NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
420108 |
2ee7   |
10147 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2ee7
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 2125
_Distance_constraint_stats_list.Viol_count 305
_Distance_constraint_stats_list.Viol_total 77.879
_Distance_constraint_stats_list.Viol_max 0.183
_Distance_constraint_stats_list.Viol_rms 0.0023
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0001
_Distance_constraint_stats_list.Viol_average_violations_only 0.0128
_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 6 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 VAL 0.016 0.011 20 0 "[ . 1 . 2]"
1 13 ASP 0.079 0.020 7 0 "[ . 1 . 2]"
1 14 GLU 0.067 0.020 7 0 "[ . 1 . 2]"
1 15 GLU 0.123 0.079 10 0 "[ . 1 . 2]"
1 16 ALA 0.002 0.001 18 0 "[ . 1 . 2]"
1 17 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 18 HIS 0.000 0.000 8 0 "[ . 1 . 2]"
1 19 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 LEU 0.011 0.008 19 0 "[ . 1 . 2]"
1 21 TYR 0.003 0.002 8 0 "[ . 1 . 2]"
1 22 LEU 0.005 0.005 14 0 "[ . 1 . 2]"
1 23 TRP 0.011 0.004 19 0 "[ . 1 . 2]"
1 24 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 ASP 0.005 0.005 14 0 "[ . 1 . 2]"
1 26 ASN 0.019 0.017 19 0 "[ . 1 . 2]"
1 27 ILE 0.020 0.005 17 0 "[ . 1 . 2]"
1 28 PRO 0.255 0.183 20 0 "[ . 1 . 2]"
1 29 LEU 0.281 0.183 20 0 "[ . 1 . 2]"
1 31 ARG 0.006 0.004 18 0 "[ . 1 . 2]"
1 32 PRO 0.073 0.029 13 0 "[ . 1 . 2]"
1 33 LYS 0.103 0.029 13 0 "[ . 1 . 2]"
1 34 ARG 0.030 0.009 13 0 "[ . 1 . 2]"
1 35 ASN 0.004 0.004 11 0 "[ . 1 . 2]"
1 36 LEU 0.074 0.021 1 0 "[ . 1 . 2]"
1 37 SER 0.011 0.006 18 0 "[ . 1 . 2]"
1 38 ARG 0.009 0.009 8 0 "[ . 1 . 2]"
1 39 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 PHE 0.022 0.008 18 0 "[ . 1 . 2]"
1 41 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 ASP 0.023 0.018 20 0 "[ . 1 . 2]"
1 43 GLY 0.029 0.018 20 0 "[ . 1 . 2]"
1 44 VAL 0.003 0.001 2 0 "[ . 1 . 2]"
1 45 LEU 0.070 0.030 6 0 "[ . 1 . 2]"
1 46 VAL 0.000 0.000 19 0 "[ . 1 . 2]"
1 47 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 GLU 0.009 0.005 19 0 "[ . 1 . 2]"
1 49 VAL 0.016 0.005 17 0 "[ . 1 . 2]"
1 50 ILE 0.022 0.007 2 0 "[ . 1 . 2]"
1 51 LYS 0.013 0.004 7 0 "[ . 1 . 2]"
1 52 PHE 0.013 0.008 10 0 "[ . 1 . 2]"
1 53 TYR 0.030 0.004 16 0 "[ . 1 . 2]"
1 54 PHE 0.028 0.009 7 0 "[ . 1 . 2]"
1 55 PRO 0.009 0.004 7 0 "[ . 1 . 2]"
1 56 LYS 0.072 0.054 13 0 "[ . 1 . 2]"
1 57 MET 0.037 0.009 7 0 "[ . 1 . 2]"
1 58 VAL 0.023 0.008 10 0 "[ . 1 . 2]"
1 59 GLU 0.002 0.002 9 0 "[ . 1 . 2]"
1 60 MET 0.034 0.013 11 0 "[ . 1 . 2]"
1 61 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 ASN 0.074 0.064 18 0 "[ . 1 . 2]"
1 63 TYR 0.022 0.008 18 0 "[ . 1 . 2]"
1 64 VAL 0.078 0.053 18 0 "[ . 1 . 2]"
1 65 PRO 0.071 0.053 18 0 "[ . 1 . 2]"
1 66 ALA 0.003 0.003 18 0 "[ . 1 . 2]"
1 68 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 71 GLN 0.012 0.008 10 0 "[ . 1 . 2]"
1 72 LYS 0.001 0.001 18 0 "[ . 1 . 2]"
1 73 LEU 0.011 0.006 4 0 "[ . 1 . 2]"
1 74 SER 0.009 0.006 4 0 "[ . 1 . 2]"
1 75 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 TRP 0.001 0.001 19 0 "[ . 1 . 2]"
1 77 GLY 0.000 0.000 14 0 "[ . 1 . 2]"
1 78 HIS 0.041 0.020 10 0 "[ . 1 . 2]"
1 79 LEU 0.006 0.006 10 0 "[ . 1 . 2]"
1 80 ASN 0.077 0.030 20 0 "[ . 1 . 2]"
1 81 ARG 0.050 0.021 18 0 "[ . 1 . 2]"
1 82 LYS 0.350 0.055 13 0 "[ . 1 . 2]"
1 83 VAL 0.006 0.004 17 0 "[ . 1 . 2]"
1 84 LEU 0.129 0.033 10 0 "[ . 1 . 2]"
1 85 LYS 0.277 0.108 15 0 "[ . 1 . 2]"
1 86 ARG 0.135 0.130 2 0 "[ . 1 . 2]"
1 87 LEU 0.010 0.006 15 0 "[ . 1 . 2]"
1 88 ASN 0.000 0.000 17 0 "[ . 1 . 2]"
1 89 PHE 0.153 0.032 4 0 "[ . 1 . 2]"
1 90 SER 0.165 0.032 4 0 "[ . 1 . 2]"
1 91 VAL 0.024 0.017 19 0 "[ . 1 . 2]"
1 92 PRO 0.010 0.006 18 0 "[ . 1 . 2]"
1 93 ASP 0.002 0.002 2 0 "[ . 1 . 2]"
1 94 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 95 VAL 0.013 0.006 18 0 "[ . 1 . 2]"
1 96 MET 0.012 0.003 2 0 "[ . 1 . 2]"
1 97 ARG 0.004 0.003 6 0 "[ . 1 . 2]"
1 98 LYS 0.120 0.045 2 0 "[ . 1 . 2]"
1 99 ILE 0.004 0.004 6 0 "[ . 1 . 2]"
1 100 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 GLN 0.004 0.003 6 0 "[ . 1 . 2]"
1 102 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 103 ALA 0.015 0.011 2 0 "[ . 1 . 2]"
1 104 PRO 0.012 0.011 2 0 "[ . 1 . 2]"
1 105 GLY 0.002 0.002 3 0 "[ . 1 . 2]"
1 106 VAL 0.014 0.005 2 0 "[ . 1 . 2]"
1 107 VAL 0.009 0.004 6 0 "[ . 1 . 2]"
1 108 GLU 0.004 0.002 14 0 "[ . 1 . 2]"
1 109 LEU 0.001 0.001 1 0 "[ . 1 . 2]"
1 110 VAL 0.003 0.002 19 0 "[ . 1 . 2]"
1 111 LEU 0.009 0.003 16 0 "[ . 1 . 2]"
1 112 ILE 0.061 0.015 13 0 "[ . 1 . 2]"
1 113 PRO 0.008 0.008 19 0 "[ . 1 . 2]"
1 114 LEU 0.209 0.105 12 0 "[ . 1 . 2]"
1 115 ARG 0.305 0.128 19 0 "[ . 1 . 2]"
1 116 GLN 0.049 0.039 6 0 "[ . 1 . 2]"
1 117 ARG 0.193 0.102 19 0 "[ . 1 . 2]"
1 118 LEU 0.021 0.005 19 0 "[ . 1 . 2]"
1 119 GLU 0.160 0.090 17 0 "[ . 1 . 2]"
1 120 GLU 0.065 0.065 17 0 "[ . 1 . 2]"
1 121 ARG 0.019 0.015 18 0 "[ . 1 . 2]"
1 122 GLN 0.021 0.008 20 0 "[ . 1 . 2]"
1 123 ARG 0.039 0.021 11 0 "[ . 1 . 2]"
1 124 ARG 0.101 0.085 16 0 "[ . 1 . 2]"
1 125 ARG 0.127 0.093 20 0 "[ . 1 . 2]"
1 126 LYS 0.248 0.053 11 0 "[ . 1 . 2]"
1 127 GLN 0.057 0.032 19 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 6 SER QB 1 7 GLY H . . 4.980 3.113 2.199 3.979 . 0 0 "[ . 1 . 2]" 1
2 1 7 GLY QA 1 8 MET QB . . 5.120 4.030 3.638 4.436 . 0 0 "[ . 1 . 2]" 1
3 1 8 MET H 1 8 MET QG . . 4.640 3.302 2.008 4.261 . 0 0 "[ . 1 . 2]" 1
4 1 8 MET QB 1 9 ALA H . . 4.230 3.307 2.147 4.030 . 0 0 "[ . 1 . 2]" 1
5 1 9 ALA MB 1 10 SER H . . 4.330 2.997 2.188 3.707 . 0 0 "[ . 1 . 2]" 1
6 1 11 SER HA 1 12 VAL H . . 2.920 2.382 2.138 2.538 . 0 0 "[ . 1 . 2]" 1
7 1 11 SER HA 1 12 VAL HA . . 4.690 4.361 4.294 4.516 . 0 0 "[ . 1 . 2]" 1
8 1 11 SER HA 1 12 VAL MG2 . . 3.910 3.681 3.339 3.902 . 0 0 "[ . 1 . 2]" 1
9 1 11 SER QB 1 12 VAL H . . 3.420 2.626 2.148 3.367 . 0 0 "[ . 1 . 2]" 1
10 1 12 VAL H 1 12 VAL HB . . 3.810 2.808 2.499 3.692 . 0 0 "[ . 1 . 2]" 1
11 1 12 VAL H 1 12 VAL MG1 . . 4.090 3.819 3.763 4.008 . 0 0 "[ . 1 . 2]" 1
12 1 12 VAL H 1 12 VAL MG2 . . 3.150 2.225 1.875 2.643 . 0 0 "[ . 1 . 2]" 1
13 1 12 VAL H 1 13 ASP H . . 4.650 4.030 2.580 4.626 . 0 0 "[ . 1 . 2]" 1
14 1 12 VAL HA 1 12 VAL MG1 . . 3.400 2.333 2.193 2.461 . 0 0 "[ . 1 . 2]" 1
15 1 12 VAL HA 1 12 VAL MG2 . . 3.510 2.417 2.277 2.555 . 0 0 "[ . 1 . 2]" 1
16 1 12 VAL HA 1 13 ASP H . . 2.950 2.389 2.156 2.863 . 0 0 "[ . 1 . 2]" 1
17 1 12 VAL HA 1 13 ASP HA . . 5.060 4.513 4.351 4.804 . 0 0 "[ . 1 . 2]" 1
18 1 12 VAL HA 1 16 ALA MB . . 3.920 2.861 1.858 3.910 . 0 0 "[ . 1 . 2]" 1
19 1 12 VAL HB 1 13 ASP H . . 4.170 4.085 3.937 4.181 0.011 20 0 "[ . 1 . 2]" 1
20 1 12 VAL MG1 1 13 ASP H . . 4.300 2.758 1.952 4.147 . 0 0 "[ . 1 . 2]" 1
21 1 12 VAL MG1 1 16 ALA H . . 4.400 4.021 3.565 4.401 0.001 18 0 "[ . 1 . 2]" 1
22 1 12 VAL MG1 1 16 ALA HA . . 4.830 4.458 3.969 4.812 . 0 0 "[ . 1 . 2]" 1
23 1 12 VAL MG1 1 16 ALA MB . . 3.240 1.956 1.720 2.187 . 0 0 "[ . 1 . 2]" 1
24 1 12 VAL MG1 1 17 LEU H . . 4.210 3.500 2.855 4.093 . 0 0 "[ . 1 . 2]" 1
25 1 12 VAL MG2 1 13 ASP H . . 4.460 4.038 3.850 4.304 . 0 0 "[ . 1 . 2]" 1
26 1 13 ASP H 1 13 ASP HB2 . . 4.000 2.843 2.286 3.931 . 0 0 "[ . 1 . 2]" 1
27 1 13 ASP H 1 13 ASP QB . . 3.410 2.585 2.194 3.235 . 0 0 "[ . 1 . 2]" 1
28 1 13 ASP H 1 13 ASP HB3 . . 4.000 3.294 2.624 3.822 . 0 0 "[ . 1 . 2]" 1
29 1 13 ASP H 1 14 GLU H . . 4.610 4.530 4.389 4.630 0.020 7 0 "[ . 1 . 2]" 1
30 1 13 ASP H 1 16 ALA MB . . 3.490 2.569 1.864 3.297 . 0 0 "[ . 1 . 2]" 1
31 1 13 ASP HA 1 14 GLU H . . 3.150 2.494 2.345 2.553 . 0 0 "[ . 1 . 2]" 1
32 1 13 ASP HA 1 15 GLU H . . 4.650 4.436 4.011 4.650 . 0 0 "[ . 1 . 2]" 1
33 1 13 ASP QB 1 14 GLU H . . 3.160 2.503 2.120 3.148 . 0 0 "[ . 1 . 2]" 1
34 1 13 ASP QB 1 15 GLU H . . 4.070 2.822 2.422 3.250 . 0 0 "[ . 1 . 2]" 1
35 1 13 ASP QB 1 16 ALA H . . 4.280 3.190 2.714 4.103 . 0 0 "[ . 1 . 2]" 1
36 1 13 ASP HB2 1 14 GLU H . . 3.790 3.306 2.154 3.784 . 0 0 "[ . 1 . 2]" 1
37 1 13 ASP HB2 1 15 GLU H . . 4.910 3.531 2.438 4.637 . 0 0 "[ . 1 . 2]" 1
38 1 13 ASP HB2 1 16 ALA H . . 4.870 3.763 2.784 4.763 . 0 0 "[ . 1 . 2]" 1
39 1 13 ASP HB3 1 14 GLU H . . 3.790 2.844 2.141 3.742 . 0 0 "[ . 1 . 2]" 1
40 1 13 ASP HB3 1 15 GLU H . . 4.910 3.287 2.453 4.726 . 0 0 "[ . 1 . 2]" 1
41 1 13 ASP HB3 1 16 ALA H . . 4.870 3.957 2.765 4.845 . 0 0 "[ . 1 . 2]" 1
42 1 14 GLU H 1 14 GLU QB . . 3.090 2.509 2.357 2.748 . 0 0 "[ . 1 . 2]" 1
43 1 14 GLU H 1 14 GLU HG2 . . 4.220 2.549 1.905 3.565 . 0 0 "[ . 1 . 2]" 1
44 1 14 GLU H 1 14 GLU QG . . 3.560 2.152 1.884 2.423 . 0 0 "[ . 1 . 2]" 1
45 1 14 GLU H 1 14 GLU HG3 . . 4.220 2.943 2.087 3.718 . 0 0 "[ . 1 . 2]" 1
46 1 14 GLU H 1 15 GLU H . . 3.600 2.802 2.552 3.104 . 0 0 "[ . 1 . 2]" 1
47 1 14 GLU H 1 16 ALA H . . 4.670 4.419 4.233 4.635 . 0 0 "[ . 1 . 2]" 1
48 1 14 GLU HA 1 14 GLU HG2 . . 3.880 3.012 2.342 3.761 . 0 0 "[ . 1 . 2]" 1
49 1 14 GLU HA 1 14 GLU HG3 . . 3.880 3.517 2.532 3.880 . 0 0 "[ . 1 . 2]" 1
50 1 14 GLU HA 1 16 ALA H . . 4.790 4.448 4.114 4.667 . 0 0 "[ . 1 . 2]" 1
51 1 14 GLU HA 1 17 LEU H . . 4.000 3.609 3.236 3.992 . 0 0 "[ . 1 . 2]" 1
52 1 14 GLU HA 1 17 LEU MD1 . . 3.630 2.390 1.908 3.104 . 0 0 "[ . 1 . 2]" 1
53 1 14 GLU QB 1 15 GLU H . . 3.590 2.829 2.332 3.565 . 0 0 "[ . 1 . 2]" 1
54 1 14 GLU QB 1 15 GLU HA . . 4.650 3.989 3.772 4.384 . 0 0 "[ . 1 . 2]" 1
55 1 14 GLU QG 1 15 GLU H . . 4.180 3.514 1.969 4.182 0.002 18 0 "[ . 1 . 2]" 1
56 1 15 GLU H 1 15 GLU HB2 . . 3.680 3.078 2.160 3.613 . 0 0 "[ . 1 . 2]" 1
57 1 15 GLU H 1 15 GLU QB . . 2.880 2.361 2.115 2.585 . 0 0 "[ . 1 . 2]" 1
58 1 15 GLU H 1 15 GLU HB3 . . 3.680 2.591 2.340 3.018 . 0 0 "[ . 1 . 2]" 1
59 1 15 GLU H 1 15 GLU QG . . 3.930 2.922 1.976 4.009 0.079 10 0 "[ . 1 . 2]" 1
60 1 15 GLU H 1 16 ALA H . . 3.200 2.774 2.485 2.941 . 0 0 "[ . 1 . 2]" 1
61 1 15 GLU H 1 16 ALA MB . . 4.510 4.336 4.054 4.495 . 0 0 "[ . 1 . 2]" 1
62 1 15 GLU H 1 17 LEU H . . 4.760 4.345 4.139 4.687 . 0 0 "[ . 1 . 2]" 1
63 1 15 GLU HA 1 15 GLU QG . . 3.760 3.002 2.216 3.466 . 0 0 "[ . 1 . 2]" 1
64 1 15 GLU HA 1 17 LEU H . . 4.970 4.411 4.156 4.902 . 0 0 "[ . 1 . 2]" 1
65 1 15 GLU HA 1 18 HIS H . . 3.990 3.610 3.243 3.940 . 0 0 "[ . 1 . 2]" 1
66 1 15 GLU HA 1 18 HIS HB2 . . 3.950 3.332 2.687 3.925 . 0 0 "[ . 1 . 2]" 1
67 1 15 GLU HA 1 18 HIS HB3 . . 3.950 3.468 2.626 3.937 . 0 0 "[ . 1 . 2]" 1
68 1 15 GLU HA 1 19 GLN H . . 5.140 4.663 3.825 5.118 . 0 0 "[ . 1 . 2]" 1
69 1 15 GLU QB 1 16 ALA H . . 3.380 2.930 2.288 3.380 0.000 2 0 "[ . 1 . 2]" 1
70 1 15 GLU HB2 1 16 ALA H . . 3.930 3.671 3.523 3.923 . 0 0 "[ . 1 . 2]" 1
71 1 15 GLU HB3 1 16 ALA H . . 3.930 3.243 2.317 3.922 . 0 0 "[ . 1 . 2]" 1
72 1 15 GLU QG 1 16 ALA H . . 4.220 2.699 1.885 4.202 . 0 0 "[ . 1 . 2]" 1
73 1 15 GLU QG 1 16 ALA HA . . 4.800 3.613 3.165 4.508 . 0 0 "[ . 1 . 2]" 1
74 1 16 ALA H 1 16 ALA MB . . 2.940 2.122 2.025 2.253 . 0 0 "[ . 1 . 2]" 1
75 1 16 ALA HA 1 19 GLN H . . 4.240 3.809 3.542 4.181 . 0 0 "[ . 1 . 2]" 1
76 1 16 ALA HA 1 19 GLN QB . . 3.990 3.341 2.697 3.865 . 0 0 "[ . 1 . 2]" 1
77 1 16 ALA HA 1 19 GLN QG . . 4.190 3.094 2.636 4.140 . 0 0 "[ . 1 . 2]" 1
78 1 16 ALA MB 1 17 LEU H . . 3.290 2.529 2.135 2.754 . 0 0 "[ . 1 . 2]" 1
79 1 16 ALA MB 1 17 LEU HA . . 4.720 3.720 3.586 3.844 . 0 0 "[ . 1 . 2]" 1
80 1 17 LEU H 1 17 LEU HB2 . . 3.650 2.479 2.242 2.660 . 0 0 "[ . 1 . 2]" 1
81 1 17 LEU H 1 17 LEU QB . . 3.060 2.434 2.218 2.593 . 0 0 "[ . 1 . 2]" 1
82 1 17 LEU H 1 17 LEU HB3 . . 3.650 3.575 3.527 3.612 . 0 0 "[ . 1 . 2]" 1
83 1 17 LEU H 1 17 LEU MD1 . . 4.210 3.479 3.271 3.778 . 0 0 "[ . 1 . 2]" 1
84 1 17 LEU H 1 17 LEU MD2 . . 4.710 3.479 3.076 3.883 . 0 0 "[ . 1 . 2]" 1
85 1 17 LEU H 1 17 LEU HG . . 3.470 2.285 1.962 2.745 . 0 0 "[ . 1 . 2]" 1
86 1 17 LEU H 1 18 HIS H . . 3.450 2.876 2.674 3.140 . 0 0 "[ . 1 . 2]" 1
87 1 17 LEU HA 1 17 LEU MD1 . . 4.020 3.889 3.793 3.942 . 0 0 "[ . 1 . 2]" 1
88 1 17 LEU HA 1 17 LEU MD2 . . 3.130 2.172 1.954 2.346 . 0 0 "[ . 1 . 2]" 1
89 1 17 LEU HA 1 17 LEU HG . . 3.420 2.959 2.674 3.178 . 0 0 "[ . 1 . 2]" 1
90 1 17 LEU HA 1 20 LEU H . . 3.810 3.564 3.386 3.761 . 0 0 "[ . 1 . 2]" 1
91 1 17 LEU HA 1 20 LEU HB2 . . 4.310 4.129 3.890 4.304 . 0 0 "[ . 1 . 2]" 1
92 1 17 LEU HA 1 20 LEU HB3 . . 3.430 3.095 2.788 3.312 . 0 0 "[ . 1 . 2]" 1
93 1 17 LEU HA 1 21 TYR H . . 4.890 4.593 4.278 4.828 . 0 0 "[ . 1 . 2]" 1
94 1 17 LEU QB 1 17 LEU MD1 . . 3.000 2.044 1.959 2.099 . 0 0 "[ . 1 . 2]" 1
95 1 17 LEU QB 1 17 LEU MD2 . . 3.030 2.224 2.143 2.333 . 0 0 "[ . 1 . 2]" 1
96 1 17 LEU QB 1 21 TYR QE . . 3.870 2.711 2.242 3.458 . 0 0 "[ . 1 . 2]" 1
97 1 17 LEU HB2 1 17 LEU MD1 . . 3.430 2.199 2.021 2.408 . 0 0 "[ . 1 . 2]" 1
98 1 17 LEU HB2 1 17 LEU MD2 . . 3.650 3.176 3.150 3.192 . 0 0 "[ . 1 . 2]" 1
99 1 17 LEU HB2 1 18 HIS H . . 3.860 2.388 2.027 2.823 . 0 0 "[ . 1 . 2]" 1
100 1 17 LEU HB3 1 17 LEU MD1 . . 3.430 2.472 2.295 2.635 . 0 0 "[ . 1 . 2]" 1
101 1 17 LEU HB3 1 17 LEU MD2 . . 3.650 2.271 2.181 2.398 . 0 0 "[ . 1 . 2]" 1
102 1 17 LEU HB3 1 18 HIS H . . 3.860 3.347 2.881 3.668 . 0 0 "[ . 1 . 2]" 1
103 1 17 LEU MD1 1 18 HIS H . . 4.680 4.193 3.799 4.656 . 0 0 "[ . 1 . 2]" 1
104 1 17 LEU MD1 1 21 TYR QE . . 4.350 3.741 2.850 4.336 . 0 0 "[ . 1 . 2]" 1
105 1 17 LEU MD2 1 18 HIS H . . 5.320 4.629 4.469 4.806 . 0 0 "[ . 1 . 2]" 1
106 1 17 LEU MD2 1 21 TYR QE . . 4.390 3.480 2.425 4.374 . 0 0 "[ . 1 . 2]" 1
107 1 17 LEU MD2 1 108 GLU QG . . 3.760 2.890 2.005 3.726 . 0 0 "[ . 1 . 2]" 1
108 1 18 HIS H 1 18 HIS HB2 . . 3.360 2.346 2.179 2.571 . 0 0 "[ . 1 . 2]" 1
109 1 18 HIS H 1 18 HIS HB3 . . 3.360 2.791 2.511 2.997 . 0 0 "[ . 1 . 2]" 1
110 1 18 HIS H 1 20 LEU HB3 . . 5.500 5.260 5.105 5.453 . 0 0 "[ . 1 . 2]" 1
111 1 18 HIS HA 1 18 HIS HD2 . . 4.370 2.586 2.171 3.850 . 0 0 "[ . 1 . 2]" 1
112 1 18 HIS HA 1 21 TYR H . . 4.450 3.200 3.012 3.519 . 0 0 "[ . 1 . 2]" 1
113 1 18 HIS HA 1 21 TYR HB2 . . 4.450 2.349 2.245 2.471 . 0 0 "[ . 1 . 2]" 1
114 1 18 HIS HA 1 21 TYR HB3 . . 4.050 3.955 3.821 4.049 . 0 0 "[ . 1 . 2]" 1
115 1 18 HIS HA 1 21 TYR QD . . 3.930 2.799 1.999 3.519 . 0 0 "[ . 1 . 2]" 1
116 1 18 HIS HA 1 21 TYR QE . . 4.800 4.525 3.868 4.800 0.000 8 0 "[ . 1 . 2]" 1
117 1 18 HIS QB 1 19 GLN H . . 3.380 2.288 2.141 2.414 . 0 0 "[ . 1 . 2]" 1
118 1 18 HIS HB2 1 19 GLN H . . 3.890 3.617 3.392 3.805 . 0 0 "[ . 1 . 2]" 1
119 1 18 HIS HB3 1 19 GLN H . . 3.890 2.314 2.160 2.456 . 0 0 "[ . 1 . 2]" 1
120 1 18 HIS HD2 1 21 TYR HB2 . . 4.690 2.941 2.216 4.444 . 0 0 "[ . 1 . 2]" 1
121 1 18 HIS HD2 1 22 LEU MD1 . . 4.550 3.750 1.893 4.522 . 0 0 "[ . 1 . 2]" 1
122 1 18 HIS HD2 1 22 LEU HG . . 4.860 3.132 2.045 3.831 . 0 0 "[ . 1 . 2]" 1
123 1 18 HIS HE1 1 22 LEU MD1 . . 4.610 3.452 2.348 4.517 . 0 0 "[ . 1 . 2]" 1
124 1 19 GLN H 1 19 GLN QB . . 3.210 2.453 2.299 2.614 . 0 0 "[ . 1 . 2]" 1
125 1 19 GLN H 1 19 GLN QG . . 3.340 2.275 1.958 3.300 . 0 0 "[ . 1 . 2]" 1
126 1 19 GLN H 1 20 LEU H . . 3.440 2.947 2.813 3.097 . 0 0 "[ . 1 . 2]" 1
127 1 19 GLN HA 1 19 GLN QE . . 4.760 3.011 2.081 3.824 . 0 0 "[ . 1 . 2]" 1
128 1 19 GLN HA 1 19 GLN QG . . 3.650 2.763 2.347 3.035 . 0 0 "[ . 1 . 2]" 1
129 1 19 GLN HA 1 22 LEU H . . 4.150 3.725 3.509 3.998 . 0 0 "[ . 1 . 2]" 1
130 1 19 GLN HA 1 22 LEU HB2 . . 3.720 3.184 2.887 3.465 . 0 0 "[ . 1 . 2]" 1
131 1 19 GLN HA 1 22 LEU HB3 . . 5.050 4.728 4.432 4.887 . 0 0 "[ . 1 . 2]" 1
132 1 19 GLN HA 1 22 LEU MD1 . . 3.230 2.284 1.899 2.780 . 0 0 "[ . 1 . 2]" 1
133 1 19 GLN HA 1 22 LEU HG . . 3.890 3.651 3.112 3.890 . 0 0 "[ . 1 . 2]" 1
134 1 19 GLN QB 1 19 GLN HE22 . . 4.970 4.093 3.407 4.401 . 0 0 "[ . 1 . 2]" 1
135 1 19 GLN QB 1 20 LEU H . . 4.100 2.551 2.347 2.796 . 0 0 "[ . 1 . 2]" 1
136 1 19 GLN QB 1 20 LEU HA . . 4.080 3.871 3.788 3.969 . 0 0 "[ . 1 . 2]" 1
137 1 19 GLN QB 1 22 LEU MD1 . . 4.600 4.045 3.427 4.517 . 0 0 "[ . 1 . 2]" 1
138 1 19 GLN QE 1 22 LEU MD1 . . 4.030 2.985 2.224 3.808 . 0 0 "[ . 1 . 2]" 1
139 1 19 GLN HE21 1 22 LEU MD1 . . 4.860 3.474 2.415 4.632 . 0 0 "[ . 1 . 2]" 1
140 1 19 GLN HE22 1 19 GLN QG . . 3.810 3.277 3.216 3.421 . 0 0 "[ . 1 . 2]" 1
141 1 19 GLN HE22 1 22 LEU MD1 . . 4.860 3.343 2.445 4.235 . 0 0 "[ . 1 . 2]" 1
142 1 19 GLN QG 1 20 LEU H . . 4.360 4.147 3.947 4.356 . 0 0 "[ . 1 . 2]" 1
143 1 19 GLN QG 1 22 LEU MD1 . . 4.560 3.901 3.365 4.226 . 0 0 "[ . 1 . 2]" 1
144 1 20 LEU H 1 20 LEU HB2 . . 3.230 2.797 2.703 2.914 . 0 0 "[ . 1 . 2]" 1
145 1 20 LEU H 1 20 LEU HB3 . . 3.100 2.268 2.198 2.343 . 0 0 "[ . 1 . 2]" 1
146 1 20 LEU H 1 20 LEU MD1 . . 4.410 4.301 4.234 4.378 . 0 0 "[ . 1 . 2]" 1
147 1 20 LEU H 1 20 LEU MD2 . . 4.200 4.066 4.011 4.130 . 0 0 "[ . 1 . 2]" 1
148 1 20 LEU H 1 20 LEU HG . . 4.380 4.297 4.204 4.372 . 0 0 "[ . 1 . 2]" 1
149 1 20 LEU H 1 21 TYR H . . 3.520 2.585 2.362 2.828 . 0 0 "[ . 1 . 2]" 1
150 1 20 LEU H 1 21 TYR HB2 . . 4.870 4.563 4.378 4.769 . 0 0 "[ . 1 . 2]" 1
151 1 20 LEU HA 1 20 LEU MD1 . . 3.330 2.515 2.229 2.720 . 0 0 "[ . 1 . 2]" 1
152 1 20 LEU HA 1 20 LEU MD2 . . 4.180 4.003 3.961 4.018 . 0 0 "[ . 1 . 2]" 1
153 1 20 LEU HA 1 20 LEU HG . . 4.230 3.144 2.993 3.303 . 0 0 "[ . 1 . 2]" 1
154 1 20 LEU HA 1 23 TRP H . . 4.470 3.564 3.254 3.882 . 0 0 "[ . 1 . 2]" 1
155 1 20 LEU HA 1 23 TRP HB2 . . 4.170 3.811 3.543 4.077 . 0 0 "[ . 1 . 2]" 1
156 1 20 LEU HA 1 23 TRP HB3 . . 4.170 2.898 2.555 3.532 . 0 0 "[ . 1 . 2]" 1
157 1 20 LEU HA 1 23 TRP HE3 . . 4.460 3.460 2.911 4.223 . 0 0 "[ . 1 . 2]" 1
158 1 20 LEU HB2 1 20 LEU MD1 . . 3.170 2.177 2.043 2.349 . 0 0 "[ . 1 . 2]" 1
159 1 20 LEU HB2 1 20 LEU MD2 . . 3.450 2.574 2.419 2.695 . 0 0 "[ . 1 . 2]" 1
160 1 20 LEU HB2 1 21 TYR H . . 4.390 4.041 3.864 4.187 . 0 0 "[ . 1 . 2]" 1
161 1 20 LEU HB2 1 112 ILE MD . . 4.050 3.888 3.252 4.058 0.008 19 0 "[ . 1 . 2]" 1
162 1 20 LEU HB2 1 112 ILE QG . . 4.230 2.906 2.371 3.331 . 0 0 "[ . 1 . 2]" 1
163 1 20 LEU HB3 1 20 LEU MD1 . . 3.550 3.147 3.108 3.192 . 0 0 "[ . 1 . 2]" 1
164 1 20 LEU HB3 1 20 LEU MD2 . . 3.550 2.127 1.989 2.231 . 0 0 "[ . 1 . 2]" 1
165 1 20 LEU HB3 1 21 TYR H . . 3.780 2.744 2.461 2.980 . 0 0 "[ . 1 . 2]" 1
166 1 20 LEU MD1 1 23 TRP QB . . 4.280 3.361 2.949 3.720 . 0 0 "[ . 1 . 2]" 1
167 1 20 LEU MD1 1 23 TRP HE3 . . 3.500 2.106 1.876 2.441 . 0 0 "[ . 1 . 2]" 1
168 1 20 LEU MD1 1 23 TRP HZ3 . . 3.790 2.546 2.148 3.019 . 0 0 "[ . 1 . 2]" 1
169 1 20 LEU MD1 1 108 GLU HA . . 4.510 4.068 3.388 4.501 . 0 0 "[ . 1 . 2]" 1
170 1 20 LEU MD1 1 111 LEU HB2 . . 3.090 2.474 2.001 2.875 . 0 0 "[ . 1 . 2]" 1
171 1 20 LEU MD1 1 111 LEU HB3 . . 3.090 2.138 1.931 2.541 . 0 0 "[ . 1 . 2]" 1
172 1 20 LEU MD1 1 111 LEU MD1 . . 3.230 2.880 2.418 3.110 . 0 0 "[ . 1 . 2]" 1
173 1 20 LEU MD1 1 111 LEU MD2 . . 3.950 3.750 3.483 3.950 . 0 0 "[ . 1 . 2]" 1
174 1 20 LEU MD1 1 112 ILE HA . . 3.570 2.516 1.995 3.242 . 0 0 "[ . 1 . 2]" 1
175 1 20 LEU MD2 1 21 TYR H . . 4.300 3.889 3.420 4.250 . 0 0 "[ . 1 . 2]" 1
176 1 20 LEU MD2 1 21 TYR QD . . 3.950 3.402 2.663 3.947 . 0 0 "[ . 1 . 2]" 1
177 1 20 LEU MD2 1 21 TYR QE . . 4.620 3.338 2.358 3.969 . 0 0 "[ . 1 . 2]" 1
178 1 20 LEU MD2 1 23 TRP HE3 . . 5.040 4.511 4.295 4.854 . 0 0 "[ . 1 . 2]" 1
179 1 20 LEU MD2 1 108 GLU HA . . 3.710 2.827 2.412 3.355 . 0 0 "[ . 1 . 2]" 1
180 1 20 LEU MD2 1 108 GLU HB2 . . 4.500 3.803 3.205 4.200 . 0 0 "[ . 1 . 2]" 1
181 1 20 LEU MD2 1 108 GLU QB . . 3.680 2.694 1.977 3.593 . 0 0 "[ . 1 . 2]" 1
182 1 20 LEU MD2 1 108 GLU HB3 . . 4.500 2.845 1.990 4.145 . 0 0 "[ . 1 . 2]" 1
183 1 20 LEU MD2 1 108 GLU HG2 . . 3.770 2.574 1.874 3.708 . 0 0 "[ . 1 . 2]" 1
184 1 20 LEU MD2 1 108 GLU QG . . 3.220 2.124 1.793 3.217 . 0 0 "[ . 1 . 2]" 1
185 1 20 LEU MD2 1 108 GLU HG3 . . 3.770 2.539 1.826 3.758 . 0 0 "[ . 1 . 2]" 1
186 1 20 LEU MD2 1 111 LEU HB2 . . 3.570 2.475 2.087 2.953 . 0 0 "[ . 1 . 2]" 1
187 1 20 LEU MD2 1 111 LEU QB . . 3.050 2.392 2.040 2.773 . 0 0 "[ . 1 . 2]" 1
188 1 20 LEU MD2 1 111 LEU HB3 . . 3.570 3.227 2.879 3.573 0.003 16 0 "[ . 1 . 2]" 1
189 1 20 LEU HG 1 21 TYR H . . 3.780 3.473 2.889 3.780 . 0 0 "[ . 1 . 2]" 1
190 1 20 LEU HG 1 21 TYR HA . . 4.890 3.345 3.004 3.609 . 0 0 "[ . 1 . 2]" 1
191 1 20 LEU HG 1 21 TYR QD . . 4.070 3.745 2.496 4.067 . 0 0 "[ . 1 . 2]" 1
192 1 20 LEU HG 1 24 VAL MG2 . . 3.640 3.319 2.212 3.629 . 0 0 "[ . 1 . 2]" 1
193 1 21 TYR H 1 21 TYR HB2 . . 3.580 2.304 2.187 2.492 . 0 0 "[ . 1 . 2]" 1
194 1 21 TYR H 1 21 TYR HB3 . . 3.700 3.549 3.494 3.600 . 0 0 "[ . 1 . 2]" 1
195 1 21 TYR H 1 21 TYR QD . . 4.140 2.578 1.909 3.351 . 0 0 "[ . 1 . 2]" 1
196 1 21 TYR H 1 22 LEU H . . 3.800 2.686 2.487 2.896 . 0 0 "[ . 1 . 2]" 1
197 1 21 TYR HA 1 21 TYR QD . . 3.420 2.598 1.999 3.061 . 0 0 "[ . 1 . 2]" 1
198 1 21 TYR HA 1 21 TYR QE . . 4.830 4.419 4.193 4.561 . 0 0 "[ . 1 . 2]" 1
199 1 21 TYR HA 1 24 VAL H . . 4.320 3.826 3.489 4.141 . 0 0 "[ . 1 . 2]" 1
200 1 21 TYR HA 1 24 VAL HB . . 3.840 3.536 3.075 3.786 . 0 0 "[ . 1 . 2]" 1
201 1 21 TYR HA 1 24 VAL MG2 . . 3.820 3.113 2.313 3.758 . 0 0 "[ . 1 . 2]" 1
202 1 21 TYR HB2 1 22 LEU H . . 4.010 2.808 2.424 3.302 . 0 0 "[ . 1 . 2]" 1
203 1 21 TYR HB2 1 22 LEU HA . . 4.930 4.570 4.368 4.807 . 0 0 "[ . 1 . 2]" 1
204 1 21 TYR HB2 1 22 LEU HG . . 4.160 3.616 3.237 4.055 . 0 0 "[ . 1 . 2]" 1
205 1 21 TYR HB3 1 22 LEU H . . 4.030 3.495 3.068 4.012 . 0 0 "[ . 1 . 2]" 1
206 1 21 TYR HB3 1 22 LEU HG . . 4.470 4.319 4.109 4.470 . 0 0 "[ . 1 . 2]" 1
207 1 21 TYR QD 1 36 LEU MD2 . . 4.020 3.071 1.995 3.933 . 0 0 "[ . 1 . 2]" 1
208 1 21 TYR QD 1 36 LEU HG . . 5.500 4.636 2.943 5.370 . 0 0 "[ . 1 . 2]" 1
209 1 21 TYR QE 1 36 LEU MD1 . . 4.420 3.079 1.850 4.229 . 0 0 "[ . 1 . 2]" 1
210 1 21 TYR QE 1 36 LEU MD2 . . 4.180 3.139 1.920 4.182 0.002 8 0 "[ . 1 . 2]" 1
211 1 21 TYR QE 1 108 GLU HG2 . . 4.390 3.690 2.536 4.388 . 0 0 "[ . 1 . 2]" 1
212 1 21 TYR QE 1 108 GLU HG3 . . 4.390 3.831 2.826 4.389 . 0 0 "[ . 1 . 2]" 1
