NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
561833 |
2ltk   |
18485 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2ltk
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 1890
_Distance_constraint_stats_list.Viol_count 4332
_Distance_constraint_stats_list.Viol_total 2421.457
_Distance_constraint_stats_list.Viol_max 0.646
_Distance_constraint_stats_list.Viol_rms 0.0153
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0032
_Distance_constraint_stats_list.Viol_average_violations_only 0.0279
_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 2 ALA 0.305 0.036 3 0 "[ . 1 . 2]"
1 3 MET 1.125 0.076 12 0 "[ . 1 . 2]"
1 4 VAL 0.432 0.076 12 0 "[ . 1 . 2]"
1 5 LYS 0.824 0.042 17 0 "[ . 1 . 2]"
1 6 LYS 0.071 0.033 7 0 "[ . 1 . 2]"
1 7 ASP 0.617 0.061 16 0 "[ . 1 . 2]"
1 8 ILE 0.654 0.038 18 0 "[ . 1 . 2]"
1 9 ASP 0.857 0.063 20 0 "[ . 1 . 2]"
1 10 ASP 0.894 0.081 6 0 "[ . 1 . 2]"
1 11 THR 1.093 0.081 6 0 "[ . 1 . 2]"
1 12 ILE 1.220 0.068 17 0 "[ . 1 . 2]"
1 13 LYS 2.372 0.103 4 0 "[ . 1 . 2]"
1 14 SER 1.749 0.111 19 0 "[ . 1 . 2]"
1 15 GLU 1.220 0.073 14 0 "[ . 1 . 2]"
1 16 ASP 2.382 0.080 10 0 "[ . 1 . 2]"
1 17 VAL 1.993 0.073 14 0 "[ . 1 . 2]"
1 18 VAL 0.311 0.026 19 0 "[ . 1 . 2]"
1 19 THR 0.754 0.038 20 0 "[ . 1 . 2]"
1 20 PHE 0.904 0.038 18 0 "[ . 1 . 2]"
1 21 ILE 1.204 0.089 17 0 "[ . 1 . 2]"
1 22 LYS 1.685 0.105 6 0 "[ . 1 . 2]"
1 23 GLY 1.228 0.037 14 0 "[ . 1 . 2]"
1 24 LEU 4.706 0.125 12 0 "[ . 1 . 2]"
1 25 PRO 2.727 0.089 5 0 "[ . 1 . 2]"
1 26 GLU 2.935 0.106 14 0 "[ . 1 . 2]"
1 27 ALA 1.858 0.082 12 0 "[ . 1 . 2]"
1 28 PRO 2.839 0.105 14 0 "[ . 1 . 2]"
1 29 MET 2.677 0.062 15 0 "[ . 1 . 2]"
1 30 CYS 3.784 0.105 6 0 "[ . 1 . 2]"
1 31 ALA 0.754 0.053 1 0 "[ . 1 . 2]"
1 32 TYR 2.238 0.079 9 0 "[ . 1 . 2]"
1 33 SER 1.625 0.087 2 0 "[ . 1 . 2]"
1 34 LYS 2.823 0.143 14 0 "[ . 1 . 2]"
1 35 ARG 1.174 0.081 10 0 "[ . 1 . 2]"
1 36 MET 1.136 0.059 20 0 "[ . 1 . 2]"
1 37 ILE 1.446 0.053 13 0 "[ . 1 . 2]"
1 38 ASP 3.625 0.129 16 0 "[ . 1 . 2]"
1 39 VAL 4.187 0.129 16 0 "[ . 1 . 2]"
1 40 LEU 1.852 0.059 20 0 "[ . 1 . 2]"
1 41 GLU 0.496 0.030 5 0 "[ . 1 . 2]"
1 42 ALA 2.770 0.090 13 0 "[ . 1 . 2]"
1 43 LEU 0.835 0.044 17 0 "[ . 1 . 2]"
1 44 GLY 0.008 0.008 14 0 "[ . 1 . 2]"
1 45 LEU 3.222 0.107 14 0 "[ . 1 . 2]"
1 46 GLU 3.880 0.127 12 0 "[ . 1 . 2]"
1 47 TYR 2.938 0.089 5 0 "[ . 1 . 2]"
1 48 THR 0.810 0.045 8 0 "[ . 1 . 2]"
1 49 SER 0.740 0.043 11 0 "[ . 1 . 2]"
1 50 PHE 1.252 0.073 15 0 "[ . 1 . 2]"
1 51 ASP 0.180 0.062 5 0 "[ . 1 . 2]"
1 52 VAL 3.270 0.077 1 0 "[ . 1 . 2]"
1 53 LEU 3.862 0.086 13 0 "[ . 1 . 2]"
1 54 ALA 2.578 0.285 19 0 "[ . 1 . 2]"
1 55 HIS 3.400 0.087 15 0 "[ . 1 . 2]"
1 56 PRO 1.913 0.087 15 0 "[ . 1 . 2]"
1 57 VAL 0.918 0.073 5 0 "[ . 1 . 2]"
1 58 VAL 1.898 0.285 19 0 "[ . 1 . 2]"
1 59 ARG 7.200 0.480 20 0 "[ . 1 . 2]"
1 60 SER 1.269 0.085 11 0 "[ . 1 . 2]"
1 61 TYR 2.356 0.068 17 0 "[ . 1 . 2]"
1 62 VAL 10.037 0.646 6 4 "[* .+ * - . 2]"
1 63 LYS 0.891 0.075 8 0 "[ . 1 . 2]"
1 64 GLU 0.312 0.065 20 0 "[ . 1 . 2]"
1 65 VAL 1.800 0.436 8 0 "[ . 1 . 2]"
1 66 SER 1.432 0.436 8 0 "[ . 1 . 2]"
1 67 GLU 0.244 0.044 15 0 "[ . 1 . 2]"
1 68 TRP 1.838 0.068 15 0 "[ . 1 . 2]"
1 69 PRO 2.695 0.646 6 2 "[ .+ - 1 . 2]"
1 70 THR 0.389 0.047 15 0 "[ . 1 . 2]"
1 71 ILE 0.676 0.093 4 0 "[ . 1 . 2]"
1 72 PRO 1.251 0.093 4 0 "[ . 1 . 2]"
1 73 GLN 0.123 0.034 5 0 "[ . 1 . 2]"
1 74 LEU 1.912 0.065 1 0 "[ . 1 . 2]"
1 75 PHE 3.001 0.542 1 2 "[+ . - . 2]"
1 76 ILE 1.422 0.050 7 0 "[ . 1 . 2]"
1 77 LYS 1.869 0.080 9 0 "[ . 1 . 2]"
1 78 ALA 0.734 0.054 2 0 "[ . 1 . 2]"
1 79 GLU 2.039 0.120 15 0 "[ . 1 . 2]"
1 80 PHE 1.225 0.068 15 0 "[ . 1 . 2]"
1 81 VAL 0.449 0.040 20 0 "[ . 1 . 2]"
1 82 GLY 0.016 0.007 18 0 "[ . 1 . 2]"
1 83 GLY 0.141 0.023 15 0 "[ . 1 . 2]"
1 84 LEU 1.500 0.079 9 0 "[ . 1 . 2]"
1 85 ASP 1.153 0.071 17 0 "[ . 1 . 2]"
1 86 ILE 1.291 0.071 17 0 "[ . 1 . 2]"
1 87 VAL 2.922 0.102 16 0 "[ . 1 . 2]"
1 88 THR 2.449 0.091 5 0 "[ . 1 . 2]"
1 89 LYS 2.544 0.085 8 0 "[ . 1 . 2]"
1 90 MET 3.016 0.075 19 0 "[ . 1 . 2]"
1 91 LEU 1.435 0.046 16 0 "[ . 1 . 2]"
1 92 GLU 1.878 0.099 7 0 "[ . 1 . 2]"
1 93 SER 2.641 0.111 2 0 "[ . 1 . 2]"
1 94 GLY 0.085 0.026 12 0 "[ . 1 . 2]"
1 95 ASP 1.363 0.064 16 0 "[ . 1 . 2]"
1 96 LEU 2.454 0.061 4 0 "[ . 1 . 2]"
1 97 LYS 1.387 0.050 12 0 "[ . 1 . 2]"
1 98 LYS 1.368 0.064 16 0 "[ . 1 . 2]"
1 99 MET 4.763 0.082 11 0 "[ . 1 . 2]"
1 100 LEU 1.963 0.087 19 0 "[ . 1 . 2]"
1 101 ARG 4.210 0.087 15 0 "[ . 1 . 2]"
1 102 ASP 4.208 0.097 11 0 "[ . 1 . 2]"
1 103 LYS 3.354 0.101 17 0 "[ . 1 . 2]"
1 104 GLY 1.354 0.065 13 0 "[ . 1 . 2]"
1 105 ILE 2.454 0.091 10 0 "[ . 1 . 2]"
1 106 THR 1.736 0.084 11 0 "[ . 1 . 2]"
1 107 CYS 2.309 0.065 6 0 "[ . 1 . 2]"
1 108 ARG 2.032 0.097 10 0 "[ . 1 . 2]"
1 109 ASP 2.344 0.108 12 0 "[ . 1 . 2]"
1 110 LEU 2.428 0.108 12 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 2 ALA HA 1 3 MET H . . 3.220 2.305 2.060 3.143 . 0 0 "[ . 1 . 2]" 1
2 1 2 ALA HA 1 3 MET HB2 . . 4.460 4.425 4.298 4.474 0.014 6 0 "[ . 1 . 2]" 1
3 1 2 ALA MB 1 3 MET H . . 4.050 2.685 2.026 3.479 . 0 0 "[ . 1 . 2]" 1
4 1 2 ALA MB 1 3 MET HB2 . . 5.110 4.833 4.477 5.146 0.036 3 0 "[ . 1 . 2]" 1
5 1 2 ALA MB 1 4 VAL HA . . 5.230 5.034 4.808 5.253 0.023 12 0 "[ . 1 . 2]" 1
6 1 2 ALA MB 1 4 VAL MG1 . . 3.570 3.547 3.199 3.592 0.022 20 0 "[ . 1 . 2]" 1
7 1 3 MET H 1 3 MET HB2 . . 3.970 2.647 2.285 3.226 . 0 0 "[ . 1 . 2]" 1
8 1 3 MET H 1 3 MET HG2 . . 4.800 4.517 4.423 4.795 . 0 0 "[ . 1 . 2]" 1
9 1 3 MET HA 1 3 MET ME . . 4.760 4.427 4.171 4.539 . 0 0 "[ . 1 . 2]" 1
10 1 3 MET HA 1 3 MET HG2 . . 3.560 2.922 2.518 3.218 . 0 0 "[ . 1 . 2]" 1
11 1 3 MET HA 1 3 MET HG3 . . 3.810 2.577 2.286 3.003 . 0 0 "[ . 1 . 2]" 1
12 1 3 MET HA 1 4 VAL H . . 2.690 2.204 2.052 2.405 . 0 0 "[ . 1 . 2]" 1
13 1 3 MET HA 1 4 VAL MG1 . . 4.230 3.860 3.639 4.235 0.005 12 0 "[ . 1 . 2]" 1
14 1 3 MET HA 1 4 VAL MG2 . . 4.010 3.799 3.682 3.999 . 0 0 "[ . 1 . 2]" 1
15 1 3 MET HB2 1 4 VAL H . . 4.860 4.251 4.081 4.494 . 0 0 "[ . 1 . 2]" 1
16 1 3 MET HB3 1 3 MET ME . . 2.670 2.380 2.187 2.676 0.006 10 0 "[ . 1 . 2]" 1
17 1 3 MET HB3 1 4 VAL H . . 4.210 3.997 3.671 4.286 0.076 12 0 "[ . 1 . 2]" 1
18 1 3 MET HB3 1 7 ASP HB2 . . 4.860 4.884 4.795 4.921 0.061 16 0 "[ . 1 . 2]" 1
19 1 3 MET HB3 1 8 ILE MD . . 5.200 4.868 4.363 5.197 . 0 0 "[ . 1 . 2]" 1
20 1 3 MET HB3 1 57 VAL MG1 . . 4.450 3.773 3.036 4.448 . 0 0 "[ . 1 . 2]" 1
21 1 3 MET HB3 1 57 VAL MG2 . . 4.870 4.339 3.702 4.880 0.010 8 0 "[ . 1 . 2]" 1
22 1 3 MET ME 1 3 MET HG2 . . 3.760 2.969 2.457 3.475 . 0 0 "[ . 1 . 2]" 1
23 1 3 MET ME 1 4 VAL H . . 5.500 5.109 4.525 5.509 0.009 9 0 "[ . 1 . 2]" 1
24 1 3 MET ME 1 8 ILE MD . . 4.020 2.867 2.179 3.582 . 0 0 "[ . 1 . 2]" 1
25 1 3 MET ME 1 8 ILE HG12 . . 4.400 3.709 3.162 4.242 . 0 0 "[ . 1 . 2]" 1
26 1 3 MET ME 1 50 PHE QD . . 3.540 3.016 2.526 3.539 . 0 0 "[ . 1 . 2]" 1
27 1 3 MET ME 1 50 PHE QE . . 3.440 3.339 3.062 3.455 0.015 12 0 "[ . 1 . 2]" 1
28 1 3 MET ME 1 55 HIS HB3 . . 5.280 2.939 2.613 3.503 . 0 0 "[ . 1 . 2]" 1
29 1 3 MET ME 1 55 HIS HD2 . . 4.000 3.822 3.324 4.020 0.020 8 0 "[ . 1 . 2]" 1
30 1 3 MET ME 1 55 HIS HE1 . . 4.860 4.113 2.930 4.873 0.013 10 0 "[ . 1 . 2]" 1
31 1 3 MET ME 1 58 VAL HB . . 4.340 4.345 4.303 4.362 0.022 4 0 "[ . 1 . 2]" 1
32 1 3 MET ME 1 58 VAL QG . . 3.540 2.104 2.027 2.251 . 0 0 "[ . 1 . 2]" 1
33 1 3 MET HG2 1 4 VAL H . . 4.040 2.749 2.231 3.724 . 0 0 "[ . 1 . 2]" 1
34 1 3 MET HG2 1 7 ASP HB2 . . 4.840 2.577 2.227 3.009 . 0 0 "[ . 1 . 2]" 1
35 1 3 MET HG2 1 57 VAL MG1 . . 4.960 3.092 2.320 3.621 . 0 0 "[ . 1 . 2]" 1
36 1 3 MET HG3 1 4 VAL H . . 4.090 3.262 2.461 3.915 . 0 0 "[ . 1 . 2]" 1
37 1 3 MET HG3 1 7 ASP HB3 . . 3.970 3.109 2.744 3.503 . 0 0 "[ . 1 . 2]" 1
38 1 3 MET HG3 1 8 ILE MD . . 5.440 4.744 4.077 5.310 . 0 0 "[ . 1 . 2]" 1
39 1 4 VAL H 1 4 VAL MG1 . . 3.650 2.940 2.746 3.108 . 0 0 "[ . 1 . 2]" 1
40 1 4 VAL H 1 4 VAL MG2 . . 2.930 2.246 2.137 2.350 . 0 0 "[ . 1 . 2]" 1
41 1 4 VAL H 1 7 ASP HB2 . . 4.000 2.769 2.399 3.007 . 0 0 "[ . 1 . 2]" 1
42 1 4 VAL H 1 7 ASP HB3 . . 4.190 4.078 3.917 4.205 0.015 20 0 "[ . 1 . 2]" 1
43 1 4 VAL HA 1 4 VAL MG1 . . 3.070 2.326 2.280 2.381 . 0 0 "[ . 1 . 2]" 1
44 1 4 VAL HA 1 57 VAL MG1 . . 3.830 2.914 2.645 3.341 . 0 0 "[ . 1 . 2]" 1
45 1 4 VAL HA 1 57 VAL MG2 . . 3.880 2.742 2.179 3.227 . 0 0 "[ . 1 . 2]" 1
46 1 4 VAL HB 1 5 LYS H . . 3.430 2.472 2.300 2.639 . 0 0 "[ . 1 . 2]" 1
47 1 4 VAL HB 1 6 LYS H . . 3.970 3.184 3.032 3.359 . 0 0 "[ . 1 . 2]" 1
48 1 4 VAL HB 1 6 LYS HB2 . . 4.810 4.591 3.948 4.815 0.005 12 0 "[ . 1 . 2]" 1
49 1 4 VAL HB 1 6 LYS HB3 . . 4.790 4.029 3.568 4.396 . 0 0 "[ . 1 . 2]" 1
50 1 4 VAL HB 1 57 VAL MG1 . . 4.980 4.560 4.265 4.982 0.002 15 0 "[ . 1 . 2]" 1
51 1 4 VAL MG1 1 5 LYS H . . 4.310 3.702 3.607 3.789 . 0 0 "[ . 1 . 2]" 1
52 1 4 VAL MG1 1 7 ASP H . . 5.170 4.843 4.675 4.979 . 0 0 "[ . 1 . 2]" 1
53 1 4 VAL MG2 1 5 LYS H . . 4.580 3.556 3.415 3.710 . 0 0 "[ . 1 . 2]" 1
54 1 4 VAL MG2 1 6 LYS H . . 3.860 2.735 2.541 2.986 . 0 0 "[ . 1 . 2]" 1
55 1 4 VAL MG2 1 6 LYS HA . . 4.940 4.337 4.122 4.598 . 0 0 "[ . 1 . 2]" 1
56 1 4 VAL MG2 1 6 LYS HB2 . . 3.790 3.460 2.790 3.795 0.005 4 0 "[ . 1 . 2]" 1
57 1 4 VAL MG2 1 6 LYS HB3 . . 3.410 2.290 2.117 2.474 . 0 0 "[ . 1 . 2]" 1
58 1 4 VAL MG2 1 6 LYS QG . . 4.630 3.848 3.526 4.233 . 0 0 "[ . 1 . 2]" 1
59 1 4 VAL MG2 1 7 ASP H . . 3.260 2.271 2.070 2.419 . 0 0 "[ . 1 . 2]" 1
60 1 4 VAL MG2 1 7 ASP HA . . 4.730 4.118 3.881 4.294 . 0 0 "[ . 1 . 2]" 1
61 1 4 VAL MG2 1 7 ASP HB2 . . 4.260 3.509 3.305 3.670 . 0 0 "[ . 1 . 2]" 1
62 1 4 VAL MG2 1 7 ASP HB3 . . 4.480 4.426 4.308 4.493 0.013 9 0 "[ . 1 . 2]" 1
63 1 4 VAL MG2 1 8 ILE H . . 5.050 4.529 4.280 4.741 . 0 0 "[ . 1 . 2]" 1
64 1 5 LYS H 1 5 LYS HB2 . . 3.680 2.312 2.193 2.434 . 0 0 "[ . 1 . 2]" 1
65 1 5 LYS H 1 5 LYS HB3 . . 3.840 2.662 2.520 2.809 . 0 0 "[ . 1 . 2]" 1
66 1 5 LYS H 1 6 LYS HB3 . . 5.210 4.997 4.742 5.243 0.033 7 0 "[ . 1 . 2]" 1
67 1 5 LYS H 1 57 VAL MG2 . . 4.510 3.201 2.551 3.719 . 0 0 "[ . 1 . 2]" 1
68 1 5 LYS HA 1 5 LYS QD . . 4.060 3.639 3.301 4.101 0.041 6 0 "[ . 1 . 2]" 1
69 1 5 LYS HA 1 5 LYS HG2 . . 4.190 2.455 2.251 2.955 . 0 0 "[ . 1 . 2]" 1
70 1 5 LYS HA 1 5 LYS HG3 . . 3.990 3.232 2.249 3.563 . 0 0 "[ . 1 . 2]" 1
71 1 5 LYS HA 1 8 ILE HB . . 4.320 3.447 3.138 3.751 . 0 0 "[ . 1 . 2]" 1
72 1 5 LYS HA 1 8 ILE MD . . 4.140 3.310 2.986 3.691 . 0 0 "[ . 1 . 2]" 1
73 1 5 LYS HA 1 8 ILE HG13 . . 4.820 3.294 2.924 3.661 . 0 0 "[ . 1 . 2]" 1
74 1 5 LYS HA 1 57 VAL MG1 . . 4.310 2.198 2.028 2.412 . 0 0 "[ . 1 . 2]" 1
75 1 5 LYS HA 1 57 VAL MG2 . . 4.820 3.896 3.279 4.327 . 0 0 "[ . 1 . 2]" 1
76 1 5 LYS HA 1 61 TYR QD . . 4.710 3.603 3.405 4.078 . 0 0 "[ . 1 . 2]" 1
77 1 5 LYS HB2 1 57 VAL MG2 . . 4.260 3.186 2.366 3.826 . 0 0 "[ . 1 . 2]" 1
78 1 5 LYS HB3 1 6 LYS H . . 3.820 2.831 2.679 3.125 . 0 0 "[ . 1 . 2]" 1
79 1 5 LYS QD 1 61 TYR QD . . 4.780 2.727 2.185 3.855 . 0 0 "[ . 1 . 2]" 1
80 1 5 LYS QD 1 61 TYR QE . . 4.060 3.296 2.645 4.097 0.037 15 0 "[ . 1 . 2]" 1
81 1 5 LYS QD 1 65 VAL QG . . 4.150 2.753 2.144 3.694 . 0 0 "[ . 1 . 2]" 1
82 1 5 LYS QE 1 57 VAL MG1 . . 5.050 4.819 4.057 5.065 0.015 10 0 "[ . 1 . 2]" 1
83 1 5 LYS QE 1 61 TYR QD . . 4.570 4.121 2.246 4.612 0.042 17 0 "[ . 1 . 2]" 1
84 1 5 LYS QE 1 65 VAL QG . . 4.740 3.417 1.970 4.632 . 0 0 "[ . 1 . 2]" 1
85 1 5 LYS HG2 1 57 VAL MG1 . . 4.200 3.402 2.935 4.210 0.010 2 0 "[ . 1 . 2]" 1
86 1 5 LYS HG2 1 57 VAL MG2 . . 5.040 4.927 4.088 5.073 0.033 15 0 "[ . 1 . 2]" 1
87 1 5 LYS HG2 1 61 TYR QD . . 3.570 2.208 2.102 2.564 . 0 0 "[ . 1 . 2]" 1
88 1 5 LYS HG2 1 61 TYR QE . . 4.790 3.929 3.235 4.457 . 0 0 "[ . 1 . 2]" 1
89 1 5 LYS HG3 1 61 TYR QD . . 3.590 3.328 2.315 3.627 0.037 9 0 "[ . 1 . 2]" 1
90 1 6 LYS H 1 6 LYS HB2 . . 3.240 2.374 2.055 2.521 . 0 0 "[ . 1 . 2]" 1
91 1 6 LYS H 1 6 LYS HB3 . . 3.460 2.549 2.350 2.897 . 0 0 "[ . 1 . 2]" 1
92 1 6 LYS H 1 6 LYS QG . . 4.470 3.955 3.693 4.068 . 0 0 "[ . 1 . 2]" 1
