.520 0.050 7 0 "[ . 1 . 2]"
1 57 LEU 1.952 0.048 17 0 "[ . 1 . 2]"
1 58 ASP 0.012 0.012 15 0 "[ . 1 . 2]"
1 59 LEU 1.341 0.049 18 0 "[ . 1 . 2]"
1 60 PRO 0.045 0.012 14 0 "[ . 1 . 2]"
1 61 GLU 1.219 0.215 18 0 "[ . 1 . 2]"
1 62 GLY 0.623 0.081 18 0 "[ . 1 . 2]"
1 63 GLU 0.464 0.064 1 0 "[ . 1 . 2]"
1 64 HIS 1.120 0.049 18 0 "[ . 1 . 2]"
1 65 GLN 1.192 0.164 9 0 "[ . 1 . 2]"
1 66 TYR 1.248 0.043 8 0 "[ . 1 . 2]"
1 67 LYS 0.240 0.017 5 0 "[ . 1 . 2]"
1 68 PHE 0.936 0.057 2 0 "[ . 1 . 2]"
1 69 PHE 1.022 0.057 2 0 "[ . 1 . 2]"
1 70 VAL 0.418 0.106 16 0 "[ . 1 . 2]"
1 71 ASP 0.056 0.010 20 0 "[ . 1 . 2]"
1 72 GLY 0.021 0.007 18 0 "[ . 1 . 2]"
1 73 GLN 0.326 0.041 17 0 "[ . 1 . 2]"
1 74 TRP 1.036 0.126 17 0 "[ . 1 . 2]"
1 75 VAL 0.581 0.041 17 0 "[ . 1 . 2]"
1 76 HIS 2.119 0.111 17 0 "[ . 1 . 2]"
1 77 ASP 0.106 0.023 17 0 "[ . 1 . 2]"
1 78 PRO 1.946 0.111 17 0 "[ . 1 . 2]"
1 79 SER 0.078 0.011 6 0 "[ . 1 . 2]"
1 80 GLU 0.076 0.011 6 0 "[ . 1 . 2]"
1 81 PRO 0.405 0.077 17 0 "[ . 1 . 2]"
1 82 VAL 0.274 0.033 17 0 "[ . 1 . 2]"
1 83 VAL 0.247 0.042 17 0 "[ . 1 . 2]"
1 84 THR 0.476 0.059 17 0 "[ . 1 . 2]"
1 85 SER 0.689 0.056 13 0 "[ . 1 . 2]"
1 86 GLN 0.628 0.121 17 0 "[ . 1 . 2]"
1 87 LEU 0.843 0.121 17 0 "[ . 1 . 2]"
1 88 GLY 0.172 0.022 4 0 "[ . 1 . 2]"
1 89 THR 0.378 0.052 9 0 "[ . 1 . 2]"
1 90 ILE 0.916 0.059 17 0 "[ . 1 . 2]"
1 91 ASN 0.564 0.056 13 0 "[ . 1 . 2]"
1 92 ASN 0.296 0.033 17 0 "[ . 1 . 2]"
1 93 LEU 0.977 0.131 17 0 "[ . 1 . 2]"
1 94 ILE 1.017 0.131 17 0 "[ . 1 . 2]"
1 95 HIS 0.882 0.070 14 0 "[ . 1 . 2]"
1 96 VAL 0.789 0.066 15 0 "[ . 1 . 2]"
1 97 LYS 2.096 0.265 10 0 "[ . 1 . 2]"
1 98 LYS 1.253 0.120 18 0 "[ . 1 . 2]"
1 99 SER 0.173 0.037 13 0 "[ . 1 . 2]"
1 100 ASP 0.753 0.101 3 0 "[ . 1 . 2]"
1 101 PHE 1.455 0.154 6 0 "[ . 1 . 2]"
1 102 GLU 1.122 0.223 8 0 "[ . 1 . 2]"
1 103 VAL 1.544 0.223 8 0 "[ . 1 . 2]"
1 104 PHE 0.003 0.003 12 0 "[ . 1 . 2]"
1 105 ASP 0.001 0.001 5 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 3 MET H 1 3 MET QB . . 3.600 2.635 2.206 3.223 . 0 0 "[ . 1 . 2]" 1
2 1 4 GLY QA 1 5 ILE HA . . 4.760 3.983 3.935 4.085 . 0 0 "[ . 1 . 2]" 1
3 1 5 ILE HA 1 5 ILE MD . . 4.370 2.997 1.994 4.144 . 0 0 "[ . 1 . 2]" 1
4 1 5 ILE HA 1 5 ILE MG . . 3.640 2.690 2.121 3.202 . 0 0 "[ . 1 . 2]" 1
5 1 5 ILE HB 1 5 ILE MD . . 3.620 2.459 2.123 3.229 . 0 0 "[ . 1 . 2]" 1
6 1 5 ILE HG12 1 5 ILE MG . . 3.470 2.425 2.044 3.196 . 0 0 "[ . 1 . 2]" 1
7 1 5 ILE HG13 1 5 ILE MG . . 3.470 2.739 2.244 3.202 . 0 0 "[ . 1 . 2]" 1
8 1 6 ARG HA 1 6 ARG QD . . 4.230 3.462 2.044 4.230 . 6 0 "[ . 1 . 2]" 1
9 1 6 ARG HA 1 6 ARG QG . . 3.520 2.495 2.154 3.418 . 0 0 "[ . 1 . 2]" 1
10 1 6 ARG QB 1 6 ARG QD . . 3.270 2.239 2.065 2.620 . 0 0 "[ . 1 . 2]" 1
11 1 9 ASP H 1 10 SER H . . 3.610 2.350 2.009 2.948 . 0 0 "[ . 1 . 2]" 1
12 1 9 ASP HB2 1 10 SER H . . 5.320 3.235 2.151 4.114 . 0 0 "[ . 1 . 2]" 1
13 1 9 ASP HB3 1 10 SER H . . 5.320 3.601 2.146 4.142 . 0 0 "[ . 1 . 2]" 1
14 1 10 SER H 1 10 SER QB . . 3.540 2.869 2.259 3.385 . 0 0 "[ . 1 . 2]" 1
15 1 10 SER HA 1 11 VAL H . . 2.840 2.389 2.139 2.711 . 0 0 "[ . 1 . 2]" 1
16 1 10 SER HA 1 11 VAL MG1 . . 5.470 4.256 3.603 5.576 0.106 19 0 "[ . 1 . 2]" 1
17 1 10 SER HA 1 11 VAL QG . . 4.780 3.560 3.116 3.946 . 0 0 "[ . 1 . 2]" 1
18 1 10 SER HA 1 11 VAL MG2 . . 5.470 4.171 3.336 5.513 0.043 10 0 "[ . 1 . 2]" 1
19 1 10 SER QB 1 11 VAL H . . 4.270 3.440 1.971 3.995 . 0 0 "[ . 1 . 2]" 1
20 1 10 SER QB 1 11 VAL QG . . 4.760 4.038 3.258 4.743 . 0 0 "[ . 1 . 2]" 1
21 1 11 VAL H 1 11 VAL HB . . 3.960 3.511 2.744 3.933 . 0 0 "[ . 1 . 2]" 1
22 1 11 VAL H 1 11 VAL QG . . 3.040 2.280 1.898 2.957 . 0 0 "[ . 1 . 2]" 1
23 1 11 VAL H 1 12 LYS H . . 4.370 4.234 3.561 4.415 0.045 10 0 "[ . 1 . 2]" 1
24 1 11 VAL HA 1 11 VAL QG . . 2.940 2.173 2.061 2.313 . 0 0 "[ . 1 . 2]" 1
25 1 11 VAL HA 1 12 LYS H . . 2.440 2.198 2.140 2.426 . 0 0 "[ . 1 . 2]" 1
26 1 11 VAL HB 1 12 LYS H . . 4.330 3.568 2.582 4.306 . 0 0 "[ . 1 . 2]" 1
27 1 11 VAL QG 1 12 LYS H . . 3.880 3.075 2.121 3.708 . 0 0 "[ . 1 . 2]" 1
28 1 11 VAL MG1 1 12 LYS H . . 4.750 3.588 2.155 4.233 . 0 0 "[ . 1 . 2]" 1
29 1 11 VAL MG2 1 12 LYS H . . 4.750 3.707 2.132 4.232 . 0 0 "[ . 1 . 2]" 1
30 1 12 LYS H 1 13 PRO HA . . 4.810 4.421 4.118 5.112 0.302 19 0 "[ . 1 . 2]" 1
31 1 12 LYS H 1 13 PRO HB3 . . 5.380 5.011 4.551 5.328 . 0 0 "[ . 1 . 2]" 1
32 1 12 LYS H 1 13 PRO HD2 . . 4.340 3.754 3.130 4.010 . 0 0 "[ . 1 . 2]" 1
33 1 12 LYS H 1 13 PRO QD . . 3.710 2.827 2.382 3.127 . 0 0 "[ . 1 . 2]" 1
34 1 12 LYS H 1 13 PRO HD3 . . 4.340 2.926 2.433 3.263 . 0 0 "[ . 1 . 2]" 1
35 1 13 PRO HA 1 14 THR HG1 . . 5.310 5.079 4.391 5.315 0.005 13 0 "[ . 1 . 2]" 1
36 1 13 PRO HB2 1 14 THR H . . 3.910 3.509 2.933 3.792 . 0 0 "[ . 1 . 2]" 1
37 1 13 PRO HB2 1 14 THR HA . . 5.180 4.333 4.142 4.620 . 0 0 "[ . 1 . 2]" 1
38 1 13 PRO QD 1 14 THR H . . 4.110 2.693 2.617 2.775 . 0 0 "[ . 1 . 2]" 1
39 1 13 PRO HD2 1 14 THR H . . 4.700 2.746 2.664 2.836 . 0 0 "[ . 1 . 2]" 1
40 1 13 PRO HD3 1 14 THR H . . 4.700 3.889 3.839 3.942 . 0 0 "[ . 1 . 2]" 1
41 1 14 THR H 1 14 THR HB . . 3.800 3.389 2.635 3.798 . 0 0 "[ . 1 . 2]" 1
42 1 14 THR H 1 14 THR HG1 . . 3.440 2.194 1.948 3.035 . 0 0 "[ . 1 . 2]" 1
43 1 14 THR H 1 15 GLN H . . 4.690 4.391 2.988 4.648 . 0 0 "[ . 1 . 2]" 1
44 1 14 THR HA 1 14 THR HB . . 3.000 2.715 2.426 3.025 0.025 6 0 "[ . 1 . 2]" 1
45 1 14 THR HA 1 14 THR HG1 . . 3.600 3.173 2.571 3.558 . 0 0 "[ . 1 . 2]" 1
46 1 14 THR HA 1 15 GLN H . . 2.720 2.390 2.147 2.858 0.138 20 0 "[ . 1 . 2]" 1
47 1 14 THR HA 1 15 GLN HB2 . . 5.450 4.557 4.203 5.042 . 0 0 "[ . 1 . 2]" 1
48 1 14 THR HB 1 14 THR HG1 . . 2.850 2.743 2.460 2.853 0.003 19 0 "[ . 1 . 2]" 1
49 1 14 THR HB 1 15 GLN H . . 3.990 2.999 1.952 4.158 0.168 20 0 "[ . 1 . 2]" 1
50 1 14 THR HG1 1 15 GLN H . . 4.730 4.500 3.793 4.731 0.001 1 0 "[ . 1 . 2]" 1
51 1 15 GLN H 1 15 GLN HB2 . . 3.240 2.430 2.127 3.240 0.000 17 0 "[ . 1 . 2]" 1
52 1 15 GLN H 1 15 GLN HB3 . . 3.760 3.435 2.899 3.801 0.041 5 0 "[ . 1 . 2]" 1
53 1 15 GLN H 1 15 GLN HG2 . . 4.940 4.080 2.511 4.969 0.029 5 0 "[ . 1 . 2]" 1
54 1 15 GLN H 1 15 GLN QG . . 4.300 3.427 2.451 4.322 0.022 5 0 "[ . 1 . 2]" 1
55 1 15 GLN H 1 15 GLN HG3 . . 4.940 3.847 2.679 4.779 . 0 0 "[ . 1 . 2]" 1
56 1 15 GLN HA 1 15 GLN HG2 . . 3.700 2.948 2.120 3.677 . 0 0 "[ . 1 . 2]" 1
57 1 15 GLN HA 1 15 GLN QG . . 3.140 2.367 2.090 2.743 . 0 0 "[ . 1 . 2]" 1
58 1 15 GLN HA 1 15 GLN HG3 . . 3.700 2.776 2.203 3.704 0.004 6 0 "[ . 1 . 2]" 1
59 1 15 GLN HA 1 16 GLN H . . 2.680 2.484 2.143 2.686 0.006 5 0 "[ . 1 . 2]" 1
60 1 15 GLN HB2 1 15 GLN QE . . 4.420 3.773 2.995 4.330 . 0 0 "[ . 1 . 2]" 1
61 1 15 GLN HB3 1 16 GLN HA . . 4.490 4.411 4.063 4.500 0.010 18 0 "[ . 1 . 2]" 1
62 1 16 GLN H 1 16 GLN HB2 . . 3.370 2.822 2.436 3.571 0.201 1 0 "[ . 1 . 2]" 1
63 1 16 GLN H 1 16 GLN QB . . 2.900 2.398 2.180 2.848 . 0 0 "[ . 1 . 2]" 1
64 1 16 GLN H 1 16 GLN HB3 . . 3.370 2.670 2.202 3.119 . 0 0 "[ . 1 . 2]" 1
65 1 16 GLN H 1 17 ALA MB . . 5.500 4.519 3.963 5.064 . 0 0 "[ . 1 . 2]" 1
66 1 16 GLN HA 1 16 GLN QG . . 3.120 2.600 2.106 3.333 0.213 11 0 "[ . 1 . 2]" 1
67 1 16 GLN HA 1 17 ALA H . . 2.550 2.236 2.152 2.548 . 0 0 "[ . 1 . 2]" 1
68 1 16 GLN HA 1 17 ALA MB . . 4.380 3.824 3.704 3.912 . 0 0 "[ . 1 . 2]" 1
69 1 16 GLN QB 1 16 GLN QG . . 2.350 2.034 1.987 2.085 . 0 0 "[ . 1 . 2]" 1
70 1 16 GLN QB 1 17 ALA H . . 3.720 3.467 2.751 3.741 0.021 20 0 "[ . 1 . 2]" 1
71 1 16 GLN HB2 1 17 ALA H . . 4.340 4.038 2.837 4.335 . 0 0 "[ . 1 . 2]" 1
72 1 16 GLN HB3 1 17 ALA H . . 4.340 3.875 2.821 4.204 . 0 0 "[ . 1 . 2]" 1
73 1 16 GLN QG 1 17 ALA H . . 3.400 2.532 2.004 3.265 . 0 0 "[ . 1 . 2]" 1
74 1 16 GLN QG 1 17 ALA MB . . 4.970 4.231 3.961 4.370 . 0 0 "[ . 1 . 2]" 1
75 1 17 ALA H 1 17 ALA MB . . 3.080 2.811 2.151 2.878 . 0 0 "[ . 1 . 2]" 1
76 1 17 ALA H 1 18 ARG H . . 4.520 4.264 4.153 4.524 0.004 13 0 "[ . 1 . 2]" 1
77 1 17 ALA H 1 18 ARG HA . . 5.250 4.647 4.522 5.314 0.064 13 0 "[ . 1 . 2]" 1
78 1 17 ALA H 1 58 ASP HA . . 5.470 5.033 4.420 5.299 . 0 0 "[ . 1 . 2]" 1
79 1 17 ALA HA 1 18 ARG H . . 2.960 2.278 2.170 2.445 . 0 0 "[ . 1 . 2]" 1
80 1 17 ALA HA 1 18 ARG HA . . 4.720 4.328 4.316 4.348 . 0 0 "[ . 1 . 2]" 1
81 1 17 ALA HA 1 18 ARG QG . . 5.140 4.567 4.222 5.078 . 0 0 "[ . 1 . 2]" 1
82 1 17 ALA HA 1 60 PRO HA . . 4.410 4.139 3.755 4.409 . 0 0 "[ . 1 . 2]" 1
83 1 17 ALA MB 1 58 ASP HA . . 4.430 2.877 2.759 2.984 . 0 0 "[ . 1 . 2]" 1
84 1 17 ALA MB 1 58 ASP QB . . 3.570 2.130 1.950 2.351 . 0 0 "[ . 1 . 2]" 1
85 1 17 ALA MB 1 59 LEU H . . 4.410 2.583 2.516 2.695 . 0 0 "[ . 1 . 2]" 1
86 1 17 ALA MB 1 60 PRO HA . . 4.240 2.550 2.414 2.705 . 0 0 "[ . 1 . 2]" 1
87 1 18 ARG H 1 18 ARG HB2 . . 3.850 2.279 2.088 3.605 . 0 0 "[ . 1 . 2]" 1
88 1 18 ARG H 1 18 ARG QB . . 3.250 2.141 2.065 2.498 . 0 0 "[ . 1 . 2]" 1
89 1 18 ARG H 1 18 ARG HB3 . . 3.850 3.306 2.322 3.501 . 0 0 "[ . 1 . 2]" 1
90 1 18 ARG H 1 18 ARG QD . . 5.110 4.182 2.118 4.726 . 0 0 "[ . 1 . 2]" 1
91 1 18 ARG H 1 18 ARG QG . . 4.280 3.125 2.368 3.593 . 0 0 "[ . 1 . 2]" 1
92 1 18 ARG H 1 59 LEU H . . 4.310 4.136 4.005 4.305 . 0 0 "[ . 1 . 2]" 1
93 1 18 ARG HA 1 18 ARG QD . . 4.220 3.875 3.023 4.220 . 0 0 "[ . 1 . 2]" 1
94 1 18 ARG HA 1 18 ARG QG . . 3.570 2.289 2.006 3.350 . 0 0 "[ . 1 . 2]" 1
95 1 18 ARG HA 1 19 PRO QB . . 5.150 4.582 4.562 4.592 . 0 0 "[ . 1 . 2]" 1
96 1 18 ARG HA 1 19 PRO HD2 . . 3.700 2.460 2.375 2.501 . 0 0 "[ . 1 . 2]" 1
97 1 18 ARG HA 1 19 PRO HD3 . . 3.850 2.324 2.290 2.342 . 0 0 "[ . 1 . 2]" 1
98 1 18 ARG HA 1 19 PRO QG . . 4.040 4.040 3.986 4.066 0.026 20 0 "[ . 1 . 2]" 1
99 1 18 ARG HA 1 96 VAL MG1 . . 5.500 5.083 4.806 5.402 . 0 0 "[ . 1 . 2]" 1
100 1 18 ARG QB 1 18 ARG QD . . 3.110 2.073 1.979 2.207 . 0 0 "[ . 1 . 2]" 1
101 1 18 ARG QB 1 19 PRO HD2 . . 3.940 2.228 1.908 2.647 . 0 0 "[ . 1 . 2]" 1
102 1 18 ARG QB 1 19 PRO HD3 . . 4.270 3.523 3.203 3.814 . 0 0 "[ . 1 . 2]" 1
103 1 18 ARG QB 1 96 VAL MG1 . . 3.530 2.886 2.483 3.596 0.066 15 0 "[ . 1 . 2]" 1
104 1 18 ARG HB2 1 19 PRO HD2 . . 4.490 3.526 1.915 3.847 . 0 0 "[ . 1 . 2]" 1
105 1 18 ARG HB2 1 19 PRO HD3 . . 5.030 4.600 3.276 4.814 . 0 0 "[ . 1 . 2]" 1
106 1 18 ARG HB2 1 96 VAL MG1 . . 4.270 3.124 2.549 4.309 0.039 7 0 "[ . 1 . 2]" 1
107 1 18 ARG HB3 1 19 PRO HD2 . . 4.490 2.401 2.012 3.545 . 0 0 "[ . 1 . 2]" 1
108 1 18 ARG HB3 1 19 PRO HD3 . . 5.030 3.750 3.456 4.517 . 0 0 "[ . 1 . 2]" 1
109 1 18 ARG HB3 1 96 VAL MG1 . . 4.270 3.473 2.944 3.956 . 0 0 "[ . 1 . 2]" 1
110 1 18 ARG QD 1 19 PRO HD2 . . 4.370 3.281 1.985 4.365 . 0 0 "[ . 1 . 2]" 1
111 1 18 ARG QD 1 19 PRO HD3 . . 4.950 4.697 3.684 5.071 0.121 7 0 "[ . 1 . 2]" 1
112 1 18 ARG QD 1 96 VAL MG1 . . 3.730 3.534 2.008 3.751 0.021 2 0 "[ . 1 . 2]" 1
113 1 18 ARG QD 1 96 VAL MG2 . . 5.340 5.145 2.773 5.376 0.036 6 0 "[ . 1 . 2]" 1
114 1 18 ARG QD 1 97 LYS H . . 5.340 4.434 3.150 5.161 . 0 0 "[ . 1 . 2]" 1
115 1 18 ARG QG 1 19 PRO HD2 . . 4.520 2.348 1.987 3.893 . 0 0 "[ . 1 . 2]" 1
116 1 18 ARG QG 1 19 PRO HD3 . . 4.890 3.223 2.887 4.758 . 0 0 "[ . 1 . 2]" 1
117 1 18 ARG QG 1 96 VAL MG1 . . 4.890 4.165 1.877 4.675 . 0 0 "[ . 1 . 2]" 1
118 1 19 PRO HA 1 20 THR H . . 3.090 2.357 2.300 2.402 . 0 0 "[ . 1 . 2]" 1
119 1 19 PRO HA 1 20 THR HA . . 4.950 4.365 4.348 4.384 . 0 0 "[ . 1 . 2]" 1
120 1 19 PRO HA 1 56 ILE MD . . 4.470 4.400 4.306 4.475 0.005 13 0 "[ . 1 . 2]" 1
121 1 19 PRO HA 1 56 ILE MG . . 4.090 3.091 2.883 3.300 . 0 0 "[ . 1 . 2]" 1
122 1 19 PRO HA 1 58 ASP QB . . 5.000 4.325 4.074 4.805 . 0 0 "[ . 1 . 2]" 1
123 1 19 PRO QB 1 20 THR H . . 3.350 2.636 2.534 2.773 . 0 0 "[ . 1 . 2]" 1
124 1 19 PRO QB 1 56 ILE MG . . 3.140 2.119 2.018 2.209 . 0 0 "[ . 1 . 2]" 1
125 1 19 PRO QB 1 57 LEU H . . 3.880 3.644 3.610 3.662 . 0 0 "[ . 1 . 2]" 1
126 1 19 PRO QB 1 58 ASP HA . . 5.340 4.471 4.394 4.582 . 0 0 "[ . 1 . 2]" 1
127 1 19 PRO HB2 1 20 THR H . . 3.850 2.725 2.607 2.883 . 0 0 "[ . 1 . 2]" 1
128 1 19 PRO HB2 1 56 ILE MG . . 3.700 2.532 2.363 2.708 . 0 0 "[ . 1 . 2]" 1
129 1 19 PRO HB3 1 20 THR H . . 3.850 3.511 3.450 3.598 . 0 0 "[ . 1 . 2]" 1
130 1 19 PRO HB3 1 56 ILE MG . . 3.700 2.275 2.190 2.342 . 0 0 "[ . 1 . 2]" 1
131 1 19 PRO HD2 1 96 VAL MG1 . . 5.500 5.283 5.062 5.513 0.013 18 0 "[ . 1 . 2]" 1
132 1 19 PRO QG 1 20 THR H . . 4.640 4.240 4.162 4.339 . 0 0 "[ . 1 . 2]" 1
133 1 19 PRO QG 1 56 ILE MD . . 4.110 3.937 3.784 4.062 . 0 0 "[ . 1 . 2]" 1
134 1 19 PRO QG 1 56 ILE MG . . 3.660 3.640 3.442 3.680 0.020 16 0 "[ . 1 . 2]" 1
135 1 19 PRO QG 1 57 LEU H . . 5.500 5.514 5.482 5.527 0.027 17 0 "[ . 1 . 2]" 1
136 1 20 THR H 1 20 THR HB . . 3.310 2.703 2.630 2.774 . 0 0 "[ . 1 . 2]" 1
137 1 20 THR H 1 20 THR MG . . 3.420 2.124 2.083 2.175 . 0 0 "[ . 1 . 2]" 1
138 1 20 THR H 1 21 VAL H . . 4.760 4.571 4.548 4.597 . 0 0 "[ . 1 . 2]" 1
139 1 20 THR H 1 56 ILE H . . 5.500 5.519 5.492 5.550 0.050 7 0 "[ . 1 . 2]" 1
140 1 20 THR H 1 56 ILE HA . . 3.550 2.783 2.732 2.884 . 0 0 "[ . 1 . 2]" 1
141 1 20 THR H 1 56 ILE MD . . 3.650 3.272 3.031 3.493 . 0 0 "[ . 1 . 2]" 1
142 1 20 THR H 1 56 ILE MG . . 3.610 2.997 2.724 3.380 . 0 0 "[ . 1 . 2]" 1
143 1 20 THR H 1 57 LEU H . . 3.610 1.946 1.906 2.018 . 0 0 "[ . 1 . 2]" 1
144 1 20 THR H 1 57 LEU MD1 . . 5.030 4.875 4.768 4.953 . 0 0 "[ . 1 . 2]" 1
145 1 20 THR H 1 58 ASP H . . 5.500 5.321 5.193 5.475 . 0 0 "[ . 1 . 2]" 1
146 1 20 THR H 1 59 LEU H . . 4.860 4.886 4.873 4.896 0.036 17 0 "[ . 1 . 2]" 1
147 1 20 THR H 1 59 LEU MD1 . . 4.260 4.154 4.026 4.256 . 0 0 "[ . 1 . 2]" 1
148 1 20 THR H 1 59 LEU MD2 . . 5.500 5.491 5.369 5.520 0.020 14 0 "[ . 1 . 2]" 1
149 1 20 THR HA 1 20 THR MG . . 3.230 3.198 3.193 3.202 . 0 0 "[ . 1 . 2]" 1
150 1 20 THR HA 1 21 VAL H . . 3.030 2.321 2.288 2.332 . 0 0 "[ . 1 . 2]" 1
151 1 20 THR HA 1 21 VAL HA . . 5.320 4.378 4.368 4.384 . 0 0 "[ . 1 . 2]" 1
152 1 20 THR HA 1 57 LEU H . . 4.640 4.545 4.495 4.641 0.001 16 0 "[ . 1 . 2]" 1
153 1 20 THR HA 1 94 ILE MD . . 4.020 2.903 2.596 3.166 . 0 0 "[ . 1 . 2]" 1
154 1 20 THR HB 1 21 VAL H . . 4.450 3.969 3.942 4.031 . 0 0 "[ . 1 . 2]" 1
155 1 20 THR HB 1 22 ILE MD . . 4.810 3.530 3.497 3.569 . 0 0 "[ . 1 . 2]" 1
156 1 20 THR HB 1 57 LEU H . . 4.220 3.164 3.074 3.276 . 0 0 "[ . 1 . 2]" 1
157 1 20 THR HB 1 57 LEU HB2 . . 5.000 4.457 4.353 4.644 . 0 0 "[ . 1 . 2]" 1
158 1 20 THR HB 1 57 LEU HB3 . . 5.500 5.218 5.104 5.447 . 0 0 "[ . 1 . 2]" 1
159 1 20 THR HB 1 57 LEU MD1 . . 4.620 3.169 3.085 3.415 . 0 0 "[ . 1 . 2]" 1
160 1 20 THR HB 1 59 LEU H . . 4.970 4.610 4.459 4.759 . 0 0 "[ . 1 . 2]" 1
161 1 20 THR HB 1 59 LEU MD1 . . 3.860 2.019 1.930 2.248 . 0 0 "[ . 1 . 2]" 1
162 1 20 THR HB 1 59 LEU MD2 . . 5.030 3.913 3.756 4.002 . 0 0 "[ . 1 . 2]" 1
163 1 20 THR HB 1 59 LEU HG . . 4.650 3.023 2.868 3.148 . 0 0 "[ . 1 . 2]" 1
164 1 20 THR HB 1 94 ILE MD . . 4.440 3.587 3.449 3.679 . 0 0 "[ . 1 . 2]" 1
165 1 20 THR MG 1 21 VAL H . . 3.670 3.342 3.276 3.426 . 0 0 "[ . 1 . 2]" 1
166 1 20 THR MG 1 22 ILE H . . 3.680 3.320 3.280 3.357 . 0 0 "[ . 1 . 2]" 1
167 1 20 THR MG 1 22 ILE MD . . 2.890 1.774 1.758 1.792 . 0 0 "[ . 1 . 2]" 1
168 1 20 THR MG 1 57 LEU H . . 3.740 1.925 1.911 1.985 . 0 0 "[ . 1 . 2]" 1
169 1 20 THR MG 1 57 LEU HA . . 4.560 4.317 4.305 4.357 . 0 0 "[ . 1 . 2]" 1
170 1 20 THR MG 1 57 LEU HB3 . . 4.330 4.123 4.086 4.186 . 0 0 "[ . 1 . 2]" 1
171 1 20 THR MG 1 57 LEU MD1 . . 3.180 2.866 2.820 2.896 . 0 0 "[ . 1 . 2]" 1
172 1 20 THR MG 1 59 LEU MD1 . . 3.350 3.212 2.936 3.360 0.010 6 0 "[ . 1 . 2]" 1
173 1 21 VAL H 1 21 VAL HB . . 3.420 2.580 2.536 2.635 . 0 0 "[ . 1 . 2]" 1
174 1 21 VAL H 1 22 ILE H . . 4.280 4.113 4.090 4.150 . 0 0 "[ . 1 . 2]" 1
175 1 21 VAL H 1 22 ILE MD . . 5.090 3.109 2.984 3.235 . 0 0 "[ . 1 . 2]" 1
176 1 21 VAL H 1 59 LEU MD1 . . 5.170 4.459 4.282 4.726 . 0 0 "[ . 1 . 2]" 1
177 1 21 VAL H 1 94 ILE MD . . 3.080 2.225 2.070 2.560 . 0 0 "[ . 1 . 2]" 1
178 1 21 VAL H 1 94 ILE QG . . 4.980 4.057 3.884 4.392 . 0 0 "[ . 1 . 2]" 1
179 1 21 VAL HA 1 21 VAL MG1 . . 3.300 2.298 2.234 2.336 . 0 0 "[ . 1 . 2]" 1
180 1 21 VAL HA 1 22 ILE H . . 3.110 2.193 2.191 2.197 . 0 0 "[ . 1 . 2]" 1
181 1 21 VAL HB 1 22 ILE H . . 4.610 4.417 4.387 4.436 . 0 0 "[ . 1 . 2]" 1
182 1 21 VAL MG1 1 22 ILE H . . 3.420 3.164 3.076 3.285 . 0 0 "[ . 1 . 2]" 1
183 1 21 VAL MG1 1 22 ILE HA . . 3.890 3.749 3.688 3.848 . 0 0 "[ . 1 . 2]" 1
184 1 22 ILE H 1 22 ILE HB . . 3.430 2.574 2.566 2.582 . 0 0 "[ . 1 . 2]" 1
185 1 22 ILE H 1 22 ILE MD . . 4.030 3.160 3.087 3.292 . 0 0 "[ . 1 . 2]" 1
186 1 22 ILE H 1 22 ILE MG . . 4.060 3.617 3.582 3.649 . 0 0 "[ . 1 . 2]" 1
187 1 22 ILE H 1 23 ARG H . . 4.840 4.384 4.380 4.388 . 0 0 "[ . 1 . 2]" 1
188 1 22 ILE H 1 23 ARG QB . . 5.010 4.724 4.551 5.028 0.018 14 0 "[ . 1 . 2]" 1
189 1 22 ILE H 1 55 ALA MB . . 4.710 4.246 4.004 4.386 . 0 0 "[ . 1 . 2]" 1
190 1 22 ILE HA 1 22 ILE MD . . 3.560 3.151 3.115 3.174 . 0 0 "[ . 1 . 2]" 1
191 1 22 ILE HA 1 22 ILE MG . . 3.240 2.635 2.606 2.665 . 0 0 "[ . 1 . 2]" 1
192 1 22 ILE HA 1 23 ARG H . . 3.240 2.199 2.195 2.203 . 0 0 "[ . 1 . 2]" 1
193 1 22 ILE HB 1 33 ILE MD . . 4.880 3.472 3.322 3.549 . 0 0 "[ . 1 . 2]" 1
194 1 22 ILE HB 1 46 LEU MD1 . . 4.820 4.577 4.313 4.833 0.013 9 0 "[ . 1 . 2]" 1
195 1 22 ILE HB 1 46 LEU MD2 . . 4.760 4.564 3.974 4.762 0.002 7 0 "[ . 1 . 2]" 1
196 1 22 ILE HB 1 55 ALA MB . . 3.520 2.165 1.946 2.359 . 0 0 "[ . 1 . 2]" 1
197 1 22 ILE MD 1 22 ILE MG . . 3.250 3.060 3.024 3.081 . 0 0 "[ . 1 . 2]" 1
198 1 22 ILE MD 1 23 ARG H . . 4.800 4.810 4.772 4.832 0.032 15 0 "[ . 1 . 2]" 1
199 1 22 ILE MD 1 33 ILE HB . . 4.960 4.419 4.370 4.626 . 0 0 "[ . 1 . 2]" 1
200 1 22 ILE MD 1 33 ILE MD . . 3.460 1.961 1.933 2.059 . 0 0 "[ . 1 . 2]" 1
201 1 22 ILE MD 1 33 ILE MG . . 4.510 3.492 3.373 3.673 . 0 0 "[ . 1 . 2]" 1
202 1 22 ILE MD 1 37 PHE QE . . 4.620 4.636 4.612 4.648 0.028 20 0 "[ . 1 . 2]" 1
203 1 22 ILE MD 1 37 PHE HZ . . 5.260 5.219 5.148 5.267 0.007 7 0 "[ . 1 . 2]" 1
204 1 22 ILE MD 1 55 ALA MB . . 4.320 2.259 1.949 2.484 . 0 0 "[ . 1 . 2]" 1
205 1 22 ILE MD 1 59 LEU MD2 . . 5.460 5.169 5.037 5.279 . 0 0 "[ . 1 . 2]" 1
206 1 22 ILE MD 1 66 TYR QD . . 3.870 3.788 3.678 3.881 0.011 18 0 "[ . 1 . 2]" 1
207 1 22 ILE MD 1 66 TYR QE . . 3.860 3.780 3.662 3.855 . 0 0 "[ . 1 . 2]" 1
208 1 22 ILE MD 1 68 PHE QE . . 4.380 4.163 4.069 4.330 . 0 0 "[ . 1 . 2]" 1
209 1 22 ILE MD 1 68 PHE HZ . . 4.570 4.433 4.339 4.545 . 0 0 "[ . 1 . 2]" 1
210 1 22 ILE MD 1 94 ILE HB . . 4.930 4.183 4.101 4.296 . 0 0 "[ . 1 . 2]" 1
211 1 22 ILE MD 1 94 ILE MD . . 3.280 2.644 2.525 2.774 . 0 0 "[ . 1 . 2]" 1
212 1 22 ILE MD 1 94 ILE QG . . 5.320 4.541 4.419 4.672 . 0 0 "[ . 1 . 2]" 1
213 1 22 ILE MD 1 94 ILE MG . . 4.150 4.126 3.978 4.180 0.030 17 0 "[ . 1 . 2]" 1
214 1 22 ILE QG 1 33 ILE MD . . 3.140 1.891 1.865 1.963 . 0 0 "[ . 1 . 2]" 1
215 1 22 ILE QG 1 66 TYR QD . . 4.060 3.590 3.488 3.677 . 0 0 "[ . 1 . 2]" 1
216 1 22 ILE QG 1 66 TYR QE . . 3.910 2.981 2.885 3.083 . 0 0 "[ . 1 . 2]" 1
217 1 22 ILE HG12 1 33 ILE MD . . 3.760 1.907 1.880 1.978 . 0 0 "[ . 1 . 2]" 1
218 1 22 ILE HG13 1 33 ILE MD . . 3.760 3.137 3.085 3.285 . 0 0 "[ . 1 . 2]" 1
219 1 22 ILE MG 1 23 ARG H . . 3.460 2.298 2.281 2.335 . 0 0 "[ . 1 . 2]" 1
220 1 22 ILE MG 1 31 VAL QG . . 4.340 4.145 4.068 4.255 . 0 0 "[ . 1 . 2]" 1
221 1 22 ILE MG 1 54 VAL QG . . 3.770 3.246 2.861 3.549 . 0 0 "[ . 1 . 2]" 1
222 1 22 ILE MG 1 55 ALA MB . . 3.770 1.963 1.867 2.109 . 0 0 "[ . 1 . 2]" 1
223 1 22 ILE MG 1 66 TYR QD . . 4.840 4.743 4.538 4.833 . 0 0 "[ . 1 . 2]" 1
224 1 22 ILE MG 1 66 TYR QE . . 4.210 3.966 3.842 4.049 . 0 0 "[ . 1 . 2]" 1
225 1 22 ILE MG 1 68 PHE QD . . 4.520 3.868 3.800 3.922 . 0 0 "[ . 1 . 2]" 1
226 1 22 ILE MG 1 68 PHE QE . . 3.230 1.902 1.871 1.921 . 0 0 "[ . 1 . 2]" 1
227 1 22 ILE MG 1 68 PHE HZ . . 3.240 1.986 1.950 2.090 . 0 0 "[ . 1 . 2]" 1
228 1 23 ARG H 1 23 ARG HB2 . . 3.960 3.690 2.777 3.914 . 0 0 "[ . 1 . 2]" 1
229 1 23 ARG H 1 23 ARG HB3 . . 3.960 3.450 2.813 3.757 . 0 0 "[ . 1 . 2]" 1
230 1 23 ARG H 1 23 ARG QG . . 3.990 2.690 2.285 4.019 0.029 8 0 "[ . 1 . 2]" 1
231 1 23 ARG H 1 24 TRP H . . 4.830 3.911 3.824 4.221 . 0 0 "[ . 1 . 2]" 1
232 1 23 ARG H 1 54 VAL QG . . 4.760 4.331 4.206 4.577 . 0 0 "[ . 1 . 2]" 1
233 1 23 ARG HA 1 24 TRP H . . 3.240 2.159 2.139 2.173 . 0 0 "[ . 1 . 2]" 1
234 1 23 ARG HA 1 46 LEU MD2 . . 4.230 4.139 3.786 4.236 0.006 11 0 "[ . 1 . 2]" 1
235 1 23 ARG HA 1 54 VAL HA . . 3.730 2.730 2.418 2.881 . 0 0 "[ . 1 . 2]" 1
236 1 23 ARG HA 1 54 VAL HB . . 5.310 4.515 3.928 5.161 . 0 0 "[ . 1 . 2]" 1
237 1 23 ARG HA 1 54 VAL QG . . 3.700 2.215 1.994 2.823 . 0 0 "[ . 1 . 2]" 1
238 1 23 ARG QB 1 23 ARG QD . . 3.320 2.127 1.941 2.480 . 0 0 "[ . 1 . 2]" 1
239 1 23 ARG QB 1 24 TRP H . . 3.630 3.530 3.374 3.683 0.053 8 0 "[ . 1 . 2]" 1
240 1 23 ARG QB 1 54 VAL HA . . 4.560 4.355 3.942 4.603 0.043 13 0 "[ . 1 . 2]" 1
241 1 23 ARG QB 1 54 VAL QG . . 3.410 2.874 2.523 3.370 . 0 0 "[ . 1 . 2]" 1