213 1 22 LEU H 1 22 LEU HB2 . . 3.650 2.483 2.324 2.643 . 0 0 "[ . 1 . 2]" 1
214 1 22 LEU H 1 22 LEU HB3 . . 3.820 3.589 3.563 3.630 . 0 0 "[ . 1 . 2]" 1
215 1 22 LEU H 1 22 LEU MD1 . . 4.220 3.425 3.151 3.837 . 0 0 "[ . 1 . 2]" 1
216 1 22 LEU H 1 22 LEU MD2 . . 4.430 3.590 3.280 3.991 . 0 0 "[ . 1 . 2]" 1
217 1 22 LEU H 1 22 LEU HG . . 3.730 2.320 1.955 2.857 . 0 0 "[ . 1 . 2]" 1
218 1 22 LEU HA 1 22 LEU MD1 . . 4.100 3.908 3.828 3.959 . 0 0 "[ . 1 . 2]" 1
219 1 22 LEU HA 1 22 LEU MD2 . . 3.180 2.290 1.995 2.561 . 0 0 "[ . 1 . 2]" 1
220 1 22 LEU HA 1 22 LEU HG . . 3.700 2.945 2.720 3.107 . 0 0 "[ . 1 . 2]" 1
221 1 22 LEU HA 1 25 ASP H . . 4.300 3.380 3.073 3.827 . 0 0 "[ . 1 . 2]" 1
222 1 22 LEU HA 1 25 ASP HB2 . . 4.040 3.133 2.236 4.045 0.005 14 0 "[ . 1 . 2]" 1
223 1 22 LEU HA 1 25 ASP QB . . 3.500 2.646 2.192 3.141 . 0 0 "[ . 1 . 2]" 1
224 1 22 LEU HA 1 25 ASP HB3 . . 4.040 3.165 2.214 4.019 . 0 0 "[ . 1 . 2]" 1
225 1 22 LEU HB2 1 22 LEU MD1 . . 3.440 2.155 1.985 2.357 . 0 0 "[ . 1 . 2]" 1
226 1 22 LEU HB2 1 22 LEU MD2 . . 3.530 3.162 3.127 3.193 . 0 0 "[ . 1 . 2]" 1
227 1 22 LEU HB2 1 23 TRP H . . 4.040 2.436 2.213 2.791 . 0 0 "[ . 1 . 2]" 1
228 1 22 LEU HB3 1 22 LEU MD1 . . 3.360 2.529 2.321 2.680 . 0 0 "[ . 1 . 2]" 1
229 1 22 LEU HB3 1 22 LEU MD2 . . 3.300 2.201 2.045 2.325 . 0 0 "[ . 1 . 2]" 1
230 1 22 LEU HB3 1 23 TRP H . . 4.300 3.470 3.303 3.735 . 0 0 "[ . 1 . 2]" 1
231 1 23 TRP H 1 23 TRP HB2 . . 3.620 2.762 2.683 2.865 . 0 0 "[ . 1 . 2]" 1
232 1 23 TRP H 1 23 TRP HB3 . . 3.620 2.347 2.240 2.432 . 0 0 "[ . 1 . 2]" 1
233 1 23 TRP H 1 23 TRP HE3 . . 4.700 4.473 4.246 4.695 . 0 0 "[ . 1 . 2]" 1
234 1 23 TRP H 1 24 VAL H . . 3.900 2.926 2.731 3.090 . 0 0 "[ . 1 . 2]" 1
235 1 23 TRP H 1 24 VAL MG2 . . 4.620 4.366 4.140 4.557 . 0 0 "[ . 1 . 2]" 1
236 1 23 TRP HA 1 23 TRP HD1 . . 3.770 2.871 2.590 3.105 . 0 0 "[ . 1 . 2]" 1
237 1 23 TRP HA 1 26 ASN H . . 4.430 3.850 3.396 4.325 . 0 0 "[ . 1 . 2]" 1
238 1 23 TRP HA 1 26 ASN HB2 . . 4.730 3.939 3.218 4.725 . 0 0 "[ . 1 . 2]" 1
239 1 23 TRP HA 1 26 ASN QB . . 4.160 3.293 2.754 4.068 . 0 0 "[ . 1 . 2]" 1
240 1 23 TRP HA 1 26 ASN HB3 . . 4.730 3.667 2.841 4.673 . 0 0 "[ . 1 . 2]" 1
241 1 23 TRP QB 1 24 VAL H . . 3.640 2.652 2.289 2.862 . 0 0 "[ . 1 . 2]" 1
242 1 23 TRP QB 1 24 VAL MG2 . . 4.500 3.362 3.173 3.605 . 0 0 "[ . 1 . 2]" 1
243 1 23 TRP HB2 1 24 VAL H . . 4.150 4.011 3.756 4.149 . 0 0 "[ . 1 . 2]" 1
244 1 23 TRP HB3 1 24 VAL H . . 4.150 2.692 2.309 2.917 . 0 0 "[ . 1 . 2]" 1
245 1 23 TRP HE1 1 27 ILE MD . . 4.200 2.796 2.063 3.615 . 0 0 "[ . 1 . 2]" 1
246 1 23 TRP HE1 1 53 TYR QE . . 4.130 3.104 1.906 4.099 . 0 0 "[ . 1 . 2]" 1
247 1 23 TRP HE3 1 24 VAL H . . 4.320 3.367 2.696 3.926 . 0 0 "[ . 1 . 2]" 1
248 1 23 TRP HE3 1 24 VAL MG2 . . 3.650 2.463 1.958 3.171 . 0 0 "[ . 1 . 2]" 1
249 1 23 TRP HH2 1 49 VAL MG1 . . 3.490 2.471 1.984 2.841 . 0 0 "[ . 1 . 2]" 1
250 1 23 TRP HH2 1 49 VAL MG2 . . 4.520 4.114 3.577 4.524 0.004 19 0 "[ . 1 . 2]" 1
251 1 23 TRP HH2 1 111 LEU MD2 . . 5.500 3.659 2.847 4.306 . 0 0 "[ . 1 . 2]" 1
252 1 23 TRP HH2 1 114 LEU MD2 . . 4.680 2.683 1.975 3.454 . 0 0 "[ . 1 . 2]" 1
253 1 23 TRP HH2 1 115 ARG HA . . 4.480 4.253 3.788 4.483 0.003 19 0 "[ . 1 . 2]" 1
254 1 23 TRP HH2 1 115 ARG QB . . 4.990 3.229 2.404 4.532 . 0 0 "[ . 1 . 2]" 1
255 1 23 TRP HH2 1 118 LEU MD1 . . 4.060 3.668 3.205 3.969 . 0 0 "[ . 1 . 2]" 1
256 1 23 TRP HZ2 1 27 ILE MD . . 4.240 3.122 2.409 3.880 . 0 0 "[ . 1 . 2]" 1
257 1 23 TRP HZ2 1 49 VAL MG1 . . 3.850 2.677 1.917 3.431 . 0 0 "[ . 1 . 2]" 1
258 1 23 TRP HZ2 1 53 TYR QE . . 3.640 2.747 2.246 3.487 . 0 0 "[ . 1 . 2]" 1
259 1 23 TRP HZ2 1 114 LEU MD2 . . 4.830 4.190 3.103 4.815 . 0 0 "[ . 1 . 2]" 1
260 1 23 TRP HZ2 1 115 ARG HA . . 4.350 3.769 3.204 4.320 . 0 0 "[ . 1 . 2]" 1
261 1 23 TRP HZ2 1 118 LEU MD1 . . 3.740 3.116 2.562 3.739 . 0 0 "[ . 1 . 2]" 1
262 1 23 TRP HZ3 1 24 VAL MG2 . . 3.980 3.038 2.242 3.971 . 0 0 "[ . 1 . 2]" 1
263 1 23 TRP HZ3 1 111 LEU HB2 . . 5.000 4.350 3.789 4.998 . 0 0 "[ . 1 . 2]" 1
264 1 23 TRP HZ3 1 111 LEU QB . . 4.240 2.682 2.079 3.259 . 0 0 "[ . 1 . 2]" 1
265 1 23 TRP HZ3 1 111 LEU HB3 . . 5.000 2.709 2.088 3.303 . 0 0 "[ . 1 . 2]" 1
266 1 23 TRP HZ3 1 111 LEU MD1 . . 3.950 3.725 3.407 3.952 0.002 13 0 "[ . 1 . 2]" 1
267 1 23 TRP HZ3 1 111 LEU MD2 . . 4.980 3.197 2.484 4.030 . 0 0 "[ . 1 . 2]" 1
268 1 23 TRP HZ3 1 114 LEU MD2 . . 4.960 3.942 3.331 4.881 . 0 0 "[ . 1 . 2]" 1
269 1 24 VAL H 1 24 VAL HB . . 3.680 2.540 2.453 2.643 . 0 0 "[ . 1 . 2]" 1
270 1 24 VAL H 1 24 VAL MG1 . . 4.220 3.764 3.752 3.776 . 0 0 "[ . 1 . 2]" 1
271 1 24 VAL H 1 24 VAL MG2 . . 3.490 2.172 1.879 2.448 . 0 0 "[ . 1 . 2]" 1
272 1 24 VAL H 1 25 ASP H . . 3.950 2.729 2.472 3.028 . 0 0 "[ . 1 . 2]" 1
273 1 24 VAL H 1 26 ASN H . . 5.120 4.322 3.971 4.772 . 0 0 "[ . 1 . 2]" 1
274 1 24 VAL HA 1 24 VAL MG1 . . 3.620 2.391 2.299 2.454 . 0 0 "[ . 1 . 2]" 1
275 1 24 VAL HA 1 24 VAL MG2 . . 3.480 2.342 2.201 2.469 . 0 0 "[ . 1 . 2]" 1
276 1 24 VAL HA 1 26 ASN H . . 4.740 4.358 3.869 4.626 . 0 0 "[ . 1 . 2]" 1
277 1 24 VAL HA 1 27 ILE H . . 4.410 3.528 3.200 3.742 . 0 0 "[ . 1 . 2]" 1
278 1 24 VAL HA 1 27 ILE HB . . 4.330 3.371 2.845 4.068 . 0 0 "[ . 1 . 2]" 1
279 1 24 VAL HA 1 27 ILE MD . . 3.790 2.637 1.974 3.469 . 0 0 "[ . 1 . 2]" 1
280 1 24 VAL HA 1 27 ILE QG . . 4.120 3.567 2.542 4.096 . 0 0 "[ . 1 . 2]" 1
281 1 24 VAL HB 1 25 ASP H . . 4.100 2.473 2.166 2.949 . 0 0 "[ . 1 . 2]" 1
282 1 24 VAL MG1 1 25 ASP H . . 4.340 3.342 2.988 3.804 . 0 0 "[ . 1 . 2]" 1
283 1 24 VAL MG1 1 25 ASP HA . . 3.840 3.489 3.279 3.834 . 0 0 "[ . 1 . 2]" 1
284 1 24 VAL MG1 1 27 ILE HB . . 3.930 3.456 2.977 3.848 . 0 0 "[ . 1 . 2]" 1
285 1 24 VAL MG1 1 29 LEU MD1 . . 3.160 2.282 1.641 3.136 . 0 0 "[ . 1 . 2]" 1
286 1 24 VAL MG1 1 40 PHE QE . . 4.370 2.858 2.218 3.647 . 0 0 "[ . 1 . 2]" 1
287 1 24 VAL MG1 1 40 PHE HZ . . 3.760 2.138 1.912 3.111 . 0 0 "[ . 1 . 2]" 1
288 1 24 VAL MG2 1 25 ASP H . . 4.420 3.779 3.664 3.915 . 0 0 "[ . 1 . 2]" 1
289 1 24 VAL MG2 1 40 PHE QE . . 4.340 2.976 2.122 3.886 . 0 0 "[ . 1 . 2]" 1
290 1 24 VAL MG2 1 40 PHE HZ . . 3.510 2.327 1.769 3.377 . 0 0 "[ . 1 . 2]" 1
291 1 25 ASP H 1 25 ASP HB2 . . 3.780 2.487 2.179 3.497 . 0 0 "[ . 1 . 2]" 1
292 1 25 ASP H 1 25 ASP QB . . 3.240 2.237 2.128 2.626 . 0 0 "[ . 1 . 2]" 1
293 1 25 ASP H 1 25 ASP HB3 . . 3.780 2.758 2.188 3.598 . 0 0 "[ . 1 . 2]" 1
294 1 25 ASP H 1 26 ASN H . . 3.590 2.918 2.600 3.129 . 0 0 "[ . 1 . 2]" 1
295 1 25 ASP H 1 27 ILE H . . 4.990 4.456 4.135 4.725 . 0 0 "[ . 1 . 2]" 1
296 1 25 ASP HA 1 27 ILE H . . 4.900 4.414 3.842 4.679 . 0 0 "[ . 1 . 2]" 1
297 1 25 ASP QB 1 26 ASN H . . 3.720 2.519 2.247 3.496 . 0 0 "[ . 1 . 2]" 1
298 1 25 ASP HB2 1 26 ASN H . . 4.390 3.653 2.585 4.164 . 0 0 "[ . 1 . 2]" 1
299 1 25 ASP HB3 1 26 ASN H . . 4.390 2.658 2.268 3.756 . 0 0 "[ . 1 . 2]" 1
300 1 26 ASN H 1 26 ASN HB2 . . 3.570 2.636 2.334 3.495 . 0 0 "[ . 1 . 2]" 1
301 1 26 ASN H 1 26 ASN QB . . 2.990 2.278 2.165 2.717 . 0 0 "[ . 1 . 2]" 1
302 1 26 ASN H 1 26 ASN HB3 . . 3.570 2.600 2.186 3.587 0.017 19 0 "[ . 1 . 2]" 1
303 1 26 ASN H 1 26 ASN QD . . 4.570 4.169 1.958 4.569 . 0 0 "[ . 1 . 2]" 1
304 1 26 ASN QB 1 27 ILE H . . 3.580 2.538 2.262 3.309 . 0 0 "[ . 1 . 2]" 1
305 1 26 ASN HB2 1 27 ILE H . . 4.160 3.733 2.358 4.153 . 0 0 "[ . 1 . 2]" 1
306 1 26 ASN HB3 1 27 ILE H . . 4.160 2.700 2.281 3.701 . 0 0 "[ . 1 . 2]" 1
307 1 26 ASN HD21 1 27 ILE H . . 5.500 3.953 2.801 5.254 . 0 0 "[ . 1 . 2]" 1
308 1 26 ASN HD22 1 27 ILE H . . 5.500 4.954 3.485 5.502 0.002 7 0 "[ . 1 . 2]" 1
309 1 27 ILE H 1 27 ILE HB . . 3.510 2.571 2.460 2.819 . 0 0 "[ . 1 . 2]" 1
310 1 27 ILE H 1 27 ILE MD . . 4.500 3.377 3.070 3.699 . 0 0 "[ . 1 . 2]" 1
311 1 27 ILE H 1 27 ILE HG12 . . 4.220 3.493 3.181 3.771 . 0 0 "[ . 1 . 2]" 1
312 1 27 ILE H 1 27 ILE QG . . 3.530 2.072 1.871 2.442 . 0 0 "[ . 1 . 2]" 1
313 1 27 ILE H 1 27 ILE HG13 . . 4.220 2.088 1.882 2.475 . 0 0 "[ . 1 . 2]" 1
314 1 27 ILE H 1 27 ILE MG . . 4.170 3.770 3.752 3.834 . 0 0 "[ . 1 . 2]" 1
315 1 27 ILE H 1 28 PRO HD2 . . 5.310 4.785 4.681 4.841 . 0 0 "[ . 1 . 2]" 1
316 1 27 ILE H 1 28 PRO QD . . 4.590 4.260 4.086 4.330 . 0 0 "[ . 1 . 2]" 1
317 1 27 ILE H 1 28 PRO HD3 . . 5.310 4.781 4.504 4.898 . 0 0 "[ . 1 . 2]" 1
318 1 27 ILE HA 1 27 ILE MD . . 4.450 3.884 3.835 3.973 . 0 0 "[ . 1 . 2]" 1
319 1 27 ILE HA 1 27 ILE HG12 . . 4.160 2.693 2.546 2.867 . 0 0 "[ . 1 . 2]" 1
320 1 27 ILE HA 1 27 ILE QG . . 3.540 2.471 2.393 2.669 . 0 0 "[ . 1 . 2]" 1
321 1 27 ILE HA 1 27 ILE HG13 . . 4.160 2.894 2.650 3.221 . 0 0 "[ . 1 . 2]" 1
322 1 27 ILE HA 1 27 ILE MG . . 3.590 2.382 2.204 2.471 . 0 0 "[ . 1 . 2]" 1
323 1 27 ILE HA 1 28 PRO HD2 . . 3.550 2.076 1.934 2.175 . 0 0 "[ . 1 . 2]" 1
324 1 27 ILE HA 1 28 PRO QD . . 2.900 1.922 1.855 1.970 . 0 0 "[ . 1 . 2]" 1
325 1 27 ILE HA 1 28 PRO HD3 . . 3.550 2.277 2.252 2.383 . 0 0 "[ . 1 . 2]" 1
326 1 27 ILE HA 1 28 PRO HG2 . . 4.440 4.254 4.139 4.332 . 0 0 "[ . 1 . 2]" 1
327 1 27 ILE HA 1 28 PRO HG3 . . 4.440 4.332 4.315 4.358 . 0 0 "[ . 1 . 2]" 1
328 1 27 ILE HB 1 27 ILE MD . . 3.740 2.282 2.159 2.443 . 0 0 "[ . 1 . 2]" 1
329 1 27 ILE HB 1 29 LEU MD1 . . 3.490 2.955 2.046 3.467 . 0 0 "[ . 1 . 2]" 1
330 1 27 ILE HB 1 29 LEU HG . . 4.060 3.309 2.134 4.026 . 0 0 "[ . 1 . 2]" 1
331 1 27 ILE MD 1 27 ILE MG . . 3.210 2.208 1.964 2.428 . 0 0 "[ . 1 . 2]" 1
332 1 27 ILE MD 1 49 VAL HA . . 4.300 3.278 2.472 4.010 . 0 0 "[ . 1 . 2]" 1
333 1 27 ILE MD 1 49 VAL MG1 . . 3.420 2.150 1.861 2.532 . 0 0 "[ . 1 . 2]" 1
334 1 27 ILE MD 1 49 VAL MG2 . . 3.760 3.211 2.480 3.765 0.005 17 0 "[ . 1 . 2]" 1
335 1 27 ILE MD 1 52 PHE QD . . 4.560 4.033 3.595 4.561 0.001 4 0 "[ . 1 . 2]" 1
336 1 27 ILE MD 1 53 TYR QD . . 4.860 4.237 3.453 4.864 0.004 16 0 "[ . 1 . 2]" 1
337 1 27 ILE MD 1 53 TYR QE . . 3.650 2.939 2.369 3.646 . 0 0 "[ . 1 . 2]" 1
338 1 27 ILE QG 1 28 PRO QD . . 4.970 3.413 3.237 3.736 . 0 0 "[ . 1 . 2]" 1
339 1 27 ILE QG 1 52 PHE QE . . 4.460 4.034 3.201 4.457 . 0 0 "[ . 1 . 2]" 1
340 1 27 ILE MG 1 28 PRO HD2 . . 3.800 1.967 1.786 2.534 . 0 0 "[ . 1 . 2]" 1
341 1 27 ILE MG 1 28 PRO HD3 . . 3.800 3.321 3.126 3.760 . 0 0 "[ . 1 . 2]" 1
342 1 27 ILE MG 1 29 LEU MD1 . . 3.570 2.868 2.223 3.572 0.002 15 0 "[ . 1 . 2]" 1
343 1 27 ILE MG 1 29 LEU MD2 . . 3.440 2.913 2.280 3.354 . 0 0 "[ . 1 . 2]" 1
344 1 27 ILE MG 1 29 LEU HG . . 3.830 2.283 1.829 2.668 . 0 0 "[ . 1 . 2]" 1
345 1 27 ILE MG 1 49 VAL HA . . 3.700 2.973 2.608 3.314 . 0 0 "[ . 1 . 2]" 1
346 1 27 ILE MG 1 49 VAL MG2 . . 3.720 3.546 2.736 3.723 0.003 11 0 "[ . 1 . 2]" 1
347 1 27 ILE MG 1 52 PHE H . . 4.950 4.217 3.848 4.668 . 0 0 "[ . 1 . 2]" 1
348 1 27 ILE MG 1 52 PHE HB2 . . 4.670 2.657 2.240 3.203 . 0 0 "[ . 1 . 2]" 1
349 1 27 ILE MG 1 52 PHE QB . . 3.920 2.559 2.181 3.109 . 0 0 "[ . 1 . 2]" 1
350 1 27 ILE MG 1 52 PHE HB3 . . 4.670 3.425 2.997 4.205 . 0 0 "[ . 1 . 2]" 1
351 1 27 ILE MG 1 52 PHE QD . . 4.140 2.775 1.942 3.534 . 0 0 "[ . 1 . 2]" 1
352 1 28 PRO HA 1 29 LEU H . . 3.280 2.446 2.154 3.463 0.183 20 0 "[ . 1 . 2]" 1
353 1 28 PRO HA 1 29 LEU HB2 . . 5.110 4.664 4.485 4.986 . 0 0 "[ . 1 . 2]" 1
354 1 28 PRO HA 1 29 LEU HG . . 5.490 4.728 4.023 5.529 0.039 4 0 "[ . 1 . 2]" 1
355 1 28 PRO QB 1 29 LEU H . . 4.520 3.610 1.827 3.886 . 0 0 "[ . 1 . 2]" 1
356 1 28 PRO HD2 1 52 PHE QE . . 4.690 3.540 2.270 4.396 . 0 0 "[ . 1 . 2]" 1
357 1 28 PRO HD3 1 52 PHE QE . . 4.690 3.755 2.511 4.662 . 0 0 "[ . 1 . 2]" 1
358 1 28 PRO QG 1 52 PHE QE . . 5.350 3.898 2.810 5.253 . 0 0 "[ . 1 . 2]" 1
359 1 29 LEU H 1 29 LEU HB2 . . 3.890 2.572 2.287 3.573 . 0 0 "[ . 1 . 2]" 1
360 1 29 LEU H 1 29 LEU MD1 . . 4.450 3.898 3.415 4.253 . 0 0 "[ . 1 . 2]" 1
361 1 29 LEU H 1 29 LEU MD2 . . 5.130 4.038 3.197 4.368 . 0 0 "[ . 1 . 2]" 1
362 1 29 LEU H 1 29 LEU HG . . 4.510 3.121 2.260 3.553 . 0 0 "[ . 1 . 2]" 1
363 1 29 LEU HA 1 29 LEU MD2 . . 3.450 2.222 1.964 2.501 . 0 0 "[ . 1 . 2]" 1
364 1 29 LEU HB2 1 29 LEU MD1 . . 3.080 2.176 2.037 2.297 . 0 0 "[ . 1 . 2]" 1
365 1 29 LEU HB2 1 45 LEU MD1 . . 4.810 4.415 3.685 4.811 0.001 8 0 "[ . 1 . 2]" 1
366 1 29 LEU HB3 1 29 LEU MD1 . . 3.440 2.504 2.353 2.648 . 0 0 "[ . 1 . 2]" 1
367 1 29 LEU HB3 1 29 LEU MD2 . . 3.580 2.228 2.069 2.351 . 0 0 "[ . 1 . 2]" 1
368 1 29 LEU HB3 1 45 LEU MD1 . . 4.770 3.291 2.429 3.815 . 0 0 "[ . 1 . 2]" 1
369 1 29 LEU MD1 1 31 ARG QD . . 5.340 4.321 2.445 5.341 0.001 8 0 "[ . 1 . 2]" 1
370 1 29 LEU MD1 1 40 PHE QE . . 4.090 3.805 2.544 4.098 0.008 18 0 "[ . 1 . 2]" 1
371 1 29 LEU MD1 1 40 PHE HZ . . 3.910 3.643 2.161 3.913 0.003 8 0 "[ . 1 . 2]" 1
372 1 29 LEU MD1 1 49 VAL HA . . 4.780 3.495 2.554 4.469 . 0 0 "[ . 1 . 2]" 1
373 1 29 LEU MD1 1 49 VAL MG2 . . 3.730 2.161 1.739 2.809 . 0 0 "[ . 1 . 2]" 1
374 1 29 LEU MD2 1 31 ARG QD . . 5.340 4.217 2.350 5.212 . 0 0 "[ . 1 . 2]" 1
375 1 29 LEU MD2 1 45 LEU MD1 . . 3.350 2.553 1.899 3.128 . 0 0 "[ . 1 . 2]" 1
376 1 29 LEU MD2 1 48 GLU H . . 4.750 4.566 4.185 4.755 0.005 19 0 "[ . 1 . 2]" 1
377 1 29 LEU MD2 1 48 GLU HB2 . . 3.500 2.519 2.059 2.832 . 0 0 "[ . 1 . 2]" 1
378 1 29 LEU MD2 1 48 GLU HB3 . . 3.500 2.453 1.885 3.074 . 0 0 "[ . 1 . 2]" 1
379 1 29 LEU MD2 1 48 GLU HG2 . . 4.850 4.365 3.994 4.765 . 0 0 "[ . 1 . 2]" 1
380 1 29 LEU MD2 1 48 GLU QG . . 4.060 3.572 2.946 4.048 . 0 0 "[ . 1 . 2]" 1
381 1 29 LEU MD2 1 48 GLU HG3 . . 4.850 3.837 3.033 4.579 . 0 0 "[ . 1 . 2]" 1
382 1 29 LEU MD2 1 49 VAL H . . 4.190 3.341 2.837 3.871 . 0 0 "[ . 1 . 2]" 1
383 1 29 LEU MD2 1 49 VAL HA . . 4.240 3.027 2.020 3.958 . 0 0 "[ . 1 . 2]" 1
384 1 31 ARG HA 1 31 ARG QG . . 3.700 2.723 2.148 3.389 . 0 0 "[ . 1 . 2]" 1
385 1 31 ARG QB 1 32 PRO QD . . 3.930 2.394 1.807 3.510 . 0 0 "[ . 1 . 2]" 1
386 1 31 ARG QB 1 45 LEU MD1 . . 4.600 3.370 2.226 4.599 . 0 0 "[ . 1 . 2]" 1
387 1 31 ARG QB 1 45 LEU MD2 . . 4.720 3.524 2.489 4.722 0.002 8 0 "[ . 1 . 2]" 1
388 1 31 ARG QD 1 45 LEU MD1 . . 4.150 2.530 2.016 3.711 . 0 0 "[ . 1 . 2]" 1
389 1 31 ARG QD 1 45 LEU MD2 . . 4.050 2.681 1.969 3.848 . 0 0 "[ . 1 . 2]" 1
390 1 31 ARG HD2 1 45 LEU MD1 . . 4.740 3.119 2.080 4.737 . 0 0 "[ . 1 . 2]" 1
391 1 31 ARG HD2 1 45 LEU MD2 . . 4.610 3.375 2.086 4.614 0.004 18 0 "[ . 1 . 2]" 1
392 1 31 ARG HD3 1 45 LEU MD1 . . 4.740 3.061 2.181 4.370 . 0 0 "[ . 1 . 2]" 1
393 1 31 ARG HD3 1 45 LEU MD2 . . 4.610 2.994 2.009 4.206 . 0 0 "[ . 1 . 2]" 1
394 1 31 ARG QG 1 32 PRO QD . . 5.130 3.057 1.809 4.317 . 0 0 "[ . 1 . 2]" 1
395 1 31 ARG QG 1 45 LEU MD2 . . 4.270 3.596 2.556 4.267 . 0 0 "[ . 1 . 2]" 1
396 1 32 PRO HA 1 33 LYS QD . . 4.170 3.220 2.464 4.193 0.023 18 0 "[ . 1 . 2]" 1
397 1 32 PRO HA 1 33 LYS QE . . 4.070 3.805 3.083 4.072 0.002 14 0 "[ . 1 . 2]" 1
398 1 32 PRO HA 1 33 LYS QG . . 4.490 4.156 3.102 4.519 0.029 13 0 "[ . 1 . 2]" 1
399 1 33 LYS HA 1 33 LYS QD . . 4.340 3.356 2.004 3.866 . 0 0 "[ . 1 . 2]" 1
400 1 33 LYS HA 1 33 LYS QG . . 3.690 2.905 2.269 3.468 . 0 0 "[ . 1 . 2]" 1
401 1 33 LYS QB 1 33 LYS QE . . 4.340 3.271 1.913 3.940 . 0 0 "[ . 1 . 2]" 1
402 1 33 LYS QB 1 34 ARG H . . 4.270 3.349 1.995 4.019 . 0 0 "[ . 1 . 2]" 1
403 1 33 LYS HB2 1 34 ARG H . . 4.880 3.898 2.027 4.439 . 0 0 "[ . 1 . 2]" 1
404 1 33 LYS HB3 1 34 ARG H . . 4.880 3.887 2.049 4.665 . 0 0 "[ . 1 . 2]" 1
405 1 33 LYS QD 1 34 ARG H . . 5.340 4.366 1.957 5.299 . 0 0 "[ . 1 . 2]" 1
406 1 33 LYS QE 1 33 LYS QG . . 3.100 2.222 2.004 2.577 . 0 0 "[ . 1 . 2]" 1
407 1 33 LYS QG 1 34 ARG H . . 4.160 3.994 2.182 4.169 0.009 13 0 "[ . 1 . 2]" 1
408 1 34 ARG H 1 34 ARG QB . . 3.680 2.568 2.242 3.368 . 0 0 "[ . 1 . 2]" 1
409 1 34 ARG H 1 34 ARG QG . . 4.490 3.518 1.967 4.421 . 0 0 "[ . 1 . 2]" 1
410 1 34 ARG QB 1 34 ARG QD . . 3.300 2.232 2.088 2.600 . 0 0 "[ . 1 . 2]" 1
411 1 35 ASN HA 1 35 ASN HD21 . . 4.110 2.700 1.898 3.675 . 0 0 "[ . 1 . 2]" 1
412 1 35 ASN HA 1 35 ASN HD22 . . 4.110 3.709 3.412 4.106 . 0 0 "[ . 1 . 2]" 1
413 1 35 ASN QD 1 36 LEU H . . 4.170 3.567 2.564 4.174 0.004 11 0 "[ . 1 . 2]" 1
414 1 36 LEU H 1 37 SER HB2 . . 4.930 4.772 4.373 4.934 0.004 18 0 "[ . 1 . 2]" 1
415 1 36 LEU H 1 37 SER HB3 . . 4.930 4.798 4.498 4.936 0.006 18 0 "[ . 1 . 2]" 1
416 1 36 LEU H 1 38 ARG H . . 4.590 4.134 3.547 4.599 0.009 8 0 "[ . 1 . 2]" 1
417 1 36 LEU HA 1 36 LEU MD1 . . 4.150 3.361 2.316 4.066 . 0 0 "[ . 1 . 2]" 1
418 1 36 LEU HA 1 36 LEU MD2 . . 4.030 3.375 1.889 4.051 0.021 1 0 "[ . 1 . 2]" 1
419 1 36 LEU HA 1 36 LEU HG . . 4.040 3.099 2.395 3.704 . 0 0 "[ . 1 . 2]" 1
420 1 36 LEU HA 1 39 ASP QB . . 4.260 2.841 2.012 4.251 . 0 0 "[ . 1 . 2]" 1
421 1 36 LEU HA 1 40 PHE QD . . 3.970 3.407 2.645 3.959 . 0 0 "[ . 1 . 2]" 1
422 1 36 LEU MD1 1 40 PHE QD . . 5.050 3.451 2.208 4.863 . 0 0 "[ . 1 . 2]" 1
423 1 36 LEU MD2 1 40 PHE QD . . 4.790 3.617 2.031 4.789 . 0 0 "[ . 1 . 2]" 1
424 1 36 LEU MD2 1 40 PHE QE . . 4.380 3.201 2.118 4.244 . 0 0 "[ . 1 . 2]" 1
425 1 37 SER HA 1 40 PHE H . . 4.540 4.065 3.536 4.492 . 0 0 "[ . 1 . 2]" 1
426 1 37 SER QB 1 38 ARG H . . 4.260 2.557 2.075 3.001 . 0 0 "[ . 1 . 2]" 1
427 1 38 ARG H 1 39 ASP H . . 4.350 2.654 2.230 3.128 . 0 0 "[ . 1 . 2]" 1
428 1 38 ARG H 1 40 PHE H . . 5.110 4.333 3.758 4.764 . 0 0 "[ . 1 . 2]" 1
429 1 39 ASP H 1 40 PHE H . . 4.790 2.830 2.553 3.176 . 0 0 "[ . 1 . 2]" 1
430 1 39 ASP QB 1 40 PHE H . . 5.020 2.329 2.031 3.000 . 0 0 "[ . 1 . 2]" 1
431 1 39 ASP QB 1 40 PHE QD . . 4.500 3.175 2.453 4.430 . 0 0 "[ . 1 . 2]" 1
432 1 39 ASP QB 1 45 LEU MD2 . . 4.030 2.569 1.841 3.848 . 0 0 "[ . 1 . 2]" 1
433 1 40 PHE H 1 40 PHE QD . . 4.470 2.514 2.030 3.344 . 0 0 "[ . 1 . 2]" 1
434 1 40 PHE H 1 41 SER H . . 4.400 2.772 2.322 3.136 . 0 0 "[ . 1 . 2]" 1
435 1 40 PHE HA 1 46 VAL MG2 . . 5.150 3.132 2.488 3.612 . 0 0 "[ . 1 . 2]" 1
436 1 40 PHE QB 1 107 VAL MG1 . . 3.660 3.064 2.343 3.660 . 0 0 "[ . 1 . 2]" 1
437 1 40 PHE QB 1 107 VAL MG2 . . 3.550 2.733 2.142 3.409 . 0 0 "[ . 1 . 2]" 1
438 1 40 PHE QB 1 111 LEU MD1 . . 4.810 3.310 2.204 4.015 . 0 0 "[ . 1 . 2]" 1
439 1 40 PHE HB2 1 107 VAL MG1 . . 4.180 3.664 2.960 4.182 0.002 12 0 "[ . 1 . 2]" 1
440 1 40 PHE HB2 1 111 LEU MD1 . . 5.500 4.156 3.122 4.959 . 0 0 "[ . 1 . 2]" 1
441 1 40 PHE HB3 1 107 VAL MG1 . . 4.180 3.328 2.407 4.183 0.003 16 0 "[ . 1 . 2]" 1
442 1 40 PHE HB3 1 111 LEU MD1 . . 5.500 3.492 2.253 4.243 . 0 0 "[ . 1 . 2]" 1
443 1 40 PHE QD 1 45 LEU MD2 . . 5.210 3.373 2.107 4.902 . 0 0 "[ . 1 . 2]" 1
444 1 40 PHE QD 1 46 VAL MG1 . . 4.600 4.160 3.383 4.577 . 0 0 "[ . 1 . 2]" 1
445 1 40 PHE QD 1 46 VAL MG2 . . 3.700 2.620 1.979 3.070 . 0 0 "[ . 1 . 2]" 1
446 1 40 PHE QD 1 107 VAL MG2 . . 4.520 3.347 2.858 3.892 . 0 0 "[ . 1 . 2]" 1
447 1 40 PHE QD 1 111 LEU MD1 . . 4.260 2.501 1.962 3.138 . 0 0 "[ . 1 . 2]" 1
448 1 40 PHE QD 1 111 LEU MD2 . . 4.680 2.636 1.933 3.413 . 0 0 "[ . 1 . 2]" 1
449 1 40 PHE QE 1 45 LEU MD2 . . 4.790 3.554 1.984 4.793 0.003 1 0 "[ . 1 . 2]" 1
450 1 40 PHE QE 1 46 VAL HA . . 4.640 3.992 2.690 4.508 . 0 0 "[ . 1 . 2]" 1
451 1 40 PHE QE 1 46 VAL MG2 . . 4.750 3.703 2.837 4.189 . 0 0 "[ . 1 . 2]" 1
452 1 40 PHE QE 1 49 VAL MG2 . . 4.030 2.958 2.312 3.689 . 0 0 "[ . 1 . 2]" 1
453 1 40 PHE QE 1 111 LEU MD1 . . 4.480 2.868 2.285 3.234 . 0 0 "[ . 1 . 2]" 1
454 1 40 PHE QE 1 111 LEU MD2 . . 4.930 2.717 1.976 3.328 . 0 0 "[ . 1 . 2]" 1
455 1 40 PHE QE 1 111 LEU HG . . 5.500 5.102 4.545 5.500 0.000 10 0 "[ . 1 . 2]" 1
456 1 40 PHE HZ 1 49 VAL MG2 . . 4.350 3.310 2.341 4.242 . 0 0 "[ . 1 . 2]" 1
457 1 41 SER H 1 42 ASP H . . 5.040 2.969 2.777 3.189 . 0 0 "[ . 1 . 2]" 1
458 1 41 SER HA 1 76 TRP HE1 . . 4.750 4.089 3.003 4.747 . 0 0 "[ . 1 . 2]" 1
459 1 41 SER HA 1 99 ILE MG . . 3.640 2.675 2.003 3.464 . 0 0 "[ . 1 . 2]" 1
460 1 42 ASP H 1 43 GLY H . . 4.610 3.876 2.591 4.628 0.018 20 0 "[ . 1 . 2]" 1
461 1 42 ASP HA 1 44 VAL H . . 4.580 4.101 3.567 4.512 . 0 0 "[ . 1 . 2]" 1
462 1 43 GLY H 1 44 VAL H . . 3.910 2.955 2.552 3.308 . 0 0 "[ . 1 . 2]" 1
463 1 43 GLY H 1 44 VAL MG2 . . 4.650 4.216 3.287 4.651 0.001 4 0 "[ . 1 . 2]" 1
464 1 43 GLY H 1 76 TRP HE1 . . 4.340 2.990 1.935 4.170 . 0 0 "[ . 1 . 2]" 1
465 1 43 GLY H 1 76 TRP HZ2 . . 4.560 4.128 3.555 4.523 . 0 0 "[ . 1 . 2]" 1
466 1 43 GLY H 1 99 ILE MG . . 5.450 5.031 4.558 5.449 . 0 0 "[ . 1 . 2]" 1
467 1 43 GLY QA 1 44 VAL HA . . 5.080 4.067 4.001 4.132 . 0 0 "[ . 1 . 2]" 1
468 1 43 GLY QA 1 46 VAL MG2 . . 3.960 2.442 1.936 3.016 . 0 0 "[ . 1 . 2]" 1
469 1 43 GLY QA 1 76 TRP HE1 . . 4.420 3.184 2.701 4.279 . 0 0 "[ . 1 . 2]" 1
470 1 43 GLY QA 1 76 TRP HZ2 . . 4.520 3.051 2.468 3.839 . 0 0 "[ . 1 . 2]" 1
471 1 43 GLY QA 1 79 LEU MD1 . . 4.590 4.320 3.755 4.596 0.006 10 0 "[ . 1 . 2]" 1
472 1 43 GLY HA2 1 46 VAL HB . . 4.850 2.976 2.337 3.448 . 0 0 "[ . 1 . 2]" 1
473 1 43 GLY HA2 1 46 VAL MG2 . . 4.670 2.467 1.947 3.058 . 0 0 "[ . 1 . 2]" 1
474 1 43 GLY HA2 1 76 TRP HE1 . . 5.190 3.658 3.113 4.797 . 0 0 "[ . 1 . 2]" 1
475 1 43 GLY HA2 1 76 TRP HZ2 . . 5.290 3.141 2.513 4.010 . 0 0 "[ . 1 . 2]" 1
476 1 43 GLY HA2 1 79 LEU MD2 . . 4.780 3.880 3.286 4.417 . 0 0 "[ . 1 . 2]" 1
477 1 43 GLY HA3 1 46 VAL HB . . 4.850 4.206 3.550 4.842 . 0 0 "[ . 1 . 2]" 1
478 1 43 GLY HA3 1 46 VAL MG2 . . 4.670 3.950 3.438 4.606 . 0 0 "[ . 1 . 2]" 1
479 1 43 GLY HA3 1 76 TRP HE1 . . 5.190 3.522 2.963 4.809 . 0 0 "[ . 1 . 2]" 1
480 1 43 GLY HA3 1 76 TRP HZ2 . . 5.290 4.180 3.512 4.907 . 0 0 "[ . 1 . 2]" 1
481 1 43 GLY HA3 1 79 LEU MD2 . . 4.780 3.849 2.978 4.442 . 0 0 "[ . 1 . 2]" 1
482 1 44 VAL H 1 44 VAL HB . . 3.470 2.613 2.401 2.692 . 0 0 "[ . 1 . 2]" 1
483 1 44 VAL H 1 44 VAL MG1 . . 3.990 3.782 3.736 3.863 . 0 0 "[ . 1 . 2]" 1
484 1 44 VAL H 1 44 VAL MG2 . . 3.240 2.208 1.908 2.679 . 0 0 "[ . 1 . 2]" 1
485 1 44 VAL H 1 45 LEU H . . 4.180 2.802 2.020 3.159 . 0 0 "[ . 1 . 2]" 1
486 1 44 VAL HA 1 44 VAL MG1 . . 3.530 2.406 2.296 2.491 . 0 0 "[ . 1 . 2]" 1
487 1 44 VAL HA 1 44 VAL MG2 . . 3.430 2.315 2.130 2.449 . 0 0 "[ . 1 . 2]" 1
488 1 44 VAL HA 1 47 ALA H . . 4.710 3.857 3.506 4.258 . 0 0 "[ . 1 . 2]" 1