93 1 6 LYS H 1 7 ASP H . . 3.830 2.934 2.876 2.994 . 0 0 "[ . 1 . 2]" 1
94 1 6 LYS HA 1 6 LYS QG . . 3.370 2.560 2.278 3.141 . 0 0 "[ . 1 . 2]" 1
95 1 6 LYS HA 1 9 ASP H . . 3.790 3.249 3.098 3.541 . 0 0 "[ . 1 . 2]" 1
96 1 6 LYS HA 1 9 ASP QB . . 3.090 2.398 2.017 2.944 . 0 0 "[ . 1 . 2]" 1
97 1 6 LYS HA 1 10 ASP H . . 4.600 3.716 3.275 4.120 . 0 0 "[ . 1 . 2]" 1
98 1 6 LYS HB2 1 7 ASP H . . 4.280 4.139 3.774 4.270 . 0 0 "[ . 1 . 2]" 1
99 1 6 LYS HB3 1 6 LYS QE . . 4.900 3.784 2.103 4.320 . 0 0 "[ . 1 . 2]" 1
100 1 6 LYS HB3 1 7 ASP H . . 4.160 3.029 2.763 3.163 . 0 0 "[ . 1 . 2]" 1
101 1 6 LYS QE 1 6 LYS QG . . 2.860 2.334 2.066 2.862 0.002 15 0 "[ . 1 . 2]" 1
102 1 7 ASP H 1 7 ASP HB2 . . 3.510 2.491 2.418 2.563 . 0 0 "[ . 1 . 2]" 1
103 1 7 ASP H 1 7 ASP HB3 . . 3.660 3.637 3.616 3.657 . 0 0 "[ . 1 . 2]" 1
104 1 7 ASP HA 1 7 ASP HB3 . . 3.000 2.508 2.464 2.558 . 0 0 "[ . 1 . 2]" 1
105 1 7 ASP HB2 1 8 ILE H . . 4.120 2.835 2.564 3.068 . 0 0 "[ . 1 . 2]" 1
106 1 7 ASP HB3 1 8 ILE H . . 4.360 3.720 3.446 3.959 . 0 0 "[ . 1 . 2]" 1
107 1 7 ASP HB3 1 8 ILE HA . . 4.830 4.532 4.279 4.780 . 0 0 "[ . 1 . 2]" 1
108 1 8 ILE H 1 8 ILE HB . . 3.700 2.575 2.496 2.617 . 0 0 "[ . 1 . 2]" 1
109 1 8 ILE H 1 8 ILE MD . . 4.230 3.761 3.647 3.992 . 0 0 "[ . 1 . 2]" 1
110 1 8 ILE H 1 8 ILE HG12 . . 4.460 3.285 3.102 3.486 . 0 0 "[ . 1 . 2]" 1
111 1 8 ILE H 1 8 ILE HG13 . . 3.860 2.206 2.061 2.514 . 0 0 "[ . 1 . 2]" 1
112 1 8 ILE H 1 8 ILE MG . . 4.720 3.839 3.813 3.868 . 0 0 "[ . 1 . 2]" 1
113 1 8 ILE H 1 9 ASP H . . 3.810 2.556 2.272 2.683 . 0 0 "[ . 1 . 2]" 1
114 1 8 ILE HA 1 8 ILE MD . . 4.260 3.812 3.767 3.879 . 0 0 "[ . 1 . 2]" 1
115 1 8 ILE HA 1 8 ILE HG12 . . 3.720 2.505 2.429 2.604 . 0 0 "[ . 1 . 2]" 1
116 1 8 ILE HA 1 8 ILE HG13 . . 4.000 3.217 3.127 3.300 . 0 0 "[ . 1 . 2]" 1
117 1 8 ILE HA 1 8 ILE MG . . 3.630 2.410 2.376 2.472 . 0 0 "[ . 1 . 2]" 1
118 1 8 ILE HA 1 11 THR H . . 4.320 3.390 3.147 3.638 . 0 0 "[ . 1 . 2]" 1
119 1 8 ILE HA 1 11 THR HB . . 3.660 2.581 2.455 2.830 . 0 0 "[ . 1 . 2]" 1
120 1 8 ILE HA 1 11 THR MG . . 4.630 3.937 3.796 4.095 . 0 0 "[ . 1 . 2]" 1
121 1 8 ILE HA 1 50 PHE QE . . 3.810 3.453 3.184 3.662 . 0 0 "[ . 1 . 2]" 1
122 1 8 ILE HA 1 50 PHE HZ . . 3.280 2.592 2.402 2.898 . 0 0 "[ . 1 . 2]" 1
123 1 8 ILE HB 1 8 ILE MD . . 3.590 2.506 2.448 2.555 . 0 0 "[ . 1 . 2]" 1
124 1 8 ILE HB 1 9 ASP H . . 3.710 2.614 2.487 2.708 . 0 0 "[ . 1 . 2]" 1
125 1 8 ILE HB 1 61 TYR QD . . 4.730 2.714 2.440 2.969 . 0 0 "[ . 1 . 2]" 1
126 1 8 ILE HB 1 61 TYR QE . . 3.670 3.498 3.203 3.684 0.014 7 0 "[ . 1 . 2]" 1
127 1 8 ILE MD 1 8 ILE MG . . 3.560 2.049 2.024 2.066 . 0 0 "[ . 1 . 2]" 1
128 1 8 ILE MD 1 9 ASP H . . 5.020 4.685 4.540 4.809 . 0 0 "[ . 1 . 2]" 1
129 1 8 ILE MD 1 20 PHE QE . . 4.810 2.660 2.400 2.905 . 0 0 "[ . 1 . 2]" 1
130 1 8 ILE MD 1 20 PHE HZ . . 4.890 3.989 3.808 4.302 . 0 0 "[ . 1 . 2]" 1
131 1 8 ILE MD 1 50 PHE QD . . 4.190 3.568 3.143 3.811 . 0 0 "[ . 1 . 2]" 1
132 1 8 ILE MD 1 50 PHE HZ . . 4.540 4.548 4.444 4.575 0.035 8 0 "[ . 1 . 2]" 1
133 1 8 ILE MD 1 57 VAL HB . . 4.980 3.885 3.465 4.374 . 0 0 "[ . 1 . 2]" 1
134 1 8 ILE MD 1 57 VAL MG1 . . 3.550 2.117 2.001 2.235 . 0 0 "[ . 1 . 2]" 1
135 1 8 ILE MD 1 58 VAL HA . . 3.360 2.123 2.023 2.286 . 0 0 "[ . 1 . 2]" 1
136 1 8 ILE MD 1 58 VAL QG . . 3.430 1.987 1.924 2.053 . 0 0 "[ . 1 . 2]" 1
137 1 8 ILE MD 1 61 TYR H . . 5.020 3.881 3.702 4.189 . 0 0 "[ . 1 . 2]" 1
138 1 8 ILE MD 1 61 TYR HA . . 5.060 4.738 4.396 5.068 0.008 3 0 "[ . 1 . 2]" 1
139 1 8 ILE MD 1 61 TYR HB2 . . 4.410 2.519 2.310 2.901 . 0 0 "[ . 1 . 2]" 1
140 1 8 ILE MD 1 61 TYR HB3 . . 4.670 3.089 2.704 3.731 . 0 0 "[ . 1 . 2]" 1
141 1 8 ILE MD 1 61 TYR QD . . 3.580 3.276 2.978 3.530 . 0 0 "[ . 1 . 2]" 1
142 1 8 ILE HG12 1 50 PHE HZ . . 4.440 3.321 3.062 3.492 . 0 0 "[ . 1 . 2]" 1
143 1 8 ILE MG 1 9 ASP H . . 4.700 3.543 3.416 3.655 . 0 0 "[ . 1 . 2]" 1
144 1 8 ILE MG 1 9 ASP HA . . 4.880 3.589 3.268 3.852 . 0 0 "[ . 1 . 2]" 1
145 1 8 ILE MG 1 11 THR MG . . 5.500 4.265 4.080 4.499 . 0 0 "[ . 1 . 2]" 1
146 1 8 ILE MG 1 12 ILE MD . . 3.740 2.621 2.189 3.131 . 0 0 "[ . 1 . 2]" 1
147 1 8 ILE MG 1 12 ILE HG12 . . 4.620 3.632 2.607 4.393 . 0 0 "[ . 1 . 2]" 1
148 1 8 ILE MG 1 12 ILE HG13 . . 4.760 2.848 2.398 3.166 . 0 0 "[ . 1 . 2]" 1
149 1 8 ILE MG 1 12 ILE MG . . 5.260 4.583 4.405 4.907 . 0 0 "[ . 1 . 2]" 1
150 1 8 ILE MG 1 20 PHE QD . . 4.360 4.373 4.282 4.398 0.038 18 0 "[ . 1 . 2]" 1
151 1 8 ILE MG 1 20 PHE QE . . 3.320 2.448 2.345 2.503 . 0 0 "[ . 1 . 2]" 1
152 1 8 ILE MG 1 20 PHE HZ . . 3.080 2.293 2.190 2.502 . 0 0 "[ . 1 . 2]" 1
153 1 8 ILE MG 1 50 PHE QD . . 4.090 3.464 3.191 3.773 . 0 0 "[ . 1 . 2]" 1
154 1 8 ILE MG 1 50 PHE QE . . 3.680 2.905 2.589 3.165 . 0 0 "[ . 1 . 2]" 1
155 1 8 ILE MG 1 50 PHE HZ . . 4.230 3.223 2.947 3.487 . 0 0 "[ . 1 . 2]" 1
156 1 8 ILE MG 1 58 VAL QG . . 5.500 3.442 3.304 3.600 . 0 0 "[ . 1 . 2]" 1
157 1 8 ILE MG 1 61 TYR QD . . 3.590 2.962 2.859 3.106 . 0 0 "[ . 1 . 2]" 1
158 1 8 ILE MG 1 61 TYR QE . . 3.570 3.258 3.133 3.429 . 0 0 "[ . 1 . 2]" 1
159 1 8 ILE MG 1 62 VAL QG . . 5.500 4.597 4.256 4.825 . 0 0 "[ . 1 . 2]" 1
160 1 9 ASP H 1 9 ASP QB . . 3.160 2.171 2.069 2.244 . 0 0 "[ . 1 . 2]" 1
161 1 9 ASP H 1 9 ASP HB3 . . 3.330 2.719 2.511 2.922 . 0 0 "[ . 1 . 2]" 1
162 1 9 ASP H 1 10 ASP H . . 3.760 2.850 2.776 2.938 . 0 0 "[ . 1 . 2]" 1
163 1 9 ASP H 1 61 TYR QE . . 4.010 3.095 2.737 3.319 . 0 0 "[ . 1 . 2]" 1
164 1 9 ASP HA 1 12 ILE H . . 4.300 3.521 3.176 3.910 . 0 0 "[ . 1 . 2]" 1
165 1 9 ASP HA 1 12 ILE HB . . 3.800 2.769 2.251 3.394 . 0 0 "[ . 1 . 2]" 1
166 1 9 ASP HA 1 12 ILE MD . . 4.270 3.744 3.019 4.333 0.063 20 0 "[ . 1 . 2]" 1
167 1 9 ASP HA 1 61 TYR QD . . 4.620 4.640 4.515 4.681 0.061 9 0 "[ . 1 . 2]" 1
168 1 9 ASP HA 1 61 TYR QE . . 3.960 2.656 2.420 2.946 . 0 0 "[ . 1 . 2]" 1
169 1 9 ASP QB 1 10 ASP H . . 3.430 2.571 2.376 2.837 . 0 0 "[ . 1 . 2]" 1
170 1 9 ASP QB 1 10 ASP HA . . 4.360 4.238 4.116 4.366 0.006 10 0 "[ . 1 . 2]" 1
171 1 9 ASP QB 1 61 TYR QE . . 3.930 2.194 2.047 2.594 . 0 0 "[ . 1 . 2]" 1
172 1 9 ASP HB2 1 61 TYR QE . . 3.510 2.207 2.056 2.620 . 0 0 "[ . 1 . 2]" 1
173 1 9 ASP HB3 1 10 ASP H . . 3.210 2.617 2.404 2.907 . 0 0 "[ . 1 . 2]" 1
174 1 10 ASP H 1 10 ASP HB2 . . 3.440 2.369 2.260 2.496 . 0 0 "[ . 1 . 2]" 1
175 1 10 ASP H 1 10 ASP HB3 . . 3.610 3.018 2.354 3.592 . 0 0 "[ . 1 . 2]" 1
176 1 10 ASP H 1 11 THR H . . 3.630 2.639 2.398 2.772 . 0 0 "[ . 1 . 2]" 1
177 1 10 ASP HA 1 10 ASP HB3 . . 3.020 2.821 2.482 3.049 0.029 20 0 "[ . 1 . 2]" 1
178 1 10 ASP HA 1 13 LYS H . . 3.560 3.319 3.084 3.562 0.002 19 0 "[ . 1 . 2]" 1
179 1 10 ASP HA 1 13 LYS HB2 . . 3.720 2.426 2.306 2.782 . 0 0 "[ . 1 . 2]" 1
180 1 10 ASP HA 1 13 LYS HB3 . . 3.780 3.768 3.628 3.822 0.042 3 0 "[ . 1 . 2]" 1
181 1 10 ASP HB2 1 11 THR H . . 3.820 3.475 2.810 3.901 0.081 6 0 "[ . 1 . 2]" 1
182 1 10 ASP HB3 1 11 THR H . . 3.820 3.179 2.472 3.821 0.001 7 0 "[ . 1 . 2]" 1
183 1 11 THR H 1 11 THR HB . . 3.430 2.584 2.505 2.754 . 0 0 "[ . 1 . 2]" 1
184 1 11 THR H 1 11 THR MG . . 4.100 3.820 3.794 3.846 . 0 0 "[ . 1 . 2]" 1
185 1 11 THR H 1 12 ILE H . . 3.500 2.720 2.551 2.950 . 0 0 "[ . 1 . 2]" 1
186 1 11 THR H 1 50 PHE HZ . . 4.630 4.651 4.597 4.703 0.073 15 0 "[ . 1 . 2]" 1
187 1 11 THR HA 1 11 THR MG . . 3.250 2.367 2.268 2.425 . 0 0 "[ . 1 . 2]" 1
188 1 11 THR HA 1 14 SER H . . 3.710 3.176 2.861 3.491 . 0 0 "[ . 1 . 2]" 1
189 1 11 THR HA 1 15 GLU HG2 . . 4.030 3.395 3.032 3.785 . 0 0 "[ . 1 . 2]" 1
190 1 11 THR HA 1 15 GLU HG3 . . 4.460 4.420 4.260 4.489 0.029 2 0 "[ . 1 . 2]" 1
191 1 11 THR HA 1 18 VAL MG2 . . 5.170 4.783 4.477 5.055 . 0 0 "[ . 1 . 2]" 1
192 1 11 THR HB 1 12 ILE H . . 3.750 2.663 2.506 2.854 . 0 0 "[ . 1 . 2]" 1
193 1 11 THR HB 1 18 VAL MG2 . . 5.300 4.155 3.736 4.556 . 0 0 "[ . 1 . 2]" 1
194 1 11 THR HB 1 50 PHE QE . . 3.360 3.082 2.665 3.365 0.005 15 0 "[ . 1 . 2]" 1
195 1 11 THR HB 1 50 PHE HZ . . 3.140 2.510 2.342 2.687 . 0 0 "[ . 1 . 2]" 1
196 1 11 THR MG 1 12 ILE H . . 4.200 3.562 3.392 3.698 . 0 0 "[ . 1 . 2]" 1
197 1 11 THR MG 1 12 ILE HA . . 5.060 3.774 3.497 4.016 . 0 0 "[ . 1 . 2]" 1
198 1 11 THR MG 1 14 SER H . . 4.950 4.438 4.234 4.633 . 0 0 "[ . 1 . 2]" 1
199 1 11 THR MG 1 15 GLU H . . 4.450 3.777 3.541 4.185 . 0 0 "[ . 1 . 2]" 1
200 1 11 THR MG 1 15 GLU HB2 . . 4.470 3.272 2.791 3.679 . 0 0 "[ . 1 . 2]" 1
201 1 11 THR MG 1 15 GLU HB3 . . 4.840 4.176 3.860 4.387 . 0 0 "[ . 1 . 2]" 1
202 1 11 THR MG 1 15 GLU HG2 . . 3.720 2.470 2.203 2.735 . 0 0 "[ . 1 . 2]" 1
203 1 11 THR MG 1 15 GLU HG3 . . 3.520 2.367 2.216 2.656 . 0 0 "[ . 1 . 2]" 1
204 1 11 THR MG 1 18 VAL MG1 . . 4.420 3.325 3.006 3.674 . 0 0 "[ . 1 . 2]" 1
205 1 11 THR MG 1 18 VAL MG2 . . 3.490 2.657 2.262 3.064 . 0 0 "[ . 1 . 2]" 1
206 1 11 THR MG 1 48 THR H . . 5.210 5.030 4.668 5.223 0.013 16 0 "[ . 1 . 2]" 1
207 1 11 THR MG 1 48 THR HB . . 3.850 2.927 2.611 3.130 . 0 0 "[ . 1 . 2]" 1
208 1 11 THR MG 1 48 THR MG . . 3.080 2.148 2.083 2.261 . 0 0 "[ . 1 . 2]" 1
209 1 11 THR MG 1 50 PHE QE . . 2.840 2.624 2.410 2.844 0.004 16 0 "[ . 1 . 2]" 1
210 1 11 THR MG 1 50 PHE HZ . . 2.860 2.364 2.214 2.531 . 0 0 "[ . 1 . 2]" 1
211 1 12 ILE H 1 12 ILE HB . . 3.240 2.283 2.210 2.347 . 0 0 "[ . 1 . 2]" 1
212 1 12 ILE H 1 12 ILE MD . . 4.460 3.663 3.512 3.902 . 0 0 "[ . 1 . 2]" 1
213 1 12 ILE H 1 12 ILE HG12 . . 4.220 3.167 2.180 3.815 . 0 0 "[ . 1 . 2]" 1
214 1 12 ILE H 1 12 ILE HG13 . . 3.730 2.769 2.404 3.293 . 0 0 "[ . 1 . 2]" 1
215 1 12 ILE H 1 12 ILE MG . . 3.840 3.730 3.696 3.769 . 0 0 "[ . 1 . 2]" 1
216 1 12 ILE H 1 13 LYS H . . 3.310 2.819 2.732 2.896 . 0 0 "[ . 1 . 2]" 1
217 1 12 ILE H 1 50 PHE QE . . 4.770 4.513 4.162 4.781 0.011 19 0 "[ . 1 . 2]" 1
218 1 12 ILE H 1 61 TYR QE . . 5.400 5.422 5.364 5.468 0.068 17 0 "[ . 1 . 2]" 1
219 1 12 ILE HA 1 12 ILE MD . . 4.120 3.264 2.342 3.778 . 0 0 "[ . 1 . 2]" 1
220 1 12 ILE HA 1 12 ILE HG12 . . 3.890 2.489 2.302 2.731 . 0 0 "[ . 1 . 2]" 1
221 1 12 ILE HA 1 12 ILE HG13 . . 3.920 3.105 2.642 3.758 . 0 0 "[ . 1 . 2]" 1
222 1 12 ILE HA 1 12 ILE MG . . 3.350 2.628 2.541 2.672 . 0 0 "[ . 1 . 2]" 1
223 1 12 ILE HA 1 18 VAL MG2 . . 2.930 2.177 2.128 2.285 . 0 0 "[ . 1 . 2]" 1
224 1 12 ILE HB 1 12 ILE MD . . 3.750 2.756 2.421 3.253 . 0 0 "[ . 1 . 2]" 1
225 1 12 ILE HB 1 13 LYS H . . 3.180 2.990 2.689 3.192 0.012 17 0 "[ . 1 . 2]" 1
226 1 12 ILE HB 1 78 ALA HA . . 4.880 4.770 4.585 4.901 0.021 15 0 "[ . 1 . 2]" 1
227 1 12 ILE MD 1 12 ILE MG . . 3.400 2.061 1.976 2.095 . 0 0 "[ . 1 . 2]" 1
228 1 12 ILE MD 1 18 VAL HB . . 4.730 3.226 2.314 4.077 . 0 0 "[ . 1 . 2]" 1
229 1 12 ILE MD 1 18 VAL MG2 . . 4.680 3.404 2.620 4.005 . 0 0 "[ . 1 . 2]" 1
230 1 12 ILE MD 1 20 PHE QD . . 4.390 4.252 4.076 4.364 . 0 0 "[ . 1 . 2]" 1
231 1 12 ILE MD 1 20 PHE QE . . 3.210 2.313 2.235 2.488 . 0 0 "[ . 1 . 2]" 1
232 1 12 ILE MD 1 20 PHE HZ . . 3.140 2.226 2.093 2.441 . 0 0 "[ . 1 . 2]" 1
233 1 12 ILE MD 1 61 TYR QD . . 3.960 3.721 3.401 3.973 0.013 8 0 "[ . 1 . 2]" 1
234 1 12 ILE MD 1 61 TYR QE . . 3.270 2.512 2.288 2.794 . 0 0 "[ . 1 . 2]" 1
235 1 12 ILE MD 1 75 PHE HB2 . . 4.500 3.670 2.813 4.496 . 0 0 "[ . 1 . 2]" 1
236 1 12 ILE MD 1 75 PHE HB3 . . 5.130 3.923 3.059 4.556 . 0 0 "[ . 1 . 2]" 1
237 1 12 ILE MD 1 75 PHE QD . . 3.710 3.346 2.955 3.686 . 0 0 "[ . 1 . 2]" 1
238 1 12 ILE MD 1 75 PHE QE . . 4.110 3.450 3.216 3.696 . 0 0 "[ . 1 . 2]" 1
239 1 12 ILE MD 1 75 PHE HZ . . 4.660 4.065 3.829 4.369 . 0 0 "[ . 1 . 2]" 1
240 1 12 ILE MD 1 78 ALA HA . . 4.820 4.412 3.811 4.825 0.005 18 0 "[ . 1 . 2]" 1
241 1 12 ILE MD 1 78 ALA MB . . 5.270 4.913 4.487 5.271 0.001 11 0 "[ . 1 . 2]" 1
242 1 12 ILE HG13 1 18 VAL MG1 . . 4.360 3.144 2.427 4.162 . 0 0 "[ . 1 . 2]" 1
243 1 12 ILE HG13 1 18 VAL MG2 . . 5.090 3.626 2.617 4.834 . 0 0 "[ . 1 . 2]" 1
244 1 12 ILE HG13 1 20 PHE QE . . 4.460 4.430 4.201 4.491 0.031 5 0 "[ . 1 . 2]" 1
245 1 12 ILE HG13 1 20 PHE HZ . . 4.130 3.877 3.319 4.149 0.019 14 0 "[ . 1 . 2]" 1
246 1 12 ILE MG 1 13 LYS H . . 4.070 3.383 3.172 3.520 . 0 0 "[ . 1 . 2]" 1