242 1 23 ARG HB2 1 24 TRP H . . 4.400 3.874 3.731 4.469 0.069 9 0 "[ . 1 . 2]" 1
243 1 23 ARG HB2 1 54 VAL HA . . 5.220 5.129 4.072 5.254 0.034 20 0 "[ . 1 . 2]" 1
244 1 23 ARG HB3 1 24 TRP H . . 4.400 4.227 3.495 4.375 . 0 0 "[ . 1 . 2]" 1
245 1 23 ARG HB3 1 54 VAL HA . . 5.220 4.779 4.613 5.260 0.040 7 0 "[ . 1 . 2]" 1
246 1 23 ARG QD 1 54 VAL QG . . 4.830 4.252 3.272 4.806 . 0 0 "[ . 1 . 2]" 1
247 1 24 TRP H 1 24 TRP HB2 . . 4.120 3.190 3.103 3.368 . 0 0 "[ . 1 . 2]" 1
248 1 24 TRP H 1 24 TRP HB3 . . 3.920 2.567 2.490 2.767 . 0 0 "[ . 1 . 2]" 1
249 1 24 TRP H 1 25 SER H . . 4.550 4.365 4.249 4.460 . 0 0 "[ . 1 . 2]" 1
250 1 24 TRP H 1 31 VAL QG . . 4.920 4.644 4.523 4.790 . 0 0 "[ . 1 . 2]" 1
251 1 24 TRP H 1 46 LEU MD2 . . 3.520 3.295 3.160 3.528 0.008 8 0 "[ . 1 . 2]" 1
252 1 24 TRP H 1 53 PHE H . . 3.860 3.568 3.280 3.870 0.010 12 0 "[ . 1 . 2]" 1
253 1 24 TRP H 1 53 PHE HB2 . . 4.370 3.046 2.769 3.239 . 0 0 "[ . 1 . 2]" 1
254 1 24 TRP H 1 53 PHE HB3 . . 4.570 4.235 3.775 4.570 . 0 0 "[ . 1 . 2]" 1
255 1 24 TRP H 1 53 PHE QD . . 4.710 4.495 4.275 4.657 . 0 0 "[ . 1 . 2]" 1
256 1 24 TRP H 1 54 VAL H . . 4.970 4.710 4.569 4.910 . 0 0 "[ . 1 . 2]" 1
257 1 24 TRP H 1 54 VAL HA . . 4.020 3.416 3.255 3.686 . 0 0 "[ . 1 . 2]" 1
258 1 24 TRP H 1 54 VAL QG . . 3.960 3.410 3.221 3.691 . 0 0 "[ . 1 . 2]" 1
259 1 24 TRP HA 1 25 SER H . . 3.080 2.163 2.145 2.205 . 0 0 "[ . 1 . 2]" 1
260 1 24 TRP HA 1 46 LEU MD2 . . 4.920 4.826 4.654 4.966 0.046 16 0 "[ . 1 . 2]" 1
261 1 24 TRP HA 1 68 PHE QD . . 5.500 5.382 5.229 5.505 0.005 8 0 "[ . 1 . 2]" 1
262 1 24 TRP HA 1 68 PHE QE . . 4.990 4.491 4.330 4.670 . 0 0 "[ . 1 . 2]" 1
263 1 24 TRP HB2 1 25 SER H . . 4.360 4.116 3.970 4.184 . 0 0 "[ . 1 . 2]" 1
264 1 24 TRP HB2 1 31 VAL QG . . 4.970 3.513 3.360 4.073 . 0 0 "[ . 1 . 2]" 1
265 1 24 TRP HB2 1 46 LEU MD1 . . 5.500 5.012 4.795 5.165 . 0 0 "[ . 1 . 2]" 1
266 1 24 TRP HB2 1 46 LEU MD2 . . 4.900 3.306 3.076 3.478 . 0 0 "[ . 1 . 2]" 1
267 1 24 TRP HB2 1 68 PHE QE . . 4.400 3.456 3.326 3.647 . 0 0 "[ . 1 . 2]" 1
268 1 24 TRP HB3 1 24 TRP HE1 . . 4.990 4.794 4.782 4.808 . 0 0 "[ . 1 . 2]" 1
269 1 24 TRP HB3 1 25 SER H . . 4.430 4.232 4.137 4.316 . 0 0 "[ . 1 . 2]" 1
270 1 24 TRP HB3 1 31 VAL QG . . 4.150 2.777 2.630 3.175 . 0 0 "[ . 1 . 2]" 1
271 1 24 TRP HB3 1 46 LEU MD2 . . 4.180 2.607 2.403 2.794 . 0 0 "[ . 1 . 2]" 1
272 1 24 TRP HB3 1 53 PHE QD . . 4.330 3.794 3.485 4.075 . 0 0 "[ . 1 . 2]" 1
273 1 24 TRP HD1 1 25 SER H . . 4.560 4.139 3.997 4.291 . 0 0 "[ . 1 . 2]" 1
274 1 24 TRP HD1 1 27 GLY H . . 4.740 4.197 4.085 4.315 . 0 0 "[ . 1 . 2]" 1
275 1 24 TRP HD1 1 31 VAL HB . . 4.650 4.607 4.361 4.659 0.009 9 0 "[ . 1 . 2]" 1
276 1 24 TRP HD1 1 31 VAL MG1 . . 3.720 3.136 2.474 3.318 . 0 0 "[ . 1 . 2]" 1
277 1 24 TRP HD1 1 31 VAL QG . . 3.080 2.349 2.232 2.486 . 0 0 "[ . 1 . 2]" 1
278 1 24 TRP HD1 1 31 VAL MG2 . . 3.720 2.461 2.289 3.240 . 0 0 "[ . 1 . 2]" 1
279 1 24 TRP HD1 1 46 LEU MD2 . . 4.860 3.955 3.675 4.168 . 0 0 "[ . 1 . 2]" 1
280 1 24 TRP HD1 1 53 PHE HB2 . . 3.680 2.800 2.439 2.957 . 0 0 "[ . 1 . 2]" 1
281 1 24 TRP HD1 1 53 PHE HB3 . . 4.250 4.099 3.450 4.265 0.015 20 0 "[ . 1 . 2]" 1
282 1 24 TRP HD1 1 53 PHE QD . . 2.940 2.469 2.126 2.840 . 0 0 "[ . 1 . 2]" 1
283 1 24 TRP HD1 1 70 VAL MG1 . . 4.340 4.208 4.024 4.353 0.013 15 0 "[ . 1 . 2]" 1
284 1 24 TRP HD1 1 70 VAL MG2 . . 4.430 3.457 3.284 3.660 . 0 0 "[ . 1 . 2]" 1
285 1 24 TRP HE1 1 25 SER H . . 5.130 4.946 4.758 5.126 . 0 0 "[ . 1 . 2]" 1
286 1 24 TRP HE1 1 25 SER HA . . 4.980 4.869 4.758 4.973 . 0 0 "[ . 1 . 2]" 1
287 1 24 TRP HE1 1 26 GLU HA . . 4.610 4.510 4.436 4.596 . 0 0 "[ . 1 . 2]" 1
288 1 24 TRP HE1 1 26 GLU HB2 . . 3.930 2.338 2.218 2.477 . 0 0 "[ . 1 . 2]" 1
289 1 24 TRP HE1 1 26 GLU QB . . 3.410 1.895 1.850 1.971 . 0 0 "[ . 1 . 2]" 1
290 1 24 TRP HE1 1 26 GLU HB3 . . 3.930 2.008 1.944 2.100 . 0 0 "[ . 1 . 2]" 1
291 1 24 TRP HE1 1 26 GLU HG2 . . 4.490 3.665 3.384 4.487 . 0 0 "[ . 1 . 2]" 1
292 1 24 TRP HE1 1 26 GLU HG3 . . 4.490 4.311 3.527 4.431 . 0 0 "[ . 1 . 2]" 1
293 1 24 TRP HE1 1 27 GLY H . . 3.410 3.263 3.181 3.379 . 0 0 "[ . 1 . 2]" 1
294 1 24 TRP HE1 1 28 GLY HA3 . . 4.880 4.695 4.470 4.867 . 0 0 "[ . 1 . 2]" 1
295 1 24 TRP HE1 1 31 VAL MG1 . . 4.700 4.118 2.879 4.326 . 0 0 "[ . 1 . 2]" 1
296 1 24 TRP HE1 1 31 VAL QG . . 3.540 3.065 2.771 3.193 . 0 0 "[ . 1 . 2]" 1
297 1 24 TRP HE1 1 31 VAL MG2 . . 4.700 3.243 2.841 4.706 0.006 16 0 "[ . 1 . 2]" 1
298 1 24 TRP HE1 1 53 PHE HB2 . . 5.500 5.355 5.008 5.525 0.025 7 0 "[ . 1 . 2]" 1
299 1 24 TRP HE1 1 53 PHE QD . . 4.540 4.475 4.226 4.561 0.021 16 0 "[ . 1 . 2]" 1
300 1 24 TRP HE1 1 70 VAL HB . . 4.760 4.134 3.990 4.282 . 0 0 "[ . 1 . 2]" 1
301 1 24 TRP HE1 1 70 VAL MG1 . . 3.330 2.577 2.337 2.837 . 0 0 "[ . 1 . 2]" 1
302 1 24 TRP HE1 1 70 VAL MG2 . . 3.850 2.596 2.370 2.749 . 0 0 "[ . 1 . 2]" 1
303 1 24 TRP HE1 1 75 VAL MG2 . . 4.500 4.508 4.491 4.520 0.020 16 0 "[ . 1 . 2]" 1
304 1 24 TRP HE3 1 68 PHE QD . . 4.160 2.724 2.510 3.011 . 0 0 "[ . 1 . 2]" 1
305 1 24 TRP HE3 1 68 PHE QE . . 4.140 2.992 2.729 3.258 . 0 0 "[ . 1 . 2]" 1
306 1 24 TRP HE3 1 68 PHE HZ . . 4.850 4.446 4.216 4.625 . 0 0 "[ . 1 . 2]" 1
307 1 24 TRP HH2 1 26 GLU QB . . 4.550 4.360 4.179 4.544 . 0 0 "[ . 1 . 2]" 1
308 1 24 TRP HH2 1 26 GLU QG . . 4.730 4.567 4.356 4.735 0.005 17 0 "[ . 1 . 2]" 1
309 1 24 TRP HH2 1 70 VAL MG2 . . 4.450 4.127 3.773 4.363 . 0 0 "[ . 1 . 2]" 1
310 1 24 TRP HH2 1 75 VAL HB . . 3.960 3.025 2.854 3.178 . 0 0 "[ . 1 . 2]" 1
311 1 24 TRP HH2 1 75 VAL MG1 . . 3.920 3.927 3.920 3.937 0.017 17 0 "[ . 1 . 2]" 1
312 1 24 TRP HH2 1 75 VAL MG2 . . 3.210 2.400 2.192 2.641 . 0 0 "[ . 1 . 2]" 1
313 1 24 TRP HH2 1 77 ASP HA . . 4.760 4.630 4.383 4.766 0.006 7 0 "[ . 1 . 2]" 1
314 1 24 TRP HZ2 1 26 GLU HB2 . . 3.640 2.713 2.451 2.903 . 0 0 "[ . 1 . 2]" 1
315 1 24 TRP HZ2 1 26 GLU QB . . 3.120 2.609 2.388 2.760 . 0 0 "[ . 1 . 2]" 1
316 1 24 TRP HZ2 1 26 GLU HB3 . . 3.640 3.390 3.272 3.586 . 0 0 "[ . 1 . 2]" 1
317 1 24 TRP HZ2 1 26 GLU QG . . 3.820 2.726 2.520 3.331 . 0 0 "[ . 1 . 2]" 1
318 1 24 TRP HZ2 1 70 VAL MG1 . . 3.860 3.490 3.189 3.729 . 0 0 "[ . 1 . 2]" 1
319 1 24 TRP HZ2 1 70 VAL MG2 . . 3.770 3.150 2.838 3.357 . 0 0 "[ . 1 . 2]" 1
320 1 24 TRP HZ2 1 75 VAL HB . . 4.670 4.569 4.382 4.673 0.003 2 0 "[ . 1 . 2]" 1
321 1 24 TRP HZ2 1 75 VAL MG1 . . 4.270 4.225 4.137 4.276 0.006 11 0 "[ . 1 . 2]" 1
322 1 24 TRP HZ2 1 75 VAL MG2 . . 3.370 2.765 2.617 2.947 . 0 0 "[ . 1 . 2]" 1
323 1 24 TRP HZ3 1 68 PHE HB2 . . 4.910 3.952 3.467 4.364 . 0 0 "[ . 1 . 2]" 1
324 1 24 TRP HZ3 1 68 PHE HB3 . . 5.020 4.520 4.078 4.850 . 0 0 "[ . 1 . 2]" 1
325 1 24 TRP HZ3 1 70 VAL MG2 . . 4.900 4.742 4.416 4.905 0.005 7 0 "[ . 1 . 2]" 1
326 1 24 TRP HZ3 1 75 VAL HB . . 5.460 4.365 4.237 4.467 . 0 0 "[ . 1 . 2]" 1
327 1 24 TRP HZ3 1 75 VAL MG2 . . 3.730 3.119 3.023 3.307 . 0 0 "[ . 1 . 2]" 1
328 1 24 TRP HZ3 1 76 HIS H . . 5.130 4.219 4.057 4.421 . 0 0 "[ . 1 . 2]" 1
329 1 24 TRP HZ3 1 76 HIS HA . . 4.900 3.250 2.799 3.667 . 0 0 "[ . 1 . 2]" 1
330 1 24 TRP HZ3 1 77 ASP H . . 4.630 3.373 2.754 3.706 . 0 0 "[ . 1 . 2]" 1
331 1 24 TRP HZ3 1 77 ASP HA . . 4.190 3.521 3.175 3.780 . 0 0 "[ . 1 . 2]" 1
332 1 24 TRP HZ3 1 77 ASP QB . . 4.070 3.025 2.384 3.859 . 0 0 "[ . 1 . 2]" 1
333 1 25 SER H 1 25 SER HB2 . . 4.010 3.602 2.951 3.861 . 0 0 "[ . 1 . 2]" 1
334 1 25 SER H 1 25 SER QB . . 3.290 2.973 2.491 3.204 . 0 0 "[ . 1 . 2]" 1
335 1 25 SER H 1 25 SER HB3 . . 4.010 3.268 2.557 3.870 . 0 0 "[ . 1 . 2]" 1
336 1 25 SER H 1 26 GLU HA . . 4.980 4.918 4.832 5.000 0.020 16 0 "[ . 1 . 2]" 1
337 1 25 SER H 1 53 PHE H . . 5.360 4.990 4.811 5.259 . 0 0 "[ . 1 . 2]" 1
338 1 25 SER HA 1 52 ASP HA . . 4.140 3.969 3.762 4.155 0.015 16 0 "[ . 1 . 2]" 1
339 1 25 SER HA 1 52 ASP HB2 . . 4.540 2.783 2.398 4.543 0.003 11 0 "[ . 1 . 2]" 1
340 1 25 SER HA 1 52 ASP HB3 . . 4.540 3.527 2.654 4.126 . 0 0 "[ . 1 . 2]" 1
341 1 25 SER HA 1 53 PHE H . . 3.840 3.275 3.024 3.523 . 0 0 "[ . 1 . 2]" 1
342 1 25 SER QB 1 52 ASP HA . . 4.580 4.113 3.751 4.587 0.007 19 0 "[ . 1 . 2]" 1
343 1 25 SER QB 1 52 ASP QB . . 4.750 2.274 1.940 2.927 . 0 0 "[ . 1 . 2]" 1
344 1 26 GLU HA 1 26 GLU HG2 . . 3.880 3.516 2.338 3.737 . 0 0 "[ . 1 . 2]" 1
345 1 26 GLU HA 1 26 GLU QG . . 3.370 2.671 2.305 2.816 . 0 0 "[ . 1 . 2]" 1
346 1 26 GLU HA 1 26 GLU HG3 . . 3.880 2.827 2.618 3.508 . 0 0 "[ . 1 . 2]" 1
347 1 26 GLU HA 1 27 GLY HA3 . . 5.260 4.539 4.536 4.542 . 0 0 "[ . 1 . 2]" 1
348 1 26 GLU HB2 1 27 GLY H . . 3.720 3.466 3.402 3.512 . 0 0 "[ . 1 . 2]" 1
349 1 26 GLU HB3 1 27 GLY H . . 3.720 2.023 1.950 2.109 . 0 0 "[ . 1 . 2]" 1
350 1 26 GLU QG 1 27 GLY H . . 3.740 3.402 3.237 3.738 . 0 0 "[ . 1 . 2]" 1
351 1 26 GLU QG 1 28 GLY H . . 4.480 4.119 3.926 4.482 0.002 4 0 "[ . 1 . 2]" 1
352 1 26 GLU HG2 1 27 GLY H . . 4.410 4.042 3.327 4.318 . 0 0 "[ . 1 . 2]" 1
353 1 26 GLU HG3 1 27 GLY H . . 4.410 3.777 3.492 4.427 0.017 17 0 "[ . 1 . 2]" 1
354 1 27 GLY H 1 27 GLY HA2 . . 2.920 2.513 2.451 2.519 . 0 0 "[ . 1 . 2]" 1
355 1 27 GLY H 1 28 GLY H . . 3.350 1.950 1.894 2.060 . 0 0 "[ . 1 . 2]" 1
356 1 27 GLY H 1 28 GLY HA3 . . 4.260 4.126 4.109 4.260 0.000 16 0 "[ . 1 . 2]" 1
357 1 27 GLY H 1 31 VAL QG . . 4.570 4.292 4.099 4.432 . 0 0 "[ . 1 . 2]" 1
358 1 27 GLY H 1 53 PHE QD . . 4.400 4.333 4.178 4.409 0.009 3 0 "[ . 1 . 2]" 1
359 1 27 GLY H 1 53 PHE QE . . 4.000 2.833 2.459 3.101 . 0 0 "[ . 1 . 2]" 1
360 1 27 GLY H 1 53 PHE HZ . . 5.030 4.307 3.660 4.804 . 0 0 "[ . 1 . 2]" 1
361 1 27 GLY H 1 70 VAL MG1 . . 4.660 3.988 3.763 4.162 . 0 0 "[ . 1 . 2]" 1
362 1 27 GLY HA2 1 28 GLY H . . 2.970 2.868 2.803 2.929 . 0 0 "[ . 1 . 2]" 1
363 1 28 GLY H 1 29 LYS H . . 4.430 4.348 4.233 4.400 . 0 0 "[ . 1 . 2]" 1
364 1 28 GLY H 1 30 GLU H . . 5.500 5.307 5.097 5.498 . 0 0 "[ . 1 . 2]" 1
365 1 28 GLY H 1 31 VAL QG . . 4.200 3.735 3.644 3.871 . 0 0 "[ . 1 . 2]" 1
366 1 28 GLY H 1 53 PHE QE . . 3.720 3.334 3.057 3.658 . 0 0 "[ . 1 . 2]" 1
367 1 28 GLY H 1 70 VAL MG1 . . 3.880 3.167 3.048 3.283 . 0 0 "[ . 1 . 2]" 1
368 1 28 GLY HA2 1 29 LYS H . . 3.340 2.806 2.746 2.921 . 0 0 "[ . 1 . 2]" 1
369 1 28 GLY HA2 1 30 GLU H . . 4.980 4.706 4.561 4.981 0.001 16 0 "[ . 1 . 2]" 1
370 1 28 GLY HA2 1 31 VAL QG . . 5.160 5.113 4.953 5.168 0.008 17 0 "[ . 1 . 2]" 1
371 1 28 GLY HA2 1 70 VAL MG1 . . 3.880 3.497 3.394 3.720 . 0 0 "[ . 1 . 2]" 1
372 1 28 GLY HA3 1 29 LYS H . . 3.400 2.345 2.263 2.393 . 0 0 "[ . 1 . 2]" 1
373 1 28 GLY HA3 1 30 GLU H . . 3.950 3.614 3.435 3.876 . 0 0 "[ . 1 . 2]" 1
374 1 28 GLY HA3 1 31 VAL QG . . 4.420 3.756 3.585 3.843 . 0 0 "[ . 1 . 2]" 1
375 1 28 GLY HA3 1 70 VAL MG1 . . 3.790 2.316 2.213 2.499 . 0 0 "[ . 1 . 2]" 1
376 1 29 LYS H 1 29 LYS QB . . 3.060 2.456 2.272 2.578 . 0 0 "[ . 1 . 2]" 1
377 1 29 LYS H 1 29 LYS QD . . 4.820 4.340 3.910 4.673 . 0 0 "[ . 1 . 2]" 1
378 1 29 LYS H 1 29 LYS HG2 . . 3.990 3.107 2.429 3.571 . 0 0 "[ . 1 . 2]" 1
379 1 29 LYS H 1 29 LYS QG . . 3.430 2.714 2.402 3.401 . 0 0 "[ . 1 . 2]" 1
380 1 29 LYS H 1 29 LYS HG3 . . 3.990 3.327 2.667 4.275 0.285 15 0 "[ . 1 . 2]" 1
381 1 29 LYS H 1 30 GLU H . . 2.960 2.121 2.049 2.263 . 0 0 "[ . 1 . 2]" 1
382 1 29 LYS H 1 30 GLU HA . . 4.940 4.740 4.677 4.785 . 0 0 "[ . 1 . 2]" 1
383 1 29 LYS H 1 30 GLU HG2 . . 4.590 4.090 3.931 4.278 . 0 0 "[ . 1 . 2]" 1
384 1 29 LYS H 1 31 VAL QG . . 4.540 4.480 4.329 4.542 0.002 19 0 "[ . 1 . 2]" 1
385 1 29 LYS H 1 70 VAL MG1 . . 4.000 3.300 3.072 3.451 . 0 0 "[ . 1 . 2]" 1
386 1 29 LYS H 1 71 ASP H . . 4.640 3.524 3.319 3.832 . 0 0 "[ . 1 . 2]" 1
387 1 29 LYS HA 1 29 LYS HD2 . . 5.270 3.918 2.233 4.816 . 0 0 "[ . 1 . 2]" 1
388 1 29 LYS HA 1 29 LYS QD . . 4.590 3.291 2.128 4.337 . 0 0 "[ . 1 . 2]" 1
389 1 29 LYS HA 1 29 LYS HD3 . . 5.270 3.770 2.145 5.238 . 0 0 "[ . 1 . 2]" 1
390 1 29 LYS HA 1 29 LYS HE2 . . 5.290 4.193 2.055 5.296 0.006 9 0 "[ . 1 . 2]" 1
391 1 29 LYS HA 1 29 LYS QE . . 4.570 3.734 2.022 4.503 . 0 0 "[ . 1 . 2]" 1
392 1 29 LYS HA 1 29 LYS HE3 . . 5.290 4.340 2.802 5.219 . 0 0 "[ . 1 . 2]" 1
393 1 29 LYS HA 1 29 LYS HG2 . . 3.930 2.659 2.344 3.764 . 0 0 "[ . 1 . 2]" 1
394 1 29 LYS HA 1 29 LYS QG . . 3.450 2.562 2.303 2.999 . 0 0 "[ . 1 . 2]" 1
395 1 29 LYS HA 1 29 LYS HG3 . . 3.930 3.565 3.078 3.837 . 0 0 "[ . 1 . 2]" 1
396 1 29 LYS QB 1 29 LYS HD2 . . 3.460 2.689 2.087 3.302 . 0 0 "[ . 1 . 2]" 1
397 1 29 LYS QB 1 29 LYS QD . . 3.020 2.208 2.049 2.556 . 0 0 "[ . 1 . 2]" 1
398 1 29 LYS QB 1 29 LYS HD3 . . 3.460 2.726 2.095 3.442 . 0 0 "[ . 1 . 2]" 1
399 1 29 LYS QB 1 29 LYS QE . . 4.420 2.699 1.977 3.750 . 0 0 "[ . 1 . 2]" 1
400 1 29 LYS QB 1 30 GLU H . . 2.880 2.713 2.460 2.920 0.040 15 0 "[ . 1 . 2]" 1
401 1 29 LYS QB 1 30 GLU HG2 . . 4.090 3.238 2.832 3.769 . 0 0 "[ . 1 . 2]" 1
402 1 29 LYS QB 1 71 ASP H . . 4.720 4.608 4.408 4.729 0.009 16 0 "[ . 1 . 2]" 1
403 1 29 LYS QB 1 72 GLY H . . 5.500 5.309 4.827 5.505 0.005 3 0 "[ . 1 . 2]" 1
404 1 29 LYS QE 1 29 LYS QG . . 3.270 2.189 2.023 2.567 . 0 0 "[ . 1 . 2]" 1
405 1 29 LYS QG 1 30 GLU H . . 4.130 3.980 2.454 4.132 0.002 9 0 "[ . 1 . 2]" 1
406 1 29 LYS QG 1 30 GLU HG2 . . 5.340 4.875 2.103 5.293 . 0 0 "[ . 1 . 2]" 1
407 1 29 LYS HG2 1 30 GLU H . . 4.870 4.483 2.511 4.859 . 0 0 "[ . 1 . 2]" 1
408 1 29 LYS HG3 1 30 GLU H . . 4.870 4.559 3.453 4.875 0.005 14 0 "[ . 1 . 2]" 1
409 1 30 GLU H 1 31 VAL H . . 4.210 4.189 4.101 4.221 0.011 12 0 "[ . 1 . 2]" 1
410 1 30 GLU H 1 31 VAL QG . . 4.020 3.708 3.536 3.821 . 0 0 "[ . 1 . 2]" 1
411 1 30 GLU H 1 70 VAL MG1 . . 4.130 3.311 3.091 3.585 . 0 0 "[ . 1 . 2]" 1
412 1 30 GLU HA 1 30 GLU HG2 . . 3.800 3.660 3.602 3.743 . 0 0 "[ . 1 . 2]" 1
413 1 30 GLU HA 1 30 GLU HG3 . . 4.070 3.849 3.733 3.942 . 0 0 "[ . 1 . 2]" 1
414 1 30 GLU HA 1 31 VAL H . . 3.130 2.168 2.148 2.189 . 0 0 "[ . 1 . 2]" 1
415 1 30 GLU HA 1 31 VAL QG . . 4.360 3.524 3.225 3.580 . 0 0 "[ . 1 . 2]" 1
416 1 30 GLU HA 1 32 PHE QE . . 4.770 4.456 4.286 4.767 . 0 0 "[ . 1 . 2]" 1
417 1 30 GLU HA 1 53 PHE QD . . 5.500 5.203 4.794 5.398 . 0 0 "[ . 1 . 2]" 1
418 1 30 GLU HA 1 53 PHE QE . . 4.000 3.957 3.256 4.010 0.010 12 0 "[ . 1 . 2]" 1
419 1 30 GLU QB 1 31 VAL H . . 3.950 3.094 2.991 3.200 . 0 0 "[ . 1 . 2]" 1
420 1 30 GLU QB 1 32 PHE QE . . 3.240 2.172 2.019 2.528 . 0 0 "[ . 1 . 2]" 1
421 1 30 GLU HB2 1 32 PHE QE . . 4.050 2.191 2.031 2.557 . 0 0 "[ . 1 . 2]" 1
422 1 30 GLU HB3 1 32 PHE QE . . 4.050 3.584 3.479 3.960 . 0 0 "[ . 1 . 2]" 1
423 1 30 GLU HG2 1 32 PHE QD . . 4.940 4.609 4.205 4.930 . 0 0 "[ . 1 . 2]" 1
424 1 30 GLU HG2 1 32 PHE QE . . 3.960 3.862 3.623 3.958 . 0 0 "[ . 1 . 2]" 1
425 1 30 GLU HG2 1 71 ASP H . . 4.940 3.932 3.449 4.817 . 0 0 "[ . 1 . 2]" 1
426 1 30 GLU HG2 1 72 GLY H . . 5.010 3.837 3.180 4.825 . 0 0 "[ . 1 . 2]" 1
427 1 30 GLU HG3 1 31 VAL H . . 5.010 4.298 4.068 4.616 . 0 0 "[ . 1 . 2]" 1
428 1 30 GLU HG3 1 32 PHE QD . . 4.020 2.951 2.751 3.430 . 0 0 "[ . 1 . 2]" 1
429 1 30 GLU HG3 1 32 PHE QE . . 3.330 2.351 2.012 2.534 . 0 0 "[ . 1 . 2]" 1
430 1 31 VAL H 1 31 VAL HB . . 3.900 2.753 2.648 3.779 . 0 0 "[ . 1 . 2]" 1
431 1 31 VAL H 1 31 VAL MG1 . . 4.210 3.803 2.356 3.912 . 0 0 "[ . 1 . 2]" 1
432 1 31 VAL H 1 31 VAL QG . . 3.470 2.651 2.047 2.782 . 0 0 "[ . 1 . 2]" 1
433 1 31 VAL H 1 31 VAL MG2 . . 4.210 2.711 2.247 2.847 . 0 0 "[ . 1 . 2]" 1
434 1 31 VAL H 1 32 PHE H . . 4.640 4.408 4.327 4.490 . 0 0 "[ . 1 . 2]" 1
435 1 31 VAL H 1 32 PHE QD . . 4.790 4.394 4.241 4.583 . 0 0 "[ . 1 . 2]" 1
436 1 31 VAL H 1 53 PHE QD . . 4.530 4.063 3.480 4.264 . 0 0 "[ . 1 . 2]" 1
437 1 31 VAL H 1 53 PHE QE . . 4.430 3.876 3.059 4.239 . 0 0 "[ . 1 . 2]" 1
438 1 31 VAL HA 1 31 VAL MG1 . . 3.640 2.330 2.294 2.511 . 0 0 "[ . 1 . 2]" 1
439 1 31 VAL HA 1 31 VAL MG2 . . 3.640 2.388 2.331 3.181 . 0 0 "[ . 1 . 2]" 1
440 1 31 VAL HA 1 69 PHE H . . 4.800 4.141 4.058 4.237 . 0 0 "[ . 1 . 2]" 1
441 1 31 VAL HA 1 70 VAL H . . 5.020 4.928 4.823 5.029 0.009 20 0 "[ . 1 . 2]" 1
442 1 31 VAL HA 1 70 VAL HA . . 3.640 2.977 2.844 3.046 . 0 0 "[ . 1 . 2]" 1
443 1 31 VAL HA 1 70 VAL MG1 . . 4.200 3.596 3.529 3.697 . 0 0 "[ . 1 . 2]" 1
444 1 31 VAL HA 1 70 VAL MG2 . . 4.130 2.590 2.457 2.756 . 0 0 "[ . 1 . 2]" 1
445 1 31 VAL HA 1 71 ASP H . . 4.870 4.781 4.656 4.827 . 0 0 "[ . 1 . 2]" 1
446 1 31 VAL HB 1 32 PHE H . . 4.070 3.981 2.928 4.079 0.009 13 0 "[ . 1 . 2]" 1
447 1 31 VAL HB 1 46 LEU HB2 . . 4.830 2.641 2.505 4.202 . 0 0 "[ . 1 . 2]" 1
448 1 31 VAL HB 1 46 LEU HB3 . . 4.700 3.090 2.868 4.799 0.099 16 0 "[ . 1 . 2]" 1
449 1 31 VAL HB 1 53 PHE QD . . 4.010 3.003 2.837 4.246 0.236 16 0 "[ . 1 . 2]" 1
450 1 31 VAL QG 1 32 PHE H . . 3.360 2.499 2.324 3.275 . 0 0 "[ . 1 . 2]" 1
451 1 31 VAL QG 1 32 PHE HA . . 5.100 3.489 3.422 3.546 . 0 0 "[ . 1 . 2]" 1
452 1 31 VAL QG 1 33 ILE HB . . 4.880 4.230 4.155 4.529 . 0 0 "[ . 1 . 2]" 1
453 1 31 VAL QG 1 45 PRO HA . . 5.440 5.408 4.806 5.453 0.013 9 0 "[ . 1 . 2]" 1
454 1 31 VAL QG 1 46 LEU H . . 4.310 4.249 3.328 4.320 0.010 3 0 "[ . 1 . 2]" 1
455 1 31 VAL QG 1 46 LEU HB2 . . 4.510 2.713 1.876 2.822 . 0 0 "[ . 1 . 2]" 1
456 1 31 VAL QG 1 46 LEU HB3 . . 3.710 3.268 2.164 3.383 . 0 0 "[ . 1 . 2]" 1
457 1 31 VAL QG 1 46 LEU MD1 . . 3.300 2.060 1.939 2.395 . 0 0 "[ . 1 . 2]" 1
458 1 31 VAL QG 1 46 LEU MD2 . . 3.230 1.854 1.790 1.907 . 0 0 "[ . 1 . 2]" 1
459 1 31 VAL QG 1 46 LEU HG . . 5.050 3.839 3.675 3.922 . 0 0 "[ . 1 . 2]" 1
460 1 31 VAL QG 1 53 PHE H . . 5.280 4.613 4.462 4.755 . 0 0 "[ . 1 . 2]" 1
461 1 31 VAL QG 1 53 PHE HB2 . . 3.760 2.993 2.855 3.174 . 0 0 "[ . 1 . 2]" 1
462 1 31 VAL QG 1 53 PHE HB3 . . 3.910 2.977 2.248 3.191 . 0 0 "[ . 1 . 2]" 1
463 1 31 VAL QG 1 53 PHE QD . . 3.180 2.754 1.814 2.958 . 0 0 "[ . 1 . 2]" 1
464 1 31 VAL QG 1 53 PHE QE . . 3.580 2.814 2.231 2.951 . 0 0 "[ . 1 . 2]" 1
465 1 31 VAL QG 1 54 VAL H . . 5.430 4.901 4.254 5.209 . 0 0 "[ . 1 . 2]" 1
466 1 31 VAL QG 1 68 PHE QD . . 3.640 3.179 3.105 3.694 0.054 16 0 "[ . 1 . 2]" 1
467 1 31 VAL QG 1 68 PHE QE . . 4.290 3.959 3.893 4.176 . 0 0 "[ . 1 . 2]" 1
468 1 31 VAL QG 1 69 PHE H . . 4.340 3.121 2.998 4.103 . 0 0 "[ . 1 . 2]" 1
469 1 31 VAL QG 1 70 VAL H . . 5.170 4.339 4.230 4.632 . 0 0 "[ . 1 . 2]" 1
470 1 31 VAL QG 1 70 VAL HA . . 3.750 3.166 2.978 3.248 . 0 0 "[ . 1 . 2]" 1
471 1 31 VAL QG 1 70 VAL HB . . 4.500 3.852 3.734 3.961 . 0 0 "[ . 1 . 2]" 1
472 1 31 VAL QG 1 70 VAL MG1 . . 3.210 2.276 1.875 2.412 . 0 0 "[ . 1 . 2]" 1
473 1 31 VAL QG 1 71 ASP H . . 4.220 4.165 4.005 4.230 0.010 20 0 "[ . 1 . 2]" 1
474 1 31 VAL MG1 1 32 PHE H . . 4.160 2.560 2.339 4.057 . 0 0 "[ . 1 . 2]" 1
475 1 31 VAL MG1 1 46 LEU H . . 5.500 4.539 4.402 5.552 0.052 16 0 "[ . 1 . 2]" 1
476 1 31 VAL MG1 1 46 LEU HB3 . . 4.380 3.514 3.398 4.389 0.009 16 0 "[ . 1 . 2]" 1
477 1 31 VAL MG1 1 46 LEU MD2 . . 4.180 1.961 1.800 3.800 . 0 0 "[ . 1 . 2]" 1
478 1 31 VAL MG1 1 53 PHE HB2 . . 4.360 3.328 3.124 3.880 . 0 0 "[ . 1 . 2]" 1
479 1 31 VAL MG1 1 53 PHE HB3 . . 4.530 3.315 3.181 3.703 . 0 0 "[ . 1 . 2]" 1
480 1 31 VAL MG1 1 53 PHE QD . . 3.860 3.802 2.668 3.876 0.016 12 0 "[ . 1 . 2]" 1
481 1 31 VAL MG1 1 70 VAL HA . . 5.130 3.903 2.998 4.027 . 0 0 "[ . 1 . 2]" 1
482 1 31 VAL MG1 1 70 VAL MG1 . . 4.170 3.627 1.878 3.784 . 0 0 "[ . 1 . 2]" 1
483 1 31 VAL MG1 1 70 VAL MG2 . . 3.490 1.933 1.876 2.016 . 0 0 "[ . 1 . 2]" 1
484 1 31 VAL MG2 1 32 PHE H . . 4.160 3.994 3.457 4.058 . 0 0 "[ . 1 . 2]" 1
485 1 31 VAL MG2 1 46 LEU H . . 5.500 5.396 3.355 5.509 0.009 7 0 "[ . 1 . 2]" 1
486 1 31 VAL MG2 1 46 LEU HB3 . . 4.380 4.175 2.170 4.366 . 0 0 "[ . 1 . 2]" 1
487 1 31 VAL MG2 1 46 LEU MD2 . . 4.180 3.150 1.885 3.294 . 0 0 "[ . 1 . 2]" 1
488 1 31 VAL MG2 1 53 PHE HB2 . . 4.360 3.412 3.206 3.710 . 0 0 "[ . 1 . 2]" 1
489 1 31 VAL MG2 1 53 PHE HB3 . . 4.530 3.438 2.268 3.810 . 0 0 "[ . 1 . 2]" 1
490 1 31 VAL MG2 1 53 PHE QD . . 3.860 2.829 1.846 3.077 . 0 0 "[ . 1 . 2]" 1
491 1 31 VAL MG2 1 70 VAL HA . . 5.130 3.437 3.177 5.130 0.000 16 0 "[ . 1 . 2]" 1
492 1 31 VAL MG2 1 70 VAL MG1 . . 4.170 2.417 2.179 4.276 0.106 16 0 "[ . 1 . 2]" 1
493 1 31 VAL MG2 1 70 VAL MG2 . . 3.490 2.133 1.959 3.387 . 0 0 "[ . 1 . 2]" 1
494 1 32 PHE H 1 32 PHE QD . . 3.790 3.159 2.970 3.295 . 0 0 "[ . 1 . 2]" 1
495 1 32 PHE H 1 33 ILE H . . 4.750 4.414 4.382 4.442 . 0 0 "[ . 1 . 2]" 1
496 1 32 PHE H 1 43 LYS QD . . 4.520 4.419 4.166 4.541 0.021 12 0 "[ . 1 . 2]" 1
497 1 32 PHE H 1 69 PHE H . . 3.960 2.696 2.615 2.799 . 0 0 "[ . 1 . 2]" 1
498 1 32 PHE H 1 69 PHE HB3 . . 4.170 2.833 2.610 3.057 . 0 0 "[ . 1 . 2]" 1
499 1 32 PHE H 1 69 PHE QD . . 4.260 3.537 3.291 3.709 . 0 0 "[ . 1 . 2]" 1
500 1 32 PHE H 1 70 VAL HA . . 4.170 4.180 4.168 4.191 0.021 2 0 "[ . 1 . 2]" 1
501 1 32 PHE H 1 70 VAL MG2 . . 4.200 3.326 3.229 3.536 . 0 0 "[ . 1 . 2]" 1
502 1 32 PHE HA 1 32 PHE QD . . 3.640 2.877 2.806 3.003 . 0 0 "[ . 1 . 2]" 1
503 1 32 PHE HA 1 32 PHE QE . . 4.880 4.586 4.551 4.645 . 0 0 "[ . 1 . 2]" 1
504 1 32 PHE HA 1 44 ILE H . . 5.030 4.825 4.475 4.960 . 0 0 "[ . 1 . 2]" 1
505 1 32 PHE HA 1 45 PRO HA . . 3.800 3.277 3.150 3.406 . 0 0 "[ . 1 . 2]" 1