489 1 44 VAL HA 1 47 ALA MB . . 3.770 3.217 2.769 3.700 . 0 0 "[ . 1 . 2]" 1
490 1 44 VAL HA 1 60 MET ME . . 4.190 2.686 2.008 3.673 . 0 0 "[ . 1 . 2]" 1
491 1 44 VAL HA 1 63 TYR HB2 . . 4.640 4.352 3.710 4.608 . 0 0 "[ . 1 . 2]" 1
492 1 44 VAL HA 1 63 TYR QB . . 3.890 3.589 3.321 3.835 . 0 0 "[ . 1 . 2]" 1
493 1 44 VAL HA 1 63 TYR HB3 . . 4.640 3.858 3.444 4.505 . 0 0 "[ . 1 . 2]" 1
494 1 44 VAL HB 1 45 LEU H . . 4.620 2.579 2.044 3.208 . 0 0 "[ . 1 . 2]" 1
495 1 44 VAL HB 1 45 LEU HA . . 4.970 4.292 4.125 4.711 . 0 0 "[ . 1 . 2]" 1
496 1 44 VAL HB 1 65 PRO HA . . 4.350 4.077 3.634 4.340 . 0 0 "[ . 1 . 2]" 1
497 1 44 VAL HB 1 65 PRO HD3 . . 5.500 5.193 4.250 5.501 0.001 2 0 "[ . 1 . 2]" 1
498 1 44 VAL MG1 1 45 LEU H . . 4.830 3.379 3.007 3.832 . 0 0 "[ . 1 . 2]" 1
499 1 44 VAL MG1 1 45 LEU HA . . 3.840 3.443 3.151 3.698 . 0 0 "[ . 1 . 2]" 1
500 1 44 VAL MG1 1 48 GLU H . . 5.240 4.611 3.835 5.081 . 0 0 "[ . 1 . 2]" 1
501 1 44 VAL MG1 1 48 GLU QG . . 4.080 3.569 2.725 4.080 0.000 18 0 "[ . 1 . 2]" 1
502 1 44 VAL MG1 1 60 MET ME . . 3.080 2.064 1.767 2.720 . 0 0 "[ . 1 . 2]" 1
503 1 44 VAL MG1 1 65 PRO HA . . 4.340 3.785 3.166 4.310 . 0 0 "[ . 1 . 2]" 1
504 1 44 VAL MG2 1 45 LEU H . . 4.620 3.832 3.605 4.191 . 0 0 "[ . 1 . 2]" 1
505 1 44 VAL MG2 1 60 MET ME . . 3.590 3.160 2.272 3.587 . 0 0 "[ . 1 . 2]" 1
506 1 44 VAL MG2 1 63 TYR HB2 . . 4.400 3.816 3.185 4.364 . 0 0 "[ . 1 . 2]" 1
507 1 44 VAL MG2 1 63 TYR QB . . 3.520 2.779 2.039 3.295 . 0 0 "[ . 1 . 2]" 1
508 1 44 VAL MG2 1 63 TYR HB3 . . 4.400 2.868 2.053 3.409 . 0 0 "[ . 1 . 2]" 1
509 1 44 VAL MG2 1 63 TYR QD . . 4.700 4.317 3.410 4.688 . 0 0 "[ . 1 . 2]" 1
510 1 44 VAL MG2 1 64 VAL H . . 4.530 3.592 2.712 4.082 . 0 0 "[ . 1 . 2]" 1
511 1 44 VAL MG2 1 65 PRO HA . . 3.580 2.264 1.894 2.768 . 0 0 "[ . 1 . 2]" 1
512 1 44 VAL MG2 1 66 ALA H . . 4.380 3.684 3.308 4.129 . 0 0 "[ . 1 . 2]" 1
513 1 44 VAL MG2 1 75 ASN QB . . 4.840 3.686 2.927 4.243 . 0 0 "[ . 1 . 2]" 1
514 1 44 VAL MG2 1 75 ASN HD21 . . 4.180 2.813 2.209 3.936 . 0 0 "[ . 1 . 2]" 1
515 1 44 VAL MG2 1 75 ASN HD22 . . 4.120 3.433 2.842 4.072 . 0 0 "[ . 1 . 2]" 1
516 1 45 LEU H 1 45 LEU MD1 . . 5.500 4.112 3.826 4.355 . 0 0 "[ . 1 . 2]" 1
517 1 45 LEU H 1 45 LEU HG . . 4.590 4.423 3.866 4.620 0.030 6 0 "[ . 1 . 2]" 1
518 1 45 LEU H 1 46 VAL H . . 4.280 2.689 2.271 3.011 . 0 0 "[ . 1 . 2]" 1
519 1 45 LEU HA 1 45 LEU MD1 . . 3.420 2.250 1.970 2.796 . 0 0 "[ . 1 . 2]" 1
520 1 45 LEU HA 1 45 LEU MD2 . . 4.680 3.495 1.988 3.978 . 0 0 "[ . 1 . 2]" 1
521 1 45 LEU HA 1 45 LEU HG . . 4.010 3.300 2.851 3.726 . 0 0 "[ . 1 . 2]" 1
522 1 45 LEU HA 1 48 GLU H . . 3.830 3.444 3.194 3.829 . 0 0 "[ . 1 . 2]" 1
523 1 45 LEU HA 1 48 GLU HB2 . . 3.720 3.362 2.945 3.722 0.002 8 0 "[ . 1 . 2]" 1
524 1 45 LEU HA 1 48 GLU QG . . 3.400 2.648 2.150 3.338 . 0 0 "[ . 1 . 2]" 1
525 1 45 LEU QB 1 45 LEU MD1 . . 2.840 2.259 1.995 2.434 . 0 0 "[ . 1 . 2]" 1
526 1 45 LEU QB 1 46 VAL H . . 3.730 2.451 2.178 2.743 . 0 0 "[ . 1 . 2]" 1
527 1 45 LEU HB2 1 46 VAL H . . 4.310 3.707 2.498 4.040 . 0 0 "[ . 1 . 2]" 1
528 1 45 LEU HB3 1 46 VAL H . . 4.310 2.511 2.204 2.902 . 0 0 "[ . 1 . 2]" 1
529 1 45 LEU MD1 1 48 GLU H . . 4.790 4.182 3.743 4.753 . 0 0 "[ . 1 . 2]" 1
530 1 45 LEU MD2 1 46 VAL H . . 5.500 4.208 3.723 4.750 . 0 0 "[ . 1 . 2]" 1
531 1 46 VAL H 1 46 VAL HB . . 3.560 2.622 2.375 2.716 . 0 0 "[ . 1 . 2]" 1
532 1 46 VAL H 1 46 VAL MG1 . . 4.700 3.768 3.728 3.777 . 0 0 "[ . 1 . 2]" 1
533 1 46 VAL H 1 46 VAL MG2 . . 3.190 2.000 1.878 2.557 . 0 0 "[ . 1 . 2]" 1
534 1 46 VAL H 1 47 ALA H . . 3.600 2.903 2.648 3.088 . 0 0 "[ . 1 . 2]" 1
535 1 46 VAL HA 1 46 VAL MG1 . . 3.480 2.435 2.326 2.476 . 0 0 "[ . 1 . 2]" 1
536 1 46 VAL HA 1 46 VAL MG2 . . 3.370 2.370 2.154 2.440 . 0 0 "[ . 1 . 2]" 1
537 1 46 VAL HA 1 49 VAL H . . 3.840 3.566 3.314 3.810 . 0 0 "[ . 1 . 2]" 1
538 1 46 VAL HA 1 49 VAL HB . . 3.740 3.408 2.983 3.676 . 0 0 "[ . 1 . 2]" 1
539 1 46 VAL HA 1 49 VAL MG1 . . 4.780 4.519 4.230 4.770 . 0 0 "[ . 1 . 2]" 1
540 1 46 VAL HA 1 49 VAL MG2 . . 3.870 2.561 2.276 3.034 . 0 0 "[ . 1 . 2]" 1
541 1 46 VAL HA 1 50 ILE H . . 5.310 4.957 4.689 5.199 . 0 0 "[ . 1 . 2]" 1
542 1 46 VAL HB 1 47 ALA H . . 3.860 2.563 2.285 2.873 . 0 0 "[ . 1 . 2]" 1
543 1 46 VAL HB 1 47 ALA HA . . 5.130 4.216 4.099 4.421 . 0 0 "[ . 1 . 2]" 1
544 1 46 VAL HB 1 76 TRP HH2 . . 5.210 4.502 3.789 5.009 . 0 0 "[ . 1 . 2]" 1
545 1 46 VAL HB 1 79 LEU MD2 . . 3.550 3.101 2.633 3.543 . 0 0 "[ . 1 . 2]" 1
546 1 46 VAL MG1 1 47 ALA H . . 4.460 3.413 3.217 3.648 . 0 0 "[ . 1 . 2]" 1
547 1 46 VAL MG1 1 47 ALA HA . . 4.560 3.493 3.267 3.709 . 0 0 "[ . 1 . 2]" 1
548 1 46 VAL MG1 1 49 VAL HB . . 4.610 3.414 2.902 3.804 . 0 0 "[ . 1 . 2]" 1
549 1 46 VAL MG1 1 50 ILE HG12 . . 4.550 4.307 3.948 4.550 . 0 0 "[ . 1 . 2]" 1
550 1 46 VAL MG1 1 50 ILE HG13 . . 3.550 3.371 3.059 3.531 . 0 0 "[ . 1 . 2]" 1
551 1 46 VAL MG1 1 76 TRP HH2 . . 4.200 3.484 2.916 3.967 . 0 0 "[ . 1 . 2]" 1
552 1 46 VAL MG1 1 76 TRP HZ3 . . 4.480 4.112 3.688 4.474 . 0 0 "[ . 1 . 2]" 1
553 1 46 VAL MG1 1 79 LEU MD2 . . 3.250 2.733 2.255 3.222 . 0 0 "[ . 1 . 2]" 1
554 1 46 VAL MG2 1 47 ALA H . . 4.520 3.819 3.706 3.986 . 0 0 "[ . 1 . 2]" 1
555 1 46 VAL MG2 1 76 TRP HH2 . . 3.450 2.655 2.064 3.091 . 0 0 "[ . 1 . 2]" 1
556 1 46 VAL MG2 1 76 TRP HZ2 . . 3.900 2.820 2.215 3.185 . 0 0 "[ . 1 . 2]" 1
557 1 46 VAL MG2 1 76 TRP HZ3 . . 4.670 4.318 3.955 4.668 . 0 0 "[ . 1 . 2]" 1
558 1 46 VAL MG2 1 79 LEU MD2 . . 4.210 3.844 3.498 4.117 . 0 0 "[ . 1 . 2]" 1
559 1 46 VAL MG2 1 111 LEU MD1 . . 4.420 4.021 3.299 4.420 0.000 19 0 "[ . 1 . 2]" 1
560 1 46 VAL MG2 1 111 LEU MD2 . . 4.740 2.862 2.157 3.353 . 0 0 "[ . 1 . 2]" 1
561 1 47 ALA H 1 47 ALA MB . . 3.370 2.202 2.073 2.254 . 0 0 "[ . 1 . 2]" 1
562 1 47 ALA H 1 48 GLU H . . 3.800 2.825 2.644 3.139 . 0 0 "[ . 1 . 2]" 1
563 1 47 ALA H 1 60 MET ME . . 5.480 4.483 3.464 5.450 . 0 0 "[ . 1 . 2]" 1
564 1 47 ALA H 1 79 LEU MD1 . . 4.660 4.091 3.740 4.531 . 0 0 "[ . 1 . 2]" 1
565 1 47 ALA H 1 79 LEU MD2 . . 4.590 3.951 3.490 4.394 . 0 0 "[ . 1 . 2]" 1
566 1 47 ALA HA 1 50 ILE H . . 4.220 3.561 3.317 3.703 . 0 0 "[ . 1 . 2]" 1
567 1 47 ALA HA 1 50 ILE HB . . 3.930 3.420 3.215 3.650 . 0 0 "[ . 1 . 2]" 1
568 1 47 ALA HA 1 50 ILE MD . . 3.700 2.143 1.943 2.476 . 0 0 "[ . 1 . 2]" 1
569 1 47 ALA HA 1 50 ILE HG12 . . 4.860 4.599 4.163 4.823 . 0 0 "[ . 1 . 2]" 1
570 1 47 ALA HA 1 51 LYS H . . 4.930 4.706 4.299 4.916 . 0 0 "[ . 1 . 2]" 1
571 1 47 ALA HA 1 58 VAL MG2 . . 4.520 3.575 2.901 4.208 . 0 0 "[ . 1 . 2]" 1
572 1 47 ALA HA 1 79 LEU MD1 . . 3.740 3.512 3.161 3.733 . 0 0 "[ . 1 . 2]" 1
573 1 47 ALA HA 1 79 LEU MD2 . . 4.490 3.962 3.433 4.348 . 0 0 "[ . 1 . 2]" 1
574 1 47 ALA MB 1 48 GLU H . . 3.460 2.507 2.275 2.818 . 0 0 "[ . 1 . 2]" 1
575 1 47 ALA MB 1 48 GLU HA . . 4.630 3.769 3.706 3.858 . 0 0 "[ . 1 . 2]" 1
576 1 47 ALA MB 1 63 TYR QD . . 4.110 3.844 3.185 4.109 . 0 0 "[ . 1 . 2]" 1
577 1 47 ALA MB 1 79 LEU MD1 . . 3.310 2.641 2.309 3.002 . 0 0 "[ . 1 . 2]" 1
578 1 47 ALA MB 1 79 LEU MD2 . . 3.990 3.598 3.131 3.922 . 0 0 "[ . 1 . 2]" 1
579 1 48 GLU H 1 48 GLU HB2 . . 3.580 2.531 2.310 2.740 . 0 0 "[ . 1 . 2]" 1
580 1 48 GLU H 1 48 GLU HB3 . . 4.110 3.588 3.558 3.602 . 0 0 "[ . 1 . 2]" 1
581 1 48 GLU H 1 48 GLU HG2 . . 4.280 2.663 1.910 3.612 . 0 0 "[ . 1 . 2]" 1
582 1 48 GLU H 1 48 GLU QG . . 3.440 2.180 1.896 2.576 . 0 0 "[ . 1 . 2]" 1
583 1 48 GLU H 1 48 GLU HG3 . . 4.280 2.876 1.959 3.684 . 0 0 "[ . 1 . 2]" 1
584 1 48 GLU H 1 49 VAL H . . 3.840 2.848 2.615 3.023 . 0 0 "[ . 1 . 2]" 1
585 1 48 GLU H 1 58 VAL MG2 . . 5.290 4.692 4.106 5.110 . 0 0 "[ . 1 . 2]" 1
586 1 48 GLU HA 1 51 LYS H . . 4.390 3.343 3.139 3.587 . 0 0 "[ . 1 . 2]" 1
587 1 48 GLU HA 1 51 LYS HB2 . . 4.060 2.724 2.435 3.181 . 0 0 "[ . 1 . 2]" 1
588 1 48 GLU HA 1 51 LYS QB . . 3.410 2.615 2.334 2.866 . 0 0 "[ . 1 . 2]" 1
589 1 48 GLU HA 1 51 LYS HB3 . . 4.060 3.521 2.993 4.050 . 0 0 "[ . 1 . 2]" 1
590 1 48 GLU HA 1 51 LYS QG . . 4.510 4.176 3.747 4.500 . 0 0 "[ . 1 . 2]" 1
591 1 48 GLU HB2 1 49 VAL H . . 4.010 2.521 2.326 2.688 . 0 0 "[ . 1 . 2]" 1
592 1 48 GLU HB2 1 49 VAL HA . . 4.880 4.251 4.024 4.541 . 0 0 "[ . 1 . 2]" 1
593 1 48 GLU HB3 1 49 VAL H . . 3.890 3.519 3.221 3.859 . 0 0 "[ . 1 . 2]" 1
594 1 48 GLU HB3 1 49 VAL HA . . 5.030 4.359 4.063 4.711 . 0 0 "[ . 1 . 2]" 1
595 1 49 VAL H 1 49 VAL HB . . 3.400 2.580 2.469 2.716 . 0 0 "[ . 1 . 2]" 1
596 1 49 VAL H 1 49 VAL MG1 . . 3.940 3.765 3.753 3.772 . 0 0 "[ . 1 . 2]" 1
597 1 49 VAL H 1 49 VAL MG2 . . 3.430 2.103 1.899 2.343 . 0 0 "[ . 1 . 2]" 1
598 1 49 VAL H 1 50 ILE H . . 3.750 2.864 2.697 3.061 . 0 0 "[ . 1 . 2]" 1
599 1 49 VAL HA 1 49 VAL MG1 . . 3.450 2.421 2.323 2.509 . 0 0 "[ . 1 . 2]" 1
600 1 49 VAL HA 1 49 VAL MG2 . . 3.380 2.320 2.201 2.433 . 0 0 "[ . 1 . 2]" 1
601 1 49 VAL HA 1 51 LYS H . . 5.320 4.401 4.106 4.732 . 0 0 "[ . 1 . 2]" 1
602 1 49 VAL HA 1 52 PHE H . . 4.200 4.009 3.819 4.197 . 0 0 "[ . 1 . 2]" 1
603 1 49 VAL HA 1 52 PHE HB2 . . 4.580 4.255 3.822 4.576 . 0 0 "[ . 1 . 2]" 1
604 1 49 VAL HA 1 52 PHE HB3 . . 4.580 4.386 4.061 4.578 . 0 0 "[ . 1 . 2]" 1
605 1 49 VAL HB 1 50 ILE H . . 3.690 2.575 2.233 3.015 . 0 0 "[ . 1 . 2]" 1
606 1 49 VAL MG1 1 50 ILE H . . 4.160 3.370 3.097 3.712 . 0 0 "[ . 1 . 2]" 1
607 1 49 VAL MG1 1 50 ILE HA . . 4.200 3.406 3.170 3.698 . 0 0 "[ . 1 . 2]" 1
608 1 49 VAL MG1 1 53 TYR H . . 5.310 4.880 4.588 5.206 . 0 0 "[ . 1 . 2]" 1
609 1 49 VAL MG1 1 53 TYR QE . . 3.690 3.147 2.339 3.693 0.003 2 0 "[ . 1 . 2]" 1
610 1 49 VAL MG2 1 50 ILE H . . 4.260 3.837 3.714 4.041 . 0 0 "[ . 1 . 2]" 1
611 1 50 ILE H 1 50 ILE HB . . 3.460 2.609 2.539 2.662 . 0 0 "[ . 1 . 2]" 1
612 1 50 ILE H 1 50 ILE MD . . 3.660 3.311 3.069 3.447 . 0 0 "[ . 1 . 2]" 1
613 1 50 ILE H 1 50 ILE HG12 . . 3.620 3.425 3.289 3.580 . 0 0 "[ . 1 . 2]" 1
614 1 50 ILE H 1 50 ILE HG13 . . 3.260 1.981 1.903 2.089 . 0 0 "[ . 1 . 2]" 1
615 1 50 ILE H 1 50 ILE MG . . 4.140 3.769 3.762 3.789 . 0 0 "[ . 1 . 2]" 1
616 1 50 ILE H 1 51 LYS H . . 3.710 2.667 2.420 2.937 . 0 0 "[ . 1 . 2]" 1
617 1 50 ILE H 1 58 VAL MG2 . . 4.500 3.714 3.391 3.989 . 0 0 "[ . 1 . 2]" 1
618 1 50 ILE HA 1 50 ILE MD . . 4.260 3.897 3.849 3.927 . 0 0 "[ . 1 . 2]" 1
619 1 50 ILE HA 1 50 ILE HG12 . . 3.770 2.721 2.583 2.880 . 0 0 "[ . 1 . 2]" 1
620 1 50 ILE HA 1 50 ILE HG13 . . 3.660 2.894 2.764 3.033 . 0 0 "[ . 1 . 2]" 1
621 1 50 ILE HA 1 50 ILE MG . . 3.170 2.286 2.199 2.422 . 0 0 "[ . 1 . 2]" 1
622 1 50 ILE HA 1 53 TYR H . . 3.980 3.450 3.268 3.669 . 0 0 "[ . 1 . 2]" 1
623 1 50 ILE HA 1 53 TYR QB . . 4.790 3.157 2.965 3.412 . 0 0 "[ . 1 . 2]" 1
624 1 50 ILE HA 1 53 TYR QD . . 4.030 2.798 2.113 3.627 . 0 0 "[ . 1 . 2]" 1
625 1 50 ILE HA 1 54 PHE H . . 5.040 3.895 3.606 4.195 . 0 0 "[ . 1 . 2]" 1
626 1 50 ILE HA 1 118 LEU MD1 . . 3.560 2.806 2.246 3.233 . 0 0 "[ . 1 . 2]" 1
627 1 50 ILE HB 1 50 ILE MD . . 3.450 2.274 2.117 2.419 . 0 0 "[ . 1 . 2]" 1
628 1 50 ILE HB 1 51 LYS H . . 4.160 2.636 2.451 2.877 . 0 0 "[ . 1 . 2]" 1
629 1 50 ILE HB 1 51 LYS HA . . 4.750 4.106 4.037 4.182 . 0 0 "[ . 1 . 2]" 1
630 1 50 ILE HB 1 58 VAL MG2 . . 3.800 2.169 1.928 2.556 . 0 0 "[ . 1 . 2]" 1
631 1 50 ILE MD 1 50 ILE MG . . 2.740 2.181 1.974 2.490 . 0 0 "[ . 1 . 2]" 1
632 1 50 ILE MD 1 51 LYS H . . 4.550 4.375 4.111 4.532 . 0 0 "[ . 1 . 2]" 1
633 1 50 ILE MD 1 79 LEU MD1 . . 3.760 3.354 2.959 3.749 . 0 0 "[ . 1 . 2]" 1
634 1 50 ILE MD 1 79 LEU MD2 . . 3.740 3.367 3.066 3.717 . 0 0 "[ . 1 . 2]" 1
635 1 50 ILE HG12 1 50 ILE MG . . 3.690 2.243 2.046 2.333 . 0 0 "[ . 1 . 2]" 1
636 1 50 ILE HG12 1 118 LEU MD1 . . 3.800 2.911 2.054 3.479 . 0 0 "[ . 1 . 2]" 1
637 1 50 ILE HG13 1 118 LEU MD1 . . 4.200 3.780 2.922 4.205 0.005 19 0 "[ . 1 . 2]" 1
638 1 50 ILE MG 1 51 LYS H . . 4.380 3.584 3.351 3.807 . 0 0 "[ . 1 . 2]" 1
639 1 50 ILE MG 1 53 TYR HB2 . . 4.400 2.975 2.653 3.496 . 0 0 "[ . 1 . 2]" 1
640 1 50 ILE MG 1 53 TYR QB . . 3.610 2.913 2.610 3.367 . 0 0 "[ . 1 . 2]" 1
641 1 50 ILE MG 1 53 TYR HB3 . . 4.400 4.186 3.870 4.401 0.001 16 0 "[ . 1 . 2]" 1
642 1 50 ILE MG 1 54 PHE H . . 4.200 2.781 2.374 3.099 . 0 0 "[ . 1 . 2]" 1
643 1 50 ILE MG 1 54 PHE HB2 . . 4.420 2.779 2.391 3.008 . 0 0 "[ . 1 . 2]" 1
644 1 50 ILE MG 1 54 PHE QB . . 3.780 2.742 2.364 2.959 . 0 0 "[ . 1 . 2]" 1
645 1 50 ILE MG 1 54 PHE HB3 . . 4.420 4.211 3.716 4.421 0.001 3 0 "[ . 1 . 2]" 1
646 1 50 ILE MG 1 54 PHE QD . . 3.640 2.771 2.238 3.276 . 0 0 "[ . 1 . 2]" 1
647 1 50 ILE MG 1 57 MET HB2 . . 3.860 2.548 2.087 3.117 . 0 0 "[ . 1 . 2]" 1
648 1 50 ILE MG 1 57 MET QB . . 3.370 2.380 1.855 2.940 . 0 0 "[ . 1 . 2]" 1
649 1 50 ILE MG 1 57 MET HB3 . . 3.860 2.905 2.078 3.794 . 0 0 "[ . 1 . 2]" 1
650 1 50 ILE MG 1 57 MET QG . . 3.840 3.513 3.038 3.847 0.007 2 0 "[ . 1 . 2]" 1
651 1 50 ILE MG 1 118 LEU MD1 . . 3.900 3.345 2.672 3.742 . 0 0 "[ . 1 . 2]" 1
652 1 51 LYS H 1 51 LYS HB2 . . 3.410 2.299 2.163 2.606 . 0 0 "[ . 1 . 2]" 1
653 1 51 LYS H 1 51 LYS QB . . 2.970 2.187 2.118 2.267 . 0 0 "[ . 1 . 2]" 1
654 1 51 LYS H 1 51 LYS HB3 . . 3.410 2.848 2.481 3.069 . 0 0 "[ . 1 . 2]" 1
655 1 51 LYS H 1 51 LYS QG . . 4.120 3.947 3.729 4.066 . 0 0 "[ . 1 . 2]" 1
656 1 51 LYS H 1 52 PHE H . . 3.720 3.063 2.828 3.255 . 0 0 "[ . 1 . 2]" 1
657 1 51 LYS H 1 58 VAL HB . . 5.430 4.677 4.000 5.360 . 0 0 "[ . 1 . 2]" 1
658 1 51 LYS H 1 58 VAL MG2 . . 3.480 2.197 1.854 2.463 . 0 0 "[ . 1 . 2]" 1
659 1 51 LYS HA 1 51 LYS HD2 . . 4.280 2.952 2.343 4.107 . 0 0 "[ . 1 . 2]" 1
660 1 51 LYS HA 1 51 LYS HD3 . . 4.280 3.248 2.294 3.942 . 0 0 "[ . 1 . 2]" 1
661 1 51 LYS HA 1 51 LYS HE2 . . 5.310 4.746 3.714 5.296 . 0 0 "[ . 1 . 2]" 1
662 1 51 LYS HA 1 51 LYS QE . . 4.580 4.135 3.502 4.519 . 0 0 "[ . 1 . 2]" 1
663 1 51 LYS HA 1 51 LYS HE3 . . 5.310 4.638 4.106 5.117 . 0 0 "[ . 1 . 2]" 1
664 1 51 LYS HA 1 51 LYS QG . . 3.420 2.524 2.257 2.966 . 0 0 "[ . 1 . 2]" 1
665 1 51 LYS HA 1 53 TYR H . . 4.760 4.361 3.895 4.763 0.003 2 0 "[ . 1 . 2]" 1
666 1 51 LYS HA 1 54 PHE H . . 3.970 3.699 3.095 3.964 . 0 0 "[ . 1 . 2]" 1
667 1 51 LYS HA 1 54 PHE QB . . 5.340 4.659 4.136 5.140 . 0 0 "[ . 1 . 2]" 1
668 1 51 LYS HA 1 55 PRO HA . . 3.740 2.446 1.998 2.801 . 0 0 "[ . 1 . 2]" 1
669 1 51 LYS HA 1 55 PRO QB . . 4.450 4.045 3.434 4.453 0.003 12 0 "[ . 1 . 2]" 1
670 1 51 LYS HA 1 58 VAL H . . 4.530 4.066 3.642 4.445 . 0 0 "[ . 1 . 2]" 1
671 1 51 LYS HA 1 58 VAL HB . . 4.400 3.595 3.083 4.293 . 0 0 "[ . 1 . 2]" 1
672 1 51 LYS HA 1 58 VAL MG1 . . 4.840 4.114 3.842 4.286 . 0 0 "[ . 1 . 2]" 1
673 1 51 LYS HA 1 58 VAL MG2 . . 3.720 2.119 1.820 2.628 . 0 0 "[ . 1 . 2]" 1
674 1 51 LYS QB 1 51 LYS QD . . 3.240 2.245 2.054 2.611 . 0 0 "[ . 1 . 2]" 1
675 1 51 LYS QB 1 51 LYS QE . . 4.330 3.313 2.012 3.803 . 0 0 "[ . 1 . 2]" 1
676 1 51 LYS QB 1 55 PRO HA . . 4.720 3.911 3.668 4.263 . 0 0 "[ . 1 . 2]" 1
677 1 51 LYS QB 1 58 VAL MG2 . . 3.170 2.272 1.980 2.647 . 0 0 "[ . 1 . 2]" 1
678 1 51 LYS HB2 1 52 PHE H . . 3.860 3.582 3.297 3.848 . 0 0 "[ . 1 . 2]" 1
679 1 51 LYS HB2 1 55 PRO HA . . 5.400 4.211 3.913 4.522 . 0 0 "[ . 1 . 2]" 1
680 1 51 LYS HB2 1 58 VAL MG2 . . 3.950 2.298 1.994 2.689 . 0 0 "[ . 1 . 2]" 1
681 1 51 LYS HB3 1 52 PHE H . . 3.860 2.320 2.047 2.613 . 0 0 "[ . 1 . 2]" 1
682 1 51 LYS HB3 1 55 PRO HA . . 5.400 4.687 4.264 5.404 0.004 7 0 "[ . 1 . 2]" 1
683 1 51 LYS HB3 1 58 VAL MG2 . . 3.950 3.609 3.286 3.951 0.001 6 0 "[ . 1 . 2]" 1
684 1 51 LYS HD2 1 55 PRO HA . . 4.450 2.667 1.999 4.447 . 0 0 "[ . 1 . 2]" 1
685 1 51 LYS HD3 1 55 PRO HA . . 4.450 3.174 1.998 4.177 . 0 0 "[ . 1 . 2]" 1
686 1 51 LYS QE 1 55 PRO HA . . 4.240 3.389 2.380 4.239 . 0 0 "[ . 1 . 2]" 1
687 1 51 LYS QE 1 55 PRO QB . . 4.390 2.973 2.001 4.308 . 0 0 "[ . 1 . 2]" 1
688 1 51 LYS HE2 1 55 PRO HA . . 5.000 4.084 2.464 5.002 0.002 19 0 "[ . 1 . 2]" 1
689 1 51 LYS HE3 1 55 PRO HA . . 5.000 3.786 2.442 4.995 . 0 0 "[ . 1 . 2]" 1
690 1 51 LYS QG 1 52 PHE H . . 4.250 3.795 3.101 4.250 0.000 20 0 "[ . 1 . 2]" 1
691 1 51 LYS QG 1 55 PRO HA . . 3.810 2.696 2.033 3.810 . 7 0 "[ . 1 . 2]" 1
692 1 51 LYS QG 1 55 PRO QB . . 5.290 3.223 2.499 4.122 . 0 0 "[ . 1 . 2]" 1
693 1 52 PHE H 1 52 PHE HB2 . . 3.360 2.447 2.248 2.645 . 0 0 "[ . 1 . 2]" 1
694 1 52 PHE H 1 52 PHE HB3 . . 3.360 2.668 2.423 2.962 . 0 0 "[ . 1 . 2]" 1
695 1 52 PHE H 1 52 PHE QD . . 4.370 4.151 3.987 4.207 . 0 0 "[ . 1 . 2]" 1
696 1 52 PHE H 1 53 TYR H . . 3.470 2.959 2.666 3.199 . 0 0 "[ . 1 . 2]" 1
697 1 52 PHE H 1 54 PHE H . . 4.900 4.638 4.229 4.900 0.000 19 0 "[ . 1 . 2]" 1
698 1 52 PHE H 1 58 VAL MG2 . . 4.610 4.430 4.170 4.618 0.008 10 0 "[ . 1 . 2]" 1
699 1 52 PHE HA 1 52 PHE QD . . 3.540 2.991 2.170 3.182 . 0 0 "[ . 1 . 2]" 1
700 1 52 PHE QB 1 53 TYR H . . 3.550 2.464 2.113 2.871 . 0 0 "[ . 1 . 2]" 1
701 1 52 PHE HB2 1 53 TYR H . . 4.130 3.799 3.454 3.991 . 0 0 "[ . 1 . 2]" 1
702 1 52 PHE HB3 1 53 TYR H . . 4.130 2.498 2.132 2.943 . 0 0 "[ . 1 . 2]" 1
703 1 52 PHE QD 1 53 TYR H . . 4.370 3.290 2.563 3.828 . 0 0 "[ . 1 . 2]" 1
704 1 52 PHE QD 1 53 TYR QD . . 4.770 3.375 2.431 3.880 . 0 0 "[ . 1 . 2]" 1
705 1 53 TYR H 1 53 TYR HB2 . . 3.680 2.390 2.306 2.503 . 0 0 "[ . 1 . 2]" 1
706 1 53 TYR H 1 53 TYR HB3 . . 3.680 3.595 3.555 3.659 . 0 0 "[ . 1 . 2]" 1
707 1 53 TYR H 1 54 PHE H . . 3.200 2.664 2.343 2.847 . 0 0 "[ . 1 . 2]" 1
708 1 53 TYR H 1 58 VAL MG2 . . 5.500 5.132 4.604 5.503 0.003 2 0 "[ . 1 . 2]" 1
709 1 53 TYR HA 1 53 TYR QD . . 3.850 2.885 2.407 3.134 . 0 0 "[ . 1 . 2]" 1
710 1 53 TYR QB 1 54 PHE HA . . 4.760 4.179 4.061 4.319 . 0 0 "[ . 1 . 2]" 1
711 1 53 TYR QB 1 54 PHE QD . . 3.660 2.939 2.420 3.267 . 0 0 "[ . 1 . 2]" 1
712 1 53 TYR QB 1 54 PHE QE . . 3.790 3.173 2.649 3.670 . 0 0 "[ . 1 . 2]" 1
713 1 53 TYR QB 1 118 LEU HB3 . . 3.420 3.192 2.676 3.424 0.004 14 0 "[ . 1 . 2]" 1
714 1 53 TYR QB 1 118 LEU MD2 . . 3.430 2.557 2.058 3.066 . 0 0 "[ . 1 . 2]" 1
715 1 53 TYR HB2 1 54 PHE H . . 3.930 2.285 1.999 2.698 . 0 0 "[ . 1 . 2]" 1
716 1 53 TYR HB2 1 54 PHE QE . . 4.430 4.149 3.689 4.433 0.003 8 0 "[ . 1 . 2]" 1
717 1 53 TYR HB2 1 118 LEU MD2 . . 3.970 2.727 2.112 3.211 . 0 0 "[ . 1 . 2]" 1
718 1 53 TYR HB3 1 54 PHE H . . 3.930 3.196 3.018 3.573 . 0 0 "[ . 1 . 2]" 1
719 1 53 TYR HB3 1 54 PHE QE . . 4.430 3.304 2.697 3.925 . 0 0 "[ . 1 . 2]" 1
720 1 53 TYR HB3 1 118 LEU MD2 . . 3.970 3.148 2.605 3.971 0.001 1 0 "[ . 1 . 2]" 1
721 1 53 TYR QD 1 118 LEU HB2 . . 4.510 4.170 3.698 4.511 0.001 10 0 "[ . 1 . 2]" 1
722 1 53 TYR QD 1 118 LEU HB3 . . 5.400 3.084 2.461 3.687 . 0 0 "[ . 1 . 2]" 1
723 1 53 TYR QD 1 118 LEU MD1 . . 3.700 2.785 2.101 3.439 . 0 0 "[ . 1 . 2]" 1
724 1 53 TYR QD 1 122 GLN QB . . 3.940 2.974 2.084 3.938 . 0 0 "[ . 1 . 2]" 1
725 1 53 TYR QE 1 118 LEU MD1 . . 4.020 2.970 2.058 3.939 . 0 0 "[ . 1 . 2]" 1
726 1 53 TYR QE 1 119 GLU HA . . 4.460 3.599 2.511 4.460 . 0 0 "[ . 1 . 2]" 1
727 1 53 TYR QE 1 119 GLU QG . . 3.980 3.224 2.007 3.962 . 0 0 "[ . 1 . 2]" 1
728 1 54 PHE H 1 54 PHE HB2 . . 4.080 2.805 2.601 2.929 . 0 0 "[ . 1 . 2]" 1
729 1 54 PHE H 1 54 PHE HB3 . . 4.080 3.850 3.738 3.935 . 0 0 "[ . 1 . 2]" 1
730 1 54 PHE H 1 54 PHE QD . . 4.230 3.264 2.910 3.469 . 0 0 "[ . 1 . 2]" 1
731 1 54 PHE H 1 55 PRO HD2 . . 4.850 4.597 4.385 4.778 . 0 0 "[ . 1 . 2]" 1
732 1 54 PHE H 1 55 PRO QD . . 4.180 3.882 3.581 4.167 . 0 0 "[ . 1 . 2]" 1
733 1 54 PHE H 1 55 PRO HD3 . . 4.850 4.191 3.798 4.590 . 0 0 "[ . 1 . 2]" 1
734 1 54 PHE HA 1 54 PHE QD . . 3.690 2.591 2.357 2.920 . 0 0 "[ . 1 . 2]" 1
735 1 54 PHE HA 1 55 PRO HD2 . . 3.540 1.956 1.915 2.073 . 0 0 "[ . 1 . 2]" 1
736 1 54 PHE HA 1 55 PRO QD . . 3.100 1.872 1.851 1.919 . 0 0 "[ . 1 . 2]" 1
737 1 54 PHE HA 1 55 PRO HD3 . . 3.540 2.412 2.265 2.659 . 0 0 "[ . 1 . 2]" 1
738 1 54 PHE HA 1 55 PRO HG2 . . 4.690 4.154 4.114 4.251 . 0 0 "[ . 1 . 2]" 1
739 1 54 PHE HA 1 55 PRO QG . . 4.100 3.781 3.766 3.819 . 0 0 "[ . 1 . 2]" 1
740 1 54 PHE HA 1 55 PRO HG3 . . 4.690 4.353 4.314 4.476 . 0 0 "[ . 1 . 2]" 1
741 1 54 PHE HA 1 56 LYS H . . 4.820 3.807 3.196 4.272 . 0 0 "[ . 1 . 2]" 1
742 1 54 PHE HA 1 57 MET H . . 5.060 4.460 4.149 4.758 . 0 0 "[ . 1 . 2]" 1
743 1 54 PHE QB 1 55 PRO QD . . 4.300 3.128 2.674 3.565 . 0 0 "[ . 1 . 2]" 1
744 1 54 PHE QB 1 57 MET H . . 3.850 2.686 2.339 2.898 . 0 0 "[ . 1 . 2]" 1
745 1 54 PHE QB 1 57 MET QB . . 3.530 2.164 1.966 2.719 . 0 0 "[ . 1 . 2]" 1
746 1 54 PHE QB 1 57 MET QG . . 3.320 2.090 1.836 2.437 . 0 0 "[ . 1 . 2]" 1
747 1 54 PHE HB2 1 57 MET H . . 4.440 3.324 2.813 3.690 . 0 0 "[ . 1 . 2]" 1
748 1 54 PHE HB2 1 57 MET HB2 . . 4.750 2.241 1.997 2.938 . 0 0 "[ . 1 . 2]" 1
749 1 54 PHE HB2 1 57 MET HB3 . . 4.750 3.668 3.394 4.432 . 0 0 "[ . 1 . 2]" 1
750 1 54 PHE HB2 1 57 MET HG2 . . 4.400 3.387 2.367 4.404 0.004 20 0 "[ . 1 . 2]" 1
751 1 54 PHE HB2 1 57 MET HG3 . . 4.400 2.392 2.002 3.028 . 0 0 "[ . 1 . 2]" 1
752 1 54 PHE HB3 1 57 MET H . . 4.440 2.850 2.500 3.063 . 0 0 "[ . 1 . 2]" 1
753 1 54 PHE HB3 1 57 MET HB2 . . 4.750 3.147 2.467 3.474 . 0 0 "[ . 1 . 2]" 1
754 1 54 PHE HB3 1 57 MET HB3 . . 4.750 4.579 4.000 4.759 0.009 7 0 "[ . 1 . 2]" 1
755 1 54 PHE HB3 1 57 MET HG2 . . 4.400 3.119 2.224 4.291 . 0 0 "[ . 1 . 2]" 1
756 1 54 PHE HB3 1 57 MET HG3 . . 4.400 2.689 2.055 3.258 . 0 0 "[ . 1 . 2]" 1
757 1 54 PHE QD 1 55 PRO HD2 . . 4.970 3.613 3.234 3.926 . 0 0 "[ . 1 . 2]" 1
758 1 54 PHE QD 1 55 PRO QD . . 4.220 3.481 3.127 3.775 . 0 0 "[ . 1 . 2]" 1
759 1 54 PHE QD 1 55 PRO HD3 . . 4.970 4.556 4.150 4.894 . 0 0 "[ . 1 . 2]" 1
760 1 54 PHE QD 1 118 LEU MD2 . . 3.250 2.624 1.908 3.131 . 0 0 "[ . 1 . 2]" 1
761 1 54 PHE QE 1 87 LEU MD1 . . 5.500 4.934 4.496 5.470 . 0 0 "[ . 1 . 2]" 1
762 1 54 PHE QE 1 87 LEU MD2 . . 4.020 3.464 2.667 3.992 . 0 0 "[ . 1 . 2]" 1
763 1 54 PHE QE 1 118 LEU HA . . 3.630 2.782 2.065 3.108 . 0 0 "[ . 1 . 2]" 1
764 1 54 PHE QE 1 118 LEU HB2 . . 5.500 5.001 3.892 5.501 0.001 13 0 "[ . 1 . 2]" 1