247 1 12 ILE MG 1 13 LYS HA . . 4.130 3.658 3.529 3.809 . 0 0 "[ . 1 . 2]" 1
248 1 12 ILE MG 1 13 LYS HB2 . . 5.300 4.630 4.379 4.823 . 0 0 "[ . 1 . 2]" 1
249 1 12 ILE MG 1 13 LYS QE . . 5.400 4.661 4.084 5.396 . 0 0 "[ . 1 . 2]" 1
250 1 12 ILE MG 1 13 LYS HG2 . . 5.230 3.816 3.129 4.608 . 0 0 "[ . 1 . 2]" 1
251 1 12 ILE MG 1 75 PHE HB2 . . 4.340 4.094 3.726 4.344 0.004 4 0 "[ . 1 . 2]" 1
252 1 12 ILE MG 1 75 PHE HB3 . . 4.250 3.400 2.966 3.763 . 0 0 "[ . 1 . 2]" 1
253 1 12 ILE MG 1 75 PHE QD . . 4.040 2.933 2.607 3.154 . 0 0 "[ . 1 . 2]" 1
254 1 12 ILE MG 1 75 PHE QE . . 4.920 3.535 3.097 3.835 . 0 0 "[ . 1 . 2]" 1
255 1 12 ILE MG 1 78 ALA H . . 4.140 3.479 3.225 3.728 . 0 0 "[ . 1 . 2]" 1
256 1 12 ILE MG 1 78 ALA HA . . 3.080 2.076 1.967 2.224 . 0 0 "[ . 1 . 2]" 1
257 1 12 ILE MG 1 78 ALA MB . . 3.330 2.435 2.204 2.669 . 0 0 "[ . 1 . 2]" 1
258 1 13 LYS H 1 13 LYS HB2 . . 3.110 2.036 1.997 2.078 . 0 0 "[ . 1 . 2]" 1
259 1 13 LYS H 1 13 LYS HB3 . . 3.280 3.342 3.302 3.383 0.103 4 0 "[ . 1 . 2]" 1
260 1 13 LYS H 1 13 LYS HG2 . . 4.070 3.439 2.833 4.097 0.027 6 0 "[ . 1 . 2]" 1
261 1 13 LYS H 1 13 LYS HG3 . . 3.720 3.392 2.633 3.759 0.039 15 0 "[ . 1 . 2]" 1
262 1 13 LYS H 1 15 GLU H . . 4.600 4.399 4.138 4.580 . 0 0 "[ . 1 . 2]" 1
263 1 13 LYS H 1 78 ALA MB . . 5.010 4.144 3.817 4.366 . 0 0 "[ . 1 . 2]" 1
264 1 13 LYS HA 1 13 LYS HB3 . . 2.950 2.713 2.622 2.834 . 0 0 "[ . 1 . 2]" 1
265 1 13 LYS HA 1 13 LYS HG2 . . 3.340 2.419 2.113 2.711 . 0 0 "[ . 1 . 2]" 1
266 1 13 LYS HA 1 13 LYS HG3 . . 3.850 3.279 2.644 3.701 . 0 0 "[ . 1 . 2]" 1
267 1 13 LYS HA 1 78 ALA MB . . 2.930 2.361 2.035 2.603 . 0 0 "[ . 1 . 2]" 1
268 1 13 LYS HB3 1 13 LYS QD . . 3.170 2.405 2.287 2.581 . 0 0 "[ . 1 . 2]" 1
269 1 13 LYS HB3 1 14 SER H . . 3.670 3.592 3.259 3.742 0.072 3 0 "[ . 1 . 2]" 1
270 1 13 LYS HB3 1 14 SER HA . . 4.680 4.315 4.005 4.577 . 0 0 "[ . 1 . 2]" 1
271 1 13 LYS HB3 1 14 SER HB2 . . 4.830 4.730 4.392 4.903 0.073 18 0 "[ . 1 . 2]" 1
272 1 13 LYS QE 1 78 ALA MB . . 4.440 3.394 2.171 4.469 0.029 4 0 "[ . 1 . 2]" 1
273 1 13 LYS HG2 1 78 ALA MB . . 3.110 3.000 2.552 3.131 0.021 17 0 "[ . 1 . 2]" 1
274 1 14 SER H 1 14 SER HB2 . . 3.430 2.472 2.142 2.873 . 0 0 "[ . 1 . 2]" 1
275 1 14 SER H 1 14 SER HB3 . . 3.410 2.902 2.344 3.521 0.111 19 0 "[ . 1 . 2]" 1
276 1 14 SER H 1 15 GLU H . . 3.070 2.435 2.235 2.707 . 0 0 "[ . 1 . 2]" 1
277 1 14 SER H 1 15 GLU HG2 . . 4.400 4.259 4.031 4.429 0.029 11 0 "[ . 1 . 2]" 1
278 1 14 SER HA 1 14 SER HB2 . . 2.980 2.687 2.418 3.012 0.032 19 0 "[ . 1 . 2]" 1
279 1 14 SER HA 1 14 SER HB3 . . 3.000 2.827 2.444 3.026 0.026 4 0 "[ . 1 . 2]" 1
280 1 14 SER HB2 1 15 GLU H . . 4.200 3.627 2.869 4.137 . 0 0 "[ . 1 . 2]" 1
281 1 14 SER HB2 1 15 GLU HG2 . . 4.740 4.302 3.515 4.770 0.030 7 0 "[ . 1 . 2]" 1
282 1 14 SER HB3 1 15 GLU H . . 4.040 3.171 2.449 4.051 0.011 5 0 "[ . 1 . 2]" 1
283 1 14 SER HB3 1 15 GLU HG2 . . 4.570 3.481 2.570 4.578 0.008 19 0 "[ . 1 . 2]" 1
284 1 15 GLU H 1 15 GLU HB2 . . 3.400 2.370 2.257 2.504 . 0 0 "[ . 1 . 2]" 1
285 1 15 GLU H 1 15 GLU HB3 . . 3.590 3.589 3.552 3.623 0.033 16 0 "[ . 1 . 2]" 1
286 1 15 GLU H 1 15 GLU HG2 . . 3.640 2.553 2.280 2.901 . 0 0 "[ . 1 . 2]" 1
287 1 15 GLU H 1 15 GLU HG3 . . 3.850 3.735 3.537 3.870 0.020 19 0 "[ . 1 . 2]" 1
288 1 15 GLU H 1 16 ASP H . . 4.850 4.635 4.574 4.688 . 0 0 "[ . 1 . 2]" 1
289 1 15 GLU H 1 18 VAL MG2 . . 4.200 3.753 3.616 3.910 . 0 0 "[ . 1 . 2]" 1
290 1 15 GLU HA 1 15 GLU HG2 . . 3.960 3.033 2.813 3.324 . 0 0 "[ . 1 . 2]" 1
291 1 15 GLU HA 1 15 GLU HG3 . . 4.140 3.771 3.704 3.861 . 0 0 "[ . 1 . 2]" 1
292 1 15 GLU HA 1 16 ASP H . . 2.830 2.364 2.247 2.481 . 0 0 "[ . 1 . 2]" 1
293 1 15 GLU HA 1 16 ASP HB2 . . 4.770 4.687 4.531 4.791 0.021 9 0 "[ . 1 . 2]" 1
294 1 15 GLU HA 1 17 VAL H . . 4.010 4.039 3.948 4.083 0.073 14 0 "[ . 1 . 2]" 1
295 1 15 GLU HB2 1 16 ASP H . . 4.420 3.766 3.519 3.982 . 0 0 "[ . 1 . 2]" 1
296 1 15 GLU HB2 1 17 VAL H . . 4.470 3.884 3.411 4.207 . 0 0 "[ . 1 . 2]" 1
297 1 15 GLU HB2 1 18 VAL MG2 . . 3.400 2.194 2.110 2.334 . 0 0 "[ . 1 . 2]" 1
298 1 15 GLU HB3 1 15 GLU HG3 . . 2.820 2.507 2.407 2.579 . 0 0 "[ . 1 . 2]" 1
299 1 15 GLU HB3 1 16 ASP H . . 3.780 2.584 2.416 2.786 . 0 0 "[ . 1 . 2]" 1
300 1 15 GLU HB3 1 17 VAL H . . 4.020 2.714 2.357 3.120 . 0 0 "[ . 1 . 2]" 1
301 1 15 GLU HB3 1 18 VAL MG2 . . 3.650 2.803 2.470 3.213 . 0 0 "[ . 1 . 2]" 1
302 1 15 GLU HG2 1 18 VAL MG2 . . 5.500 3.753 3.298 4.047 . 0 0 "[ . 1 . 2]" 1
303 1 15 GLU HG2 1 48 THR MG . . 5.070 4.563 4.326 4.812 . 0 0 "[ . 1 . 2]" 1
304 1 15 GLU HG3 1 18 VAL MG2 . . 4.320 2.879 2.301 3.737 . 0 0 "[ . 1 . 2]" 1
305 1 15 GLU HG3 1 48 THR HB . . 4.840 2.545 2.284 3.342 . 0 0 "[ . 1 . 2]" 1
306 1 15 GLU HG3 1 48 THR MG . . 4.820 3.467 3.124 3.776 . 0 0 "[ . 1 . 2]" 1
307 1 16 ASP H 1 16 ASP HB2 . . 3.380 2.457 2.335 2.547 . 0 0 "[ . 1 . 2]" 1
308 1 16 ASP H 1 16 ASP HB3 . . 3.630 3.638 3.595 3.664 0.034 7 0 "[ . 1 . 2]" 1
309 1 16 ASP H 1 17 VAL H . . 3.510 2.117 1.960 2.299 . 0 0 "[ . 1 . 2]" 1
310 1 16 ASP H 1 17 VAL MG2 . . 4.610 4.063 3.899 4.297 . 0 0 "[ . 1 . 2]" 1
311 1 16 ASP H 1 18 VAL MG2 . . 4.560 4.453 4.250 4.581 0.021 13 0 "[ . 1 . 2]" 1
312 1 16 ASP H 1 47 TYR HA . . 4.560 4.575 4.473 4.640 0.080 10 0 "[ . 1 . 2]" 1
313 1 16 ASP HA 1 17 VAL MG2 . . 5.030 4.253 4.100 4.362 . 0 0 "[ . 1 . 2]" 1
314 1 16 ASP HA 1 77 LYS H . . 4.290 3.113 2.943 3.292 . 0 0 "[ . 1 . 2]" 1
315 1 16 ASP HA 1 77 LYS HA . . 2.880 2.931 2.898 2.960 0.080 9 0 "[ . 1 . 2]" 1
316 1 16 ASP HA 1 77 LYS QD . . 3.730 2.554 2.114 3.760 0.030 13 0 "[ . 1 . 2]" 1
317 1 16 ASP HA 1 77 LYS QG . . 3.680 3.197 2.036 3.682 0.002 16 0 "[ . 1 . 2]" 1
318 1 16 ASP HA 1 105 ILE MD . . 4.120 3.835 3.472 4.121 0.001 16 0 "[ . 1 . 2]" 1
319 1 16 ASP HB2 1 17 VAL H . . 3.590 2.881 2.743 3.089 . 0 0 "[ . 1 . 2]" 1
320 1 16 ASP HB2 1 17 VAL MG2 . . 3.930 2.721 2.429 2.980 . 0 0 "[ . 1 . 2]" 1
321 1 16 ASP HB2 1 105 ILE MD . . 3.720 3.453 3.044 3.734 0.014 15 0 "[ . 1 . 2]" 1
322 1 16 ASP HB2 1 105 ILE MG . . 4.170 3.307 2.744 3.772 . 0 0 "[ . 1 . 2]" 1
323 1 16 ASP HB3 1 17 VAL H . . 3.870 3.863 3.713 3.910 0.040 16 0 "[ . 1 . 2]" 1
324 1 16 ASP HB3 1 17 VAL MG2 . . 3.310 3.113 2.667 3.327 0.017 1 0 "[ . 1 . 2]" 1
325 1 16 ASP HB3 1 77 LYS QG . . 4.460 3.423 2.917 3.766 . 0 0 "[ . 1 . 2]" 1
326 1 16 ASP HB3 1 105 ILE MD . . 3.390 2.390 1.971 2.792 . 0 0 "[ . 1 . 2]" 1
327 1 16 ASP HB3 1 105 ILE HG12 . . 4.460 2.904 2.222 4.527 0.067 10 0 "[ . 1 . 2]" 1
328 1 16 ASP HB3 1 105 ILE HG13 . . 4.700 3.680 3.012 4.036 . 0 0 "[ . 1 . 2]" 1
329 1 16 ASP HB3 1 105 ILE MG . . 4.000 3.250 2.787 3.709 . 0 0 "[ . 1 . 2]" 1
330 1 17 VAL H 1 17 VAL HB . . 3.690 2.751 2.693 2.816 . 0 0 "[ . 1 . 2]" 1
331 1 17 VAL H 1 17 VAL MG1 . . 3.880 3.911 3.899 3.924 0.044 5 0 "[ . 1 . 2]" 1
332 1 17 VAL H 1 17 VAL MG2 . . 3.440 2.877 2.751 3.028 . 0 0 "[ . 1 . 2]" 1
333 1 17 VAL H 1 18 VAL MG2 . . 4.000 3.608 3.467 3.683 . 0 0 "[ . 1 . 2]" 1
334 1 17 VAL H 1 47 TYR HA . . 3.960 3.383 3.255 3.492 . 0 0 "[ . 1 . 2]" 1
335 1 17 VAL HA 1 17 VAL MG1 . . 3.180 2.336 2.279 2.372 . 0 0 "[ . 1 . 2]" 1
336 1 17 VAL HA 1 17 VAL MG2 . . 3.340 2.520 2.431 2.564 . 0 0 "[ . 1 . 2]" 1
337 1 17 VAL HA 1 18 VAL H . . 3.210 2.181 2.149 2.216 . 0 0 "[ . 1 . 2]" 1
338 1 17 VAL HA 1 18 VAL MG2 . . 4.910 3.865 3.808 3.917 . 0 0 "[ . 1 . 2]" 1
339 1 17 VAL HA 1 76 ILE HA . . 3.360 2.714 2.451 2.806 . 0 0 "[ . 1 . 2]" 1
340 1 17 VAL HA 1 76 ILE MD . . 3.870 2.523 2.234 3.893 0.023 11 0 "[ . 1 . 2]" 1
341 1 17 VAL HA 1 76 ILE MG . . 5.130 3.962 3.612 4.034 . 0 0 "[ . 1 . 2]" 1
342 1 17 VAL HB 1 47 TYR HA . . 3.440 2.356 2.208 2.613 . 0 0 "[ . 1 . 2]" 1
343 1 17 VAL HB 1 47 TYR QR . . 4.980 4.204 3.999 4.352 . 0 0 "[ . 1 . 2]" 1
344 1 17 VAL MG1 1 18 VAL H . . 4.050 2.778 2.571 2.937 . 0 0 "[ . 1 . 2]" 1
345 1 17 VAL MG1 1 40 LEU MD1 . . 3.940 2.995 2.704 3.102 . 0 0 "[ . 1 . 2]" 1
346 1 17 VAL MG1 1 40 LEU MD2 . . 3.760 2.095 1.987 2.209 . 0 0 "[ . 1 . 2]" 1
347 1 17 VAL MG1 1 47 TYR HA . . 3.870 3.524 3.438 3.645 . 0 0 "[ . 1 . 2]" 1
348 1 17 VAL MG1 1 47 TYR HB2 . . 3.800 2.606 2.418 2.802 . 0 0 "[ . 1 . 2]" 1
349 1 17 VAL MG1 1 47 TYR HB3 . . 3.690 2.388 2.264 2.598 . 0 0 "[ . 1 . 2]" 1
350 1 17 VAL MG1 1 47 TYR QR . . 4.340 3.661 3.435 3.917 . 0 0 "[ . 1 . 2]" 1
351 1 17 VAL MG1 1 76 ILE HG12 . . 4.330 3.860 2.402 4.239 . 0 0 "[ . 1 . 2]" 1
352 1 17 VAL MG2 1 18 VAL H . . 4.280 4.220 4.121 4.276 . 0 0 "[ . 1 . 2]" 1
353 1 17 VAL MG2 1 40 LEU MD1 . . 4.900 4.886 4.639 4.929 0.029 5 0 "[ . 1 . 2]" 1
354 1 17 VAL MG2 1 46 GLU H . . 4.810 3.951 3.594 4.387 . 0 0 "[ . 1 . 2]" 1
355 1 17 VAL MG2 1 47 TYR HA . . 4.410 3.865 3.708 4.150 . 0 0 "[ . 1 . 2]" 1
356 1 17 VAL MG2 1 76 ILE HA . . 3.830 3.633 3.334 3.816 . 0 0 "[ . 1 . 2]" 1
357 1 17 VAL MG2 1 76 ILE MD . . 3.060 2.103 2.043 2.312 . 0 0 "[ . 1 . 2]" 1
358 1 18 VAL H 1 18 VAL HB . . 3.710 2.880 2.834 2.955 . 0 0 "[ . 1 . 2]" 1
359 1 18 VAL H 1 18 VAL MG1 . . 4.390 4.000 3.966 4.042 . 0 0 "[ . 1 . 2]" 1
360 1 18 VAL H 1 18 VAL MG2 . . 3.890 3.070 3.022 3.114 . 0 0 "[ . 1 . 2]" 1
361 1 18 VAL H 1 74 LEU MD1 . . 4.430 3.139 2.994 3.368 . 0 0 "[ . 1 . 2]" 1
362 1 18 VAL H 1 75 PHE H . . 4.270 3.185 3.061 3.330 . 0 0 "[ . 1 . 2]" 1
363 1 18 VAL H 1 75 PHE HB2 . . 4.240 3.183 2.950 3.328 . 0 0 "[ . 1 . 2]" 1
364 1 18 VAL H 1 75 PHE HB3 . . 4.700 3.941 3.647 4.109 . 0 0 "[ . 1 . 2]" 1
365 1 18 VAL H 1 76 ILE MD . . 4.990 3.706 3.502 4.998 0.008 10 0 "[ . 1 . 2]" 1
366 1 18 VAL H 1 76 ILE MG . . 5.370 5.374 5.192 5.396 0.026 19 0 "[ . 1 . 2]" 1
367 1 18 VAL HA 1 18 VAL MG1 . . 3.410 2.403 2.362 2.430 . 0 0 "[ . 1 . 2]" 1
368 1 18 VAL HA 1 18 VAL MG2 . . 3.290 2.359 2.327 2.387 . 0 0 "[ . 1 . 2]" 1
369 1 18 VAL HA 1 19 THR H . . 2.920 2.219 2.188 2.259 . 0 0 "[ . 1 . 2]" 1
370 1 18 VAL HA 1 19 THR MG . . 4.340 3.713 3.616 3.825 . 0 0 "[ . 1 . 2]" 1
371 1 18 VAL HA 1 48 THR H . . 3.700 2.683 2.501 2.849 . 0 0 "[ . 1 . 2]" 1
372 1 18 VAL HA 1 48 THR HB . . 3.820 3.521 3.227 3.824 0.004 3 0 "[ . 1 . 2]" 1
373 1 18 VAL HA 1 48 THR MG . . 4.890 4.295 3.976 4.582 . 0 0 "[ . 1 . 2]" 1
374 1 18 VAL HB 1 19 THR H . . 4.810 4.060 3.942 4.191 . 0 0 "[ . 1 . 2]" 1
375 1 18 VAL HB 1 20 PHE QE . . 4.740 4.447 3.940 4.745 0.005 10 0 "[ . 1 . 2]" 1
376 1 18 VAL HB 1 75 PHE H . . 4.750 4.114 3.998 4.302 . 0 0 "[ . 1 . 2]" 1
377 1 18 VAL HB 1 75 PHE HB2 . . 3.470 2.339 2.213 2.463 . 0 0 "[ . 1 . 2]" 1
378 1 18 VAL HB 1 75 PHE HB3 . . 3.740 3.373 3.061 3.562 . 0 0 "[ . 1 . 2]" 1
379 1 18 VAL HB 1 75 PHE QD . . 4.820 4.135 3.942 4.288 . 0 0 "[ . 1 . 2]" 1
380 1 18 VAL MG1 1 19 THR H . . 3.540 2.394 2.259 2.591 . 0 0 "[ . 1 . 2]" 1
381 1 18 VAL MG1 1 19 THR HA . . 4.500 3.528 3.407 3.668 . 0 0 "[ . 1 . 2]" 1
382 1 18 VAL MG1 1 20 PHE H . . 5.050 4.626 4.448 4.771 . 0 0 "[ . 1 . 2]" 1
383 1 18 VAL MG1 1 20 PHE QE . . 4.790 3.146 2.722 3.475 . 0 0 "[ . 1 . 2]" 1
384 1 18 VAL MG1 1 48 THR HB . . 3.980 3.224 2.800 3.558 . 0 0 "[ . 1 . 2]" 1
385 1 18 VAL MG1 1 49 SER HA . . 4.270 3.945 3.787 4.090 . 0 0 "[ . 1 . 2]" 1
386 1 18 VAL MG1 1 50 PHE QD . . 2.860 2.325 2.153 2.512 . 0 0 "[ . 1 . 2]" 1
387 1 18 VAL MG1 1 50 PHE QE . . 3.740 2.282 2.138 2.419 . 0 0 "[ . 1 . 2]" 1
388 1 18 VAL MG1 1 75 PHE HB2 . . 4.280 3.499 3.308 3.665 . 0 0 "[ . 1 . 2]" 1
389 1 18 VAL MG2 1 19 THR H . . 4.710 3.908 3.814 3.992 . 0 0 "[ . 1 . 2]" 1
390 1 18 VAL MG2 1 48 THR H . . 3.960 3.184 3.007 3.390 . 0 0 "[ . 1 . 2]" 1
391 1 18 VAL MG2 1 48 THR HB . . 3.620 2.438 2.229 2.736 . 0 0 "[ . 1 . 2]" 1
392 1 18 VAL MG2 1 50 PHE QE . . 3.460 3.347 3.192 3.459 . 0 0 "[ . 1 . 2]" 1
393 1 18 VAL MG2 1 75 PHE HB2 . . 4.620 3.913 3.747 4.047 . 0 0 "[ . 1 . 2]" 1
394 1 18 VAL MG2 1 75 PHE HB3 . . 4.690 4.325 3.990 4.497 . 0 0 "[ . 1 . 2]" 1
395 1 19 THR H 1 19 THR MG . . 3.350 2.426 2.343 2.526 . 0 0 "[ . 1 . 2]" 1
396 1 19 THR H 1 20 PHE H . . 4.650 4.440 4.408 4.475 . 0 0 "[ . 1 . 2]" 1
397 1 19 THR H 1 48 THR H . . 4.320 4.084 3.944 4.174 . 0 0 "[ . 1 . 2]" 1