506 1 32 PHE HA 1 45 PRO QB . . 5.340 5.053 4.940 5.168 . 0 0 "[ . 1 . 2]" 1
507 1 32 PHE HA 1 46 LEU H . . 3.700 3.319 3.209 3.483 . 0 0 "[ . 1 . 2]" 1
508 1 32 PHE HA 1 46 LEU HB3 . . 5.500 5.114 5.013 5.208 . 0 0 "[ . 1 . 2]" 1
509 1 32 PHE HA 1 46 LEU MD1 . . 3.630 2.468 2.178 2.769 . 0 0 "[ . 1 . 2]" 1
510 1 32 PHE HA 1 55 ALA MB . . 5.500 5.204 5.011 5.402 . 0 0 "[ . 1 . 2]" 1
511 1 32 PHE HB2 1 43 LYS HB2 . . 4.990 4.705 4.503 4.944 . 0 0 "[ . 1 . 2]" 1
512 1 32 PHE HB2 1 43 LYS HB3 . . 5.140 3.323 3.187 3.480 . 0 0 "[ . 1 . 2]" 1
513 1 32 PHE HB2 1 43 LYS QD . . 4.620 2.187 1.944 2.386 . 0 0 "[ . 1 . 2]" 1
514 1 32 PHE HB2 1 43 LYS QG . . 5.340 3.492 2.296 4.183 . 0 0 "[ . 1 . 2]" 1
515 1 32 PHE HB2 1 46 LEU MD1 . . 5.500 4.731 4.540 5.041 . 0 0 "[ . 1 . 2]" 1
516 1 32 PHE HB2 1 69 PHE HB2 . . 4.950 3.723 3.605 3.943 . 0 0 "[ . 1 . 2]" 1
517 1 32 PHE HB2 1 69 PHE QD . . 4.270 2.748 2.622 2.957 . 0 0 "[ . 1 . 2]" 1
518 1 32 PHE HB3 1 33 ILE H . . 4.200 2.749 2.578 2.845 . 0 0 "[ . 1 . 2]" 1
519 1 32 PHE HB3 1 43 LYS HB3 . . 5.280 2.135 1.996 2.389 . 0 0 "[ . 1 . 2]" 1
520 1 32 PHE HB3 1 43 LYS QD . . 4.660 2.530 2.250 3.099 . 0 0 "[ . 1 . 2]" 1
521 1 32 PHE HB3 1 43 LYS QG . . 5.310 2.931 1.988 3.555 . 0 0 "[ . 1 . 2]" 1
522 1 32 PHE HB3 1 44 ILE H . . 4.590 3.741 3.354 3.921 . 0 0 "[ . 1 . 2]" 1
523 1 32 PHE HB3 1 46 LEU MD1 . . 5.500 4.366 4.177 4.554 . 0 0 "[ . 1 . 2]" 1
524 1 32 PHE HB3 1 69 PHE HB2 . . 5.320 4.868 4.687 5.223 . 0 0 "[ . 1 . 2]" 1
525 1 32 PHE HB3 1 69 PHE QD . . 4.640 4.400 4.261 4.609 . 0 0 "[ . 1 . 2]" 1
526 1 32 PHE QD 1 33 ILE H . . 4.470 3.665 3.588 3.812 . 0 0 "[ . 1 . 2]" 1
527 1 32 PHE QD 1 43 LYS HA . . 5.280 4.575 4.286 4.691 . 0 0 "[ . 1 . 2]" 1
528 1 32 PHE QD 1 43 LYS HB2 . . 4.380 4.032 3.570 4.372 . 0 0 "[ . 1 . 2]" 1
529 1 32 PHE QD 1 43 LYS HB3 . . 3.820 2.679 2.354 2.783 . 0 0 "[ . 1 . 2]" 1
530 1 32 PHE QD 1 43 LYS QD . . 3.980 3.218 3.088 3.274 . 0 0 "[ . 1 . 2]" 1
531 1 32 PHE QD 1 44 ILE H . . 4.420 4.158 3.680 4.264 . 0 0 "[ . 1 . 2]" 1
532 1 32 PHE QD 1 45 PRO HA . . 3.510 2.528 2.389 2.894 . 0 0 "[ . 1 . 2]" 1
533 1 32 PHE QD 1 46 LEU H . . 4.420 4.160 4.055 4.409 . 0 0 "[ . 1 . 2]" 1
534 1 32 PHE QD 1 69 PHE H . . 5.290 5.213 5.046 5.293 0.003 7 0 "[ . 1 . 2]" 1
535 1 32 PHE QD 1 69 PHE HB3 . . 3.990 3.570 3.454 3.700 . 0 0 "[ . 1 . 2]" 1
536 1 32 PHE QD 1 69 PHE QD . . 3.260 2.269 2.056 2.382 . 0 0 "[ . 1 . 2]" 1
537 1 32 PHE QD 1 69 PHE QE . . 3.930 3.726 3.457 3.861 . 0 0 "[ . 1 . 2]" 1
538 1 32 PHE QE 1 43 LYS HB3 . . 4.420 4.289 4.120 4.424 0.004 20 0 "[ . 1 . 2]" 1
539 1 32 PHE QE 1 43 LYS QD . . 4.520 4.427 4.288 4.508 . 0 0 "[ . 1 . 2]" 1
540 1 32 PHE QE 1 45 PRO HA . . 3.850 2.988 2.839 3.114 . 0 0 "[ . 1 . 2]" 1
541 1 32 PHE QE 1 45 PRO HB2 . . 4.580 4.397 4.205 4.580 . 16 0 "[ . 1 . 2]" 1
542 1 32 PHE QE 1 45 PRO QB . . 3.840 2.791 2.576 2.940 . 0 0 "[ . 1 . 2]" 1
543 1 32 PHE QE 1 45 PRO HB3 . . 4.580 2.823 2.599 2.976 . 0 0 "[ . 1 . 2]" 1
544 1 32 PHE QE 1 45 PRO QG . . 4.500 4.404 4.149 4.501 0.001 12 0 "[ . 1 . 2]" 1
545 1 32 PHE QE 1 69 PHE QD . . 4.400 4.216 3.990 4.353 . 0 0 "[ . 1 . 2]" 1
546 1 32 PHE QE 1 69 PHE QE . . 4.590 4.441 4.036 4.591 0.001 2 0 "[ . 1 . 2]" 1
547 1 33 ILE H 1 33 ILE MD . . 5.500 4.632 4.612 4.661 . 0 0 "[ . 1 . 2]" 1
548 1 33 ILE H 1 33 ILE MG . . 3.580 1.981 1.934 2.032 . 0 0 "[ . 1 . 2]" 1
549 1 33 ILE H 1 34 SER H . . 4.500 4.441 4.415 4.456 . 0 0 "[ . 1 . 2]" 1
550 1 33 ILE H 1 34 SER HA . . 5.040 5.049 5.015 5.067 0.027 2 0 "[ . 1 . 2]" 1
551 1 33 ILE H 1 43 LYS HA . . 5.030 4.342 4.225 4.418 . 0 0 "[ . 1 . 2]" 1
552 1 33 ILE H 1 43 LYS HB3 . . 4.500 4.278 4.088 4.511 0.011 5 0 "[ . 1 . 2]" 1
553 1 33 ILE H 1 44 ILE H . . 3.980 3.075 2.801 3.150 . 0 0 "[ . 1 . 2]" 1
554 1 33 ILE H 1 44 ILE HA . . 5.500 4.583 4.438 4.661 . 0 0 "[ . 1 . 2]" 1
555 1 33 ILE H 1 44 ILE HB . . 4.490 3.287 3.125 3.380 . 0 0 "[ . 1 . 2]" 1
556 1 33 ILE H 1 45 PRO HA . . 4.670 4.369 4.321 4.531 . 0 0 "[ . 1 . 2]" 1
557 1 33 ILE H 1 46 LEU H . . 5.070 4.805 4.663 4.901 . 0 0 "[ . 1 . 2]" 1
558 1 33 ILE H 1 46 LEU MD1 . . 3.740 2.697 2.615 2.835 . 0 0 "[ . 1 . 2]" 1
559 1 33 ILE H 1 55 ALA MB . . 4.540 4.457 4.343 4.550 0.010 2 0 "[ . 1 . 2]" 1
560 1 33 ILE HA 1 34 SER H . . 3.200 2.218 2.212 2.222 . 0 0 "[ . 1 . 2]" 1
561 1 33 ILE HA 1 46 LEU MD1 . . 4.370 3.528 3.454 3.648 . 0 0 "[ . 1 . 2]" 1
562 1 33 ILE HA 1 66 TYR QD . . 4.650 4.281 4.223 4.413 . 0 0 "[ . 1 . 2]" 1
563 1 33 ILE HA 1 68 PHE QD . . 5.070 3.302 3.192 3.482 . 0 0 "[ . 1 . 2]" 1
564 1 33 ILE HA 1 74 TRP HZ3 . . 4.550 3.432 3.272 3.650 . 0 0 "[ . 1 . 2]" 1
565 1 33 ILE HB 1 33 ILE MD . . 3.720 2.417 2.413 2.423 . 0 0 "[ . 1 . 2]" 1
566 1 33 ILE HB 1 34 SER H . . 4.220 4.053 4.041 4.061 . 0 0 "[ . 1 . 2]" 1
567 1 33 ILE HB 1 37 PHE HZ . . 5.310 5.311 5.230 5.331 0.021 16 0 "[ . 1 . 2]" 1
568 1 33 ILE HB 1 46 LEU MD1 . . 3.380 1.956 1.916 2.010 . 0 0 "[ . 1 . 2]" 1
569 1 33 ILE HB 1 57 LEU MD1 . . 5.500 5.533 5.520 5.548 0.048 17 0 "[ . 1 . 2]" 1
570 1 33 ILE HB 1 66 TYR QD . . 4.550 4.301 4.229 4.396 . 0 0 "[ . 1 . 2]" 1
571 1 33 ILE HB 1 68 PHE HA . . 4.790 4.086 3.915 4.176 . 0 0 "[ . 1 . 2]" 1
572 1 33 ILE HB 1 68 PHE QD . . 4.210 3.073 2.954 3.121 . 0 0 "[ . 1 . 2]" 1
573 1 33 ILE HB 1 68 PHE QE . . 4.370 3.019 2.855 3.069 . 0 0 "[ . 1 . 2]" 1
574 1 33 ILE HB 1 69 PHE H . . 5.370 5.137 5.036 5.263 . 0 0 "[ . 1 . 2]" 1
575 1 33 ILE MD 1 33 ILE MG . . 3.360 2.066 2.056 2.077 . 0 0 "[ . 1 . 2]" 1
576 1 33 ILE MD 1 34 SER H . . 4.690 3.959 3.944 3.982 . 0 0 "[ . 1 . 2]" 1
577 1 33 ILE MD 1 34 SER HA . . 5.150 4.716 4.693 4.730 . 0 0 "[ . 1 . 2]" 1
578 1 33 ILE MD 1 37 PHE QE . . 3.650 3.276 3.237 3.324 . 0 0 "[ . 1 . 2]" 1
579 1 33 ILE MD 1 37 PHE HZ . . 3.500 3.272 3.186 3.330 . 0 0 "[ . 1 . 2]" 1
580 1 33 ILE MD 1 44 ILE HB . . 4.850 4.280 4.238 4.326 . 0 0 "[ . 1 . 2]" 1
581 1 33 ILE MD 1 55 ALA MB . . 3.880 2.394 2.258 2.486 . 0 0 "[ . 1 . 2]" 1
582 1 33 ILE MD 1 57 LEU MD1 . . 3.600 2.911 2.872 3.003 . 0 0 "[ . 1 . 2]" 1
583 1 33 ILE MD 1 66 TYR HB2 . . 4.990 2.697 2.512 2.883 . 0 0 "[ . 1 . 2]" 1
584 1 33 ILE MD 1 66 TYR HB3 . . 4.800 3.211 3.060 3.365 . 0 0 "[ . 1 . 2]" 1
585 1 33 ILE MD 1 66 TYR QD . . 3.410 2.445 2.386 2.502 . 0 0 "[ . 1 . 2]" 1
586 1 33 ILE MD 1 66 TYR QE . . 4.000 3.404 3.294 3.487 . 0 0 "[ . 1 . 2]" 1
587 1 33 ILE MD 1 67 LYS H . . 5.320 4.100 3.985 4.217 . 0 0 "[ . 1 . 2]" 1
588 1 33 ILE MD 1 68 PHE QE . . 4.440 3.034 2.913 3.166 . 0 0 "[ . 1 . 2]" 1
589 1 33 ILE MD 1 68 PHE HZ . . 5.500 4.194 4.094 4.253 . 0 0 "[ . 1 . 2]" 1
590 1 33 ILE MD 1 94 ILE MD . . 5.410 4.159 4.007 4.318 . 0 0 "[ . 1 . 2]" 1
591 1 33 ILE QG 1 37 PHE HZ . . 4.620 2.846 2.696 2.907 . 0 0 "[ . 1 . 2]" 1
592 1 33 ILE QG 1 55 ALA MB . . 4.760 3.964 3.866 4.053 . 0 0 "[ . 1 . 2]" 1
593 1 33 ILE QG 1 66 TYR QD . . 4.020 2.103 2.030 2.214 . 0 0 "[ . 1 . 2]" 1
594 1 33 ILE QG 1 66 TYR QE . . 4.490 3.872 3.758 4.028 . 0 0 "[ . 1 . 2]" 1
595 1 33 ILE QG 1 68 PHE HA . . 4.840 3.686 3.631 3.734 . 0 0 "[ . 1 . 2]" 1
596 1 33 ILE QG 1 68 PHE QE . . 4.600 3.526 3.453 3.773 . 0 0 "[ . 1 . 2]" 1
597 1 33 ILE HG12 1 34 SER H . . 3.710 2.388 2.371 2.429 . 0 0 "[ . 1 . 2]" 1
598 1 33 ILE HG12 1 67 LYS H . . 4.260 3.402 3.290 3.497 . 0 0 "[ . 1 . 2]" 1
599 1 33 ILE HG13 1 34 SER H . . 3.710 2.783 2.755 2.803 . 0 0 "[ . 1 . 2]" 1
600 1 33 ILE HG13 1 67 LYS H . . 4.260 3.182 3.013 3.348 . 0 0 "[ . 1 . 2]" 1
601 1 33 ILE MG 1 34 SER H . . 4.330 3.779 3.762 3.823 . 0 0 "[ . 1 . 2]" 1
602 1 33 ILE MG 1 35 GLY H . . 5.500 5.126 5.108 5.159 . 0 0 "[ . 1 . 2]" 1
603 1 33 ILE MG 1 37 PHE QE . . 4.830 3.775 3.749 3.812 . 0 0 "[ . 1 . 2]" 1
604 1 33 ILE MG 1 37 PHE HZ . . 3.720 2.807 2.769 2.866 . 0 0 "[ . 1 . 2]" 1
605 1 33 ILE MG 1 44 ILE H . . 4.090 3.070 3.021 3.215 . 0 0 "[ . 1 . 2]" 1
606 1 33 ILE MG 1 44 ILE HA . . 5.480 4.049 4.017 4.100 . 0 0 "[ . 1 . 2]" 1
607 1 33 ILE MG 1 44 ILE HB . . 3.420 1.885 1.879 1.907 . 0 0 "[ . 1 . 2]" 1
608 1 33 ILE MG 1 44 ILE MD . . 3.760 3.333 3.302 3.355 . 0 0 "[ . 1 . 2]" 1
609 1 33 ILE MG 1 44 ILE HG12 . . 4.530 3.545 3.479 3.578 . 0 0 "[ . 1 . 2]" 1
610 1 33 ILE MG 1 55 ALA MB . . 3.830 1.904 1.870 1.941 . 0 0 "[ . 1 . 2]" 1
611 1 33 ILE MG 1 57 LEU MD2 . . 3.450 2.462 2.420 2.527 . 0 0 "[ . 1 . 2]" 1
612 1 33 ILE MG 1 68 PHE QE . . 5.500 4.182 4.042 4.230 . 0 0 "[ . 1 . 2]" 1
613 1 34 SER H 1 35 GLY H . . 4.320 4.283 4.271 4.295 . 0 0 "[ . 1 . 2]" 1
614 1 34 SER H 1 37 PHE HZ . . 4.570 4.099 3.935 4.165 . 0 0 "[ . 1 . 2]" 1
615 1 34 SER H 1 66 TYR HA . . 4.750 4.314 4.231 4.419 . 0 0 "[ . 1 . 2]" 1
616 1 34 SER H 1 66 TYR HB2 . . 4.440 3.272 3.215 3.347 . 0 0 "[ . 1 . 2]" 1
617 1 34 SER H 1 66 TYR QD . . 4.490 4.013 3.896 4.161 . 0 0 "[ . 1 . 2]" 1
618 1 34 SER H 1 67 LYS H . . 3.680 2.453 2.360 2.513 . 0 0 "[ . 1 . 2]" 1
619 1 34 SER H 1 67 LYS HA . . 4.910 4.813 4.712 4.864 . 0 0 "[ . 1 . 2]" 1
620 1 34 SER H 1 67 LYS QB . . 4.520 3.790 3.620 3.884 . 0 0 "[ . 1 . 2]" 1
621 1 34 SER H 1 74 TRP HZ3 . . 4.020 2.948 2.872 3.043 . 0 0 "[ . 1 . 2]" 1
622 1 34 SER HA 1 35 GLY H . . 3.480 2.202 2.200 2.205 . 0 0 "[ . 1 . 2]" 1
623 1 34 SER HA 1 37 PHE QE . . 4.520 3.486 3.319 3.579 . 0 0 "[ . 1 . 2]" 1
624 1 34 SER HA 1 37 PHE HZ . . 4.390 2.555 2.353 2.713 . 0 0 "[ . 1 . 2]" 1
625 1 34 SER HA 1 38 ASN HD22 . . 5.130 2.600 2.534 2.635 . 0 0 "[ . 1 . 2]" 1
626 1 34 SER HA 1 40 TRP H . . 5.450 5.436 5.399 5.458 0.008 9 0 "[ . 1 . 2]" 1
627 1 34 SER HA 1 44 ILE MD . . 3.990 3.036 2.913 3.095 . 0 0 "[ . 1 . 2]" 1
628 1 34 SER HA 1 74 TRP HH2 . . 4.600 4.560 4.458 4.607 0.007 9 0 "[ . 1 . 2]" 1
629 1 34 SER QB 1 35 GLY H . . 4.140 3.401 2.954 3.613 . 0 0 "[ . 1 . 2]" 1
630 1 34 SER QB 1 38 ASN HD22 . . 4.340 3.123 2.416 3.428 . 0 0 "[ . 1 . 2]" 1
631 1 34 SER QB 1 40 TRP HA . . 4.050 3.404 2.648 3.822 . 0 0 "[ . 1 . 2]" 1
632 1 34 SER QB 1 40 TRP HZ3 . . 4.390 3.659 3.494 3.991 . 0 0 "[ . 1 . 2]" 1
633 1 34 SER QB 1 43 LYS HA . . 4.020 2.911 2.464 3.710 . 0 0 "[ . 1 . 2]" 1
634 1 34 SER QB 1 43 LYS QD . . 4.840 4.168 3.696 4.923 0.083 17 0 "[ . 1 . 2]" 1
635 1 34 SER QB 1 43 LYS QG . . 4.030 2.759 2.379 3.455 . 0 0 "[ . 1 . 2]" 1
636 1 34 SER QB 1 44 ILE H . . 4.500 3.857 3.453 4.528 0.028 6 0 "[ . 1 . 2]" 1
637 1 34 SER QB 1 74 TRP HZ2 . . 4.100 3.844 3.795 3.924 . 0 0 "[ . 1 . 2]" 1
638 1 34 SER QB 1 74 TRP HZ3 . . 3.900 2.733 2.525 2.900 . 0 0 "[ . 1 . 2]" 1
639 1 34 SER HB2 1 38 ASN HD22 . . 4.940 3.879 3.698 4.150 . 0 0 "[ . 1 . 2]" 1
640 1 34 SER HB2 1 40 TRP HA . . 4.630 4.420 4.216 4.531 . 0 0 "[ . 1 . 2]" 1
641 1 34 SER HB2 1 43 LYS HA . . 4.650 3.111 2.480 4.327 . 0 0 "[ . 1 . 2]" 1
642 1 34 SER HB2 1 74 TRP HH2 . . 3.580 2.141 1.990 2.290 . 0 0 "[ . 1 . 2]" 1
643 1 34 SER HB2 1 74 TRP HZ2 . . 4.760 4.287 3.988 4.462 . 0 0 "[ . 1 . 2]" 1
644 1 34 SER HB3 1 38 ASN HD22 . . 4.940 3.452 2.434 3.978 . 0 0 "[ . 1 . 2]" 1
645 1 34 SER HB3 1 40 TRP HA . . 4.630 3.592 2.674 4.139 . 0 0 "[ . 1 . 2]" 1
646 1 34 SER HB3 1 43 LYS HA . . 4.650 4.237 3.918 4.513 . 0 0 "[ . 1 . 2]" 1
647 1 34 SER HB3 1 74 TRP HH2 . . 3.580 2.531 2.065 3.242 . 0 0 "[ . 1 . 2]" 1
648 1 34 SER HB3 1 74 TRP HZ2 . . 4.760 4.418 4.149 4.816 0.056 6 0 "[ . 1 . 2]" 1
649 1 35 GLY H 1 36 SER H . . 4.400 4.328 4.297 4.372 . 0 0 "[ . 1 . 2]" 1
650 1 35 GLY H 1 37 PHE H . . 4.580 4.090 3.878 4.170 . 0 0 "[ . 1 . 2]" 1
651 1 35 GLY H 1 37 PHE QE . . 4.280 3.101 3.039 3.190 . 0 0 "[ . 1 . 2]" 1
652 1 35 GLY H 1 37 PHE HZ . . 4.190 2.961 2.889 3.020 . 0 0 "[ . 1 . 2]" 1
653 1 35 GLY H 1 38 ASN H . . 4.160 3.656 3.626 3.686 . 0 0 "[ . 1 . 2]" 1
654 1 35 GLY H 1 38 ASN HD21 . . 3.090 1.884 1.868 1.891 . 0 0 "[ . 1 . 2]" 1
655 1 35 GLY H 1 38 ASN HD22 . . 4.020 1.901 1.892 1.931 . 0 0 "[ . 1 . 2]" 1
656 1 35 GLY H 1 40 TRP H . . 3.870 3.877 3.832 3.895 0.025 12 0 "[ . 1 . 2]" 1
657 1 35 GLY H 1 40 TRP HA . . 3.880 3.754 3.706 3.821 . 0 0 "[ . 1 . 2]" 1
658 1 35 GLY H 1 44 ILE MD . . 4.500 4.020 3.959 4.080 . 0 0 "[ . 1 . 2]" 1
659 1 35 GLY H 1 66 TYR HA . . 4.210 4.202 4.162 4.225 0.015 6 0 "[ . 1 . 2]" 1
660 1 35 GLY HA2 1 37 PHE H . . 4.400 4.253 4.174 4.301 . 0 0 "[ . 1 . 2]" 1
661 1 35 GLY HA2 1 38 ASN H . . 5.120 5.030 4.993 5.043 . 0 0 "[ . 1 . 2]" 1
662 1 35 GLY HA2 1 38 ASN HD22 . . 5.020 4.325 4.241 4.366 . 0 0 "[ . 1 . 2]" 1
663 1 35 GLY HA2 1 40 TRP HE1 . . 4.920 3.907 3.694 4.024 . 0 0 "[ . 1 . 2]" 1
664 1 35 GLY HA2 1 66 TYR HA . . 4.120 2.182 2.087 2.251 . 0 0 "[ . 1 . 2]" 1
665 1 35 GLY HA2 1 67 LYS H . . 4.200 3.960 3.860 4.069 . 0 0 "[ . 1 . 2]" 1
666 1 35 GLY HA3 1 37 PHE H . . 4.100 3.102 3.050 3.138 . 0 0 "[ . 1 . 2]" 1
667 1 35 GLY HA3 1 37 PHE QD . . 4.390 2.868 2.786 2.939 . 0 0 "[ . 1 . 2]" 1
668 1 35 GLY HA3 1 37 PHE QE . . 4.110 2.387 2.300 2.475 . 0 0 "[ . 1 . 2]" 1
669 1 35 GLY HA3 1 38 ASN H . . 5.070 4.411 4.366 4.477 . 0 0 "[ . 1 . 2]" 1
670 1 35 GLY HA3 1 38 ASN HD21 . . 4.200 3.981 3.926 4.019 . 0 0 "[ . 1 . 2]" 1
671 1 35 GLY HA3 1 38 ASN HD22 . . 5.500 4.429 4.398 4.450 . 0 0 "[ . 1 . 2]" 1
672 1 35 GLY HA3 1 40 TRP HH2 . . 5.500 4.754 4.674 4.873 . 0 0 "[ . 1 . 2]" 1
673 1 35 GLY HA3 1 66 TYR HA . . 4.150 2.414 2.358 2.481 . 0 0 "[ . 1 . 2]" 1
674 1 35 GLY HA3 1 66 TYR HB2 . . 5.500 3.601 3.449 3.736 . 0 0 "[ . 1 . 2]" 1
675 1 35 GLY HA3 1 66 TYR HB3 . . 4.880 3.004 2.829 3.116 . 0 0 "[ . 1 . 2]" 1
676 1 35 GLY HA3 1 66 TYR QD . . 5.070 4.813 4.696 4.884 . 0 0 "[ . 1 . 2]" 1
677 1 35 GLY HA3 1 67 LYS H . . 4.480 4.372 4.316 4.454 . 0 0 "[ . 1 . 2]" 1
678 1 36 SER H 1 36 SER HB2 . . 3.880 3.214 2.320 3.606 . 0 0 "[ . 1 . 2]" 1
679 1 36 SER H 1 36 SER QB . . 3.400 2.333 2.129 2.643 . 0 0 "[ . 1 . 2]" 1
680 1 36 SER H 1 36 SER HB3 . . 3.880 2.509 2.174 3.577 . 0 0 "[ . 1 . 2]" 1
681 1 36 SER H 1 37 PHE H . . 3.420 2.508 2.491 2.566 . 0 0 "[ . 1 . 2]" 1
682 1 36 SER H 1 37 PHE HA . . 5.210 5.035 5.022 5.088 . 0 0 "[ . 1 . 2]" 1
683 1 36 SER H 1 37 PHE QD . . 4.080 3.569 3.493 3.641 . 0 0 "[ . 1 . 2]" 1
684 1 36 SER H 1 37 PHE QE . . 4.910 4.448 4.406 4.505 . 0 0 "[ . 1 . 2]" 1
685 1 36 SER H 1 38 ASN H . . 4.390 4.270 4.251 4.312 . 0 0 "[ . 1 . 2]" 1
686 1 36 SER H 1 40 TRP H . . 5.180 5.101 5.069 5.156 . 0 0 "[ . 1 . 2]" 1
687 1 36 SER H 1 40 TRP HD1 . . 5.390 4.820 4.629 4.927 . 0 0 "[ . 1 . 2]" 1
688 1 36 SER H 1 40 TRP HE1 . . 3.990 3.116 2.910 3.196 . 0 0 "[ . 1 . 2]" 1
689 1 36 SER H 1 40 TRP HZ2 . . 4.270 3.329 3.225 3.448 . 0 0 "[ . 1 . 2]" 1
690 1 36 SER H 1 64 HIS HA . . 5.420 4.934 4.805 5.045 . 0 0 "[ . 1 . 2]" 1
691 1 36 SER H 1 64 HIS HB2 . . 4.440 4.111 3.805 4.356 . 0 0 "[ . 1 . 2]" 1
692 1 36 SER H 1 64 HIS HB3 . . 4.730 3.875 3.764 4.004 . 0 0 "[ . 1 . 2]" 1
693 1 36 SER H 1 65 GLN H . . 3.980 3.025 2.947 3.132 . 0 0 "[ . 1 . 2]" 1
694 1 36 SER H 1 65 GLN HB2 . . 4.600 4.254 4.177 4.412 . 0 0 "[ . 1 . 2]" 1
695 1 36 SER H 1 65 GLN HB3 . . 5.040 4.767 4.637 4.866 . 0 0 "[ . 1 . 2]" 1
696 1 36 SER H 1 66 TYR HA . . 4.070 3.896 3.779 3.993 . 0 0 "[ . 1 . 2]" 1
697 1 36 SER HA 1 38 ASN H . . 3.960 3.449 3.419 3.507 . 0 0 "[ . 1 . 2]" 1
698 1 36 SER HA 1 39 ASN H . . 3.720 2.866 2.831 2.890 . 0 0 "[ . 1 . 2]" 1
699 1 36 SER HA 1 39 ASN HA . . 4.180 3.018 2.979 3.046 . 0 0 "[ . 1 . 2]" 1
700 1 36 SER HA 1 40 TRP H . . 3.840 3.412 3.365 3.503 . 0 0 "[ . 1 . 2]" 1
701 1 36 SER HA 1 40 TRP HD1 . . 3.580 2.576 2.412 2.673 . 0 0 "[ . 1 . 2]" 1
702 1 36 SER HA 1 40 TRP HE1 . . 3.360 2.301 2.236 2.379 . 0 0 "[ . 1 . 2]" 1
703 1 36 SER HA 1 40 TRP HZ2 . . 4.820 4.613 4.495 4.753 . 0 0 "[ . 1 . 2]" 1
704 1 36 SER QB 1 37 PHE H . . 3.870 3.430 3.079 3.740 . 0 0 "[ . 1 . 2]" 1
705 1 36 SER QB 1 39 ASN H . . 4.570 4.327 4.152 4.543 . 0 0 "[ . 1 . 2]" 1
706 1 36 SER QB 1 65 GLN HB2 . . 5.340 3.835 3.627 4.169 . 0 0 "[ . 1 . 2]" 1
707 1 36 SER QB 1 65 GLN HB3 . . 5.340 4.922 4.665 5.348 0.008 13 0 "[ . 1 . 2]" 1
708 1 36 SER HB2 1 37 PHE H . . 4.430 4.146 3.206 4.381 . 0 0 "[ . 1 . 2]" 1
709 1 36 SER HB2 1 40 TRP HE1 . . 3.850 2.892 2.089 3.631 . 0 0 "[ . 1 . 2]" 1
710 1 36 SER HB3 1 37 PHE H . . 4.430 3.774 3.221 4.243 . 0 0 "[ . 1 . 2]" 1
711 1 36 SER HB3 1 40 TRP HE1 . . 3.850 2.869 2.090 3.680 . 0 0 "[ . 1 . 2]" 1
712 1 37 PHE H 1 37 PHE HB2 . . 3.680 3.587 3.585 3.590 . 0 0 "[ . 1 . 2]" 1
713 1 37 PHE H 1 37 PHE QB . . 3.230 2.574 2.551 2.611 . 0 0 "[ . 1 . 2]" 1
714 1 37 PHE H 1 37 PHE HB3 . . 3.680 2.638 2.610 2.682 . 0 0 "[ . 1 . 2]" 1
715 1 37 PHE H 1 37 PHE QD . . 3.110 2.317 2.250 2.367 . 0 0 "[ . 1 . 2]" 1
716 1 37 PHE H 1 37 PHE QE . . 4.120 3.967 3.948 4.003 . 0 0 "[ . 1 . 2]" 1
717 1 37 PHE H 1 38 ASN H . . 3.220 2.629 2.563 2.653 . 0 0 "[ . 1 . 2]" 1
718 1 37 PHE H 1 39 ASN H . . 3.970 3.942 3.898 3.959 . 0 0 "[ . 1 . 2]" 1
719 1 37 PHE H 1 40 TRP H . . 4.870 4.863 4.784 4.883 0.013 8 0 "[ . 1 . 2]" 1
720 1 37 PHE H 1 40 TRP HE1 . . 5.100 4.961 4.778 5.014 . 0 0 "[ . 1 . 2]" 1
721 1 37 PHE H 1 59 LEU MD2 . . 4.330 4.268 4.201 4.340 0.010 14 0 "[ . 1 . 2]" 1
722 1 37 PHE H 1 65 GLN H . . 4.820 4.597 4.487 4.786 . 0 0 "[ . 1 . 2]" 1
723 1 37 PHE H 1 94 ILE MG . . 5.500 5.499 5.405 5.524 0.024 17 0 "[ . 1 . 2]" 1
724 1 37 PHE HA 1 37 PHE QD . . 3.940 3.726 3.725 3.727 . 0 0 "[ . 1 . 2]" 1
725 1 37 PHE HA 1 38 ASN HA . . 5.290 4.506 4.496 4.515 . 0 0 "[ . 1 . 2]" 1
726 1 37 PHE HA 1 59 LEU MD2 . . 4.200 3.829 3.766 3.989 . 0 0 "[ . 1 . 2]" 1
727 1 37 PHE QB 1 38 ASN H . . 4.170 3.676 3.639 3.703 . 0 0 "[ . 1 . 2]" 1
728 1 37 PHE QB 1 59 LEU MD2 . . 3.620 1.879 1.841 1.977 . 0 0 "[ . 1 . 2]" 1
729 1 37 PHE HB2 1 59 LEU MD2 . . 4.150 2.005 1.943 2.086 . 0 0 "[ . 1 . 2]" 1
730 1 37 PHE HB3 1 59 LEU MD2 . . 4.150 2.280 2.150 2.452 . 0 0 "[ . 1 . 2]" 1
731 1 37 PHE QD 1 38 ASN H . . 3.410 3.337 3.258 3.373 . 0 0 "[ . 1 . 2]" 1
732 1 37 PHE QD 1 38 ASN HA . . 4.750 3.746 3.693 3.794 . 0 0 "[ . 1 . 2]" 1
733 1 37 PHE QD 1 38 ASN HB2 . . 4.250 3.900 3.856 3.944 . 0 0 "[ . 1 . 2]" 1
734 1 37 PHE QD 1 38 ASN HB3 . . 4.260 2.319 2.272 2.392 . 0 0 "[ . 1 . 2]" 1
735 1 37 PHE QD 1 39 ASN H . . 4.990 4.982 4.932 4.999 0.009 20 0 "[ . 1 . 2]" 1
736 1 37 PHE QD 1 44 ILE MD . . 3.950 3.649 3.587 3.739 . 0 0 "[ . 1 . 2]" 1
737 1 37 PHE QD 1 57 LEU MD1 . . 3.940 2.974 2.898 3.008 . 0 0 "[ . 1 . 2]" 1
738 1 37 PHE QD 1 59 LEU MD1 . . 3.920 3.366 3.184 3.540 . 0 0 "[ . 1 . 2]" 1
739 1 37 PHE QD 1 59 LEU MD2 . . 3.380 2.762 2.711 2.892 . 0 0 "[ . 1 . 2]" 1
740 1 37 PHE QD 1 66 TYR HA . . 4.750 4.753 4.716 4.766 0.016 18 0 "[ . 1 . 2]" 1
741 1 37 PHE QE 1 38 ASN H . . 4.520 4.318 4.232 4.375 . 0 0 "[ . 1 . 2]" 1
742 1 37 PHE QE 1 44 ILE MD . . 3.110 1.983 1.937 2.071 . 0 0 "[ . 1 . 2]" 1
743 1 37 PHE QE 1 44 ILE HG13 . . 4.760 4.091 4.030 4.215 . 0 0 "[ . 1 . 2]" 1
744 1 37 PHE QE 1 57 LEU MD1 . . 3.630 2.609 2.536 2.686 . 0 0 "[ . 1 . 2]" 1
745 1 37 PHE QE 1 57 LEU MD2 . . 4.360 4.000 3.942 4.048 . 0 0 "[ . 1 . 2]" 1
746 1 37 PHE QE 1 59 LEU MD1 . . 4.420 4.032 3.894 4.139 . 0 0 "[ . 1 . 2]" 1
747 1 37 PHE QE 1 59 LEU MD2 . . 4.100 3.689 3.582 3.872 . 0 0 "[ . 1 . 2]" 1
748 1 37 PHE QE 1 66 TYR H . . 5.250 5.160 5.040 5.256 0.006 9 0 "[ . 1 . 2]" 1
749 1 37 PHE QE 1 66 TYR HA . . 4.120 3.542 3.447 3.647 . 0 0 "[ . 1 . 2]" 1
750 1 37 PHE QE 1 66 TYR HB3 . . 3.790 2.315 2.248 2.382 . 0 0 "[ . 1 . 2]" 1
751 1 37 PHE QE 1 66 TYR QD . . 4.330 4.272 4.209 4.336 0.006 16 0 "[ . 1 . 2]" 1
752 1 37 PHE QE 1 67 LYS H . . 4.610 4.532 4.464 4.580 . 0 0 "[ . 1 . 2]" 1
753 1 37 PHE QE 1 94 ILE MG . . 5.200 4.443 4.335 4.560 . 0 0 "[ . 1 . 2]" 1
754 1 37 PHE HZ 1 44 ILE MD . . 3.480 2.929 2.852 3.072 . 0 0 "[ . 1 . 2]" 1
755 1 37 PHE HZ 1 57 LEU MD1 . . 3.760 2.708 2.648 2.777 . 0 0 "[ . 1 . 2]" 1
756 1 37 PHE HZ 1 59 LEU MD2 . . 5.080 4.591 4.448 4.803 . 0 0 "[ . 1 . 2]" 1
757 1 37 PHE HZ 1 66 TYR HB2 . . 5.350 4.153 4.091 4.229 . 0 0 "[ . 1 . 2]" 1
758 1 37 PHE HZ 1 66 TYR HB3 . . 5.100 4.439 4.315 4.551 . 0 0 "[ . 1 . 2]" 1
759 1 38 ASN H 1 38 ASN HB2 . . 3.910 3.852 3.835 3.873 . 0 0 "[ . 1 . 2]" 1
760 1 38 ASN H 1 38 ASN HB3 . . 3.660 2.907 2.875 2.958 . 0 0 "[ . 1 . 2]" 1
761 1 38 ASN H 1 38 ASN HD21 . . 4.030 2.584 2.455 2.685 . 0 0 "[ . 1 . 2]" 1
762 1 38 ASN H 1 38 ASN HD22 . . 4.340 3.674 3.616 3.724 . 0 0 "[ . 1 . 2]" 1
763 1 38 ASN H 1 39 ASN H . . 2.850 2.074 2.019 2.134 . 0 0 "[ . 1 . 2]" 1
764 1 38 ASN H 1 39 ASN HA . . 4.270 4.190 4.140 4.232 . 0 0 "[ . 1 . 2]" 1
765 1 38 ASN H 1 39 ASN HB2 . . 5.170 4.945 4.886 4.996 . 0 0 "[ . 1 . 2]" 1
766 1 38 ASN H 1 40 TRP H . . 3.400 2.969 2.943 2.995 . 0 0 "[ . 1 . 2]" 1
767 1 38 ASN H 1 40 TRP HA . . 4.820 4.783 4.764 4.807 . 0 0 "[ . 1 . 2]" 1
768 1 38 ASN H 1 40 TRP HE1 . . 5.500 5.456 5.313 5.495 . 0 0 "[ . 1 . 2]" 1
769 1 38 ASN H 1 41 SER H . . 5.100 4.992 4.975 5.011 . 0 0 "[ . 1 . 2]" 1
770 1 38 ASN H 1 42 THR MG . . 5.120 4.929 4.872 5.063 . 0 0 "[ . 1 . 2]" 1
771 1 38 ASN H 1 44 ILE MD . . 5.430 5.161 5.079 5.239 . 0 0 "[ . 1 . 2]" 1