765 1 54 PHE QE 1 118 LEU HB3 . . 4.640 3.629 2.291 4.338 . 0 0 "[ . 1 . 2]" 1
766 1 54 PHE QE 1 118 LEU MD1 . . 5.500 4.774 4.040 5.308 . 0 0 "[ . 1 . 2]" 1
767 1 54 PHE QE 1 118 LEU MD2 . . 3.510 2.434 1.970 3.049 . 0 0 "[ . 1 . 2]" 1
768 1 54 PHE QE 1 121 ARG H . . 4.670 4.442 4.162 4.671 0.001 6 0 "[ . 1 . 2]" 1
769 1 54 PHE QE 1 121 ARG HB2 . . 4.540 2.654 2.123 3.068 . 0 0 "[ . 1 . 2]" 1
770 1 54 PHE QE 1 121 ARG QB . . 3.870 2.457 2.008 2.816 . 0 0 "[ . 1 . 2]" 1
771 1 54 PHE QE 1 121 ARG HB3 . . 4.540 2.973 2.224 3.594 . 0 0 "[ . 1 . 2]" 1
772 1 54 PHE QE 1 121 ARG HD2 . . 5.070 4.340 3.136 5.074 0.004 20 0 "[ . 1 . 2]" 1
773 1 54 PHE QE 1 121 ARG QD . . 4.300 3.621 2.886 4.289 . 0 0 "[ . 1 . 2]" 1
774 1 54 PHE QE 1 121 ARG HD3 . . 5.070 4.049 2.936 5.069 . 0 0 "[ . 1 . 2]" 1
775 1 54 PHE QE 1 121 ARG HG2 . . 5.170 4.705 3.277 5.142 . 0 0 "[ . 1 . 2]" 1
776 1 54 PHE QE 1 121 ARG QG . . 4.540 3.814 2.889 4.500 . 0 0 "[ . 1 . 2]" 1
777 1 54 PHE QE 1 121 ARG HG3 . . 5.170 4.151 2.937 4.971 . 0 0 "[ . 1 . 2]" 1
778 1 54 PHE QE 1 122 GLN H . . 4.070 3.823 3.420 4.062 . 0 0 "[ . 1 . 2]" 1
779 1 54 PHE QE 1 122 GLN HA . . 3.900 2.988 2.337 3.847 . 0 0 "[ . 1 . 2]" 1
780 1 54 PHE HZ 1 118 LEU HA . . 4.760 4.350 3.615 4.758 . 0 0 "[ . 1 . 2]" 1
781 1 54 PHE HZ 1 121 ARG H . . 4.770 4.122 3.415 4.509 . 0 0 "[ . 1 . 2]" 1
782 1 54 PHE HZ 1 121 ARG HB2 . . 4.370 2.508 2.022 3.227 . 0 0 "[ . 1 . 2]" 1
783 1 54 PHE HZ 1 121 ARG QB . . 3.820 1.987 1.847 2.212 . 0 0 "[ . 1 . 2]" 1
784 1 54 PHE HZ 1 121 ARG HB3 . . 4.370 2.204 1.998 3.210 . 0 0 "[ . 1 . 2]" 1
785 1 54 PHE HZ 1 121 ARG HG2 . . 4.920 4.642 4.210 4.913 . 0 0 "[ . 1 . 2]" 1
786 1 54 PHE HZ 1 121 ARG HG3 . . 4.920 4.477 3.927 4.879 . 0 0 "[ . 1 . 2]" 1
787 1 54 PHE HZ 1 122 GLN H . . 3.940 2.772 2.240 3.181 . 0 0 "[ . 1 . 2]" 1
788 1 54 PHE HZ 1 122 GLN HA . . 3.890 2.741 2.274 3.682 . 0 0 "[ . 1 . 2]" 1
789 1 54 PHE HZ 1 122 GLN QB . . 4.170 3.543 3.036 4.053 . 0 0 "[ . 1 . 2]" 1
790 1 55 PRO HA 1 58 VAL H . . 4.510 3.838 3.422 4.137 . 0 0 "[ . 1 . 2]" 1
791 1 55 PRO HA 1 58 VAL MG2 . . 4.700 3.203 1.968 4.071 . 0 0 "[ . 1 . 2]" 1
792 1 55 PRO QB 1 56 LYS H . . 3.950 3.086 2.796 3.663 . 0 0 "[ . 1 . 2]" 1
793 1 55 PRO QB 1 56 LYS QG . . 5.180 4.306 3.471 5.046 . 0 0 "[ . 1 . 2]" 1
794 1 55 PRO QD 1 56 LYS H . . 3.890 2.664 2.601 2.866 . 0 0 "[ . 1 . 2]" 1
795 1 55 PRO HD2 1 56 LYS H . . 4.570 2.715 2.645 2.936 . 0 0 "[ . 1 . 2]" 1
796 1 55 PRO HD3 1 56 LYS H . . 4.570 3.865 3.835 3.994 . 0 0 "[ . 1 . 2]" 1
797 1 55 PRO QG 1 56 LYS H . . 3.740 2.237 1.887 3.148 . 0 0 "[ . 1 . 2]" 1
798 1 56 LYS H 1 56 LYS QB . . 3.190 2.484 2.157 2.711 . 0 0 "[ . 1 . 2]" 1
799 1 56 LYS H 1 56 LYS QD . . 4.140 3.627 1.879 4.138 . 0 0 "[ . 1 . 2]" 1
800 1 56 LYS H 1 56 LYS HG2 . . 3.960 2.664 1.902 3.976 0.016 13 0 "[ . 1 . 2]" 1
801 1 56 LYS H 1 56 LYS QG . . 3.390 2.215 1.893 3.444 0.054 13 0 "[ . 1 . 2]" 1
802 1 56 LYS H 1 56 LYS HG3 . . 3.960 3.022 2.148 3.940 . 0 0 "[ . 1 . 2]" 1
803 1 56 LYS H 1 57 MET H . . 3.350 2.711 2.330 2.989 . 0 0 "[ . 1 . 2]" 1
804 1 56 LYS H 1 58 VAL H . . 4.550 4.203 3.773 4.535 . 0 0 "[ . 1 . 2]" 1
805 1 56 LYS HA 1 56 LYS QD . . 4.430 3.955 1.986 4.396 . 0 0 "[ . 1 . 2]" 1
806 1 56 LYS HA 1 56 LYS HG2 . . 3.920 3.318 2.485 3.888 . 0 0 "[ . 1 . 2]" 1
807 1 56 LYS HA 1 56 LYS QG . . 3.380 2.958 2.321 3.343 . 0 0 "[ . 1 . 2]" 1
808 1 56 LYS HA 1 56 LYS HG3 . . 3.920 3.425 2.350 3.882 . 0 0 "[ . 1 . 2]" 1
809 1 56 LYS HA 1 58 VAL H . . 4.700 4.251 3.649 4.663 . 0 0 "[ . 1 . 2]" 1
810 1 56 LYS QB 1 56 LYS QE . . 3.960 2.589 1.926 3.681 . 0 0 "[ . 1 . 2]" 1
811 1 56 LYS HB2 1 56 LYS QD . . 3.520 2.552 2.166 3.446 . 0 0 "[ . 1 . 2]" 1
812 1 56 LYS HB2 1 57 MET H . . 4.060 3.066 2.178 3.974 . 0 0 "[ . 1 . 2]" 1
813 1 56 LYS HB3 1 56 LYS QD . . 3.520 2.617 2.150 3.415 . 0 0 "[ . 1 . 2]" 1
814 1 56 LYS HB3 1 57 MET H . . 4.060 3.594 2.904 4.038 . 0 0 "[ . 1 . 2]" 1
815 1 56 LYS QD 1 57 MET H . . 4.850 4.169 3.687 4.828 . 0 0 "[ . 1 . 2]" 1
816 1 56 LYS QE 1 56 LYS QG . . 3.240 2.260 2.057 2.511 . 0 0 "[ . 1 . 2]" 1
817 1 56 LYS QG 1 57 MET H . . 4.280 2.918 1.785 4.282 0.002 13 0 "[ . 1 . 2]" 1
818 1 57 MET H 1 57 MET HB2 . . 3.800 2.456 2.245 2.719 . 0 0 "[ . 1 . 2]" 1
819 1 57 MET H 1 57 MET QB . . 3.140 2.415 2.221 2.644 . 0 0 "[ . 1 . 2]" 1
820 1 57 MET H 1 57 MET HB3 . . 3.800 3.587 3.528 3.618 . 0 0 "[ . 1 . 2]" 1
821 1 57 MET H 1 57 MET ME . . 5.490 4.790 4.112 4.971 . 0 0 "[ . 1 . 2]" 1
822 1 57 MET H 1 57 MET HG2 . . 4.000 2.579 1.989 3.791 . 0 0 "[ . 1 . 2]" 1
823 1 57 MET H 1 57 MET QG . . 3.350 2.326 1.976 2.705 . 0 0 "[ . 1 . 2]" 1
824 1 57 MET H 1 57 MET HG3 . . 4.000 3.197 2.143 3.749 . 0 0 "[ . 1 . 2]" 1
825 1 57 MET H 1 58 VAL H . . 3.120 2.882 2.504 3.123 0.003 12 0 "[ . 1 . 2]" 1
826 1 57 MET H 1 58 VAL MG2 . . 5.500 4.331 3.832 4.705 . 0 0 "[ . 1 . 2]" 1
827 1 57 MET HA 1 57 MET ME . . 4.220 3.876 3.268 4.220 0.000 20 0 "[ . 1 . 2]" 1
828 1 57 MET HA 1 57 MET HG2 . . 3.840 2.595 2.226 2.921 . 0 0 "[ . 1 . 2]" 1
829 1 57 MET HA 1 57 MET QG . . 3.220 2.532 2.189 2.830 . 0 0 "[ . 1 . 2]" 1
830 1 57 MET HA 1 57 MET HG3 . . 3.840 3.574 2.799 3.790 . 0 0 "[ . 1 . 2]" 1
831 1 57 MET HA 1 58 VAL MG2 . . 5.270 4.910 4.660 5.161 . 0 0 "[ . 1 . 2]" 1
832 1 57 MET QB 1 57 MET ME . . 3.100 2.295 1.919 2.637 . 0 0 "[ . 1 . 2]" 1
833 1 57 MET QB 1 58 VAL H . . 3.630 2.574 2.292 2.898 . 0 0 "[ . 1 . 2]" 1
834 1 57 MET HB2 1 57 MET ME . . 3.540 3.295 2.141 3.485 . 0 0 "[ . 1 . 2]" 1
835 1 57 MET HB2 1 58 VAL H . . 4.140 2.655 2.331 3.024 . 0 0 "[ . 1 . 2]" 1
836 1 57 MET HB3 1 57 MET ME . . 3.540 2.354 1.985 2.736 . 0 0 "[ . 1 . 2]" 1
837 1 57 MET HB3 1 58 VAL H . . 4.140 3.489 3.144 3.781 . 0 0 "[ . 1 . 2]" 1
838 1 57 MET ME 1 57 MET QG . . 3.280 2.269 2.069 2.584 . 0 0 "[ . 1 . 2]" 1
839 1 57 MET ME 1 83 VAL HA . . 4.050 3.260 2.277 4.043 . 0 0 "[ . 1 . 2]" 1
840 1 57 MET ME 1 86 ARG QB . . 3.160 2.273 1.756 3.147 . 0 0 "[ . 1 . 2]" 1
841 1 57 MET ME 1 87 LEU MD2 . . 3.200 2.826 2.238 3.185 . 0 0 "[ . 1 . 2]" 1
842 1 57 MET ME 1 87 LEU HG . . 3.170 2.479 1.972 3.168 . 0 0 "[ . 1 . 2]" 1
843 1 58 VAL H 1 58 VAL HB . . 3.270 2.541 2.401 2.668 . 0 0 "[ . 1 . 2]" 1
844 1 58 VAL H 1 58 VAL MG2 . . 3.320 2.181 1.893 2.509 . 0 0 "[ . 1 . 2]" 1
845 1 58 VAL H 1 59 GLU H . . 4.740 4.185 3.062 4.627 . 0 0 "[ . 1 . 2]" 1
846 1 58 VAL HA 1 58 VAL MG1 . . 3.450 2.370 2.235 2.461 . 0 0 "[ . 1 . 2]" 1
847 1 58 VAL HA 1 58 VAL MG2 . . 3.470 2.370 2.185 2.494 . 0 0 "[ . 1 . 2]" 1
848 1 58 VAL HA 1 83 VAL MG2 . . 4.200 3.929 3.337 4.202 0.002 7 0 "[ . 1 . 2]" 1
849 1 58 VAL HB 1 59 GLU H . . 5.500 3.636 1.917 4.426 . 0 0 "[ . 1 . 2]" 1
850 1 58 VAL MG1 1 59 GLU H . . 4.040 2.547 2.014 3.084 . 0 0 "[ . 1 . 2]" 1
851 1 58 VAL MG1 1 60 MET HG2 . . 4.780 2.576 1.850 4.332 . 0 0 "[ . 1 . 2]" 1
852 1 58 VAL MG1 1 60 MET QG . . 4.200 2.339 1.798 4.021 . 0 0 "[ . 1 . 2]" 1
853 1 58 VAL MG1 1 60 MET HG3 . . 4.780 3.024 1.843 4.766 . 0 0 "[ . 1 . 2]" 1
854 1 59 GLU H 1 59 GLU QG . . 4.750 3.580 2.661 4.427 . 0 0 "[ . 1 . 2]" 1
855 1 59 GLU HA 1 59 GLU QG . . 3.840 2.498 2.163 2.998 . 0 0 "[ . 1 . 2]" 1
856 1 59 GLU QB 1 60 MET H . . 4.760 3.584 2.227 3.968 . 0 0 "[ . 1 . 2]" 1
857 1 59 GLU QB 1 62 ASN HD21 . . 3.810 3.019 1.888 3.804 . 0 0 "[ . 1 . 2]" 1
858 1 59 GLU QB 1 62 ASN HD22 . . 3.810 3.103 2.058 3.807 . 0 0 "[ . 1 . 2]" 1
859 1 59 GLU QG 1 60 MET H . . 4.690 4.296 3.459 4.692 0.002 9 0 "[ . 1 . 2]" 1
860 1 59 GLU QG 1 62 ASN QD . . 4.570 3.316 1.916 4.383 . 0 0 "[ . 1 . 2]" 1
861 1 60 MET H 1 60 MET HG2 . . 4.580 3.117 2.113 4.593 0.013 11 0 "[ . 1 . 2]" 1
862 1 60 MET H 1 60 MET QG . . 3.950 2.876 2.091 3.961 0.011 11 0 "[ . 1 . 2]" 1
863 1 60 MET H 1 60 MET HG3 . . 4.580 3.803 2.406 4.578 . 0 0 "[ . 1 . 2]" 1
864 1 60 MET HA 1 60 MET ME . . 3.670 2.483 1.914 3.493 . 0 0 "[ . 1 . 2]" 1
865 1 60 MET HA 1 62 ASN H . . 4.750 3.860 3.148 4.437 . 0 0 "[ . 1 . 2]" 1
866 1 60 MET HA 1 63 TYR H . . 4.250 3.522 2.672 4.150 . 0 0 "[ . 1 . 2]" 1
867 1 60 MET HA 1 63 TYR QD . . 3.630 2.660 2.017 3.632 0.002 18 0 "[ . 1 . 2]" 1
868 1 60 MET ME 1 60 MET HG2 . . 3.680 2.313 1.986 3.395 . 0 0 "[ . 1 . 2]" 1
869 1 60 MET ME 1 60 MET QG . . 3.190 2.181 1.962 2.498 . 0 0 "[ . 1 . 2]" 1
870 1 60 MET ME 1 60 MET HG3 . . 3.680 3.168 2.321 3.380 . 0 0 "[ . 1 . 2]" 1
871 1 60 MET ME 1 63 TYR H . . 4.410 4.026 3.572 4.393 . 0 0 "[ . 1 . 2]" 1
872 1 60 MET ME 1 63 TYR HB2 . . 3.930 2.239 1.850 2.794 . 0 0 "[ . 1 . 2]" 1
873 1 60 MET ME 1 63 TYR HB3 . . 3.930 3.103 1.997 3.938 0.008 18 0 "[ . 1 . 2]" 1
874 1 60 MET ME 1 63 TYR QD . . 4.120 2.891 2.007 4.110 . 0 0 "[ . 1 . 2]" 1
875 1 61 HIS H 1 62 ASN H . . 4.650 2.379 1.802 3.197 . 0 0 "[ . 1 . 2]" 1
876 1 61 HIS HB2 1 62 ASN H . . 4.890 3.526 2.443 4.502 . 0 0 "[ . 1 . 2]" 1
877 1 61 HIS HB3 1 62 ASN H . . 4.890 3.187 2.147 4.013 . 0 0 "[ . 1 . 2]" 1
878 1 62 ASN H 1 62 ASN HB2 . . 3.810 3.047 2.186 3.874 0.064 18 0 "[ . 1 . 2]" 1
879 1 62 ASN H 1 62 ASN QB . . 3.290 2.630 2.165 2.904 . 0 0 "[ . 1 . 2]" 1
880 1 62 ASN H 1 62 ASN HB3 . . 3.810 3.311 2.361 3.782 . 0 0 "[ . 1 . 2]" 1
881 1 62 ASN H 1 62 ASN HD21 . . 4.570 2.754 1.963 4.162 . 0 0 "[ . 1 . 2]" 1
882 1 62 ASN H 1 62 ASN QD . . 3.880 2.643 1.934 3.736 . 0 0 "[ . 1 . 2]" 1
883 1 62 ASN H 1 62 ASN HD22 . . 4.570 3.585 2.908 4.568 . 0 0 "[ . 1 . 2]" 1
884 1 62 ASN H 1 63 TYR H . . 3.270 2.348 1.826 3.074 . 0 0 "[ . 1 . 2]" 1
885 1 62 ASN HA 1 62 ASN QD . . 4.240 3.894 2.960 4.244 0.004 18 0 "[ . 1 . 2]" 1
886 1 62 ASN QB 1 63 TYR H . . 3.820 2.796 2.032 3.560 . 0 0 "[ . 1 . 2]" 1
887 1 62 ASN HB2 1 63 TYR H . . 4.380 2.973 2.050 4.025 . 0 0 "[ . 1 . 2]" 1
888 1 62 ASN HB3 1 63 TYR H . . 4.380 3.697 3.003 4.199 . 0 0 "[ . 1 . 2]" 1
889 1 63 TYR H 1 63 TYR HB2 . . 3.810 2.552 2.195 2.738 . 0 0 "[ . 1 . 2]" 1
890 1 63 TYR H 1 63 TYR QB . . 3.240 2.499 2.173 2.655 . 0 0 "[ . 1 . 2]" 1
891 1 63 TYR H 1 63 TYR HB3 . . 3.810 3.590 3.500 3.620 . 0 0 "[ . 1 . 2]" 1
892 1 63 TYR H 1 63 TYR QD . . 3.470 2.757 2.149 3.146 . 0 0 "[ . 1 . 2]" 1
893 1 63 TYR H 1 63 TYR QE . . 4.950 4.299 4.036 4.894 . 0 0 "[ . 1 . 2]" 1
894 1 63 TYR H 1 64 VAL H . . 4.740 4.594 4.488 4.643 . 0 0 "[ . 1 . 2]" 1
895 1 63 TYR HA 1 63 TYR QD . . 3.820 2.546 2.079 2.956 . 0 0 "[ . 1 . 2]" 1
896 1 63 TYR HA 1 64 VAL H . . 2.930 2.266 2.138 2.514 . 0 0 "[ . 1 . 2]" 1
897 1 63 TYR HA 1 64 VAL HB . . 4.930 4.473 4.267 4.603 . 0 0 "[ . 1 . 2]" 1
898 1 63 TYR QB 1 64 VAL H . . 3.770 2.796 2.213 3.307 . 0 0 "[ . 1 . 2]" 1
899 1 63 TYR HB2 1 64 VAL H . . 4.570 3.886 3.472 4.264 . 0 0 "[ . 1 . 2]" 1
900 1 63 TYR HB3 1 64 VAL H . . 4.570 2.873 2.231 3.445 . 0 0 "[ . 1 . 2]" 1
901 1 63 TYR QD 1 64 VAL H . . 4.100 3.857 2.789 4.100 0.000 10 0 "[ . 1 . 2]" 1
902 1 63 TYR QD 1 75 ASN QB . . 3.950 2.779 2.128 3.286 . 0 0 "[ . 1 . 2]" 1
903 1 63 TYR QD 1 79 LEU MD1 . . 4.790 3.697 3.429 3.953 . 0 0 "[ . 1 . 2]" 1
904 1 63 TYR QE 1 75 ASN QB . . 5.260 3.796 2.824 4.503 . 0 0 "[ . 1 . 2]" 1
905 1 63 TYR QE 1 78 HIS H . . 4.450 4.076 3.568 4.454 0.004 19 0 "[ . 1 . 2]" 1
906 1 63 TYR QE 1 78 HIS QB . . 3.750 2.048 1.927 2.286 . 0 0 "[ . 1 . 2]" 1
907 1 63 TYR QE 1 79 LEU H . . 3.540 2.968 2.526 3.337 . 0 0 "[ . 1 . 2]" 1
908 1 63 TYR QE 1 79 LEU HA . . 4.180 3.580 3.173 3.866 . 0 0 "[ . 1 . 2]" 1
909 1 63 TYR QE 1 79 LEU HB2 . . 4.380 3.271 2.939 3.478 . 0 0 "[ . 1 . 2]" 1
910 1 63 TYR QE 1 79 LEU HB3 . . 5.000 4.737 4.467 4.948 . 0 0 "[ . 1 . 2]" 1
911 1 63 TYR QE 1 79 LEU MD1 . . 4.250 2.724 2.042 3.101 . 0 0 "[ . 1 . 2]" 1
912 1 63 TYR QE 1 80 ASN H . . 5.500 5.348 4.906 5.508 0.008 18 0 "[ . 1 . 2]" 1
913 1 63 TYR QE 1 83 VAL MG2 . . 4.470 3.625 3.117 4.239 . 0 0 "[ . 1 . 2]" 1
914 1 64 VAL H 1 64 VAL HB . . 3.400 2.803 2.638 2.976 . 0 0 "[ . 1 . 2]" 1
915 1 64 VAL H 1 64 VAL MG1 . . 3.990 3.881 3.779 3.950 . 0 0 "[ . 1 . 2]" 1
916 1 64 VAL H 1 64 VAL MG2 . . 3.370 3.072 2.789 3.370 0.000 14 0 "[ . 1 . 2]" 1
917 1 64 VAL H 1 65 PRO HD3 . . 4.870 4.628 4.498 4.799 . 0 0 "[ . 1 . 2]" 1
918 1 64 VAL H 1 71 GLN QE . . 5.000 4.504 3.806 5.008 0.008 10 0 "[ . 1 . 2]" 1
919 1 64 VAL H 1 75 ASN QB . . 5.010 4.457 3.877 4.835 . 0 0 "[ . 1 . 2]" 1
920 1 64 VAL H 1 75 ASN HD21 . . 4.070 3.768 3.217 4.067 . 0 0 "[ . 1 . 2]" 1
921 1 64 VAL H 1 75 ASN HD22 . . 3.700 2.697 2.152 3.300 . 0 0 "[ . 1 . 2]" 1
922 1 64 VAL HA 1 64 VAL MG1 . . 3.450 2.468 2.411 2.562 . 0 0 "[ . 1 . 2]" 1
923 1 64 VAL HA 1 64 VAL MG2 . . 3.350 2.288 2.119 2.404 . 0 0 "[ . 1 . 2]" 1
924 1 64 VAL HA 1 65 PRO HD2 . . 3.280 2.136 2.044 2.181 . 0 0 "[ . 1 . 2]" 1
925 1 64 VAL HA 1 65 PRO HD3 . . 3.300 2.258 2.252 2.279 . 0 0 "[ . 1 . 2]" 1
926 1 64 VAL HA 1 65 PRO HG2 . . 4.570 4.302 4.228 4.336 . 0 0 "[ . 1 . 2]" 1
927 1 64 VAL HA 1 65 PRO HG3 . . 4.570 4.345 4.319 4.360 . 0 0 "[ . 1 . 2]" 1
928 1 64 VAL HB 1 65 PRO HD2 . . 4.180 4.034 3.934 4.233 0.053 18 0 "[ . 1 . 2]" 1
929 1 64 VAL HB 1 65 PRO HD3 . . 5.500 4.932 4.878 5.030 . 0 0 "[ . 1 . 2]" 1
930 1 64 VAL HB 1 71 GLN QE . . 4.450 4.108 3.607 4.451 0.001 4 0 "[ . 1 . 2]" 1
931 1 64 VAL MG1 1 65 PRO QB . . 4.740 3.939 3.881 4.077 . 0 0 "[ . 1 . 2]" 1
932 1 64 VAL MG1 1 65 PRO HD2 . . 3.670 1.880 1.815 1.963 . 0 0 "[ . 1 . 2]" 1
933 1 64 VAL MG1 1 65 PRO HD3 . . 4.010 3.223 3.146 3.404 . 0 0 "[ . 1 . 2]" 1
934 1 64 VAL MG1 1 65 PRO HG2 . . 4.640 3.008 2.924 3.174 . 0 0 "[ . 1 . 2]" 1
935 1 64 VAL MG1 1 65 PRO HG3 . . 4.640 3.984 3.886 4.169 . 0 0 "[ . 1 . 2]" 1
936 1 64 VAL MG2 1 65 PRO HD2 . . 4.210 3.306 3.031 3.387 . 0 0 "[ . 1 . 2]" 1
937 1 64 VAL MG2 1 65 PRO HD3 . . 4.160 4.044 3.843 4.127 . 0 0 "[ . 1 . 2]" 1
938 1 64 VAL MG2 1 75 ASN HD22 . . 5.270 4.977 4.570 5.269 . 0 0 "[ . 1 . 2]" 1
939 1 65 PRO HA 1 66 ALA H . . 3.110 2.188 2.151 2.286 . 0 0 "[ . 1 . 2]" 1
940 1 65 PRO HA 1 66 ALA MB . . 4.740 4.036 3.787 4.190 . 0 0 "[ . 1 . 2]" 1
941 1 65 PRO QB 1 66 ALA H . . 3.770 3.470 2.812 3.767 . 0 0 "[ . 1 . 2]" 1
942 1 65 PRO HB2 1 66 ALA H . . 4.420 3.728 2.930 4.089 . 0 0 "[ . 1 . 2]" 1
943 1 65 PRO HB3 1 66 ALA H . . 4.420 4.144 3.625 4.409 . 0 0 "[ . 1 . 2]" 1
944 1 66 ALA H 1 66 ALA MB . . 3.610 2.496 2.284 2.776 . 0 0 "[ . 1 . 2]" 1
945 1 66 ALA H 1 72 LYS QE . . 4.210 3.286 2.208 4.070 . 0 0 "[ . 1 . 2]" 1
946 1 66 ALA MB 1 71 GLN H . . 4.430 4.227 3.983 4.433 0.003 18 0 "[ . 1 . 2]" 1
947 1 66 ALA MB 1 71 GLN HB2 . . 3.660 2.721 2.109 3.215 . 0 0 "[ . 1 . 2]" 1
948 1 66 ALA MB 1 71 GLN QB . . 3.000 2.036 1.798 2.281 . 0 0 "[ . 1 . 2]" 1
949 1 66 ALA MB 1 71 GLN HB3 . . 3.660 2.131 1.950 2.521 . 0 0 "[ . 1 . 2]" 1
950 1 66 ALA MB 1 71 GLN HG2 . . 3.670 2.495 1.824 3.647 . 0 0 "[ . 1 . 2]" 1
951 1 66 ALA MB 1 71 GLN QG . . 3.210 1.967 1.751 2.531 . 0 0 "[ . 1 . 2]" 1
952 1 66 ALA MB 1 71 GLN HG3 . . 3.670 2.434 1.856 3.095 . 0 0 "[ . 1 . 2]" 1
953 1 66 ALA MB 1 72 LYS H . . 4.060 3.734 3.028 4.058 . 0 0 "[ . 1 . 2]" 1
954 1 66 ALA MB 1 72 LYS HA . . 5.030 4.339 3.257 4.920 . 0 0 "[ . 1 . 2]" 1
955 1 66 ALA MB 1 72 LYS QE . . 3.910 3.343 2.351 3.855 . 0 0 "[ . 1 . 2]" 1
956 1 66 ALA MB 1 75 ASN HD21 . . 5.500 4.619 3.934 5.413 . 0 0 "[ . 1 . 2]" 1
957 1 66 ALA MB 1 75 ASN HD22 . . 4.290 3.844 3.369 4.246 . 0 0 "[ . 1 . 2]" 1
958 1 68 SER QB 1 70 GLN H . . 4.170 3.421 2.853 4.009 . 0 0 "[ . 1 . 2]" 1
959 1 68 SER QB 1 71 GLN H . . 4.560 2.886 2.532 3.435 . 0 0 "[ . 1 . 2]" 1
960 1 69 LEU HA 1 69 LEU QD . . 3.260 2.216 1.928 3.186 . 0 0 "[ . 1 . 2]" 1
961 1 69 LEU HA 1 69 LEU HG . . 3.910 3.287 2.523 3.756 . 0 0 "[ . 1 . 2]" 1
962 1 69 LEU HA 1 71 GLN H . . 4.860 4.405 4.030 4.793 . 0 0 "[ . 1 . 2]" 1
963 1 69 LEU HA 1 72 LYS H . . 4.050 3.399 3.027 3.794 . 0 0 "[ . 1 . 2]" 1
964 1 69 LEU HA 1 72 LYS QB . . 4.040 2.798 2.169 3.360 . 0 0 "[ . 1 . 2]" 1
965 1 69 LEU HA 1 72 LYS QG . . 3.720 2.269 1.807 2.905 . 0 0 "[ . 1 . 2]" 1
966 1 69 LEU HA 1 73 LEU H . . 4.580 4.241 3.676 4.578 . 0 0 "[ . 1 . 2]" 1
967 1 69 LEU QB 1 69 LEU QD . . 2.760 1.930 1.820 2.036 . 0 0 "[ . 1 . 2]" 1
968 1 69 LEU QB 1 70 GLN H . . 3.440 2.338 1.893 3.393 . 0 0 "[ . 1 . 2]" 1
969 1 69 LEU QD 1 70 GLN H . . 4.360 3.471 2.905 3.950 . 0 0 "[ . 1 . 2]" 1
970 1 69 LEU QD 1 72 LYS H . . 4.850 4.378 3.556 4.849 . 0 0 "[ . 1 . 2]" 1
971 1 69 LEU QD 1 72 LYS QB . . 3.520 2.928 2.200 3.437 . 0 0 "[ . 1 . 2]" 1
972 1 69 LEU QD 1 72 LYS QG . . 3.700 2.990 2.244 3.696 . 0 0 "[ . 1 . 2]" 1
973 1 69 LEU QD 1 101 GLN H . . 4.680 4.104 3.657 4.672 . 0 0 "[ . 1 . 2]" 1
974 1 69 LEU QD 1 101 GLN HA . . 4.250 2.901 2.504 3.456 . 0 0 "[ . 1 . 2]" 1
975 1 69 LEU QD 1 101 GLN QE . . 3.960 2.293 1.644 3.651 . 0 0 "[ . 1 . 2]" 1
976 1 69 LEU QD 1 101 GLN HG2 . . 3.600 2.772 1.824 3.472 . 0 0 "[ . 1 . 2]" 1
977 1 69 LEU MD1 1 70 GLN H . . 5.020 3.971 2.958 4.733 . 0 0 "[ . 1 . 2]" 1
978 1 69 LEU MD1 1 101 GLN HE21 . . 5.220 2.899 1.895 5.121 . 0 0 "[ . 1 . 2]" 1
979 1 69 LEU MD1 1 101 GLN HE22 . . 5.220 3.738 2.264 5.211 . 0 0 "[ . 1 . 2]" 1
980 1 69 LEU MD1 1 101 GLN HG2 . . 4.540 3.100 1.838 4.521 . 0 0 "[ . 1 . 2]" 1
981 1 69 LEU MD2 1 70 GLN H . . 5.020 4.156 3.008 4.795 . 0 0 "[ . 1 . 2]" 1
982 1 69 LEU MD2 1 101 GLN HE21 . . 5.220 2.936 1.834 4.699 . 0 0 "[ . 1 . 2]" 1
983 1 69 LEU MD2 1 101 GLN HE22 . . 5.220 3.423 2.147 5.038 . 0 0 "[ . 1 . 2]" 1
984 1 69 LEU MD2 1 101 GLN HG2 . . 4.540 3.434 2.669 4.238 . 0 0 "[ . 1 . 2]" 1
985 1 69 LEU HG 1 70 GLN H . . 4.450 3.926 1.958 4.450 . 0 0 "[ . 1 . 2]" 1
986 1 69 LEU HG 1 101 GLN HE21 . . 5.500 4.315 3.216 5.485 . 0 0 "[ . 1 . 2]" 1
987 1 69 LEU HG 1 101 GLN HE22 . . 5.500 4.974 3.983 5.497 . 0 0 "[ . 1 . 2]" 1
988 1 70 GLN H 1 70 GLN HB2 . . 3.790 2.738 2.177 3.606 . 0 0 "[ . 1 . 2]" 1
989 1 70 GLN H 1 70 GLN QB . . 3.150 2.388 2.128 2.633 . 0 0 "[ . 1 . 2]" 1
990 1 70 GLN H 1 70 GLN HB3 . . 3.790 3.129 2.341 3.622 . 0 0 "[ . 1 . 2]" 1
991 1 70 GLN H 1 70 GLN QG . . 4.140 2.653 1.944 4.077 . 0 0 "[ . 1 . 2]" 1
992 1 70 GLN H 1 71 GLN H . . 4.020 3.028 2.873 3.158 . 0 0 "[ . 1 . 2]" 1
993 1 70 GLN HA 1 70 GLN QG . . 3.710 2.723 2.150 3.464 . 0 0 "[ . 1 . 2]" 1
994 1 70 GLN HA 1 73 LEU H . . 4.360 4.136 3.727 4.352 . 0 0 "[ . 1 . 2]" 1
995 1 70 GLN HA 1 73 LEU HB2 . . 4.330 3.513 2.656 4.015 . 0 0 "[ . 1 . 2]" 1
996 1 70 GLN HB2 1 71 GLN H . . 3.810 3.025 2.238 3.800 . 0 0 "[ . 1 . 2]" 1
997 1 70 GLN HB3 1 71 GLN H . . 3.810 3.227 2.183 3.805 . 0 0 "[ . 1 . 2]" 1
998 1 70 GLN QG 1 71 GLN H . . 4.540 3.477 1.795 4.282 . 0 0 "[ . 1 . 2]" 1
999 1 71 GLN H 1 71 GLN HB2 . . 3.990 2.311 2.167 2.573 . 0 0 "[ . 1 . 2]" 1
1000 1 71 GLN H 1 71 GLN QB . . 3.360 2.205 2.121 2.267 . 0 0 "[ . 1 . 2]" 1
1001 1 71 GLN H 1 71 GLN HB3 . . 3.990 2.978 2.472 3.549 . 0 0 "[ . 1 . 2]" 1
1002 1 71 GLN H 1 71 GLN HG2 . . 4.700 3.990 2.647 4.615 . 0 0 "[ . 1 . 2]" 1
1003 1 71 GLN H 1 71 GLN HG3 . . 4.700 4.328 3.593 4.601 . 0 0 "[ . 1 . 2]" 1
1004 1 71 GLN H 1 72 LYS H . . 3.670 2.788 2.566 3.159 . 0 0 "[ . 1 . 2]" 1
1005 1 71 GLN H 1 73 LEU H . . 4.840 4.706 4.539 4.838 . 0 0 "[ . 1 . 2]" 1
1006 1 71 GLN HA 1 71 GLN HG2 . . 4.030 3.283 2.343 3.747 . 0 0 "[ . 1 . 2]" 1
1007 1 71 GLN HA 1 71 GLN QG . . 3.420 2.761 2.314 3.098 . 0 0 "[ . 1 . 2]" 1
1008 1 71 GLN HA 1 71 GLN HG3 . . 4.030 3.237 2.743 3.623 . 0 0 "[ . 1 . 2]" 1
1009 1 71 GLN HA 1 74 SER H . . 4.000 3.501 3.126 3.742 . 0 0 "[ . 1 . 2]" 1
1010 1 71 GLN QB 1 72 LYS H . . 3.980 2.378 2.046 2.590 . 0 0 "[ . 1 . 2]" 1
1011 1 71 GLN QE 1 71 GLN QG . . 3.100 2.186 2.067 2.467 . 0 0 "[ . 1 . 2]" 1
1012 1 71 GLN QE 1 74 SER HB2 . . 4.790 4.100 3.333 4.723 . 0 0 "[ . 1 . 2]" 1
1013 1 71 GLN HE21 1 74 SER HB2 . . 5.500 4.754 3.518 5.484 . 0 0 "[ . 1 . 2]" 1
1014 1 71 GLN HE21 1 74 SER HB3 . . 4.290 3.544 2.572 4.208 . 0 0 "[ . 1 . 2]" 1
1015 1 71 GLN HE22 1 74 SER HB2 . . 5.500 4.588 3.521 5.357 . 0 0 "[ . 1 . 2]" 1
1016 1 71 GLN HE22 1 74 SER HB3 . . 4.290 3.559 2.620 4.100 . 0 0 "[ . 1 . 2]" 1
1017 1 72 LYS H 1 72 LYS QB . . 3.380 2.599 2.492 2.735 . 0 0 "[ . 1 . 2]" 1
1018 1 72 LYS H 1 72 LYS HD2 . . 4.900 4.310 2.419 4.823 . 0 0 "[ . 1 . 2]" 1
1019 1 72 LYS H 1 72 LYS QD . . 4.140 3.599 2.349 4.126 . 0 0 "[ . 1 . 2]" 1
1020 1 72 LYS H 1 72 LYS HD3 . . 4.900 3.963 3.181 4.611 . 0 0 "[ . 1 . 2]" 1
1021 1 72 LYS H 1 72 LYS QE . . 4.540 3.666 2.256 4.334 . 0 0 "[ . 1 . 2]" 1
1022 1 72 LYS H 1 72 LYS HG2 . . 3.980 1.977 1.899 2.118 . 0 0 "[ . 1 . 2]" 1
1023 1 72 LYS H 1 72 LYS QG . . 3.240 1.962 1.890 2.093 . 0 0 "[ . 1 . 2]" 1
1024 1 72 LYS H 1 72 LYS HG3 . . 3.980 3.344 3.191 3.485 . 0 0 "[ . 1 . 2]" 1
1025 1 72 LYS H 1 73 LEU H . . 3.570 3.163 2.925 3.291 . 0 0 "[ . 1 . 2]" 1
1026 1 72 LYS H 1 74 SER H . . 4.500 4.313 4.124 4.485 . 0 0 "[ . 1 . 2]" 1
1027 1 72 LYS HA 1 72 LYS HD2 . . 4.130 3.524 1.999 4.131 0.001 18 0 "[ . 1 . 2]" 1
1028 1 72 LYS HA 1 72 LYS QD . . 3.630 2.462 1.988 3.242 . 0 0 "[ . 1 . 2]" 1
1029 1 72 LYS HA 1 72 LYS HD3 . . 4.130 2.758 1.999 3.683 . 0 0 "[ . 1 . 2]" 1
1030 1 72 LYS HA 1 72 LYS HE2 . . 5.170 3.473 2.000 4.631 . 0 0 "[ . 1 . 2]" 1
1031 1 72 LYS HA 1 72 LYS QE . . 4.460 3.011 1.961 4.023 . 0 0 "[ . 1 . 2]" 1
1032 1 72 LYS HA 1 72 LYS HE3 . . 5.170 3.625 1.991 4.935 . 0 0 "[ . 1 . 2]" 1
1033 1 72 LYS HA 1 72 LYS HG2 . . 4.150 2.910 2.669 3.417 . 0 0 "[ . 1 . 2]" 1
1034 1 72 LYS HA 1 72 LYS QG . . 3.550 2.814 2.616 3.177 . 0 0 "[ . 1 . 2]" 1
1035 1 72 LYS HA 1 72 LYS HG3 . . 4.150 3.790 3.761 3.825 . 0 0 "[ . 1 . 2]" 1
1036 1 72 LYS HA 1 74 SER H . . 4.880 4.593 4.258 4.803 . 0 0 "[ . 1 . 2]" 1
1037 1 72 LYS HA 1 75 ASN H . . 4.500 3.817 3.559 4.198 . 0 0 "[ . 1 . 2]" 1
1038 1 72 LYS HA 1 75 ASN HD21 . . 4.730 3.761 2.714 4.576 . 0 0 "[ . 1 . 2]" 1
1039 1 72 LYS HA 1 75 ASN HD22 . . 5.120 4.585 3.958 5.026 . 0 0 "[ . 1 . 2]" 1
1040 1 72 LYS HA 1 76 TRP HD1 . . 4.510 3.918 3.528 4.423 . 0 0 "[ . 1 . 2]" 1
1041 1 72 LYS HA 1 100 ALA MB . . 5.500 4.545 3.857 5.291 . 0 0 "[ . 1 . 2]" 1