398 1 19 THR H 1 49 SER HA . . 3.550 2.804 2.669 2.918 . 0 0 "[ . 1 . 2]" 1
399 1 19 THR HA 1 19 THR MG . . 3.560 3.260 3.251 3.272 . 0 0 "[ . 1 . 2]" 1
400 1 19 THR HA 1 20 PHE H . . 3.030 2.227 2.165 2.295 . 0 0 "[ . 1 . 2]" 1
401 1 19 THR HA 1 20 PHE QD . . 4.040 3.421 3.022 3.744 . 0 0 "[ . 1 . 2]" 1
402 1 19 THR HA 1 40 LEU MD1 . . 4.960 4.816 4.681 4.977 0.017 18 0 "[ . 1 . 2]" 1
403 1 19 THR HA 1 73 GLN H . . 5.250 4.684 4.542 4.799 . 0 0 "[ . 1 . 2]" 1
404 1 19 THR HA 1 74 LEU HA . . 3.380 2.679 2.525 3.004 . 0 0 "[ . 1 . 2]" 1
405 1 19 THR HA 1 74 LEU MD1 . . 4.440 3.581 3.238 3.998 . 0 0 "[ . 1 . 2]" 1
406 1 19 THR HA 1 75 PHE H . . 4.550 3.463 3.302 3.680 . 0 0 "[ . 1 . 2]" 1
407 1 19 THR HA 1 75 PHE QD . . 4.690 3.861 3.500 4.274 . 0 0 "[ . 1 . 2]" 1
408 1 19 THR HB 1 20 PHE H . . 4.330 3.890 3.780 4.044 . 0 0 "[ . 1 . 2]" 1
409 1 19 THR HB 1 40 LEU MD1 . . 3.390 2.739 2.561 2.906 . 0 0 "[ . 1 . 2]" 1
410 1 19 THR HB 1 40 LEU MD2 . . 5.220 4.051 3.837 4.346 . 0 0 "[ . 1 . 2]" 1
411 1 19 THR HB 1 74 LEU HA . . 4.390 3.188 2.983 3.697 . 0 0 "[ . 1 . 2]" 1
412 1 19 THR HB 1 74 LEU MD1 . . 3.260 2.792 2.279 3.274 0.014 12 0 "[ . 1 . 2]" 1
413 1 19 THR HB 1 74 LEU MD2 . . 4.380 3.309 2.062 4.418 0.038 20 0 "[ . 1 . 2]" 1
414 1 19 THR MG 1 20 PHE H . . 4.310 3.721 3.543 3.862 . 0 0 "[ . 1 . 2]" 1
415 1 19 THR MG 1 36 MET HB3 . . 4.850 4.170 3.693 4.442 . 0 0 "[ . 1 . 2]" 1
416 1 19 THR MG 1 36 MET ME . . 5.020 4.768 4.454 5.055 0.035 1 0 "[ . 1 . 2]" 1
417 1 19 THR MG 1 37 ILE MD . . 3.380 2.581 2.418 2.775 . 0 0 "[ . 1 . 2]" 1
418 1 19 THR MG 1 40 LEU MD1 . . 3.360 2.255 2.101 2.445 . 0 0 "[ . 1 . 2]" 1
419 1 19 THR MG 1 47 TYR QR . . 3.470 2.989 2.634 3.409 . 0 0 "[ . 1 . 2]" 1
420 1 19 THR MG 1 48 THR H . . 4.350 4.353 4.256 4.373 0.023 1 0 "[ . 1 . 2]" 1
421 1 19 THR MG 1 49 SER H . . 4.350 4.255 4.064 4.358 0.008 2 0 "[ . 1 . 2]" 1
422 1 19 THR MG 1 49 SER HA . . 3.430 2.307 2.145 2.430 . 0 0 "[ . 1 . 2]" 1
423 1 19 THR MG 1 49 SER HB2 . . 3.790 2.515 2.414 2.648 . 0 0 "[ . 1 . 2]" 1
424 1 19 THR MG 1 49 SER HB3 . . 3.840 3.800 3.687 3.861 0.021 1 0 "[ . 1 . 2]" 1
425 1 19 THR MG 1 50 PHE H . . 4.280 3.327 3.158 3.467 . 0 0 "[ . 1 . 2]" 1
426 1 20 PHE H 1 20 PHE HB2 . . 4.190 2.576 2.502 2.620 . 0 0 "[ . 1 . 2]" 1
427 1 20 PHE H 1 20 PHE QD . . 3.580 2.918 2.639 3.143 . 0 0 "[ . 1 . 2]" 1
428 1 20 PHE H 1 21 ILE MG . . 4.700 3.505 3.317 3.780 . 0 0 "[ . 1 . 2]" 1
429 1 20 PHE H 1 73 GLN H . . 4.460 2.908 2.831 3.066 . 0 0 "[ . 1 . 2]" 1
430 1 20 PHE HA 1 20 PHE QD . . 3.560 2.970 2.747 3.128 . 0 0 "[ . 1 . 2]" 1
431 1 20 PHE HA 1 20 PHE QE . . 4.740 4.707 4.611 4.754 0.014 2 0 "[ . 1 . 2]" 1
432 1 20 PHE HA 1 21 ILE H . . 3.100 2.173 2.120 2.223 . 0 0 "[ . 1 . 2]" 1
433 1 20 PHE HA 1 21 ILE MG . . 4.190 3.705 3.505 4.103 . 0 0 "[ . 1 . 2]" 1
434 1 20 PHE HA 1 50 PHE H . . 3.660 2.911 2.743 3.107 . 0 0 "[ . 1 . 2]" 1
435 1 20 PHE HA 1 50 PHE HB2 . . 5.500 2.756 2.608 2.920 . 0 0 "[ . 1 . 2]" 1
436 1 20 PHE HA 1 50 PHE HB3 . . 4.100 4.014 3.525 4.119 0.019 20 0 "[ . 1 . 2]" 1
437 1 20 PHE HB2 1 52 VAL MG1 . . 4.680 4.104 3.826 4.559 . 0 0 "[ . 1 . 2]" 1
438 1 20 PHE HB2 1 62 VAL QG . . 5.100 2.907 2.454 3.331 . 0 0 "[ . 1 . 2]" 1
439 1 20 PHE HB2 1 71 ILE MD . . 4.490 3.261 2.589 3.894 . 0 0 "[ . 1 . 2]" 1
440 1 20 PHE HB2 1 73 GLN H . . 4.510 3.079 2.882 3.352 . 0 0 "[ . 1 . 2]" 1
441 1 20 PHE HB2 1 73 GLN QG . . 4.970 3.320 2.197 4.119 . 0 0 "[ . 1 . 2]" 1
442 1 20 PHE HB3 1 52 VAL MG1 . . 3.680 2.757 2.525 3.176 . 0 0 "[ . 1 . 2]" 1
443 1 20 PHE HB3 1 58 VAL QG . . 4.780 3.635 3.461 3.821 . 0 0 "[ . 1 . 2]" 1
444 1 20 PHE HB3 1 62 VAL QG . . 4.960 2.743 2.479 3.078 . 0 0 "[ . 1 . 2]" 1
445 1 20 PHE HB3 1 71 ILE MD . . 4.910 3.158 2.383 3.932 . 0 0 "[ . 1 . 2]" 1
446 1 20 PHE QD 1 50 PHE HB2 . . 4.990 2.855 2.354 3.254 . 0 0 "[ . 1 . 2]" 1
447 1 20 PHE QD 1 50 PHE HB3 . . 3.780 3.223 2.563 3.786 0.006 14 0 "[ . 1 . 2]" 1
448 1 20 PHE QD 1 52 VAL MG1 . . 3.370 3.079 2.845 3.279 . 0 0 "[ . 1 . 2]" 1
449 1 20 PHE QD 1 52 VAL MG2 . . 5.270 5.248 5.071 5.294 0.024 14 0 "[ . 1 . 2]" 1
450 1 20 PHE QD 1 58 VAL QG . . 2.880 2.113 2.020 2.252 . 0 0 "[ . 1 . 2]" 1
451 1 20 PHE QD 1 62 VAL QG . . 3.120 2.756 2.481 3.012 . 0 0 "[ . 1 . 2]" 1
452 1 20 PHE QD 1 75 PHE QE . . 3.510 3.120 2.688 3.514 0.004 17 0 "[ . 1 . 2]" 1
453 1 20 PHE QE 1 58 VAL HA . . 4.660 3.354 3.012 3.642 . 0 0 "[ . 1 . 2]" 1
454 1 20 PHE QE 1 58 VAL QG . . 3.070 2.415 2.261 2.638 . 0 0 "[ . 1 . 2]" 1
455 1 20 PHE QE 1 62 VAL QG . . 5.480 3.253 2.933 3.488 . 0 0 "[ . 1 . 2]" 1
456 1 20 PHE QE 1 75 PHE QD . . 3.410 3.122 2.738 3.423 0.013 1 0 "[ . 1 . 2]" 1
457 1 20 PHE QE 1 75 PHE QE . . 3.640 3.011 2.817 3.238 . 0 0 "[ . 1 . 2]" 1
458 1 21 ILE H 1 21 ILE MD . . 4.810 4.176 4.062 4.301 . 0 0 "[ . 1 . 2]" 1
459 1 21 ILE H 1 21 ILE HG12 . . 3.640 2.636 2.564 2.779 . 0 0 "[ . 1 . 2]" 1
460 1 21 ILE H 1 21 ILE HG13 . . 4.240 3.102 2.629 3.351 . 0 0 "[ . 1 . 2]" 1
461 1 21 ILE H 1 21 ILE MG . . 4.150 2.990 2.861 3.310 . 0 0 "[ . 1 . 2]" 1
462 1 21 ILE HA 1 21 ILE HB . . 2.810 2.370 2.308 2.504 . 0 0 "[ . 1 . 2]" 1
463 1 21 ILE HA 1 21 ILE MD . . 4.780 4.184 4.151 4.221 . 0 0 "[ . 1 . 2]" 1
464 1 21 ILE HA 1 21 ILE MG . . 3.700 2.390 2.253 2.462 . 0 0 "[ . 1 . 2]" 1
465 1 21 ILE HA 1 22 LYS H . . 3.710 2.415 2.188 2.545 . 0 0 "[ . 1 . 2]" 1
466 1 21 ILE HA 1 72 PRO HA . . 5.000 3.259 2.710 3.639 . 0 0 "[ . 1 . 2]" 1
467 1 21 ILE HA 1 72 PRO HB2 . . 4.790 3.497 3.108 4.293 . 0 0 "[ . 1 . 2]" 1
468 1 21 ILE HA 1 72 PRO HB3 . . 3.700 2.313 2.129 2.699 . 0 0 "[ . 1 . 2]" 1
469 1 21 ILE HB 1 21 ILE MD . . 3.610 2.357 2.318 2.404 . 0 0 "[ . 1 . 2]" 1
470 1 21 ILE HB 1 22 LYS H . . 3.520 2.223 1.936 2.602 . 0 0 "[ . 1 . 2]" 1
471 1 21 ILE HB 1 22 LYS HB2 . . 4.340 4.320 4.071 4.429 0.089 17 0 "[ . 1 . 2]" 1
472 1 21 ILE HB 1 33 SER HA . . 3.860 3.183 2.859 3.778 . 0 0 "[ . 1 . 2]" 1
473 1 21 ILE HB 1 33 SER HB2 . . 3.960 3.527 2.262 3.829 . 0 0 "[ . 1 . 2]" 1
474 1 21 ILE HB 1 33 SER HB3 . . 3.640 2.438 2.100 3.694 0.054 7 0 "[ . 1 . 2]" 1
475 1 21 ILE MD 1 21 ILE MG . . 3.460 2.130 2.115 2.150 . 0 0 "[ . 1 . 2]" 1
476 1 21 ILE MD 1 22 LYS H . . 5.130 3.793 3.450 4.415 . 0 0 "[ . 1 . 2]" 1
477 1 21 ILE MD 1 24 LEU H . . 4.830 4.416 4.172 4.615 . 0 0 "[ . 1 . 2]" 1
478 1 21 ILE MD 1 25 PRO HA . . 3.800 2.436 2.148 2.799 . 0 0 "[ . 1 . 2]" 1
479 1 21 ILE MD 1 25 PRO HB2 . . 4.560 4.261 3.973 4.578 0.018 7 0 "[ . 1 . 2]" 1
480 1 21 ILE MD 1 25 PRO HB3 . . 3.970 3.105 2.833 3.592 . 0 0 "[ . 1 . 2]" 1
481 1 21 ILE MD 1 25 PRO HD2 . . 4.970 4.638 4.496 4.887 . 0 0 "[ . 1 . 2]" 1
482 1 21 ILE MD 1 25 PRO HD3 . . 4.170 3.679 3.470 3.869 . 0 0 "[ . 1 . 2]" 1
483 1 21 ILE MD 1 25 PRO HG3 . . 5.190 4.299 3.285 4.796 . 0 0 "[ . 1 . 2]" 1
484 1 21 ILE MD 1 28 PRO HA . . 4.250 3.566 3.357 3.809 . 0 0 "[ . 1 . 2]" 1
485 1 21 ILE MD 1 28 PRO HB2 . . 4.480 3.756 3.588 3.887 . 0 0 "[ . 1 . 2]" 1
486 1 21 ILE MD 1 28 PRO HB3 . . 5.040 2.481 2.422 2.576 . 0 0 "[ . 1 . 2]" 1
487 1 21 ILE MD 1 28 PRO HG2 . . 5.020 5.043 5.031 5.059 0.039 10 0 "[ . 1 . 2]" 1
488 1 21 ILE MD 1 33 SER HB2 . . 4.710 3.818 3.506 4.050 . 0 0 "[ . 1 . 2]" 1
489 1 21 ILE MD 1 33 SER HB3 . . 4.350 2.620 2.103 4.265 . 0 0 "[ . 1 . 2]" 1
490 1 21 ILE MD 1 37 ILE MD . . 3.570 2.386 2.245 2.656 . 0 0 "[ . 1 . 2]" 1
491 1 21 ILE MD 1 37 ILE HG12 . . 4.810 2.768 2.479 3.071 . 0 0 "[ . 1 . 2]" 1
492 1 21 ILE MD 1 37 ILE HG13 . . 4.560 2.824 2.530 3.059 . 0 0 "[ . 1 . 2]" 1
493 1 21 ILE MD 1 37 ILE MG . . 5.210 4.330 4.091 4.554 . 0 0 "[ . 1 . 2]" 1
494 1 21 ILE MD 1 49 SER HB2 . . 5.020 4.038 3.767 4.246 . 0 0 "[ . 1 . 2]" 1
495 1 21 ILE HG13 1 22 LYS H . . 4.850 3.453 3.056 4.314 . 0 0 "[ . 1 . 2]" 1
496 1 21 ILE MG 1 22 LYS H . . 4.080 3.655 3.374 3.830 . 0 0 "[ . 1 . 2]" 1
497 1 21 ILE MG 1 33 SER HA . . 3.750 2.938 2.031 3.346 . 0 0 "[ . 1 . 2]" 1
498 1 21 ILE MG 1 33 SER HB2 . . 4.790 4.429 2.837 4.795 0.005 9 0 "[ . 1 . 2]" 1
499 1 21 ILE MG 1 33 SER HB3 . . 3.940 3.450 3.199 3.977 0.037 2 0 "[ . 1 . 2]" 1
500 1 21 ILE MG 1 36 MET QG . . 4.500 3.029 2.699 4.153 . 0 0 "[ . 1 . 2]" 1
501 1 21 ILE MG 1 37 ILE H . . 5.150 4.112 3.882 4.405 . 0 0 "[ . 1 . 2]" 1
502 1 21 ILE MG 1 37 ILE MD . . 3.660 3.075 2.853 3.354 . 0 0 "[ . 1 . 2]" 1
503 1 21 ILE MG 1 37 ILE HG12 . . 4.040 3.042 2.814 3.253 . 0 0 "[ . 1 . 2]" 1
504 1 21 ILE MG 1 72 PRO HB2 . . 4.010 2.402 2.212 3.392 . 0 0 "[ . 1 . 2]" 1
505 1 21 ILE MG 1 72 PRO HB3 . . 3.620 2.384 2.172 2.793 . 0 0 "[ . 1 . 2]" 1
506 1 21 ILE MG 1 72 PRO HD3 . . 5.500 4.755 4.295 5.387 . 0 0 "[ . 1 . 2]" 1
507 1 22 LYS H 1 22 LYS HB3 . . 4.150 3.263 2.518 3.616 . 0 0 "[ . 1 . 2]" 1
508 1 22 LYS H 1 33 SER HB3 . . 4.250 3.091 2.686 4.260 0.010 10 0 "[ . 1 . 2]" 1
509 1 22 LYS HA 1 22 LYS HD2 . . 4.570 4.464 4.217 4.620 0.050 19 0 "[ . 1 . 2]" 1
510 1 22 LYS HA 1 22 LYS HG2 . . 4.200 2.863 2.555 3.331 . 0 0 "[ . 1 . 2]" 1
511 1 22 LYS HA 1 23 GLY H . . 3.090 2.448 2.336 2.597 . 0 0 "[ . 1 . 2]" 1
512 1 22 LYS HA 1 52 VAL H . . 4.070 3.538 3.212 3.865 . 0 0 "[ . 1 . 2]" 1
513 1 22 LYS HA 1 52 VAL MG2 . . 3.640 2.723 2.413 3.112 . 0 0 "[ . 1 . 2]" 1
514 1 22 LYS HA 1 53 LEU H . . 4.200 3.651 3.455 4.018 . 0 0 "[ . 1 . 2]" 1
515 1 22 LYS HA 1 53 LEU MD1 . . 4.170 3.106 2.792 3.423 . 0 0 "[ . 1 . 2]" 1
516 1 22 LYS HA 1 53 LEU MD2 . . 4.650 3.774 3.447 4.117 . 0 0 "[ . 1 . 2]" 1
517 1 22 LYS HB2 1 22 LYS HD3 . . 3.760 2.828 2.500 3.193 . 0 0 "[ . 1 . 2]" 1
518 1 22 LYS HB3 1 30 CYS HB2 . . 4.220 2.533 2.160 3.251 . 0 0 "[ . 1 . 2]" 1
519 1 22 LYS HD2 1 30 CYS HB2 . . 4.150 3.556 2.728 4.159 0.009 2 0 "[ . 1 . 2]" 1
520 1 22 LYS HD2 1 30 CYS HB3 . . 4.520 3.979 3.087 4.551 0.031 14 0 "[ . 1 . 2]" 1
521 1 22 LYS HD3 1 30 CYS HB2 . . 3.700 2.676 2.219 3.429 . 0 0 "[ . 1 . 2]" 1
522 1 22 LYS HD3 1 30 CYS HB3 . . 4.010 3.602 2.750 4.010 0.000 4 0 "[ . 1 . 2]" 1
523 1 22 LYS HG2 1 30 CYS HB2 . . 4.080 3.953 3.380 4.185 0.105 6 0 "[ . 1 . 2]" 1
524 1 23 GLY H 1 24 LEU H . . 4.480 4.491 4.465 4.505 0.025 17 0 "[ . 1 . 2]" 1
525 1 23 GLY H 1 52 VAL MG2 . . 5.380 4.116 3.571 4.557 . 0 0 "[ . 1 . 2]" 1
526 1 23 GLY H 1 53 LEU HB2 . . 4.920 4.430 4.227 4.668 . 0 0 "[ . 1 . 2]" 1
527 1 23 GLY H 1 53 LEU MD1 . . 4.130 4.110 3.971 4.157 0.027 5 0 "[ . 1 . 2]" 1
528 1 23 GLY HA2 1 24 LEU H . . 3.300 2.683 2.593 2.739 . 0 0 "[ . 1 . 2]" 1
529 1 23 GLY HA2 1 28 PRO HA . . 4.050 3.753 3.614 3.943 . 0 0 "[ . 1 . 2]" 1
530 1 23 GLY HA2 1 29 MET H . . 4.090 3.583 3.352 3.765 . 0 0 "[ . 1 . 2]" 1
531 1 23 GLY HA2 1 29 MET HB2 . . 5.040 4.040 3.360 4.313 . 0 0 "[ . 1 . 2]" 1
532 1 23 GLY HA2 1 29 MET ME . . 4.340 2.179 2.060 2.483 . 0 0 "[ . 1 . 2]" 1
533 1 23 GLY HA2 1 29 MET HG2 . . 4.260 4.257 3.951 4.293 0.033 14 0 "[ . 1 . 2]" 1
534 1 23 GLY HA2 1 29 MET HG3 . . 4.160 2.594 2.220 2.680 . 0 0 "[ . 1 . 2]" 1
535 1 23 GLY HA2 1 53 LEU MD1 . . 4.410 3.857 3.589 3.975 . 0 0 "[ . 1 . 2]" 1
536 1 23 GLY HA3 1 24 LEU H . . 3.260 2.567 2.439 2.707 . 0 0 "[ . 1 . 2]" 1
537 1 23 GLY HA3 1 28 PRO HA . . 3.450 2.055 1.949 2.210 . 0 0 "[ . 1 . 2]" 1
538 1 23 GLY HA3 1 28 PRO HB2 . . 4.590 4.222 3.985 4.538 . 0 0 "[ . 1 . 2]" 1
539 1 23 GLY HA3 1 29 MET H . . 3.770 2.241 2.081 2.420 . 0 0 "[ . 1 . 2]" 1
540 1 23 GLY HA3 1 29 MET HG2 . . 3.900 3.919 3.909 3.935 0.035 2 0 "[ . 1 . 2]" 1
541 1 23 GLY HA3 1 29 MET HG3 . . 4.070 2.429 2.363 2.547 . 0 0 "[ . 1 . 2]" 1
542 1 23 GLY HA3 1 53 LEU MD1 . . 4.550 4.545 4.316 4.587 0.037 14 0 "[ . 1 . 2]" 1
543 1 24 LEU H 1 24 LEU HA . . 2.900 2.872 2.847 2.900 . 0 0 "[ . 1 . 2]" 1
544 1 24 LEU H 1 24 LEU HB2 . . 3.570 1.983 1.929 2.086 . 0 0 "[ . 1 . 2]" 1
545 1 24 LEU H 1 24 LEU HB3 . . 3.430 3.168 3.095 3.312 . 0 0 "[ . 1 . 2]" 1
546 1 24 LEU H 1 24 LEU MD1 . . 4.260 3.097 2.886 3.226 . 0 0 "[ . 1 . 2]" 1
547 1 24 LEU H 1 24 LEU MD2 . . 3.980 3.872 3.520 3.988 0.008 15 0 "[ . 1 . 2]" 1
548 1 24 LEU H 1 24 LEU HG . . 4.250 4.351 4.325 4.375 0.125 12 0 "[ . 1 . 2]" 1