772 1 38 ASN H 1 59 LEU MD2 . . 5.450 5.091 5.025 5.167 . 0 0 "[ . 1 . 2]" 1
773 1 38 ASN HA 1 38 ASN HD21 . . 4.610 4.172 4.118 4.216 . 0 0 "[ . 1 . 2]" 1
774 1 38 ASN HA 1 38 ASN HD22 . . 5.170 5.139 5.114 5.159 . 0 0 "[ . 1 . 2]" 1
775 1 38 ASN HA 1 39 ASN H . . 3.550 3.125 3.113 3.135 . 0 0 "[ . 1 . 2]" 1
776 1 38 ASN HA 1 40 TRP H . . 4.490 4.389 4.371 4.405 . 0 0 "[ . 1 . 2]" 1
777 1 38 ASN HA 1 41 SER H . . 4.940 4.832 4.814 4.871 . 0 0 "[ . 1 . 2]" 1
778 1 38 ASN HB2 1 41 SER H . . 4.460 3.990 3.921 4.054 . 0 0 "[ . 1 . 2]" 1
779 1 38 ASN HB2 1 42 THR H . . 4.480 4.433 4.252 4.475 . 0 0 "[ . 1 . 2]" 1
780 1 38 ASN HB3 1 39 ASN H . . 4.450 4.345 4.334 4.358 . 0 0 "[ . 1 . 2]" 1
781 1 38 ASN HB3 1 42 THR H . . 5.500 5.267 5.114 5.305 . 0 0 "[ . 1 . 2]" 1
782 1 38 ASN HB3 1 44 ILE MD . . 4.760 3.020 2.955 3.115 . 0 0 "[ . 1 . 2]" 1
783 1 38 ASN HD21 1 39 ASN H . . 4.750 4.284 4.161 4.378 . 0 0 "[ . 1 . 2]" 1
784 1 38 ASN HD21 1 40 TRP H . . 3.880 3.452 3.367 3.530 . 0 0 "[ . 1 . 2]" 1
785 1 38 ASN HD21 1 40 TRP HA . . 4.350 3.972 3.924 4.004 . 0 0 "[ . 1 . 2]" 1
786 1 38 ASN HD21 1 42 THR H . . 5.040 4.914 4.838 4.958 . 0 0 "[ . 1 . 2]" 1
787 1 38 ASN HD21 1 42 THR MG . . 3.880 3.757 3.669 3.887 0.007 17 0 "[ . 1 . 2]" 1
788 1 38 ASN HD21 1 44 ILE MD . . 3.970 3.310 3.181 3.413 . 0 0 "[ . 1 . 2]" 1
789 1 38 ASN HD21 1 44 ILE HG12 . . 5.500 5.443 5.318 5.510 0.010 18 0 "[ . 1 . 2]" 1
790 1 38 ASN HD22 1 40 TRP HA . . 4.390 2.499 2.457 2.532 . 0 0 "[ . 1 . 2]" 1
791 1 38 ASN HD22 1 41 SER H . . 4.400 3.881 3.770 3.972 . 0 0 "[ . 1 . 2]" 1
792 1 38 ASN HD22 1 42 THR H . . 3.690 3.658 3.633 3.697 0.007 5 0 "[ . 1 . 2]" 1
793 1 38 ASN HD22 1 42 THR MG . . 4.000 3.529 3.411 3.607 . 0 0 "[ . 1 . 2]" 1
794 1 38 ASN HD22 1 43 LYS HA . . 4.900 4.776 4.667 4.909 0.009 12 0 "[ . 1 . 2]" 1
795 1 38 ASN HD22 1 44 ILE MD . . 4.150 3.650 3.587 3.701 . 0 0 "[ . 1 . 2]" 1
796 1 39 ASN H 1 39 ASN HA . . 2.830 2.274 2.273 2.276 . 0 0 "[ . 1 . 2]" 1
797 1 39 ASN H 1 39 ASN HB2 . . 3.490 3.083 3.065 3.089 . 0 0 "[ . 1 . 2]" 1
798 1 39 ASN H 1 39 ASN HB3 . . 3.840 3.810 3.777 3.835 . 0 0 "[ . 1 . 2]" 1
799 1 39 ASN H 1 40 TRP H . . 3.370 2.612 2.606 2.632 . 0 0 "[ . 1 . 2]" 1
800 1 39 ASN H 1 40 TRP HA . . 5.050 4.884 4.878 4.904 . 0 0 "[ . 1 . 2]" 1
801 1 39 ASN H 1 40 TRP HD1 . . 3.880 3.868 3.706 3.889 0.009 3 0 "[ . 1 . 2]" 1
802 1 39 ASN H 1 40 TRP HE1 . . 5.040 5.023 4.968 5.048 0.008 9 0 "[ . 1 . 2]" 1
803 1 39 ASN H 1 41 SER H . . 4.720 4.506 4.441 4.593 . 0 0 "[ . 1 . 2]" 1
804 1 39 ASN HA 1 39 ASN QD . . 4.480 3.875 3.772 3.952 . 0 0 "[ . 1 . 2]" 1
805 1 39 ASN HA 1 40 TRP H . . 3.350 3.031 3.023 3.040 . 0 0 "[ . 1 . 2]" 1
806 1 39 ASN HA 1 40 TRP HD1 . . 3.110 2.597 2.550 2.623 . 0 0 "[ . 1 . 2]" 1
807 1 39 ASN HB2 1 39 ASN HD22 . . 3.680 3.564 3.490 3.672 . 0 0 "[ . 1 . 2]" 1
808 1 39 ASN HB2 1 40 TRP H . . 4.480 4.395 4.374 4.419 . 0 0 "[ . 1 . 2]" 1
809 1 39 ASN HB2 1 40 TRP HD1 . . 5.160 5.138 5.096 5.162 0.002 14 0 "[ . 1 . 2]" 1
810 1 39 ASN HB2 1 41 SER QB . . 4.720 4.125 4.000 4.394 . 0 0 "[ . 1 . 2]" 1
811 1 39 ASN HB3 1 39 ASN QD . . 3.260 2.602 2.367 2.787 . 0 0 "[ . 1 . 2]" 1
812 1 39 ASN HB3 1 39 ASN HD22 . . 3.770 3.663 3.550 3.757 . 0 0 "[ . 1 . 2]" 1
813 1 39 ASN HB3 1 40 TRP H . . 4.480 3.970 3.955 3.985 . 0 0 "[ . 1 . 2]" 1
814 1 39 ASN HB3 1 41 SER H . . 3.730 3.352 3.218 3.526 . 0 0 "[ . 1 . 2]" 1
815 1 39 ASN HB3 1 41 SER QB . . 4.730 2.629 2.456 2.969 . 0 0 "[ . 1 . 2]" 1
816 1 40 TRP H 1 40 TRP HB2 . . 3.670 3.592 3.576 3.612 . 0 0 "[ . 1 . 2]" 1
817 1 40 TRP H 1 40 TRP HD1 . . 3.870 3.017 2.868 3.062 . 0 0 "[ . 1 . 2]" 1
818 1 40 TRP H 1 40 TRP HE1 . . 4.760 4.644 4.602 4.658 . 0 0 "[ . 1 . 2]" 1
819 1 40 TRP H 1 41 SER H . . 3.320 2.786 2.765 2.815 . 0 0 "[ . 1 . 2]" 1
820 1 40 TRP H 1 42 THR H . . 4.360 4.315 4.249 4.378 0.018 12 0 "[ . 1 . 2]" 1
821 1 40 TRP HA 1 40 TRP HD1 . . 4.150 4.023 3.924 4.052 . 0 0 "[ . 1 . 2]" 1
822 1 40 TRP HA 1 40 TRP HE3 . . 3.740 3.582 3.550 3.706 . 0 0 "[ . 1 . 2]" 1
823 1 40 TRP HA 1 41 SER H . . 3.220 2.866 2.798 2.920 . 0 0 "[ . 1 . 2]" 1
824 1 40 TRP HA 1 42 THR H . . 3.270 3.196 3.172 3.226 . 0 0 "[ . 1 . 2]" 1
825 1 40 TRP HB2 1 40 TRP HD1 . . 3.650 2.796 2.785 2.837 . 0 0 "[ . 1 . 2]" 1
826 1 40 TRP HB2 1 41 SER H . . 4.850 4.151 4.092 4.221 . 0 0 "[ . 1 . 2]" 1
827 1 40 TRP HB3 1 40 TRP HE3 . . 3.960 2.447 2.425 2.453 . 0 0 "[ . 1 . 2]" 1
828 1 40 TRP HB3 1 40 TRP HZ3 . . 5.340 4.858 4.841 4.863 . 0 0 "[ . 1 . 2]" 1
829 1 40 TRP HE1 1 65 GLN H . . 5.080 4.967 4.801 5.086 0.006 17 0 "[ . 1 . 2]" 1
830 1 40 TRP HE1 1 65 GLN HB2 . . 4.860 4.748 4.551 4.867 0.007 9 0 "[ . 1 . 2]" 1
831 1 40 TRP HE1 1 65 GLN HB3 . . 5.270 5.233 5.023 5.279 0.009 4 0 "[ . 1 . 2]" 1
832 1 40 TRP HH2 1 66 TYR H . . 4.320 4.323 4.289 4.331 0.011 7 0 "[ . 1 . 2]" 1
833 1 40 TRP HH2 1 66 TYR HA . . 4.010 3.082 2.984 3.195 . 0 0 "[ . 1 . 2]" 1
834 1 40 TRP HH2 1 67 LYS H . . 4.280 4.028 3.903 4.130 . 0 0 "[ . 1 . 2]" 1
835 1 40 TRP HH2 1 67 LYS QB . . 3.920 2.630 2.469 2.738 . 0 0 "[ . 1 . 2]" 1
836 1 40 TRP HH2 1 67 LYS HD2 . . 5.370 5.170 5.053 5.278 . 0 0 "[ . 1 . 2]" 1
837 1 40 TRP HH2 1 67 LYS HD3 . . 4.480 4.446 4.250 4.485 0.005 17 0 "[ . 1 . 2]" 1
838 1 40 TRP HH2 1 91 ASN HB2 . . 4.750 2.858 2.623 2.977 . 0 0 "[ . 1 . 2]" 1
839 1 40 TRP HH2 1 91 ASN HB3 . . 4.660 3.044 2.751 3.393 . 0 0 "[ . 1 . 2]" 1
840 1 40 TRP HH2 1 91 ASN HD22 . . 5.330 5.327 5.249 5.349 0.019 17 0 "[ . 1 . 2]" 1
841 1 40 TRP HZ2 1 65 GLN H . . 4.750 4.151 4.040 4.326 . 0 0 "[ . 1 . 2]" 1
842 1 40 TRP HZ2 1 65 GLN HA . . 4.960 4.751 4.612 4.796 . 0 0 "[ . 1 . 2]" 1
843 1 40 TRP HZ2 1 65 GLN HB2 . . 3.700 3.187 3.030 3.464 . 0 0 "[ . 1 . 2]" 1
844 1 40 TRP HZ2 1 65 GLN HB3 . . 3.730 2.793 2.693 2.860 . 0 0 "[ . 1 . 2]" 1
845 1 40 TRP HZ2 1 66 TYR H . . 4.910 4.784 4.591 4.913 0.003 2 0 "[ . 1 . 2]" 1
846 1 40 TRP HZ2 1 66 TYR HA . . 4.930 3.715 3.468 3.894 . 0 0 "[ . 1 . 2]" 1
847 1 40 TRP HZ2 1 91 ASN HB2 . . 4.470 4.258 3.933 4.455 . 0 0 "[ . 1 . 2]" 1
848 1 40 TRP HZ2 1 91 ASN HD21 . . 4.470 4.342 4.197 4.466 . 0 0 "[ . 1 . 2]" 1
849 1 40 TRP HZ2 1 91 ASN HD22 . . 5.330 5.257 5.170 5.339 0.009 13 0 "[ . 1 . 2]" 1
850 1 40 TRP HZ3 1 66 TYR HA . . 4.360 4.127 4.066 4.313 . 0 0 "[ . 1 . 2]" 1
851 1 40 TRP HZ3 1 67 LYS QB . . 3.950 1.990 1.904 2.061 . 0 0 "[ . 1 . 2]" 1
852 1 40 TRP HZ3 1 67 LYS HD2 . . 5.180 5.098 4.952 5.191 0.011 6 0 "[ . 1 . 2]" 1
853 1 40 TRP HZ3 1 67 LYS HD3 . . 5.110 4.317 4.060 4.445 . 0 0 "[ . 1 . 2]" 1
854 1 40 TRP HZ3 1 67 LYS HG3 . . 4.830 4.497 4.344 4.599 . 0 0 "[ . 1 . 2]" 1
855 1 40 TRP HZ3 1 74 TRP HZ3 . . 4.400 4.259 4.115 4.405 0.005 3 0 "[ . 1 . 2]" 1
856 1 40 TRP HZ3 1 91 ASN HB2 . . 5.500 4.773 4.630 4.880 . 0 0 "[ . 1 . 2]" 1
857 1 41 SER H 1 41 SER QB . . 3.050 2.440 2.371 2.499 . 0 0 "[ . 1 . 2]" 1
858 1 41 SER H 1 42 THR H . . 2.770 2.348 2.213 2.418 . 0 0 "[ . 1 . 2]" 1
859 1 41 SER H 1 42 THR HA . . 5.020 4.911 4.845 4.967 . 0 0 "[ . 1 . 2]" 1
860 1 41 SER H 1 42 THR MG . . 4.060 3.239 3.162 3.391 . 0 0 "[ . 1 . 2]" 1
861 1 41 SER HA 1 42 THR H . . 3.340 3.115 3.097 3.224 . 0 0 "[ . 1 . 2]" 1
862 1 41 SER QB 1 42 THR H . . 3.750 3.620 3.575 3.771 0.021 17 0 "[ . 1 . 2]" 1
863 1 41 SER QB 1 42 THR MG . . 4.560 3.486 3.291 4.105 . 0 0 "[ . 1 . 2]" 1
864 1 42 THR H 1 42 THR MG . . 3.010 2.642 2.496 2.665 . 0 0 "[ . 1 . 2]" 1
865 1 42 THR H 1 43 LYS HA . . 4.630 4.576 4.562 4.622 . 0 0 "[ . 1 . 2]" 1
866 1 42 THR H 1 44 ILE MD . . 4.700 4.643 4.577 4.703 0.003 16 0 "[ . 1 . 2]" 1
867 1 42 THR HA 1 42 THR MG . . 3.230 3.203 3.194 3.206 . 0 0 "[ . 1 . 2]" 1
868 1 42 THR HB 1 44 ILE MD . . 4.770 4.606 4.560 4.719 . 0 0 "[ . 1 . 2]" 1
869 1 42 THR MG 1 44 ILE MD . . 3.450 2.333 2.279 2.477 . 0 0 "[ . 1 . 2]" 1
870 1 43 LYS HA 1 43 LYS QD . . 4.210 3.753 3.499 4.014 . 0 0 "[ . 1 . 2]" 1
871 1 43 LYS HA 1 43 LYS HE2 . . 5.500 5.553 5.499 5.704 0.204 13 0 "[ . 1 . 2]" 1
872 1 43 LYS HA 1 43 LYS HE3 . . 5.500 4.911 4.683 4.966 . 0 0 "[ . 1 . 2]" 1
873 1 43 LYS HA 1 43 LYS HG2 . . 4.010 2.315 2.153 2.637 . 0 0 "[ . 1 . 2]" 1
874 1 43 LYS HA 1 43 LYS HG3 . . 4.010 2.954 2.371 3.359 . 0 0 "[ . 1 . 2]" 1
875 1 43 LYS HA 1 44 ILE H . . 3.530 2.142 2.139 2.164 . 0 0 "[ . 1 . 2]" 1
876 1 43 LYS HA 1 74 TRP HH2 . . 5.430 3.961 3.801 4.044 . 0 0 "[ . 1 . 2]" 1
877 1 43 LYS HB2 1 43 LYS QD . . 3.850 2.606 2.427 2.771 . 0 0 "[ . 1 . 2]" 1
878 1 43 LYS HB2 1 43 LYS QE . . 4.140 3.618 3.188 3.979 . 0 0 "[ . 1 . 2]" 1
879 1 43 LYS HB3 1 44 ILE H . . 4.220 3.575 3.257 3.752 . 0 0 "[ . 1 . 2]" 1
880 1 43 LYS QD 1 44 ILE H . . 5.370 4.854 4.392 5.242 . 0 0 "[ . 1 . 2]" 1
881 1 43 LYS QD 1 69 PHE H . . 5.050 4.903 4.670 5.064 0.014 13 0 "[ . 1 . 2]" 1
882 1 43 LYS QD 1 69 PHE HB2 . . 4.380 3.093 2.875 3.191 . 0 0 "[ . 1 . 2]" 1
883 1 43 LYS QD 1 69 PHE HB3 . . 4.780 2.641 2.347 2.822 . 0 0 "[ . 1 . 2]" 1
884 1 43 LYS QD 1 69 PHE QD . . 3.710 3.062 2.650 3.347 . 0 0 "[ . 1 . 2]" 1
885 1 43 LYS QD 1 69 PHE QE . . 4.250 4.038 3.700 4.265 0.015 16 0 "[ . 1 . 2]" 1
886 1 43 LYS QD 1 74 TRP HE1 . . 5.500 5.431 5.115 5.511 0.011 7 0 "[ . 1 . 2]" 1
887 1 43 LYS QD 1 74 TRP HH2 . . 4.330 3.271 2.817 3.867 . 0 0 "[ . 1 . 2]" 1
888 1 43 LYS QD 1 74 TRP HZ2 . . 3.970 3.780 3.609 3.977 0.007 12 0 "[ . 1 . 2]" 1
889 1 43 LYS QD 1 74 TRP HZ3 . . 4.710 4.268 3.942 4.731 0.021 12 0 "[ . 1 . 2]" 1
890 1 43 LYS QE 1 69 PHE QD . . 3.820 3.213 2.983 3.692 . 0 0 "[ . 1 . 2]" 1
891 1 43 LYS QE 1 69 PHE QE . . 4.050 3.684 3.554 3.823 . 0 0 "[ . 1 . 2]" 1
892 1 43 LYS QE 1 74 TRP HD1 . . 5.340 5.315 5.216 5.466 0.126 17 0 "[ . 1 . 2]" 1
893 1 43 LYS QE 1 74 TRP HE1 . . 4.110 3.591 3.531 3.661 . 0 0 "[ . 1 . 2]" 1
894 1 43 LYS QE 1 74 TRP HH2 . . 3.730 3.162 3.038 3.347 . 0 0 "[ . 1 . 2]" 1
895 1 43 LYS QE 1 74 TRP HZ2 . . 3.230 2.251 1.984 2.451 . 0 0 "[ . 1 . 2]" 1
896 1 43 LYS HE2 1 69 PHE QD . . 4.490 3.395 3.028 4.231 . 0 0 "[ . 1 . 2]" 1
897 1 43 LYS HE2 1 69 PHE QE . . 4.840 3.860 3.680 4.094 . 0 0 "[ . 1 . 2]" 1
898 1 43 LYS HE2 1 69 PHE HZ . . 5.500 4.587 4.380 4.722 . 0 0 "[ . 1 . 2]" 1
899 1 43 LYS HE2 1 74 TRP HE1 . . 4.980 4.050 3.761 4.680 . 0 0 "[ . 1 . 2]" 1
900 1 43 LYS HE2 1 74 TRP HZ2 . . 3.980 2.894 2.517 3.825 . 0 0 "[ . 1 . 2]" 1
901 1 43 LYS HE3 1 69 PHE QD . . 4.490 4.351 3.887 4.514 0.024 6 0 "[ . 1 . 2]" 1
902 1 43 LYS HE3 1 69 PHE QE . . 4.840 4.693 4.452 4.776 . 0 0 "[ . 1 . 2]" 1
903 1 43 LYS HE3 1 69 PHE HZ . . 5.500 5.485 5.364 5.515 0.015 6 0 "[ . 1 . 2]" 1
904 1 43 LYS HE3 1 74 TRP HE1 . . 4.980 4.182 3.660 4.549 . 0 0 "[ . 1 . 2]" 1
905 1 43 LYS HE3 1 74 TRP HZ2 . . 3.980 2.461 1.992 2.823 . 0 0 "[ . 1 . 2]" 1
906 1 43 LYS QG 1 74 TRP HH2 . . 3.590 2.400 2.256 2.618 . 0 0 "[ . 1 . 2]" 1
907 1 43 LYS QG 1 74 TRP HZ2 . . 4.210 3.177 3.001 3.307 . 0 0 "[ . 1 . 2]" 1
908 1 43 LYS HG2 1 74 TRP HH2 . . 4.270 2.653 2.302 3.439 . 0 0 "[ . 1 . 2]" 1
909 1 43 LYS HG3 1 74 TRP HH2 . . 4.270 3.278 2.515 4.086 . 0 0 "[ . 1 . 2]" 1
910 1 44 ILE H 1 44 ILE HB . . 3.600 2.280 2.274 2.319 . 0 0 "[ . 1 . 2]" 1
911 1 44 ILE H 1 44 ILE MD . . 3.260 2.322 2.278 2.468 . 0 0 "[ . 1 . 2]" 1
912 1 44 ILE H 1 44 ILE HG12 . . 4.310 4.116 4.100 4.232 . 0 0 "[ . 1 . 2]" 1
913 1 44 ILE H 1 44 ILE MG . . 3.810 3.647 3.644 3.651 . 0 0 "[ . 1 . 2]" 1
914 1 44 ILE H 1 45 PRO HA . . 5.500 5.503 5.379 5.524 0.024 15 0 "[ . 1 . 2]" 1
915 1 44 ILE H 1 45 PRO HD2 . . 5.100 4.826 4.824 4.833 . 0 0 "[ . 1 . 2]" 1
916 1 44 ILE H 1 45 PRO HD3 . . 5.100 4.841 4.819 4.845 . 0 0 "[ . 1 . 2]" 1
917 1 44 ILE H 1 57 LEU MD2 . . 5.500 5.396 5.342 5.443 . 0 0 "[ . 1 . 2]" 1
918 1 44 ILE HA 1 44 ILE MD . . 3.890 2.644 2.616 2.683 . 0 0 "[ . 1 . 2]" 1
919 1 44 ILE HA 1 44 ILE HG13 . . 3.450 2.288 2.281 2.300 . 0 0 "[ . 1 . 2]" 1
920 1 44 ILE HA 1 45 PRO HD2 . . 3.840 2.101 2.096 2.104 . 0 0 "[ . 1 . 2]" 1
921 1 44 ILE HA 1 45 PRO HD3 . . 3.840 2.260 2.259 2.261 . 0 0 "[ . 1 . 2]" 1
922 1 44 ILE HA 1 45 PRO HG2 . . 4.480 4.273 4.270 4.276 . 0 0 "[ . 1 . 2]" 1
923 1 44 ILE HA 1 45 PRO QG . . 3.930 3.833 3.831 3.834 . 0 0 "[ . 1 . 2]" 1
924 1 44 ILE HA 1 45 PRO HG3 . . 4.480 4.332 4.331 4.333 . 0 0 "[ . 1 . 2]" 1
925 1 44 ILE HB 1 44 ILE MD . . 3.300 2.327 2.289 2.353 . 0 0 "[ . 1 . 2]" 1
926 1 44 ILE HB 1 57 LEU MD2 . . 4.650 3.485 3.426 3.534 . 0 0 "[ . 1 . 2]" 1
927 1 44 ILE MD 1 44 ILE MG . . 3.280 3.242 3.240 3.245 . 0 0 "[ . 1 . 2]" 1
928 1 44 ILE MD 1 45 PRO HD2 . . 4.620 4.147 4.119 4.167 . 0 0 "[ . 1 . 2]" 1
929 1 44 ILE MD 1 45 PRO QD . . 3.900 3.825 3.797 3.845 . 0 0 "[ . 1 . 2]" 1
930 1 44 ILE MD 1 45 PRO HD3 . . 4.620 4.485 4.451 4.511 . 0 0 "[ . 1 . 2]" 1
931 1 44 ILE MD 1 57 LEU HB3 . . 4.760 4.676 4.563 4.750 . 0 0 "[ . 1 . 2]" 1
932 1 44 ILE MD 1 57 LEU MD1 . . 3.810 3.506 3.415 3.574 . 0 0 "[ . 1 . 2]" 1
933 1 44 ILE MD 1 57 LEU MD2 . . 4.030 4.036 4.012 4.048 0.018 18 0 "[ . 1 . 2]" 1
934 1 44 ILE HG13 1 44 ILE MG . . 3.230 2.509 2.493 2.526 . 0 0 "[ . 1 . 2]" 1
935 1 44 ILE HG13 1 45 PRO HD2 . . 4.140 2.956 2.945 2.965 . 0 0 "[ . 1 . 2]" 1
936 1 44 ILE HG13 1 45 PRO QD . . 3.480 2.882 2.873 2.891 . 0 0 "[ . 1 . 2]" 1
937 1 44 ILE HG13 1 45 PRO HD3 . . 4.140 4.001 3.995 4.010 . 0 0 "[ . 1 . 2]" 1
938 1 44 ILE HG13 1 45 PRO HG2 . . 5.500 5.121 5.106 5.134 . 0 0 "[ . 1 . 2]" 1
939 1 44 ILE HG13 1 45 PRO QG . . 4.760 4.725 4.713 4.735 . 0 0 "[ . 1 . 2]" 1
940 1 44 ILE HG13 1 45 PRO HG3 . . 5.500 5.543 5.535 5.554 0.054 16 0 "[ . 1 . 2]" 1
941 1 44 ILE HG13 1 57 LEU MD2 . . 4.090 4.106 4.090 4.121 0.031 9 0 "[ . 1 . 2]" 1
942 1 45 PRO HA 1 46 LEU H . . 3.160 2.179 2.164 2.202 . 0 0 "[ . 1 . 2]" 1
943 1 45 PRO HA 1 46 LEU MD1 . . 4.270 3.926 3.759 4.098 . 0 0 "[ . 1 . 2]" 1
944 1 46 LEU H 1 46 LEU HB3 . . 3.680 3.322 3.286 3.363 . 0 0 "[ . 1 . 2]" 1
945 1 46 LEU H 1 46 LEU MD1 . . 3.230 3.053 2.887 3.263 0.033 16 0 "[ . 1 . 2]" 1
946 1 46 LEU H 1 46 LEU HG . . 4.480 4.326 4.253 4.400 . 0 0 "[ . 1 . 2]" 1
947 1 46 LEU HA 1 46 LEU MD1 . . 3.600 2.730 2.524 2.916 . 0 0 "[ . 1 . 2]" 1
948 1 46 LEU HA 1 46 LEU MD2 . . 3.710 3.660 3.554 3.711 0.001 18 0 "[ . 1 . 2]" 1
949 1 46 LEU HA 1 46 LEU HG . . 4.040 2.265 2.182 2.328 . 0 0 "[ . 1 . 2]" 1
950 1 46 LEU HA 1 54 VAL H . . 4.290 4.168 3.981 4.365 0.075 16 0 "[ . 1 . 2]" 1
951 1 46 LEU HA 1 55 ALA MB . . 3.710 3.088 2.797 3.344 . 0 0 "[ . 1 . 2]" 1
952 1 46 LEU HB2 1 53 PHE HB3 . . 4.180 3.673 3.505 4.183 0.003 16 0 "[ . 1 . 2]" 1
953 1 46 LEU HB2 1 53 PHE QD . . 4.170 3.886 3.603 4.216 0.046 20 0 "[ . 1 . 2]" 1
954 1 46 LEU HB3 1 53 PHE HA . . 4.260 3.885 3.764 4.155 . 0 0 "[ . 1 . 2]" 1
955 1 46 LEU HB3 1 53 PHE HB2 . . 4.940 3.995 3.779 4.530 . 0 0 "[ . 1 . 2]" 1
956 1 46 LEU HB3 1 54 VAL H . . 4.780 3.064 2.767 3.337 . 0 0 "[ . 1 . 2]" 1
957 1 46 LEU MD1 1 53 PHE HB2 . . 5.500 5.043 4.889 5.472 . 0 0 "[ . 1 . 2]" 1
958 1 46 LEU MD1 1 53 PHE QD . . 5.310 5.073 4.903 5.277 . 0 0 "[ . 1 . 2]" 1
959 1 46 LEU MD1 1 54 VAL HA . . 4.870 4.804 4.705 4.893 0.023 20 0 "[ . 1 . 2]" 1
960 1 46 LEU MD1 1 55 ALA MB . . 3.320 2.110 1.856 2.409 . 0 0 "[ . 1 . 2]" 1
961 1 46 LEU MD1 1 68 PHE QD . . 3.490 2.989 2.806 3.200 . 0 0 "[ . 1 . 2]" 1
962 1 46 LEU MD1 1 68 PHE QE . . 3.950 2.881 2.591 3.085 . 0 0 "[ . 1 . 2]" 1
963 1 46 LEU MD1 1 69 PHE H . . 4.500 4.302 4.054 4.506 0.006 7 0 "[ . 1 . 2]" 1
964 1 46 LEU MD2 1 53 PHE H . . 4.790 4.452 4.349 4.734 . 0 0 "[ . 1 . 2]" 1
965 1 46 LEU MD2 1 53 PHE HA . . 4.460 3.733 3.580 3.832 . 0 0 "[ . 1 . 2]" 1
966 1 46 LEU MD2 1 53 PHE HB2 . . 3.650 2.524 2.357 3.067 . 0 0 "[ . 1 . 2]" 1
967 1 46 LEU MD2 1 53 PHE HB3 . . 3.950 1.935 1.890 2.135 . 0 0 "[ . 1 . 2]" 1
968 1 46 LEU MD2 1 53 PHE QD . . 4.140 3.377 3.251 3.562 . 0 0 "[ . 1 . 2]" 1
969 1 46 LEU MD2 1 54 VAL HA . . 3.720 2.832 2.648 3.110 . 0 0 "[ . 1 . 2]" 1
970 1 46 LEU MD2 1 55 ALA MB . . 3.980 3.177 2.646 3.440 . 0 0 "[ . 1 . 2]" 1
971 1 46 LEU MD2 1 68 PHE QD . . 3.490 3.291 3.099 3.435 . 0 0 "[ . 1 . 2]" 1
972 1 46 LEU MD2 1 68 PHE QE . . 3.310 2.726 2.220 2.907 . 0 0 "[ . 1 . 2]" 1
973 1 46 LEU MD2 1 68 PHE HZ . . 4.510 4.163 3.776 4.311 . 0 0 "[ . 1 . 2]" 1
974 1 46 LEU MD2 1 70 VAL MG2 . . 4.820 4.207 4.113 4.601 . 0 0 "[ . 1 . 2]" 1
975 1 46 LEU HG 1 54 VAL H . . 4.410 3.597 3.479 3.843 . 0 0 "[ . 1 . 2]" 1
976 1 46 LEU HG 1 54 VAL HA . . 4.490 3.663 3.514 3.929 . 0 0 "[ . 1 . 2]" 1
977 1 46 LEU HG 1 55 ALA MB . . 3.640 2.300 2.046 2.535 . 0 0 "[ . 1 . 2]" 1
978 1 47 ILE HA 1 47 ILE MD . . 3.620 2.082 1.974 2.272 . 0 0 "[ . 1 . 2]" 1
979 1 47 ILE HA 1 47 ILE MG . . 3.400 2.344 2.280 2.610 . 0 0 "[ . 1 . 2]" 1
980 1 47 ILE HA 1 48 LYS H . . 2.880 2.157 2.139 2.173 . 0 0 "[ . 1 . 2]" 1
981 1 47 ILE HB 1 47 ILE MD . . 3.690 3.111 2.476 3.231 . 0 0 "[ . 1 . 2]" 1
982 1 47 ILE HB 1 48 LYS H . . 4.490 4.389 4.282 4.509 0.019 20 0 "[ . 1 . 2]" 1
983 1 47 ILE MD 1 48 LYS H . . 4.070 3.803 3.649 4.163 0.093 20 0 "[ . 1 . 2]" 1
984 1 47 ILE HG12 1 47 ILE MG . . 3.640 3.059 2.333 3.195 . 0 0 "[ . 1 . 2]" 1
985 1 47 ILE HG13 1 47 ILE MG . . 3.640 2.283 2.234 2.400 . 0 0 "[ . 1 . 2]" 1
986 1 47 ILE MG 1 48 LYS H . . 3.080 2.938 2.636 3.070 . 0 0 "[ . 1 . 2]" 1
987 1 48 LYS H 1 48 LYS HB2 . . 3.170 2.190 2.095 2.259 . 0 0 "[ . 1 . 2]" 1
988 1 48 LYS H 1 48 LYS HB3 . . 3.100 2.953 2.833 3.111 0.011 20 0 "[ . 1 . 2]" 1
989 1 48 LYS H 1 48 LYS HG2 . . 4.660 4.611 4.466 4.663 0.003 12 0 "[ . 1 . 2]" 1
990 1 48 LYS H 1 48 LYS HG3 . . 4.210 4.115 3.855 4.234 0.024 16 0 "[ . 1 . 2]" 1
991 1 48 LYS H 1 53 PHE QD . . 4.840 4.595 4.336 4.856 0.016 12 0 "[ . 1 . 2]" 1
992 1 48 LYS HA 1 48 LYS QD . . 4.610 3.855 3.455 4.070 . 0 0 "[ . 1 . 2]" 1
993 1 48 LYS HA 1 53 PHE HA . . 3.740 2.592 2.171 2.791 . 0 0 "[ . 1 . 2]" 1
994 1 48 LYS HA 1 53 PHE QD . . 4.440 3.215 3.042 3.779 . 0 0 "[ . 1 . 2]" 1
995 1 48 LYS HB2 1 48 LYS QD . . 3.610 2.429 2.056 3.157 . 0 0 "[ . 1 . 2]" 1
996 1 48 LYS HB2 1 49 SER H . . 4.730 4.484 4.300 4.559 . 0 0 "[ . 1 . 2]" 1
997 1 48 LYS HB2 1 53 PHE QD . . 4.200 3.935 3.618 4.216 0.016 7 0 "[ . 1 . 2]" 1
998 1 48 LYS HB3 1 49 SER H . . 4.030 3.957 3.657 4.045 0.015 8 0 "[ . 1 . 2]" 1
999 1 48 LYS QD 1 53 PHE QD . . 4.030 3.711 2.779 4.078 0.048 20 0 "[ . 1 . 2]" 1
1000 1 48 LYS QD 1 53 PHE QE . . 3.410 2.194 1.914 3.016 . 0 0 "[ . 1 . 2]" 1
1001 1 48 LYS QE 1 48 LYS HG2 . . 3.610 2.844 2.352 3.513 . 0 0 "[ . 1 . 2]" 1
1002 1 48 LYS QE 1 53 PHE QD . . 4.560 3.740 2.415 4.587 0.027 9 0 "[ . 1 . 2]" 1
1003 1 48 LYS QE 1 53 PHE QE . . 4.510 2.603 1.974 3.659 . 0 0 "[ . 1 . 2]" 1
1004 1 48 LYS HE2 1 48 LYS HG2 . . 4.130 3.125 2.573 3.989 . 0 0 "[ . 1 . 2]" 1
1005 1 48 LYS HE3 1 48 LYS HG2 . . 4.130 3.530 2.472 4.238 0.108 20 0 "[ . 1 . 2]" 1
1006 1 48 LYS HG2 1 49 SER H . . 3.880 3.545 2.471 3.867 . 0 0 "[ . 1 . 2]" 1
1007 1 48 LYS HG2 1 53 PHE HA . . 5.210 4.852 3.405 5.221 0.011 12 0 "[ . 1 . 2]" 1
1008 1 48 LYS HG2 1 53 PHE QD . . 4.630 4.435 3.851 4.652 0.022 9 0 "[ . 1 . 2]" 1
1009 1 48 LYS HG2 1 53 PHE QE . . 4.200 3.910 3.495 4.206 0.006 12 0 "[ . 1 . 2]" 1
1010 1 48 LYS HG3 1 49 SER H . . 3.690 3.503 3.063 3.811 0.121 20 0 "[ . 1 . 2]" 1
1011 1 48 LYS HG3 1 53 PHE H . . 5.500 5.197 4.274 5.515 0.015 20 0 "[ . 1 . 2]" 1
1012 1 48 LYS HG3 1 53 PHE HA . . 5.140 3.721 3.177 3.915 . 0 0 "[ . 1 . 2]" 1
1013 1 48 LYS HG3 1 53 PHE QD . . 4.290 2.852 2.372 3.107 . 0 0 "[ . 1 . 2]" 1
1014 1 48 LYS HG3 1 53 PHE QE . . 4.400 2.690 2.328 3.264 . 0 0 "[ . 1 . 2]" 1
1015 1 48 LYS HG3 1 54 VAL H . . 5.500 5.402 5.098 5.500 . 0 0 "[ . 1 . 2]" 1
1016 1 49 SER H 1 49 SER QB . . 3.520 2.435 2.310 2.465 . 0 0 "[ . 1 . 2]" 1
1017 1 49 SER H 1 52 ASP H . . 4.040 3.671 3.313 3.980 . 0 0 "[ . 1 . 2]" 1
1018 1 49 SER H 1 53 PHE HA . . 3.690 2.824 2.700 2.960 . 0 0 "[ . 1 . 2]" 1
1019 1 49 SER H 1 53 PHE QD . . 5.210 4.634 4.495 4.896 . 0 0 "[ . 1 . 2]" 1
1020 1 49 SER H 1 54 VAL H . . 4.430 4.214 4.076 4.377 . 0 0 "[ . 1 . 2]" 1
1021 1 49 SER QB 1 54 VAL H . . 5.050 4.445 4.230 4.664 . 0 0 "[ . 1 . 2]" 1
1022 1 49 SER QB 1 54 VAL QG . . 3.360 2.721 2.344 3.210 . 0 0 "[ . 1 . 2]" 1
1023 1 50 HIS HA 1 50 HIS HD2 . . 4.410 3.339 2.192 4.409 . 0 0 "[ . 1 . 2]" 1
1024 1 51 ASN HA 1 51 ASN HD21 . . 4.280 3.947 3.506 4.279 . 0 0 "[ . 1 . 2]" 1
1025 1 51 ASN HA 1 51 ASN HD22 . . 4.460 4.290 4.087 4.450 . 0 0 "[ . 1 . 2]" 1
1026 1 51 ASN HA 1 52 ASP HA . . 4.730 4.674 4.620 4.702 . 0 0 "[ . 1 . 2]" 1
1027 1 51 ASN QB 1 51 ASN HD21 . . 2.920 2.123 2.087 2.248 . 0 0 "[ . 1 . 2]" 1
1028 1 51 ASN QB 1 51 ASN HD22 . . 3.340 3.221 3.214 3.236 . 0 0 "[ . 1 . 2]" 1
1029 1 51 ASN QB 1 52 ASP H . . 3.270 2.380 2.179 2.535 . 0 0 "[ . 1 . 2]" 1
1030 1 51 ASN HB2 1 51 ASN HD21 . . 3.440 2.705 2.115 3.214 . 0 0 "[ . 1 . 2]" 1
1031 1 51 ASN HB2 1 51 ASN HD22 . . 3.950 3.690 3.434 3.921 . 0 0 "[ . 1 . 2]" 1
1032 1 51 ASN HB2 1 52 ASP H . . 4.030 2.765 2.326 3.608 . 0 0 "[ . 1 . 2]" 1