1042 1 72 LYS QB 1 72 LYS QE . . 4.010 3.229 2.002 3.807 . 0 0 "[ . 1 . 2]" 1
1043 1 72 LYS QB 1 73 LEU H . . 3.410 2.102 2.002 2.235 . 0 0 "[ . 1 . 2]" 1
1044 1 72 LYS QB 1 73 LEU HG . . 4.990 3.499 2.981 3.726 . 0 0 "[ . 1 . 2]" 1
1045 1 72 LYS QB 1 76 TRP HD1 . . 4.190 3.208 2.645 3.757 . 0 0 "[ . 1 . 2]" 1
1046 1 72 LYS QB 1 100 ALA HA . . 4.470 3.397 2.734 4.354 . 0 0 "[ . 1 . 2]" 1
1047 1 72 LYS HB2 1 73 LEU H . . 3.910 2.130 2.017 2.271 . 0 0 "[ . 1 . 2]" 1
1048 1 72 LYS HB2 1 73 LEU HA . . 4.760 4.193 3.955 4.317 . 0 0 "[ . 1 . 2]" 1
1049 1 72 LYS HB2 1 76 TRP HD1 . . 4.980 4.465 4.120 4.916 . 0 0 "[ . 1 . 2]" 1
1050 1 72 LYS HB2 1 100 ALA HA . . 5.220 4.380 3.979 4.933 . 0 0 "[ . 1 . 2]" 1
1051 1 72 LYS HB2 1 100 ALA MB . . 3.820 2.657 2.206 3.121 . 0 0 "[ . 1 . 2]" 1
1052 1 72 LYS HB3 1 73 LEU H . . 3.910 3.225 3.022 3.481 . 0 0 "[ . 1 . 2]" 1
1053 1 72 LYS HB3 1 73 LEU HA . . 4.760 4.295 4.151 4.498 . 0 0 "[ . 1 . 2]" 1
1054 1 72 LYS HB3 1 76 TRP HD1 . . 4.980 3.294 2.675 3.899 . 0 0 "[ . 1 . 2]" 1
1055 1 72 LYS HB3 1 100 ALA HA . . 5.220 3.562 2.772 4.882 . 0 0 "[ . 1 . 2]" 1
1056 1 72 LYS HB3 1 100 ALA MB . . 3.820 2.646 1.878 3.523 . 0 0 "[ . 1 . 2]" 1
1057 1 72 LYS QE 1 72 LYS QG . . 3.320 2.255 2.069 2.745 . 0 0 "[ . 1 . 2]" 1
1058 1 73 LEU H 1 73 LEU HB2 . . 3.330 2.296 2.211 2.495 . 0 0 "[ . 1 . 2]" 1
1059 1 73 LEU H 1 73 LEU HB3 . . 3.660 3.545 3.511 3.593 . 0 0 "[ . 1 . 2]" 1
1060 1 73 LEU H 1 73 LEU MD1 . . 3.870 3.645 3.498 3.776 . 0 0 "[ . 1 . 2]" 1
1061 1 73 LEU H 1 73 LEU MD2 . . 3.970 3.739 3.402 3.906 . 0 0 "[ . 1 . 2]" 1
1062 1 73 LEU H 1 73 LEU HG . . 3.280 2.645 2.258 2.831 . 0 0 "[ . 1 . 2]" 1
1063 1 73 LEU H 1 74 SER H . . 3.450 2.842 2.536 2.953 . 0 0 "[ . 1 . 2]" 1
1064 1 73 LEU H 1 76 TRP HD1 . . 5.030 4.425 4.055 4.781 . 0 0 "[ . 1 . 2]" 1
1065 1 73 LEU H 1 100 ALA MB . . 3.720 3.215 2.840 3.671 . 0 0 "[ . 1 . 2]" 1
1066 1 73 LEU HA 1 73 LEU MD1 . . 4.160 3.835 3.806 3.896 . 0 0 "[ . 1 . 2]" 1
1067 1 73 LEU HA 1 73 LEU MD2 . . 3.140 2.073 1.975 2.200 . 0 0 "[ . 1 . 2]" 1
1068 1 73 LEU HA 1 73 LEU HG . . 3.760 2.811 2.669 3.122 . 0 0 "[ . 1 . 2]" 1
1069 1 73 LEU HA 1 76 TRP H . . 4.040 3.570 3.073 3.987 . 0 0 "[ . 1 . 2]" 1
1070 1 73 LEU HA 1 76 TRP HB2 . . 4.320 2.510 2.100 2.809 . 0 0 "[ . 1 . 2]" 1
1071 1 73 LEU HA 1 76 TRP QB . . 3.600 2.486 2.088 2.771 . 0 0 "[ . 1 . 2]" 1
1072 1 73 LEU HA 1 76 TRP HB3 . . 4.320 4.015 3.676 4.321 0.001 19 0 "[ . 1 . 2]" 1
1073 1 73 LEU HA 1 76 TRP HD1 . . 4.460 3.187 2.520 3.843 . 0 0 "[ . 1 . 2]" 1
1074 1 73 LEU HA 1 77 GLY H . . 5.210 3.898 3.620 4.319 . 0 0 "[ . 1 . 2]" 1
1075 1 73 LEU HA 1 96 MET QB . . 4.580 4.255 3.779 4.544 . 0 0 "[ . 1 . 2]" 1
1076 1 73 LEU HA 1 100 ALA MB . . 4.570 3.145 2.689 3.480 . 0 0 "[ . 1 . 2]" 1
1077 1 73 LEU HB2 1 73 LEU MD1 . . 3.340 2.249 2.130 2.384 . 0 0 "[ . 1 . 2]" 1
1078 1 73 LEU HB2 1 73 LEU MD2 . . 3.430 3.180 3.168 3.192 . 0 0 "[ . 1 . 2]" 1
1079 1 73 LEU HB2 1 74 SER H . . 3.640 2.637 2.457 2.748 . 0 0 "[ . 1 . 2]" 1
1080 1 73 LEU HB3 1 73 LEU MD1 . . 3.180 2.398 2.292 2.495 . 0 0 "[ . 1 . 2]" 1
1081 1 73 LEU HB3 1 73 LEU MD2 . . 3.580 2.302 2.233 2.352 . 0 0 "[ . 1 . 2]" 1
1082 1 73 LEU HB3 1 74 SER H . . 4.030 3.271 3.068 3.779 . 0 0 "[ . 1 . 2]" 1
1083 1 73 LEU MD1 1 74 SER H . . 4.600 4.455 4.292 4.580 . 0 0 "[ . 1 . 2]" 1
1084 1 73 LEU MD1 1 97 ARG H . . 4.860 4.632 4.035 4.861 0.001 18 0 "[ . 1 . 2]" 1
1085 1 73 LEU MD1 1 97 ARG HA . . 4.200 2.876 2.393 3.379 . 0 0 "[ . 1 . 2]" 1
1086 1 73 LEU MD2 1 74 SER H . . 4.670 4.625 4.536 4.676 0.006 4 0 "[ . 1 . 2]" 1
1087 1 73 LEU MD2 1 76 TRP QB . . 4.100 3.193 2.684 3.597 . 0 0 "[ . 1 . 2]" 1
1088 1 73 LEU MD2 1 76 TRP HD1 . . 4.960 4.137 3.549 4.760 . 0 0 "[ . 1 . 2]" 1
1089 1 73 LEU MD2 1 96 MET HA . . 4.450 4.065 3.515 4.340 . 0 0 "[ . 1 . 2]" 1
1090 1 73 LEU MD2 1 96 MET HB2 . . 3.570 3.222 2.837 3.488 . 0 0 "[ . 1 . 2]" 1
1091 1 73 LEU MD2 1 96 MET QB . . 2.930 2.495 1.954 2.811 . 0 0 "[ . 1 . 2]" 1
1092 1 73 LEU MD2 1 96 MET HB3 . . 3.570 2.603 1.989 2.977 . 0 0 "[ . 1 . 2]" 1
1093 1 73 LEU MD2 1 97 ARG H . . 4.030 3.340 3.134 3.612 . 0 0 "[ . 1 . 2]" 1
1094 1 73 LEU MD2 1 97 ARG HA . . 3.260 2.119 1.908 2.492 . 0 0 "[ . 1 . 2]" 1
1095 1 73 LEU MD2 1 100 ALA H . . 4.550 3.436 2.974 3.816 . 0 0 "[ . 1 . 2]" 1
1096 1 73 LEU MD2 1 100 ALA MB . . 3.090 2.172 1.797 2.511 . 0 0 "[ . 1 . 2]" 1
1097 1 73 LEU HG 1 74 SER H . . 4.750 4.651 4.302 4.753 0.003 18 0 "[ . 1 . 2]" 1
1098 1 73 LEU HG 1 100 ALA MB . . 3.560 2.335 1.863 2.819 . 0 0 "[ . 1 . 2]" 1
1099 1 74 SER H 1 74 SER HB2 . . 3.080 2.318 2.206 2.485 . 0 0 "[ . 1 . 2]" 1
1100 1 74 SER H 1 74 SER HB3 . . 3.080 2.810 2.598 2.951 . 0 0 "[ . 1 . 2]" 1
1101 1 74 SER HA 1 77 GLY H . . 4.210 3.975 3.763 4.133 . 0 0 "[ . 1 . 2]" 1
1102 1 74 SER HB2 1 75 ASN H . . 3.810 3.635 3.400 3.789 . 0 0 "[ . 1 . 2]" 1
1103 1 74 SER HB3 1 75 ASN H . . 3.370 2.408 2.143 2.780 . 0 0 "[ . 1 . 2]" 1
1104 1 74 SER HB3 1 75 ASN QB . . 5.110 4.403 4.250 4.513 . 0 0 "[ . 1 . 2]" 1
1105 1 75 ASN H 1 75 ASN HB2 . . 3.730 2.405 2.230 2.539 . 0 0 "[ . 1 . 2]" 1
1106 1 75 ASN H 1 75 ASN QB . . 3.190 2.369 2.207 2.491 . 0 0 "[ . 1 . 2]" 1
1107 1 75 ASN H 1 75 ASN HB3 . . 3.730 3.577 3.522 3.600 . 0 0 "[ . 1 . 2]" 1
1108 1 75 ASN H 1 76 TRP H . . 3.550 2.832 2.509 3.121 . 0 0 "[ . 1 . 2]" 1
1109 1 75 ASN HA 1 78 HIS H . . 4.880 3.645 3.438 3.879 . 0 0 "[ . 1 . 2]" 1
1110 1 75 ASN QB 1 75 ASN HD22 . . 3.580 3.214 3.213 3.219 . 0 0 "[ . 1 . 2]" 1
1111 1 75 ASN QB 1 76 TRP H . . 3.260 2.301 2.131 2.727 . 0 0 "[ . 1 . 2]" 1
1112 1 75 ASN QB 1 76 TRP HA . . 4.630 3.784 3.735 3.912 . 0 0 "[ . 1 . 2]" 1
1113 1 75 ASN HB2 1 76 TRP H . . 3.850 2.359 2.186 2.809 . 0 0 "[ . 1 . 2]" 1
1114 1 75 ASN HB2 1 76 TRP HA . . 5.500 4.333 4.173 4.563 . 0 0 "[ . 1 . 2]" 1
1115 1 75 ASN HB3 1 76 TRP H . . 3.850 3.229 2.956 3.688 . 0 0 "[ . 1 . 2]" 1
1116 1 75 ASN HB3 1 76 TRP HA . . 5.500 4.185 4.003 4.356 . 0 0 "[ . 1 . 2]" 1
1117 1 76 TRP H 1 76 TRP HB2 . . 3.660 2.273 2.192 2.330 . 0 0 "[ . 1 . 2]" 1
1118 1 76 TRP H 1 76 TRP QB . . 3.100 2.248 2.171 2.302 . 0 0 "[ . 1 . 2]" 1
1119 1 76 TRP H 1 76 TRP HB3 . . 3.660 3.545 3.499 3.577 . 0 0 "[ . 1 . 2]" 1
1120 1 76 TRP H 1 76 TRP HD1 . . 3.800 2.931 2.759 3.214 . 0 0 "[ . 1 . 2]" 1
1121 1 76 TRP H 1 77 GLY H . . 3.630 2.995 2.818 3.147 . 0 0 "[ . 1 . 2]" 1
1122 1 76 TRP HA 1 76 TRP HD1 . . 4.540 4.026 3.896 4.213 . 0 0 "[ . 1 . 2]" 1
1123 1 76 TRP HA 1 76 TRP HE3 . . 3.910 3.046 2.668 3.274 . 0 0 "[ . 1 . 2]" 1
1124 1 76 TRP HA 1 78 HIS H . . 4.860 4.395 4.162 4.760 . 0 0 "[ . 1 . 2]" 1
1125 1 76 TRP HA 1 79 LEU H . . 4.320 3.394 3.247 3.649 . 0 0 "[ . 1 . 2]" 1
1126 1 76 TRP HA 1 79 LEU HB2 . . 3.900 3.079 2.705 3.522 . 0 0 "[ . 1 . 2]" 1
1127 1 76 TRP HA 1 79 LEU HB3 . . 3.810 2.911 2.729 3.120 . 0 0 "[ . 1 . 2]" 1
1128 1 76 TRP HA 1 79 LEU MD2 . . 3.900 3.411 3.223 3.653 . 0 0 "[ . 1 . 2]" 1
1129 1 76 TRP HA 1 80 ASN H . . 4.890 4.574 4.383 4.811 . 0 0 "[ . 1 . 2]" 1
1130 1 76 TRP QB 1 77 GLY H . . 3.580 2.467 2.298 2.663 . 0 0 "[ . 1 . 2]" 1
1131 1 76 TRP HB2 1 77 GLY H . . 4.150 2.610 2.443 2.817 . 0 0 "[ . 1 . 2]" 1
1132 1 76 TRP HB3 1 77 GLY H . . 4.150 3.039 2.799 3.283 . 0 0 "[ . 1 . 2]" 1
1133 1 76 TRP HD1 1 99 ILE MG . . 4.850 4.285 3.575 4.674 . 0 0 "[ . 1 . 2]" 1
1134 1 76 TRP HD1 1 100 ALA MB . . 4.380 3.261 2.216 3.806 . 0 0 "[ . 1 . 2]" 1
1135 1 76 TRP HE1 1 99 ILE MG . . 4.060 2.889 2.277 3.255 . 0 0 "[ . 1 . 2]" 1
1136 1 76 TRP HE3 1 79 LEU MD2 . . 4.510 3.334 2.714 3.640 . 0 0 "[ . 1 . 2]" 1
1137 1 76 TRP HE3 1 80 ASN H . . 5.300 5.141 4.841 5.290 . 0 0 "[ . 1 . 2]" 1
1138 1 76 TRP HE3 1 84 LEU MD1 . . 4.720 3.844 3.529 4.286 . 0 0 "[ . 1 . 2]" 1
1139 1 76 TRP HH2 1 99 ILE MD . . 4.410 3.564 3.261 3.935 . 0 0 "[ . 1 . 2]" 1
1140 1 76 TRP HH2 1 99 ILE MG . . 4.240 3.290 2.876 3.795 . 0 0 "[ . 1 . 2]" 1
1141 1 76 TRP HH2 1 107 VAL MG2 . . 3.900 2.932 2.166 3.750 . 0 0 "[ . 1 . 2]" 1
1142 1 76 TRP HH2 1 110 VAL MG1 . . 4.620 4.290 3.670 4.608 . 0 0 "[ . 1 . 2]" 1
1143 1 76 TRP HZ2 1 99 ILE MD . . 4.580 4.067 3.439 4.567 . 0 0 "[ . 1 . 2]" 1
1144 1 76 TRP HZ2 1 99 ILE MG . . 3.700 2.461 2.156 2.958 . 0 0 "[ . 1 . 2]" 1
1145 1 76 TRP HZ2 1 107 VAL MG2 . . 4.270 3.132 2.576 3.693 . 0 0 "[ . 1 . 2]" 1
1146 1 76 TRP HZ3 1 79 LEU MD2 . . 4.190 3.296 2.804 3.660 . 0 0 "[ . 1 . 2]" 1
1147 1 76 TRP HZ3 1 84 LEU MD1 . . 4.390 3.916 3.321 4.381 . 0 0 "[ . 1 . 2]" 1
1148 1 76 TRP HZ3 1 110 VAL MG1 . . 4.140 3.654 3.283 4.011 . 0 0 "[ . 1 . 2]" 1
1149 1 76 TRP HZ3 1 110 VAL MG2 . . 4.980 4.729 4.382 4.972 . 0 0 "[ . 1 . 2]" 1
1150 1 77 GLY H 1 78 HIS H . . 3.530 2.968 2.841 3.197 . 0 0 "[ . 1 . 2]" 1
1151 1 77 GLY QA 1 78 HIS HA . . 4.320 4.010 4.003 4.017 . 0 0 "[ . 1 . 2]" 1
1152 1 77 GLY QA 1 80 ASN H . . 4.710 3.586 3.400 3.736 . 0 0 "[ . 1 . 2]" 1
1153 1 77 GLY QA 1 80 ASN HB2 . . 4.360 3.258 2.974 3.479 . 0 0 "[ . 1 . 2]" 1
1154 1 77 GLY QA 1 80 ASN HB3 . . 4.130 3.252 3.013 3.477 . 0 0 "[ . 1 . 2]" 1
1155 1 77 GLY QA 1 96 MET ME . . 4.110 2.607 2.012 3.082 . 0 0 "[ . 1 . 2]" 1
1156 1 77 GLY HA2 1 80 ASN HB2 . . 5.130 3.305 3.012 3.539 . 0 0 "[ . 1 . 2]" 1
1157 1 77 GLY HA2 1 80 ASN HB3 . . 4.760 3.321 3.062 3.577 . 0 0 "[ . 1 . 2]" 1
1158 1 77 GLY HA2 1 96 MET ME . . 4.790 2.649 2.026 3.140 . 0 0 "[ . 1 . 2]" 1
1159 1 77 GLY HA3 1 80 ASN HB2 . . 5.130 4.935 4.596 5.128 . 0 0 "[ . 1 . 2]" 1
1160 1 77 GLY HA3 1 80 ASN HB3 . . 4.760 4.650 4.471 4.760 0.000 14 0 "[ . 1 . 2]" 1
1161 1 77 GLY HA3 1 96 MET ME . . 4.790 3.908 3.384 4.477 . 0 0 "[ . 1 . 2]" 1
1162 1 78 HIS H 1 78 HIS QB . . 3.000 2.313 2.184 2.619 . 0 0 "[ . 1 . 2]" 1
1163 1 78 HIS H 1 78 HIS HD2 . . 4.730 3.660 2.057 4.747 0.017 10 0 "[ . 1 . 2]" 1
1164 1 78 HIS H 1 79 LEU H . . 3.450 2.657 2.486 2.810 . 0 0 "[ . 1 . 2]" 1
1165 1 78 HIS H 1 79 LEU HB2 . . 5.090 4.716 4.559 4.906 . 0 0 "[ . 1 . 2]" 1
1166 1 78 HIS H 1 80 ASN H . . 4.880 3.901 3.788 4.104 . 0 0 "[ . 1 . 2]" 1
1167 1 78 HIS HA 1 78 HIS HD2 . . 4.620 2.959 2.120 4.640 0.020 10 0 "[ . 1 . 2]" 1
1168 1 78 HIS HA 1 80 ASN H . . 3.930 3.699 3.555 3.890 . 0 0 "[ . 1 . 2]" 1
1169 1 78 HIS HA 1 81 ARG HB2 . . 4.180 3.466 3.209 3.987 . 0 0 "[ . 1 . 2]" 1
1170 1 78 HIS QB 1 79 LEU H . . 3.440 2.550 2.270 2.842 . 0 0 "[ . 1 . 2]" 1
1171 1 78 HIS QB 1 79 LEU HA . . 4.690 3.850 3.772 3.928 . 0 0 "[ . 1 . 2]" 1
1172 1 79 LEU H 1 79 LEU HB2 . . 3.430 2.257 2.177 2.406 . 0 0 "[ . 1 . 2]" 1
1173 1 79 LEU H 1 79 LEU HB3 . . 3.600 2.795 2.645 2.893 . 0 0 "[ . 1 . 2]" 1
1174 1 79 LEU H 1 79 LEU MD1 . . 4.140 3.774 3.571 3.992 . 0 0 "[ . 1 . 2]" 1
1175 1 79 LEU H 1 79 LEU MD2 . . 4.700 4.286 4.247 4.321 . 0 0 "[ . 1 . 2]" 1
1176 1 79 LEU H 1 79 LEU HG . . 4.540 4.481 4.449 4.506 . 0 0 "[ . 1 . 2]" 1
1177 1 79 LEU H 1 80 ASN H . . 3.680 2.659 2.522 2.815 . 0 0 "[ . 1 . 2]" 1
1178 1 79 LEU HA 1 79 LEU MD1 . . 3.440 2.429 2.311 2.582 . 0 0 "[ . 1 . 2]" 1
1179 1 79 LEU HA 1 79 LEU MD2 . . 4.040 3.835 3.796 3.884 . 0 0 "[ . 1 . 2]" 1
1180 1 79 LEU HA 1 81 ARG H . . 5.140 4.152 3.904 4.447 . 0 0 "[ . 1 . 2]" 1
1181 1 79 LEU HA 1 82 LYS H . . 3.840 3.200 3.077 3.335 . 0 0 "[ . 1 . 2]" 1
1182 1 79 LEU HA 1 82 LYS HB2 . . 3.840 2.299 2.058 2.535 . 0 0 "[ . 1 . 2]" 1
1183 1 79 LEU HA 1 82 LYS HB3 . . 4.970 3.731 3.416 4.018 . 0 0 "[ . 1 . 2]" 1
1184 1 79 LEU HA 1 83 VAL H . . 3.670 3.061 2.777 3.471 . 0 0 "[ . 1 . 2]" 1
1185 1 79 LEU HA 1 83 VAL HB . . 4.310 3.536 3.267 3.876 . 0 0 "[ . 1 . 2]" 1
1186 1 79 LEU HA 1 83 VAL MG2 . . 3.430 2.715 2.376 3.147 . 0 0 "[ . 1 . 2]" 1
1187 1 79 LEU HB2 1 79 LEU MD1 . . 3.560 2.167 2.035 2.237 . 0 0 "[ . 1 . 2]" 1
1188 1 79 LEU HB2 1 79 LEU MD2 . . 3.600 2.620 2.546 2.697 . 0 0 "[ . 1 . 2]" 1
1189 1 79 LEU HB2 1 80 ASN H . . 4.150 3.966 3.807 4.100 . 0 0 "[ . 1 . 2]" 1
1190 1 79 LEU HB2 1 83 VAL MG2 . . 4.960 4.087 3.879 4.235 . 0 0 "[ . 1 . 2]" 1
1191 1 79 LEU HB3 1 79 LEU MD2 . . 3.660 2.080 1.970 2.210 . 0 0 "[ . 1 . 2]" 1
1192 1 79 LEU HB3 1 80 ASN H . . 3.720 3.175 3.002 3.328 . 0 0 "[ . 1 . 2]" 1
1193 1 79 LEU HB3 1 83 VAL MG2 . . 4.450 4.317 4.042 4.440 . 0 0 "[ . 1 . 2]" 1
1194 1 79 LEU HB3 1 84 LEU MD2 . . 5.500 4.978 4.524 5.292 . 0 0 "[ . 1 . 2]" 1
1195 1 79 LEU MD1 1 83 VAL H . . 4.500 4.306 4.020 4.463 . 0 0 "[ . 1 . 2]" 1
1196 1 79 LEU MD1 1 83 VAL HB . . 3.740 3.364 3.186 3.526 . 0 0 "[ . 1 . 2]" 1
1197 1 79 LEU MD1 1 83 VAL MG1 . . 3.890 3.531 3.394 3.741 . 0 0 "[ . 1 . 2]" 1
1198 1 79 LEU MD1 1 83 VAL MG2 . . 3.470 1.918 1.799 2.103 . 0 0 "[ . 1 . 2]" 1
1199 1 79 LEU MD1 1 84 LEU H . . 5.230 4.877 4.675 5.003 . 0 0 "[ . 1 . 2]" 1
1200 1 79 LEU MD2 1 80 ASN H . . 4.860 4.714 4.525 4.854 . 0 0 "[ . 1 . 2]" 1
1201 1 79 LEU MD2 1 83 VAL HB . . 4.270 3.343 3.096 3.533 . 0 0 "[ . 1 . 2]" 1
1202 1 79 LEU MD2 1 83 VAL MG1 . . 4.220 3.424 3.150 3.723 . 0 0 "[ . 1 . 2]" 1
1203 1 79 LEU MD2 1 83 VAL MG2 . . 3.600 3.230 2.944 3.472 . 0 0 "[ . 1 . 2]" 1
1204 1 79 LEU MD2 1 84 LEU H . . 5.500 4.255 3.966 4.471 . 0 0 "[ . 1 . 2]" 1
1205 1 79 LEU MD2 1 84 LEU MD1 . . 4.340 3.988 3.617 4.182 . 0 0 "[ . 1 . 2]" 1
1206 1 79 LEU MD2 1 84 LEU MD2 . . 3.910 3.535 3.219 3.804 . 0 0 "[ . 1 . 2]" 1
1207 1 79 LEU MD2 1 84 LEU HG . . 5.000 3.704 3.395 3.983 . 0 0 "[ . 1 . 2]" 1
1208 1 79 LEU HG 1 80 ASN H . . 4.880 4.676 4.490 4.812 . 0 0 "[ . 1 . 2]" 1
1209 1 79 LEU HG 1 83 VAL HB . . 4.500 2.098 1.996 2.301 . 0 0 "[ . 1 . 2]" 1
1210 1 79 LEU HG 1 83 VAL MG1 . . 4.360 3.280 3.114 3.497 . 0 0 "[ . 1 . 2]" 1
1211 1 79 LEU HG 1 83 VAL MG2 . . 4.250 2.223 2.017 2.424 . 0 0 "[ . 1 . 2]" 1
1212 1 79 LEU HG 1 84 LEU H . . 4.790 3.572 3.380 3.725 . 0 0 "[ . 1 . 2]" 1
1213 1 79 LEU HG 1 84 LEU HG . . 4.170 3.854 3.553 4.045 . 0 0 "[ . 1 . 2]" 1
1214 1 80 ASN H 1 80 ASN HB2 . . 3.220 2.581 2.407 2.725 . 0 0 "[ . 1 . 2]" 1
1215 1 80 ASN H 1 80 ASN HB3 . . 3.270 2.557 2.464 2.714 . 0 0 "[ . 1 . 2]" 1
1216 1 80 ASN H 1 80 ASN HD21 . . 5.500 4.736 4.541 4.792 . 0 0 "[ . 1 . 2]" 1
1217 1 80 ASN H 1 81 ARG H . . 3.590 2.428 2.274 2.579 . 0 0 "[ . 1 . 2]" 1
1218 1 80 ASN H 1 84 LEU MD1 . . 4.650 4.002 3.731 4.215 . 0 0 "[ . 1 . 2]" 1
1219 1 80 ASN H 1 96 MET ME . . 5.230 4.679 3.975 5.120 . 0 0 "[ . 1 . 2]" 1
1220 1 80 ASN HA 1 83 VAL H . . 4.890 4.040 3.801 4.252 . 0 0 "[ . 1 . 2]" 1
1221 1 80 ASN HA 1 84 LEU H . . 4.120 3.233 3.080 3.561 . 0 0 "[ . 1 . 2]" 1
1222 1 80 ASN HA 1 84 LEU HB2 . . 3.970 2.341 2.040 2.636 . 0 0 "[ . 1 . 2]" 1
1223 1 80 ASN HA 1 84 LEU HB3 . . 4.520 3.734 3.475 4.010 . 0 0 "[ . 1 . 2]" 1
1224 1 80 ASN HA 1 84 LEU MD1 . . 3.420 2.017 1.911 2.151 . 0 0 "[ . 1 . 2]" 1
1225 1 80 ASN HA 1 84 LEU MD2 . . 4.390 3.826 3.671 4.095 . 0 0 "[ . 1 . 2]" 1
1226 1 80 ASN HA 1 84 LEU HG . . 4.110 2.300 2.052 2.686 . 0 0 "[ . 1 . 2]" 1
1227 1 80 ASN HB2 1 81 ARG H . . 4.010 3.943 3.726 4.020 0.010 10 0 "[ . 1 . 2]" 1
1228 1 80 ASN HB2 1 81 ARG QG . . 4.930 4.682 4.308 4.888 . 0 0 "[ . 1 . 2]" 1
1229 1 80 ASN HB2 1 84 LEU MD1 . . 4.280 2.766 2.513 3.384 . 0 0 "[ . 1 . 2]" 1
1230 1 80 ASN HB2 1 84 LEU HG . . 4.960 4.384 4.067 4.960 . 0 0 "[ . 1 . 2]" 1
1231 1 80 ASN HB2 1 96 MET ME . . 3.360 2.860 2.081 3.358 . 0 0 "[ . 1 . 2]" 1
1232 1 80 ASN HB3 1 80 ASN HD22 . . 3.870 3.758 3.435 3.900 0.030 20 0 "[ . 1 . 2]" 1
1233 1 80 ASN HB3 1 81 ARG H . . 3.430 2.805 2.559 3.029 . 0 0 "[ . 1 . 2]" 1
1234 1 80 ASN HB3 1 81 ARG HG2 . . 4.920 4.162 2.717 4.821 . 0 0 "[ . 1 . 2]" 1
1235 1 80 ASN HB3 1 81 ARG HG3 . . 4.920 3.405 2.908 4.709 . 0 0 "[ . 1 . 2]" 1
1236 1 80 ASN HB3 1 84 LEU MD1 . . 4.460 3.808 3.613 4.200 . 0 0 "[ . 1 . 2]" 1
1237 1 80 ASN HB3 1 96 MET ME . . 3.400 3.229 3.006 3.391 . 0 0 "[ . 1 . 2]" 1
1238 1 80 ASN HD21 1 84 LEU MD1 . . 5.010 3.308 2.624 4.594 . 0 0 "[ . 1 . 2]" 1
1239 1 80 ASN HD21 1 91 VAL H . . 4.260 3.781 3.226 4.199 . 0 0 "[ . 1 . 2]" 1
1240 1 80 ASN HD21 1 91 VAL HB . . 4.800 3.416 2.506 4.797 . 0 0 "[ . 1 . 2]" 1
1241 1 80 ASN HD21 1 96 MET ME . . 3.330 2.109 1.699 2.725 . 0 0 "[ . 1 . 2]" 1
1242 1 80 ASN HD22 1 84 LEU MD1 . . 4.620 3.238 2.676 4.080 . 0 0 "[ . 1 . 2]" 1
1243 1 80 ASN HD22 1 90 SER QB . . 5.070 4.416 3.641 4.871 . 0 0 "[ . 1 . 2]" 1
1244 1 80 ASN HD22 1 91 VAL H . . 4.060 2.261 1.813 2.807 . 0 0 "[ . 1 . 2]" 1
1245 1 80 ASN HD22 1 91 VAL HB . . 4.620 3.086 2.161 4.108 . 0 0 "[ . 1 . 2]" 1
1246 1 80 ASN HD22 1 96 MET ME . . 3.580 3.041 2.458 3.478 . 0 0 "[ . 1 . 2]" 1
1247 1 81 ARG H 1 81 ARG HB2 . . 3.360 2.444 2.367 2.615 . 0 0 "[ . 1 . 2]" 1
1248 1 81 ARG H 1 81 ARG HB3 . . 3.910 3.650 3.591 3.731 . 0 0 "[ . 1 . 2]" 1
1249 1 81 ARG H 1 81 ARG QG . . 3.190 2.927 2.527 3.181 . 0 0 "[ . 1 . 2]" 1
1250 1 81 ARG H 1 82 LYS H . . 3.370 2.186 1.953 2.394 . 0 0 "[ . 1 . 2]" 1
1251 1 81 ARG H 1 82 LYS HB2 . . 4.860 4.036 3.877 4.255 . 0 0 "[ . 1 . 2]" 1
1252 1 81 ARG H 1 83 VAL H . . 4.470 3.855 3.555 4.056 . 0 0 "[ . 1 . 2]" 1
1253 1 81 ARG HA 1 81 ARG QD . . 4.260 3.638 2.019 4.191 . 0 0 "[ . 1 . 2]" 1
1254 1 81 ARG HA 1 81 ARG HG2 . . 4.010 2.450 2.251 3.029 . 0 0 "[ . 1 . 2]" 1
1255 1 81 ARG HA 1 81 ARG QG . . 3.370 2.375 2.209 2.903 . 0 0 "[ . 1 . 2]" 1
1256 1 81 ARG HA 1 81 ARG HG3 . . 4.010 3.240 2.902 3.829 . 0 0 "[ . 1 . 2]" 1
1257 1 81 ARG HA 1 84 LEU HB2 . . 5.320 4.468 4.251 4.769 . 0 0 "[ . 1 . 2]" 1
1258 1 81 ARG HA 1 84 LEU MD1 . . 5.500 5.433 5.273 5.504 0.004 18 0 "[ . 1 . 2]" 1
1259 1 81 ARG HA 1 85 LYS H . . 3.870 3.296 3.157 3.464 . 0 0 "[ . 1 . 2]" 1
1260 1 81 ARG HA 1 85 LYS HB2 . . 4.130 2.147 1.984 2.348 . 0 0 "[ . 1 . 2]" 1
1261 1 81 ARG HA 1 85 LYS QB . . 3.290 2.113 1.974 2.312 . 0 0 "[ . 1 . 2]" 1
1262 1 81 ARG HA 1 85 LYS HB3 . . 4.130 3.358 2.426 3.765 . 0 0 "[ . 1 . 2]" 1
1263 1 81 ARG HA 1 85 LYS HD2 . . 5.300 3.947 2.656 4.995 . 0 0 "[ . 1 . 2]" 1
1264 1 81 ARG HA 1 85 LYS QD . . 4.500 3.190 2.265 4.521 0.021 18 0 "[ . 1 . 2]" 1
1265 1 81 ARG HA 1 85 LYS HD3 . . 5.300 3.804 2.386 5.302 0.002 18 0 "[ . 1 . 2]" 1
1266 1 81 ARG HA 1 85 LYS QE . . 5.380 4.485 2.169 5.150 . 0 0 "[ . 1 . 2]" 1
1267 1 81 ARG HB2 1 81 ARG QD . . 3.660 2.804 2.275 3.466 . 0 0 "[ . 1 . 2]" 1
1268 1 81 ARG HB2 1 82 LYS H . . 3.900 3.589 3.178 3.687 . 0 0 "[ . 1 . 2]" 1
1269 1 81 ARG HB3 1 81 ARG QD . . 3.150 2.442 2.178 2.861 . 0 0 "[ . 1 . 2]" 1
1270 1 81 ARG HB3 1 82 LYS H . . 4.440 4.200 3.872 4.361 . 0 0 "[ . 1 . 2]" 1
1271 1 82 LYS H 1 82 LYS HB2 . . 3.610 2.435 2.255 2.546 . 0 0 "[ . 1 . 2]" 1
1272 1 82 LYS H 1 82 LYS HB3 . . 3.740 3.640 3.528 3.720 . 0 0 "[ . 1 . 2]" 1
1273 1 82 LYS H 1 82 LYS HG2 . . 4.330 3.279 2.625 4.361 0.031 10 0 "[ . 1 . 2]" 1
1274 1 82 LYS H 1 82 LYS QG . . 3.570 3.082 2.579 3.623 0.053 10 0 "[ . 1 . 2]" 1
1275 1 82 LYS H 1 82 LYS HG3 . . 4.330 3.974 3.421 4.330 0.000 1 0 "[ . 1 . 2]" 1
1276 1 82 LYS H 1 83 VAL H . . 3.260 2.002 1.895 2.231 . 0 0 "[ . 1 . 2]" 1
1277 1 82 LYS H 1 83 VAL HB . . 4.960 4.396 4.286 4.611 . 0 0 "[ . 1 . 2]" 1
1278 1 82 LYS H 1 83 VAL MG2 . . 4.420 4.090 3.914 4.225 . 0 0 "[ . 1 . 2]" 1
1279 1 82 LYS H 1 84 LEU H . . 4.560 4.131 3.880 4.498 . 0 0 "[ . 1 . 2]" 1
1280 1 82 LYS HA 1 82 LYS QD . . 3.630 2.552 1.986 3.654 0.024 16 0 "[ . 1 . 2]" 1
1281 1 82 LYS HA 1 82 LYS QG . . 3.740 2.553 2.144 2.841 . 0 0 "[ . 1 . 2]" 1
1282 1 82 LYS HB2 1 82 LYS QE . . 4.230 4.041 3.436 4.285 0.055 13 0 "[ . 1 . 2]" 1
1283 1 82 LYS HB2 1 83 VAL H . . 3.540 2.897 2.690 3.163 . 0 0 "[ . 1 . 2]" 1
1284 1 82 LYS HB2 1 83 VAL MG2 . . 3.590 3.146 2.798 3.418 . 0 0 "[ . 1 . 2]" 1
1285 1 82 LYS HB3 1 82 LYS QD . . 3.570 2.310 2.045 3.241 . 0 0 "[ . 1 . 2]" 1
1286 1 82 LYS HB3 1 82 LYS QE . . 4.070 3.581 2.274 4.091 0.021 10 0 "[ . 1 . 2]" 1
1287 1 82 LYS HB3 1 83 VAL H . . 3.860 3.660 3.452 3.864 0.004 17 0 "[ . 1 . 2]" 1
1288 1 82 LYS HB3 1 83 VAL MG2 . . 3.810 3.179 2.878 3.489 . 0 0 "[ . 1 . 2]" 1
1289 1 82 LYS HE2 1 82 LYS HG2 . . 4.220 3.103 2.151 4.133 . 0 0 "[ . 1 . 2]" 1
1290 1 82 LYS HE2 1 82 LYS HG3 . . 4.220 3.279 2.105 4.194 . 0 0 "[ . 1 . 2]" 1
1291 1 82 LYS HE3 1 82 LYS HG2 . . 4.220 2.956 2.087 3.960 . 0 0 "[ . 1 . 2]" 1
1292 1 82 LYS HE3 1 82 LYS HG3 . . 4.220 2.904 2.136 3.752 . 0 0 "[ . 1 . 2]" 1
1293 1 83 VAL H 1 83 VAL HB . . 3.430 2.592 2.483 2.769 . 0 0 "[ . 1 . 2]" 1
1294 1 83 VAL H 1 83 VAL MG1 . . 3.970 3.822 3.766 3.909 . 0 0 "[ . 1 . 2]" 1
1295 1 83 VAL H 1 83 VAL MG2 . . 3.440 2.797 2.619 2.964 . 0 0 "[ . 1 . 2]" 1
1296 1 83 VAL H 1 84 LEU H . . 3.300 2.595 2.476 2.690 . 0 0 "[ . 1 . 2]" 1
1297 1 83 VAL H 1 85 LYS H . . 3.990 3.594 3.265 3.854 . 0 0 "[ . 1 . 2]" 1
1298 1 83 VAL HA 1 83 VAL MG1 . . 3.310 2.387 2.268 2.459 . 0 0 "[ . 1 . 2]" 1
1299 1 83 VAL HA 1 83 VAL MG2 . . 3.450 2.310 2.203 2.421 . 0 0 "[ . 1 . 2]" 1
1300 1 83 VAL HA 1 86 ARG H . . 4.910 3.752 3.514 3.919 . 0 0 "[ . 1 . 2]" 1
1301 1 83 VAL HA 1 86 ARG QB . . 4.310 3.268 2.631 3.909 . 0 0 "[ . 1 . 2]" 1
1302 1 83 VAL HB 1 84 LEU H . . 3.490 1.985 1.899 2.087 . 0 0 "[ . 1 . 2]" 1
1303 1 83 VAL HB 1 84 LEU HA . . 5.070 4.193 4.046 4.293 . 0 0 "[ . 1 . 2]" 1
1304 1 83 VAL HB 1 84 LEU MD2 . . 3.860 3.629 3.346 3.821 . 0 0 "[ . 1 . 2]" 1
1305 1 83 VAL HB 1 84 LEU HG . . 4.900 3.247 2.989 3.446 . 0 0 "[ . 1 . 2]" 1
1306 1 83 VAL MG1 1 84 LEU H . . 4.170 2.658 2.431 3.021 . 0 0 "[ . 1 . 2]" 1
1307 1 83 VAL MG1 1 84 LEU HA . . 4.150 3.067 2.891 3.429 . 0 0 "[ . 1 . 2]" 1
1308 1 83 VAL MG1 1 87 LEU MD1 . . 2.890 2.138 1.785 2.756 . 0 0 "[ . 1 . 2]" 1
1309 1 83 VAL MG2 1 84 LEU H . . 4.070 3.619 3.541 3.683 . 0 0 "[ . 1 . 2]" 1
1310 1 84 LEU H 1 84 LEU HB2 . . 3.560 2.706 2.582 2.780 . 0 0 "[ . 1 . 2]" 1
1311 1 84 LEU H 1 84 LEU MD1 . . 4.080 3.625 3.432 3.758 . 0 0 "[ . 1 . 2]" 1
1312 1 84 LEU H 1 84 LEU MD2 . . 3.970 2.876 2.656 3.114 . 0 0 "[ . 1 . 2]" 1
1313 1 84 LEU H 1 84 LEU HG . . 3.310 2.033 1.893 2.192 . 0 0 "[ . 1 . 2]" 1
1314 1 84 LEU H 1 85 LYS H . . 3.880 3.122 2.935 3.229 . 0 0 "[ . 1 . 2]" 1