549 1 24 LEU H 1 27 ALA H . . 4.130 4.144 4.030 4.167 0.037 5 0 "[ . 1 . 2]" 1
550 1 24 LEU H 1 27 ALA MB . . 4.260 3.809 3.517 4.258 . 0 0 "[ . 1 . 2]" 1
551 1 24 LEU H 1 29 MET H . . 4.680 4.486 4.274 4.695 0.015 13 0 "[ . 1 . 2]" 1
552 1 24 LEU H 1 29 MET HG3 . . 4.650 3.768 3.423 3.897 . 0 0 "[ . 1 . 2]" 1
553 1 24 LEU HA 1 24 LEU HB3 . . 2.960 2.878 2.826 2.901 . 0 0 "[ . 1 . 2]" 1
554 1 24 LEU HA 1 24 LEU MD1 . . 3.310 2.049 2.003 2.077 . 0 0 "[ . 1 . 2]" 1
555 1 24 LEU HA 1 24 LEU MD2 . . 4.480 3.799 3.764 3.826 . 0 0 "[ . 1 . 2]" 1
556 1 24 LEU HA 1 24 LEU HG . . 4.160 2.643 2.492 2.854 . 0 0 "[ . 1 . 2]" 1
557 1 24 LEU HA 1 25 PRO HD2 . . 3.320 2.885 2.700 3.113 . 0 0 "[ . 1 . 2]" 1
558 1 24 LEU HA 1 25 PRO HD3 . . 3.000 2.131 1.998 2.219 . 0 0 "[ . 1 . 2]" 1
559 1 24 LEU HA 1 25 PRO HG2 . . 5.000 4.754 4.614 4.851 . 0 0 "[ . 1 . 2]" 1
560 1 24 LEU HA 1 25 PRO HG3 . . 4.710 4.331 3.878 4.457 . 0 0 "[ . 1 . 2]" 1
561 1 24 LEU HB2 1 24 LEU MD1 . . 3.570 2.571 2.503 2.762 . 0 0 "[ . 1 . 2]" 1
562 1 24 LEU HB2 1 24 LEU MD2 . . 2.890 2.307 2.212 2.362 . 0 0 "[ . 1 . 2]" 1
563 1 24 LEU HB2 1 25 PRO HD2 . . 4.030 4.053 3.974 4.112 0.082 7 0 "[ . 1 . 2]" 1
564 1 24 LEU HB2 1 25 PRO HD3 . . 4.550 4.526 4.235 4.599 0.049 20 0 "[ . 1 . 2]" 1
565 1 24 LEU HB2 1 27 ALA H . . 3.860 3.410 3.058 3.643 . 0 0 "[ . 1 . 2]" 1
566 1 24 LEU HB3 1 25 PRO HD2 . . 3.590 2.674 2.504 2.764 . 0 0 "[ . 1 . 2]" 1
567 1 24 LEU HB3 1 25 PRO HD3 . . 4.710 3.660 3.293 3.813 . 0 0 "[ . 1 . 2]" 1
568 1 24 LEU HB3 1 26 GLU H . . 4.100 2.831 2.408 3.084 . 0 0 "[ . 1 . 2]" 1
569 1 24 LEU HB3 1 26 GLU HG2 . . 4.150 2.784 2.265 3.394 . 0 0 "[ . 1 . 2]" 1
570 1 24 LEU HB3 1 26 GLU HG3 . . 4.170 3.204 2.840 3.754 . 0 0 "[ . 1 . 2]" 1
571 1 24 LEU HB3 1 27 ALA H . . 3.960 2.258 1.962 2.512 . 0 0 "[ . 1 . 2]" 1
572 1 24 LEU HB3 1 27 ALA MB . . 3.490 2.894 2.552 3.490 0.000 2 0 "[ . 1 . 2]" 1
573 1 24 LEU MD1 1 25 PRO HD2 . . 3.780 3.460 3.311 3.783 0.003 3 0 "[ . 1 . 2]" 1
574 1 24 LEU MD1 1 25 PRO HD3 . . 3.830 3.043 2.991 3.077 . 0 0 "[ . 1 . 2]" 1
575 1 24 LEU MD1 1 25 PRO HG3 . . 4.810 4.860 4.847 4.877 0.067 3 0 "[ . 1 . 2]" 1
576 1 24 LEU MD1 1 27 ALA H . . 5.250 5.040 4.840 5.258 0.008 2 0 "[ . 1 . 2]" 1
577 1 24 LEU MD1 1 51 ASP HB3 . . 4.400 3.969 2.688 4.412 0.012 17 0 "[ . 1 . 2]" 1
578 1 24 LEU MD2 1 25 PRO HD3 . . 4.680 4.394 3.960 4.687 0.007 6 0 "[ . 1 . 2]" 1
579 1 24 LEU MD2 1 26 GLU QB . . 5.190 4.518 4.311 5.120 . 0 0 "[ . 1 . 2]" 1
580 1 24 LEU MD2 1 26 GLU HG2 . . 4.550 2.953 2.634 3.741 . 0 0 "[ . 1 . 2]" 1
581 1 24 LEU MD2 1 26 GLU HG3 . . 4.440 3.016 2.579 3.631 . 0 0 "[ . 1 . 2]" 1
582 1 24 LEU MD2 1 27 ALA H . . 4.110 3.948 3.631 4.135 0.025 18 0 "[ . 1 . 2]" 1
583 1 24 LEU MD2 1 27 ALA MB . . 3.940 3.076 2.625 3.772 . 0 0 "[ . 1 . 2]" 1
584 1 25 PRO HA 1 27 ALA H . . 4.210 4.088 3.806 4.232 0.022 15 0 "[ . 1 . 2]" 1
585 1 25 PRO HA 1 37 ILE HB . . 4.900 4.543 4.328 4.686 . 0 0 "[ . 1 . 2]" 1
586 1 25 PRO HA 1 37 ILE MD . . 3.870 2.871 2.669 3.205 . 0 0 "[ . 1 . 2]" 1
587 1 25 PRO HA 1 37 ILE HG12 . . 4.590 3.736 3.547 3.885 . 0 0 "[ . 1 . 2]" 1
588 1 25 PRO HA 1 37 ILE HG13 . . 3.440 2.289 2.213 2.369 . 0 0 "[ . 1 . 2]" 1
589 1 25 PRO HA 1 37 ILE MG . . 3.860 3.453 3.081 3.695 . 0 0 "[ . 1 . 2]" 1
590 1 25 PRO HB2 1 26 GLU H . . 4.510 3.402 2.628 3.804 . 0 0 "[ . 1 . 2]" 1
591 1 25 PRO HB2 1 37 ILE MD . . 3.960 2.582 2.353 3.645 . 0 0 "[ . 1 . 2]" 1
592 1 25 PRO HB2 1 37 ILE HG13 . . 4.690 3.559 3.139 4.293 . 0 0 "[ . 1 . 2]" 1
593 1 25 PRO HB2 1 37 ILE MG . . 3.820 3.020 2.481 3.779 . 0 0 "[ . 1 . 2]" 1
594 1 25 PRO HB2 1 47 TYR QR . . 4.740 3.182 2.608 4.199 . 0 0 "[ . 1 . 2]" 1
595 1 25 PRO HB3 1 26 GLU H . . 4.300 4.189 4.017 4.316 0.016 16 0 "[ . 1 . 2]" 1
596 1 25 PRO HB3 1 47 TYR QR . . 4.930 3.069 2.649 3.277 . 0 0 "[ . 1 . 2]" 1
597 1 25 PRO HB3 1 47 TYR QE . . 3.300 3.104 2.663 3.328 0.028 1 0 "[ . 1 . 2]" 1
598 1 25 PRO HB3 1 49 SER HB2 . . 4.240 3.169 2.866 3.886 . 0 0 "[ . 1 . 2]" 1
599 1 25 PRO HB3 1 49 SER HB3 . . 3.970 2.878 2.413 3.562 . 0 0 "[ . 1 . 2]" 1
600 1 25 PRO HD2 1 26 GLU H . . 4.130 2.242 2.107 2.507 . 0 0 "[ . 1 . 2]" 1
601 1 25 PRO HD3 1 26 GLU H . . 4.850 3.681 3.546 3.863 . 0 0 "[ . 1 . 2]" 1
602 1 25 PRO HD3 1 49 SER HB3 . . 4.920 3.632 3.139 4.218 . 0 0 "[ . 1 . 2]" 1
603 1 25 PRO HG2 1 37 ILE MD . . 4.330 4.348 4.334 4.369 0.039 6 0 "[ . 1 . 2]" 1
604 1 25 PRO HG2 1 47 TYR QR . . 4.510 4.196 3.836 4.599 0.089 5 0 "[ . 1 . 2]" 1
605 1 25 PRO HG2 1 49 SER HB3 . . 4.600 4.108 3.159 4.602 0.002 5 0 "[ . 1 . 2]" 1
606 1 25 PRO HG3 1 26 GLU H . . 4.520 4.062 3.793 4.431 . 0 0 "[ . 1 . 2]" 1
607 1 25 PRO HG3 1 37 ILE MD . . 4.760 3.913 3.467 4.092 . 0 0 "[ . 1 . 2]" 1
608 1 25 PRO HG3 1 37 ILE MG . . 5.300 5.245 4.751 5.324 0.024 16 0 "[ . 1 . 2]" 1
609 1 25 PRO HG3 1 47 TYR QR . . 4.420 3.631 3.278 4.360 . 0 0 "[ . 1 . 2]" 1
610 1 26 GLU H 1 26 GLU QB . . 3.190 2.668 2.504 2.785 . 0 0 "[ . 1 . 2]" 1
611 1 26 GLU H 1 26 GLU HG2 . . 3.860 1.903 1.771 2.098 . 0 0 "[ . 1 . 2]" 1
612 1 26 GLU H 1 26 GLU HG3 . . 3.680 3.118 2.908 3.477 . 0 0 "[ . 1 . 2]" 1
613 1 26 GLU H 1 27 ALA H . . 3.370 2.493 2.294 2.608 . 0 0 "[ . 1 . 2]" 1
614 1 26 GLU H 1 27 ALA MB . . 4.420 4.347 4.228 4.425 0.005 19 0 "[ . 1 . 2]" 1
615 1 26 GLU H 1 28 PRO HD3 . . 4.810 4.284 4.048 4.523 . 0 0 "[ . 1 . 2]" 1
616 1 26 GLU HA 1 26 GLU QB . . 2.600 2.138 2.109 2.173 . 0 0 "[ . 1 . 2]" 1
617 1 26 GLU HA 1 26 GLU HG2 . . 3.580 3.664 3.645 3.686 0.106 14 0 "[ . 1 . 2]" 1
618 1 26 GLU HA 1 26 GLU HG3 . . 3.760 3.767 3.734 3.797 0.037 20 0 "[ . 1 . 2]" 1
619 1 26 GLU HA 1 28 PRO HD2 . . 4.690 4.685 4.508 4.715 0.025 1 0 "[ . 1 . 2]" 1
620 1 26 GLU HA 1 28 PRO HD3 . . 3.920 3.875 3.739 3.945 0.025 1 0 "[ . 1 . 2]" 1
621 1 26 GLU QB 1 27 ALA H . . 3.690 3.722 3.664 3.772 0.082 12 0 "[ . 1 . 2]" 1
622 1 26 GLU QB 1 27 ALA MB . . 4.140 3.918 3.764 4.067 . 0 0 "[ . 1 . 2]" 1
623 1 26 GLU HG2 1 27 ALA H . . 4.380 3.085 2.715 3.397 . 0 0 "[ . 1 . 2]" 1
624 1 26 GLU HG2 1 27 ALA MB . . 4.020 3.874 3.403 4.031 0.011 5 0 "[ . 1 . 2]" 1
625 1 26 GLU HG3 1 27 ALA H . . 4.180 2.977 2.656 3.227 . 0 0 "[ . 1 . 2]" 1
626 1 26 GLU HG3 1 27 ALA MB . . 3.930 2.776 2.514 3.088 . 0 0 "[ . 1 . 2]" 1
627 1 27 ALA H 1 27 ALA MB . . 3.510 2.645 2.541 2.728 . 0 0 "[ . 1 . 2]" 1
628 1 27 ALA H 1 28 PRO HD2 . . 3.970 3.776 3.640 3.884 . 0 0 "[ . 1 . 2]" 1
629 1 27 ALA H 1 28 PRO HD3 . . 3.380 2.802 2.567 2.988 . 0 0 "[ . 1 . 2]" 1
630 1 27 ALA HA 1 28 PRO HD2 . . 2.930 2.358 2.291 2.415 . 0 0 "[ . 1 . 2]" 1
631 1 27 ALA HA 1 28 PRO HD3 . . 3.080 3.100 3.085 3.119 0.039 11 0 "[ . 1 . 2]" 1
632 1 27 ALA HA 1 28 PRO HG2 . . 4.540 4.486 4.401 4.546 0.006 12 0 "[ . 1 . 2]" 1
633 1 27 ALA MB 1 28 PRO HD2 . . 4.120 3.998 3.950 4.039 . 0 0 "[ . 1 . 2]" 1
634 1 27 ALA MB 1 28 PRO HD3 . . 4.310 4.196 4.153 4.242 . 0 0 "[ . 1 . 2]" 1
635 1 27 ALA MB 1 29 MET HG2 . . 4.880 4.833 4.412 4.912 0.032 15 0 "[ . 1 . 2]" 1
636 1 28 PRO HA 1 29 MET H . . 3.200 2.199 2.135 2.253 . 0 0 "[ . 1 . 2]" 1
637 1 28 PRO HA 1 29 MET HG2 . . 4.430 4.315 4.070 4.443 0.013 9 0 "[ . 1 . 2]" 1
638 1 28 PRO HA 1 30 CYS H . . 3.910 3.878 3.768 3.948 0.038 2 0 "[ . 1 . 2]" 1
639 1 28 PRO HB2 1 29 MET H . . 4.320 3.022 2.830 3.309 . 0 0 "[ . 1 . 2]" 1
640 1 28 PRO HB2 1 30 CYS H . . 3.980 2.392 2.170 2.891 . 0 0 "[ . 1 . 2]" 1
641 1 28 PRO HB2 1 30 CYS HB2 . . 4.590 4.659 4.631 4.695 0.105 14 0 "[ . 1 . 2]" 1
642 1 28 PRO HB2 1 33 SER HB2 . . 4.380 2.619 2.026 4.305 . 0 0 "[ . 1 . 2]" 1
643 1 28 PRO HB2 1 33 SER HB3 . . 3.670 2.887 2.103 3.189 . 0 0 "[ . 1 . 2]" 1
644 1 28 PRO HB3 1 29 MET H . . 4.060 3.646 3.415 3.848 . 0 0 "[ . 1 . 2]" 1
645 1 28 PRO HB3 1 30 CYS H . . 4.460 4.047 3.841 4.410 . 0 0 "[ . 1 . 2]" 1
646 1 28 PRO HB3 1 33 SER HB2 . . 4.320 3.444 2.666 4.407 0.087 2 0 "[ . 1 . 2]" 1
647 1 28 PRO HD2 1 34 LYS QG . . 4.810 3.986 3.544 4.656 . 0 0 "[ . 1 . 2]" 1
648 1 28 PRO HG2 1 34 LYS HA . . 3.670 3.343 2.831 3.683 0.013 4 0 "[ . 1 . 2]" 1
649 1 28 PRO HG2 1 34 LYS QG . . 4.440 3.251 2.513 4.044 . 0 0 "[ . 1 . 2]" 1
650 1 28 PRO HG3 1 34 LYS HA . . 3.730 2.292 2.119 2.682 . 0 0 "[ . 1 . 2]" 1
651 1 28 PRO HG3 1 34 LYS QG . . 4.230 3.193 2.691 3.899 . 0 0 "[ . 1 . 2]" 1
652 1 29 MET H 1 29 MET HB2 . . 4.030 2.521 2.437 2.627 . 0 0 "[ . 1 . 2]" 1
653 1 29 MET H 1 29 MET HG2 . . 4.140 3.289 3.126 3.463 . 0 0 "[ . 1 . 2]" 1
654 1 29 MET H 1 29 MET HG3 . . 4.340 2.438 2.199 2.676 . 0 0 "[ . 1 . 2]" 1
655 1 29 MET H 1 30 CYS H . . 3.660 2.619 2.470 2.887 . 0 0 "[ . 1 . 2]" 1
656 1 29 MET HA 1 29 MET HG2 . . 3.900 2.496 2.380 2.685 . 0 0 "[ . 1 . 2]" 1
657 1 29 MET HB2 1 29 MET ME . . 3.510 2.770 2.593 2.968 . 0 0 "[ . 1 . 2]" 1
658 1 29 MET HB2 1 53 LEU MD1 . . 3.550 2.785 2.358 3.043 . 0 0 "[ . 1 . 2]" 1
659 1 29 MET HB3 1 29 MET ME . . 3.510 3.544 3.520 3.572 0.062 15 0 "[ . 1 . 2]" 1
660 1 29 MET HB3 1 53 LEU MD1 . . 4.340 3.617 3.097 3.920 . 0 0 "[ . 1 . 2]" 1
661 1 29 MET ME 1 29 MET HG2 . . 3.200 3.216 3.194 3.240 0.040 7 0 "[ . 1 . 2]" 1
662 1 29 MET ME 1 29 MET HG3 . . 3.860 2.191 2.150 2.238 . 0 0 "[ . 1 . 2]" 1
663 1 29 MET ME 1 53 LEU HB2 . . 3.330 2.267 2.097 2.457 . 0 0 "[ . 1 . 2]" 1
664 1 29 MET ME 1 53 LEU HB3 . . 2.740 2.741 2.580 2.760 0.020 2 0 "[ . 1 . 2]" 1
665 1 29 MET ME 1 53 LEU MD1 . . 3.660 1.934 1.872 2.031 . 0 0 "[ . 1 . 2]" 1
666 1 29 MET ME 1 53 LEU MD2 . . 4.080 3.969 3.922 4.047 . 0 0 "[ . 1 . 2]" 1
667 1 29 MET ME 1 53 LEU HG . . 3.300 3.327 3.301 3.355 0.055 20 0 "[ . 1 . 2]" 1
668 1 29 MET HG3 1 53 LEU MD1 . . 3.910 3.720 3.360 3.873 . 0 0 "[ . 1 . 2]" 1
669 1 30 CYS H 1 30 CYS HB2 . . 4.130 2.963 2.529 3.223 . 0 0 "[ . 1 . 2]" 1
670 1 30 CYS H 1 30 CYS HB3 . . 4.070 3.073 2.626 3.756 . 0 0 "[ . 1 . 2]" 1
671 1 30 CYS H 1 33 SER H . . 4.400 4.432 4.346 4.463 0.063 6 0 "[ . 1 . 2]" 1
672 1 30 CYS H 1 33 SER HB2 . . 4.000 3.189 2.753 4.051 0.051 7 0 "[ . 1 . 2]" 1
673 1 30 CYS H 1 33 SER HB3 . . 4.640 4.150 2.694 4.648 0.008 20 0 "[ . 1 . 2]" 1
674 1 30 CYS H 1 34 LYS H . . 4.940 4.183 3.754 4.468 . 0 0 "[ . 1 . 2]" 1
675 1 30 CYS HB3 1 31 ALA MB . . 5.060 4.906 4.221 5.113 0.053 1 0 "[ . 1 . 2]" 1
676 1 30 CYS HB3 1 32 TYR H . . 4.460 4.003 3.463 4.379 . 0 0 "[ . 1 . 2]" 1
677 1 31 ALA HA 1 34 LYS H . . 4.020 3.508 3.249 3.687 . 0 0 "[ . 1 . 2]" 1
678 1 31 ALA HA 1 34 LYS HB2 . . 3.610 3.501 2.850 3.640 0.030 12 0 "[ . 1 . 2]" 1
679 1 31 ALA HA 1 34 LYS QG . . 4.630 4.496 4.221 4.667 0.037 14 0 "[ . 1 . 2]" 1
680 1 31 ALA HA 1 35 ARG H . . 4.700 4.201 4.068 4.554 . 0 0 "[ . 1 . 2]" 1
681 1 31 ALA MB 1 32 TYR H . . 3.950 2.371 2.164 2.560 . 0 0 "[ . 1 . 2]" 1
682 1 31 ALA MB 1 32 TYR HA . . 5.100 3.891 3.805 4.013 . 0 0 "[ . 1 . 2]" 1
683 1 31 ALA MB 1 32 TYR QD . . 3.470 3.399 3.085 3.496 0.026 12 0 "[ . 1 . 2]" 1
684 1 31 ALA MB 1 32 TYR QE . . 3.670 3.613 3.424 3.698 0.028 17 0 "[ . 1 . 2]" 1
685 1 32 TYR H 1 32 TYR HB2 . . 3.870 2.629 2.488 2.723 . 0 0 "[ . 1 . 2]" 1
686 1 32 TYR H 1 32 TYR HB3 . . 4.080 3.605 3.551 3.661 . 0 0 "[ . 1 . 2]" 1
687 1 32 TYR H 1 32 TYR QD . . 3.230 2.291 2.005 2.664 . 0 0 "[ . 1 . 2]" 1
688 1 32 TYR H 1 32 TYR QE . . 4.070 3.955 3.801 4.075 0.005 5 0 "[ . 1 . 2]" 1
689 1 32 TYR H 1 33 SER H . . 3.500 2.745 2.670 2.880 . 0 0 "[ . 1 . 2]" 1
690 1 32 TYR H 1 34 LYS H . . 4.600 4.379 4.245 4.486 . 0 0 "[ . 1 . 2]" 1
691 1 32 TYR HA 1 32 TYR QD . . 2.920 2.759 2.462 2.950 0.030 9 0 "[ . 1 . 2]" 1
692 1 32 TYR HA 1 35 ARG H . . 4.040 3.145 2.905 3.346 . 0 0 "[ . 1 . 2]" 1
693 1 32 TYR HA 1 35 ARG HB2 . . 3.850 2.751 2.450 3.340 . 0 0 "[ . 1 . 2]" 1
694 1 32 TYR HA 1 35 ARG HB3 . . 3.760 2.589 2.382 2.964 . 0 0 "[ . 1 . 2]" 1
695 1 32 TYR HA 1 84 LEU MD1 . . 3.620 3.221 2.563 3.565 . 0 0 "[ . 1 . 2]" 1
696 1 32 TYR HA 1 84 LEU MD2 . . 5.090 3.932 3.746 4.389 . 0 0 "[ . 1 . 2]" 1
697 1 32 TYR HB2 1 33 SER H . . 4.620 2.998 2.814 3.098 . 0 0 "[ . 1 . 2]" 1
698 1 32 TYR HB2 1 72 PRO HD2 . . 4.210 2.953 2.657 3.771 . 0 0 "[ . 1 . 2]" 1