1033 1 51 ASN HB3 1 51 ASN HD21 . . 3.440 2.538 2.116 3.270 . 0 0 "[ . 1 . 2]" 1
1034 1 51 ASN HB3 1 51 ASN HD22 . . 3.950 3.620 3.435 3.951 0.001 10 0 "[ . 1 . 2]" 1
1035 1 51 ASN HB3 1 52 ASP H . . 4.030 2.952 2.199 3.401 . 0 0 "[ . 1 . 2]" 1
1036 1 52 ASP H 1 52 ASP QB . . 3.460 3.250 2.815 3.346 . 0 0 "[ . 1 . 2]" 1
1037 1 52 ASP H 1 53 PHE H . . 4.420 4.342 4.326 4.358 . 0 0 "[ . 1 . 2]" 1
1038 1 52 ASP H 1 54 VAL QG . . 4.320 4.015 3.895 4.120 . 0 0 "[ . 1 . 2]" 1
1039 1 52 ASP HA 1 53 PHE H . . 3.130 2.692 2.637 2.751 . 0 0 "[ . 1 . 2]" 1
1040 1 52 ASP HA 1 53 PHE QD . . 4.910 3.639 3.275 3.983 . 0 0 "[ . 1 . 2]" 1
1041 1 52 ASP HA 1 54 VAL QG . . 5.270 5.020 4.953 5.089 . 0 0 "[ . 1 . 2]" 1
1042 1 52 ASP QB 1 53 PHE H . . 3.070 1.944 1.921 2.029 . 0 0 "[ . 1 . 2]" 1
1043 1 52 ASP QB 1 54 VAL QG . . 4.430 4.120 3.535 4.305 . 0 0 "[ . 1 . 2]" 1
1044 1 52 ASP HB2 1 53 PHE H . . 3.570 2.074 1.931 3.386 . 0 0 "[ . 1 . 2]" 1
1045 1 52 ASP HB3 1 53 PHE H . . 3.570 3.349 1.950 3.541 . 0 0 "[ . 1 . 2]" 1
1046 1 53 PHE H 1 53 PHE HB2 . . 3.650 2.517 2.428 2.615 . 0 0 "[ . 1 . 2]" 1
1047 1 53 PHE H 1 53 PHE HB3 . . 3.730 3.633 3.615 3.647 . 0 0 "[ . 1 . 2]" 1
1048 1 53 PHE H 1 53 PHE QD . . 3.550 2.074 1.931 2.309 . 0 0 "[ . 1 . 2]" 1
1049 1 53 PHE H 1 54 VAL H . . 4.600 4.590 4.580 4.598 . 0 0 "[ . 1 . 2]" 1
1050 1 53 PHE H 1 54 VAL QG . . 5.010 4.076 4.022 4.135 . 0 0 "[ . 1 . 2]" 1
1051 1 53 PHE HA 1 53 PHE QD . . 3.490 3.069 2.913 3.156 . 0 0 "[ . 1 . 2]" 1
1052 1 53 PHE HA 1 54 VAL H . . 3.210 2.254 2.219 2.294 . 0 0 "[ . 1 . 2]" 1
1053 1 53 PHE HA 1 54 VAL QG . . 4.690 3.300 3.109 3.539 . 0 0 "[ . 1 . 2]" 1
1054 1 53 PHE HB2 1 54 VAL H . . 4.090 3.873 3.691 4.032 . 0 0 "[ . 1 . 2]" 1
1055 1 53 PHE HB3 1 54 VAL H . . 4.300 2.841 2.739 2.957 . 0 0 "[ . 1 . 2]" 1
1056 1 53 PHE QD 1 54 VAL H . . 4.170 4.092 3.917 4.205 0.035 20 0 "[ . 1 . 2]" 1
1057 1 54 VAL H 1 54 VAL HB . . 3.930 3.511 2.880 3.934 0.004 15 0 "[ . 1 . 2]" 1
1058 1 54 VAL H 1 54 VAL QG . . 3.300 2.564 2.177 2.990 . 0 0 "[ . 1 . 2]" 1
1059 1 54 VAL HA 1 54 VAL QG . . 3.100 2.154 2.056 2.264 . 0 0 "[ . 1 . 2]" 1
1060 1 54 VAL HB 1 56 ILE HG12 . . 4.810 4.146 3.755 4.522 . 0 0 "[ . 1 . 2]" 1
1061 1 55 ALA HA 1 56 ILE MD . . 4.650 4.348 4.237 4.466 . 0 0 "[ . 1 . 2]" 1
1062 1 55 ALA MB 1 56 ILE H . . 3.520 2.853 2.792 2.939 . 0 0 "[ . 1 . 2]" 1
1063 1 55 ALA MB 1 56 ILE HG12 . . 5.250 4.439 4.397 4.487 . 0 0 "[ . 1 . 2]" 1
1064 1 55 ALA MB 1 57 LEU MD1 . . 4.290 3.945 3.805 4.137 . 0 0 "[ . 1 . 2]" 1
1065 1 55 ALA MB 1 57 LEU MD2 . . 3.810 2.277 2.121 2.517 . 0 0 "[ . 1 . 2]" 1
1066 1 55 ALA MB 1 68 PHE QE . . 4.720 3.436 3.334 3.611 . 0 0 "[ . 1 . 2]" 1
1067 1 56 ILE H 1 56 ILE HB . . 3.710 2.822 2.803 2.845 . 0 0 "[ . 1 . 2]" 1
1068 1 56 ILE H 1 56 ILE MD . . 3.950 3.839 3.813 3.878 . 0 0 "[ . 1 . 2]" 1
1069 1 56 ILE H 1 56 ILE HG12 . . 4.050 2.998 2.938 3.057 . 0 0 "[ . 1 . 2]" 1
1070 1 56 ILE H 1 56 ILE MG . . 4.150 3.921 3.908 3.934 . 0 0 "[ . 1 . 2]" 1
1071 1 56 ILE H 1 57 LEU H . . 4.350 4.154 4.077 4.208 . 0 0 "[ . 1 . 2]" 1
1072 1 56 ILE H 1 57 LEU MD2 . . 4.680 2.608 2.521 2.695 . 0 0 "[ . 1 . 2]" 1
1073 1 56 ILE HA 1 56 ILE MD . . 3.800 2.006 1.965 2.064 . 0 0 "[ . 1 . 2]" 1
1074 1 56 ILE HA 1 56 ILE HG12 . . 4.060 3.057 3.017 3.080 . 0 0 "[ . 1 . 2]" 1
1075 1 56 ILE HA 1 56 ILE MG . . 3.250 2.302 2.247 2.375 . 0 0 "[ . 1 . 2]" 1
1076 1 56 ILE HA 1 57 LEU H . . 3.020 2.141 2.139 2.146 . 0 0 "[ . 1 . 2]" 1
1077 1 56 ILE MD 1 56 ILE MG . . 2.780 2.054 1.918 2.136 . 0 0 "[ . 1 . 2]" 1
1078 1 56 ILE MD 1 57 LEU H . . 3.900 3.591 3.491 3.679 . 0 0 "[ . 1 . 2]" 1
1079 1 56 ILE HG12 1 57 LEU H . . 5.200 5.099 5.068 5.121 . 0 0 "[ . 1 . 2]" 1
1080 1 56 ILE MG 1 57 LEU H . . 3.320 2.685 2.421 2.899 . 0 0 "[ . 1 . 2]" 1
1081 1 56 ILE MG 1 57 LEU HA . . 4.610 3.470 3.356 3.565 . 0 0 "[ . 1 . 2]" 1
1082 1 56 ILE MG 1 58 ASP H . . 4.860 4.462 4.358 4.577 . 0 0 "[ . 1 . 2]" 1
1083 1 56 ILE MG 1 58 ASP HA . . 5.100 4.931 4.797 5.043 . 0 0 "[ . 1 . 2]" 1
1084 1 57 LEU H 1 57 LEU HB3 . . 3.960 3.690 3.653 3.717 . 0 0 "[ . 1 . 2]" 1
1085 1 57 LEU H 1 57 LEU MD1 . . 4.210 4.038 4.003 4.069 . 0 0 "[ . 1 . 2]" 1
1086 1 57 LEU H 1 57 LEU MD2 . . 3.880 2.676 2.610 2.738 . 0 0 "[ . 1 . 2]" 1
1087 1 57 LEU H 1 58 ASP H . . 4.320 4.214 4.186 4.246 . 0 0 "[ . 1 . 2]" 1
1088 1 57 LEU H 1 59 LEU MD1 . . 4.580 4.428 4.286 4.576 . 0 0 "[ . 1 . 2]" 1
1089 1 57 LEU H 1 59 LEU MD2 . . 5.180 4.957 4.834 5.085 . 0 0 "[ . 1 . 2]" 1
1090 1 57 LEU HA 1 57 LEU MD1 . . 4.150 4.117 4.106 4.123 . 0 0 "[ . 1 . 2]" 1
1091 1 57 LEU HA 1 57 LEU MD2 . . 3.390 3.362 3.315 3.400 0.010 16 0 "[ . 1 . 2]" 1
1092 1 57 LEU HA 1 57 LEU HG . . 3.720 3.680 3.668 3.689 . 0 0 "[ . 1 . 2]" 1
1093 1 57 LEU HA 1 58 ASP H . . 2.840 2.177 2.160 2.191 . 0 0 "[ . 1 . 2]" 1
1094 1 57 LEU HA 1 59 LEU MD2 . . 5.010 4.688 4.555 4.821 . 0 0 "[ . 1 . 2]" 1
1095 1 57 LEU HB2 1 57 LEU MD1 . . 3.310 2.077 2.000 2.136 . 0 0 "[ . 1 . 2]" 1
1096 1 57 LEU HB2 1 58 ASP H . . 3.520 3.200 3.130 3.278 . 0 0 "[ . 1 . 2]" 1
1097 1 57 LEU HB2 1 58 ASP HA . . 5.260 4.748 4.709 4.788 . 0 0 "[ . 1 . 2]" 1
1098 1 57 LEU HB2 1 59 LEU MD1 . . 4.840 3.985 3.903 4.110 . 0 0 "[ . 1 . 2]" 1
1099 1 57 LEU HB2 1 59 LEU MD2 . . 3.660 2.530 2.326 2.809 . 0 0 "[ . 1 . 2]" 1
1100 1 57 LEU HB2 1 59 LEU HG . . 4.010 3.280 3.184 3.429 . 0 0 "[ . 1 . 2]" 1
1101 1 57 LEU HB3 1 58 ASP H . . 3.860 3.803 3.719 3.872 0.012 15 0 "[ . 1 . 2]" 1
1102 1 57 LEU HB3 1 59 LEU MD1 . . 5.310 5.044 4.901 5.145 . 0 0 "[ . 1 . 2]" 1
1103 1 57 LEU HB3 1 59 LEU MD2 . . 4.970 3.989 3.821 4.182 . 0 0 "[ . 1 . 2]" 1
1104 1 57 LEU MD1 1 58 ASP H . . 4.960 4.813 4.739 4.885 . 0 0 "[ . 1 . 2]" 1
1105 1 57 LEU MD1 1 59 LEU MD2 . . 3.570 1.864 1.823 1.905 . 0 0 "[ . 1 . 2]" 1
1106 1 57 LEU MD1 1 59 LEU HG . . 4.580 2.980 2.893 3.045 . 0 0 "[ . 1 . 2]" 1
1107 1 57 LEU MD1 1 66 TYR QD . . 5.500 5.524 5.510 5.543 0.043 8 0 "[ . 1 . 2]" 1
1108 1 57 LEU MD2 1 59 LEU MD1 . . 4.430 3.987 3.754 4.138 . 0 0 "[ . 1 . 2]" 1
1109 1 57 LEU MD2 1 59 LEU MD2 . . 4.290 4.087 3.962 4.191 . 0 0 "[ . 1 . 2]" 1
1110 1 57 LEU MD2 1 59 LEU HG . . 4.960 4.745 4.616 4.859 . 0 0 "[ . 1 . 2]" 1
1111 1 57 LEU HG 1 59 LEU MD2 . . 3.970 3.417 3.262 3.503 . 0 0 "[ . 1 . 2]" 1
1112 1 58 ASP H 1 58 ASP QB . . 2.890 2.594 2.206 2.778 . 0 0 "[ . 1 . 2]" 1
1113 1 58 ASP H 1 59 LEU H . . 4.600 4.336 4.270 4.411 . 0 0 "[ . 1 . 2]" 1
1114 1 58 ASP H 1 59 LEU MD2 . . 4.580 4.371 4.256 4.464 . 0 0 "[ . 1 . 2]" 1
1115 1 58 ASP HA 1 59 LEU H . . 3.080 2.163 2.145 2.185 . 0 0 "[ . 1 . 2]" 1
1116 1 58 ASP QB 1 59 LEU H . . 3.850 3.553 3.454 3.675 . 0 0 "[ . 1 . 2]" 1
1117 1 59 LEU H 1 59 LEU HB3 . . 3.920 3.752 3.730 3.781 . 0 0 "[ . 1 . 2]" 1
1118 1 59 LEU H 1 59 LEU MD1 . . 4.240 3.663 3.563 3.871 . 0 0 "[ . 1 . 2]" 1
1119 1 59 LEU H 1 59 LEU MD2 . . 3.710 3.695 3.640 3.724 0.014 5 0 "[ . 1 . 2]" 1
1120 1 59 LEU H 1 59 LEU HG . . 3.360 2.525 2.424 2.727 . 0 0 "[ . 1 . 2]" 1
1121 1 59 LEU H 1 60 PRO HD2 . . 4.880 4.816 4.814 4.825 . 0 0 "[ . 1 . 2]" 1
1122 1 59 LEU HA 1 59 LEU MD1 . . 4.320 3.972 3.936 3.983 . 0 0 "[ . 1 . 2]" 1
1123 1 59 LEU HA 1 59 LEU MD2 . . 3.470 2.454 2.347 2.533 . 0 0 "[ . 1 . 2]" 1
1124 1 59 LEU HA 1 60 PRO HG2 . . 4.680 4.492 4.463 4.499 . 0 0 "[ . 1 . 2]" 1
1125 1 59 LEU HA 1 60 PRO HG3 . . 4.680 4.457 4.437 4.462 . 0 0 "[ . 1 . 2]" 1
1126 1 59 LEU HA 1 64 HIS HE1 . . 4.980 5.002 4.988 5.029 0.049 18 0 "[ . 1 . 2]" 1
1127 1 59 LEU HB2 1 60 PRO HD2 . . 4.760 3.437 3.404 3.503 . 0 0 "[ . 1 . 2]" 1
1128 1 59 LEU HB2 1 94 ILE MG . . 5.320 5.159 4.932 5.284 . 0 0 "[ . 1 . 2]" 1
1129 1 59 LEU HB2 1 96 VAL MG2 . . 5.070 2.401 2.230 2.671 . 0 0 "[ . 1 . 2]" 1
1130 1 59 LEU HB3 1 60 PRO HD2 . . 4.970 1.995 1.978 2.071 . 0 0 "[ . 1 . 2]" 1
1131 1 59 LEU HB3 1 64 HIS HD2 . . 4.480 4.381 4.240 4.455 . 0 0 "[ . 1 . 2]" 1
1132 1 59 LEU HB3 1 96 VAL MG2 . . 3.760 3.463 3.267 3.720 . 0 0 "[ . 1 . 2]" 1
1133 1 59 LEU MD1 1 64 HIS HD2 . . 3.400 3.019 2.786 3.205 . 0 0 "[ . 1 . 2]" 1
1134 1 59 LEU MD1 1 64 HIS HE1 . . 5.100 4.639 4.503 4.800 . 0 0 "[ . 1 . 2]" 1
1135 1 59 LEU MD1 1 66 TYR QD . . 5.400 5.102 4.975 5.265 . 0 0 "[ . 1 . 2]" 1
1136 1 59 LEU MD1 1 94 ILE MD . . 3.630 3.037 2.810 3.247 . 0 0 "[ . 1 . 2]" 1
1137 1 59 LEU MD1 1 94 ILE MG . . 3.530 3.015 2.806 3.127 . 0 0 "[ . 1 . 2]" 1
1138 1 59 LEU MD1 1 96 VAL H . . 5.500 5.266 5.024 5.432 . 0 0 "[ . 1 . 2]" 1
1139 1 59 LEU MD1 1 96 VAL MG2 . . 3.350 2.539 2.435 2.814 . 0 0 "[ . 1 . 2]" 1
1140 1 59 LEU MD2 1 60 PRO HD2 . . 3.920 2.868 2.798 2.927 . 0 0 "[ . 1 . 2]" 1
1141 1 59 LEU MD2 1 60 PRO HD3 . . 3.850 3.619 3.517 3.738 . 0 0 "[ . 1 . 2]" 1
1142 1 59 LEU MD2 1 60 PRO HG2 . . 5.100 4.824 4.763 4.895 . 0 0 "[ . 1 . 2]" 1
1143 1 59 LEU MD2 1 60 PRO QG . . 4.410 4.372 4.309 4.422 0.012 14 0 "[ . 1 . 2]" 1
1144 1 59 LEU MD2 1 60 PRO HG3 . . 5.100 5.002 4.914 5.075 . 0 0 "[ . 1 . 2]" 1
1145 1 59 LEU MD2 1 64 HIS HD2 . . 4.890 4.881 4.770 4.907 0.017 18 0 "[ . 1 . 2]" 1
1146 1 59 LEU MD2 1 64 HIS HE1 . . 4.910 4.791 4.726 4.887 . 0 0 "[ . 1 . 2]" 1
1147 1 59 LEU MD2 1 94 ILE MG . . 4.680 4.613 4.471 4.692 0.012 13 0 "[ . 1 . 2]" 1
1148 1 59 LEU MD2 1 96 VAL MG2 . . 4.570 4.396 4.272 4.533 . 0 0 "[ . 1 . 2]" 1
1149 1 59 LEU HG 1 60 PRO HD2 . . 5.140 4.631 4.606 4.669 . 0 0 "[ . 1 . 2]" 1
1150 1 60 PRO HA 1 61 GLU H . . 2.980 2.243 2.206 2.275 . 0 0 "[ . 1 . 2]" 1
1151 1 60 PRO HB2 1 61 GLU H . . 3.200 3.076 2.965 3.212 0.012 18 0 "[ . 1 . 2]" 1
1152 1 60 PRO HB2 1 64 HIS HE1 . . 4.320 3.616 3.570 3.657 . 0 0 "[ . 1 . 2]" 1
1153 1 60 PRO HB3 1 61 GLU H . . 4.260 3.711 3.645 3.793 . 0 0 "[ . 1 . 2]" 1
1154 1 60 PRO HB3 1 64 HIS HE1 . . 4.780 4.672 4.648 4.699 . 0 0 "[ . 1 . 2]" 1
1155 1 60 PRO HD2 1 64 HIS HE1 . . 3.730 2.921 2.896 2.965 . 0 0 "[ . 1 . 2]" 1
1156 1 60 PRO HD2 1 96 VAL MG2 . . 5.500 4.806 4.660 5.001 . 0 0 "[ . 1 . 2]" 1
1157 1 60 PRO HD3 1 64 HIS HE1 . . 4.560 4.331 4.318 4.361 . 0 0 "[ . 1 . 2]" 1
1158 1 60 PRO QG 1 64 HIS HE1 . . 3.250 1.975 1.955 1.985 . 0 0 "[ . 1 . 2]" 1
1159 1 60 PRO HG2 1 64 HIS HE1 . . 3.810 1.982 1.962 1.992 . 0 0 "[ . 1 . 2]" 1
1160 1 60 PRO HG3 1 64 HIS HE1 . . 3.810 3.723 3.706 3.737 . 0 0 "[ . 1 . 2]" 1
1161 1 61 GLU H 1 61 GLU QB . . 2.700 2.223 2.051 2.242 . 0 0 "[ . 1 . 2]" 1
1162 1 61 GLU H 1 62 GLY H . . 4.610 4.449 4.329 4.536 . 0 0 "[ . 1 . 2]" 1
1163 1 61 GLU H 1 96 VAL MG1 . . 4.160 4.064 3.890 4.169 0.009 20 0 "[ . 1 . 2]" 1
1164 1 61 GLU HA 1 61 GLU HG2 . . 4.010 2.586 2.503 3.375 . 0 0 "[ . 1 . 2]" 1
1165 1 61 GLU HA 1 61 GLU HG3 . . 4.010 3.482 2.050 3.643 . 0 0 "[ . 1 . 2]" 1
1166 1 61 GLU HA 1 62 GLY H . . 3.070 2.150 2.142 2.175 . 0 0 "[ . 1 . 2]" 1
1167 1 61 GLU HA 1 96 VAL H . . 4.750 4.687 4.342 4.764 0.014 10 0 "[ . 1 . 2]" 1
1168 1 61 GLU HA 1 96 VAL HA . . 4.960 4.816 4.697 4.925 . 0 0 "[ . 1 . 2]" 1
1169 1 61 GLU HA 1 96 VAL HB . . 3.620 2.826 2.469 2.956 . 0 0 "[ . 1 . 2]" 1
1170 1 61 GLU HA 1 96 VAL MG1 . . 3.270 2.249 2.035 2.367 . 0 0 "[ . 1 . 2]" 1
1171 1 61 GLU HA 1 96 VAL MG2 . . 4.360 4.277 3.826 4.383 0.023 16 0 "[ . 1 . 2]" 1
1172 1 61 GLU HA 1 97 LYS H . . 4.410 4.375 4.245 4.424 0.014 7 0 "[ . 1 . 2]" 1
1173 1 61 GLU HA 1 98 LYS H . . 5.360 5.183 4.680 5.449 0.089 18 0 "[ . 1 . 2]" 1
1174 1 61 GLU HA 1 98 LYS HA . . 5.500 5.044 4.263 5.508 0.008 14 0 "[ . 1 . 2]" 1
1175 1 61 GLU QB 1 62 GLY H . . 4.050 3.848 3.518 3.954 . 0 0 "[ . 1 . 2]" 1
1176 1 61 GLU QB 1 62 GLY HA2 . . 5.050 4.774 4.106 4.842 . 0 0 "[ . 1 . 2]" 1
1177 1 61 GLU QB 1 96 VAL MG1 . . 3.860 3.454 3.188 3.650 . 0 0 "[ . 1 . 2]" 1
1178 1 61 GLU QB 1 97 LYS H . . 5.190 5.133 4.992 5.405 0.215 18 0 "[ . 1 . 2]" 1
1179 1 61 GLU QB 1 97 LYS HA . . 4.230 3.799 3.551 4.158 . 0 0 "[ . 1 . 2]" 1
1180 1 61 GLU QB 1 98 LYS H . . 4.240 4.013 3.396 4.258 0.018 10 0 "[ . 1 . 2]" 1
1181 1 61 GLU QB 1 98 LYS HA . . 4.150 3.423 2.333 4.246 0.096 18 0 "[ . 1 . 2]" 1
1182 1 61 GLU QB 1 98 LYS HB2 . . 4.500 4.042 3.629 4.568 0.068 18 0 "[ . 1 . 2]" 1
1183 1 61 GLU QB 1 98 LYS QB . . 3.850 2.962 2.014 3.766 . 0 0 "[ . 1 . 2]" 1
1184 1 61 GLU QB 1 98 LYS HB3 . . 4.500 3.179 2.024 4.562 0.062 11 0 "[ . 1 . 2]" 1
1185 1 61 GLU QB 1 98 LYS QE . . 5.460 3.831 1.987 5.331 . 0 0 "[ . 1 . 2]" 1
1186 1 61 GLU QG 1 62 GLY H . . 3.750 2.964 2.653 3.332 . 0 0 "[ . 1 . 2]" 1
1187 1 61 GLU QG 1 62 GLY HA2 . . 4.780 3.742 3.500 4.845 0.065 18 0 "[ . 1 . 2]" 1
1188 1 61 GLU QG 1 96 VAL MG1 . . 4.080 3.527 1.968 3.862 . 0 0 "[ . 1 . 2]" 1
1189 1 61 GLU QG 1 97 LYS H . . 4.740 4.241 3.350 4.520 . 0 0 "[ . 1 . 2]" 1
1190 1 61 GLU QG 1 97 LYS HA . . 3.550 2.117 1.918 2.594 . 0 0 "[ . 1 . 2]" 1
1191 1 61 GLU QG 1 97 LYS HB2 . . 4.860 4.483 3.867 4.865 0.005 15 0 "[ . 1 . 2]" 1
1192 1 61 GLU QG 1 97 LYS HB3 . . 4.540 3.825 3.552 4.248 . 0 0 "[ . 1 . 2]" 1
1193 1 61 GLU QG 1 98 LYS HA . . 4.230 3.469 2.630 3.990 . 0 0 "[ . 1 . 2]" 1
1194 1 61 GLU QG 1 98 LYS QB . . 3.820 2.319 1.976 2.963 . 0 0 "[ . 1 . 2]" 1
1195 1 61 GLU QG 1 98 LYS QD . . 5.340 3.419 1.957 4.385 . 0 0 "[ . 1 . 2]" 1
1196 1 61 GLU QG 1 98 LYS QG . . 4.430 2.990 1.977 3.914 . 0 0 "[ . 1 . 2]" 1
1197 1 61 GLU HG2 1 62 GLY HA2 . . 5.500 3.849 3.555 5.581 0.081 18 0 "[ . 1 . 2]" 1
1198 1 61 GLU HG2 1 97 LYS HA . . 4.060 2.194 1.981 2.948 . 0 0 "[ . 1 . 2]" 1
1199 1 61 GLU HG2 1 98 LYS H . . 3.860 3.503 2.607 3.853 . 0 0 "[ . 1 . 2]" 1
1200 1 61 GLU HG2 1 98 LYS HA . . 4.920 4.602 2.747 4.951 0.031 14 0 "[ . 1 . 2]" 1
1201 1 61 GLU HG2 1 98 LYS QG . . 5.300 4.347 3.459 5.249 . 0 0 "[ . 1 . 2]" 1
1202 1 61 GLU HG3 1 62 GLY HA2 . . 5.500 5.304 5.185 5.386 . 0 0 "[ . 1 . 2]" 1
1203 1 61 GLU HG3 1 97 LYS HA . . 4.060 2.871 2.562 3.188 . 0 0 "[ . 1 . 2]" 1
1204 1 61 GLU HG3 1 98 LYS H . . 3.860 2.754 1.962 3.611 . 0 0 "[ . 1 . 2]" 1
1205 1 61 GLU HG3 1 98 LYS HA . . 4.920 3.621 2.682 4.213 . 0 0 "[ . 1 . 2]" 1
1206 1 61 GLU HG3 1 98 LYS QG . . 5.300 3.112 1.989 5.317 0.017 18 0 "[ . 1 . 2]" 1
1207 1 62 GLY H 1 63 GLU H . . 4.470 4.221 4.064 4.372 . 0 0 "[ . 1 . 2]" 1
1208 1 62 GLY H 1 63 GLU QB . . 5.370 5.289 5.157 5.434 0.064 1 0 "[ . 1 . 2]" 1
1209 1 62 GLY H 1 64 HIS HD2 . . 5.500 5.469 5.228 5.529 0.029 18 0 "[ . 1 . 2]" 1
1210 1 62 GLY H 1 95 HIS HA . . 4.910 4.835 4.537 4.941 0.031 18 0 "[ . 1 . 2]" 1
1211 1 62 GLY H 1 96 VAL H . . 3.490 3.113 2.825 3.219 . 0 0 "[ . 1 . 2]" 1
1212 1 62 GLY H 1 96 VAL HA . . 4.640 4.404 4.231 4.509 . 0 0 "[ . 1 . 2]" 1
1213 1 62 GLY H 1 96 VAL HB . . 3.320 2.374 1.940 2.572 . 0 0 "[ . 1 . 2]" 1
1214 1 62 GLY H 1 96 VAL MG1 . . 3.370 3.234 2.998 3.383 0.013 2 0 "[ . 1 . 2]" 1
1215 1 62 GLY H 1 96 VAL MG2 . . 4.240 3.976 3.640 4.113 . 0 0 "[ . 1 . 2]" 1
1216 1 62 GLY H 1 97 LYS H . . 4.810 4.686 4.512 4.823 0.013 16 0 "[ . 1 . 2]" 1
1217 1 62 GLY H 1 97 LYS HA . . 4.560 3.881 3.574 4.134 . 0 0 "[ . 1 . 2]" 1
1218 1 62 GLY H 1 97 LYS QG . . 5.500 5.077 4.637 5.538 0.038 5 0 "[ . 1 . 2]" 1
1219 1 62 GLY HA2 1 63 GLU H . . 3.280 3.043 2.779 3.192 . 0 0 "[ . 1 . 2]" 1
1220 1 62 GLY HA2 1 63 GLU QB . . 5.040 4.096 4.009 4.119 . 0 0 "[ . 1 . 2]" 1
1221 1 62 GLY HA2 1 96 VAL H . . 4.860 4.640 4.487 4.775 . 0 0 "[ . 1 . 2]" 1
1222 1 62 GLY HA3 1 63 GLU H . . 2.780 2.203 2.142 2.369 . 0 0 "[ . 1 . 2]" 1
1223 1 62 GLY HA3 1 63 GLU QB . . 4.790 4.240 4.136 4.410 . 0 0 "[ . 1 . 2]" 1
1224 1 62 GLY HA3 1 96 VAL H . . 5.020 4.831 4.698 4.902 . 0 0 "[ . 1 . 2]" 1
1225 1 63 GLU H 1 63 GLU QB . . 2.780 2.576 2.414 2.739 . 0 0 "[ . 1 . 2]" 1
1226 1 63 GLU H 1 64 HIS H . . 4.630 4.401 4.333 4.439 . 0 0 "[ . 1 . 2]" 1
1227 1 63 GLU H 1 95 HIS HA . . 4.880 4.835 4.670 4.915 0.035 1 0 "[ . 1 . 2]" 1
1228 1 63 GLU H 1 96 VAL H . . 5.020 4.738 4.493 4.874 . 0 0 "[ . 1 . 2]" 1
1229 1 63 GLU HA 1 63 GLU HG2 . . 3.880 2.974 2.436 3.253 . 0 0 "[ . 1 . 2]" 1
1230 1 63 GLU HA 1 63 GLU HG3 . . 3.880 2.864 2.609 3.628 . 0 0 "[ . 1 . 2]" 1
1231 1 63 GLU HA 1 64 HIS H . . 3.290 2.257 2.221 2.284 . 0 0 "[ . 1 . 2]" 1
1232 1 63 GLU HA 1 64 HIS HD2 . . 4.330 3.716 3.578 3.908 . 0 0 "[ . 1 . 2]" 1
1233 1 63 GLU HA 1 93 LEU QD . . 4.270 4.130 3.902 4.283 0.013 14 0 "[ . 1 . 2]" 1
1234 1 63 GLU HA 1 94 ILE MG . . 4.450 3.813 3.709 3.947 . 0 0 "[ . 1 . 2]" 1
1235 1 63 GLU HA 1 95 HIS HA . . 3.310 2.186 2.045 2.315 . 0 0 "[ . 1 . 2]" 1
1236 1 63 GLU HA 1 95 HIS QB . . 3.920 3.865 3.588 3.933 0.013 16 0 "[ . 1 . 2]" 1
1237 1 63 GLU HA 1 96 VAL H . . 4.050 3.003 2.744 3.266 . 0 0 "[ . 1 . 2]" 1
1238 1 63 GLU QB 1 64 HIS H . . 4.210 3.733 3.675 3.847 . 0 0 "[ . 1 . 2]" 1
1239 1 63 GLU QB 1 93 LEU QD . . 3.970 3.717 3.546 3.974 0.004 18 0 "[ . 1 . 2]" 1
1240 1 63 GLU QB 1 95 HIS HA . . 4.210 3.371 3.196 3.546 . 0 0 "[ . 1 . 2]" 1
1241 1 63 GLU QB 1 95 HIS HB2 . . 5.500 4.883 4.042 5.264 . 0 0 "[ . 1 . 2]" 1
1242 1 63 GLU QB 1 95 HIS QB . . 4.630 3.664 3.080 4.084 . 0 0 "[ . 1 . 2]" 1
1243 1 63 GLU QB 1 95 HIS HB3 . . 5.500 3.938 3.145 5.125 . 0 0 "[ . 1 . 2]" 1
1244 1 63 GLU QB 1 95 HIS HD2 . . 4.850 2.825 2.030 4.858 0.008 14 0 "[ . 1 . 2]" 1
1245 1 63 GLU QB 1 96 VAL H . . 4.760 4.514 4.339 4.768 0.008 7 0 "[ . 1 . 2]" 1
1246 1 63 GLU QG 1 64 HIS H . . 4.250 2.593 2.375 2.895 . 0 0 "[ . 1 . 2]" 1
1247 1 63 GLU QG 1 93 LEU QD . . 2.770 2.083 1.905 2.285 . 0 0 "[ . 1 . 2]" 1
1248 1 63 GLU QG 1 93 LEU HG . . 4.590 3.716 3.338 4.491 . 0 0 "[ . 1 . 2]" 1
1249 1 63 GLU QG 1 95 HIS HA . . 3.970 3.235 2.556 3.623 . 0 0 "[ . 1 . 2]" 1
1250 1 63 GLU QG 1 95 HIS QB . . 4.310 3.747 2.478 4.123 . 0 0 "[ . 1 . 2]" 1
1251 1 63 GLU QG 1 95 HIS HD2 . . 4.700 2.427 2.002 3.773 . 0 0 "[ . 1 . 2]" 1
1252 1 63 GLU HG2 1 93 LEU HG . . 5.250 4.563 3.930 5.113 . 0 0 "[ . 1 . 2]" 1
1253 1 63 GLU HG2 1 95 HIS HA . . 4.680 4.306 3.223 4.697 0.017 15 0 "[ . 1 . 2]" 1
1254 1 63 GLU HG2 1 95 HIS HD2 . . 5.500 3.853 2.681 5.495 . 0 0 "[ . 1 . 2]" 1
1255 1 63 GLU HG3 1 93 LEU HG . . 5.250 4.033 3.447 5.085 . 0 0 "[ . 1 . 2]" 1
1256 1 63 GLU HG3 1 95 HIS HA . . 4.680 3.501 2.613 4.672 . 0 0 "[ . 1 . 2]" 1
1257 1 63 GLU HG3 1 95 HIS HD2 . . 5.500 2.488 2.013 4.168 . 0 0 "[ . 1 . 2]" 1
1258 1 64 HIS H 1 64 HIS HB2 . . 3.610 3.294 3.169 3.412 . 0 0 "[ . 1 . 2]" 1
1259 1 64 HIS H 1 64 HIS HD2 . . 3.780 2.774 2.561 2.977 . 0 0 "[ . 1 . 2]" 1
1260 1 64 HIS H 1 65 GLN H . . 4.410 4.342 4.321 4.383 . 0 0 "[ . 1 . 2]" 1
1261 1 64 HIS H 1 66 TYR QD . . 5.500 5.507 5.471 5.542 0.042 17 0 "[ . 1 . 2]" 1
1262 1 64 HIS H 1 93 LEU HA . . 5.270 5.052 4.900 5.194 . 0 0 "[ . 1 . 2]" 1
1263 1 64 HIS H 1 93 LEU QD . . 3.410 3.282 3.114 3.418 0.008 1 0 "[ . 1 . 2]" 1
1264 1 64 HIS H 1 94 ILE H . . 3.750 3.255 3.174 3.383 . 0 0 "[ . 1 . 2]" 1
1265 1 64 HIS H 1 94 ILE MG . . 3.380 2.227 2.115 2.335 . 0 0 "[ . 1 . 2]" 1
1266 1 64 HIS H 1 95 HIS HA . . 3.710 3.412 3.294 3.548 . 0 0 "[ . 1 . 2]" 1
1267 1 64 HIS H 1 96 VAL H . . 4.380 4.268 4.143 4.389 0.009 6 0 "[ . 1 . 2]" 1
1268 1 64 HIS HA 1 65 GLN H . . 3.420 2.433 2.397 2.444 . 0 0 "[ . 1 . 2]" 1
1269 1 64 HIS HA 1 93 LEU QD . . 4.770 4.141 3.985 4.324 . 0 0 "[ . 1 . 2]" 1
1270 1 64 HIS HA 1 94 ILE MG . . 4.810 3.933 3.808 4.071 . 0 0 "[ . 1 . 2]" 1
1271 1 64 HIS HB2 1 65 GLN H . . 4.000 2.856 2.761 2.906 . 0 0 "[ . 1 . 2]" 1
1272 1 64 HIS HB2 1 93 LEU QD . . 5.440 5.062 4.930 5.256 . 0 0 "[ . 1 . 2]" 1
1273 1 64 HIS HB2 1 94 ILE H . . 4.880 4.660 4.436 4.846 . 0 0 "[ . 1 . 2]" 1
1274 1 64 HIS HB2 1 94 ILE MG . . 4.050 2.560 2.308 2.787 . 0 0 "[ . 1 . 2]" 1
1275 1 64 HIS HB3 1 65 GLN H . . 4.290 2.796 2.713 2.895 . 0 0 "[ . 1 . 2]" 1
1276 1 64 HIS HB3 1 94 ILE MG . . 4.190 3.870 3.660 4.055 . 0 0 "[ . 1 . 2]" 1
1277 1 64 HIS HD2 1 65 GLN H . . 5.500 5.474 5.361 5.545 0.045 17 0 "[ . 1 . 2]" 1
1278 1 64 HIS HD2 1 94 ILE QG . . 3.870 2.700 2.481 2.938 . 0 0 "[ . 1 . 2]" 1
1279 1 64 HIS HD2 1 94 ILE MG . . 2.760 1.953 1.882 2.110 . 0 0 "[ . 1 . 2]" 1
1280 1 64 HIS HD2 1 95 HIS H . . 5.500 5.015 4.834 5.232 . 0 0 "[ . 1 . 2]" 1
1281 1 64 HIS HD2 1 96 VAL H . . 4.170 3.625 3.424 3.901 . 0 0 "[ . 1 . 2]" 1
1282 1 64 HIS HD2 1 96 VAL HB . . 4.630 4.188 3.956 4.444 . 0 0 "[ . 1 . 2]" 1
1283 1 64 HIS HD2 1 96 VAL MG2 . . 3.280 2.746 2.530 2.968 . 0 0 "[ . 1 . 2]" 1
1284 1 64 HIS HE1 1 96 VAL MG2 . . 4.320 4.178 4.047 4.293 . 0 0 "[ . 1 . 2]" 1
1285 1 65 GLN H 1 65 GLN HB2 . . 3.870 2.461 2.424 2.501 . 0 0 "[ . 1 . 2]" 1
1286 1 65 GLN H 1 65 GLN HB3 . . 3.770 3.571 3.487 3.598 . 0 0 "[ . 1 . 2]" 1
1287 1 65 GLN H 1 65 GLN HG2 . . 4.890 4.736 4.688 4.831 . 0 0 "[ . 1 . 2]" 1
1288 1 65 GLN H 1 66 TYR H . . 4.510 4.329 4.285 4.387 . 0 0 "[ . 1 . 2]" 1
1289 1 65 GLN HA 1 65 GLN HE21 . . 4.660 3.945 2.962 4.824 0.164 9 0 "[ . 1 . 2]" 1
1290 1 65 GLN HA 1 65 GLN HE22 . . 5.500 5.350 4.570 5.530 0.030 9 0 "[ . 1 . 2]" 1
1291 1 65 GLN HA 1 65 GLN HG2 . . 4.010 2.980 2.799 3.348 . 0 0 "[ . 1 . 2]" 1
1292 1 65 GLN HA 1 65 GLN HG3 . . 3.910 2.231 2.053 2.330 . 0 0 "[ . 1 . 2]" 1
1293 1 65 GLN HA 1 66 TYR H . . 3.250 2.150 2.145 2.170 . 0 0 "[ . 1 . 2]" 1