1315 1 84 LEU HA 1 84 LEU MD1 . . 4.220 3.867 3.799 3.939 . 0 0 "[ . 1 . 2]" 1
1316 1 84 LEU HA 1 84 LEU MD2 . . 3.140 2.148 1.974 2.350 . 0 0 "[ . 1 . 2]" 1
1317 1 84 LEU HA 1 86 ARG H . . 4.690 4.497 4.216 4.676 . 0 0 "[ . 1 . 2]" 1
1318 1 84 LEU HA 1 87 LEU H . . 4.120 3.297 3.046 3.470 . 0 0 "[ . 1 . 2]" 1
1319 1 84 LEU HA 1 87 LEU QB . . 3.460 2.609 2.110 2.897 . 0 0 "[ . 1 . 2]" 1
1320 1 84 LEU HA 1 87 LEU MD1 . . 3.620 2.837 2.376 3.206 . 0 0 "[ . 1 . 2]" 1
1321 1 84 LEU HA 1 87 LEU HG . . 4.860 4.341 3.541 4.796 . 0 0 "[ . 1 . 2]" 1
1322 1 84 LEU HA 1 89 PHE H . . 4.750 3.774 3.481 4.145 . 0 0 "[ . 1 . 2]" 1
1323 1 84 LEU HA 1 89 PHE QB . . 4.680 2.657 2.183 3.176 . 0 0 "[ . 1 . 2]" 1
1324 1 84 LEU HB2 1 84 LEU MD1 . . 3.450 2.271 2.115 2.393 . 0 0 "[ . 1 . 2]" 1
1325 1 84 LEU HB2 1 85 LYS H . . 3.990 2.245 1.997 2.538 . 0 0 "[ . 1 . 2]" 1
1326 1 84 LEU HB2 1 85 LYS HA . . 5.500 4.097 3.992 4.197 . 0 0 "[ . 1 . 2]" 1
1327 1 84 LEU HB2 1 89 PHE QB . . 4.680 3.707 3.546 3.854 . 0 0 "[ . 1 . 2]" 1
1328 1 84 LEU HB2 1 89 PHE QD . . 4.630 4.515 4.197 4.629 . 0 0 "[ . 1 . 2]" 1
1329 1 84 LEU HB3 1 84 LEU MD1 . . 3.410 2.357 2.234 2.508 . 0 0 "[ . 1 . 2]" 1
1330 1 84 LEU HB3 1 84 LEU MD2 . . 3.430 2.318 2.165 2.399 . 0 0 "[ . 1 . 2]" 1
1331 1 84 LEU HB3 1 85 LYS H . . 4.270 3.386 3.153 3.710 . 0 0 "[ . 1 . 2]" 1
1332 1 84 LEU HB3 1 89 PHE HB2 . . 4.640 3.744 3.614 3.991 . 0 0 "[ . 1 . 2]" 1
1333 1 84 LEU HB3 1 89 PHE QB . . 3.910 2.072 1.990 2.297 . 0 0 "[ . 1 . 2]" 1
1334 1 84 LEU HB3 1 89 PHE HB3 . . 4.640 2.082 1.998 2.311 . 0 0 "[ . 1 . 2]" 1
1335 1 84 LEU HB3 1 89 PHE QD . . 4.200 3.021 2.583 3.312 . 0 0 "[ . 1 . 2]" 1
1336 1 84 LEU MD1 1 85 LYS H . . 5.040 4.187 3.938 4.332 . 0 0 "[ . 1 . 2]" 1
1337 1 84 LEU MD1 1 85 LYS HA . . 5.500 5.492 5.443 5.533 0.033 10 0 "[ . 1 . 2]" 1
1338 1 84 LEU MD1 1 89 PHE QD . . 3.710 2.723 2.453 3.198 . 0 0 "[ . 1 . 2]" 1
1339 1 84 LEU MD1 1 90 SER H . . 5.500 4.685 4.158 5.209 . 0 0 "[ . 1 . 2]" 1
1340 1 84 LEU MD1 1 91 VAL H . . 4.310 3.448 2.837 3.998 . 0 0 "[ . 1 . 2]" 1
1341 1 84 LEU MD1 1 91 VAL HB . . 4.190 2.828 2.269 3.387 . 0 0 "[ . 1 . 2]" 1
1342 1 84 LEU MD1 1 91 VAL MG2 . . 3.100 2.407 2.039 2.889 . 0 0 "[ . 1 . 2]" 1
1343 1 84 LEU MD2 1 85 LYS H . . 4.810 4.539 4.458 4.706 . 0 0 "[ . 1 . 2]" 1
1344 1 84 LEU MD2 1 89 PHE HB2 . . 4.600 3.393 3.180 3.891 . 0 0 "[ . 1 . 2]" 1
1345 1 84 LEU MD2 1 89 PHE QB . . 3.940 2.262 1.963 2.797 . 0 0 "[ . 1 . 2]" 1
1346 1 84 LEU MD2 1 89 PHE HB3 . . 4.600 2.299 1.981 2.867 . 0 0 "[ . 1 . 2]" 1
1347 1 84 LEU MD2 1 89 PHE QD . . 3.940 2.637 2.118 3.534 . 0 0 "[ . 1 . 2]" 1
1348 1 84 LEU MD2 1 89 PHE QE . . 5.100 3.860 3.499 4.521 . 0 0 "[ . 1 . 2]" 1
1349 1 84 LEU MD2 1 114 LEU MD1 . . 3.350 2.827 2.110 3.348 . 0 0 "[ . 1 . 2]" 1
1350 1 84 LEU HG 1 85 LYS H . . 4.680 4.117 3.913 4.238 . 0 0 "[ . 1 . 2]" 1
1351 1 85 LYS H 1 85 LYS HB2 . . 3.390 2.312 2.160 2.751 . 0 0 "[ . 1 . 2]" 1
1352 1 85 LYS H 1 85 LYS QB . . 2.960 2.191 2.116 2.267 . 0 0 "[ . 1 . 2]" 1
1353 1 85 LYS H 1 85 LYS HB3 . . 3.390 2.863 2.351 3.498 0.108 15 0 "[ . 1 . 2]" 1
1354 1 85 LYS H 1 85 LYS HG2 . . 4.650 4.449 3.737 4.659 0.009 8 0 "[ . 1 . 2]" 1
1355 1 85 LYS H 1 85 LYS QG . . 4.090 3.876 2.822 4.069 . 0 0 "[ . 1 . 2]" 1
1356 1 85 LYS H 1 85 LYS HG3 . . 4.650 4.293 2.920 4.553 . 0 0 "[ . 1 . 2]" 1
1357 1 85 LYS H 1 87 LEU H . . 4.880 4.176 3.916 4.396 . 0 0 "[ . 1 . 2]" 1
1358 1 85 LYS H 1 89 PHE H . . 5.090 4.604 4.435 4.852 . 0 0 "[ . 1 . 2]" 1
1359 1 85 LYS HA 1 85 LYS QD . . 4.390 3.397 2.109 4.142 . 0 0 "[ . 1 . 2]" 1
1360 1 85 LYS HA 1 85 LYS QE . . 5.500 4.267 1.963 4.986 . 0 0 "[ . 1 . 2]" 1
1361 1 85 LYS HA 1 85 LYS HG2 . . 3.740 3.064 2.168 3.749 0.009 6 0 "[ . 1 . 2]" 1
1362 1 85 LYS HA 1 85 LYS QG . . 3.180 2.434 2.147 2.674 . 0 0 "[ . 1 . 2]" 1
1363 1 85 LYS HA 1 85 LYS HG3 . . 3.740 2.776 2.307 3.561 . 0 0 "[ . 1 . 2]" 1
1364 1 85 LYS HA 1 87 LEU H . . 4.630 4.248 3.872 4.499 . 0 0 "[ . 1 . 2]" 1
1365 1 85 LYS HA 1 88 ASN H . . 4.380 4.069 3.844 4.301 . 0 0 "[ . 1 . 2]" 1
1366 1 85 LYS HA 1 88 ASN HA . . 4.490 3.951 3.644 4.286 . 0 0 "[ . 1 . 2]" 1
1367 1 85 LYS HA 1 89 PHE H . . 4.030 3.513 3.209 3.951 . 0 0 "[ . 1 . 2]" 1
1368 1 85 LYS QB 1 85 LYS QD . . 3.070 2.162 2.047 2.453 . 0 0 "[ . 1 . 2]" 1
1369 1 85 LYS QB 1 85 LYS QE . . 4.120 3.184 2.049 3.725 . 0 0 "[ . 1 . 2]" 1
1370 1 85 LYS QB 1 86 ARG H . . 3.440 2.334 2.160 2.684 . 0 0 "[ . 1 . 2]" 1
1371 1 86 ARG H 1 86 ARG QB . . 3.070 2.471 2.299 2.578 . 0 0 "[ . 1 . 2]" 1
1372 1 86 ARG H 1 86 ARG HD2 . . 4.870 4.368 2.009 4.846 . 0 0 "[ . 1 . 2]" 1
1373 1 86 ARG H 1 86 ARG HD3 . . 4.870 4.014 1.897 4.624 . 0 0 "[ . 1 . 2]" 1
1374 1 86 ARG H 1 86 ARG HG2 . . 3.630 2.231 1.904 3.760 0.130 2 0 "[ . 1 . 2]" 1
1375 1 86 ARG H 1 86 ARG HG3 . . 3.630 3.396 3.260 3.542 . 0 0 "[ . 1 . 2]" 1
1376 1 86 ARG H 1 87 LEU H . . 3.260 2.706 2.465 2.836 . 0 0 "[ . 1 . 2]" 1
1377 1 86 ARG H 1 87 LEU MD1 . . 5.100 4.991 4.771 5.099 . 0 0 "[ . 1 . 2]" 1
1378 1 86 ARG H 1 88 ASN H . . 4.380 4.333 4.232 4.380 . 17 0 "[ . 1 . 2]" 1
1379 1 86 ARG HA 1 86 ARG HD2 . . 4.080 3.203 2.110 4.015 . 0 0 "[ . 1 . 2]" 1
1380 1 86 ARG HA 1 86 ARG QD . . 3.550 2.464 1.983 3.006 . 0 0 "[ . 1 . 2]" 1
1381 1 86 ARG HA 1 86 ARG HD3 . . 4.080 2.863 2.000 4.042 . 0 0 "[ . 1 . 2]" 1
1382 1 86 ARG HA 1 86 ARG HG2 . . 3.850 2.893 2.597 3.658 . 0 0 "[ . 1 . 2]" 1
1383 1 86 ARG HA 1 86 ARG QG . . 3.250 2.752 2.387 3.007 . 0 0 "[ . 1 . 2]" 1
1384 1 86 ARG HA 1 86 ARG HG3 . . 3.850 3.717 2.419 3.855 0.005 9 0 "[ . 1 . 2]" 1
1385 1 86 ARG HA 1 88 ASN H . . 3.740 3.576 3.491 3.701 . 0 0 "[ . 1 . 2]" 1
1386 1 86 ARG QB 1 86 ARG HD2 . . 3.760 2.620 2.090 3.305 . 0 0 "[ . 1 . 2]" 1
1387 1 86 ARG QB 1 86 ARG QD . . 3.190 2.250 2.048 2.622 . 0 0 "[ . 1 . 2]" 1
1388 1 86 ARG QB 1 86 ARG HD3 . . 3.760 2.780 2.120 3.448 . 0 0 "[ . 1 . 2]" 1
1389 1 86 ARG QB 1 87 LEU H . . 3.750 2.702 2.470 3.018 . 0 0 "[ . 1 . 2]" 1
1390 1 86 ARG QB 1 87 LEU HG . . 3.940 3.082 2.956 3.273 . 0 0 "[ . 1 . 2]" 1
1391 1 86 ARG QB 1 88 ASN H . . 4.640 4.414 4.327 4.606 . 0 0 "[ . 1 . 2]" 1
1392 1 86 ARG QD 1 86 ARG QG . . 2.360 2.053 1.996 2.090 . 0 0 "[ . 1 . 2]" 1
1393 1 87 LEU H 1 87 LEU QB . . 3.440 2.373 2.310 2.461 . 0 0 "[ . 1 . 2]" 1
1394 1 87 LEU H 1 87 LEU MD1 . . 3.920 3.388 3.254 3.649 . 0 0 "[ . 1 . 2]" 1
1395 1 87 LEU H 1 87 LEU MD2 . . 4.170 3.986 3.835 4.176 0.006 15 0 "[ . 1 . 2]" 1
1396 1 87 LEU H 1 87 LEU HG . . 3.310 2.744 2.529 3.021 . 0 0 "[ . 1 . 2]" 1
1397 1 87 LEU H 1 88 ASN H . . 3.220 2.872 2.654 2.985 . 0 0 "[ . 1 . 2]" 1
1398 1 87 LEU H 1 89 PHE H . . 3.910 3.448 3.252 3.634 . 0 0 "[ . 1 . 2]" 1
1399 1 87 LEU HA 1 87 LEU MD1 . . 4.270 3.901 3.875 3.938 . 0 0 "[ . 1 . 2]" 1
1400 1 87 LEU HA 1 87 LEU MD2 . . 3.300 2.376 2.094 2.547 . 0 0 "[ . 1 . 2]" 1
1401 1 87 LEU HA 1 87 LEU HG . . 3.530 2.800 2.722 2.977 . 0 0 "[ . 1 . 2]" 1
1402 1 87 LEU QB 1 87 LEU MD1 . . 3.150 2.082 1.972 2.098 . 0 0 "[ . 1 . 2]" 1
1403 1 87 LEU QB 1 88 ASN H . . 4.380 3.749 3.663 3.788 . 0 0 "[ . 1 . 2]" 1
1404 1 87 LEU QB 1 89 PHE QB . . 3.600 2.609 2.499 2.728 . 0 0 "[ . 1 . 2]" 1
1405 1 87 LEU HB2 1 89 PHE H . . 4.310 3.364 3.079 3.532 . 0 0 "[ . 1 . 2]" 1
1406 1 87 LEU HB2 1 89 PHE HB2 . . 4.720 2.911 2.743 3.062 . 0 0 "[ . 1 . 2]" 1
1407 1 87 LEU HB2 1 89 PHE HB3 . . 4.720 3.528 3.287 3.700 . 0 0 "[ . 1 . 2]" 1
1408 1 87 LEU HB3 1 89 PHE H . . 4.310 4.151 3.934 4.310 0.000 15 0 "[ . 1 . 2]" 1
1409 1 87 LEU HB3 1 89 PHE HB2 . . 4.720 3.241 3.082 3.396 . 0 0 "[ . 1 . 2]" 1
1410 1 87 LEU HB3 1 89 PHE HB3 . . 4.720 4.522 4.199 4.724 0.004 17 0 "[ . 1 . 2]" 1
1411 1 87 LEU MD1 1 89 PHE QB . . 5.340 3.713 3.518 3.839 . 0 0 "[ . 1 . 2]" 1
1412 1 87 LEU MD1 1 118 LEU MD2 . . 3.230 2.528 1.961 3.101 . 0 0 "[ . 1 . 2]" 1
1413 1 87 LEU MD2 1 118 LEU HA . . 3.850 2.899 2.276 3.564 . 0 0 "[ . 1 . 2]" 1
1414 1 87 LEU MD2 1 118 LEU MD2 . . 3.360 2.426 2.016 3.077 . 0 0 "[ . 1 . 2]" 1
1415 1 87 LEU MD2 1 118 LEU HG . . 4.800 3.213 2.077 3.916 . 0 0 "[ . 1 . 2]" 1
1416 1 87 LEU MD2 1 121 ARG HD2 . . 4.300 2.950 1.993 4.219 . 0 0 "[ . 1 . 2]" 1
1417 1 87 LEU MD2 1 121 ARG QD . . 3.660 2.620 1.936 3.513 . 0 0 "[ . 1 . 2]" 1
1418 1 87 LEU MD2 1 121 ARG HD3 . . 4.300 3.414 1.994 4.293 . 0 0 "[ . 1 . 2]" 1
1419 1 87 LEU HG 1 88 ASN H . . 5.080 4.868 4.779 4.917 . 0 0 "[ . 1 . 2]" 1
1420 1 88 ASN H 1 88 ASN HA . . 2.830 2.296 2.280 2.310 . 0 0 "[ . 1 . 2]" 1
1421 1 88 ASN H 1 88 ASN HB2 . . 4.060 3.139 2.829 3.601 . 0 0 "[ . 1 . 2]" 1
1422 1 88 ASN H 1 88 ASN QB . . 3.530 2.988 2.738 3.320 . 0 0 "[ . 1 . 2]" 1
1423 1 88 ASN H 1 88 ASN HB3 . . 4.060 3.787 3.452 4.035 . 0 0 "[ . 1 . 2]" 1
1424 1 88 ASN H 1 89 PHE H . . 3.290 2.895 2.768 2.984 . 0 0 "[ . 1 . 2]" 1
1425 1 88 ASN HA 1 89 PHE H . . 3.230 2.883 2.818 2.975 . 0 0 "[ . 1 . 2]" 1
1426 1 88 ASN QB 1 89 PHE H . . 4.240 3.821 3.765 3.862 . 0 0 "[ . 1 . 2]" 1
1427 1 88 ASN HB2 1 89 PHE H . . 4.920 4.354 4.025 4.591 . 0 0 "[ . 1 . 2]" 1
1428 1 88 ASN HB3 1 89 PHE H . . 4.920 4.277 4.027 4.534 . 0 0 "[ . 1 . 2]" 1
1429 1 89 PHE H 1 89 PHE HB2 . . 3.600 2.645 2.550 2.728 . 0 0 "[ . 1 . 2]" 1
1430 1 89 PHE H 1 89 PHE QB . . 3.130 2.430 2.372 2.480 . 0 0 "[ . 1 . 2]" 1
1431 1 89 PHE H 1 89 PHE HB3 . . 3.600 2.835 2.755 2.879 . 0 0 "[ . 1 . 2]" 1
1432 1 89 PHE H 1 89 PHE QD . . 4.440 4.280 4.193 4.327 . 0 0 "[ . 1 . 2]" 1
1433 1 89 PHE H 1 90 SER H . . 4.500 4.484 4.346 4.532 0.032 4 0 "[ . 1 . 2]" 1
1434 1 89 PHE HA 1 89 PHE QD . . 4.250 2.909 2.321 3.070 . 0 0 "[ . 1 . 2]" 1
1435 1 89 PHE HA 1 90 SER H . . 3.200 2.257 2.140 2.530 . 0 0 "[ . 1 . 2]" 1
1436 1 89 PHE QB 1 90 SER H . . 4.010 3.429 2.890 3.754 . 0 0 "[ . 1 . 2]" 1
1437 1 89 PHE HB2 1 90 SER H . . 4.580 4.193 3.819 4.441 . 0 0 "[ . 1 . 2]" 1
1438 1 89 PHE HB3 1 90 SER H . . 4.580 3.645 2.992 4.049 . 0 0 "[ . 1 . 2]" 1
1439 1 89 PHE QD 1 90 SER H . . 3.690 2.950 2.301 3.593 . 0 0 "[ . 1 . 2]" 1
1440 1 89 PHE QD 1 91 VAL HB . . 4.500 4.357 4.093 4.501 0.001 7 0 "[ . 1 . 2]" 1
1441 1 89 PHE QD 1 91 VAL MG2 . . 4.190 2.316 2.038 2.706 . 0 0 "[ . 1 . 2]" 1
1442 1 89 PHE QD 1 114 LEU MD1 . . 5.470 4.621 4.112 5.082 . 0 0 "[ . 1 . 2]" 1
1443 1 89 PHE QE 1 91 VAL MG1 . . 5.310 4.164 3.861 4.541 . 0 0 "[ . 1 . 2]" 1
1444 1 89 PHE QE 1 91 VAL MG2 . . 3.600 1.960 1.802 2.173 . 0 0 "[ . 1 . 2]" 1
1445 1 89 PHE QE 1 110 VAL HA . . 4.860 3.964 3.400 4.565 . 0 0 "[ . 1 . 2]" 1
1446 1 89 PHE QE 1 110 VAL MG1 . . 3.790 2.545 2.050 3.148 . 0 0 "[ . 1 . 2]" 1
1447 1 89 PHE QE 1 110 VAL MG2 . . 4.550 3.458 2.569 4.238 . 0 0 "[ . 1 . 2]" 1
1448 1 89 PHE QE 1 113 PRO QB . . 3.850 2.146 1.977 2.511 . 0 0 "[ . 1 . 2]" 1
1449 1 89 PHE QE 1 113 PRO HG2 . . 4.970 3.232 2.353 3.685 . 0 0 "[ . 1 . 2]" 1
1450 1 89 PHE QE 1 113 PRO QG . . 4.320 2.976 2.095 3.369 . 0 0 "[ . 1 . 2]" 1
1451 1 89 PHE QE 1 113 PRO HG3 . . 4.970 3.502 2.349 3.960 . 0 0 "[ . 1 . 2]" 1
1452 1 89 PHE QE 1 114 LEU H . . 4.850 4.594 3.969 4.850 0.000 3 0 "[ . 1 . 2]" 1
1453 1 89 PHE QE 1 114 LEU HA . . 4.750 4.558 3.570 4.751 0.001 19 0 "[ . 1 . 2]" 1
1454 1 89 PHE QE 1 114 LEU MD1 . . 5.500 4.918 4.440 5.421 . 0 0 "[ . 1 . 2]" 1
1455 1 89 PHE HZ 1 91 VAL MG2 . . 5.060 3.805 3.442 4.022 . 0 0 "[ . 1 . 2]" 1
1456 1 89 PHE HZ 1 110 VAL HA . . 4.070 3.251 2.326 3.996 . 0 0 "[ . 1 . 2]" 1
1457 1 89 PHE HZ 1 110 VAL MG1 . . 4.120 3.107 2.439 3.807 . 0 0 "[ . 1 . 2]" 1
1458 1 89 PHE HZ 1 110 VAL MG2 . . 5.450 3.949 2.881 4.996 . 0 0 "[ . 1 . 2]" 1
1459 1 89 PHE HZ 1 113 PRO HB2 . . 5.160 3.493 2.747 4.213 . 0 0 "[ . 1 . 2]" 1
1460 1 89 PHE HZ 1 113 PRO QB . . 4.420 3.342 2.663 3.918 . 0 0 "[ . 1 . 2]" 1
1461 1 89 PHE HZ 1 113 PRO HB3 . . 5.160 4.286 3.577 4.738 . 0 0 "[ . 1 . 2]" 1
1462 1 89 PHE HZ 1 113 PRO HG2 . . 4.730 2.961 2.725 3.534 . 0 0 "[ . 1 . 2]" 1
1463 1 89 PHE HZ 1 113 PRO QG . . 3.960 2.619 2.395 3.108 . 0 0 "[ . 1 . 2]" 1
1464 1 89 PHE HZ 1 113 PRO HG3 . . 4.730 2.945 2.622 3.447 . 0 0 "[ . 1 . 2]" 1
1465 1 89 PHE HZ 1 114 LEU H . . 5.370 5.035 4.526 5.364 . 0 0 "[ . 1 . 2]" 1
1466 1 90 SER H 1 90 SER QB . . 3.460 2.873 2.592 3.271 . 0 0 "[ . 1 . 2]" 1
1467 1 90 SER H 1 91 VAL H . . 4.580 4.356 4.087 4.478 . 0 0 "[ . 1 . 2]" 1
1468 1 90 SER H 1 91 VAL MG2 . . 4.920 3.746 3.458 4.066 . 0 0 "[ . 1 . 2]" 1
1469 1 90 SER HA 1 91 VAL H . . 3.040 2.230 2.147 2.405 . 0 0 "[ . 1 . 2]" 1
1470 1 90 SER HA 1 91 VAL HB . . 4.780 4.402 4.201 4.578 . 0 0 "[ . 1 . 2]" 1
1471 1 90 SER QB 1 91 VAL H . . 3.600 2.910 2.396 3.435 . 0 0 "[ . 1 . 2]" 1
1472 1 90 SER QB 1 91 VAL HB . . 5.500 5.319 4.925 5.517 0.017 19 0 "[ . 1 . 2]" 1
1473 1 90 SER QB 1 91 VAL MG2 . . 4.680 4.466 4.183 4.678 . 0 0 "[ . 1 . 2]" 1
1474 1 91 VAL H 1 91 VAL HB . . 3.440 2.781 2.592 2.917 . 0 0 "[ . 1 . 2]" 1
1475 1 91 VAL H 1 91 VAL MG1 . . 4.230 3.843 3.732 3.926 . 0 0 "[ . 1 . 2]" 1
1476 1 91 VAL H 1 91 VAL MG2 . . 3.510 3.158 2.780 3.449 . 0 0 "[ . 1 . 2]" 1
1477 1 91 VAL H 1 92 PRO HD3 . . 4.830 4.583 4.375 4.824 . 0 0 "[ . 1 . 2]" 1
1478 1 91 VAL HA 1 91 VAL MG1 . . 3.450 2.493 2.418 2.575 . 0 0 "[ . 1 . 2]" 1
1479 1 91 VAL HA 1 91 VAL MG2 . . 3.470 2.264 2.123 2.426 . 0 0 "[ . 1 . 2]" 1
1480 1 91 VAL HA 1 92 PRO HD2 . . 3.480 2.111 2.029 2.181 . 0 0 "[ . 1 . 2]" 1
1481 1 91 VAL HA 1 92 PRO HD3 . . 3.280 2.262 2.252 2.287 . 0 0 "[ . 1 . 2]" 1
1482 1 91 VAL HA 1 92 PRO QG . . 4.010 3.839 3.799 3.874 . 0 0 "[ . 1 . 2]" 1
1483 1 91 VAL HA 1 95 VAL MG1 . . 4.760 4.693 4.567 4.760 0.000 5 0 "[ . 1 . 2]" 1
1484 1 91 VAL HB 1 92 PRO HD3 . . 5.260 4.975 4.880 5.043 . 0 0 "[ . 1 . 2]" 1
1485 1 91 VAL HB 1 96 MET ME . . 4.170 3.542 2.798 4.060 . 0 0 "[ . 1 . 2]" 1
1486 1 91 VAL HB 1 96 MET HG3 . . 4.380 4.082 3.456 4.375 . 0 0 "[ . 1 . 2]" 1
1487 1 91 VAL MG1 1 92 PRO HD2 . . 3.720 1.947 1.816 2.263 . 0 0 "[ . 1 . 2]" 1
1488 1 91 VAL MG1 1 92 PRO HD3 . . 3.760 3.302 3.141 3.532 . 0 0 "[ . 1 . 2]" 1
1489 1 91 VAL MG1 1 92 PRO QG . . 4.620 2.995 2.840 3.251 . 0 0 "[ . 1 . 2]" 1
1490 1 91 VAL MG1 1 95 VAL H . . 4.060 3.706 3.401 3.907 . 0 0 "[ . 1 . 2]" 1
1491 1 91 VAL MG1 1 95 VAL HB . . 3.480 2.112 1.847 2.361 . 0 0 "[ . 1 . 2]" 1
1492 1 91 VAL MG1 1 95 VAL MG1 . . 3.080 2.208 1.906 2.500 . 0 0 "[ . 1 . 2]" 1
1493 1 91 VAL MG1 1 96 MET H . . 3.630 3.219 2.769 3.550 . 0 0 "[ . 1 . 2]" 1
1494 1 91 VAL MG1 1 96 MET HA . . 4.020 3.767 3.232 4.023 0.003 2 0 "[ . 1 . 2]" 1
1495 1 91 VAL MG1 1 96 MET HG2 . . 3.450 2.572 1.998 3.129 . 0 0 "[ . 1 . 2]" 1
1496 1 91 VAL MG1 1 96 MET HG3 . . 3.610 2.570 2.004 3.109 . 0 0 "[ . 1 . 2]" 1
1497 1 91 VAL MG1 1 99 ILE MD . . 3.500 3.130 2.696 3.441 . 0 0 "[ . 1 . 2]" 1
1498 1 91 VAL MG2 1 92 PRO HD2 . . 4.120 3.215 2.982 3.474 . 0 0 "[ . 1 . 2]" 1
1499 1 91 VAL MG2 1 92 PRO HD3 . . 4.280 4.001 3.857 4.179 . 0 0 "[ . 1 . 2]" 1
1500 1 92 PRO HA 1 93 ASP H . . 3.410 2.336 2.168 2.587 . 0 0 "[ . 1 . 2]" 1
1501 1 92 PRO HB2 1 93 ASP H . . 4.320 2.819 2.177 3.410 . 0 0 "[ . 1 . 2]" 1
1502 1 92 PRO HB2 1 94 ASP H . . 4.320 2.539 2.163 2.913 . 0 0 "[ . 1 . 2]" 1
1503 1 92 PRO HB2 1 95 VAL H . . 3.450 3.111 2.882 3.360 . 0 0 "[ . 1 . 2]" 1
1504 1 92 PRO HB3 1 93 ASP H . . 4.260 3.573 3.250 3.918 . 0 0 "[ . 1 . 2]" 1
1505 1 92 PRO HB3 1 94 ASP H . . 5.110 4.197 3.851 4.607 . 0 0 "[ . 1 . 2]" 1
1506 1 92 PRO HB3 1 95 VAL H . . 4.940 4.645 4.467 4.830 . 0 0 "[ . 1 . 2]" 1
1507 1 92 PRO HD2 1 95 VAL HB . . 3.970 2.889 2.647 3.045 . 0 0 "[ . 1 . 2]" 1
1508 1 92 PRO HD2 1 95 VAL MG1 . . 4.510 3.606 3.440 3.867 . 0 0 "[ . 1 . 2]" 1
1509 1 92 PRO HD2 1 95 VAL MG2 . . 3.420 2.536 2.037 2.976 . 0 0 "[ . 1 . 2]" 1
1510 1 92 PRO HD3 1 95 VAL HB . . 4.700 4.499 4.215 4.704 0.004 17 0 "[ . 1 . 2]" 1
1511 1 92 PRO HD3 1 95 VAL MG1 . . 5.350 5.085 4.865 5.356 0.006 18 0 "[ . 1 . 2]" 1
1512 1 92 PRO HD3 1 95 VAL MG2 . . 4.070 3.654 3.384 3.983 . 0 0 "[ . 1 . 2]" 1
1513 1 92 PRO QG 1 95 VAL H . . 4.520 2.443 2.213 2.790 . 0 0 "[ . 1 . 2]" 1
1514 1 92 PRO QG 1 95 VAL MG2 . . 3.230 1.888 1.764 2.031 . 0 0 "[ . 1 . 2]" 1
1515 1 93 ASP H 1 93 ASP QB . . 3.500 2.386 2.156 2.711 . 0 0 "[ . 1 . 2]" 1
1516 1 93 ASP HA 1 95 VAL H . . 4.960 4.315 3.634 4.767 . 0 0 "[ . 1 . 2]" 1
1517 1 93 ASP HA 1 96 MET H . . 4.120 3.308 3.041 3.496 . 0 0 "[ . 1 . 2]" 1
1518 1 93 ASP HA 1 96 MET HB2 . . 4.930 2.601 2.237 2.884 . 0 0 "[ . 1 . 2]" 1
1519 1 93 ASP HA 1 96 MET QB . . 4.100 2.576 2.221 2.850 . 0 0 "[ . 1 . 2]" 1
1520 1 93 ASP HA 1 96 MET HB3 . . 4.930 4.165 3.763 4.447 . 0 0 "[ . 1 . 2]" 1
1521 1 93 ASP HA 1 96 MET ME . . 3.100 2.594 2.097 3.038 . 0 0 "[ . 1 . 2]" 1
1522 1 93 ASP HA 1 96 MET HG2 . . 4.530 4.397 4.178 4.532 0.002 2 0 "[ . 1 . 2]" 1
1523 1 93 ASP HA 1 96 MET HG3 . . 3.540 2.748 2.474 2.893 . 0 0 "[ . 1 . 2]" 1
1524 1 93 ASP HA 1 97 ARG H . . 4.500 4.073 3.725 4.488 . 0 0 "[ . 1 . 2]" 1
1525 1 93 ASP QB 1 94 ASP H . . 3.530 2.938 2.325 3.484 . 0 0 "[ . 1 . 2]" 1
1526 1 94 ASP H 1 94 ASP HB2 . . 4.030 2.773 2.183 3.585 . 0 0 "[ . 1 . 2]" 1
1527 1 94 ASP H 1 94 ASP QB . . 3.540 2.500 2.162 2.737 . 0 0 "[ . 1 . 2]" 1
1528 1 94 ASP H 1 94 ASP HB3 . . 4.030 3.253 2.361 3.629 . 0 0 "[ . 1 . 2]" 1
1529 1 94 ASP H 1 95 VAL H . . 3.590 2.777 2.356 2.994 . 0 0 "[ . 1 . 2]" 1
1530 1 94 ASP H 1 95 VAL MG2 . . 4.740 4.461 4.225 4.683 . 0 0 "[ . 1 . 2]" 1
1531 1 94 ASP HA 1 97 ARG H . . 3.940 3.745 3.574 3.919 . 0 0 "[ . 1 . 2]" 1
1532 1 94 ASP HA 1 97 ARG QB . . 3.670 3.092 2.773 3.456 . 0 0 "[ . 1 . 2]" 1
1533 1 94 ASP QB 1 95 VAL H . . 3.860 2.656 2.111 3.619 . 0 0 "[ . 1 . 2]" 1
1534 1 94 ASP HB2 1 95 VAL H . . 4.680 2.941 2.130 3.962 . 0 0 "[ . 1 . 2]" 1
1535 1 94 ASP HB3 1 95 VAL H . . 4.680 3.540 2.270 4.269 . 0 0 "[ . 1 . 2]" 1
1536 1 95 VAL H 1 95 VAL HB . . 3.150 2.420 2.324 2.578 . 0 0 "[ . 1 . 2]" 1
1537 1 95 VAL H 1 95 VAL MG1 . . 3.890 3.735 3.694 3.764 . 0 0 "[ . 1 . 2]" 1
1538 1 95 VAL H 1 95 VAL MG2 . . 3.110 2.355 1.993 2.704 . 0 0 "[ . 1 . 2]" 1
1539 1 95 VAL H 1 96 MET H . . 3.260 2.606 2.322 2.783 . 0 0 "[ . 1 . 2]" 1
1540 1 95 VAL H 1 96 MET HG3 . . 4.840 4.492 4.161 4.752 . 0 0 "[ . 1 . 2]" 1
1541 1 95 VAL H 1 97 ARG H . . 4.500 4.307 3.934 4.459 . 0 0 "[ . 1 . 2]" 1
1542 1 95 VAL H 1 98 LYS QD . . 4.800 4.555 4.241 4.773 . 0 0 "[ . 1 . 2]" 1
1543 1 95 VAL HA 1 95 VAL MG1 . . 3.320 2.473 2.386 2.545 . 0 0 "[ . 1 . 2]" 1
1544 1 95 VAL HA 1 95 VAL MG2 . . 3.290 2.326 2.199 2.441 . 0 0 "[ . 1 . 2]" 1
1545 1 95 VAL HA 1 97 ARG H . . 5.070 4.584 4.312 4.765 . 0 0 "[ . 1 . 2]" 1
1546 1 95 VAL HA 1 98 LYS H . . 3.920 3.721 3.416 3.846 . 0 0 "[ . 1 . 2]" 1
1547 1 95 VAL HA 1 98 LYS HB2 . . 3.790 3.320 2.944 3.576 . 0 0 "[ . 1 . 2]" 1
1548 1 95 VAL HA 1 98 LYS HB3 . . 5.100 4.889 4.567 5.053 . 0 0 "[ . 1 . 2]" 1
1549 1 95 VAL HA 1 98 LYS HD2 . . 4.220 2.388 2.009 3.050 . 0 0 "[ . 1 . 2]" 1
1550 1 95 VAL HA 1 98 LYS QD . . 3.560 2.262 1.994 2.466 . 0 0 "[ . 1 . 2]" 1
1551 1 95 VAL HA 1 98 LYS HD3 . . 4.220 3.501 2.184 4.147 . 0 0 "[ . 1 . 2]" 1
1552 1 95 VAL HA 1 98 LYS QE . . 4.390 3.869 3.308 4.380 . 0 0 "[ . 1 . 2]" 1
1553 1 95 VAL HA 1 99 ILE H . . 4.860 4.494 4.227 4.738 . 0 0 "[ . 1 . 2]" 1
1554 1 95 VAL HA 1 106 VAL MG1 . . 4.030 3.368 2.896 3.777 . 0 0 "[ . 1 . 2]" 1
1555 1 95 VAL HB 1 96 MET H . . 3.280 2.726 2.424 3.059 . 0 0 "[ . 1 . 2]" 1
1556 1 95 VAL MG1 1 96 MET H . . 4.050 3.335 2.974 3.570 . 0 0 "[ . 1 . 2]" 1
1557 1 95 VAL MG1 1 96 MET HA . . 4.570 3.321 3.105 3.636 . 0 0 "[ . 1 . 2]" 1
1558 1 95 VAL MG1 1 99 ILE H . . 4.570 3.872 3.556 4.135 . 0 0 "[ . 1 . 2]" 1
1559 1 95 VAL MG1 1 99 ILE MD . . 3.350 2.170 1.996 2.502 . 0 0 "[ . 1 . 2]" 1
1560 1 95 VAL MG1 1 99 ILE QG . . 3.790 2.742 2.425 3.010 . 0 0 "[ . 1 . 2]" 1
1561 1 95 VAL MG1 1 106 VAL MG1 . . 3.200 2.421 1.867 2.910 . 0 0 "[ . 1 . 2]" 1
1562 1 95 VAL MG1 1 110 VAL MG2 . . 3.190 2.731 2.285 3.192 0.002 19 0 "[ . 1 . 2]" 1
1563 1 95 VAL MG2 1 96 MET H . . 4.180 3.965 3.820 4.134 . 0 0 "[ . 1 . 2]" 1
1564 1 96 MET H 1 96 MET HB2 . . 3.660 2.435 2.332 2.592 . 0 0 "[ . 1 . 2]" 1
1565 1 96 MET H 1 96 MET QB . . 3.130 2.396 2.303 2.535 . 0 0 "[ . 1 . 2]" 1
1566 1 96 MET H 1 96 MET HB3 . . 3.660 3.582 3.561 3.599 . 0 0 "[ . 1 . 2]" 1
1567 1 96 MET H 1 96 MET HG2 . . 3.370 3.138 2.792 3.355 . 0 0 "[ . 1 . 2]" 1
1568 1 96 MET H 1 96 MET HG3 . . 3.590 2.504 2.295 2.675 . 0 0 "[ . 1 . 2]" 1
1569 1 96 MET H 1 97 ARG H . . 3.490 2.738 2.580 2.845 . 0 0 "[ . 1 . 2]" 1
1570 1 96 MET H 1 98 LYS H . . 4.670 4.309 3.855 4.672 0.002 18 0 "[ . 1 . 2]" 1
1571 1 96 MET HA 1 96 MET HG2 . . 3.810 2.335 2.238 2.445 . 0 0 "[ . 1 . 2]" 1
1572 1 96 MET HA 1 96 MET HG3 . . 4.230 3.333 3.233 3.458 . 0 0 "[ . 1 . 2]" 1
1573 1 96 MET HA 1 99 ILE H . . 4.170 3.456 3.145 3.793 . 0 0 "[ . 1 . 2]" 1
1574 1 96 MET HA 1 99 ILE HB . . 3.770 2.799 2.390 3.037 . 0 0 "[ . 1 . 2]" 1
1575 1 96 MET HA 1 99 ILE MD . . 3.670 2.223 1.966 2.530 . 0 0 "[ . 1 . 2]" 1
1576 1 96 MET HA 1 99 ILE QG . . 4.970 3.212 2.732 3.564 . 0 0 "[ . 1 . 2]" 1
1577 1 96 MET HA 1 99 ILE MG . . 4.320 4.098 3.797 4.279 . 0 0 "[ . 1 . 2]" 1
1578 1 96 MET HA 1 100 ALA H . . 4.770 4.073 3.871 4.255 . 0 0 "[ . 1 . 2]" 1
1579 1 96 MET QB 1 96 MET ME . . 3.940 3.048 2.759 3.403 . 0 0 "[ . 1 . 2]" 1
1580 1 96 MET QB 1 97 ARG H . . 3.350 2.436 2.301 2.577 . 0 0 "[ . 1 . 2]" 1
1581 1 96 MET QB 1 97 ARG HA . . 4.940 3.816 3.776 3.861 . 0 0 "[ . 1 . 2]" 1
1582 1 96 MET QB 1 100 ALA H . . 5.340 4.518 4.229 4.691 . 0 0 "[ . 1 . 2]" 1
1583 1 96 MET HB2 1 97 ARG H . . 3.830 2.492 2.335 2.646 . 0 0 "[ . 1 . 2]" 1
1584 1 96 MET HB3 1 97 ARG H . . 3.830 3.447 3.269 3.593 . 0 0 "[ . 1 . 2]" 1
1585 1 96 MET ME 1 96 MET HG2 . . 3.250 3.102 2.836 3.251 0.001 16 0 "[ . 1 . 2]" 1
1586 1 96 MET HG2 1 99 ILE MD . . 4.280 3.087 2.755 3.363 . 0 0 "[ . 1 . 2]" 1
1587 1 97 ARG H 1 97 ARG QB . . 2.940 2.360 2.171 2.546 . 0 0 "[ . 1 . 2]" 1
1588 1 97 ARG H 1 97 ARG HG2 . . 4.130 3.200 1.999 3.736 . 0 0 "[ . 1 . 2]" 1