699 1 32 TYR HB2 1 72 PRO HG2 . . 4.980 4.368 3.071 5.005 0.025 5 0 "[ . 1 . 2]" 1
700 1 32 TYR HB2 1 72 PRO HG3 . . 4.840 3.572 3.018 4.044 . 0 0 "[ . 1 . 2]" 1
701 1 32 TYR HB2 1 84 LEU MD1 . . 4.520 4.499 3.565 4.599 0.079 9 0 "[ . 1 . 2]" 1
702 1 32 TYR HB3 1 72 PRO HD2 . . 3.950 2.697 2.445 3.176 . 0 0 "[ . 1 . 2]" 1
703 1 32 TYR HB3 1 72 PRO HD3 . . 4.080 3.315 2.942 3.904 . 0 0 "[ . 1 . 2]" 1
704 1 32 TYR HB3 1 72 PRO HG2 . . 4.860 3.777 3.232 4.095 . 0 0 "[ . 1 . 2]" 1
705 1 32 TYR HB3 1 84 LEU MD1 . . 3.890 3.079 2.088 3.223 . 0 0 "[ . 1 . 2]" 1
706 1 32 TYR HB3 1 84 LEU MD2 . . 4.600 4.008 3.856 4.611 0.011 5 0 "[ . 1 . 2]" 1
707 1 32 TYR QD 1 33 SER H . . 4.110 4.128 4.044 4.168 0.058 2 0 "[ . 1 . 2]" 1
708 1 32 TYR QD 1 72 PRO HD2 . . 4.220 4.245 4.135 4.284 0.064 14 0 "[ . 1 . 2]" 1
709 1 32 TYR QD 1 84 LEU MD1 . . 2.880 2.092 1.974 2.255 . 0 0 "[ . 1 . 2]" 1
710 1 32 TYR QD 1 84 LEU MD2 . . 4.260 4.219 4.098 4.275 0.015 20 0 "[ . 1 . 2]" 1
711 1 32 TYR QE 1 84 LEU MD1 . . 3.560 3.519 3.330 3.602 0.042 5 0 "[ . 1 . 2]" 1
712 1 33 SER H 1 34 LYS H . . 4.210 2.660 2.552 2.864 . 0 0 "[ . 1 . 2]" 1
713 1 33 SER HB2 1 34 LYS H . . 4.260 2.948 2.383 4.037 . 0 0 "[ . 1 . 2]" 1
714 1 34 LYS H 1 34 LYS HB2 . . 3.520 2.407 2.278 2.524 . 0 0 "[ . 1 . 2]" 1
715 1 34 LYS H 1 34 LYS HB3 . . 3.490 2.599 2.399 2.884 . 0 0 "[ . 1 . 2]" 1
716 1 34 LYS H 1 34 LYS QG . . 4.350 3.985 3.851 4.038 . 0 0 "[ . 1 . 2]" 1
717 1 34 LYS H 1 35 ARG H . . 3.450 2.779 2.628 2.933 . 0 0 "[ . 1 . 2]" 1
718 1 34 LYS HA 1 34 LYS HB3 . . 2.970 3.014 2.980 3.026 0.056 10 0 "[ . 1 . 2]" 1
719 1 34 LYS HA 1 34 LYS HD2 . . 4.290 3.493 3.156 4.433 0.143 14 0 "[ . 1 . 2]" 1
720 1 34 LYS HA 1 34 LYS HD3 . . 4.350 4.367 4.253 4.458 0.108 8 0 "[ . 1 . 2]" 1
721 1 34 LYS HA 1 34 LYS QG . . 3.400 2.345 2.140 2.440 . 0 0 "[ . 1 . 2]" 1
722 1 34 LYS HA 1 37 ILE HB . . 3.550 2.975 2.838 3.152 . 0 0 "[ . 1 . 2]" 1
723 1 34 LYS HA 1 37 ILE MD . . 5.310 5.268 5.190 5.339 0.029 8 0 "[ . 1 . 2]" 1
724 1 34 LYS HA 1 37 ILE MG . . 4.750 4.233 4.057 4.409 . 0 0 "[ . 1 . 2]" 1
725 1 34 LYS HB2 1 35 ARG H . . 4.830 3.778 3.588 3.943 . 0 0 "[ . 1 . 2]" 1
726 1 34 LYS HB3 1 34 LYS HD2 . . 3.540 3.195 2.882 3.595 0.055 14 0 "[ . 1 . 2]" 1
727 1 34 LYS HB3 1 34 LYS QE . . 3.180 2.129 2.054 2.273 . 0 0 "[ . 1 . 2]" 1
728 1 34 LYS HB3 1 35 ARG H . . 3.680 2.516 2.362 2.628 . 0 0 "[ . 1 . 2]" 1
729 1 34 LYS HD2 1 34 LYS QE . . 2.780 2.207 2.152 2.395 . 0 0 "[ . 1 . 2]" 1
730 1 34 LYS HD2 1 34 LYS QG . . 2.660 2.327 2.057 2.430 . 0 0 "[ . 1 . 2]" 1
731 1 34 LYS QE 1 35 ARG HD2 . . 3.560 3.265 2.798 3.577 0.017 14 0 "[ . 1 . 2]" 1
732 1 34 LYS QE 1 35 ARG HD3 . . 2.750 2.732 2.303 2.822 0.072 10 0 "[ . 1 . 2]" 1
733 1 34 LYS QG 1 35 ARG H . . 4.390 4.204 3.550 4.394 0.004 7 0 "[ . 1 . 2]" 1
734 1 34 LYS QG 1 37 ILE MG . . 4.650 4.635 4.479 4.675 0.025 8 0 "[ . 1 . 2]" 1
735 1 35 ARG H 1 35 ARG HB2 . . 3.500 2.178 2.078 2.283 . 0 0 "[ . 1 . 2]" 1
736 1 35 ARG H 1 35 ARG HB3 . . 3.330 2.855 2.569 3.067 . 0 0 "[ . 1 . 2]" 1
737 1 35 ARG H 1 35 ARG HD2 . . 4.460 4.441 3.981 4.541 0.081 10 0 "[ . 1 . 2]" 1
738 1 35 ARG H 1 36 MET H . . 3.920 2.913 2.830 2.980 . 0 0 "[ . 1 . 2]" 1
739 1 35 ARG H 1 84 LEU MD2 . . 5.100 4.495 4.277 4.944 . 0 0 "[ . 1 . 2]" 1
740 1 35 ARG HA 1 35 ARG HD2 . . 3.360 2.147 2.040 2.350 . 0 0 "[ . 1 . 2]" 1
741 1 35 ARG HA 1 35 ARG HD3 . . 3.390 2.813 2.598 3.244 . 0 0 "[ . 1 . 2]" 1
742 1 35 ARG HA 1 35 ARG QG . . 3.290 2.771 2.519 2.994 . 0 0 "[ . 1 . 2]" 1
743 1 35 ARG HA 1 38 ASP H . . 3.920 3.326 3.044 3.517 . 0 0 "[ . 1 . 2]" 1
744 1 35 ARG HA 1 38 ASP HB3 . . 3.620 2.472 2.165 2.764 . 0 0 "[ . 1 . 2]" 1
745 1 35 ARG HB2 1 35 ARG HD2 . . 4.130 3.269 2.973 3.415 . 0 0 "[ . 1 . 2]" 1
746 1 35 ARG HB2 1 84 LEU MD1 . . 3.690 3.664 3.354 3.709 0.019 4 0 "[ . 1 . 2]" 1
747 1 35 ARG HB2 1 84 LEU MD2 . . 3.850 3.815 3.683 3.873 0.023 5 0 "[ . 1 . 2]" 1
748 1 35 ARG HB3 1 84 LEU MD1 . . 3.690 2.607 2.220 2.712 . 0 0 "[ . 1 . 2]" 1
749 1 35 ARG HB3 1 84 LEU MD2 . . 4.210 2.278 2.127 2.384 . 0 0 "[ . 1 . 2]" 1
750 1 35 ARG HD2 1 38 ASP HB2 . . 4.230 4.086 3.685 4.254 0.024 18 0 "[ . 1 . 2]" 1
751 1 35 ARG HD2 1 84 LEU MD2 . . 5.150 4.688 4.198 5.183 0.033 13 0 "[ . 1 . 2]" 1
752 1 35 ARG QG 1 38 ASP HB3 . . 4.950 4.040 3.500 4.357 . 0 0 "[ . 1 . 2]" 1
753 1 35 ARG QG 1 39 VAL MG2 . . 3.800 3.605 3.091 3.811 0.011 14 0 "[ . 1 . 2]" 1
754 1 35 ARG QG 1 84 LEU MD1 . . 4.300 2.598 2.322 3.220 . 0 0 "[ . 1 . 2]" 1
755 1 35 ARG QG 1 84 LEU MD2 . . 4.050 2.608 2.223 3.202 . 0 0 "[ . 1 . 2]" 1
756 1 36 MET H 1 36 MET HB2 . . 3.880 2.376 2.207 2.560 . 0 0 "[ . 1 . 2]" 1
757 1 36 MET H 1 36 MET QG . . 4.830 3.872 2.607 4.110 . 0 0 "[ . 1 . 2]" 1
758 1 36 MET H 1 37 ILE H . . 4.080 2.824 2.710 2.916 . 0 0 "[ . 1 . 2]" 1
759 1 36 MET H 1 37 ILE HG12 . . 4.700 4.647 4.518 4.712 0.012 7 0 "[ . 1 . 2]" 1
760 1 36 MET H 1 38 ASP H . . 4.680 4.168 4.061 4.352 . 0 0 "[ . 1 . 2]" 1
761 1 36 MET H 1 39 VAL MG2 . . 4.770 4.740 4.553 4.786 0.016 20 0 "[ . 1 . 2]" 1
762 1 36 MET H 1 84 LEU MD1 . . 4.690 4.559 3.493 4.696 0.006 3 0 "[ . 1 . 2]" 1
763 1 36 MET H 1 84 LEU MD2 . . 4.210 2.947 2.723 3.653 . 0 0 "[ . 1 . 2]" 1
764 1 36 MET HA 1 36 MET ME . . 4.450 3.820 3.318 4.283 . 0 0 "[ . 1 . 2]" 1
765 1 36 MET HA 1 39 VAL H . . 3.940 3.535 3.313 3.701 . 0 0 "[ . 1 . 2]" 1
766 1 36 MET HA 1 39 VAL MG2 . . 4.370 2.962 2.688 3.133 . 0 0 "[ . 1 . 2]" 1
767 1 36 MET HA 1 84 LEU MD2 . . 3.660 2.420 2.220 3.111 . 0 0 "[ . 1 . 2]" 1
768 1 36 MET HB3 1 37 ILE MD . . 5.250 3.907 3.598 4.200 . 0 0 "[ . 1 . 2]" 1
769 1 36 MET HB3 1 40 LEU MD1 . . 3.960 3.945 3.583 4.019 0.059 20 0 "[ . 1 . 2]" 1
770 1 36 MET ME 1 36 MET QG . . 3.390 2.285 2.190 2.394 . 0 0 "[ . 1 . 2]" 1
771 1 36 MET ME 1 40 LEU MD1 . . 4.780 4.593 4.296 4.794 0.014 16 0 "[ . 1 . 2]" 1
772 1 36 MET ME 1 73 GLN H . . 4.200 3.387 3.063 3.816 . 0 0 "[ . 1 . 2]" 1
773 1 36 MET ME 1 73 GLN HA . . 3.650 2.771 2.227 3.445 . 0 0 "[ . 1 . 2]" 1
774 1 36 MET ME 1 74 LEU H . . 3.970 3.300 2.903 3.616 . 0 0 "[ . 1 . 2]" 1
775 1 36 MET ME 1 74 LEU HA . . 4.940 3.855 3.100 4.265 . 0 0 "[ . 1 . 2]" 1
776 1 36 MET ME 1 74 LEU HB2 . . 3.380 2.570 2.151 3.056 . 0 0 "[ . 1 . 2]" 1
777 1 36 MET ME 1 74 LEU MD1 . . 4.680 4.200 3.895 4.622 . 0 0 "[ . 1 . 2]" 1
778 1 36 MET ME 1 83 GLY HA2 . . 3.150 2.943 2.450 3.153 0.003 20 0 "[ . 1 . 2]" 1
779 1 36 MET ME 1 83 GLY HA3 . . 4.210 4.112 3.698 4.233 0.023 15 0 "[ . 1 . 2]" 1
780 1 36 MET ME 1 84 LEU H . . 4.160 3.107 2.723 3.505 . 0 0 "[ . 1 . 2]" 1
781 1 36 MET ME 1 84 LEU MD2 . . 3.560 2.895 2.267 3.572 0.012 5 0 "[ . 1 . 2]" 1
782 1 36 MET ME 1 87 VAL MG1 . . 3.160 2.613 2.181 2.947 . 0 0 "[ . 1 . 2]" 1
783 1 36 MET QG 1 37 ILE MD . . 5.370 4.048 3.610 5.248 . 0 0 "[ . 1 . 2]" 1
784 1 36 MET QG 1 40 LEU MD1 . . 5.180 2.908 2.260 5.031 . 0 0 "[ . 1 . 2]" 1
785 1 37 ILE H 1 37 ILE HB . . 3.330 2.394 2.334 2.430 . 0 0 "[ . 1 . 2]" 1
786 1 37 ILE H 1 37 ILE MD . . 4.220 3.491 3.356 3.602 . 0 0 "[ . 1 . 2]" 1
787 1 37 ILE H 1 37 ILE HG12 . . 3.780 2.260 2.204 2.325 . 0 0 "[ . 1 . 2]" 1
788 1 37 ILE H 1 37 ILE HG13 . . 4.090 3.602 3.540 3.648 . 0 0 "[ . 1 . 2]" 1
789 1 37 ILE H 1 37 ILE MG . . 4.090 3.771 3.740 3.787 . 0 0 "[ . 1 . 2]" 1
790 1 37 ILE H 1 38 ASP H . . 3.520 2.785 2.715 2.845 . 0 0 "[ . 1 . 2]" 1
791 1 37 ILE HA 1 37 ILE MD . . 3.100 2.158 2.121 2.214 . 0 0 "[ . 1 . 2]" 1
792 1 37 ILE HA 1 37 ILE MG . . 3.380 2.507 2.449 2.551 . 0 0 "[ . 1 . 2]" 1
793 1 37 ILE HA 1 40 LEU H . . 4.610 3.302 3.144 3.411 . 0 0 "[ . 1 . 2]" 1
794 1 37 ILE HA 1 40 LEU HB2 . . 3.800 2.610 2.484 2.901 . 0 0 "[ . 1 . 2]" 1
795 1 37 ILE HA 1 40 LEU HB3 . . 4.680 4.249 4.129 4.536 . 0 0 "[ . 1 . 2]" 1
796 1 37 ILE HA 1 40 LEU MD1 . . 3.750 2.490 2.301 2.874 . 0 0 "[ . 1 . 2]" 1
797 1 37 ILE HA 1 40 LEU HG . . 4.370 3.538 3.230 3.836 . 0 0 "[ . 1 . 2]" 1
798 1 37 ILE HA 1 41 GLU H . . 4.440 3.887 3.708 3.994 . 0 0 "[ . 1 . 2]" 1
799 1 37 ILE HA 1 41 GLU QG . . 4.410 3.979 3.708 4.214 . 0 0 "[ . 1 . 2]" 1
800 1 37 ILE HB 1 37 ILE MD . . 3.730 3.311 3.299 3.320 . 0 0 "[ . 1 . 2]" 1
801 1 37 ILE HB 1 38 ASP H . . 3.620 2.832 2.743 2.898 . 0 0 "[ . 1 . 2]" 1
802 1 37 ILE HB 1 38 ASP HB3 . . 5.090 5.114 5.083 5.143 0.053 13 0 "[ . 1 . 2]" 1
803 1 37 ILE MD 1 37 ILE MG . . 3.240 2.135 2.083 2.180 . 0 0 "[ . 1 . 2]" 1
804 1 37 ILE MD 1 40 LEU MD1 . . 3.460 2.320 2.170 2.545 . 0 0 "[ . 1 . 2]" 1
805 1 37 ILE MD 1 47 TYR QD . . 3.760 3.760 3.644 3.790 0.030 8 0 "[ . 1 . 2]" 1
806 1 37 ILE MD 1 47 TYR QR . . 3.660 2.518 2.294 2.686 . 0 0 "[ . 1 . 2]" 1
807 1 37 ILE MD 1 47 TYR QE . . 3.170 2.559 2.313 2.750 . 0 0 "[ . 1 . 2]" 1
808 1 37 ILE HG12 1 37 ILE MG . . 3.590 3.235 3.224 3.245 . 0 0 "[ . 1 . 2]" 1
809 1 37 ILE MG 1 38 ASP H . . 4.300 3.449 3.297 3.543 . 0 0 "[ . 1 . 2]" 1
810 1 37 ILE MG 1 38 ASP HA . . 4.230 3.623 3.501 3.803 . 0 0 "[ . 1 . 2]" 1
811 1 37 ILE MG 1 40 LEU MD1 . . 5.000 3.953 3.732 4.163 . 0 0 "[ . 1 . 2]" 1
812 1 37 ILE MG 1 41 GLU H . . 4.930 3.699 3.516 3.871 . 0 0 "[ . 1 . 2]" 1
813 1 37 ILE MG 1 41 GLU HB3 . . 5.060 4.416 4.226 4.568 . 0 0 "[ . 1 . 2]" 1
814 1 37 ILE MG 1 41 GLU QG . . 3.400 2.280 2.069 2.421 . 0 0 "[ . 1 . 2]" 1
815 1 37 ILE MG 1 47 TYR QR . . 4.580 3.538 3.360 3.689 . 0 0 "[ . 1 . 2]" 1
816 1 38 ASP H 1 38 ASP HB2 . . 3.370 2.560 2.364 2.722 . 0 0 "[ . 1 . 2]" 1
817 1 38 ASP H 1 38 ASP HB3 . . 3.550 2.374 2.329 2.455 . 0 0 "[ . 1 . 2]" 1
818 1 38 ASP H 1 39 VAL H . . 3.860 2.857 2.780 2.931 . 0 0 "[ . 1 . 2]" 1
819 1 38 ASP H 1 39 VAL MG2 . . 4.820 4.440 4.316 4.579 . 0 0 "[ . 1 . 2]" 1
820 1 38 ASP HA 1 38 ASP HB3 . . 2.980 3.010 2.999 3.020 0.040 4 0 "[ . 1 . 2]" 1
821 1 38 ASP HA 1 41 GLU HB2 . . 3.450 2.635 2.418 2.778 . 0 0 "[ . 1 . 2]" 1
822 1 38 ASP HA 1 41 GLU HB3 . . 4.270 4.220 4.013 4.299 0.029 7 0 "[ . 1 . 2]" 1
823 1 38 ASP HA 1 42 ALA MB . . 4.930 3.737 3.374 3.913 . 0 0 "[ . 1 . 2]" 1
824 1 38 ASP HB2 1 39 VAL H . . 4.040 4.103 4.074 4.169 0.129 16 0 "[ . 1 . 2]" 1
825 1 38 ASP HB2 1 42 ALA MB . . 4.800 4.853 4.829 4.884 0.084 6 0 "[ . 1 . 2]" 1
826 1 38 ASP HB3 1 39 VAL H . . 4.010 2.901 2.806 3.203 . 0 0 "[ . 1 . 2]" 1
827 1 38 ASP HB3 1 39 VAL HA . . 4.890 4.742 4.645 4.899 0.009 16 0 "[ . 1 . 2]" 1
828 1 38 ASP HB3 1 39 VAL MG2 . . 4.650 3.736 3.534 3.951 . 0 0 "[ . 1 . 2]" 1
829 1 39 VAL H 1 39 VAL HB . . 3.430 2.579 2.499 2.689 . 0 0 "[ . 1 . 2]" 1
830 1 39 VAL H 1 39 VAL MG2 . . 3.900 2.300 2.197 2.559 . 0 0 "[ . 1 . 2]" 1
831 1 39 VAL H 1 40 LEU MD1 . . 5.330 4.959 4.809 5.197 . 0 0 "[ . 1 . 2]" 1
832 1 39 VAL H 1 42 ALA H . . 4.490 4.559 4.510 4.580 0.090 13 0 "[ . 1 . 2]" 1
833 1 39 VAL HA 1 39 VAL MG1 . . 3.100 2.451 2.360 2.520 . 0 0 "[ . 1 . 2]" 1
834 1 39 VAL HA 1 39 VAL MG2 . . 3.250 2.401 2.341 2.449 . 0 0 "[ . 1 . 2]" 1
835 1 39 VAL HA 1 42 ALA H . . 4.070 3.745 3.582 3.953 . 0 0 "[ . 1 . 2]" 1
836 1 39 VAL HA 1 42 ALA MB . . 3.280 2.955 2.602 3.114 . 0 0 "[ . 1 . 2]" 1
837 1 39 VAL HA 1 91 LEU MD1 . . 4.120 3.286 2.899 3.900 . 0 0 "[ . 1 . 2]" 1
838 1 39 VAL HB 1 40 LEU H . . 3.870 2.622 2.455 2.786 . 0 0 "[ . 1 . 2]" 1
839 1 39 VAL HB 1 40 LEU MD2 . . 4.400 3.683 3.180 3.992 . 0 0 "[ . 1 . 2]" 1
840 1 39 VAL HB 1 40 LEU HG . . 4.270 2.909 2.725 2.990 . 0 0 "[ . 1 . 2]" 1
841 1 39 VAL MG1 1 40 LEU H . . 4.530 3.470 3.194 3.672 . 0 0 "[ . 1 . 2]" 1
842 1 39 VAL MG1 1 40 LEU HG . . 4.150 3.536 3.125 3.853 . 0 0 "[ . 1 . 2]" 1
843 1 39 VAL MG1 1 42 ALA MB . . 4.400 4.351 4.071 4.416 0.016 18 0 "[ . 1 . 2]" 1
844 1 39 VAL MG1 1 87 VAL HA . . 4.620 4.662 4.625 4.722 0.102 16 0 "[ . 1 . 2]" 1
845 1 39 VAL MG2 1 40 LEU H . . 3.870 3.867 3.778 3.894 0.024 14 0 "[ . 1 . 2]" 1
846 1 39 VAL MG2 1 40 LEU HG . . 4.460 4.463 4.305 4.504 0.044 3 0 "[ . 1 . 2]" 1
847 1 40 LEU H 1 40 LEU HB2 . . 3.760 2.435 2.342 2.569 . 0 0 "[ . 1 . 2]" 1
848 1 40 LEU H 1 40 LEU HB3 . . 4.070 3.564 3.530 3.607 . 0 0 "[ . 1 . 2]" 1
849 1 40 LEU H 1 40 LEU MD1 . . 4.210 3.473 3.393 3.603 . 0 0 "[ . 1 . 2]" 1