1294 1 65 GLN HA 1 66 TYR QD . . 4.140 3.295 3.077 3.436 . 0 0 "[ . 1 . 2]" 1
1295 1 65 GLN HA 1 92 ASN H . . 5.440 5.228 5.129 5.442 0.002 9 0 "[ . 1 . 2]" 1
1296 1 65 GLN HA 1 93 LEU H . . 4.910 4.810 4.738 4.909 . 0 0 "[ . 1 . 2]" 1
1297 1 65 GLN HA 1 93 LEU HA . . 3.730 2.430 2.325 2.570 . 0 0 "[ . 1 . 2]" 1
1298 1 65 GLN HA 1 93 LEU HB3 . . 5.500 5.406 5.213 5.515 0.015 18 0 "[ . 1 . 2]" 1
1299 1 65 GLN HA 1 93 LEU QD . . 3.590 3.106 2.816 3.278 . 0 0 "[ . 1 . 2]" 1
1300 1 65 GLN HA 1 94 ILE H . . 4.120 2.993 2.865 3.114 . 0 0 "[ . 1 . 2]" 1
1301 1 65 GLN HB2 1 66 TYR H . . 4.420 4.411 4.361 4.438 0.018 17 0 "[ . 1 . 2]" 1
1302 1 65 GLN HB2 1 91 ASN HB2 . . 5.020 4.800 4.548 5.033 0.013 18 0 "[ . 1 . 2]" 1
1303 1 65 GLN HB2 1 93 LEU QD . . 4.340 4.128 3.802 4.272 . 0 0 "[ . 1 . 2]" 1
1304 1 65 GLN HB2 1 94 ILE H . . 5.500 5.518 5.438 5.551 0.051 17 0 "[ . 1 . 2]" 1
1305 1 65 GLN HB3 1 65 GLN HE21 . . 4.270 4.089 3.561 4.369 0.099 9 0 "[ . 1 . 2]" 1
1306 1 65 GLN HB3 1 65 GLN HE22 . . 5.010 4.805 4.431 5.100 0.090 9 0 "[ . 1 . 2]" 1
1307 1 65 GLN HB3 1 66 TYR H . . 3.970 3.408 3.295 3.457 . 0 0 "[ . 1 . 2]" 1
1308 1 65 GLN HB3 1 91 ASN HB2 . . 4.790 3.075 2.841 3.301 . 0 0 "[ . 1 . 2]" 1
1309 1 65 GLN HB3 1 91 ASN HB3 . . 4.720 4.411 4.224 4.612 . 0 0 "[ . 1 . 2]" 1
1310 1 65 GLN HB3 1 91 ASN HD21 . . 4.580 2.232 2.002 2.636 . 0 0 "[ . 1 . 2]" 1
1311 1 65 GLN HB3 1 91 ASN HD22 . . 4.800 3.537 3.255 3.920 . 0 0 "[ . 1 . 2]" 1
1312 1 65 GLN HE21 1 93 LEU QD . . 3.460 2.746 2.029 3.325 . 0 0 "[ . 1 . 2]" 1
1313 1 65 GLN HE22 1 65 GLN HG3 . . 3.770 3.527 3.479 3.727 . 0 0 "[ . 1 . 2]" 1
1314 1 65 GLN HE22 1 93 LEU QD . . 3.890 3.525 2.659 3.891 0.001 1 0 "[ . 1 . 2]" 1
1315 1 65 GLN HG2 1 66 TYR H . . 4.430 4.190 4.027 4.445 0.015 18 0 "[ . 1 . 2]" 1
1316 1 65 GLN HG2 1 83 VAL MG1 . . 3.630 2.950 2.752 3.071 . 0 0 "[ . 1 . 2]" 1
1317 1 65 GLN HG2 1 92 ASN H . . 5.500 5.005 4.819 5.397 . 0 0 "[ . 1 . 2]" 1
1318 1 65 GLN HG2 1 93 LEU HA . . 4.810 3.257 3.052 3.777 . 0 0 "[ . 1 . 2]" 1
1319 1 65 GLN HG2 1 93 LEU QD . . 3.760 3.047 2.106 3.382 . 0 0 "[ . 1 . 2]" 1
1320 1 65 GLN HG2 1 94 ILE H . . 5.450 4.960 4.745 5.407 . 0 0 "[ . 1 . 2]" 1
1321 1 65 GLN HG3 1 93 LEU HA . . 4.650 2.519 2.181 2.777 . 0 0 "[ . 1 . 2]" 1
1322 1 65 GLN HG3 1 93 LEU HB2 . . 4.580 3.542 2.860 4.491 . 0 0 "[ . 1 . 2]" 1
1323 1 65 GLN HG3 1 93 LEU MD1 . . 4.420 2.226 1.935 3.667 . 0 0 "[ . 1 . 2]" 1
1324 1 65 GLN HG3 1 93 LEU QD . . 3.430 1.974 1.874 2.236 . 0 0 "[ . 1 . 2]" 1
1325 1 65 GLN HG3 1 93 LEU MD2 . . 4.420 3.755 1.969 4.247 . 0 0 "[ . 1 . 2]" 1
1326 1 65 GLN HG3 1 94 ILE H . . 4.650 3.633 3.545 3.764 . 0 0 "[ . 1 . 2]" 1
1327 1 66 TYR H 1 66 TYR HB3 . . 4.110 3.052 3.019 3.130 . 0 0 "[ . 1 . 2]" 1
1328 1 66 TYR H 1 66 TYR QD . . 3.560 2.242 2.147 2.380 . 0 0 "[ . 1 . 2]" 1
1329 1 66 TYR H 1 66 TYR QE . . 4.250 3.936 3.876 4.022 . 0 0 "[ . 1 . 2]" 1
1330 1 66 TYR H 1 91 ASN HB2 . . 4.390 4.168 4.027 4.281 . 0 0 "[ . 1 . 2]" 1
1331 1 66 TYR H 1 91 ASN HD21 . . 4.770 4.597 4.307 4.791 0.021 9 0 "[ . 1 . 2]" 1
1332 1 66 TYR H 1 92 ASN H . . 3.980 3.854 3.775 3.904 . 0 0 "[ . 1 . 2]" 1
1333 1 66 TYR H 1 92 ASN HB3 . . 4.580 4.112 4.040 4.268 . 0 0 "[ . 1 . 2]" 1
1334 1 66 TYR H 1 93 LEU H . . 4.560 4.505 4.400 4.571 0.011 4 0 "[ . 1 . 2]" 1
1335 1 66 TYR H 1 93 LEU HA . . 3.800 3.447 3.234 3.588 . 0 0 "[ . 1 . 2]" 1
1336 1 66 TYR H 1 94 ILE H . . 4.570 4.130 3.932 4.341 . 0 0 "[ . 1 . 2]" 1
1337 1 66 TYR H 1 94 ILE MG . . 4.410 3.393 3.255 3.525 . 0 0 "[ . 1 . 2]" 1
1338 1 66 TYR HA 1 66 TYR QD . . 3.930 3.731 3.714 3.739 . 0 0 "[ . 1 . 2]" 1
1339 1 66 TYR HA 1 67 LYS H . . 3.510 2.570 2.498 2.647 . 0 0 "[ . 1 . 2]" 1
1340 1 66 TYR HB2 1 67 LYS H . . 3.500 2.135 2.005 2.272 . 0 0 "[ . 1 . 2]" 1
1341 1 66 TYR HB3 1 94 ILE MD . . 5.210 4.836 4.679 5.066 . 0 0 "[ . 1 . 2]" 1
1342 1 66 TYR HB3 1 94 ILE MG . . 3.490 3.465 3.321 3.500 0.010 9 0 "[ . 1 . 2]" 1
1343 1 66 TYR QD 1 67 LYS H . . 3.620 2.872 2.724 2.963 . 0 0 "[ . 1 . 2]" 1
1344 1 66 TYR QD 1 67 LYS HA . . 4.660 3.546 3.475 3.666 . 0 0 "[ . 1 . 2]" 1
1345 1 66 TYR QD 1 68 PHE H . . 4.980 4.329 4.253 4.432 . 0 0 "[ . 1 . 2]" 1
1346 1 66 TYR QD 1 68 PHE QD . . 4.400 4.093 4.060 4.189 . 0 0 "[ . 1 . 2]" 1
1347 1 66 TYR QD 1 68 PHE QE . . 4.020 3.968 3.915 4.042 0.022 16 0 "[ . 1 . 2]" 1
1348 1 66 TYR QD 1 68 PHE HZ . . 4.670 4.632 4.496 4.676 0.006 9 0 "[ . 1 . 2]" 1
1349 1 66 TYR QD 1 92 ASN H . . 4.960 4.691 4.634 4.752 . 0 0 "[ . 1 . 2]" 1
1350 1 66 TYR QD 1 92 ASN HB2 . . 4.510 3.275 3.156 3.402 . 0 0 "[ . 1 . 2]" 1
1351 1 66 TYR QD 1 92 ASN HB3 . . 4.380 3.931 3.817 4.137 . 0 0 "[ . 1 . 2]" 1
1352 1 66 TYR QD 1 93 LEU H . . 4.880 4.596 4.410 4.738 . 0 0 "[ . 1 . 2]" 1
1353 1 66 TYR QD 1 93 LEU HA . . 4.150 3.941 3.576 4.105 . 0 0 "[ . 1 . 2]" 1
1354 1 66 TYR QD 1 94 ILE H . . 4.220 3.551 3.333 3.752 . 0 0 "[ . 1 . 2]" 1
1355 1 66 TYR QD 1 94 ILE HB . . 4.020 2.693 2.525 2.937 . 0 0 "[ . 1 . 2]" 1
1356 1 66 TYR QD 1 94 ILE MD . . 4.710 3.749 3.614 3.980 . 0 0 "[ . 1 . 2]" 1
1357 1 66 TYR QD 1 94 ILE MG . . 3.050 2.067 1.966 2.143 . 0 0 "[ . 1 . 2]" 1
1358 1 66 TYR QE 1 67 LYS H . . 5.130 5.050 4.922 5.135 0.005 8 0 "[ . 1 . 2]" 1
1359 1 66 TYR QE 1 68 PHE QD . . 4.060 3.835 3.702 3.988 . 0 0 "[ . 1 . 2]" 1
1360 1 66 TYR QE 1 68 PHE QE . . 3.220 2.962 2.675 3.082 . 0 0 "[ . 1 . 2]" 1
1361 1 66 TYR QE 1 68 PHE HZ . . 3.320 2.815 2.744 2.942 . 0 0 "[ . 1 . 2]" 1
1362 1 66 TYR QE 1 92 ASN H . . 5.270 5.134 5.061 5.204 . 0 0 "[ . 1 . 2]" 1
1363 1 66 TYR QE 1 92 ASN HB2 . . 3.980 3.269 3.177 3.351 . 0 0 "[ . 1 . 2]" 1
1364 1 66 TYR QE 1 92 ASN HB3 . . 3.960 3.000 2.877 3.191 . 0 0 "[ . 1 . 2]" 1
1365 1 66 TYR QE 1 93 LEU H . . 4.420 3.487 3.187 3.724 . 0 0 "[ . 1 . 2]" 1
1366 1 66 TYR QE 1 93 LEU HA . . 4.330 4.097 3.735 4.322 . 0 0 "[ . 1 . 2]" 1
1367 1 66 TYR QE 1 94 ILE H . . 3.990 3.752 3.467 3.940 . 0 0 "[ . 1 . 2]" 1
1368 1 66 TYR QE 1 94 ILE HA . . 4.200 3.324 3.230 3.511 . 0 0 "[ . 1 . 2]" 1
1369 1 66 TYR QE 1 94 ILE HB . . 3.210 1.995 1.991 2.013 . 0 0 "[ . 1 . 2]" 1
1370 1 66 TYR QE 1 94 ILE MD . . 3.800 3.336 3.203 3.531 . 0 0 "[ . 1 . 2]" 1
1371 1 66 TYR QE 1 94 ILE QG . . 5.340 4.105 4.048 4.152 . 0 0 "[ . 1 . 2]" 1
1372 1 66 TYR QE 1 95 HIS H . . 5.500 5.362 5.301 5.497 . 0 0 "[ . 1 . 2]" 1
1373 1 67 LYS H 1 67 LYS QB . . 3.660 2.757 2.716 2.799 . 0 0 "[ . 1 . 2]" 1
1374 1 67 LYS H 1 67 LYS HD2 . . 5.160 4.940 4.913 4.993 . 0 0 "[ . 1 . 2]" 1
1375 1 67 LYS H 1 92 ASN H . . 5.220 4.811 4.703 4.891 . 0 0 "[ . 1 . 2]" 1
1376 1 67 LYS HA 1 67 LYS HD2 . . 4.140 2.241 2.195 2.298 . 0 0 "[ . 1 . 2]" 1
1377 1 67 LYS HA 1 67 LYS HD3 . . 4.200 3.385 3.279 3.467 . 0 0 "[ . 1 . 2]" 1
1378 1 67 LYS HA 1 76 HIS HA . . 5.240 5.013 4.927 5.128 . 0 0 "[ . 1 . 2]" 1
1379 1 67 LYS HA 1 91 ASN HA . . 5.130 3.751 3.649 3.835 . 0 0 "[ . 1 . 2]" 1
1380 1 67 LYS HA 1 92 ASN H . . 4.660 2.900 2.744 2.991 . 0 0 "[ . 1 . 2]" 1
1381 1 67 LYS QB 1 67 LYS HD2 . . 3.730 2.744 2.692 2.802 . 0 0 "[ . 1 . 2]" 1
1382 1 67 LYS QB 1 67 LYS HE2 . . 4.650 4.104 4.088 4.135 . 0 0 "[ . 1 . 2]" 1
1383 1 67 LYS QB 1 67 LYS HE3 . . 4.500 4.439 4.426 4.450 . 0 0 "[ . 1 . 2]" 1
1384 1 67 LYS QB 1 74 TRP HA . . 5.500 5.380 5.243 5.507 0.007 13 0 "[ . 1 . 2]" 1
1385 1 67 LYS QB 1 74 TRP HE3 . . 3.960 2.840 2.737 3.040 . 0 0 "[ . 1 . 2]" 1
1386 1 67 LYS QB 1 74 TRP HZ3 . . 4.230 2.762 2.636 2.920 . 0 0 "[ . 1 . 2]" 1
1387 1 67 LYS HD2 1 68 PHE H . . 3.650 2.755 2.633 2.879 . 0 0 "[ . 1 . 2]" 1
1388 1 67 LYS HD2 1 74 TRP HE3 . . 4.470 4.449 4.411 4.478 0.008 3 0 "[ . 1 . 2]" 1
1389 1 67 LYS HD2 1 75 VAL H . . 5.340 5.320 5.199 5.356 0.016 13 0 "[ . 1 . 2]" 1
1390 1 67 LYS HD2 1 76 HIS HB3 . . 5.160 2.835 2.691 2.972 . 0 0 "[ . 1 . 2]" 1
1391 1 67 LYS HD2 1 91 ASN HA . . 4.530 2.449 2.340 2.595 . 0 0 "[ . 1 . 2]" 1
1392 1 67 LYS HD3 1 91 ASN HA . . 4.280 2.003 1.992 2.054 . 0 0 "[ . 1 . 2]" 1
1393 1 67 LYS HD3 1 92 ASN H . . 4.320 3.642 3.559 3.713 . 0 0 "[ . 1 . 2]" 1
1394 1 67 LYS HE2 1 67 LYS HG2 . . 4.020 2.924 2.864 2.968 . 0 0 "[ . 1 . 2]" 1
1395 1 67 LYS HE2 1 67 LYS HG3 . . 3.950 2.387 2.351 2.444 . 0 0 "[ . 1 . 2]" 1
1396 1 67 LYS HE2 1 68 PHE H . . 4.510 3.415 3.345 3.516 . 0 0 "[ . 1 . 2]" 1
1397 1 67 LYS HE2 1 74 TRP HA . . 5.000 4.004 3.805 4.106 . 0 0 "[ . 1 . 2]" 1
1398 1 67 LYS HE2 1 74 TRP HB3 . . 4.560 2.802 2.679 2.907 . 0 0 "[ . 1 . 2]" 1
1399 1 67 LYS HE2 1 74 TRP HE3 . . 4.620 3.769 3.523 3.892 . 0 0 "[ . 1 . 2]" 1
1400 1 67 LYS HE2 1 75 VAL HA . . 4.230 3.333 3.192 3.446 . 0 0 "[ . 1 . 2]" 1
1401 1 67 LYS HE2 1 91 ASN HA . . 5.370 4.410 4.313 4.559 . 0 0 "[ . 1 . 2]" 1
1402 1 67 LYS HE3 1 67 LYS HG2 . . 3.850 3.771 3.746 3.792 . 0 0 "[ . 1 . 2]" 1
1403 1 67 LYS HE3 1 67 LYS HG3 . . 4.140 3.619 3.598 3.665 . 0 0 "[ . 1 . 2]" 1
1404 1 67 LYS HE3 1 68 PHE H . . 4.510 4.312 4.257 4.403 . 0 0 "[ . 1 . 2]" 1
1405 1 67 LYS HE3 1 68 PHE HB2 . . 5.500 5.412 5.317 5.503 0.003 12 0 "[ . 1 . 2]" 1
1406 1 67 LYS HE3 1 75 VAL HA . . 4.310 4.065 3.771 4.179 . 0 0 "[ . 1 . 2]" 1
1407 1 67 LYS HE3 1 76 HIS H . . 4.330 4.321 4.079 4.347 0.017 5 0 "[ . 1 . 2]" 1
1408 1 67 LYS HE3 1 76 HIS HA . . 4.710 4.242 4.122 4.302 . 0 0 "[ . 1 . 2]" 1
1409 1 67 LYS HE3 1 76 HIS HB3 . . 3.670 2.004 1.988 2.050 . 0 0 "[ . 1 . 2]" 1
1410 1 67 LYS HE3 1 82 VAL MG1 . . 4.970 4.800 4.604 4.922 . 0 0 "[ . 1 . 2]" 1
1411 1 67 LYS HE3 1 90 ILE MG . . 4.890 3.697 3.468 3.926 . 0 0 "[ . 1 . 2]" 1
1412 1 67 LYS HG2 1 74 TRP HB2 . . 5.120 4.086 3.945 4.397 . 0 0 "[ . 1 . 2]" 1
1413 1 67 LYS HG2 1 91 ASN HA . . 4.900 4.376 4.315 4.441 . 0 0 "[ . 1 . 2]" 1
1414 1 67 LYS HG3 1 68 PHE H . . 3.640 2.304 2.263 2.339 . 0 0 "[ . 1 . 2]" 1
1415 1 67 LYS HG3 1 74 TRP HA . . 5.030 3.894 3.767 4.054 . 0 0 "[ . 1 . 2]" 1
1416 1 67 LYS HG3 1 74 TRP HB2 . . 5.240 4.735 4.579 5.037 . 0 0 "[ . 1 . 2]" 1
1417 1 67 LYS HG3 1 74 TRP HB3 . . 5.080 2.977 2.819 3.285 . 0 0 "[ . 1 . 2]" 1
1418 1 67 LYS HG3 1 74 TRP HE3 . . 3.770 2.004 1.985 2.033 . 0 0 "[ . 1 . 2]" 1
1419 1 67 LYS HG3 1 74 TRP HZ3 . . 4.450 3.670 3.401 3.797 . 0 0 "[ . 1 . 2]" 1
1420 1 67 LYS HG3 1 75 VAL H . . 4.220 3.847 3.765 3.926 . 0 0 "[ . 1 . 2]" 1
1421 1 67 LYS HG3 1 76 HIS HA . . 5.350 5.159 5.072 5.255 . 0 0 "[ . 1 . 2]" 1
1422 1 67 LYS HG3 1 91 ASN HA . . 4.800 4.626 4.549 4.702 . 0 0 "[ . 1 . 2]" 1
1423 1 68 PHE H 1 68 PHE HB2 . . 3.910 2.323 2.317 2.336 . 0 0 "[ . 1 . 2]" 1
1424 1 68 PHE H 1 68 PHE HB3 . . 3.640 3.585 3.580 3.593 . 0 0 "[ . 1 . 2]" 1
1425 1 68 PHE H 1 68 PHE QD . . 3.570 3.490 3.380 3.515 . 0 0 "[ . 1 . 2]" 1
1426 1 68 PHE H 1 68 PHE QE . . 5.110 5.098 5.055 5.122 0.012 13 0 "[ . 1 . 2]" 1
1427 1 68 PHE H 1 69 PHE H . . 4.630 4.577 4.565 4.583 . 0 0 "[ . 1 . 2]" 1
1428 1 68 PHE H 1 74 TRP HA . . 5.500 5.139 5.008 5.330 . 0 0 "[ . 1 . 2]" 1
1429 1 68 PHE H 1 74 TRP HE3 . . 4.570 3.698 3.591 3.803 . 0 0 "[ . 1 . 2]" 1
1430 1 68 PHE H 1 75 VAL H . . 4.300 4.198 4.113 4.312 0.012 13 0 "[ . 1 . 2]" 1
1431 1 68 PHE H 1 75 VAL MG2 . . 4.370 4.278 4.192 4.390 0.020 17 0 "[ . 1 . 2]" 1
1432 1 68 PHE H 1 76 HIS HB3 . . 5.110 4.045 3.933 4.232 . 0 0 "[ . 1 . 2]" 1
1433 1 68 PHE HA 1 68 PHE QD . . 3.560 2.005 1.988 2.163 . 0 0 "[ . 1 . 2]" 1
1434 1 68 PHE HA 1 68 PHE QE . . 4.410 4.211 4.203 4.275 . 0 0 "[ . 1 . 2]" 1
1435 1 68 PHE HA 1 69 PHE H . . 3.450 2.262 2.231 2.289 . 0 0 "[ . 1 . 2]" 1
1436 1 68 PHE HA 1 70 VAL MG2 . . 4.630 4.449 4.389 4.486 . 0 0 "[ . 1 . 2]" 1
1437 1 68 PHE HA 1 74 TRP HZ3 . . 4.730 3.847 3.734 4.056 . 0 0 "[ . 1 . 2]" 1
1438 1 68 PHE HA 1 75 VAL MG2 . . 4.780 4.519 4.440 4.609 . 0 0 "[ . 1 . 2]" 1
1439 1 68 PHE HB2 1 69 PHE H . . 4.220 4.036 3.980 4.103 . 0 0 "[ . 1 . 2]" 1
1440 1 68 PHE HB2 1 70 VAL H . . 5.500 5.157 5.120 5.192 . 0 0 "[ . 1 . 2]" 1
1441 1 68 PHE HB2 1 70 VAL MG2 . . 4.240 4.033 3.895 4.104 . 0 0 "[ . 1 . 2]" 1
1442 1 68 PHE HB2 1 75 VAL MG2 . . 4.270 2.666 2.514 2.811 . 0 0 "[ . 1 . 2]" 1
1443 1 68 PHE HB2 1 77 ASP H . . 4.940 4.782 4.296 4.926 . 0 0 "[ . 1 . 2]" 1
1444 1 68 PHE HB3 1 69 PHE H . . 4.080 2.825 2.741 2.928 . 0 0 "[ . 1 . 2]" 1
1445 1 68 PHE HB3 1 70 VAL MG2 . . 3.930 2.804 2.706 2.848 . 0 0 "[ . 1 . 2]" 1
1446 1 68 PHE HB3 1 75 VAL MG2 . . 4.350 2.735 2.611 2.845 . 0 0 "[ . 1 . 2]" 1
1447 1 68 PHE HB3 1 76 HIS HA . . 4.850 4.567 4.416 4.741 . 0 0 "[ . 1 . 2]" 1
1448 1 68 PHE QD 1 69 PHE H . . 4.380 3.271 3.241 3.291 . 0 0 "[ . 1 . 2]" 1
1449 1 68 PHE QD 1 70 VAL MG2 . . 4.230 4.171 4.099 4.204 . 0 0 "[ . 1 . 2]" 1
1450 1 68 PHE QD 1 75 VAL MG2 . . 4.050 3.720 3.590 3.910 . 0 0 "[ . 1 . 2]" 1
1451 1 68 PHE QD 1 76 HIS HA . . 3.430 2.746 2.604 2.883 . 0 0 "[ . 1 . 2]" 1
1452 1 68 PHE QD 1 77 ASP H . . 4.230 3.327 2.841 3.475 . 0 0 "[ . 1 . 2]" 1
1453 1 68 PHE QD 1 77 ASP QB . . 4.750 3.815 3.496 4.437 . 0 0 "[ . 1 . 2]" 1
1454 1 68 PHE QE 1 69 PHE H . . 5.500 5.537 5.507 5.557 0.057 2 0 "[ . 1 . 2]" 1
1455 1 68 PHE QE 1 70 VAL MG2 . . 5.500 5.469 5.441 5.504 0.004 18 0 "[ . 1 . 2]" 1
1456 1 68 PHE QE 1 76 HIS HA . . 5.090 4.741 4.591 4.891 . 0 0 "[ . 1 . 2]" 1
1457 1 68 PHE QE 1 77 ASP H . . 4.280 4.190 3.927 4.288 0.008 3 0 "[ . 1 . 2]" 1
1458 1 68 PHE QE 1 77 ASP QB . . 3.960 3.639 3.292 3.960 . 0 0 "[ . 1 . 2]" 1
1459 1 68 PHE QE 1 92 ASN HB3 . . 5.500 5.294 5.038 5.499 . 0 0 "[ . 1 . 2]" 1
1460 1 69 PHE H 1 69 PHE HB2 . . 4.200 3.198 3.141 3.262 . 0 0 "[ . 1 . 2]" 1
1461 1 69 PHE H 1 69 PHE HB3 . . 4.090 2.721 2.668 2.758 . 0 0 "[ . 1 . 2]" 1
1462 1 69 PHE H 1 69 PHE QD . . 4.320 4.299 4.245 4.343 0.023 6 0 "[ . 1 . 2]" 1
1463 1 69 PHE H 1 70 VAL H . . 4.580 3.829 3.784 3.882 . 0 0 "[ . 1 . 2]" 1
1464 1 69 PHE H 1 70 VAL MG2 . . 4.340 3.168 3.112 3.235 . 0 0 "[ . 1 . 2]" 1
1465 1 69 PHE H 1 74 TRP HE3 . . 5.230 4.334 4.256 4.440 . 0 0 "[ . 1 . 2]" 1
1466 1 69 PHE H 1 75 VAL MG2 . . 4.290 4.046 3.912 4.156 . 0 0 "[ . 1 . 2]" 1
1467 1 69 PHE HA 1 69 PHE QD . . 4.070 2.823 2.609 2.943 . 0 0 "[ . 1 . 2]" 1
1468 1 69 PHE HA 1 69 PHE QE . . 4.960 4.644 4.547 4.705 . 0 0 "[ . 1 . 2]" 1
1469 1 69 PHE HA 1 70 VAL H . . 3.500 2.214 2.206 2.217 . 0 0 "[ . 1 . 2]" 1
1470 1 69 PHE HA 1 73 GLN H . . 4.490 4.155 4.034 4.311 . 0 0 "[ . 1 . 2]" 1
1471 1 69 PHE HA 1 74 TRP HA . . 3.910 2.062 1.992 2.163 . 0 0 "[ . 1 . 2]" 1
1472 1 69 PHE HB2 1 74 TRP HA . . 5.320 3.337 3.155 3.465 . 0 0 "[ . 1 . 2]" 1
1473 1 69 PHE HB2 1 74 TRP HH2 . . 4.150 3.771 3.647 3.949 . 0 0 "[ . 1 . 2]" 1
1474 1 69 PHE HB2 1 74 TRP HZ3 . . 5.190 3.077 2.967 3.189 . 0 0 "[ . 1 . 2]" 1
1475 1 69 PHE HB3 1 70 VAL H . . 4.700 4.464 4.449 4.482 . 0 0 "[ . 1 . 2]" 1
1476 1 69 PHE QD 1 70 VAL H . . 4.420 4.189 4.100 4.210 . 0 0 "[ . 1 . 2]" 1
1477 1 69 PHE QD 1 72 GLY H . . 4.490 4.370 4.251 4.488 . 0 0 "[ . 1 . 2]" 1
1478 1 69 PHE QD 1 73 GLN H . . 4.140 3.918 3.825 4.069 . 0 0 "[ . 1 . 2]" 1
1479 1 69 PHE QD 1 73 GLN HA . . 4.280 3.571 3.426 3.722 . 0 0 "[ . 1 . 2]" 1
1480 1 69 PHE QD 1 74 TRP H . . 4.550 3.299 3.149 3.595 . 0 0 "[ . 1 . 2]" 1
1481 1 69 PHE QD 1 74 TRP HA . . 3.890 2.632 2.453 2.887 . 0 0 "[ . 1 . 2]" 1
1482 1 69 PHE QD 1 74 TRP HD1 . . 3.950 3.481 3.362 3.620 . 0 0 "[ . 1 . 2]" 1
1483 1 69 PHE QD 1 74 TRP HE1 . . 4.090 3.633 3.500 3.819 . 0 0 "[ . 1 . 2]" 1
1484 1 69 PHE QD 1 74 TRP HE3 . . 4.430 3.775 3.690 3.870 . 0 0 "[ . 1 . 2]" 1
1485 1 69 PHE QD 1 74 TRP HZ2 . . 4.500 4.317 4.091 4.489 . 0 0 "[ . 1 . 2]" 1
1486 1 69 PHE QE 1 72 GLY H . . 3.970 3.649 3.453 3.890 . 0 0 "[ . 1 . 2]" 1
1487 1 69 PHE QE 1 72 GLY HA2 . . 4.790 2.551 2.460 2.750 . 0 0 "[ . 1 . 2]" 1
1488 1 69 PHE QE 1 72 GLY QA . . 3.930 2.527 2.441 2.715 . 0 0 "[ . 1 . 2]" 1
1489 1 69 PHE QE 1 72 GLY HA3 . . 4.790 4.085 4.007 4.197 . 0 0 "[ . 1 . 2]" 1
1490 1 69 PHE QE 1 73 GLN HA . . 3.420 2.466 2.257 2.739 . 0 0 "[ . 1 . 2]" 1
1491 1 69 PHE QE 1 74 TRP H . . 4.750 3.565 3.352 3.896 . 0 0 "[ . 1 . 2]" 1
1492 1 69 PHE QE 1 74 TRP HD1 . . 3.800 3.575 3.485 3.800 0.000 10 0 "[ . 1 . 2]" 1
1493 1 69 PHE QE 1 74 TRP HE1 . . 4.040 3.714 3.561 4.027 . 0 0 "[ . 1 . 2]" 1
1494 1 69 PHE HZ 1 72 GLY QA . . 3.960 2.335 2.233 2.517 . 0 0 "[ . 1 . 2]" 1
1495 1 70 VAL H 1 70 VAL HB . . 3.480 2.769 2.746 2.813 . 0 0 "[ . 1 . 2]" 1
1496 1 70 VAL H 1 70 VAL MG1 . . 4.090 3.908 3.901 3.920 . 0 0 "[ . 1 . 2]" 1
1497 1 70 VAL H 1 70 VAL MG2 . . 3.560 2.733 2.535 2.777 . 0 0 "[ . 1 . 2]" 1
1498 1 70 VAL H 1 71 ASP H . . 4.580 4.468 4.460 4.477 . 0 0 "[ . 1 . 2]" 1
1499 1 70 VAL H 1 71 ASP QB . . 5.340 4.635 4.526 4.819 . 0 0 "[ . 1 . 2]" 1
1500 1 70 VAL H 1 72 GLY H . . 5.000 4.842 4.448 5.007 0.007 18 0 "[ . 1 . 2]" 1
1501 1 70 VAL H 1 73 GLN H . . 3.640 3.519 3.399 3.647 0.007 17 0 "[ . 1 . 2]" 1
1502 1 70 VAL H 1 74 TRP HA . . 3.950 3.539 3.403 3.654 . 0 0 "[ . 1 . 2]" 1
1503 1 70 VAL H 1 75 VAL H . . 4.200 3.040 2.910 3.163 . 0 0 "[ . 1 . 2]" 1
1504 1 70 VAL H 1 75 VAL MG1 . . 3.300 2.967 2.735 3.147 . 0 0 "[ . 1 . 2]" 1
1505 1 70 VAL H 1 75 VAL MG2 . . 3.060 2.286 2.000 2.596 . 0 0 "[ . 1 . 2]" 1
1506 1 70 VAL HA 1 70 VAL MG1 . . 3.440 2.223 2.149 2.281 . 0 0 "[ . 1 . 2]" 1
1507 1 70 VAL HA 1 70 VAL MG2 . . 3.710 2.412 2.376 2.475 . 0 0 "[ . 1 . 2]" 1
1508 1 70 VAL HA 1 71 ASP H . . 3.170 2.282 2.266 2.303 . 0 0 "[ . 1 . 2]" 1
1509 1 70 VAL HA 1 72 GLY H . . 4.200 3.470 3.202 3.560 . 0 0 "[ . 1 . 2]" 1
1510 1 70 VAL HA 1 73 GLN H . . 4.290 4.084 4.062 4.117 . 0 0 "[ . 1 . 2]" 1
1511 1 70 VAL HB 1 71 ASP H . . 4.320 3.702 3.633 3.766 . 0 0 "[ . 1 . 2]" 1
1512 1 70 VAL HB 1 75 VAL MG1 . . 4.310 3.199 2.939 3.363 . 0 0 "[ . 1 . 2]" 1
1513 1 70 VAL HB 1 75 VAL MG2 . . 3.990 2.452 2.239 2.590 . 0 0 "[ . 1 . 2]" 1
1514 1 70 VAL MG1 1 71 ASP H . . 3.450 2.047 1.912 2.124 . 0 0 "[ . 1 . 2]" 1
1515 1 70 VAL MG1 1 71 ASP HB2 . . 4.210 2.950 2.550 3.911 . 0 0 "[ . 1 . 2]" 1
1516 1 70 VAL MG1 1 71 ASP HB3 . . 4.210 3.941 3.693 4.216 0.006 5 0 "[ . 1 . 2]" 1
1517 1 70 VAL MG1 1 72 GLY H . . 4.550 4.226 4.066 4.285 . 0 0 "[ . 1 . 2]" 1
1518 1 70 VAL MG1 1 73 GLN H . . 5.080 4.980 4.905 5.034 . 0 0 "[ . 1 . 2]" 1
1519 1 70 VAL MG2 1 71 ASP H . . 4.150 3.968 3.956 4.015 . 0 0 "[ . 1 . 2]" 1
1520 1 70 VAL MG2 1 73 GLN H . . 5.370 5.260 5.205 5.312 . 0 0 "[ . 1 . 2]" 1
1521 1 70 VAL MG2 1 75 VAL HB . . 5.020 4.766 4.529 4.890 . 0 0 "[ . 1 . 2]" 1
1522 1 70 VAL MG2 1 75 VAL MG1 . . 3.920 3.878 3.651 3.931 0.011 2 0 "[ . 1 . 2]" 1
1523 1 70 VAL MG2 1 75 VAL MG2 . . 3.240 2.296 2.098 2.388 . 0 0 "[ . 1 . 2]" 1
1524 1 71 ASP H 1 71 ASP HB2 . . 4.010 3.243 3.052 3.766 . 0 0 "[ . 1 . 2]" 1
1525 1 71 ASP H 1 71 ASP HB3 . . 4.010 3.816 3.694 4.009 . 0 0 "[ . 1 . 2]" 1
1526 1 71 ASP H 1 72 GLY H . . 3.620 2.653 2.607 2.684 . 0 0 "[ . 1 . 2]" 1
1527 1 71 ASP H 1 73 GLN H . . 4.470 4.191 4.110 4.292 . 0 0 "[ . 1 . 2]" 1
1528 1 71 ASP H 1 75 VAL MG2 . . 5.500 5.409 5.171 5.505 0.005 20 0 "[ . 1 . 2]" 1
1529 1 71 ASP HA 1 72 GLY H . . 3.290 2.869 2.817 3.041 . 0 0 "[ . 1 . 2]" 1
1530 1 71 ASP HA 1 73 GLN H . . 4.740 4.553 4.398 4.717 . 0 0 "[ . 1 . 2]" 1
1531 1 71 ASP QB 1 72 GLY H . . 3.970 3.843 3.693 3.891 . 0 0 "[ . 1 . 2]" 1
1532 1 71 ASP HB2 1 72 GLY H . . 4.760 4.441 4.086 4.593 . 0 0 "[ . 1 . 2]" 1
1533 1 71 ASP HB3 1 72 GLY H . . 4.760 4.247 3.955 4.551 . 0 0 "[ . 1 . 2]" 1
1534 1 72 GLY H 1 73 GLN H . . 3.130 2.670 2.488 2.728 . 0 0 "[ . 1 . 2]" 1
1535 1 72 GLY H 1 73 GLN HB3 . . 5.420 5.342 5.104 5.411 . 0 0 "[ . 1 . 2]" 1
1536 1 72 GLY HA2 1 73 GLN H . . 3.550 2.949 2.907 3.023 . 0 0 "[ . 1 . 2]" 1
1537 1 72 GLY HA3 1 73 GLN H . . 3.550 3.496 3.461 3.513 . 0 0 "[ . 1 . 2]" 1
1538 1 73 GLN H 1 73 GLN HB2 . . 4.010 3.972 3.934 4.001 . 0 0 "[ . 1 . 2]" 1
1539 1 73 GLN H 1 73 GLN HB3 . . 3.410 3.342 3.244 3.397 . 0 0 "[ . 1 . 2]" 1
1540 1 73 GLN H 1 73 GLN QG . . 3.200 2.624 2.554 2.663 . 0 0 "[ . 1 . 2]" 1
1541 1 73 GLN H 1 74 TRP H . . 4.510 4.356 4.328 4.390 . 0 0 "[ . 1 . 2]" 1
1542 1 73 GLN H 1 74 TRP HA . . 4.880 4.709 4.677 4.750 . 0 0 "[ . 1 . 2]" 1
1543 1 73 GLN H 1 75 VAL H . . 5.500 5.493 5.430 5.541 0.041 17 0 "[ . 1 . 2]" 1
1544 1 73 GLN H 1 75 VAL MG1 . . 4.500 4.285 4.181 4.378 . 0 0 "[ . 1 . 2]" 1
1545 1 73 GLN H 1 75 VAL MG2 . . 5.180 5.104 5.005 5.170 . 0 0 "[ . 1 . 2]" 1
1546 1 73 GLN HA 1 73 GLN HG2 . . 3.960 3.820 3.584 3.863 . 0 0 "[ . 1 . 2]" 1
1547 1 73 GLN HA 1 73 GLN QG . . 3.450 3.336 3.316 3.339 . 0 0 "[ . 1 . 2]" 1
1548 1 73 GLN HA 1 73 GLN HG3 . . 3.960 3.683 3.653 3.908 . 0 0 "[ . 1 . 2]" 1
1549 1 73 GLN HA 1 74 TRP H . . 2.820 2.336 2.282 2.484 . 0 0 "[ . 1 . 2]" 1
1550 1 73 GLN HA 1 74 TRP HD1 . . 4.250 4.055 3.860 4.187 . 0 0 "[ . 1 . 2]" 1
1551 1 73 GLN HA 1 74 TRP HE1 . . 5.500 5.482 5.347 5.540 0.040 17 0 "[ . 1 . 2]" 1
1552 1 73 GLN HB2 1 74 TRP H . . 3.470 2.627 2.315 2.759 . 0 0 "[ . 1 . 2]" 1
1553 1 73 GLN HB2 1 75 VAL MG1 . . 4.180 3.810 3.715 3.981 . 0 0 "[ . 1 . 2]" 1
1554 1 73 GLN HB3 1 73 GLN HE21 . . 4.420 3.992 3.663 4.233 . 0 0 "[ . 1 . 2]" 1
1555 1 73 GLN HB3 1 73 GLN HE22 . . 4.560 4.498 4.344 4.563 0.003 6 0 "[ . 1 . 2]" 1