1589 1 97 ARG H 1 97 ARG HG3 . . 4.130 2.759 2.228 3.919 . 0 0 "[ . 1 . 2]" 1
1590 1 97 ARG H 1 98 LYS H . . 3.470 2.908 2.716 3.044 . 0 0 "[ . 1 . 2]" 1
1591 1 97 ARG H 1 98 LYS HG3 . . 5.500 4.773 4.044 5.102 . 0 0 "[ . 1 . 2]" 1
1592 1 97 ARG H 1 99 ILE H . . 4.950 4.504 4.304 4.717 . 0 0 "[ . 1 . 2]" 1
1593 1 97 ARG HA 1 97 ARG HD2 . . 4.820 4.118 2.171 4.811 . 0 0 "[ . 1 . 2]" 1
1594 1 97 ARG HA 1 97 ARG HD3 . . 4.820 4.122 2.446 4.669 . 0 0 "[ . 1 . 2]" 1
1595 1 97 ARG HA 1 97 ARG HG2 . . 3.910 2.515 2.180 3.847 . 0 0 "[ . 1 . 2]" 1
1596 1 97 ARG HA 1 97 ARG HG3 . . 3.910 3.203 2.678 3.804 . 0 0 "[ . 1 . 2]" 1
1597 1 97 ARG HA 1 100 ALA H . . 4.350 3.969 3.734 4.345 . 0 0 "[ . 1 . 2]" 1
1598 1 97 ARG HA 1 100 ALA MB . . 3.730 3.190 2.921 3.458 . 0 0 "[ . 1 . 2]" 1
1599 1 97 ARG HA 1 101 GLN H . . 4.780 4.601 4.446 4.783 0.003 6 0 "[ . 1 . 2]" 1
1600 1 97 ARG QB 1 97 ARG HD2 . . 3.550 2.521 2.062 3.289 . 0 0 "[ . 1 . 2]" 1
1601 1 97 ARG QB 1 97 ARG QD . . 3.100 2.166 2.039 2.482 . 0 0 "[ . 1 . 2]" 1
1602 1 97 ARG QB 1 97 ARG HD3 . . 3.550 2.710 2.080 3.443 . 0 0 "[ . 1 . 2]" 1
1603 1 97 ARG QB 1 98 LYS H . . 3.390 2.563 2.221 3.264 . 0 0 "[ . 1 . 2]" 1
1604 1 97 ARG QB 1 98 LYS HA . . 4.570 3.877 3.747 4.538 . 0 0 "[ . 1 . 2]" 1
1605 1 97 ARG QG 1 98 LYS H . . 4.970 4.069 1.907 4.361 . 0 0 "[ . 1 . 2]" 1
1606 1 98 LYS H 1 98 LYS HB2 . . 3.340 2.469 2.360 2.657 . 0 0 "[ . 1 . 2]" 1
1607 1 98 LYS H 1 98 LYS HB3 . . 4.160 3.588 3.573 3.621 . 0 0 "[ . 1 . 2]" 1
1608 1 98 LYS H 1 98 LYS HD2 . . 4.790 3.508 3.294 4.042 . 0 0 "[ . 1 . 2]" 1
1609 1 98 LYS H 1 98 LYS QD . . 4.130 3.313 3.201 3.523 . 0 0 "[ . 1 . 2]" 1
1610 1 98 LYS H 1 98 LYS HD3 . . 4.790 4.304 3.411 4.633 . 0 0 "[ . 1 . 2]" 1
1611 1 98 LYS H 1 98 LYS QE . . 4.980 4.404 3.629 4.997 0.017 16 0 "[ . 1 . 2]" 1
1612 1 98 LYS H 1 98 LYS HG2 . . 3.990 3.707 3.331 3.900 . 0 0 "[ . 1 . 2]" 1
1613 1 98 LYS H 1 98 LYS HG3 . . 3.700 2.286 1.959 2.514 . 0 0 "[ . 1 . 2]" 1
1614 1 98 LYS H 1 99 ILE H . . 3.530 2.779 2.444 3.011 . 0 0 "[ . 1 . 2]" 1
1615 1 98 LYS H 1 99 ILE HB . . 5.460 4.867 4.538 5.038 . 0 0 "[ . 1 . 2]" 1
1616 1 98 LYS H 1 100 ALA H . . 4.890 4.468 4.136 4.740 . 0 0 "[ . 1 . 2]" 1
1617 1 98 LYS H 1 103 ALA MB . . 5.500 4.884 4.401 5.265 . 0 0 "[ . 1 . 2]" 1
1618 1 98 LYS H 1 106 VAL MG1 . . 4.610 4.046 3.777 4.270 . 0 0 "[ . 1 . 2]" 1
1619 1 98 LYS H 1 106 VAL MG2 . . 5.270 5.086 4.750 5.275 0.005 2 0 "[ . 1 . 2]" 1
1620 1 98 LYS HA 1 98 LYS HD2 . . 4.970 4.625 4.472 5.015 0.045 2 0 "[ . 1 . 2]" 1
1621 1 98 LYS HA 1 98 LYS QD . . 4.360 4.096 4.048 4.257 . 0 0 "[ . 1 . 2]" 1
1622 1 98 LYS HA 1 98 LYS HD3 . . 4.970 4.583 4.487 4.662 . 0 0 "[ . 1 . 2]" 1
1623 1 98 LYS HA 1 98 LYS HG2 . . 3.890 2.799 2.673 2.906 . 0 0 "[ . 1 . 2]" 1
1624 1 98 LYS HA 1 98 LYS HG3 . . 3.630 2.754 2.628 3.113 . 0 0 "[ . 1 . 2]" 1
1625 1 98 LYS HA 1 101 GLN H . . 3.790 3.401 3.267 3.547 . 0 0 "[ . 1 . 2]" 1
1626 1 98 LYS HA 1 101 GLN HB2 . . 3.960 2.313 2.112 2.459 . 0 0 "[ . 1 . 2]" 1
1627 1 98 LYS HA 1 101 GLN QB . . 3.480 2.294 2.096 2.436 . 0 0 "[ . 1 . 2]" 1
1628 1 98 LYS HA 1 101 GLN HB3 . . 3.960 3.810 3.520 3.961 0.001 3 0 "[ . 1 . 2]" 1
1629 1 98 LYS HA 1 101 GLN HG2 . . 4.680 4.293 4.018 4.597 . 0 0 "[ . 1 . 2]" 1
1630 1 98 LYS HA 1 101 GLN HG3 . . 3.770 3.431 2.934 3.757 . 0 0 "[ . 1 . 2]" 1
1631 1 98 LYS HA 1 103 ALA MB . . 3.710 3.043 2.534 3.517 . 0 0 "[ . 1 . 2]" 1
1632 1 98 LYS HB2 1 99 ILE H . . 3.740 2.389 2.180 2.567 . 0 0 "[ . 1 . 2]" 1
1633 1 98 LYS HB2 1 103 ALA MB . . 3.860 3.532 3.072 3.857 . 0 0 "[ . 1 . 2]" 1
1634 1 98 LYS HB2 1 106 VAL MG1 . . 3.480 2.097 1.908 2.421 . 0 0 "[ . 1 . 2]" 1
1635 1 98 LYS HB2 1 106 VAL MG2 . . 3.550 3.015 2.413 3.322 . 0 0 "[ . 1 . 2]" 1
1636 1 98 LYS HB3 1 99 ILE H . . 4.780 3.378 3.148 3.803 . 0 0 "[ . 1 . 2]" 1
1637 1 98 LYS HB3 1 103 ALA H . . 4.490 4.373 4.024 4.493 0.003 14 0 "[ . 1 . 2]" 1
1638 1 98 LYS HB3 1 103 ALA MB . . 3.290 2.259 1.864 2.545 . 0 0 "[ . 1 . 2]" 1
1639 1 98 LYS HB3 1 106 VAL MG1 . . 3.650 2.594 2.007 3.403 . 0 0 "[ . 1 . 2]" 1
1640 1 98 LYS HB3 1 106 VAL MG2 . . 3.170 2.153 1.978 2.764 . 0 0 "[ . 1 . 2]" 1
1641 1 98 LYS QD 1 106 VAL MG1 . . 3.640 2.387 1.965 2.989 . 0 0 "[ . 1 . 2]" 1
1642 1 98 LYS HD2 1 106 VAL MG1 . . 4.210 3.155 2.420 4.215 0.005 2 0 "[ . 1 . 2]" 1
1643 1 98 LYS HD3 1 106 VAL MG1 . . 4.210 2.544 1.980 3.423 . 0 0 "[ . 1 . 2]" 1
1644 1 98 LYS QE 1 98 LYS HG2 . . 3.460 2.517 2.199 3.057 . 0 0 "[ . 1 . 2]" 1
1645 1 98 LYS QE 1 98 LYS HG3 . . 3.410 2.641 2.239 3.358 . 0 0 "[ . 1 . 2]" 1
1646 1 98 LYS HG3 1 99 ILE H . . 4.500 4.324 3.933 4.489 . 0 0 "[ . 1 . 2]" 1
1647 1 99 ILE H 1 99 ILE HB . . 3.310 2.590 2.422 2.684 . 0 0 "[ . 1 . 2]" 1
1648 1 99 ILE H 1 99 ILE MD . . 3.820 3.402 3.208 3.558 . 0 0 "[ . 1 . 2]" 1
1649 1 99 ILE H 1 99 ILE HG12 . . 3.920 3.401 3.163 3.683 . 0 0 "[ . 1 . 2]" 1
1650 1 99 ILE H 1 99 ILE QG . . 3.310 1.998 1.890 2.304 . 0 0 "[ . 1 . 2]" 1
1651 1 99 ILE H 1 99 ILE HG13 . . 3.920 2.013 1.900 2.328 . 0 0 "[ . 1 . 2]" 1
1652 1 99 ILE H 1 99 ILE MG . . 4.000 3.767 3.743 3.778 . 0 0 "[ . 1 . 2]" 1
1653 1 99 ILE H 1 100 ALA H . . 3.610 3.012 2.864 3.260 . 0 0 "[ . 1 . 2]" 1
1654 1 99 ILE H 1 101 GLN H . . 5.210 3.934 3.824 4.053 . 0 0 "[ . 1 . 2]" 1
1655 1 99 ILE H 1 106 VAL MG1 . . 3.960 2.729 2.393 3.166 . 0 0 "[ . 1 . 2]" 1
1656 1 99 ILE HA 1 99 ILE MD . . 4.170 3.853 3.805 3.888 . 0 0 "[ . 1 . 2]" 1
1657 1 99 ILE HA 1 99 ILE HG12 . . 3.940 2.611 2.504 2.766 . 0 0 "[ . 1 . 2]" 1
1658 1 99 ILE HA 1 99 ILE HG13 . . 3.940 2.854 2.704 3.036 . 0 0 "[ . 1 . 2]" 1
1659 1 99 ILE HA 1 101 GLN H . . 4.890 3.980 3.771 4.152 . 0 0 "[ . 1 . 2]" 1
1660 1 99 ILE HA 1 102 CYS H . . 4.630 4.201 3.853 4.524 . 0 0 "[ . 1 . 2]" 1
1661 1 99 ILE HA 1 103 ALA H . . 4.250 3.249 2.976 3.518 . 0 0 "[ . 1 . 2]" 1
1662 1 99 ILE HA 1 103 ALA MB . . 5.150 3.521 2.838 4.041 . 0 0 "[ . 1 . 2]" 1
1663 1 99 ILE HA 1 106 VAL HB . . 4.980 3.348 3.094 3.551 . 0 0 "[ . 1 . 2]" 1
1664 1 99 ILE HA 1 106 VAL MG1 . . 4.410 3.164 2.523 4.099 . 0 0 "[ . 1 . 2]" 1
1665 1 99 ILE HA 1 107 VAL HB . . 4.990 3.190 2.763 3.674 . 0 0 "[ . 1 . 2]" 1
1666 1 99 ILE HB 1 99 ILE MD . . 3.530 2.316 2.138 2.431 . 0 0 "[ . 1 . 2]" 1
1667 1 99 ILE HB 1 100 ALA H . . 3.600 2.290 2.044 2.581 . 0 0 "[ . 1 . 2]" 1
1668 1 99 ILE MD 1 99 ILE MG . . 3.080 2.157 1.943 2.406 . 0 0 "[ . 1 . 2]" 1
1669 1 99 ILE MD 1 100 ALA H . . 4.630 4.233 4.048 4.532 . 0 0 "[ . 1 . 2]" 1
1670 1 99 ILE MD 1 106 VAL MG1 . . 3.690 3.151 2.584 3.417 . 0 0 "[ . 1 . 2]" 1
1671 1 99 ILE MD 1 107 VAL HA . . 3.680 2.757 2.310 3.168 . 0 0 "[ . 1 . 2]" 1
1672 1 99 ILE MD 1 107 VAL MG2 . . 3.610 3.219 2.536 3.610 0.000 1 0 "[ . 1 . 2]" 1
1673 1 99 ILE MD 1 110 VAL HB . . 4.100 3.683 2.918 3.976 . 0 0 "[ . 1 . 2]" 1
1674 1 99 ILE MD 1 110 VAL MG1 . . 4.310 3.667 3.059 4.066 . 0 0 "[ . 1 . 2]" 1
1675 1 99 ILE MD 1 110 VAL MG2 . . 3.270 2.508 1.999 2.971 . 0 0 "[ . 1 . 2]" 1
1676 1 99 ILE QG 1 100 ALA H . . 5.340 3.975 3.868 4.185 . 0 0 "[ . 1 . 2]" 1
1677 1 99 ILE QG 1 107 VAL H . . 4.690 3.177 2.787 3.428 . 0 0 "[ . 1 . 2]" 1
1678 1 99 ILE QG 1 107 VAL HA . . 3.700 2.267 1.987 2.681 . 0 0 "[ . 1 . 2]" 1
1679 1 99 ILE QG 1 107 VAL HB . . 3.870 2.600 2.131 2.891 . 0 0 "[ . 1 . 2]" 1
1680 1 99 ILE HG12 1 106 VAL MG1 . . 3.920 2.622 2.031 3.337 . 0 0 "[ . 1 . 2]" 1
1681 1 99 ILE HG12 1 107 VAL HA . . 4.370 2.286 1.998 2.723 . 0 0 "[ . 1 . 2]" 1
1682 1 99 ILE HG12 1 107 VAL HB . . 4.420 2.625 2.141 2.931 . 0 0 "[ . 1 . 2]" 1
1683 1 99 ILE HG13 1 106 VAL MG1 . . 3.920 2.145 1.837 2.392 . 0 0 "[ . 1 . 2]" 1
1684 1 99 ILE HG13 1 107 VAL HA . . 4.370 3.786 3.505 4.024 . 0 0 "[ . 1 . 2]" 1
1685 1 99 ILE HG13 1 107 VAL HB . . 4.420 4.244 3.861 4.424 0.004 6 0 "[ . 1 . 2]" 1
1686 1 99 ILE MG 1 100 ALA H . . 4.050 3.109 2.849 3.383 . 0 0 "[ . 1 . 2]" 1
1687 1 99 ILE MG 1 100 ALA HA . . 4.780 3.295 2.966 3.544 . 0 0 "[ . 1 . 2]" 1
1688 1 99 ILE MG 1 102 CYS H . . 5.110 4.378 4.151 4.696 . 0 0 "[ . 1 . 2]" 1
1689 1 99 ILE MG 1 107 VAL HA . . 3.630 3.257 2.843 3.610 . 0 0 "[ . 1 . 2]" 1
1690 1 99 ILE MG 1 107 VAL HB . . 4.130 2.218 1.873 2.887 . 0 0 "[ . 1 . 2]" 1
1691 1 99 ILE MG 1 107 VAL MG2 . . 3.110 2.459 1.950 2.841 . 0 0 "[ . 1 . 2]" 1
1692 1 100 ALA H 1 100 ALA MB . . 3.220 2.123 2.025 2.241 . 0 0 "[ . 1 . 2]" 1
1693 1 100 ALA H 1 101 GLN H . . 3.530 2.666 2.537 2.798 . 0 0 "[ . 1 . 2]" 1
1694 1 100 ALA HA 1 101 GLN HA . . 5.100 4.664 4.603 4.713 . 0 0 "[ . 1 . 2]" 1
1695 1 100 ALA HA 1 102 CYS H . . 4.160 3.427 3.330 3.576 . 0 0 "[ . 1 . 2]" 1
1696 1 100 ALA MB 1 101 GLN H . . 3.530 2.954 2.841 3.086 . 0 0 "[ . 1 . 2]" 1
1697 1 100 ALA MB 1 101 GLN HG2 . . 4.430 3.552 3.275 3.785 . 0 0 "[ . 1 . 2]" 1
1698 1 101 GLN H 1 101 GLN HB2 . . 3.800 2.271 2.189 2.433 . 0 0 "[ . 1 . 2]" 1
1699 1 101 GLN H 1 101 GLN QB . . 3.120 2.245 2.167 2.398 . 0 0 "[ . 1 . 2]" 1
1700 1 101 GLN H 1 101 GLN HB3 . . 3.800 3.541 3.484 3.622 . 0 0 "[ . 1 . 2]" 1
1701 1 101 GLN H 1 101 GLN HG2 . . 3.550 3.090 2.866 3.398 . 0 0 "[ . 1 . 2]" 1
1702 1 101 GLN H 1 101 GLN HG3 . . 4.010 3.741 2.729 4.005 . 0 0 "[ . 1 . 2]" 1
1703 1 101 GLN H 1 102 CYS H . . 3.400 2.765 2.500 3.016 . 0 0 "[ . 1 . 2]" 1
1704 1 101 GLN H 1 103 ALA H . . 4.410 3.772 3.481 4.038 . 0 0 "[ . 1 . 2]" 1
1705 1 101 GLN HA 1 101 GLN HG2 . . 3.930 2.518 2.333 2.696 . 0 0 "[ . 1 . 2]" 1
1706 1 101 GLN HA 1 101 GLN HG3 . . 3.710 3.631 3.373 3.699 . 0 0 "[ . 1 . 2]" 1
1707 1 101 GLN QB 1 102 CYS H . . 4.180 3.656 3.418 3.823 . 0 0 "[ . 1 . 2]" 1
1708 1 101 GLN QB 1 103 ALA H . . 4.170 3.664 3.370 3.905 . 0 0 "[ . 1 . 2]" 1
1709 1 101 GLN QB 1 103 ALA HA . . 5.340 4.472 4.055 4.730 . 0 0 "[ . 1 . 2]" 1
1710 1 101 GLN HB2 1 102 CYS H . . 4.790 3.973 3.680 4.214 . 0 0 "[ . 1 . 2]" 1
1711 1 101 GLN HB2 1 103 ALA H . . 4.800 3.927 3.526 4.216 . 0 0 "[ . 1 . 2]" 1
1712 1 101 GLN HB3 1 102 CYS H . . 4.790 4.274 4.055 4.439 . 0 0 "[ . 1 . 2]" 1
1713 1 101 GLN HB3 1 103 ALA H . . 4.800 4.400 4.010 4.679 . 0 0 "[ . 1 . 2]" 1
1714 1 102 CYS H 1 103 ALA H . . 3.450 2.908 2.714 3.099 . 0 0 "[ . 1 . 2]" 1
1715 1 102 CYS H 1 103 ALA MB . . 4.610 4.409 4.247 4.569 . 0 0 "[ . 1 . 2]" 1
1716 1 102 CYS HA 1 103 ALA H . . 3.540 2.708 2.621 2.820 . 0 0 "[ . 1 . 2]" 1
1717 1 103 ALA H 1 103 ALA MB . . 3.030 2.226 2.039 2.338 . 0 0 "[ . 1 . 2]" 1
1718 1 103 ALA H 1 104 PRO QD . . 4.610 4.258 4.128 4.359 . 0 0 "[ . 1 . 2]" 1
1719 1 103 ALA H 1 106 VAL MG2 . . 4.560 4.257 3.918 4.517 . 0 0 "[ . 1 . 2]" 1
1720 1 103 ALA HA 1 104 PRO HD2 . . 3.630 2.116 1.948 2.551 . 0 0 "[ . 1 . 2]" 1
1721 1 103 ALA HA 1 104 PRO QD . . 3.040 1.945 1.862 2.182 . 0 0 "[ . 1 . 2]" 1
1722 1 103 ALA HA 1 104 PRO HD3 . . 3.630 2.304 2.253 2.371 . 0 0 "[ . 1 . 2]" 1
1723 1 103 ALA HA 1 104 PRO QG . . 4.090 3.850 3.771 4.101 0.011 2 0 "[ . 1 . 2]" 1
1724 1 103 ALA MB 1 104 PRO HD2 . . 4.090 2.656 1.951 3.052 . 0 0 "[ . 1 . 2]" 1
1725 1 103 ALA MB 1 104 PRO QD . . 3.450 2.594 1.930 2.954 . 0 0 "[ . 1 . 2]" 1
1726 1 103 ALA MB 1 104 PRO HD3 . . 4.090 3.669 3.056 3.937 . 0 0 "[ . 1 . 2]" 1
1727 1 103 ALA MB 1 106 VAL HB . . 3.950 2.632 2.014 3.362 . 0 0 "[ . 1 . 2]" 1
1728 1 103 ALA MB 1 106 VAL MG2 . . 3.080 1.886 1.727 2.146 . 0 0 "[ . 1 . 2]" 1
1729 1 104 PRO HA 1 105 GLY H . . 3.070 2.180 2.155 2.262 . 0 0 "[ . 1 . 2]" 1
1730 1 104 PRO HA 1 105 GLY HA2 . . 4.660 4.413 4.352 4.484 . 0 0 "[ . 1 . 2]" 1
1731 1 104 PRO HA 1 105 GLY QA . . 4.060 3.936 3.899 3.998 . 0 0 "[ . 1 . 2]" 1
1732 1 104 PRO HA 1 105 GLY HA3 . . 4.660 4.424 4.362 4.539 . 0 0 "[ . 1 . 2]" 1
1733 1 104 PRO QB 1 105 GLY H . . 3.750 3.286 2.890 3.674 . 0 0 "[ . 1 . 2]" 1
1734 1 104 PRO HB2 1 105 GLY H . . 4.330 3.502 3.022 3.977 . 0 0 "[ . 1 . 2]" 1
1735 1 104 PRO HB3 1 105 GLY H . . 4.330 3.987 3.680 4.322 . 0 0 "[ . 1 . 2]" 1
1736 1 105 GLY H 1 106 VAL H . . 3.960 3.124 2.381 3.574 . 0 0 "[ . 1 . 2]" 1
1737 1 105 GLY H 1 106 VAL MG2 . . 4.740 4.465 3.952 4.742 0.002 3 0 "[ . 1 . 2]" 1
1738 1 105 GLY QA 1 106 VAL MG2 . . 4.790 3.769 3.410 3.924 . 0 0 "[ . 1 . 2]" 1
1739 1 105 GLY QA 1 109 LEU H . . 4.890 4.209 3.716 4.844 . 0 0 "[ . 1 . 2]" 1
1740 1 106 VAL H 1 106 VAL HB . . 3.900 2.678 2.488 2.895 . 0 0 "[ . 1 . 2]" 1
1741 1 106 VAL H 1 106 VAL MG1 . . 4.280 3.795 3.710 3.914 . 0 0 "[ . 1 . 2]" 1
1742 1 106 VAL H 1 106 VAL MG2 . . 3.510 2.405 1.874 3.183 . 0 0 "[ . 1 . 2]" 1
1743 1 106 VAL H 1 107 VAL H . . 4.100 2.751 2.049 3.393 . 0 0 "[ . 1 . 2]" 1
1744 1 106 VAL HA 1 106 VAL MG1 . . 3.210 2.368 2.208 2.526 . 0 0 "[ . 1 . 2]" 1
1745 1 106 VAL HA 1 106 VAL MG2 . . 3.110 2.341 2.143 2.501 . 0 0 "[ . 1 . 2]" 1
1746 1 106 VAL HA 1 109 LEU H . . 4.540 3.721 3.353 3.901 . 0 0 "[ . 1 . 2]" 1
1747 1 106 VAL HA 1 109 LEU QB . . 4.670 3.443 3.004 3.935 . 0 0 "[ . 1 . 2]" 1
1748 1 106 VAL HA 1 109 LEU MD1 . . 3.600 2.282 1.974 2.985 . 0 0 "[ . 1 . 2]" 1
1749 1 106 VAL HA 1 109 LEU HG . . 3.920 3.339 2.288 3.838 . 0 0 "[ . 1 . 2]" 1
1750 1 106 VAL HB 1 107 VAL H . . 4.100 2.134 1.897 2.538 . 0 0 "[ . 1 . 2]" 1
1751 1 106 VAL HB 1 107 VAL HB . . 4.240 4.087 3.967 4.241 0.001 13 0 "[ . 1 . 2]" 1
1752 1 106 VAL MG1 1 107 VAL H . . 4.470 3.052 2.642 3.479 . 0 0 "[ . 1 . 2]" 1
1753 1 106 VAL MG1 1 107 VAL HA . . 3.980 3.377 3.029 3.880 . 0 0 "[ . 1 . 2]" 1
1754 1 106 VAL MG1 1 110 VAL H . . 5.500 5.122 4.879 5.365 . 0 0 "[ . 1 . 2]" 1
1755 1 106 VAL MG2 1 107 VAL H . . 4.370 3.632 3.408 3.942 . 0 0 "[ . 1 . 2]" 1
1756 1 107 VAL H 1 107 VAL HB . . 3.750 2.558 2.474 2.744 . 0 0 "[ . 1 . 2]" 1
1757 1 107 VAL H 1 107 VAL MG1 . . 3.670 2.082 1.944 2.290 . 0 0 "[ . 1 . 2]" 1
1758 1 107 VAL H 1 107 VAL MG2 . . 4.480 3.762 3.744 3.773 . 0 0 "[ . 1 . 2]" 1
1759 1 107 VAL H 1 108 GLU H . . 4.500 2.753 2.495 2.982 . 0 0 "[ . 1 . 2]" 1
1760 1 107 VAL HA 1 107 VAL MG2 . . 3.380 2.314 2.201 2.449 . 0 0 "[ . 1 . 2]" 1
1761 1 107 VAL HA 1 109 LEU H . . 4.800 4.312 3.901 4.552 . 0 0 "[ . 1 . 2]" 1
1762 1 107 VAL HA 1 110 VAL H . . 4.430 3.638 3.422 3.834 . 0 0 "[ . 1 . 2]" 1
1763 1 107 VAL HA 1 110 VAL HB . . 4.020 3.497 3.138 3.770 . 0 0 "[ . 1 . 2]" 1
1764 1 107 VAL HA 1 110 VAL MG2 . . 3.950 2.868 2.003 3.600 . 0 0 "[ . 1 . 2]" 1
1765 1 107 VAL HA 1 111 LEU H . . 5.010 4.776 4.535 4.961 . 0 0 "[ . 1 . 2]" 1
1766 1 107 VAL MG1 1 108 GLU H . . 3.910 2.004 1.805 2.427 . 0 0 "[ . 1 . 2]" 1
1767 1 107 VAL MG1 1 108 GLU HA . . 4.320 3.238 2.976 3.699 . 0 0 "[ . 1 . 2]" 1
1768 1 107 VAL MG1 1 108 GLU QB . . 4.640 3.482 2.847 3.815 . 0 0 "[ . 1 . 2]" 1
1769 1 107 VAL MG1 1 110 VAL H . . 5.500 4.818 4.646 5.021 . 0 0 "[ . 1 . 2]" 1
1770 1 107 VAL MG2 1 110 VAL HB . . 3.970 3.349 3.070 3.679 . 0 0 "[ . 1 . 2]" 1
1771 1 107 VAL MG2 1 111 LEU H . . 4.290 4.012 3.832 4.171 . 0 0 "[ . 1 . 2]" 1
1772 1 107 VAL MG2 1 111 LEU MD1 . . 3.550 2.429 1.950 2.982 . 0 0 "[ . 1 . 2]" 1
1773 1 107 VAL MG2 1 111 LEU MD2 . . 3.670 2.837 2.543 3.203 . 0 0 "[ . 1 . 2]" 1
1774 1 107 VAL MG2 1 111 LEU HG . . 3.620 2.471 2.108 2.780 . 0 0 "[ . 1 . 2]" 1
1775 1 108 GLU H 1 108 GLU HG2 . . 4.930 3.763 1.924 4.618 . 0 0 "[ . 1 . 2]" 1
1776 1 108 GLU H 1 108 GLU HG3 . . 4.930 3.535 2.071 4.633 . 0 0 "[ . 1 . 2]" 1
1777 1 108 GLU H 1 109 LEU H . . 4.140 2.758 2.623 2.880 . 0 0 "[ . 1 . 2]" 1
1778 1 108 GLU HA 1 108 GLU HG2 . . 4.150 3.154 2.219 3.704 . 0 0 "[ . 1 . 2]" 1
1779 1 108 GLU HA 1 108 GLU QG . . 3.330 2.365 2.145 2.861 . 0 0 "[ . 1 . 2]" 1
1780 1 108 GLU HA 1 108 GLU HG3 . . 4.150 2.788 2.165 3.862 . 0 0 "[ . 1 . 2]" 1
1781 1 108 GLU HA 1 110 VAL H . . 4.790 3.663 3.498 3.850 . 0 0 "[ . 1 . 2]" 1
1782 1 108 GLU HA 1 111 LEU H . . 4.140 2.904 2.768 3.084 . 0 0 "[ . 1 . 2]" 1
1783 1 108 GLU HA 1 111 LEU HB2 . . 4.200 2.338 2.032 2.620 . 0 0 "[ . 1 . 2]" 1
1784 1 108 GLU HA 1 111 LEU QB . . 3.410 2.320 2.022 2.593 . 0 0 "[ . 1 . 2]" 1
1785 1 108 GLU HA 1 111 LEU HB3 . . 4.200 3.914 3.633 4.148 . 0 0 "[ . 1 . 2]" 1
1786 1 108 GLU HA 1 111 LEU MD1 . . 3.640 2.130 1.935 2.348 . 0 0 "[ . 1 . 2]" 1
1787 1 108 GLU HA 1 111 LEU MD2 . . 4.200 4.166 3.929 4.202 0.002 14 0 "[ . 1 . 2]" 1
1788 1 108 GLU HA 1 111 LEU HG . . 3.990 2.744 2.334 2.979 . 0 0 "[ . 1 . 2]" 1
1789 1 108 GLU QB 1 109 LEU H . . 3.770 2.582 2.443 2.800 . 0 0 "[ . 1 . 2]" 1
1790 1 109 LEU H 1 109 LEU HB2 . . 4.160 2.486 2.307 2.632 . 0 0 "[ . 1 . 2]" 1
1791 1 109 LEU H 1 109 LEU QB . . 3.500 2.441 2.280 2.569 . 0 0 "[ . 1 . 2]" 1
1792 1 109 LEU H 1 109 LEU HB3 . . 4.160 3.581 3.551 3.588 . 0 0 "[ . 1 . 2]" 1
1793 1 109 LEU H 1 109 LEU MD1 . . 4.050 3.447 3.221 3.847 . 0 0 "[ . 1 . 2]" 1
1794 1 109 LEU H 1 109 LEU MD2 . . 3.930 3.470 2.935 3.838 . 0 0 "[ . 1 . 2]" 1
1795 1 109 LEU H 1 109 LEU HG . . 3.270 2.263 1.978 2.590 . 0 0 "[ . 1 . 2]" 1
1796 1 109 LEU H 1 111 LEU H . . 4.610 4.067 3.903 4.163 . 0 0 "[ . 1 . 2]" 1
1797 1 109 LEU HA 1 109 LEU MD1 . . 4.050 3.884 3.743 3.948 . 0 0 "[ . 1 . 2]" 1
1798 1 109 LEU HA 1 109 LEU MD2 . . 3.080 2.208 1.936 2.500 . 0 0 "[ . 1 . 2]" 1
1799 1 109 LEU HA 1 109 LEU HG . . 4.050 2.950 2.652 3.261 . 0 0 "[ . 1 . 2]" 1
1800 1 109 LEU HA 1 111 LEU H . . 5.290 4.301 4.059 4.456 . 0 0 "[ . 1 . 2]" 1
1801 1 109 LEU HA 1 112 ILE H . . 4.940 3.976 3.752 4.161 . 0 0 "[ . 1 . 2]" 1
1802 1 109 LEU HA 1 112 ILE HB . . 4.400 3.434 3.209 3.780 . 0 0 "[ . 1 . 2]" 1
1803 1 109 LEU HA 1 112 ILE MD . . 4.210 3.034 2.661 3.494 . 0 0 "[ . 1 . 2]" 1
1804 1 109 LEU HA 1 113 PRO HD2 . . 4.810 4.258 4.093 4.455 . 0 0 "[ . 1 . 2]" 1
1805 1 109 LEU HA 1 113 PRO HD3 . . 4.810 4.019 3.815 4.333 . 0 0 "[ . 1 . 2]" 1
1806 1 109 LEU QB 1 109 LEU MD2 . . 3.000 2.201 2.035 2.417 . 0 0 "[ . 1 . 2]" 1
1807 1 109 LEU QB 1 110 VAL H . . 3.930 2.971 2.794 3.129 . 0 0 "[ . 1 . 2]" 1
1808 1 109 LEU QB 1 110 VAL MG2 . . 3.490 2.953 2.838 3.134 . 0 0 "[ . 1 . 2]" 1
1809 1 109 LEU HB2 1 109 LEU MD1 . . 3.240 2.204 2.040 2.413 . 0 0 "[ . 1 . 2]" 1
1810 1 109 LEU HB2 1 109 LEU MD2 . . 3.460 3.170 3.126 3.194 . 0 0 "[ . 1 . 2]" 1
1811 1 109 LEU HB2 1 110 VAL H . . 4.470 3.074 2.876 3.283 . 0 0 "[ . 1 . 2]" 1
1812 1 109 LEU HB2 1 110 VAL MG2 . . 4.030 3.089 2.914 3.376 . 0 0 "[ . 1 . 2]" 1
1813 1 109 LEU HB3 1 109 LEU MD1 . . 3.240 2.488 2.269 2.671 . 0 0 "[ . 1 . 2]" 1
1814 1 109 LEU HB3 1 109 LEU MD2 . . 3.460 2.247 2.062 2.505 . 0 0 "[ . 1 . 2]" 1
1815 1 109 LEU HB3 1 110 VAL H . . 4.470 3.944 3.676 4.106 . 0 0 "[ . 1 . 2]" 1
1816 1 109 LEU HB3 1 110 VAL MG2 . . 4.030 3.796 3.491 3.958 . 0 0 "[ . 1 . 2]" 1
1817 1 109 LEU HG 1 110 VAL H . . 4.810 4.563 4.332 4.811 0.001 1 0 "[ . 1 . 2]" 1
1818 1 110 VAL H 1 110 VAL HB . . 3.390 2.620 2.478 2.806 . 0 0 "[ . 1 . 2]" 1
1819 1 110 VAL H 1 110 VAL MG1 . . 3.970 3.816 3.778 3.847 . 0 0 "[ . 1 . 2]" 1
1820 1 110 VAL H 1 110 VAL MG2 . . 3.630 2.435 2.016 2.794 . 0 0 "[ . 1 . 2]" 1
1821 1 110 VAL H 1 111 LEU H . . 3.270 2.142 2.033 2.230 . 0 0 "[ . 1 . 2]" 1
1822 1 110 VAL H 1 111 LEU MD1 . . 5.500 4.726 4.426 4.985 . 0 0 "[ . 1 . 2]" 1
1823 1 110 VAL H 1 111 LEU HG . . 4.070 3.807 3.581 4.056 . 0 0 "[ . 1 . 2]" 1
1824 1 110 VAL H 1 112 ILE H . . 4.780 3.941 3.785 4.191 . 0 0 "[ . 1 . 2]" 1
1825 1 110 VAL H 1 113 PRO QD . . 5.180 3.923 3.810 4.150 . 0 0 "[ . 1 . 2]" 1
1826 1 110 VAL HA 1 110 VAL MG1 . . 3.520 2.312 2.136 2.447 . 0 0 "[ . 1 . 2]" 1
1827 1 110 VAL HA 1 110 VAL MG2 . . 3.310 2.403 2.226 2.569 . 0 0 "[ . 1 . 2]" 1
1828 1 110 VAL HA 1 113 PRO HD2 . . 4.730 2.981 2.900 3.148 . 0 0 "[ . 1 . 2]" 1
1829 1 110 VAL HA 1 113 PRO QD . . 3.940 2.895 2.819 3.043 . 0 0 "[ . 1 . 2]" 1
1830 1 110 VAL HA 1 113 PRO HD3 . . 4.730 3.923 3.815 4.092 . 0 0 "[ . 1 . 2]" 1
1831 1 110 VAL HA 1 113 PRO HG2 . . 4.190 2.531 2.283 2.875 . 0 0 "[ . 1 . 2]" 1
1832 1 110 VAL HA 1 113 PRO QG . . 3.580 2.376 2.178 2.638 . 0 0 "[ . 1 . 2]" 1
1833 1 110 VAL HA 1 113 PRO HG3 . . 4.190 2.885 2.745 3.069 . 0 0 "[ . 1 . 2]" 1
1834 1 110 VAL HB 1 111 LEU H . . 3.750 3.028 2.913 3.217 . 0 0 "[ . 1 . 2]" 1
1835 1 110 VAL HB 1 111 LEU HA . . 5.150 4.249 4.064 4.451 . 0 0 "[ . 1 . 2]" 1
1836 1 110 VAL HB 1 111 LEU HG . . 5.220 3.621 3.448 3.929 . 0 0 "[ . 1 . 2]" 1
1837 1 110 VAL MG1 1 111 LEU H . . 4.370 3.864 3.662 4.141 . 0 0 "[ . 1 . 2]" 1
1838 1 110 VAL MG1 1 111 LEU HA . . 4.450 3.843 3.505 4.325 . 0 0 "[ . 1 . 2]" 1
1839 1 110 VAL MG1 1 114 LEU H . . 4.610 3.986 3.628 4.407 . 0 0 "[ . 1 . 2]" 1
1840 1 110 VAL MG1 1 114 LEU QB . . 4.000 3.015 2.478 3.692 . 0 0 "[ . 1 . 2]" 1
1841 1 110 VAL MG2 1 111 LEU H . . 4.100 3.864 3.609 4.070 . 0 0 "[ . 1 . 2]" 1
1842 1 110 VAL MG2 1 113 PRO QD . . 5.350 4.506 4.428 4.628 . 0 0 "[ . 1 . 2]" 1
1843 1 111 LEU H 1 111 LEU HB2 . . 4.080 2.424 2.327 2.486 . 0 0 "[ . 1 . 2]" 1
1844 1 111 LEU H 1 111 LEU QB . . 3.280 2.388 2.299 2.443 . 0 0 "[ . 1 . 2]" 1
1845 1 111 LEU H 1 111 LEU HB3 . . 4.080 3.590 3.562 3.616 . 0 0 "[ . 1 . 2]" 1
1846 1 111 LEU H 1 111 LEU MD1 . . 3.780 3.621 3.380 3.766 . 0 0 "[ . 1 . 2]" 1
1847 1 111 LEU H 1 111 LEU MD2 . . 4.200 3.516 3.231 3.721 . 0 0 "[ . 1 . 2]" 1
1848 1 111 LEU H 1 111 LEU HG . . 3.720 2.430 2.298 2.581 . 0 0 "[ . 1 . 2]" 1
1849 1 111 LEU H 1 112 ILE H . . 4.020 2.512 2.331 2.642 . 0 0 "[ . 1 . 2]" 1
1850 1 111 LEU H 1 113 PRO QD . . 4.590 3.194 3.098 3.255 . 0 0 "[ . 1 . 2]" 1
1851 1 111 LEU HA 1 111 LEU MD1 . . 3.960 3.876 3.824 3.918 . 0 0 "[ . 1 . 2]" 1
1852 1 111 LEU HA 1 111 LEU MD2 . . 4.670 2.178 2.066 2.343 . 0 0 "[ . 1 . 2]" 1
1853 1 111 LEU HA 1 111 LEU HG . . 4.140 3.051 2.913 3.219 . 0 0 "[ . 1 . 2]" 1
1854 1 111 LEU HA 1 113 PRO QD . . 5.350 3.834 3.706 3.900 . 0 0 "[ . 1 . 2]" 1
1855 1 111 LEU HA 1 114 LEU H . . 4.030 3.446 3.261 3.698 . 0 0 "[ . 1 . 2]" 1
1856 1 111 LEU HA 1 114 LEU HB2 . . 3.980 2.802 2.177 3.523 . 0 0 "[ . 1 . 2]" 1
1857 1 111 LEU HA 1 114 LEU QB . . 3.320 2.207 2.091 2.307 . 0 0 "[ . 1 . 2]" 1
1858 1 111 LEU HA 1 114 LEU HB3 . . 3.980 2.416 2.163 2.824 . 0 0 "[ . 1 . 2]" 1