850 1 40 LEU H 1 40 LEU MD2 . . 3.980 3.406 3.163 3.610 . 0 0 "[ . 1 . 2]" 1
851 1 40 LEU H 1 40 LEU HG . . 3.420 2.209 2.095 2.396 . 0 0 "[ . 1 . 2]" 1
852 1 40 LEU H 1 41 GLU H . . 3.830 2.639 2.502 2.718 . 0 0 "[ . 1 . 2]" 1
853 1 40 LEU HA 1 40 LEU MD1 . . 4.290 3.922 3.892 3.956 . 0 0 "[ . 1 . 2]" 1
854 1 40 LEU HA 1 40 LEU MD2 . . 3.020 2.197 2.144 2.263 . 0 0 "[ . 1 . 2]" 1
855 1 40 LEU HA 1 40 LEU HG . . 4.160 3.106 2.987 3.289 . 0 0 "[ . 1 . 2]" 1
856 1 40 LEU HA 1 43 LEU HB2 . . 4.610 3.517 3.218 3.712 . 0 0 "[ . 1 . 2]" 1
857 1 40 LEU HA 1 43 LEU MD1 . . 3.910 3.847 3.484 3.932 0.022 13 0 "[ . 1 . 2]" 1
858 1 40 LEU HA 1 45 LEU MD1 . . 3.260 2.543 2.293 2.996 . 0 0 "[ . 1 . 2]" 1
859 1 40 LEU HB2 1 40 LEU MD1 . . 3.240 2.346 2.302 2.369 . 0 0 "[ . 1 . 2]" 1
860 1 40 LEU HB2 1 41 GLU H . . 3.580 2.731 2.662 2.790 . 0 0 "[ . 1 . 2]" 1
861 1 40 LEU HB2 1 41 GLU QG . . 4.660 3.545 3.156 3.780 . 0 0 "[ . 1 . 2]" 1
862 1 40 LEU HB2 1 47 TYR QR . . 4.270 3.363 2.898 3.586 . 0 0 "[ . 1 . 2]" 1
863 1 40 LEU HB2 1 47 TYR QE . . 4.120 3.569 2.995 3.866 . 0 0 "[ . 1 . 2]" 1
864 1 40 LEU HB3 1 40 LEU MD1 . . 2.630 2.462 2.423 2.498 . 0 0 "[ . 1 . 2]" 1
865 1 40 LEU HB3 1 40 LEU MD2 . . 2.650 2.359 2.277 2.475 . 0 0 "[ . 1 . 2]" 1
866 1 40 LEU HB3 1 41 GLU H . . 4.090 3.766 3.648 3.911 . 0 0 "[ . 1 . 2]" 1
867 1 40 LEU HB3 1 41 GLU QG . . 4.830 4.367 3.973 4.768 . 0 0 "[ . 1 . 2]" 1
868 1 40 LEU HB3 1 45 LEU HB2 . . 4.220 3.259 2.901 3.658 . 0 0 "[ . 1 . 2]" 1
869 1 40 LEU HB3 1 47 TYR QD . . 2.980 2.818 2.511 2.972 . 0 0 "[ . 1 . 2]" 1
870 1 40 LEU HB3 1 47 TYR QR . . 4.070 2.625 2.316 2.757 . 0 0 "[ . 1 . 2]" 1
871 1 40 LEU HB3 1 47 TYR QE . . 3.270 3.150 2.717 3.289 0.019 4 0 "[ . 1 . 2]" 1
872 1 40 LEU MD1 1 41 GLU H . . 4.620 4.591 4.516 4.632 0.012 11 0 "[ . 1 . 2]" 1
873 1 40 LEU MD1 1 45 LEU MD1 . . 4.660 4.096 3.869 4.240 . 0 0 "[ . 1 . 2]" 1
874 1 40 LEU MD1 1 47 TYR HB2 . . 4.950 3.288 2.907 3.502 . 0 0 "[ . 1 . 2]" 1
875 1 40 LEU MD1 1 47 TYR QD . . 3.670 3.280 3.011 3.489 . 0 0 "[ . 1 . 2]" 1
876 1 40 LEU MD1 1 47 TYR QR . . 3.780 3.089 2.871 3.269 . 0 0 "[ . 1 . 2]" 1
877 1 40 LEU MD1 1 47 TYR QE . . 3.940 3.777 3.456 3.947 0.007 8 0 "[ . 1 . 2]" 1
878 1 40 LEU MD1 1 74 LEU MD1 . . 3.620 3.142 2.500 3.632 0.012 19 0 "[ . 1 . 2]" 1
879 1 40 LEU MD1 1 74 LEU MD2 . . 4.690 3.005 2.058 3.797 . 0 0 "[ . 1 . 2]" 1
880 1 40 LEU MD2 1 41 GLU H . . 5.150 4.784 4.681 4.860 . 0 0 "[ . 1 . 2]" 1
881 1 40 LEU MD2 1 45 LEU HB2 . . 5.080 3.363 2.935 3.687 . 0 0 "[ . 1 . 2]" 1
882 1 40 LEU MD2 1 45 LEU HB3 . . 5.150 4.156 3.816 4.344 . 0 0 "[ . 1 . 2]" 1
883 1 40 LEU MD2 1 45 LEU MD1 . . 3.500 2.042 1.964 2.117 . 0 0 "[ . 1 . 2]" 1
884 1 40 LEU MD2 1 47 TYR QD . . 4.630 3.713 3.292 4.008 . 0 0 "[ . 1 . 2]" 1
885 1 40 LEU MD2 1 47 TYR QR . . 4.470 3.586 3.205 3.850 . 0 0 "[ . 1 . 2]" 1
886 1 40 LEU MD2 1 74 LEU MD1 . . 3.340 2.573 2.321 2.930 . 0 0 "[ . 1 . 2]" 1
887 1 40 LEU MD2 1 74 LEU MD2 . . 3.020 2.398 2.143 2.761 . 0 0 "[ . 1 . 2]" 1
888 1 40 LEU HG 1 41 GLU H . . 4.660 4.396 4.195 4.526 . 0 0 "[ . 1 . 2]" 1
889 1 41 GLU H 1 41 GLU HB2 . . 3.400 2.324 2.250 2.384 . 0 0 "[ . 1 . 2]" 1
890 1 41 GLU H 1 41 GLU HB3 . . 3.550 3.562 3.547 3.580 0.030 5 0 "[ . 1 . 2]" 1
891 1 41 GLU H 1 41 GLU QG . . 3.330 2.618 2.473 2.770 . 0 0 "[ . 1 . 2]" 1
892 1 41 GLU H 1 42 ALA H . . 3.540 2.629 2.556 2.682 . 0 0 "[ . 1 . 2]" 1
893 1 41 GLU H 1 42 ALA HA . . 5.250 5.247 5.198 5.267 0.017 18 0 "[ . 1 . 2]" 1
894 1 41 GLU H 1 42 ALA MB . . 4.460 4.342 4.270 4.399 . 0 0 "[ . 1 . 2]" 1
895 1 41 GLU H 1 47 TYR QE . . 4.730 4.287 3.794 4.525 . 0 0 "[ . 1 . 2]" 1
896 1 41 GLU HA 1 41 GLU QG . . 3.250 2.483 2.234 2.859 . 0 0 "[ . 1 . 2]" 1
897 1 41 GLU HA 1 44 GLY H . . 3.740 3.255 3.025 3.492 . 0 0 "[ . 1 . 2]" 1
898 1 41 GLU HA 1 44 GLY HA2 . . 4.550 3.488 2.838 3.781 . 0 0 "[ . 1 . 2]" 1
899 1 41 GLU HA 1 45 LEU H . . 4.240 3.663 3.492 4.011 . 0 0 "[ . 1 . 2]" 1
900 1 41 GLU HA 1 47 TYR QR . . 4.230 3.545 3.166 3.888 . 0 0 "[ . 1 . 2]" 1
901 1 41 GLU HA 1 47 TYR QE . . 4.010 3.600 3.200 3.965 . 0 0 "[ . 1 . 2]" 1
902 1 41 GLU HB2 1 42 ALA H . . 3.920 2.880 2.705 3.026 . 0 0 "[ . 1 . 2]" 1
903 1 41 GLU HB3 1 42 ALA H . . 3.870 3.660 3.449 3.805 . 0 0 "[ . 1 . 2]" 1
904 1 41 GLU QG 1 42 ALA H . . 4.570 4.368 4.281 4.478 . 0 0 "[ . 1 . 2]" 1
905 1 41 GLU QG 1 47 TYR QR . . 4.100 2.934 2.496 3.268 . 0 0 "[ . 1 . 2]" 1
906 1 41 GLU QG 1 47 TYR QE . . 3.300 2.957 2.507 3.304 0.004 1 0 "[ . 1 . 2]" 1
907 1 42 ALA H 1 42 ALA MB . . 2.880 2.246 2.217 2.269 . 0 0 "[ . 1 . 2]" 1
908 1 42 ALA H 1 43 LEU H . . 3.490 2.675 2.564 2.779 . 0 0 "[ . 1 . 2]" 1
909 1 42 ALA HA 1 44 GLY H . . 4.090 3.887 3.744 4.098 0.008 14 0 "[ . 1 . 2]" 1
910 1 42 ALA MB 1 43 LEU H . . 3.420 2.930 2.571 3.168 . 0 0 "[ . 1 . 2]" 1
911 1 42 ALA MB 1 43 LEU MD1 . . 4.410 4.386 4.167 4.428 0.018 4 0 "[ . 1 . 2]" 1
912 1 42 ALA MB 1 43 LEU MD2 . . 4.640 3.985 3.799 4.215 . 0 0 "[ . 1 . 2]" 1
913 1 43 LEU H 1 43 LEU HB2 . . 3.480 2.461 2.420 2.552 . 0 0 "[ . 1 . 2]" 1
914 1 43 LEU H 1 43 LEU HB3 . . 3.680 3.660 3.601 3.698 0.018 5 0 "[ . 1 . 2]" 1
915 1 43 LEU H 1 43 LEU MD1 . . 4.080 3.683 3.515 3.861 . 0 0 "[ . 1 . 2]" 1
916 1 43 LEU H 1 43 LEU MD2 . . 3.950 3.815 3.565 3.944 . 0 0 "[ . 1 . 2]" 1
917 1 43 LEU H 1 44 GLY H . . 3.640 2.425 2.236 2.717 . 0 0 "[ . 1 . 2]" 1
918 1 43 LEU HA 1 43 LEU MD1 . . 4.010 3.880 3.863 3.912 . 0 0 "[ . 1 . 2]" 1
919 1 43 LEU HA 1 43 LEU MD2 . . 2.870 2.154 2.096 2.211 . 0 0 "[ . 1 . 2]" 1
920 1 43 LEU HA 1 43 LEU HG . . 3.990 3.006 2.866 3.080 . 0 0 "[ . 1 . 2]" 1
921 1 43 LEU HB2 1 43 LEU MD1 . . 3.670 2.286 2.261 2.306 . 0 0 "[ . 1 . 2]" 1
922 1 43 LEU HB2 1 45 LEU MD1 . . 3.540 3.036 2.839 3.239 . 0 0 "[ . 1 . 2]" 1
923 1 43 LEU HB2 1 107 CYS HB3 . . 4.810 4.818 4.732 4.854 0.044 17 0 "[ . 1 . 2]" 1
924 1 43 LEU HB3 1 43 LEU MD1 . . 3.410 2.455 2.410 2.536 . 0 0 "[ . 1 . 2]" 1
925 1 43 LEU HB3 1 43 LEU MD2 . . 3.190 2.338 2.288 2.384 . 0 0 "[ . 1 . 2]" 1
926 1 43 LEU HB3 1 44 GLY H . . 4.660 4.254 4.133 4.376 . 0 0 "[ . 1 . 2]" 1
927 1 43 LEU HB3 1 45 LEU MD1 . . 3.810 3.714 3.576 3.822 0.012 17 0 "[ . 1 . 2]" 1
928 1 43 LEU HB3 1 107 CYS HB2 . . 3.890 3.016 2.834 3.250 . 0 0 "[ . 1 . 2]" 1
929 1 43 LEU HB3 1 107 CYS HB3 . . 4.250 3.673 3.572 3.773 . 0 0 "[ . 1 . 2]" 1
930 1 43 LEU MD1 1 45 LEU MD1 . . 3.220 2.907 2.683 3.198 . 0 0 "[ . 1 . 2]" 1
931 1 43 LEU MD1 1 45 LEU HG . . 4.830 3.834 3.665 4.032 . 0 0 "[ . 1 . 2]" 1
932 1 43 LEU MD1 1 97 LYS HG3 . . 5.190 3.388 2.864 4.394 . 0 0 "[ . 1 . 2]" 1
933 1 43 LEU MD1 1 107 CYS HB2 . . 4.760 4.389 4.236 4.545 . 0 0 "[ . 1 . 2]" 1
934 1 43 LEU MD1 1 107 CYS HB3 . . 4.890 4.730 4.576 4.889 . 0 0 "[ . 1 . 2]" 1
935 1 43 LEU MD2 1 44 GLY H . . 5.360 4.913 4.868 4.989 . 0 0 "[ . 1 . 2]" 1
936 1 43 LEU MD2 1 97 LYS HG2 . . 4.000 2.739 2.302 3.438 . 0 0 "[ . 1 . 2]" 1
937 1 43 LEU MD2 1 97 LYS HG3 . . 4.160 3.307 2.490 4.058 . 0 0 "[ . 1 . 2]" 1
938 1 43 LEU MD2 1 107 CYS HB2 . . 3.760 3.721 3.472 3.777 0.017 2 0 "[ . 1 . 2]" 1
939 1 43 LEU MD2 1 108 ARG H . . 4.500 4.045 3.674 4.293 . 0 0 "[ . 1 . 2]" 1
940 1 43 LEU MD2 1 108 ARG HB3 . . 4.700 4.618 4.324 4.729 0.029 10 0 "[ . 1 . 2]" 1
941 1 44 GLY H 1 44 GLY HA2 . . 2.810 2.282 2.267 2.294 . 0 0 "[ . 1 . 2]" 1
942 1 44 GLY H 1 45 LEU H . . 3.090 2.789 2.651 2.890 . 0 0 "[ . 1 . 2]" 1
943 1 45 LEU H 1 45 LEU HB2 . . 3.150 2.691 2.639 2.766 . 0 0 "[ . 1 . 2]" 1
944 1 45 LEU H 1 45 LEU HB3 . . 3.960 3.629 3.558 3.675 . 0 0 "[ . 1 . 2]" 1
945 1 45 LEU H 1 45 LEU MD1 . . 4.000 3.779 3.667 3.871 . 0 0 "[ . 1 . 2]" 1
946 1 45 LEU H 1 45 LEU MD2 . . 3.890 2.939 2.747 3.171 . 0 0 "[ . 1 . 2]" 1
947 1 45 LEU H 1 45 LEU HG . . 4.230 2.235 2.049 2.359 . 0 0 "[ . 1 . 2]" 1
948 1 45 LEU H 1 46 GLU H . . 4.490 4.560 4.542 4.597 0.107 14 0 "[ . 1 . 2]" 1
949 1 45 LEU H 1 47 TYR QD . . 4.660 4.326 3.937 4.666 0.006 12 0 "[ . 1 . 2]" 1
950 1 45 LEU HA 1 45 LEU MD1 . . 4.150 3.906 3.853 3.940 . 0 0 "[ . 1 . 2]" 1
951 1 45 LEU HA 1 45 LEU MD2 . . 2.930 2.453 2.372 2.552 . 0 0 "[ . 1 . 2]" 1
952 1 45 LEU HA 1 46 GLU H . . 2.720 2.316 2.194 2.494 . 0 0 "[ . 1 . 2]" 1
953 1 45 LEU HA 1 105 ILE MG . . 4.860 3.741 3.411 4.090 . 0 0 "[ . 1 . 2]" 1
954 1 45 LEU HA 1 106 THR HB . . 4.920 4.973 4.943 5.004 0.084 11 0 "[ . 1 . 2]" 1
955 1 45 LEU HB2 1 46 GLU H . . 4.160 3.440 3.131 3.762 . 0 0 "[ . 1 . 2]" 1
956 1 45 LEU HB2 1 47 TYR HB3 . . 4.680 3.727 3.366 4.004 . 0 0 "[ . 1 . 2]" 1
957 1 45 LEU HB2 1 47 TYR QD . . 4.010 2.661 2.347 2.883 . 0 0 "[ . 1 . 2]" 1
958 1 45 LEU HB2 1 47 TYR QR . . 4.110 2.631 2.330 2.841 . 0 0 "[ . 1 . 2]" 1
959 1 45 LEU HB2 1 47 TYR QE . . 4.630 4.155 3.849 4.482 . 0 0 "[ . 1 . 2]" 1
960 1 45 LEU HB3 1 45 LEU MD1 . . 3.330 2.337 2.282 2.375 . 0 0 "[ . 1 . 2]" 1
961 1 45 LEU HB3 1 45 LEU MD2 . . 3.390 2.525 2.457 2.564 . 0 0 "[ . 1 . 2]" 1
962 1 45 LEU HB3 1 46 GLU H . . 3.770 2.594 2.313 2.981 . 0 0 "[ . 1 . 2]" 1
963 1 45 LEU HB3 1 47 TYR HB3 . . 4.670 4.292 3.833 4.582 . 0 0 "[ . 1 . 2]" 1
964 1 45 LEU HB3 1 47 TYR QD . . 4.000 3.907 3.611 4.028 0.028 18 0 "[ . 1 . 2]" 1
965 1 45 LEU HB3 1 47 TYR QR . . 4.430 3.842 3.565 3.964 . 0 0 "[ . 1 . 2]" 1
966 1 45 LEU HB3 1 106 THR MG . . 3.510 3.521 3.467 3.546 0.036 18 0 "[ . 1 . 2]" 1
967 1 45 LEU MD1 1 46 GLU H . . 5.300 4.506 4.239 4.853 . 0 0 "[ . 1 . 2]" 1
968 1 45 LEU MD1 1 47 TYR QR . . 4.520 3.990 3.774 4.231 . 0 0 "[ . 1 . 2]" 1
969 1 45 LEU MD1 1 107 CYS HB2 . . 4.970 4.966 4.840 5.004 0.034 7 0 "[ . 1 . 2]" 1
970 1 45 LEU MD2 1 46 GLU H . . 4.380 4.036 3.893 4.257 . 0 0 "[ . 1 . 2]" 1
971 1 45 LEU MD2 1 106 THR H . . 4.830 4.654 4.428 4.807 . 0 0 "[ . 1 . 2]" 1
972 1 45 LEU MD2 1 106 THR MG . . 3.410 3.403 3.291 3.431 0.021 13 0 "[ . 1 . 2]" 1
973 1 45 LEU MD2 1 107 CYS H . . 4.810 4.333 4.283 4.381 . 0 0 "[ . 1 . 2]" 1
974 1 45 LEU MD2 1 107 CYS HA . . 4.200 2.482 2.320 2.635 . 0 0 "[ . 1 . 2]" 1
975 1 45 LEU MD2 1 107 CYS HB2 . . 3.680 2.833 2.605 2.953 . 0 0 "[ . 1 . 2]" 1
976 1 45 LEU MD2 1 107 CYS HB3 . . 3.430 2.084 2.027 2.234 . 0 0 "[ . 1 . 2]" 1
977 1 45 LEU MD2 1 108 ARG H . . 4.530 3.701 3.548 3.834 . 0 0 "[ . 1 . 2]" 1
978 1 46 GLU H 1 46 GLU HB2 . . 3.300 2.388 2.233 2.748 . 0 0 "[ . 1 . 2]" 1
979 1 46 GLU H 1 46 GLU HB3 . . 3.290 3.169 2.335 3.417 0.127 12 0 "[ . 1 . 2]" 1
980 1 46 GLU H 1 46 GLU HG3 . . 4.460 4.461 4.243 4.581 0.121 14 0 "[ . 1 . 2]" 1
981 1 46 GLU H 1 47 TYR H . . 4.450 4.367 4.163 4.482 0.032 18 0 "[ . 1 . 2]" 1
982 1 46 GLU H 1 47 TYR QD . . 4.870 4.232 3.914 4.601 . 0 0 "[ . 1 . 2]" 1
983 1 46 GLU H 1 105 ILE MG . . 3.670 3.650 3.431 3.701 0.031 14 0 "[ . 1 . 2]" 1
984 1 46 GLU H 1 106 THR MG . . 4.000 2.239 1.960 2.625 . 0 0 "[ . 1 . 2]" 1
985 1 46 GLU HA 1 46 GLU HB2 . . 2.980 2.848 2.422 2.970 . 0 0 "[ . 1 . 2]" 1
986 1 46 GLU HA 1 46 GLU HG2 . . 3.450 2.387 2.232 2.536 . 0 0 "[ . 1 . 2]" 1
987 1 46 GLU HA 1 46 GLU HG3 . . 3.640 3.569 3.500 3.645 0.005 14 0 "[ . 1 . 2]" 1
988 1 46 GLU HA 1 47 TYR H . . 2.630 2.119 2.023 2.251 . 0 0 "[ . 1 . 2]" 1
989 1 46 GLU HA 1 47 TYR QD . . 3.770 3.350 2.912 3.771 0.001 17 0 "[ . 1 . 2]" 1
990 1 46 GLU HA 1 47 TYR QR . . 3.850 3.256 2.839 3.664 . 0 0 "[ . 1 . 2]" 1
991 1 46 GLU HB2 1 46 GLU HG2 . . 2.570 2.535 2.411 2.607 0.037 19 0 "[ . 1 . 2]" 1
992 1 46 GLU HB2 1 47 TYR H . . 4.950 4.504 4.355 4.616 . 0 0 "[ . 1 . 2]" 1
993 1 46 GLU HB2 1 106 THR MG . . 3.960 2.351 2.098 2.632 . 0 0 "[ . 1 . 2]" 1
994 1 46 GLU HB3 1 47 TYR H . . 4.520 3.788 3.351 4.452 . 0 0 "[ . 1 . 2]" 1
995 1 46 GLU HG2 1 47 TYR H . . 4.230 4.091 3.420 4.292 0.062 11 0 "[ . 1 . 2]" 1
996 1 46 GLU HG2 1 106 THR MG . . 4.820 3.785 3.167 4.579 . 0 0 "[ . 1 . 2]" 1
997 1 46 GLU HG3 1 106 THR MG . . 4.400 3.625 3.012 4.406 0.006 15 0 "[ . 1 . 2]" 1
998 1 47 TYR H 1 47 TYR QD . . 3.420 2.842 2.648 2.981 . 0 0 "[ . 1 . 2]" 1
999 1 47 TYR H 1 47 TYR QR . . 3.370 2.794 2.613 2.919 . 0 0 "[ . 1 . 2]" 1