1556 1 73 GLN HB3 1 74 TRP H . . 4.050 3.918 3.754 3.993 . 0 0 "[ . 1 . 2]" 1
1557 1 73 GLN HB3 1 75 VAL MG1 . . 4.630 4.548 4.462 4.605 . 0 0 "[ . 1 . 2]" 1
1558 1 73 GLN HE21 1 73 GLN QG . . 3.040 2.227 2.149 2.391 . 0 0 "[ . 1 . 2]" 1
1559 1 73 GLN HE21 1 75 VAL MG1 . . 4.080 2.723 1.981 3.216 . 0 0 "[ . 1 . 2]" 1
1560 1 73 GLN HE21 1 75 VAL MG2 . . 5.080 4.877 4.194 5.069 . 0 0 "[ . 1 . 2]" 1
1561 1 73 GLN HE22 1 73 GLN QG . . 3.420 3.259 3.216 3.355 . 0 0 "[ . 1 . 2]" 1
1562 1 73 GLN HE22 1 75 VAL MG1 . . 4.160 3.354 2.756 3.633 . 0 0 "[ . 1 . 2]" 1
1563 1 73 GLN QG 1 74 TRP H . . 4.250 3.583 3.219 3.728 . 0 0 "[ . 1 . 2]" 1
1564 1 73 GLN HG2 1 75 VAL MG1 . . 4.200 3.236 2.355 3.408 . 0 0 "[ . 1 . 2]" 1
1565 1 73 GLN HG3 1 75 VAL MG1 . . 4.200 2.053 1.948 2.256 . 0 0 "[ . 1 . 2]" 1
1566 1 74 TRP H 1 74 TRP HB2 . . 3.450 2.383 2.361 2.411 . 0 0 "[ . 1 . 2]" 1
1567 1 74 TRP H 1 74 TRP HB3 . . 3.800 3.601 3.596 3.607 . 0 0 "[ . 1 . 2]" 1
1568 1 74 TRP H 1 74 TRP HD1 . . 3.460 2.866 2.662 3.126 . 0 0 "[ . 1 . 2]" 1
1569 1 74 TRP H 1 74 TRP HE1 . . 5.240 4.986 4.827 5.245 0.005 17 0 "[ . 1 . 2]" 1
1570 1 74 TRP H 1 75 VAL H . . 4.490 4.407 4.378 4.435 . 0 0 "[ . 1 . 2]" 1
1571 1 74 TRP H 1 75 VAL MG1 . . 4.310 4.190 4.026 4.308 . 0 0 "[ . 1 . 2]" 1
1572 1 74 TRP HA 1 74 TRP HD1 . . 4.330 4.258 4.203 4.315 . 0 0 "[ . 1 . 2]" 1
1573 1 74 TRP HA 1 74 TRP HE3 . . 3.700 2.882 2.766 3.039 . 0 0 "[ . 1 . 2]" 1
1574 1 74 TRP HA 1 75 VAL H . . 3.360 2.142 2.140 2.146 . 0 0 "[ . 1 . 2]" 1
1575 1 74 TRP HA 1 75 VAL MG1 . . 5.220 3.789 3.685 3.929 . 0 0 "[ . 1 . 2]" 1
1576 1 74 TRP HA 1 75 VAL MG2 . . 5.220 3.789 3.740 3.858 . 0 0 "[ . 1 . 2]" 1
1577 1 74 TRP HB2 1 74 TRP HD1 . . 3.620 2.606 2.585 2.637 . 0 0 "[ . 1 . 2]" 1
1578 1 74 TRP HB2 1 74 TRP HE1 . . 4.920 4.769 4.763 4.780 . 0 0 "[ . 1 . 2]" 1
1579 1 74 TRP HB2 1 75 VAL H . . 4.490 4.395 4.380 4.419 . 0 0 "[ . 1 . 2]" 1
1580 1 74 TRP HB3 1 74 TRP HD1 . . 3.880 3.760 3.731 3.792 . 0 0 "[ . 1 . 2]" 1
1581 1 74 TRP HB3 1 75 VAL H . . 4.320 3.571 3.527 3.626 . 0 0 "[ . 1 . 2]" 1
1582 1 74 TRP HE3 1 75 VAL H . . 4.180 3.801 3.570 4.049 . 0 0 "[ . 1 . 2]" 1
1583 1 75 VAL H 1 75 VAL HB . . 3.850 3.797 3.772 3.831 . 0 0 "[ . 1 . 2]" 1
1584 1 75 VAL H 1 75 VAL MG1 . . 3.740 2.808 2.660 2.916 . 0 0 "[ . 1 . 2]" 1
1585 1 75 VAL H 1 75 VAL MG2 . . 3.420 2.116 1.985 2.214 . 0 0 "[ . 1 . 2]" 1
1586 1 75 VAL H 1 76 HIS H . . 4.740 4.470 4.456 4.483 . 0 0 "[ . 1 . 2]" 1
1587 1 75 VAL HA 1 75 VAL MG1 . . 3.160 2.348 2.267 2.435 . 0 0 "[ . 1 . 2]" 1
1588 1 75 VAL HA 1 75 VAL MG2 . . 3.620 3.202 3.197 3.203 . 0 0 "[ . 1 . 2]" 1
1589 1 75 VAL HA 1 76 HIS H . . 2.840 2.480 2.441 2.527 . 0 0 "[ . 1 . 2]" 1
1590 1 75 VAL HB 1 76 HIS H . . 2.920 2.234 2.152 2.315 . 0 0 "[ . 1 . 2]" 1
1591 1 75 VAL HB 1 76 HIS HA . . 5.130 4.327 4.274 4.394 . 0 0 "[ . 1 . 2]" 1
1592 1 75 VAL MG1 1 76 HIS H . . 3.880 3.656 3.612 3.710 . 0 0 "[ . 1 . 2]" 1
1593 1 75 VAL MG2 1 76 HIS H . . 3.310 3.182 3.060 3.292 . 0 0 "[ . 1 . 2]" 1
1594 1 75 VAL MG2 1 77 ASP H . . 5.140 5.026 4.689 5.143 0.003 14 0 "[ . 1 . 2]" 1
1595 1 76 HIS H 1 76 HIS HB2 . . 4.160 3.968 3.948 3.988 . 0 0 "[ . 1 . 2]" 1
1596 1 76 HIS H 1 76 HIS HB3 . . 3.510 3.269 3.211 3.306 . 0 0 "[ . 1 . 2]" 1
1597 1 76 HIS H 1 77 ASP H . . 4.490 4.372 4.330 4.392 . 0 0 "[ . 1 . 2]" 1
1598 1 76 HIS HA 1 76 HIS HD2 . . 4.520 4.284 4.266 4.293 . 0 0 "[ . 1 . 2]" 1
1599 1 76 HIS HA 1 77 ASP H . . 3.490 2.338 2.236 2.367 . 0 0 "[ . 1 . 2]" 1
1600 1 76 HIS HA 1 90 ILE MG . . 5.500 5.475 5.327 5.510 0.010 17 0 "[ . 1 . 2]" 1
1601 1 76 HIS HA 1 92 ASN HD22 . . 4.750 3.552 3.329 3.763 . 0 0 "[ . 1 . 2]" 1
1602 1 76 HIS HB2 1 76 HIS HD2 . . 3.790 2.941 2.930 2.960 . 0 0 "[ . 1 . 2]" 1
1603 1 76 HIS HB2 1 77 ASP H . . 3.710 2.641 2.567 2.930 . 0 0 "[ . 1 . 2]" 1
1604 1 76 HIS HB2 1 82 VAL MG1 . . 4.460 2.273 2.095 2.443 . 0 0 "[ . 1 . 2]" 1
1605 1 76 HIS HB2 1 90 ILE MG . . 4.540 3.613 3.426 3.682 . 0 0 "[ . 1 . 2]" 1
1606 1 76 HIS HB2 1 92 ASN HD21 . . 4.210 3.907 3.679 4.197 . 0 0 "[ . 1 . 2]" 1
1607 1 76 HIS HB2 1 92 ASN HD22 . . 5.070 2.716 2.472 3.076 . 0 0 "[ . 1 . 2]" 1
1608 1 76 HIS HB3 1 76 HIS HD2 . . 3.970 3.957 3.955 3.961 . 0 0 "[ . 1 . 2]" 1
1609 1 76 HIS HB3 1 77 ASP H . . 4.290 3.956 3.911 4.121 . 0 0 "[ . 1 . 2]" 1
1610 1 76 HIS HB3 1 82 VAL MG1 . . 4.440 3.550 3.347 3.726 . 0 0 "[ . 1 . 2]" 1
1611 1 76 HIS HB3 1 90 ILE MG . . 4.410 3.593 3.472 3.676 . 0 0 "[ . 1 . 2]" 1
1612 1 76 HIS HB3 1 91 ASN HA . . 5.500 3.926 3.723 4.140 . 0 0 "[ . 1 . 2]" 1
1613 1 76 HIS HB3 1 92 ASN H . . 4.870 4.710 4.405 4.850 . 0 0 "[ . 1 . 2]" 1
1614 1 76 HIS HD2 1 77 ASP H . . 4.420 3.465 3.406 3.729 . 0 0 "[ . 1 . 2]" 1
1615 1 76 HIS HD2 1 78 PRO HA . . 3.240 3.224 3.194 3.251 0.011 17 0 "[ . 1 . 2]" 1
1616 1 76 HIS HD2 1 78 PRO HB2 . . 5.500 5.592 5.576 5.611 0.111 17 0 "[ . 1 . 2]" 1
1617 1 76 HIS HD2 1 78 PRO HB3 . . 4.410 4.395 4.359 4.416 0.006 4 0 "[ . 1 . 2]" 1
1618 1 76 HIS HD2 1 79 SER H . . 5.490 5.388 5.257 5.447 . 0 0 "[ . 1 . 2]" 1
1619 1 76 HIS HD2 1 80 GLU H . . 5.500 5.346 5.244 5.443 . 0 0 "[ . 1 . 2]" 1
1620 1 76 HIS HD2 1 82 VAL HB . . 4.260 4.156 4.025 4.262 0.002 18 0 "[ . 1 . 2]" 1
1621 1 76 HIS HD2 1 82 VAL MG1 . . 2.790 2.248 2.067 2.400 . 0 0 "[ . 1 . 2]" 1
1622 1 76 HIS HD2 1 82 VAL MG2 . . 3.430 3.249 3.091 3.418 . 0 0 "[ . 1 . 2]" 1
1623 1 76 HIS HD2 1 90 ILE MG . . 3.950 3.702 3.480 3.879 . 0 0 "[ . 1 . 2]" 1
1624 1 76 HIS HD2 1 92 ASN HD22 . . 4.920 4.379 4.090 4.770 . 0 0 "[ . 1 . 2]" 1
1625 1 76 HIS HE1 1 82 VAL MG2 . . 5.500 4.799 4.595 4.983 . 0 0 "[ . 1 . 2]" 1
1626 1 76 HIS HE1 1 90 ILE HB . . 3.720 2.745 2.496 3.023 . 0 0 "[ . 1 . 2]" 1
1627 1 76 HIS HE1 1 90 ILE MD . . 4.020 4.022 3.988 4.047 0.027 17 0 "[ . 1 . 2]" 1
1628 1 76 HIS HE1 1 90 ILE HG13 . . 4.020 2.524 2.416 2.632 . 0 0 "[ . 1 . 2]" 1
1629 1 76 HIS HE1 1 90 ILE MG . . 3.390 2.699 2.562 2.859 . 0 0 "[ . 1 . 2]" 1
1630 1 77 ASP H 1 77 ASP HB2 . . 3.820 2.584 2.259 3.676 . 0 0 "[ . 1 . 2]" 1
1631 1 77 ASP H 1 77 ASP HB3 . . 3.820 3.028 2.486 3.677 . 0 0 "[ . 1 . 2]" 1
1632 1 77 ASP H 1 78 PRO HD2 . . 4.990 4.840 4.839 4.842 . 0 0 "[ . 1 . 2]" 1
1633 1 77 ASP H 1 78 PRO HD3 . . 4.840 4.841 4.830 4.863 0.023 17 0 "[ . 1 . 2]" 1
1634 1 77 ASP H 1 79 SER H . . 5.480 5.325 5.084 5.479 . 0 0 "[ . 1 . 2]" 1
1635 1 77 ASP H 1 80 GLU H . . 4.770 4.589 4.529 4.638 . 0 0 "[ . 1 . 2]" 1
1636 1 77 ASP H 1 80 GLU HB2 . . 4.630 3.579 3.429 3.848 . 0 0 "[ . 1 . 2]" 1
1637 1 77 ASP H 1 82 VAL MG1 . . 4.240 3.304 3.105 3.558 . 0 0 "[ . 1 . 2]" 1
1638 1 77 ASP H 1 92 ASN HD21 . . 4.340 3.948 3.759 4.148 . 0 0 "[ . 1 . 2]" 1
1639 1 77 ASP H 1 92 ASN HD22 . . 4.060 2.295 2.043 2.522 . 0 0 "[ . 1 . 2]" 1
1640 1 77 ASP HA 1 78 PRO HD3 . . 3.830 2.255 2.253 2.257 . 0 0 "[ . 1 . 2]" 1
1641 1 77 ASP HA 1 78 PRO HG2 . . 4.680 4.291 4.286 4.297 . 0 0 "[ . 1 . 2]" 1
1642 1 77 ASP HA 1 78 PRO QG . . 4.090 3.844 3.840 3.848 . 0 0 "[ . 1 . 2]" 1
1643 1 77 ASP HA 1 78 PRO HG3 . . 4.680 4.339 4.335 4.341 . 0 0 "[ . 1 . 2]" 1
1644 1 77 ASP HA 1 79 SER H . . 3.970 3.815 3.717 3.880 . 0 0 "[ . 1 . 2]" 1
1645 1 77 ASP HA 1 80 GLU H . . 4.860 4.586 4.474 4.756 . 0 0 "[ . 1 . 2]" 1
1646 1 77 ASP QB 1 78 PRO HD2 . . 4.810 3.166 2.559 3.471 . 0 0 "[ . 1 . 2]" 1
1647 1 77 ASP QB 1 78 PRO HD3 . . 4.880 4.117 3.746 4.274 . 0 0 "[ . 1 . 2]" 1
1648 1 77 ASP QB 1 79 SER H . . 4.200 3.021 2.405 3.726 . 0 0 "[ . 1 . 2]" 1
1649 1 77 ASP QB 1 80 GLU H . . 3.960 2.642 2.421 3.453 . 0 0 "[ . 1 . 2]" 1
1650 1 77 ASP HB2 1 79 SER H . . 4.800 4.243 2.652 4.669 . 0 0 "[ . 1 . 2]" 1
1651 1 77 ASP HB2 1 80 GLU H . . 4.720 3.895 2.861 4.337 . 0 0 "[ . 1 . 2]" 1
1652 1 77 ASP HB3 1 79 SER H . . 4.800 3.251 2.431 4.327 . 0 0 "[ . 1 . 2]" 1
1653 1 77 ASP HB3 1 80 GLU H . . 4.720 2.832 2.436 4.684 . 0 0 "[ . 1 . 2]" 1
1654 1 78 PRO HA 1 82 VAL MG1 . . 3.930 3.324 3.173 3.572 . 0 0 "[ . 1 . 2]" 1
1655 1 78 PRO HA 1 82 VAL MG2 . . 4.530 2.981 2.790 3.125 . 0 0 "[ . 1 . 2]" 1
1656 1 78 PRO HB2 1 79 SER H . . 3.810 3.511 3.403 3.692 . 0 0 "[ . 1 . 2]" 1
1657 1 78 PRO HB3 1 79 SER H . . 4.420 4.244 4.180 4.348 . 0 0 "[ . 1 . 2]" 1
1658 1 78 PRO HD2 1 79 SER H . . 3.310 2.680 2.651 2.759 . 0 0 "[ . 1 . 2]" 1
1659 1 78 PRO QG 1 79 SER H . . 3.440 2.577 2.433 2.829 . 0 0 "[ . 1 . 2]" 1
1660 1 79 SER H 1 79 SER HB2 . . 3.500 2.278 2.105 2.488 . 0 0 "[ . 1 . 2]" 1
1661 1 79 SER H 1 79 SER QB . . 2.920 2.200 2.081 2.276 . 0 0 "[ . 1 . 2]" 1
1662 1 79 SER H 1 79 SER HB3 . . 3.500 3.146 2.638 3.499 . 0 0 "[ . 1 . 2]" 1
1663 1 79 SER H 1 80 GLU H . . 2.890 2.456 2.378 2.467 . 0 0 "[ . 1 . 2]" 1
1664 1 79 SER H 1 80 GLU HA . . 5.200 5.109 5.051 5.130 . 0 0 "[ . 1 . 2]" 1
1665 1 79 SER H 1 80 GLU HB2 . . 4.990 4.389 4.313 4.430 . 0 0 "[ . 1 . 2]" 1
1666 1 79 SER H 1 80 GLU QG . . 4.960 4.773 4.645 4.886 . 0 0 "[ . 1 . 2]" 1
1667 1 79 SER H 1 82 VAL MG1 . . 5.030 4.925 4.849 5.023 . 0 0 "[ . 1 . 2]" 1
1668 1 79 SER H 1 82 VAL MG2 . . 5.500 5.446 5.240 5.505 0.005 15 0 "[ . 1 . 2]" 1
1669 1 79 SER HA 1 80 GLU H . . 3.480 3.479 3.460 3.491 0.011 6 0 "[ . 1 . 2]" 1
1670 1 79 SER QB 1 80 GLU H . . 3.230 2.878 2.800 3.005 . 0 0 "[ . 1 . 2]" 1
1671 1 79 SER QB 1 80 GLU QG . . 4.810 3.632 3.479 3.776 . 0 0 "[ . 1 . 2]" 1
1672 1 79 SER HB2 1 80 GLU H . . 4.020 3.439 3.031 3.965 . 0 0 "[ . 1 . 2]" 1
1673 1 79 SER HB3 1 80 GLU H . . 4.020 3.270 2.871 3.613 . 0 0 "[ . 1 . 2]" 1
1674 1 80 GLU H 1 80 GLU HB2 . . 3.440 2.199 2.171 2.229 . 0 0 "[ . 1 . 2]" 1
1675 1 80 GLU H 1 80 GLU HB3 . . 3.670 3.490 3.461 3.504 . 0 0 "[ . 1 . 2]" 1
1676 1 80 GLU H 1 80 GLU HG2 . . 4.220 3.634 3.039 4.221 0.001 17 0 "[ . 1 . 2]" 1
1677 1 80 GLU H 1 80 GLU QG . . 3.460 3.015 2.965 3.152 . 0 0 "[ . 1 . 2]" 1
1678 1 80 GLU H 1 80 GLU HG3 . . 4.220 3.562 3.064 4.214 . 0 0 "[ . 1 . 2]" 1
1679 1 80 GLU H 1 82 VAL MG1 . . 4.140 3.800 3.650 3.891 . 0 0 "[ . 1 . 2]" 1
1680 1 80 GLU H 1 92 ASN HD21 . . 5.020 4.764 4.526 5.018 . 0 0 "[ . 1 . 2]" 1
1681 1 80 GLU H 1 92 ASN HD22 . . 4.740 4.605 4.383 4.746 0.006 18 0 "[ . 1 . 2]" 1
1682 1 80 GLU HA 1 81 PRO HB3 . . 5.000 4.868 4.866 4.873 . 0 0 "[ . 1 . 2]" 1
1683 1 80 GLU HA 1 81 PRO QD . . 3.430 2.156 2.152 2.167 . 0 0 "[ . 1 . 2]" 1
1684 1 80 GLU HB2 1 81 PRO QD . . 4.490 3.479 3.460 3.501 . 0 0 "[ . 1 . 2]" 1
1685 1 80 GLU HB2 1 92 ASN HD21 . . 5.130 2.873 2.606 3.108 . 0 0 "[ . 1 . 2]" 1
1686 1 80 GLU HB2 1 92 ASN HD22 . . 4.870 2.818 2.655 3.067 . 0 0 "[ . 1 . 2]" 1
1687 1 80 GLU HB3 1 92 ASN HD21 . . 5.140 2.306 2.166 2.611 . 0 0 "[ . 1 . 2]" 1
1688 1 80 GLU HB3 1 92 ASN HD22 . . 4.920 3.240 3.006 3.544 . 0 0 "[ . 1 . 2]" 1
1689 1 80 GLU HB3 1 93 LEU H . . 4.730 4.009 3.671 4.335 . 0 0 "[ . 1 . 2]" 1
1690 1 80 GLU QG 1 81 PRO QD . . 4.430 2.700 2.225 3.152 . 0 0 "[ . 1 . 2]" 1
1691 1 81 PRO HA 1 82 VAL H . . 2.400 2.372 2.312 2.401 0.001 14 0 "[ . 1 . 2]" 1
1692 1 81 PRO HA 1 82 VAL HA . . 5.310 4.494 4.464 4.505 . 0 0 "[ . 1 . 2]" 1
1693 1 81 PRO HA 1 82 VAL MG1 . . 4.450 4.215 4.121 4.313 . 0 0 "[ . 1 . 2]" 1
1694 1 81 PRO HA 1 82 VAL MG2 . . 4.040 3.960 3.883 4.042 0.002 14 0 "[ . 1 . 2]" 1
1695 1 81 PRO HA 1 93 LEU H . . 5.350 5.242 5.079 5.354 0.004 11 0 "[ . 1 . 2]" 1
1696 1 81 PRO HA 1 93 LEU HB2 . . 5.500 5.429 4.814 5.535 0.035 9 0 "[ . 1 . 2]" 1
1697 1 81 PRO HB2 1 93 LEU H . . 4.420 3.825 3.595 4.012 . 0 0 "[ . 1 . 2]" 1
1698 1 81 PRO HB2 1 93 LEU HB2 . . 4.210 3.313 2.701 3.562 . 0 0 "[ . 1 . 2]" 1
1699 1 81 PRO HB3 1 93 LEU QD . . 4.960 3.900 3.396 5.037 0.077 17 0 "[ . 1 . 2]" 1
1700 1 81 PRO QD 1 82 VAL H . . 4.790 4.524 4.482 4.615 . 0 0 "[ . 1 . 2]" 1
1701 1 81 PRO QD 1 93 LEU H . . 4.700 3.746 3.567 4.008 . 0 0 "[ . 1 . 2]" 1
1702 1 81 PRO QG 1 93 LEU H . . 4.450 2.522 2.381 2.647 . 0 0 "[ . 1 . 2]" 1
1703 1 81 PRO QG 1 93 LEU HB2 . . 4.610 3.820 3.285 4.283 . 0 0 "[ . 1 . 2]" 1
1704 1 81 PRO QG 1 93 LEU HB3 . . 4.720 2.484 2.039 3.325 . 0 0 "[ . 1 . 2]" 1
1705 1 81 PRO QG 1 93 LEU QD . . 4.340 3.620 3.201 4.153 . 0 0 "[ . 1 . 2]" 1
1706 1 82 VAL H 1 82 VAL HB . . 3.760 3.671 3.648 3.705 . 0 0 "[ . 1 . 2]" 1
1707 1 82 VAL H 1 82 VAL MG1 . . 3.210 2.553 2.400 2.690 . 0 0 "[ . 1 . 2]" 1
1708 1 82 VAL H 1 82 VAL MG2 . . 2.630 2.002 1.914 2.117 . 0 0 "[ . 1 . 2]" 1
1709 1 82 VAL H 1 83 VAL H . . 4.740 4.574 4.546 4.584 . 0 0 "[ . 1 . 2]" 1
1710 1 82 VAL H 1 90 ILE MG . . 5.330 5.025 4.924 5.186 . 0 0 "[ . 1 . 2]" 1
1711 1 82 VAL H 1 92 ASN HA . . 4.720 4.499 4.386 4.554 . 0 0 "[ . 1 . 2]" 1
1712 1 82 VAL H 1 92 ASN HD21 . . 5.080 4.484 4.292 4.780 . 0 0 "[ . 1 . 2]" 1
1713 1 82 VAL H 1 93 LEU H . . 5.330 5.245 5.157 5.343 0.013 18 0 "[ . 1 . 2]" 1
1714 1 82 VAL HA 1 82 VAL MG1 . . 3.250 2.367 2.240 2.436 . 0 0 "[ . 1 . 2]" 1
1715 1 82 VAL HA 1 82 VAL MG2 . . 3.420 3.193 3.183 3.203 . 0 0 "[ . 1 . 2]" 1
1716 1 82 VAL HA 1 83 VAL H . . 3.120 2.333 2.228 2.395 . 0 0 "[ . 1 . 2]" 1
1717 1 82 VAL HA 1 83 VAL HA . . 5.500 4.499 4.437 4.525 . 0 0 "[ . 1 . 2]" 1
1718 1 82 VAL HA 1 90 ILE MG . . 4.020 3.816 3.627 3.993 . 0 0 "[ . 1 . 2]" 1
1719 1 82 VAL HA 1 91 ASN H . . 4.720 4.264 4.107 4.419 . 0 0 "[ . 1 . 2]" 1
1720 1 82 VAL HA 1 92 ASN HA . . 3.450 2.183 2.093 2.235 . 0 0 "[ . 1 . 2]" 1
1721 1 82 VAL HA 1 92 ASN HB2 . . 5.310 5.195 5.115 5.241 . 0 0 "[ . 1 . 2]" 1
1722 1 82 VAL HA 1 92 ASN HD21 . . 4.680 3.615 3.334 3.887 . 0 0 "[ . 1 . 2]" 1
1723 1 82 VAL HA 1 92 ASN HD22 . . 5.120 4.712 4.557 4.893 . 0 0 "[ . 1 . 2]" 1
1724 1 82 VAL HA 1 93 LEU H . . 4.090 3.816 3.651 3.923 . 0 0 "[ . 1 . 2]" 1
1725 1 82 VAL HB 1 83 VAL H . . 3.050 2.563 2.405 2.874 . 0 0 "[ . 1 . 2]" 1
1726 1 82 VAL HB 1 90 ILE HB . . 4.860 4.648 4.500 4.861 0.001 10 0 "[ . 1 . 2]" 1
1727 1 82 VAL HB 1 90 ILE MD . . 4.230 4.161 4.007 4.237 0.007 7 0 "[ . 1 . 2]" 1
1728 1 82 VAL HB 1 90 ILE MG . . 3.220 2.105 2.012 2.243 . 0 0 "[ . 1 . 2]" 1
1729 1 82 VAL HB 1 91 ASN H . . 3.840 3.634 3.432 3.861 0.021 17 0 "[ . 1 . 2]" 1
1730 1 82 VAL HB 1 92 ASN HA . . 4.380 3.901 3.717 4.094 . 0 0 "[ . 1 . 2]" 1
1731 1 82 VAL MG1 1 90 ILE MG . . 3.010 2.870 2.715 2.988 . 0 0 "[ . 1 . 2]" 1
1732 1 82 VAL MG1 1 92 ASN HA . . 3.500 2.596 2.195 2.715 . 0 0 "[ . 1 . 2]" 1
1733 1 82 VAL MG1 1 92 ASN HB2 . . 4.730 4.527 4.386 4.616 . 0 0 "[ . 1 . 2]" 1
1734 1 82 VAL MG1 1 92 ASN HD21 . . 4.120 2.226 1.924 2.417 . 0 0 "[ . 1 . 2]" 1
1735 1 82 VAL MG1 1 92 ASN HD22 . . 4.030 2.465 2.341 2.612 . 0 0 "[ . 1 . 2]" 1
1736 1 82 VAL MG2 1 83 VAL HA . . 4.000 3.713 3.515 3.919 . 0 0 "[ . 1 . 2]" 1
1737 1 82 VAL MG2 1 90 ILE MD . . 3.800 3.801 3.786 3.808 0.008 13 0 "[ . 1 . 2]" 1
1738 1 82 VAL MG2 1 90 ILE MG . . 3.130 2.662 2.526 2.773 . 0 0 "[ . 1 . 2]" 1
1739 1 82 VAL MG2 1 92 ASN HA . . 4.680 4.667 4.569 4.713 0.033 17 0 "[ . 1 . 2]" 1
1740 1 82 VAL MG2 1 92 ASN HD21 . . 4.920 4.698 4.449 4.871 . 0 0 "[ . 1 . 2]" 1
1741 1 83 VAL H 1 83 VAL MG1 . . 2.950 2.300 2.177 2.501 . 0 0 "[ . 1 . 2]" 1
1742 1 83 VAL H 1 84 THR H . . 4.440 4.293 4.235 4.381 . 0 0 "[ . 1 . 2]" 1
1743 1 83 VAL H 1 90 ILE MG . . 3.490 2.847 2.650 3.138 . 0 0 "[ . 1 . 2]" 1
1744 1 83 VAL H 1 91 ASN H . . 3.550 2.512 2.362 2.740 . 0 0 "[ . 1 . 2]" 1
1745 1 83 VAL H 1 92 ASN H . . 5.500 4.942 4.890 5.048 . 0 0 "[ . 1 . 2]" 1
1746 1 83 VAL H 1 92 ASN HA . . 4.030 3.823 3.704 3.919 . 0 0 "[ . 1 . 2]" 1
1747 1 83 VAL HA 1 83 VAL MG1 . . 3.200 3.189 3.186 3.201 0.001 1 0 "[ . 1 . 2]" 1
1748 1 83 VAL HA 1 83 VAL MG2 . . 3.060 2.284 2.195 2.380 . 0 0 "[ . 1 . 2]" 1
1749 1 83 VAL HA 1 84 THR H . . 2.610 2.224 2.191 2.260 . 0 0 "[ . 1 . 2]" 1
1750 1 83 VAL HA 1 84 THR HB . . 5.470 5.001 4.937 5.101 . 0 0 "[ . 1 . 2]" 1
1751 1 83 VAL HB 1 93 LEU HB2 . . 4.790 4.349 4.088 4.563 . 0 0 "[ . 1 . 2]" 1
1752 1 83 VAL HB 1 93 LEU HB3 . . 5.500 5.452 5.209 5.542 0.042 17 0 "[ . 1 . 2]" 1
1753 1 83 VAL HB 1 93 LEU QD . . 4.430 3.819 3.048 4.150 . 0 0 "[ . 1 . 2]" 1
1754 1 83 VAL MG1 1 91 ASN HA . . 4.980 4.943 4.868 4.982 0.002 18 0 "[ . 1 . 2]" 1
1755 1 83 VAL MG1 1 91 ASN HB2 . . 4.280 4.131 3.962 4.271 . 0 0 "[ . 1 . 2]" 1
1756 1 83 VAL MG1 1 91 ASN HB3 . . 4.870 4.824 4.670 4.888 0.018 13 0 "[ . 1 . 2]" 1
1757 1 83 VAL MG1 1 91 ASN HD21 . . 4.550 2.947 2.688 3.210 . 0 0 "[ . 1 . 2]" 1
1758 1 83 VAL MG1 1 91 ASN HD22 . . 4.660 2.421 2.267 2.540 . 0 0 "[ . 1 . 2]" 1
1759 1 83 VAL MG1 1 92 ASN H . . 5.070 5.043 4.969 5.083 0.013 19 0 "[ . 1 . 2]" 1
1760 1 83 VAL MG1 1 92 ASN HA . . 5.400 4.442 4.273 4.541 . 0 0 "[ . 1 . 2]" 1
1761 1 83 VAL MG1 1 93 LEU HB2 . . 3.500 3.160 2.938 3.524 0.024 17 0 "[ . 1 . 2]" 1
1762 1 83 VAL MG2 1 84 THR H . . 2.870 2.210 1.927 2.374 . 0 0 "[ . 1 . 2]" 1
1763 1 83 VAL MG2 1 84 THR HA . . 4.120 4.018 3.892 4.122 0.002 17 0 "[ . 1 . 2]" 1
1764 1 83 VAL MG2 1 91 ASN HD22 . . 4.480 4.243 4.110 4.484 0.004 6 0 "[ . 1 . 2]" 1
1765 1 84 THR H 1 84 THR HB . . 2.850 2.783 2.732 2.863 0.013 17 0 "[ . 1 . 2]" 1
1766 1 84 THR H 1 84 THR MG . . 3.960 3.765 3.740 3.778 . 0 0 "[ . 1 . 2]" 1
1767 1 84 THR H 1 85 SER H . . 4.460 4.393 4.349 4.505 0.045 17 0 "[ . 1 . 2]" 1
1768 1 84 THR H 1 90 ILE MD . . 4.340 3.269 3.092 3.469 . 0 0 "[ . 1 . 2]" 1
1769 1 84 THR H 1 91 ASN H . . 5.120 4.862 4.745 4.988 . 0 0 "[ . 1 . 2]" 1
1770 1 84 THR HA 1 84 THR MG . . 3.120 2.176 2.070 2.304 . 0 0 "[ . 1 . 2]" 1
1771 1 84 THR HA 1 85 SER H . . 3.190 2.149 2.141 2.157 . 0 0 "[ . 1 . 2]" 1
1772 1 84 THR HA 1 88 GLY H . . 5.480 5.456 5.363 5.502 0.022 4 0 "[ . 1 . 2]" 1
1773 1 84 THR HA 1 90 ILE HA . . 3.340 2.159 2.000 2.315 . 0 0 "[ . 1 . 2]" 1
1774 1 84 THR HA 1 90 ILE MD . . 3.850 1.976 1.961 2.030 . 0 0 "[ . 1 . 2]" 1
1775 1 84 THR HA 1 90 ILE HG12 . . 4.270 4.029 3.913 4.180 . 0 0 "[ . 1 . 2]" 1
1776 1 84 THR HA 1 90 ILE HG13 . . 5.020 4.836 4.762 4.918 . 0 0 "[ . 1 . 2]" 1
1777 1 84 THR HA 1 90 ILE MG . . 4.070 3.473 3.428 3.517 . 0 0 "[ . 1 . 2]" 1
1778 1 84 THR HA 1 91 ASN H . . 3.930 3.619 3.481 3.726 . 0 0 "[ . 1 . 2]" 1
1779 1 84 THR HB 1 85 SER H . . 4.350 4.168 3.954 4.238 . 0 0 "[ . 1 . 2]" 1
1780 1 84 THR HB 1 90 ILE HA . . 5.500 5.094 4.934 5.252 . 0 0 "[ . 1 . 2]" 1
1781 1 84 THR HB 1 90 ILE MD . . 4.470 3.516 3.463 3.618 . 0 0 "[ . 1 . 2]" 1
1782 1 84 THR HB 1 90 ILE MG . . 5.500 5.509 5.482 5.559 0.059 17 0 "[ . 1 . 2]" 1
1783 1 84 THR MG 1 85 SER H . . 3.160 3.001 2.567 3.152 . 0 0 "[ . 1 . 2]" 1
1784 1 84 THR MG 1 88 GLY H . . 3.580 3.407 3.246 3.514 . 0 0 "[ . 1 . 2]" 1
1785 1 84 THR MG 1 88 GLY HA2 . . 3.810 2.289 1.927 2.473 . 0 0 "[ . 1 . 2]" 1
1786 1 84 THR MG 1 88 GLY QA . . 3.230 2.268 1.911 2.445 . 0 0 "[ . 1 . 2]" 1
1787 1 84 THR MG 1 88 GLY HA3 . . 3.810 3.675 3.185 3.828 0.018 9 0 "[ . 1 . 2]" 1
1788 1 84 THR MG 1 89 THR H . . 3.540 3.478 3.299 3.550 0.010 17 0 "[ . 1 . 2]" 1
1789 1 84 THR MG 1 90 ILE H . . 3.980 3.727 3.564 3.929 . 0 0 "[ . 1 . 2]" 1
1790 1 84 THR MG 1 90 ILE HA . . 3.740 3.358 3.146 3.512 . 0 0 "[ . 1 . 2]" 1
1791 1 84 THR MG 1 90 ILE HB . . 5.070 5.004 4.797 5.079 0.009 17 0 "[ . 1 . 2]" 1
1792 1 84 THR MG 1 90 ILE MD . . 3.580 1.985 1.851 2.247 . 0 0 "[ . 1 . 2]" 1
1793 1 84 THR MG 1 90 ILE HG13 . . 4.340 4.235 4.068 4.335 . 0 0 "[ . 1 . 2]" 1
1794 1 84 THR MG 1 90 ILE MG . . 4.420 4.214 4.081 4.287 . 0 0 "[ . 1 . 2]" 1
1795 1 85 SER H 1 85 SER HB2 . . 3.580 3.111 2.165 3.549 . 0 0 "[ . 1 . 2]" 1
1796 1 85 SER H 1 85 SER QB . . 3.100 2.141 2.058 2.258 . 0 0 "[ . 1 . 2]" 1
1797 1 85 SER H 1 85 SER HB3 . . 3.580 2.491 2.081 3.488 . 0 0 "[ . 1 . 2]" 1
1798 1 85 SER H 1 88 GLY H . . 4.540 4.352 4.091 4.528 . 0 0 "[ . 1 . 2]" 1
1799 1 85 SER H 1 89 THR H . . 3.660 3.438 3.202 3.651 . 0 0 "[ . 1 . 2]" 1
1800 1 85 SER H 1 89 THR HA . . 4.830 4.722 4.497 4.835 0.005 19 0 "[ . 1 . 2]" 1
1801 1 85 SER H 1 90 ILE HA . . 3.630 3.060 2.943 3.204 . 0 0 "[ . 1 . 2]" 1
1802 1 85 SER H 1 90 ILE MD . . 4.430 3.732 3.546 3.899 . 0 0 "[ . 1 . 2]" 1
1803 1 85 SER H 1 90 ILE HG12 . . 5.290 5.276 5.133 5.332 0.042 19 0 "[ . 1 . 2]" 1
1804 1 85 SER H 1 90 ILE MG . . 4.860 4.745 4.649 4.867 0.007 5 0 "[ . 1 . 2]" 1
1805 1 85 SER H 1 91 ASN H . . 4.080 3.934 3.693 4.087 0.007 5 0 "[ . 1 . 2]" 1
1806 1 85 SER HA 1 88 GLY H . . 5.000 4.795 4.669 5.006 0.006 11 0 "[ . 1 . 2]" 1
1807 1 85 SER HA 1 89 THR H . . 5.270 5.044 4.848 5.285 0.015 4 0 "[ . 1 . 2]" 1
1808 1 85 SER QB 1 89 THR H . . 3.800 3.323 3.017 3.699 . 0 0 "[ . 1 . 2]" 1
1809 1 85 SER QB 1 89 THR MG . . 4.530 4.282 4.065 4.538 0.008 20 0 "[ . 1 . 2]" 1
1810 1 85 SER QB 1 91 ASN HB2 . . 5.340 5.061 4.854 5.253 . 0 0 "[ . 1 . 2]" 1
1811 1 85 SER QB 1 91 ASN HD22 . . 4.150 3.469 3.021 3.707 . 0 0 "[ . 1 . 2]" 1
1812 1 85 SER HB2 1 91 ASN HD21 . . 5.500 5.233 4.846 5.539 0.039 17 0 "[ . 1 . 2]" 1
1813 1 85 SER HB2 1 91 ASN HD22 . . 4.720 3.922 3.476 4.343 . 0 0 "[ . 1 . 2]" 1
1814 1 85 SER HB3 1 91 ASN HD21 . . 5.500 5.174 4.453 5.556 0.056 13 0 "[ . 1 . 2]" 1
1815 1 85 SER HB3 1 91 ASN HD22 . . 4.720 3.970 3.116 4.384 . 0 0 "[ . 1 . 2]" 1