1859 1 111 LEU HA 1 114 LEU MD2 . . 3.260 2.656 2.331 3.002 . 0 0 "[ . 1 . 2]" 1
1860 1 111 LEU HA 1 115 ARG H . . 4.530 4.052 3.403 4.502 . 0 0 "[ . 1 . 2]" 1
1861 1 111 LEU QB 1 111 LEU MD1 . . 3.260 2.075 2.040 2.096 . 0 0 "[ . 1 . 2]" 1
1862 1 111 LEU QB 1 112 ILE H . . 3.360 2.590 2.360 2.818 . 0 0 "[ . 1 . 2]" 1
1863 1 111 LEU QB 1 112 ILE HA . . 4.830 3.851 3.794 3.913 . 0 0 "[ . 1 . 2]" 1
1864 1 112 ILE H 1 112 ILE HB . . 3.600 2.245 2.210 2.295 . 0 0 "[ . 1 . 2]" 1
1865 1 112 ILE H 1 112 ILE MD . . 3.910 3.593 3.404 3.715 . 0 0 "[ . 1 . 2]" 1
1866 1 112 ILE H 1 112 ILE HG12 . . 4.040 4.029 3.982 4.055 0.015 13 0 "[ . 1 . 2]" 1
1867 1 112 ILE H 1 112 ILE HG13 . . 4.040 2.791 2.731 2.877 . 0 0 "[ . 1 . 2]" 1
1868 1 112 ILE H 1 112 ILE MG . . 3.690 3.642 3.606 3.677 . 0 0 "[ . 1 . 2]" 1
1869 1 112 ILE H 1 113 PRO HD2 . . 3.870 2.151 2.006 2.298 . 0 0 "[ . 1 . 2]" 1
1870 1 112 ILE H 1 113 PRO QD . . 3.150 2.118 1.981 2.257 . 0 0 "[ . 1 . 2]" 1
1871 1 112 ILE H 1 113 PRO HD3 . . 3.870 3.170 3.056 3.300 . 0 0 "[ . 1 . 2]" 1
1872 1 112 ILE H 1 113 PRO HG2 . . 5.060 4.385 4.241 4.529 . 0 0 "[ . 1 . 2]" 1
1873 1 112 ILE H 1 113 PRO QG . . 4.380 4.049 3.920 4.180 . 0 0 "[ . 1 . 2]" 1
1874 1 112 ILE H 1 113 PRO HG3 . . 5.060 4.756 4.614 4.908 . 0 0 "[ . 1 . 2]" 1
1875 1 112 ILE HA 1 112 ILE MD . . 3.790 3.739 3.725 3.746 . 0 0 "[ . 1 . 2]" 1
1876 1 112 ILE HA 1 112 ILE HG12 . . 3.760 2.524 2.444 2.647 . 0 0 "[ . 1 . 2]" 1
1877 1 112 ILE HA 1 112 ILE QG . . 3.190 2.224 2.206 2.235 . 0 0 "[ . 1 . 2]" 1
1878 1 112 ILE HA 1 112 ILE HG13 . . 3.760 2.477 2.360 2.560 . 0 0 "[ . 1 . 2]" 1
1879 1 112 ILE HA 1 112 ILE MG . . 3.270 2.662 2.638 2.689 . 0 0 "[ . 1 . 2]" 1
1880 1 112 ILE HA 1 115 ARG H . . 4.720 4.358 4.013 4.638 . 0 0 "[ . 1 . 2]" 1
1881 1 112 ILE HB 1 112 ILE MD . . 3.390 2.303 2.205 2.402 . 0 0 "[ . 1 . 2]" 1
1882 1 112 ILE HB 1 113 PRO HD2 . . 3.540 2.511 2.496 2.520 . 0 0 "[ . 1 . 2]" 1
1883 1 112 ILE HB 1 113 PRO QD . . 3.100 1.881 1.871 1.884 . 0 0 "[ . 1 . 2]" 1
1884 1 112 ILE HB 1 113 PRO HD3 . . 3.540 1.942 1.929 1.946 . 0 0 "[ . 1 . 2]" 1
1885 1 112 ILE HB 1 113 PRO QG . . 4.920 3.862 3.857 3.865 . 0 0 "[ . 1 . 2]" 1
1886 1 112 ILE MD 1 113 PRO QD . . 4.310 3.531 3.465 3.577 . 0 0 "[ . 1 . 2]" 1
1887 1 112 ILE QG 1 113 PRO QD . . 4.570 3.664 3.653 3.684 . 0 0 "[ . 1 . 2]" 1
1888 1 112 ILE HG12 1 112 ILE MG . . 3.490 2.336 2.278 2.389 . 0 0 "[ . 1 . 2]" 1
1889 1 112 ILE HG13 1 112 ILE MG . . 3.490 3.188 3.169 3.197 . 0 0 "[ . 1 . 2]" 1
1890 1 112 ILE MG 1 113 PRO HA . . 4.270 2.924 2.822 2.987 . 0 0 "[ . 1 . 2]" 1
1891 1 112 ILE MG 1 113 PRO HD2 . . 3.940 3.213 3.159 3.280 . 0 0 "[ . 1 . 2]" 1
1892 1 112 ILE MG 1 113 PRO QD . . 3.270 1.959 1.948 2.019 . 0 0 "[ . 1 . 2]" 1
1893 1 112 ILE MG 1 113 PRO HD3 . . 3.940 1.976 1.965 2.041 . 0 0 "[ . 1 . 2]" 1
1894 1 112 ILE MG 1 114 LEU H . . 4.950 4.380 4.185 4.556 . 0 0 "[ . 1 . 2]" 1
1895 1 113 PRO HA 1 116 GLN H . . 3.860 3.439 3.078 3.719 . 0 0 "[ . 1 . 2]" 1
1896 1 113 PRO HA 1 116 GLN HB2 . . 4.070 2.489 2.187 4.054 . 0 0 "[ . 1 . 2]" 1
1897 1 113 PRO HA 1 116 GLN QB . . 3.470 2.408 2.170 2.818 . 0 0 "[ . 1 . 2]" 1
1898 1 113 PRO HA 1 116 GLN HB3 . . 4.070 3.879 2.875 4.078 0.008 19 0 "[ . 1 . 2]" 1
1899 1 113 PRO HA 1 116 GLN HG2 . . 4.720 4.067 2.009 4.685 . 0 0 "[ . 1 . 2]" 1
1900 1 113 PRO HA 1 116 GLN QG . . 4.100 2.979 1.998 3.642 . 0 0 "[ . 1 . 2]" 1
1901 1 113 PRO HA 1 116 GLN HG3 . . 4.720 3.210 2.682 4.606 . 0 0 "[ . 1 . 2]" 1
1902 1 113 PRO QB 1 114 LEU H . . 3.920 3.161 2.810 3.439 . 0 0 "[ . 1 . 2]" 1
1903 1 113 PRO QD 1 114 LEU H . . 3.810 2.628 2.603 2.707 . 0 0 "[ . 1 . 2]" 1
1904 1 113 PRO HD2 1 114 LEU H . . 4.590 2.676 2.648 2.763 . 0 0 "[ . 1 . 2]" 1
1905 1 113 PRO HD3 1 114 LEU H . . 4.590 3.850 3.836 3.880 . 0 0 "[ . 1 . 2]" 1
1906 1 113 PRO QG 1 114 LEU H . . 3.550 2.312 1.901 2.719 . 0 0 "[ . 1 . 2]" 1
1907 1 113 PRO HG2 1 114 LEU H . . 4.190 2.331 1.909 2.755 . 0 0 "[ . 1 . 2]" 1
1908 1 113 PRO HG3 1 114 LEU H . . 4.190 3.853 3.534 4.169 . 0 0 "[ . 1 . 2]" 1
1909 1 114 LEU H 1 114 LEU HB2 . . 3.470 2.458 2.210 2.710 . 0 0 "[ . 1 . 2]" 1
1910 1 114 LEU H 1 114 LEU HB3 . . 3.470 2.579 2.331 2.904 . 0 0 "[ . 1 . 2]" 1
1911 1 114 LEU H 1 114 LEU MD1 . . 4.400 4.006 3.630 4.240 . 0 0 "[ . 1 . 2]" 1
1912 1 114 LEU H 1 114 LEU MD2 . . 5.210 4.207 4.070 4.340 . 0 0 "[ . 1 . 2]" 1
1913 1 114 LEU H 1 114 LEU HG . . 4.570 4.477 4.358 4.558 . 0 0 "[ . 1 . 2]" 1
1914 1 114 LEU H 1 115 ARG H . . 3.690 2.977 2.626 3.199 . 0 0 "[ . 1 . 2]" 1
1915 1 114 LEU H 1 116 GLN H . . 5.040 4.268 4.012 4.691 . 0 0 "[ . 1 . 2]" 1
1916 1 114 LEU HA 1 114 LEU MD1 . . 3.380 2.528 1.994 3.485 0.105 12 0 "[ . 1 . 2]" 1
1917 1 114 LEU HA 1 114 LEU MD2 . . 4.330 3.885 3.497 3.989 . 0 0 "[ . 1 . 2]" 1
1918 1 114 LEU HA 1 114 LEU HG . . 3.980 2.888 2.538 3.175 . 0 0 "[ . 1 . 2]" 1
1919 1 114 LEU HA 1 117 ARG H . . 4.150 3.809 3.628 4.148 . 0 0 "[ . 1 . 2]" 1
1920 1 114 LEU HA 1 117 ARG HB2 . . 3.940 3.275 2.931 3.590 . 0 0 "[ . 1 . 2]" 1
1921 1 114 LEU HA 1 117 ARG HB3 . . 5.210 4.884 4.531 5.188 . 0 0 "[ . 1 . 2]" 1
1922 1 114 LEU HA 1 117 ARG QG . . 4.670 3.698 2.949 4.666 . 0 0 "[ . 1 . 2]" 1
1923 1 114 LEU HA 1 118 LEU H . . 4.790 4.385 4.100 4.662 . 0 0 "[ . 1 . 2]" 1
1924 1 114 LEU QB 1 114 LEU MD2 . . 3.090 2.034 1.936 2.100 . 0 0 "[ . 1 . 2]" 1
1925 1 114 LEU QB 1 115 ARG H . . 3.410 2.266 1.892 2.600 . 0 0 "[ . 1 . 2]" 1
1926 1 114 LEU HB2 1 114 LEU MD1 . . 3.390 2.141 2.018 2.334 . 0 0 "[ . 1 . 2]" 1
1927 1 114 LEU HB2 1 114 LEU MD2 . . 3.650 2.610 2.407 3.094 . 0 0 "[ . 1 . 2]" 1
1928 1 114 LEU HB2 1 115 ARG H . . 3.920 3.700 3.397 3.921 0.001 3 0 "[ . 1 . 2]" 1
1929 1 114 LEU HB3 1 114 LEU MD1 . . 3.390 3.102 2.711 3.193 . 0 0 "[ . 1 . 2]" 1
1930 1 114 LEU HB3 1 114 LEU MD2 . . 3.650 2.137 1.989 2.275 . 0 0 "[ . 1 . 2]" 1
1931 1 114 LEU HB3 1 115 ARG H . . 3.920 2.288 1.901 2.643 . 0 0 "[ . 1 . 2]" 1
1932 1 114 LEU MD2 1 115 ARG H . . 4.250 3.576 2.666 4.116 . 0 0 "[ . 1 . 2]" 1
1933 1 114 LEU HG 1 115 ARG H . . 4.350 3.630 3.149 4.227 . 0 0 "[ . 1 . 2]" 1
1934 1 114 LEU HG 1 118 LEU H . . 5.260 4.484 4.196 4.998 . 0 0 "[ . 1 . 2]" 1
1935 1 114 LEU HG 1 118 LEU HG . . 4.350 3.238 2.881 3.742 . 0 0 "[ . 1 . 2]" 1
1936 1 115 ARG H 1 115 ARG HB2 . . 3.630 2.891 2.199 3.596 . 0 0 "[ . 1 . 2]" 1
1937 1 115 ARG H 1 115 ARG QB . . 3.170 2.284 2.154 2.473 . 0 0 "[ . 1 . 2]" 1
1938 1 115 ARG H 1 115 ARG HB3 . . 3.630 2.492 2.227 3.501 . 0 0 "[ . 1 . 2]" 1
1939 1 115 ARG H 1 115 ARG QD . . 5.340 4.137 3.215 4.597 . 0 0 "[ . 1 . 2]" 1
1940 1 115 ARG H 1 115 ARG HG2 . . 4.840 3.785 2.152 4.465 . 0 0 "[ . 1 . 2]" 1
1941 1 115 ARG H 1 115 ARG QG . . 4.130 3.417 2.126 4.041 . 0 0 "[ . 1 . 2]" 1
1942 1 115 ARG H 1 115 ARG HG3 . . 4.840 4.120 2.346 4.627 . 0 0 "[ . 1 . 2]" 1
1943 1 115 ARG H 1 116 GLN H . . 3.540 2.756 2.477 2.944 . 0 0 "[ . 1 . 2]" 1
1944 1 115 ARG H 1 116 GLN QG . . 5.340 4.732 4.358 5.252 . 0 0 "[ . 1 . 2]" 1
1945 1 115 ARG H 1 117 ARG H . . 4.840 4.280 3.970 4.788 . 0 0 "[ . 1 . 2]" 1
1946 1 115 ARG HA 1 115 ARG HD2 . . 4.870 4.520 3.909 4.872 0.002 5 0 "[ . 1 . 2]" 1
1947 1 115 ARG HA 1 115 ARG HD3 . . 4.870 4.484 3.521 4.998 0.128 19 0 "[ . 1 . 2]" 1
1948 1 115 ARG HA 1 115 ARG HG2 . . 4.100 3.149 2.193 4.224 0.124 6 0 "[ . 1 . 2]" 1
1949 1 115 ARG HA 1 115 ARG QG . . 3.600 2.772 2.152 3.432 . 0 0 "[ . 1 . 2]" 1
1950 1 115 ARG HA 1 115 ARG HG3 . . 4.100 3.243 2.636 3.918 . 0 0 "[ . 1 . 2]" 1
1951 1 115 ARG HA 1 117 ARG H . . 4.970 4.224 3.531 4.806 . 0 0 "[ . 1 . 2]" 1
1952 1 115 ARG HA 1 118 LEU H . . 4.290 3.399 3.059 3.638 . 0 0 "[ . 1 . 2]" 1
1953 1 115 ARG HA 1 118 LEU HB2 . . 5.140 2.573 2.319 3.071 . 0 0 "[ . 1 . 2]" 1
1954 1 115 ARG HA 1 118 LEU HB3 . . 4.600 4.160 3.850 4.535 . 0 0 "[ . 1 . 2]" 1
1955 1 115 ARG HA 1 118 LEU MD1 . . 3.810 2.290 1.939 2.745 . 0 0 "[ . 1 . 2]" 1
1956 1 115 ARG HA 1 119 GLU H . . 4.750 4.053 3.504 4.542 . 0 0 "[ . 1 . 2]" 1
1957 1 115 ARG QB 1 115 ARG QD . . 3.310 2.118 2.039 2.232 . 0 0 "[ . 1 . 2]" 1
1958 1 115 ARG QB 1 116 GLN H . . 3.370 2.748 2.351 3.409 0.039 6 0 "[ . 1 . 2]" 1
1959 1 115 ARG HB2 1 116 GLN H . . 4.060 3.762 2.481 3.993 . 0 0 "[ . 1 . 2]" 1
1960 1 115 ARG HB3 1 116 GLN H . . 4.060 2.938 2.450 3.902 . 0 0 "[ . 1 . 2]" 1
1961 1 115 ARG QG 1 116 GLN H . . 4.210 3.086 1.847 4.179 . 0 0 "[ . 1 . 2]" 1
1962 1 115 ARG QG 1 119 GLU QG . . 4.040 3.224 2.252 4.044 0.004 6 0 "[ . 1 . 2]" 1
1963 1 115 ARG HG2 1 116 GLN H . . 4.800 3.374 1.903 4.798 . 0 0 "[ . 1 . 2]" 1
1964 1 115 ARG HG3 1 116 GLN H . . 4.800 3.929 1.894 4.790 . 0 0 "[ . 1 . 2]" 1
1965 1 116 GLN H 1 116 GLN HB2 . . 3.650 2.415 2.231 3.486 . 0 0 "[ . 1 . 2]" 1
1966 1 116 GLN H 1 116 GLN QB . . 2.940 2.318 2.157 2.492 . 0 0 "[ . 1 . 2]" 1
1967 1 116 GLN H 1 116 GLN HB3 . . 3.650 3.498 2.178 3.605 . 0 0 "[ . 1 . 2]" 1
1968 1 116 GLN H 1 116 GLN HG2 . . 3.980 3.201 2.124 3.926 . 0 0 "[ . 1 . 2]" 1
1969 1 116 GLN H 1 116 GLN QG . . 3.370 2.540 2.107 3.283 . 0 0 "[ . 1 . 2]" 1
1970 1 116 GLN H 1 116 GLN HG3 . . 3.980 2.997 2.314 3.979 . 0 0 "[ . 1 . 2]" 1
1971 1 116 GLN H 1 117 ARG H . . 3.460 2.862 2.658 3.095 . 0 0 "[ . 1 . 2]" 1
1972 1 116 GLN H 1 118 LEU H . . 4.760 4.478 4.246 4.659 . 0 0 "[ . 1 . 2]" 1
1973 1 116 GLN HA 1 116 GLN HG2 . . 4.010 2.596 2.185 3.823 . 0 0 "[ . 1 . 2]" 1
1974 1 116 GLN HA 1 116 GLN QG . . 3.450 2.433 2.144 3.270 . 0 0 "[ . 1 . 2]" 1
1975 1 116 GLN HA 1 116 GLN HG3 . . 4.010 3.208 2.575 3.748 . 0 0 "[ . 1 . 2]" 1
1976 1 116 GLN HA 1 119 GLU H . . 4.140 3.951 3.647 4.131 . 0 0 "[ . 1 . 2]" 1
1977 1 116 GLN HA 1 119 GLU QG . . 4.340 3.462 2.443 4.335 . 0 0 "[ . 1 . 2]" 1
1978 1 116 GLN QB 1 117 ARG H . . 3.330 2.659 2.224 3.329 . 0 0 "[ . 1 . 2]" 1
1979 1 116 GLN HB2 1 117 ARG H . . 4.050 2.791 2.285 3.957 . 0 0 "[ . 1 . 2]" 1
1980 1 116 GLN HB3 1 117 ARG H . . 4.050 3.435 2.962 3.768 . 0 0 "[ . 1 . 2]" 1
1981 1 117 ARG H 1 117 ARG HB2 . . 4.010 2.357 2.174 2.608 . 0 0 "[ . 1 . 2]" 1
1982 1 117 ARG H 1 117 ARG HB3 . . 4.050 3.564 3.478 3.623 . 0 0 "[ . 1 . 2]" 1
1983 1 117 ARG H 1 117 ARG HD2 . . 5.290 4.282 2.406 5.259 . 0 0 "[ . 1 . 2]" 1
1984 1 117 ARG H 1 117 ARG QD . . 4.590 3.795 2.041 4.487 . 0 0 "[ . 1 . 2]" 1
1985 1 117 ARG H 1 117 ARG HD3 . . 5.290 4.424 2.100 5.203 . 0 0 "[ . 1 . 2]" 1
1986 1 117 ARG H 1 117 ARG HG2 . . 4.260 2.771 1.980 4.160 . 0 0 "[ . 1 . 2]" 1
1987 1 117 ARG H 1 117 ARG QG . . 3.680 2.628 1.964 3.621 . 0 0 "[ . 1 . 2]" 1
1988 1 117 ARG H 1 117 ARG HG3 . . 4.260 3.613 2.637 4.031 . 0 0 "[ . 1 . 2]" 1
1989 1 117 ARG H 1 118 LEU H . . 3.590 2.669 2.319 2.919 . 0 0 "[ . 1 . 2]" 1
1990 1 117 ARG H 1 118 LEU HB2 . . 4.900 4.613 4.361 4.831 . 0 0 "[ . 1 . 2]" 1
1991 1 117 ARG HA 1 117 ARG HD2 . . 4.110 3.071 2.009 4.212 0.102 19 0 "[ . 1 . 2]" 1
1992 1 117 ARG HA 1 117 ARG QD . . 3.530 2.515 1.999 3.549 0.019 19 0 "[ . 1 . 2]" 1
1993 1 117 ARG HA 1 117 ARG HD3 . . 4.110 3.251 2.162 4.124 0.014 14 0 "[ . 1 . 2]" 1
1994 1 117 ARG HA 1 117 ARG QG . . 3.740 2.627 2.231 2.861 . 0 0 "[ . 1 . 2]" 1
1995 1 117 ARG HA 1 120 GLU H . . 3.770 3.410 3.052 3.744 . 0 0 "[ . 1 . 2]" 1
1996 1 117 ARG HA 1 120 GLU HB2 . . 4.120 3.050 2.089 3.796 . 0 0 "[ . 1 . 2]" 1
1997 1 117 ARG HA 1 120 GLU QB . . 3.540 2.757 2.078 3.301 . 0 0 "[ . 1 . 2]" 1
1998 1 117 ARG HA 1 120 GLU HB3 . . 4.120 3.378 2.410 4.081 . 0 0 "[ . 1 . 2]" 1
1999 1 117 ARG HB2 1 118 LEU H . . 3.640 2.467 2.212 2.722 . 0 0 "[ . 1 . 2]" 1
2000 1 117 ARG HB3 1 117 ARG HD2 . . 4.100 3.035 2.209 3.840 . 0 0 "[ . 1 . 2]" 1
2001 1 117 ARG HB3 1 117 ARG QD . . 3.570 2.567 2.095 3.348 . 0 0 "[ . 1 . 2]" 1
2002 1 117 ARG HB3 1 117 ARG HD3 . . 4.100 3.070 2.114 4.154 0.054 14 0 "[ . 1 . 2]" 1
2003 1 117 ARG HB3 1 118 LEU H . . 3.680 3.285 3.026 3.684 0.004 17 0 "[ . 1 . 2]" 1
2004 1 117 ARG HB3 1 118 LEU HA . . 4.760 4.185 3.957 4.542 . 0 0 "[ . 1 . 2]" 1
2005 1 117 ARG QG 1 118 LEU H . . 4.710 4.092 3.768 4.398 . 0 0 "[ . 1 . 2]" 1
2006 1 117 ARG HG2 1 118 LEU H . . 5.500 4.498 4.082 4.973 . 0 0 "[ . 1 . 2]" 1
2007 1 117 ARG HG3 1 118 LEU H . . 5.500 4.721 4.376 5.003 . 0 0 "[ . 1 . 2]" 1
2008 1 118 LEU H 1 118 LEU HB2 . . 3.650 2.459 2.328 2.683 . 0 0 "[ . 1 . 2]" 1
2009 1 118 LEU H 1 118 LEU HB3 . . 3.740 3.587 3.559 3.605 . 0 0 "[ . 1 . 2]" 1
2010 1 118 LEU H 1 118 LEU MD1 . . 3.850 3.473 3.112 3.726 . 0 0 "[ . 1 . 2]" 1
2011 1 118 LEU H 1 118 LEU MD2 . . 3.940 3.564 3.106 3.818 . 0 0 "[ . 1 . 2]" 1
2012 1 118 LEU H 1 118 LEU HG . . 3.330 2.337 1.985 2.560 . 0 0 "[ . 1 . 2]" 1
2013 1 118 LEU H 1 119 GLU H . . 3.520 2.912 2.592 3.150 . 0 0 "[ . 1 . 2]" 1
2014 1 118 LEU H 1 120 GLU H . . 4.900 4.311 3.943 4.808 . 0 0 "[ . 1 . 2]" 1
2015 1 118 LEU HA 1 118 LEU MD1 . . 3.930 3.875 3.822 3.929 . 0 0 "[ . 1 . 2]" 1
2016 1 118 LEU HA 1 118 LEU MD2 . . 3.300 2.186 1.990 2.581 . 0 0 "[ . 1 . 2]" 1
2017 1 118 LEU HA 1 118 LEU HG . . 3.830 2.877 2.736 3.110 . 0 0 "[ . 1 . 2]" 1
2018 1 118 LEU HA 1 121 ARG H . . 4.670 3.595 3.121 4.068 . 0 0 "[ . 1 . 2]" 1
2019 1 118 LEU HA 1 121 ARG QB . . 4.170 2.948 2.131 3.623 . 0 0 "[ . 1 . 2]" 1
2020 1 118 LEU HB2 1 118 LEU MD1 . . 3.460 2.184 2.044 2.336 . 0 0 "[ . 1 . 2]" 1
2021 1 118 LEU HB2 1 119 GLU H . . 4.050 2.546 2.300 2.807 . 0 0 "[ . 1 . 2]" 1
2022 1 118 LEU HB3 1 118 LEU MD1 . . 3.360 2.484 2.276 2.639 . 0 0 "[ . 1 . 2]" 1
2023 1 118 LEU HB3 1 118 LEU MD2 . . 3.500 2.249 2.025 2.379 . 0 0 "[ . 1 . 2]" 1
2024 1 118 LEU HB3 1 119 GLU H . . 3.800 3.421 3.030 3.656 . 0 0 "[ . 1 . 2]" 1
2025 1 118 LEU HB3 1 119 GLU HA . . 4.410 4.236 3.998 4.411 0.001 6 0 "[ . 1 . 2]" 1
2026 1 118 LEU HG 1 119 GLU H . . 4.650 4.486 4.237 4.637 . 0 0 "[ . 1 . 2]" 1
2027 1 119 GLU H 1 119 GLU QB . . 3.210 2.378 2.190 2.641 . 0 0 "[ . 1 . 2]" 1
2028 1 119 GLU H 1 119 GLU HG2 . . 3.790 2.828 2.044 3.645 . 0 0 "[ . 1 . 2]" 1
2029 1 119 GLU H 1 119 GLU QG . . 3.280 2.401 1.992 2.865 . 0 0 "[ . 1 . 2]" 1
2030 1 119 GLU H 1 119 GLU HG3 . . 3.790 3.015 2.279 3.763 . 0 0 "[ . 1 . 2]" 1
2031 1 119 GLU HA 1 119 GLU HG2 . . 3.890 2.578 2.241 3.784 . 0 0 "[ . 1 . 2]" 1
2032 1 119 GLU HA 1 119 GLU QG . . 3.240 2.500 2.202 3.330 0.090 17 0 "[ . 1 . 2]" 1
2033 1 119 GLU HA 1 119 GLU HG3 . . 3.890 3.479 3.017 3.759 . 0 0 "[ . 1 . 2]" 1
2034 1 119 GLU HA 1 122 GLN H . . 3.910 3.402 2.930 3.809 . 0 0 "[ . 1 . 2]" 1
2035 1 119 GLU HA 1 122 GLN QB . . 3.250 2.540 2.147 3.237 . 0 0 "[ . 1 . 2]" 1
2036 1 119 GLU QB 1 120 GLU H . . 3.280 2.627 2.130 3.345 0.065 17 0 "[ . 1 . 2]" 1
2037 1 119 GLU QG 1 120 GLU H . . 4.510 4.046 1.866 4.307 . 0 0 "[ . 1 . 2]" 1
2038 1 119 GLU HG2 1 120 GLU H . . 5.220 4.618 2.993 5.049 . 0 0 "[ . 1 . 2]" 1
2039 1 119 GLU HG3 1 120 GLU H . . 5.220 4.557 1.885 5.072 . 0 0 "[ . 1 . 2]" 1
2040 1 120 GLU H 1 120 GLU HB2 . . 3.630 2.324 2.176 2.571 . 0 0 "[ . 1 . 2]" 1
2041 1 120 GLU H 1 120 GLU QB . . 3.060 2.203 2.125 2.308 . 0 0 "[ . 1 . 2]" 1
2042 1 120 GLU H 1 120 GLU HB3 . . 3.630 2.862 2.480 3.541 . 0 0 "[ . 1 . 2]" 1
2043 1 120 GLU H 1 120 GLU HG2 . . 4.730 4.469 3.982 4.631 . 0 0 "[ . 1 . 2]" 1
2044 1 120 GLU H 1 120 GLU QG . . 4.060 3.846 2.700 4.054 . 0 0 "[ . 1 . 2]" 1
2045 1 120 GLU H 1 120 GLU HG3 . . 4.730 4.235 2.744 4.551 . 0 0 "[ . 1 . 2]" 1
2046 1 120 GLU H 1 121 ARG H . . 3.450 2.735 2.212 2.951 . 0 0 "[ . 1 . 2]" 1
2047 1 120 GLU HA 1 120 GLU HG2 . . 3.940 3.202 2.303 3.807 . 0 0 "[ . 1 . 2]" 1
2048 1 120 GLU HA 1 120 GLU QG . . 3.420 2.465 2.177 2.814 . 0 0 "[ . 1 . 2]" 1
2049 1 120 GLU HA 1 120 GLU HG3 . . 3.940 2.676 2.224 3.575 . 0 0 "[ . 1 . 2]" 1
2050 1 120 GLU QB 1 121 ARG H . . 3.380 2.591 2.230 3.086 . 0 0 "[ . 1 . 2]" 1
2051 1 120 GLU HB2 1 121 ARG H . . 3.920 3.617 2.826 3.917 . 0 0 "[ . 1 . 2]" 1
2052 1 120 GLU HB3 1 121 ARG H . . 3.920 2.732 2.256 3.669 . 0 0 "[ . 1 . 2]" 1
2053 1 120 GLU QG 1 121 ARG H . . 4.950 3.989 3.275 4.539 . 0 0 "[ . 1 . 2]" 1
2054 1 121 ARG H 1 121 ARG HB2 . . 3.730 2.271 2.178 2.387 . 0 0 "[ . 1 . 2]" 1
2055 1 121 ARG H 1 121 ARG QB . . 3.010 2.246 2.157 2.354 . 0 0 "[ . 1 . 2]" 1
2056 1 121 ARG H 1 121 ARG HB3 . . 3.730 3.537 3.485 3.615 . 0 0 "[ . 1 . 2]" 1
2057 1 121 ARG H 1 121 ARG HG2 . . 4.140 3.442 2.490 4.155 0.015 18 0 "[ . 1 . 2]" 1
2058 1 121 ARG H 1 121 ARG HG3 . . 4.140 3.243 2.620 3.847 . 0 0 "[ . 1 . 2]" 1
2059 1 121 ARG H 1 122 GLN H . . 3.340 2.539 2.063 2.798 . 0 0 "[ . 1 . 2]" 1
2060 1 121 ARG H 1 122 GLN QB . . 5.440 4.247 3.847 4.529 . 0 0 "[ . 1 . 2]" 1
2061 1 121 ARG HA 1 121 ARG HD2 . . 4.790 4.096 2.332 4.761 . 0 0 "[ . 1 . 2]" 1
2062 1 121 ARG HA 1 121 ARG QD . . 4.170 3.387 2.270 4.124 . 0 0 "[ . 1 . 2]" 1
2063 1 121 ARG HA 1 121 ARG HD3 . . 4.790 3.824 2.289 4.518 . 0 0 "[ . 1 . 2]" 1
2064 1 121 ARG HA 1 121 ARG HG2 . . 3.870 2.549 2.256 3.555 . 0 0 "[ . 1 . 2]" 1
2065 1 121 ARG HA 1 121 ARG QG . . 3.370 2.349 2.181 2.602 . 0 0 "[ . 1 . 2]" 1
2066 1 121 ARG HA 1 121 ARG HG3 . . 3.870 3.178 2.202 3.747 . 0 0 "[ . 1 . 2]" 1
2067 1 121 ARG QB 1 121 ARG QD . . 3.190 2.186 2.000 2.599 . 0 0 "[ . 1 . 2]" 1
2068 1 121 ARG QB 1 122 GLN H . . 3.290 2.667 2.389 2.892 . 0 0 "[ . 1 . 2]" 1
2069 1 121 ARG QB 1 122 GLN HA . . 4.020 3.848 3.763 3.936 . 0 0 "[ . 1 . 2]" 1
2070 1 121 ARG HB2 1 122 GLN H . . 3.770 2.782 2.467 3.023 . 0 0 "[ . 1 . 2]" 1
2071 1 121 ARG HB2 1 122 GLN HA . . 4.810 4.512 4.332 4.649 . 0 0 "[ . 1 . 2]" 1
2072 1 121 ARG HB3 1 122 GLN H . . 3.770 3.442 3.122 3.756 . 0 0 "[ . 1 . 2]" 1
2073 1 121 ARG HB3 1 122 GLN HA . . 4.810 4.184 4.011 4.382 . 0 0 "[ . 1 . 2]" 1
2074 1 122 GLN H 1 122 GLN QB . . 3.050 2.221 2.135 2.271 . 0 0 "[ . 1 . 2]" 1
2075 1 122 GLN H 1 122 GLN HG2 . . 4.610 4.430 2.969 4.616 0.006 19 0 "[ . 1 . 2]" 1
2076 1 122 GLN H 1 122 GLN QG . . 4.030 3.916 2.909 4.038 0.008 20 0 "[ . 1 . 2]" 1
2077 1 122 GLN H 1 122 GLN HG3 . . 4.610 4.407 4.067 4.607 . 0 0 "[ . 1 . 2]" 1
2078 1 122 GLN H 1 123 ARG H . . 3.510 3.031 2.830 3.292 . 0 0 "[ . 1 . 2]" 1
2079 1 122 GLN HA 1 122 GLN HG2 . . 3.890 3.172 2.416 3.877 . 0 0 "[ . 1 . 2]" 1
2080 1 122 GLN HA 1 122 GLN HG3 . . 3.890 2.999 2.436 3.714 . 0 0 "[ . 1 . 2]" 1
2081 1 122 GLN QB 1 122 GLN QE . . 3.900 3.209 2.062 3.655 . 0 0 "[ . 1 . 2]" 1
2082 1 122 GLN QB 1 122 GLN HE22 . . 4.440 3.955 3.305 4.318 . 0 0 "[ . 1 . 2]" 1
2083 1 122 GLN QB 1 123 ARG H . . 3.530 2.302 1.937 3.473 . 0 0 "[ . 1 . 2]" 1
2084 1 122 GLN QG 1 123 ARG H . . 5.070 3.388 2.069 4.108 . 0 0 "[ . 1 . 2]" 1
2085 1 122 GLN QG 1 123 ARG HA . . 4.440 3.824 2.999 4.424 . 0 0 "[ . 1 . 2]" 1
2086 1 123 ARG H 1 123 ARG QB . . 3.060 2.391 2.216 2.777 . 0 0 "[ . 1 . 2]" 1
2087 1 123 ARG H 1 123 ARG HG2 . . 4.050 2.524 1.926 2.792 . 0 0 "[ . 1 . 2]" 1
2088 1 123 ARG H 1 123 ARG QG . . 3.330 2.491 1.917 2.743 . 0 0 "[ . 1 . 2]" 1
2089 1 123 ARG H 1 123 ARG HG3 . . 4.050 3.868 3.453 4.054 0.004 9 0 "[ . 1 . 2]" 1
2090 1 123 ARG HA 1 123 ARG QD . . 4.420 4.325 4.186 4.441 0.021 11 0 "[ . 1 . 2]" 1
2091 1 123 ARG HA 1 123 ARG HG2 . . 3.970 3.673 3.618 3.766 . 0 0 "[ . 1 . 2]" 1
2092 1 123 ARG HA 1 123 ARG HG3 . . 3.970 3.779 3.640 3.931 . 0 0 "[ . 1 . 2]" 1
2093 1 123 ARG QB 1 123 ARG QD . . 3.210 2.107 2.042 2.190 . 0 0 "[ . 1 . 2]" 1
2094 1 123 ARG QB 1 124 ARG H . . 3.410 2.999 2.331 3.405 . 0 0 "[ . 1 . 2]" 1
2095 1 123 ARG QG 1 124 ARG H . . 3.570 2.380 1.830 3.250 . 0 0 "[ . 1 . 2]" 1
2096 1 123 ARG QG 1 124 ARG HA . . 3.550 3.266 2.873 3.555 0.005 9 0 "[ . 1 . 2]" 1
2097 1 123 ARG QG 1 125 ARG H . . 5.340 4.618 1.959 5.191 . 0 0 "[ . 1 . 2]" 1
2098 1 123 ARG HG2 1 124 ARG H . . 4.070 2.846 1.908 4.057 . 0 0 "[ . 1 . 2]" 1
2099 1 123 ARG HG2 1 124 ARG HA . . 4.170 4.057 3.923 4.169 . 0 0 "[ . 1 . 2]" 1
2100 1 123 ARG HG3 1 124 ARG H . . 4.070 2.791 2.351 3.421 . 0 0 "[ . 1 . 2]" 1
2101 1 123 ARG HG3 1 124 ARG HA . . 4.170 3.464 2.955 3.915 . 0 0 "[ . 1 . 2]" 1
2102 1 124 ARG H 1 124 ARG QG . . 3.590 2.959 2.121 3.675 0.085 16 0 "[ . 1 . 2]" 1
2103 1 124 ARG H 1 125 ARG H . . 4.700 4.237 2.720 4.644 . 0 0 "[ . 1 . 2]" 1
2104 1 124 ARG HA 1 124 ARG HG2 . . 3.840 2.701 2.186 3.698 . 0 0 "[ . 1 . 2]" 1
2105 1 124 ARG HA 1 124 ARG HG3 . . 3.840 3.259 2.176 3.850 0.010 12 0 "[ . 1 . 2]" 1
2106 1 124 ARG QB 1 124 ARG QD . . 3.320 2.216 2.034 2.573 . 0 0 "[ . 1 . 2]" 1
2107 1 124 ARG QB 1 125 ARG H . . 3.890 3.000 2.138 3.891 0.001 18 0 "[ . 1 . 2]" 1
2108 1 124 ARG HB2 1 124 ARG QD . . 3.780 2.853 2.106 3.509 . 0 0 "[ . 1 . 2]" 1
2109 1 124 ARG HB3 1 124 ARG QD . . 3.780 2.448 2.078 3.222 . 0 0 "[ . 1 . 2]" 1
2110 1 124 ARG QG 1 125 ARG H . . 5.340 4.068 3.266 4.538 . 0 0 "[ . 1 . 2]" 1
2111 1 125 ARG HA 1 125 ARG QD . . 4.190 3.058 1.972 4.283 0.093 20 0 "[ . 1 . 2]" 1
2112 1 125 ARG HA 1 125 ARG QG . . 3.670 2.774 2.247 3.419 . 0 0 "[ . 1 . 2]" 1
2113 1 125 ARG QB 1 125 ARG QD . . 3.400 2.223 2.010 2.647 . 0 0 "[ . 1 . 2]" 1
2114 1 125 ARG QB 1 126 LYS H . . 4.850 3.166 2.153 3.977 . 0 0 "[ . 1 . 2]" 1
2115 1 126 LYS HA 1 126 LYS QD . . 3.920 3.190 1.968 3.973 0.053 11 0 "[ . 1 . 2]" 1
2116 1 126 LYS HA 1 127 GLN H . . 3.190 2.386 2.151 3.215 0.025 19 0 "[ . 1 . 2]" 1
2117 1 126 LYS HA 1 127 GLN HA . . 4.880 4.412 4.291 4.782 . 0 0 "[ . 1 . 2]" 1
2118 1 126 LYS QB 1 127 GLN H . . 3.870 3.112 2.103 3.902 0.032 19 0 "[ . 1 . 2]" 1
2119 1 126 LYS HB2 1 127 GLN H . . 4.710 4.123 3.544 4.537 . 0 0 "[ . 1 . 2]" 1
2120 1 126 LYS HB3 1 127 GLN H . . 4.710 3.280 2.118 4.388 . 0 0 "[ . 1 . 2]" 1
2121 1 126 LYS QG 1 127 GLN H . . 4.770 3.468 1.947 4.560 . 0 0 "[ . 1 . 2]" 1
2122 1 126 LYS HG2 1 127 GLN H . . 5.500 4.127 2.389 5.054 . 0 0 "[ . 1 . 2]" 1
2123 1 126 LYS HG3 1 127 GLN H . . 5.500 4.092 1.954 5.214 . 0 0 "[ . 1 . 2]" 1
2124 1 127 GLN H 1 127 GLN QB . . 3.560 2.407 2.126 3.039 . 0 0 "[ . 1 . 2]" 1
2125 1 127 GLN H 1 127 GLN QG . . 4.430 3.371 2.095 4.145 . 0 0 "[ . 1 . 2]" 1
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