1816 1 86 GLN HA 1 86 GLN QG . . 3.560 3.349 3.258 3.421 . 0 0 "[ . 1 . 2]" 1
1817 1 86 GLN QB 1 87 LEU HA . . 4.580 4.405 4.316 4.575 . 0 0 "[ . 1 . 2]" 1
1818 1 86 GLN QB 1 87 LEU MD1 . . 4.190 3.872 3.393 4.204 0.014 5 0 "[ . 1 . 2]" 1
1819 1 86 GLN QB 1 87 LEU MD2 . . 4.120 3.399 2.398 3.820 . 0 0 "[ . 1 . 2]" 1
1820 1 86 GLN QB 1 88 GLY H . . 5.180 4.639 4.584 4.821 . 0 0 "[ . 1 . 2]" 1
1821 1 86 GLN QG 1 87 LEU H . . 4.420 2.502 2.247 3.144 . 0 0 "[ . 1 . 2]" 1
1822 1 86 GLN QG 1 87 LEU HA . . 4.600 3.708 3.278 3.905 . 0 0 "[ . 1 . 2]" 1
1823 1 86 GLN QG 1 87 LEU MD1 . . 3.830 2.650 1.925 3.481 . 0 0 "[ . 1 . 2]" 1
1824 1 86 GLN QG 1 87 LEU MD2 . . 4.250 1.807 1.706 2.103 . 0 0 "[ . 1 . 2]" 1
1825 1 86 GLN QG 1 87 LEU HG . . 4.190 4.190 3.960 4.311 0.121 17 0 "[ . 1 . 2]" 1
1826 1 86 GLN QG 1 88 GLY H . . 5.010 4.469 4.355 4.693 . 0 0 "[ . 1 . 2]" 1
1827 1 87 LEU H 1 87 LEU MD2 . . 4.630 1.974 1.881 2.179 . 0 0 "[ . 1 . 2]" 1
1828 1 87 LEU H 1 88 GLY H . . 3.880 2.522 2.297 2.663 . 0 0 "[ . 1 . 2]" 1
1829 1 87 LEU H 1 89 THR H . . 4.600 3.368 3.149 3.447 . 0 0 "[ . 1 . 2]" 1
1830 1 87 LEU HA 1 87 LEU MD1 . . 2.860 2.044 1.977 2.080 . 0 0 "[ . 1 . 2]" 1
1831 1 87 LEU HA 1 87 LEU MD2 . . 3.590 3.109 2.825 3.420 . 0 0 "[ . 1 . 2]" 1
1832 1 87 LEU HA 1 87 LEU HG . . 3.810 3.686 3.642 3.700 . 0 0 "[ . 1 . 2]" 1
1833 1 87 LEU HA 1 88 GLY H . . 3.250 3.204 3.084 3.262 0.012 20 0 "[ . 1 . 2]" 1
1834 1 87 LEU HA 1 88 GLY QA . . 4.880 4.154 4.111 4.167 . 0 0 "[ . 1 . 2]" 1
1835 1 87 LEU HB2 1 87 LEU MD1 . . 3.230 3.178 3.151 3.190 . 0 0 "[ . 1 . 2]" 1
1836 1 87 LEU HB2 1 87 LEU MD2 . . 3.080 2.142 2.059 2.206 . 0 0 "[ . 1 . 2]" 1
1837 1 87 LEU HB2 1 88 GLY H . . 4.090 3.669 3.540 3.863 . 0 0 "[ . 1 . 2]" 1
1838 1 87 LEU HB2 1 89 THR H . . 4.040 3.087 2.868 3.254 . 0 0 "[ . 1 . 2]" 1
1839 1 87 LEU HB2 1 89 THR MG . . 4.920 2.562 2.041 2.858 . 0 0 "[ . 1 . 2]" 1
1840 1 87 LEU HB3 1 87 LEU MD1 . . 3.000 2.432 2.326 2.590 . 0 0 "[ . 1 . 2]" 1
1841 1 87 LEU HB3 1 87 LEU MD2 . . 3.240 3.158 3.122 3.181 . 0 0 "[ . 1 . 2]" 1
1842 1 87 LEU HB3 1 88 GLY H . . 4.440 4.270 4.184 4.399 . 0 0 "[ . 1 . 2]" 1
1843 1 87 LEU HB3 1 89 THR H . . 4.320 3.962 3.788 4.250 . 0 0 "[ . 1 . 2]" 1
1844 1 87 LEU HB3 1 89 THR MG . . 4.590 2.634 2.377 2.836 . 0 0 "[ . 1 . 2]" 1
1845 1 87 LEU MD1 1 88 GLY H . . 4.820 4.517 4.265 4.682 . 0 0 "[ . 1 . 2]" 1
1846 1 87 LEU MD1 1 89 THR MG . . 4.550 4.368 4.108 4.577 0.027 4 0 "[ . 1 . 2]" 1
1847 1 87 LEU MD2 1 88 GLY H . . 5.050 4.093 3.929 4.242 . 0 0 "[ . 1 . 2]" 1
1848 1 87 LEU MD2 1 89 THR H . . 4.570 4.304 3.943 4.586 0.016 1 0 "[ . 1 . 2]" 1
1849 1 88 GLY H 1 88 GLY HA2 . . 2.950 2.312 2.307 2.333 . 0 0 "[ . 1 . 2]" 1
1850 1 88 GLY H 1 88 GLY HA3 . . 2.950 2.871 2.861 2.901 . 0 0 "[ . 1 . 2]" 1
1851 1 88 GLY H 1 89 THR H . . 2.940 2.519 2.426 2.605 . 0 0 "[ . 1 . 2]" 1
1852 1 88 GLY H 1 89 THR MG . . 4.280 4.135 4.014 4.246 . 0 0 "[ . 1 . 2]" 1
1853 1 88 GLY QA 1 89 THR HA . . 5.200 4.025 4.015 4.075 . 0 0 "[ . 1 . 2]" 1
1854 1 88 GLY HA2 1 89 THR H . . 3.550 3.143 3.074 3.223 . 0 0 "[ . 1 . 2]" 1
1855 1 88 GLY HA3 1 89 THR H . . 3.550 3.386 3.327 3.434 . 0 0 "[ . 1 . 2]" 1
1856 1 89 THR H 1 89 THR HB . . 3.880 3.746 3.645 3.781 . 0 0 "[ . 1 . 2]" 1
1857 1 89 THR H 1 89 THR MG . . 3.110 2.497 2.097 2.679 . 0 0 "[ . 1 . 2]" 1
1858 1 89 THR H 1 90 ILE H . . 4.430 4.397 4.309 4.482 0.052 9 0 "[ . 1 . 2]" 1
1859 1 89 THR H 1 90 ILE HA . . 5.270 5.072 4.984 5.282 0.012 17 0 "[ . 1 . 2]" 1
1860 1 89 THR HA 1 89 THR MG . . 2.990 2.408 2.314 2.445 . 0 0 "[ . 1 . 2]" 1
1861 1 89 THR HA 1 90 ILE H . . 2.700 2.154 2.141 2.207 . 0 0 "[ . 1 . 2]" 1
1862 1 89 THR HA 1 90 ILE MD . . 4.780 4.352 4.261 4.450 . 0 0 "[ . 1 . 2]" 1
1863 1 89 THR HA 1 90 ILE HG12 . . 4.340 3.630 3.545 3.679 . 0 0 "[ . 1 . 2]" 1
1864 1 89 THR HB 1 90 ILE H . . 3.750 3.340 2.990 3.607 . 0 0 "[ . 1 . 2]" 1
1865 1 89 THR HB 1 90 ILE HA . . 5.500 5.137 5.027 5.204 . 0 0 "[ . 1 . 2]" 1
1866 1 90 ILE H 1 90 ILE MD . . 3.830 3.207 3.031 3.339 . 0 0 "[ . 1 . 2]" 1
1867 1 90 ILE H 1 90 ILE HG12 . . 2.880 1.998 1.925 2.098 . 0 0 "[ . 1 . 2]" 1
1868 1 90 ILE H 1 90 ILE HG13 . . 3.530 3.499 3.449 3.539 0.009 9 0 "[ . 1 . 2]" 1
1869 1 90 ILE HA 1 90 ILE MD . . 3.530 2.043 1.974 2.165 . 0 0 "[ . 1 . 2]" 1
1870 1 90 ILE HA 1 90 ILE HG12 . . 3.900 3.086 3.021 3.140 . 0 0 "[ . 1 . 2]" 1
1871 1 90 ILE HA 1 90 ILE HG13 . . 3.820 3.783 3.775 3.793 . 0 0 "[ . 1 . 2]" 1
1872 1 90 ILE HA 1 90 ILE MG . . 3.340 2.295 2.255 2.346 . 0 0 "[ . 1 . 2]" 1
1873 1 90 ILE HA 1 91 ASN H . . 2.840 2.198 2.148 2.252 . 0 0 "[ . 1 . 2]" 1
1874 1 90 ILE HB 1 90 ILE MD . . 3.710 3.224 3.219 3.230 . 0 0 "[ . 1 . 2]" 1
1875 1 90 ILE MD 1 90 ILE MG . . 2.830 2.035 1.965 2.092 . 0 0 "[ . 1 . 2]" 1
1876 1 90 ILE MD 1 91 ASN H . . 4.220 3.641 3.522 3.826 . 0 0 "[ . 1 . 2]" 1
1877 1 90 ILE HG12 1 90 ILE MG . . 3.550 3.200 3.198 3.201 . 0 0 "[ . 1 . 2]" 1
1878 1 90 ILE HG13 1 90 ILE MG . . 3.410 2.371 2.316 2.431 . 0 0 "[ . 1 . 2]" 1
1879 1 90 ILE MG 1 91 ASN H . . 3.100 2.392 2.170 2.686 . 0 0 "[ . 1 . 2]" 1
1880 1 90 ILE MG 1 91 ASN HA . . 4.730 3.482 3.336 3.628 . 0 0 "[ . 1 . 2]" 1
1881 1 90 ILE MG 1 92 ASN H . . 5.000 4.756 4.621 4.888 . 0 0 "[ . 1 . 2]" 1
1882 1 90 ILE MG 1 92 ASN HA . . 4.640 4.609 4.512 4.667 0.027 17 0 "[ . 1 . 2]" 1
1883 1 91 ASN H 1 91 ASN HB2 . . 3.950 3.770 3.632 3.833 . 0 0 "[ . 1 . 2]" 1
1884 1 91 ASN H 1 91 ASN HB3 . . 3.700 3.552 3.448 3.666 . 0 0 "[ . 1 . 2]" 1
1885 1 91 ASN H 1 91 ASN HD21 . . 4.620 4.173 3.834 4.346 . 0 0 "[ . 1 . 2]" 1
1886 1 91 ASN H 1 92 ASN H . . 4.480 4.404 4.360 4.448 . 0 0 "[ . 1 . 2]" 1
1887 1 91 ASN HA 1 91 ASN HD21 . . 4.840 4.383 4.361 4.418 . 0 0 "[ . 1 . 2]" 1
1888 1 91 ASN HA 1 92 ASN H . . 3.200 2.344 2.310 2.384 . 0 0 "[ . 1 . 2]" 1
1889 1 91 ASN HA 1 92 ASN HA . . 5.210 4.323 4.320 4.326 . 0 0 "[ . 1 . 2]" 1
1890 1 91 ASN HB2 1 92 ASN H . . 3.670 2.620 2.524 2.700 . 0 0 "[ . 1 . 2]" 1
1891 1 91 ASN HD21 1 92 ASN H . . 4.510 4.206 4.034 4.451 . 0 0 "[ . 1 . 2]" 1
1892 1 92 ASN H 1 92 ASN HB2 . . 3.420 2.379 2.317 2.446 . 0 0 "[ . 1 . 2]" 1
1893 1 92 ASN H 1 92 ASN HB3 . . 3.800 3.592 3.572 3.609 . 0 0 "[ . 1 . 2]" 1
1894 1 92 ASN H 1 92 ASN HD21 . . 4.460 4.355 4.191 4.458 . 0 0 "[ . 1 . 2]" 1
1895 1 92 ASN H 1 92 ASN HD22 . . 4.890 4.666 4.508 4.798 . 0 0 "[ . 1 . 2]" 1
1896 1 92 ASN H 1 93 LEU H . . 4.700 4.557 4.525 4.589 . 0 0 "[ . 1 . 2]" 1
1897 1 92 ASN HA 1 92 ASN HD21 . . 4.250 2.394 2.138 2.624 . 0 0 "[ . 1 . 2]" 1
1898 1 92 ASN HA 1 92 ASN HD22 . . 5.080 3.594 3.476 3.732 . 0 0 "[ . 1 . 2]" 1
1899 1 92 ASN HA 1 93 LEU H . . 3.290 2.529 2.442 2.603 . 0 0 "[ . 1 . 2]" 1
1900 1 92 ASN HB2 1 93 LEU H . . 3.720 3.466 3.308 3.591 . 0 0 "[ . 1 . 2]" 1
1901 1 92 ASN HD21 1 93 LEU H . . 3.840 3.315 3.121 3.508 . 0 0 "[ . 1 . 2]" 1
1902 1 92 ASN HD22 1 93 LEU H . . 5.200 4.943 4.767 5.124 . 0 0 "[ . 1 . 2]" 1
1903 1 93 LEU H 1 93 LEU HB2 . . 3.480 3.154 2.719 3.331 . 0 0 "[ . 1 . 2]" 1
1904 1 93 LEU H 1 93 LEU HB3 . . 3.520 2.809 2.658 3.238 . 0 0 "[ . 1 . 2]" 1
1905 1 93 LEU H 1 94 ILE H . . 4.350 4.283 4.180 4.373 0.023 9 0 "[ . 1 . 2]" 1
1906 1 93 LEU HA 1 93 LEU QD . . 3.280 2.134 1.961 2.409 . 0 0 "[ . 1 . 2]" 1
1907 1 93 LEU HA 1 93 LEU HG . . 4.180 3.192 2.498 3.661 . 0 0 "[ . 1 . 2]" 1
1908 1 93 LEU HA 1 94 ILE H . . 3.090 2.168 2.141 2.231 . 0 0 "[ . 1 . 2]" 1
1909 1 93 LEU HA 1 94 ILE MG . . 4.740 3.616 3.524 3.719 . 0 0 "[ . 1 . 2]" 1
1910 1 93 LEU HB2 1 93 LEU MD1 . . 3.540 2.401 2.230 3.180 . 0 0 "[ . 1 . 2]" 1
1911 1 93 LEU HB2 1 93 LEU QD . . 2.980 2.109 2.038 2.344 . 0 0 "[ . 1 . 2]" 1
1912 1 93 LEU HB2 1 93 LEU MD2 . . 3.540 2.427 2.208 3.192 . 0 0 "[ . 1 . 2]" 1
1913 1 93 LEU HB2 1 94 ILE H . . 4.530 4.192 3.957 4.499 . 0 0 "[ . 1 . 2]" 1
1914 1 93 LEU HB3 1 93 LEU MD1 . . 3.330 3.027 2.270 3.194 . 0 0 "[ . 1 . 2]" 1
1915 1 93 LEU HB3 1 93 LEU MD2 . . 3.330 2.415 2.285 3.160 . 0 0 "[ . 1 . 2]" 1
1916 1 93 LEU HB3 1 94 ILE H . . 4.250 4.074 3.630 4.252 0.002 18 0 "[ . 1 . 2]" 1
1917 1 93 LEU QD 1 94 ILE H . . 3.070 2.040 1.831 2.429 . 0 0 "[ . 1 . 2]" 1
1918 1 93 LEU QD 1 94 ILE HA . . 4.600 3.887 3.440 4.011 . 0 0 "[ . 1 . 2]" 1
1919 1 93 LEU QD 1 95 HIS HA . . 4.420 4.375 4.204 4.452 0.032 16 0 "[ . 1 . 2]" 1
1920 1 93 LEU QD 1 95 HIS QB . . 4.690 4.325 3.551 4.576 . 0 0 "[ . 1 . 2]" 1
1921 1 93 LEU QD 1 95 HIS HD2 . . 4.460 3.310 2.167 4.328 . 0 0 "[ . 1 . 2]" 1
1922 1 93 LEU MD1 1 95 HIS HD2 . . 5.300 3.731 2.170 4.780 . 0 0 "[ . 1 . 2]" 1
1923 1 93 LEU MD2 1 95 HIS HD2 . . 5.300 3.915 3.051 4.947 . 0 0 "[ . 1 . 2]" 1
1924 1 93 LEU HG 1 94 ILE H . . 4.200 3.356 2.792 4.331 0.131 17 0 "[ . 1 . 2]" 1
1925 1 94 ILE H 1 94 ILE HB . . 4.000 3.215 3.097 3.321 . 0 0 "[ . 1 . 2]" 1
1926 1 94 ILE H 1 94 ILE QG . . 4.720 4.042 4.005 4.075 . 0 0 "[ . 1 . 2]" 1
1927 1 94 ILE H 1 94 ILE MG . . 3.170 2.221 2.100 2.361 . 0 0 "[ . 1 . 2]" 1
1928 1 94 ILE H 1 95 HIS H . . 4.560 4.407 4.357 4.479 . 0 0 "[ . 1 . 2]" 1
1929 1 94 ILE H 1 95 HIS HA . . 5.130 4.874 4.786 5.002 . 0 0 "[ . 1 . 2]" 1
1930 1 94 ILE HA 1 94 ILE MD . . 3.580 3.393 3.316 3.467 . 0 0 "[ . 1 . 2]" 1
1931 1 94 ILE HA 1 94 ILE HG12 . . 3.970 3.524 3.500 3.571 . 0 0 "[ . 1 . 2]" 1
1932 1 94 ILE HA 1 94 ILE QG . . 3.380 2.336 2.298 2.364 . 0 0 "[ . 1 . 2]" 1
1933 1 94 ILE HA 1 94 ILE HG13 . . 3.970 2.370 2.329 2.400 . 0 0 "[ . 1 . 2]" 1
1934 1 94 ILE HA 1 94 ILE MG . . 3.530 3.199 3.197 3.200 . 0 0 "[ . 1 . 2]" 1
1935 1 94 ILE HA 1 95 HIS H . . 3.110 2.219 2.173 2.239 . 0 0 "[ . 1 . 2]" 1
1936 1 94 ILE HB 1 94 ILE MD . . 3.380 2.190 2.117 2.246 . 0 0 "[ . 1 . 2]" 1
1937 1 94 ILE HB 1 95 HIS H . . 4.070 4.002 3.972 4.085 0.015 18 0 "[ . 1 . 2]" 1
1938 1 94 ILE MD 1 94 ILE MG . . 2.610 2.482 2.394 2.543 . 0 0 "[ . 1 . 2]" 1
1939 1 94 ILE MD 1 96 VAL HA . . 4.870 4.780 4.649 4.877 0.007 6 0 "[ . 1 . 2]" 1
1940 1 94 ILE MD 1 96 VAL HB . . 5.500 5.460 5.206 5.507 0.007 15 0 "[ . 1 . 2]" 1
1941 1 94 ILE QG 1 94 ILE MG . . 3.070 2.146 2.131 2.163 . 0 0 "[ . 1 . 2]" 1
1942 1 94 ILE QG 1 96 VAL HA . . 4.930 4.125 4.038 4.223 . 0 0 "[ . 1 . 2]" 1
1943 1 94 ILE QG 1 96 VAL MG2 . . 3.450 2.271 2.178 2.513 . 0 0 "[ . 1 . 2]" 1
1944 1 94 ILE HG12 1 94 ILE MG . . 3.530 2.188 2.173 2.206 . 0 0 "[ . 1 . 2]" 1
1945 1 94 ILE HG12 1 95 HIS H . . 3.460 3.236 3.117 3.463 0.003 5 0 "[ . 1 . 2]" 1
1946 1 94 ILE HG12 1 96 VAL MG2 . . 4.090 2.318 2.211 2.587 . 0 0 "[ . 1 . 2]" 1
1947 1 94 ILE HG13 1 94 ILE MG . . 3.530 3.102 3.076 3.121 . 0 0 "[ . 1 . 2]" 1
1948 1 94 ILE HG13 1 95 HIS H . . 3.460 2.025 1.944 2.292 . 0 0 "[ . 1 . 2]" 1
1949 1 94 ILE HG13 1 96 VAL MG2 . . 4.090 3.256 3.114 3.409 . 0 0 "[ . 1 . 2]" 1
1950 1 94 ILE MG 1 95 HIS HA . . 4.710 3.879 3.741 3.986 . 0 0 "[ . 1 . 2]" 1
1951 1 95 HIS H 1 95 HIS HB2 . . 3.850 2.854 2.647 3.491 . 0 0 "[ . 1 . 2]" 1
1952 1 95 HIS H 1 95 HIS HB3 . . 3.850 3.650 2.752 3.863 0.013 8 0 "[ . 1 . 2]" 1
1953 1 95 HIS H 1 96 VAL H . . 4.120 4.047 3.895 4.141 0.021 2 0 "[ . 1 . 2]" 1
1954 1 95 HIS H 1 96 VAL HA . . 4.880 4.676 4.556 4.761 . 0 0 "[ . 1 . 2]" 1
1955 1 95 HIS HA 1 95 HIS HD2 . . 4.500 3.533 3.093 4.160 . 0 0 "[ . 1 . 2]" 1
1956 1 95 HIS HA 1 96 VAL H . . 3.080 2.161 2.142 2.186 . 0 0 "[ . 1 . 2]" 1
1957 1 95 HIS HA 1 96 VAL MG2 . . 5.060 3.832 3.697 3.949 . 0 0 "[ . 1 . 2]" 1
1958 1 95 HIS QB 1 96 VAL H . . 4.040 3.592 3.421 3.934 . 0 0 "[ . 1 . 2]" 1
1959 1 95 HIS QB 1 96 VAL MG2 . . 5.340 4.745 4.635 4.953 . 0 0 "[ . 1 . 2]" 1
1960 1 95 HIS QB 1 97 LYS QE . . 4.400 3.800 2.580 4.443 0.043 10 0 "[ . 1 . 2]" 1
1961 1 95 HIS QB 1 97 LYS QG . . 4.720 4.014 3.700 4.697 . 0 0 "[ . 1 . 2]" 1
1962 1 95 HIS HB2 1 96 VAL H . . 4.670 4.341 3.913 4.611 . 0 0 "[ . 1 . 2]" 1
1963 1 95 HIS HB2 1 97 LYS QG . . 5.370 4.744 3.886 5.421 0.051 13 0 "[ . 1 . 2]" 1
1964 1 95 HIS HB3 1 96 VAL H . . 4.670 3.845 3.605 4.341 . 0 0 "[ . 1 . 2]" 1
1965 1 95 HIS HB3 1 97 LYS QG . . 5.370 4.452 3.915 5.440 0.070 14 0 "[ . 1 . 2]" 1
1966 1 96 VAL H 1 96 VAL HB . . 3.480 2.504 2.463 2.553 . 0 0 "[ . 1 . 2]" 1
1967 1 96 VAL H 1 96 VAL MG1 . . 3.880 3.789 3.771 3.814 . 0 0 "[ . 1 . 2]" 1
1968 1 96 VAL H 1 96 VAL MG2 . . 3.220 2.506 2.279 2.745 . 0 0 "[ . 1 . 2]" 1
1969 1 96 VAL H 1 97 LYS H . . 4.790 4.551 4.530 4.585 . 0 0 "[ . 1 . 2]" 1
1970 1 96 VAL H 1 97 LYS HA . . 5.350 5.198 5.097 5.325 . 0 0 "[ . 1 . 2]" 1
1971 1 96 VAL H 1 97 LYS QG . . 5.360 4.697 4.362 5.257 . 0 0 "[ . 1 . 2]" 1
1972 1 96 VAL HA 1 96 VAL MG1 . . 3.260 2.371 2.309 2.413 . 0 0 "[ . 1 . 2]" 1
1973 1 96 VAL HA 1 96 VAL MG2 . . 3.230 2.394 2.260 2.431 . 0 0 "[ . 1 . 2]" 1
1974 1 96 VAL HA 1 97 LYS H . . 2.670 2.218 2.183 2.237 . 0 0 "[ . 1 . 2]" 1
1975 1 96 VAL HA 1 97 LYS HA . . 4.750 4.406 4.372 4.432 . 0 0 "[ . 1 . 2]" 1
1976 1 96 VAL HA 1 97 LYS QG . . 4.740 3.461 3.172 4.021 . 0 0 "[ . 1 . 2]" 1
1977 1 96 VAL HB 1 97 LYS H . . 4.030 3.979 3.905 4.071 0.041 10 0 "[ . 1 . 2]" 1
1978 1 96 VAL MG1 1 97 LYS H . . 3.060 2.231 1.979 2.419 . 0 0 "[ . 1 . 2]" 1
1979 1 96 VAL MG1 1 97 LYS QE . . 5.500 4.955 4.107 5.558 0.058 14 0 "[ . 1 . 2]" 1
1980 1 96 VAL MG1 1 98 LYS H . . 4.950 4.803 4.450 4.960 0.010 7 0 "[ . 1 . 2]" 1
1981 1 96 VAL MG2 1 97 LYS H . . 3.990 3.892 3.850 3.941 . 0 0 "[ . 1 . 2]" 1
1982 1 97 LYS H 1 97 LYS HB2 . . 3.750 2.862 2.557 3.723 . 0 0 "[ . 1 . 2]" 1
1983 1 97 LYS H 1 97 LYS HB3 . . 3.960 3.743 3.438 3.867 . 0 0 "[ . 1 . 2]" 1
1984 1 97 LYS H 1 97 LYS QE . . 4.620 3.966 2.578 4.668 0.048 18 0 "[ . 1 . 2]" 1
1985 1 97 LYS H 1 97 LYS QG . . 3.200 2.659 2.156 3.259 0.059 10 0 "[ . 1 . 2]" 1
1986 1 97 LYS HA 1 97 LYS QD . . 4.460 3.624 2.095 4.468 0.008 19 0 "[ . 1 . 2]" 1
1987 1 97 LYS HA 1 97 LYS QE . . 4.240 3.171 1.992 4.505 0.265 10 0 "[ . 1 . 2]" 1
1988 1 97 LYS HA 1 97 LYS QG . . 3.470 2.758 2.484 3.301 . 0 0 "[ . 1 . 2]" 1
1989 1 97 LYS HA 1 98 LYS H . . 2.780 2.576 2.279 2.660 . 0 0 "[ . 1 . 2]" 1
1990 1 97 LYS HA 1 98 LYS HA . . 4.720 4.385 4.321 4.436 . 0 0 "[ . 1 . 2]" 1
1991 1 97 LYS HB2 1 97 LYS QD . . 3.240 2.835 2.304 3.312 0.072 8 0 "[ . 1 . 2]" 1
1992 1 97 LYS HB2 1 97 LYS QE . . 3.950 3.418 1.953 4.015 0.065 8 0 "[ . 1 . 2]" 1
1993 1 97 LYS HB2 1 98 LYS H . . 3.030 2.999 2.621 3.150 0.120 18 0 "[ . 1 . 2]" 1
1994 1 97 LYS HB3 1 97 LYS QD . . 3.250 2.391 2.000 3.466 0.216 10 0 "[ . 1 . 2]" 1
1995 1 97 LYS HB3 1 97 LYS QE . . 4.410 2.941 2.095 3.851 . 0 0 "[ . 1 . 2]" 1
1996 1 97 LYS HB3 1 98 LYS H . . 3.620 2.321 1.990 3.631 0.011 5 0 "[ . 1 . 2]" 1
1997 1 97 LYS QE 1 98 LYS H . . 5.500 4.485 3.501 5.501 0.001 14 0 "[ . 1 . 2]" 1
1998 1 97 LYS QG 1 98 LYS H . . 4.310 4.060 3.770 4.337 0.027 14 0 "[ . 1 . 2]" 1
1999 1 98 LYS H 1 98 LYS QE . . 4.720 3.863 2.221 4.720 0.000 9 0 "[ . 1 . 2]" 1
2000 1 98 LYS H 1 98 LYS QG . . 3.270 2.375 1.951 3.338 0.068 11 0 "[ . 1 . 2]" 1
2001 1 98 LYS H 1 100 ASP H . . 5.370 5.091 4.382 5.382 0.012 13 0 "[ . 1 . 2]" 1
2002 1 98 LYS HA 1 98 LYS QE . . 4.720 4.463 4.018 4.716 . 0 0 "[ . 1 . 2]" 1
2003 1 98 LYS HA 1 98 LYS QG . . 3.610 3.123 2.213 3.381 . 0 0 "[ . 1 . 2]" 1
2004 1 98 LYS HA 1 99 SER H . . 2.840 2.370 2.328 2.385 . 0 0 "[ . 1 . 2]" 1
2005 1 98 LYS HA 1 100 ASP H . . 4.340 4.107 3.862 4.321 . 0 0 "[ . 1 . 2]" 1
2006 1 98 LYS QB 1 98 LYS QE . . 3.960 2.327 1.968 3.410 . 0 0 "[ . 1 . 2]" 1
2007 1 98 LYS QB 1 99 SER H . . 3.000 2.526 2.458 2.703 . 0 0 "[ . 1 . 2]" 1
2008 1 98 LYS QB 1 100 ASP H . . 4.010 2.701 2.239 2.968 . 0 0 "[ . 1 . 2]" 1
2009 1 98 LYS QE 1 98 LYS QG . . 3.080 2.228 2.023 2.538 . 0 0 "[ . 1 . 2]" 1
2010 1 98 LYS QE 1 101 PHE QD . . 5.130 4.398 2.710 5.124 . 0 0 "[ . 1 . 2]" 1
2011 1 98 LYS QG 1 99 SER H . . 3.720 3.440 3.165 3.627 . 0 0 "[ . 1 . 2]" 1
2012 1 98 LYS QG 1 99 SER QB . . 5.150 4.996 4.785 5.157 0.007 11 0 "[ . 1 . 2]" 1
2013 1 98 LYS QG 1 100 ASP H . . 4.570 2.637 2.030 3.825 . 0 0 "[ . 1 . 2]" 1
2014 1 98 LYS QG 1 101 PHE H . . 4.720 3.206 2.207 4.744 0.024 13 0 "[ . 1 . 2]" 1
2015 1 98 LYS QG 1 101 PHE QD . . 5.070 3.857 2.150 5.082 0.012 2 0 "[ . 1 . 2]" 1
2016 1 99 SER H 1 99 SER QB . . 3.260 2.660 2.364 3.174 . 0 0 "[ . 1 . 2]" 1
2017 1 99 SER H 1 100 ASP H . . 3.610 2.459 1.982 2.831 . 0 0 "[ . 1 . 2]" 1
2018 1 99 SER H 1 100 ASP HA . . 4.900 4.569 4.286 4.868 . 0 0 "[ . 1 . 2]" 1
2019 1 99 SER H 1 101 PHE H . . 4.870 4.407 3.759 4.794 . 0 0 "[ . 1 . 2]" 1
2020 1 99 SER HA 1 100 ASP H . . 3.190 2.976 2.818 3.227 0.037 13 0 "[ . 1 . 2]" 1
2021 1 99 SER HA 1 101 PHE H . . 3.700 3.636 3.143 3.735 0.035 2 0 "[ . 1 . 2]" 1
2022 1 99 SER QB 1 100 ASP H . . 4.010 3.820 3.451 4.024 0.014 10 0 "[ . 1 . 2]" 1
2023 1 100 ASP H 1 100 ASP HB2 . . 3.510 2.686 2.216 3.591 0.081 4 0 "[ . 1 . 2]" 1
2024 1 100 ASP H 1 100 ASP QB . . 2.960 2.385 2.194 3.010 0.050 20 0 "[ . 1 . 2]" 1
2025 1 100 ASP H 1 100 ASP HB3 . . 3.510 3.029 2.265 3.513 0.003 18 0 "[ . 1 . 2]" 1
2026 1 100 ASP H 1 101 PHE H . . 3.040 2.141 2.013 2.691 . 0 0 "[ . 1 . 2]" 1
2027 1 100 ASP H 1 101 PHE QD . . 5.500 4.595 2.760 5.601 0.101 3 0 "[ . 1 . 2]" 1
2028 1 100 ASP H 1 102 GLU H . . 4.350 4.062 3.428 4.381 0.031 2 0 "[ . 1 . 2]" 1
2029 1 101 PHE H 1 101 PHE HB3 . . 2.980 2.655 2.324 2.936 . 0 0 "[ . 1 . 2]" 1
2030 1 101 PHE H 1 101 PHE QD . . 4.000 3.251 1.944 4.052 0.052 3 0 "[ . 1 . 2]" 1
2031 1 101 PHE H 1 102 GLU H . . 2.770 2.483 1.950 2.773 0.003 10 0 "[ . 1 . 2]" 1
2032 1 101 PHE H 1 102 GLU QG . . 4.450 3.733 2.991 4.445 . 0 0 "[ . 1 . 2]" 1
2033 1 101 PHE H 1 103 VAL QG . . 4.610 4.393 3.752 4.628 0.018 12 0 "[ . 1 . 2]" 1
2034 1 101 PHE HA 1 101 PHE QD . . 3.700 3.180 2.544 3.723 0.023 16 0 "[ . 1 . 2]" 1
2035 1 101 PHE HA 1 102 GLU HA . . 5.060 4.814 4.725 4.904 . 0 0 "[ . 1 . 2]" 1
2036 1 101 PHE HB2 1 102 GLU H . . 4.210 3.708 3.224 4.190 . 0 0 "[ . 1 . 2]" 1
2037 1 101 PHE HB2 1 103 VAL H . . 5.500 5.394 5.177 5.628 0.128 3 0 "[ . 1 . 2]" 1
2038 1 101 PHE HB3 1 102 GLU H . . 3.950 2.929 2.079 3.916 . 0 0 "[ . 1 . 2]" 1
2039 1 101 PHE HB3 1 103 VAL H . . 5.500 5.036 4.479 5.654 0.154 6 0 "[ . 1 . 2]" 1
2040 1 101 PHE QD 1 102 GLU H . . 3.790 3.264 2.310 3.807 0.017 2 0 "[ . 1 . 2]" 1
2041 1 101 PHE QD 1 102 GLU HA . . 4.150 3.530 3.023 4.048 . 0 0 "[ . 1 . 2]" 1
2042 1 101 PHE QD 1 102 GLU QB . . 4.980 4.495 3.026 4.992 0.012 7 0 "[ . 1 . 2]" 1
2043 1 102 GLU H 1 102 GLU HA . . 2.820 2.782 2.743 2.835 0.015 2 0 "[ . 1 . 2]" 1
2044 1 102 GLU H 1 102 GLU QB . . 2.690 2.580 2.459 2.664 . 0 0 "[ . 1 . 2]" 1
2045 1 102 GLU H 1 102 GLU QG . . 3.310 2.098 1.918 2.227 . 0 0 "[ . 1 . 2]" 1
2046 1 102 GLU H 1 103 VAL H . . 3.290 2.723 2.581 2.887 . 0 0 "[ . 1 . 2]" 1
2047 1 102 GLU HA 1 102 GLU HG2 . . 3.800 2.903 2.451 3.775 . 0 0 "[ . 1 . 2]" 1
2048 1 102 GLU HA 1 102 GLU HG3 . . 3.800 3.617 3.473 3.836 0.036 5 0 "[ . 1 . 2]" 1
2049 1 102 GLU HA 1 103 VAL QG . . 5.200 4.677 4.531 4.868 . 0 0 "[ . 1 . 2]" 1
2050 1 102 GLU QB 1 102 GLU QG . . 2.370 2.060 2.015 2.084 . 0 0 "[ . 1 . 2]" 1
2051 1 102 GLU QB 1 103 VAL H . . 3.150 2.963 2.503 3.373 0.223 8 0 "[ . 1 . 2]" 1
2052 1 102 GLU QG 1 103 VAL H . . 4.110 3.385 1.906 4.067 . 0 0 "[ . 1 . 2]" 1
2053 1 102 GLU HG2 1 103 VAL H . . 4.770 4.170 2.491 4.773 0.003 13 0 "[ . 1 . 2]" 1
2054 1 102 GLU HG3 1 103 VAL H . . 4.770 3.678 1.968 4.773 0.003 2 0 "[ . 1 . 2]" 1
2055 1 103 VAL H 1 103 VAL HB . . 2.960 2.690 2.564 2.965 0.005 8 0 "[ . 1 . 2]" 1
2056 1 103 VAL H 1 103 VAL QG . . 2.680 2.121 1.933 2.327 . 0 0 "[ . 1 . 2]" 1
2057 1 103 VAL HA 1 103 VAL QG . . 3.140 2.119 2.035 2.250 . 0 0 "[ . 1 . 2]" 1
2058 1 103 VAL HA 1 104 PHE H . . 2.400 2.191 2.140 2.280 . 0 0 "[ . 1 . 2]" 1
2059 1 103 VAL HA 1 104 PHE QD . . 4.850 3.763 3.374 4.398 . 0 0 "[ . 1 . 2]" 1
2060 1 103 VAL HA 1 105 ASP H . . 4.450 3.875 3.675 4.214 . 0 0 "[ . 1 . 2]" 1
2061 1 103 VAL HB 1 104 PHE H . . 4.180 4.069 3.772 4.183 0.003 12 0 "[ . 1 . 2]" 1
2062 1 103 VAL HB 1 105 ASP H . . 4.760 4.602 4.176 4.761 0.001 5 0 "[ . 1 . 2]" 1
2063 1 103 VAL QG 1 104 PHE H . . 3.580 2.336 1.924 2.819 . 0 0 "[ . 1 . 2]" 1
2064 1 103 VAL QG 1 104 PHE HA . . 4.550 3.832 3.528 4.073 . 0 0 "[ . 1 . 2]" 1
2065 1 103 VAL QG 1 105 ASP H . . 3.500 2.158 1.872 2.597 . 0 0 "[ . 1 . 2]" 1
2066 1 103 VAL QG 1 105 ASP HA . . 4.360 3.781 2.786 4.257 . 0 0 "[ . 1 . 2]" 1
2067 1 104 PHE H 1 104 PHE QB . . 2.750 2.522 2.222 2.722 . 0 0 "[ . 1 . 2]" 1
2068 1 104 PHE H 1 104 PHE QD . . 3.570 2.450 2.026 3.274 . 0 0 "[ . 1 . 2]" 1
2069 1 104 PHE H 1 105 ASP H . . 2.940 2.247 2.086 2.432 . 0 0 "[ . 1 . 2]" 1
2070 1 104 PHE HA 1 104 PHE QD . . 3.910 3.384 2.188 3.728 . 0 0 "[ . 1 . 2]" 1
2071 1 104 PHE QB 1 105 ASP H . . 3.560 3.254 2.524 3.558 . 0 0 "[ . 1 . 2]" 1
2072 1 104 PHE HB2 1 105 ASP H . . 4.150 3.567 2.603 3.986 . 0 0 "[ . 1 . 2]" 1
2073 1 104 PHE HB3 1 105 ASP H . . 4.150 3.853 3.398 4.052 . 0 0 "[ . 1 . 2]" 1
2074 1 105 ASP H 1 105 ASP QB . . 3.000 2.508 2.152 2.993 . 0 0 "[ . 1 . 2]" 1
stop_
save_