1000 1 47 TYR H 1 47 TYR QE . . 4.160 4.131 4.004 4.191 0.031 17 0 "[ . 1 . 2]" 1
1001 1 47 TYR H 1 48 THR H . . 4.540 4.467 4.414 4.515 . 0 0 "[ . 1 . 2]" 1
1002 1 47 TYR HA 1 47 TYR HB2 . . 2.840 2.480 2.440 2.518 . 0 0 "[ . 1 . 2]" 1
1003 1 47 TYR HA 1 47 TYR QD . . 3.740 3.769 3.756 3.781 0.041 10 0 "[ . 1 . 2]" 1
1004 1 47 TYR HA 1 47 TYR QR . . 4.000 3.718 3.705 3.730 . 0 0 "[ . 1 . 2]" 1
1005 1 47 TYR HA 1 48 THR H . . 2.900 2.370 2.241 2.473 . 0 0 "[ . 1 . 2]" 1
1006 1 47 TYR HA 1 48 THR HB . . 4.730 4.666 4.514 4.748 0.018 4 0 "[ . 1 . 2]" 1
1007 1 47 TYR HB2 1 48 THR H . . 3.470 2.382 2.275 2.492 . 0 0 "[ . 1 . 2]" 1
1008 1 47 TYR HB3 1 48 THR H . . 3.720 3.682 3.573 3.734 0.014 14 0 "[ . 1 . 2]" 1
1009 1 47 TYR QR 1 48 THR H . . 4.180 3.443 3.140 3.614 . 0 0 "[ . 1 . 2]" 1
1010 1 47 TYR QR 1 48 THR HA . . 4.480 3.348 3.183 3.592 . 0 0 "[ . 1 . 2]" 1
1011 1 47 TYR QR 1 49 SER H . . 4.480 3.240 2.789 3.538 . 0 0 "[ . 1 . 2]" 1
1012 1 47 TYR QR 1 49 SER HA . . 4.390 3.789 3.508 4.129 . 0 0 "[ . 1 . 2]" 1
1013 1 47 TYR QR 1 49 SER HB2 . . 3.730 2.449 2.220 2.735 . 0 0 "[ . 1 . 2]" 1
1014 1 47 TYR QR 1 49 SER HB3 . . 3.850 3.162 2.833 3.406 . 0 0 "[ . 1 . 2]" 1
1015 1 47 TYR QD 1 48 THR H . . 3.630 3.472 3.161 3.648 0.018 11 0 "[ . 1 . 2]" 1
1016 1 47 TYR QD 1 48 THR HA . . 4.340 3.407 3.246 3.667 . 0 0 "[ . 1 . 2]" 1
1017 1 47 TYR QD 1 49 SER HB2 . . 3.720 2.692 2.528 2.915 . 0 0 "[ . 1 . 2]" 1
1018 1 47 TYR QD 1 49 SER HB3 . . 3.740 3.764 3.749 3.783 0.043 11 0 "[ . 1 . 2]" 1
1019 1 47 TYR QE 1 49 SER H . . 4.540 4.299 3.634 4.555 0.015 14 0 "[ . 1 . 2]" 1
1020 1 47 TYR QE 1 49 SER HB2 . . 3.540 2.858 2.431 3.375 . 0 0 "[ . 1 . 2]" 1
1021 1 47 TYR QE 1 49 SER HB3 . . 4.100 3.421 2.929 3.879 . 0 0 "[ . 1 . 2]" 1
1022 1 48 THR H 1 48 THR HB . . 3.340 2.684 2.555 2.781 . 0 0 "[ . 1 . 2]" 1
1023 1 48 THR H 1 48 THR MG . . 4.220 3.884 3.803 3.942 . 0 0 "[ . 1 . 2]" 1
1024 1 48 THR HA 1 48 THR MG . . 3.300 2.474 2.357 2.641 . 0 0 "[ . 1 . 2]" 1
1025 1 48 THR HA 1 49 SER H . . 2.690 2.125 2.069 2.182 . 0 0 "[ . 1 . 2]" 1
1026 1 48 THR HB 1 49 SER H . . 4.310 4.272 4.178 4.336 0.026 1 0 "[ . 1 . 2]" 1
1027 1 48 THR MG 1 49 SER H . . 3.330 2.668 2.486 2.941 . 0 0 "[ . 1 . 2]" 1
1028 1 48 THR MG 1 50 PHE H . . 4.670 4.345 3.972 4.683 0.013 6 0 "[ . 1 . 2]" 1
1029 1 48 THR MG 1 50 PHE HB2 . . 5.320 4.832 4.409 5.177 . 0 0 "[ . 1 . 2]" 1
1030 1 48 THR MG 1 50 PHE QD . . 5.350 3.312 2.999 3.617 . 0 0 "[ . 1 . 2]" 1
1031 1 48 THR MG 1 50 PHE QE . . 4.310 2.896 2.663 3.114 . 0 0 "[ . 1 . 2]" 1
1032 1 48 THR MG 1 50 PHE HZ . . 3.310 3.302 3.167 3.355 0.045 8 0 "[ . 1 . 2]" 1
1033 1 49 SER H 1 49 SER HB2 . . 3.860 3.005 2.797 3.148 . 0 0 "[ . 1 . 2]" 1
1034 1 49 SER H 1 49 SER HB3 . . 3.670 2.480 2.371 2.608 . 0 0 "[ . 1 . 2]" 1
1035 1 49 SER HA 1 50 PHE H . . 3.000 2.149 2.087 2.332 . 0 0 "[ . 1 . 2]" 1
1036 1 49 SER HB2 1 50 PHE H . . 4.410 4.127 3.973 4.280 . 0 0 "[ . 1 . 2]" 1
1037 1 49 SER HB3 1 50 PHE H . . 4.540 4.207 3.808 4.315 . 0 0 "[ . 1 . 2]" 1
1038 1 50 PHE H 1 50 PHE HB2 . . 4.140 2.481 2.324 2.688 . 0 0 "[ . 1 . 2]" 1
1039 1 50 PHE H 1 50 PHE HB3 . . 3.970 3.666 3.530 3.780 . 0 0 "[ . 1 . 2]" 1
1040 1 50 PHE H 1 50 PHE QD . . 3.710 3.281 2.959 3.610 . 0 0 "[ . 1 . 2]" 1
1041 1 50 PHE HA 1 50 PHE QD . . 3.820 2.702 2.486 2.982 . 0 0 "[ . 1 . 2]" 1
1042 1 50 PHE HA 1 51 ASP H . . 2.910 2.202 2.098 2.337 . 0 0 "[ . 1 . 2]" 1
1043 1 50 PHE HB2 1 51 ASP H . . 4.420 4.198 3.912 4.397 . 0 0 "[ . 1 . 2]" 1
1044 1 50 PHE HB2 1 58 VAL QG . . 3.620 2.890 2.687 3.208 . 0 0 "[ . 1 . 2]" 1
1045 1 50 PHE HB3 1 58 VAL QG . . 4.010 1.983 1.915 2.049 . 0 0 "[ . 1 . 2]" 1
1046 1 50 PHE QD 1 51 ASP H . . 4.170 3.671 3.291 4.166 . 0 0 "[ . 1 . 2]" 1
1047 1 50 PHE QD 1 58 VAL QG . . 3.100 2.571 2.340 2.867 . 0 0 "[ . 1 . 2]" 1
1048 1 51 ASP H 1 51 ASP HB2 . . 3.710 3.214 2.669 3.712 0.002 5 0 "[ . 1 . 2]" 1
1049 1 51 ASP H 1 51 ASP HB3 . . 3.660 3.011 2.359 3.664 0.004 3 0 "[ . 1 . 2]" 1
1050 1 51 ASP H 1 54 ALA MB . . 4.780 3.937 3.434 4.589 . 0 0 "[ . 1 . 2]" 1
1051 1 51 ASP H 1 58 VAL QG . . 4.410 2.931 2.324 3.564 . 0 0 "[ . 1 . 2]" 1
1052 1 51 ASP HA 1 52 VAL H . . 3.260 2.146 2.051 2.189 . 0 0 "[ . 1 . 2]" 1
1053 1 51 ASP HA 1 52 VAL MG1 . . 4.750 3.884 3.690 4.279 . 0 0 "[ . 1 . 2]" 1
1054 1 51 ASP HA 1 52 VAL MG2 . . 4.600 3.808 3.571 3.958 . 0 0 "[ . 1 . 2]" 1
1055 1 51 ASP HB2 1 54 ALA H . . 4.540 3.445 2.070 4.561 0.021 17 0 "[ . 1 . 2]" 1
1056 1 51 ASP HB2 1 54 ALA MB . . 3.610 2.954 2.177 3.574 . 0 0 "[ . 1 . 2]" 1
1057 1 51 ASP HB3 1 54 ALA H . . 4.610 3.866 2.921 4.625 0.015 3 0 "[ . 1 . 2]" 1
1058 1 51 ASP HB3 1 54 ALA MB . . 4.050 3.113 2.077 4.112 0.062 5 0 "[ . 1 . 2]" 1
1059 1 52 VAL H 1 52 VAL MG1 . . 3.430 2.356 2.237 2.628 . 0 0 "[ . 1 . 2]" 1
1060 1 52 VAL H 1 52 VAL MG2 . . 3.400 2.086 1.980 2.182 . 0 0 "[ . 1 . 2]" 1
1061 1 52 VAL H 1 53 LEU H . . 4.110 2.618 2.525 2.692 . 0 0 "[ . 1 . 2]" 1
1062 1 52 VAL H 1 53 LEU MD2 . . 4.740 4.442 4.291 4.521 . 0 0 "[ . 1 . 2]" 1
1063 1 52 VAL HA 1 52 VAL MG1 . . 3.500 2.324 2.270 2.398 . 0 0 "[ . 1 . 2]" 1
1064 1 52 VAL HA 1 53 LEU MD2 . . 4.480 4.523 4.505 4.544 0.064 19 0 "[ . 1 . 2]" 1
1065 1 52 VAL HA 1 58 VAL HB . . 3.520 2.555 2.184 2.988 . 0 0 "[ . 1 . 2]" 1
1066 1 52 VAL HA 1 58 VAL QG . . 3.220 2.485 2.299 2.811 . 0 0 "[ . 1 . 2]" 1
1067 1 52 VAL HA 1 59 ARG H . . 4.390 3.269 3.032 3.634 . 0 0 "[ . 1 . 2]" 1
1068 1 52 VAL HB 1 59 ARG HA . . 3.890 3.405 2.857 3.897 0.007 5 0 "[ . 1 . 2]" 1
1069 1 52 VAL HB 1 59 ARG HD3 . . 5.000 4.323 2.968 5.031 0.031 16 0 "[ . 1 . 2]" 1
1070 1 52 VAL HB 1 59 ARG HG2 . . 4.530 4.574 4.463 4.607 0.077 1 0 "[ . 1 . 2]" 1
1071 1 52 VAL HB 1 59 ARG HG3 . . 4.830 4.847 4.755 4.907 0.077 5 0 "[ . 1 . 2]" 1
1072 1 52 VAL MG1 1 53 LEU H . . 4.110 4.148 4.134 4.161 0.051 18 0 "[ . 1 . 2]" 1
1073 1 52 VAL MG1 1 53 LEU MD2 . . 4.510 4.381 4.225 4.510 . 15 0 "[ . 1 . 2]" 1
1074 1 52 VAL MG1 1 58 VAL HB . . 4.610 3.624 3.129 3.996 . 0 0 "[ . 1 . 2]" 1
1075 1 52 VAL MG1 1 59 ARG HA . . 4.240 2.431 2.217 2.980 . 0 0 "[ . 1 . 2]" 1
1076 1 52 VAL MG1 1 59 ARG HG2 . . 5.480 4.808 4.489 5.201 . 0 0 "[ . 1 . 2]" 1
1077 1 52 VAL MG2 1 53 LEU H . . 3.870 2.693 2.299 2.969 . 0 0 "[ . 1 . 2]" 1
1078 1 52 VAL MG2 1 59 ARG HA . . 4.980 4.572 4.182 4.893 . 0 0 "[ . 1 . 2]" 1
1079 1 53 LEU H 1 53 LEU HB2 . . 4.020 2.570 2.525 2.641 . 0 0 "[ . 1 . 2]" 1
1080 1 53 LEU H 1 53 LEU HB3 . . 3.640 3.643 3.590 3.664 0.024 15 0 "[ . 1 . 2]" 1
1081 1 53 LEU H 1 53 LEU MD1 . . 4.470 3.838 3.684 3.962 . 0 0 "[ . 1 . 2]" 1
1082 1 53 LEU H 1 53 LEU MD2 . . 4.190 3.019 2.738 3.153 . 0 0 "[ . 1 . 2]" 1
1083 1 53 LEU H 1 53 LEU HG . . 3.820 2.331 2.081 2.516 . 0 0 "[ . 1 . 2]" 1
1084 1 53 LEU H 1 54 ALA H . . 3.520 2.504 2.343 2.691 . 0 0 "[ . 1 . 2]" 1
1085 1 53 LEU H 1 54 ALA MB . . 4.610 4.058 3.870 4.310 . 0 0 "[ . 1 . 2]" 1
1086 1 53 LEU H 1 55 HIS H . . 4.510 4.363 3.965 4.536 0.026 15 0 "[ . 1 . 2]" 1
1087 1 53 LEU HA 1 53 LEU MD1 . . 3.890 3.814 3.770 3.852 . 0 0 "[ . 1 . 2]" 1
1088 1 53 LEU HA 1 53 LEU MD2 . . 2.950 2.138 2.088 2.182 . 0 0 "[ . 1 . 2]" 1
1089 1 53 LEU HB2 1 53 LEU MD1 . . 3.090 2.574 2.499 2.616 . 0 0 "[ . 1 . 2]" 1
1090 1 53 LEU HB2 1 54 ALA H . . 4.670 3.309 2.963 3.520 . 0 0 "[ . 1 . 2]" 1
1091 1 53 LEU HB2 1 54 ALA HA . . 4.420 4.469 4.435 4.506 0.086 13 0 "[ . 1 . 2]" 1
1092 1 53 LEU HB3 1 53 LEU MD1 . . 3.620 2.291 2.242 2.364 . 0 0 "[ . 1 . 2]" 1
1093 1 53 LEU HB3 1 53 LEU MD2 . . 3.580 2.566 2.510 2.644 . 0 0 "[ . 1 . 2]" 1
1094 1 53 LEU HB3 1 54 ALA H . . 4.820 4.235 3.996 4.375 . 0 0 "[ . 1 . 2]" 1
1095 1 54 ALA H 1 54 ALA MB . . 3.160 2.276 2.141 2.396 . 0 0 "[ . 1 . 2]" 1
1096 1 54 ALA H 1 55 HIS H . . 3.410 2.474 2.259 2.658 . 0 0 "[ . 1 . 2]" 1
1097 1 54 ALA HA 1 55 HIS HA . . 4.680 4.569 4.343 4.683 0.003 18 0 "[ . 1 . 2]" 1
1098 1 54 ALA HA 1 55 HIS HB2 . . 4.720 4.754 4.710 4.796 0.076 19 0 "[ . 1 . 2]" 1
1099 1 54 ALA MB 1 55 HIS H . . 3.840 3.109 2.830 3.536 . 0 0 "[ . 1 . 2]" 1
1100 1 54 ALA MB 1 55 HIS HA . . 5.330 4.377 4.050 4.565 . 0 0 "[ . 1 . 2]" 1
1101 1 54 ALA MB 1 55 HIS HB2 . . 4.520 3.256 2.837 3.639 . 0 0 "[ . 1 . 2]" 1
1102 1 54 ALA MB 1 58 VAL QG . . 4.110 3.841 3.069 4.395 0.285 19 0 "[ . 1 . 2]" 1
1103 1 55 HIS H 1 55 HIS HB2 . . 3.780 3.037 2.674 3.246 . 0 0 "[ . 1 . 2]" 1
1104 1 55 HIS H 1 55 HIS HB3 . . 3.810 3.261 2.927 3.535 . 0 0 "[ . 1 . 2]" 1
1105 1 55 HIS H 1 56 PRO HD2 . . 4.600 4.647 4.617 4.687 0.087 15 0 "[ . 1 . 2]" 1
1106 1 55 HIS H 1 58 VAL QG . . 4.230 3.760 3.284 4.065 . 0 0 "[ . 1 . 2]" 1
1107 1 55 HIS HA 1 55 HIS HD2 . . 3.900 3.158 2.472 3.799 . 0 0 "[ . 1 . 2]" 1
1108 1 55 HIS HA 1 56 PRO HD2 . . 3.060 2.164 2.039 2.364 . 0 0 "[ . 1 . 2]" 1
1109 1 55 HIS HA 1 56 PRO HD3 . . 3.110 2.450 2.238 2.651 . 0 0 "[ . 1 . 2]" 1
1110 1 55 HIS HA 1 56 PRO HG2 . . 4.580 4.410 4.246 4.530 . 0 0 "[ . 1 . 2]" 1
1111 1 55 HIS HA 1 56 PRO HG3 . . 4.530 4.510 4.421 4.561 0.031 2 0 "[ . 1 . 2]" 1
1112 1 55 HIS HB2 1 55 HIS HD2 . . 3.230 2.726 2.567 2.962 . 0 0 "[ . 1 . 2]" 1
1113 1 55 HIS HB2 1 58 VAL H . . 4.280 4.306 4.222 4.343 0.063 6 0 "[ . 1 . 2]" 1
1114 1 55 HIS HB2 1 58 VAL HB . . 4.630 4.325 4.014 4.644 0.014 15 0 "[ . 1 . 2]" 1
1115 1 55 HIS HB2 1 58 VAL QG . . 3.740 3.086 2.970 3.323 . 0 0 "[ . 1 . 2]" 1
1116 1 55 HIS HB3 1 56 PRO HD3 . . 5.080 4.911 4.770 5.085 0.005 2 0 "[ . 1 . 2]" 1
1117 1 55 HIS HB3 1 57 VAL HB . . 4.600 3.650 3.086 4.617 0.017 2 0 "[ . 1 . 2]" 1
1118 1 55 HIS HB3 1 57 VAL MG1 . . 4.730 4.365 3.634 4.734 0.004 16 0 "[ . 1 . 2]" 1
1119 1 55 HIS HB3 1 58 VAL H . . 4.190 2.621 2.578 2.689 . 0 0 "[ . 1 . 2]" 1
1120 1 55 HIS HB3 1 58 VAL HB . . 4.120 3.198 2.449 3.724 . 0 0 "[ . 1 . 2]" 1
1121 1 55 HIS HB3 1 58 VAL QG . . 3.570 2.166 2.097 2.287 . 0 0 "[ . 1 . 2]" 1
1122 1 55 HIS HD2 1 56 PRO HD2 . . 4.700 4.324 3.280 4.762 0.062 14 0 "[ . 1 . 2]" 1
1123 1 55 HIS HD2 1 58 VAL QG . . 5.440 4.984 4.724 5.290 . 0 0 "[ . 1 . 2]" 1
1124 1 55 HIS HE1 1 57 VAL HB . . 3.550 3.366 2.322 3.623 0.073 5 0 "[ . 1 . 2]" 1
1125 1 55 HIS HE1 1 57 VAL MG2 . . 3.140 3.117 2.770 3.179 0.039 3 0 "[ . 1 . 2]" 1
1126 1 56 PRO HA 1 59 ARG H . . 3.980 3.389 3.174 3.633 . 0 0 "[ . 1 . 2]" 1
1127 1 56 PRO HA 1 59 ARG HB3 . . 4.500 4.135 3.717 4.510 0.010 16 0 "[ . 1 . 2]" 1
1128 1 56 PRO HA 1 59 ARG HD2 . . 4.090 3.696 2.673 4.135 0.045 3 0 "[ . 1 . 2]" 1
1129 1 56 PRO QB 1 59 ARG HD2 . . 4.940 4.824 4.300 4.966 0.026 1 0 "[ . 1 . 2]" 1
1130 1 56 PRO QB 1 59 ARG HD3 . . 4.290 4.066 3.582 4.333 0.043 4 0 "[ . 1 . 2]" 1
1131 1 57 VAL H 1 57 VAL MG1 . . 4.290 3.751 3.613 3.802 . 0 0 "[ . 1 . 2]" 1
1132 1 57 VAL HA 1 57 VAL MG1 . . 3.530 2.664 2.481 2.893 . 0 0 "[ . 1 . 2]" 1
1133 1 57 VAL HA 1 57 VAL MG2 . . 3.190 2.273 2.203 2.352 . 0 0 "[ . 1 . 2]" 1
1134 1 57 VAL HA 1 60 SER H . . 4.040 3.548 3.317 3.684 . 0 0 "[ . 1 . 2]" 1
1135 1 57 VAL HB 1 58 VAL H . . 4.020 3.082 2.900 3.386 . 0 0 "[ . 1 . 2]" 1
1136 1 57 VAL MG1 1 58 VAL H . . 3.980 3.358 2.918 3.675 . 0 0 "[ . 1 . 2]" 1
1137 1 57 VAL MG1 1 58 VAL HA . . 5.050 3.396 3.068 3.637 . 0 0 "[ . 1 . 2]" 1
1138 1 57 VAL MG1 1 58 VAL QG . . 3.810 3.174 2.587 3.569 . 0 0 "[ . 1 . 2]" 1
1139 1 57 VAL MG2 1 60 SER HB2 . . 4.810 4.400 3.764 4.834 0.024 1 0 "[ . 1 . 2]" 1
1140 1 57 VAL MG2 1 60 SER HB3 . . 4.910 4.415 3.670 4.933 0.023 7 0 "[ . 1 . 2]" 1
1141 1 58 VAL H 1 58 VAL HB . . 3.830 2.472 2.356 2.562 . 0 0 "[ . 1 . 2]" 1
1142 1 58 VAL H 1 58 VAL QG . . 3.290 2.316 2.231 2.495 . 0 0 "[ . 1 . 2]" 1
1143 1 58 VAL HA 1 58 VAL QG . . 3.240 2.174 2.146 2.211 . 0 0 "[ . 1 . 2]" 1
1144 1 58 VAL HA 1 61 TYR H . . 4.040 3.435 3.245 3.643 . 0 0 "[ . 1 . 2]" 1
1145 1 58 VAL HA 1 61 TYR HB2 . . 3.750 3.377 3.093 3.632 . 0 0 "[ . 1 . 2]" 1
1146 1 58 VAL HA 1 61 TYR HB3 . . 4.070 3.198 3.003 3.602 . 0 0 "[ . 1 . 2]" 1
1147 1 58 VAL HA 1 61 TYR QD . . 4.820 4.837 4.811 4.868 0.048 8 0 "[ . 1 . 2]" 1
1148 1 58 VAL HB 1 59 ARG H . . 3.280 2.641 2.523 2.798 . 0 0 "[ . 1 . 2]" 1
1149 1 58 VAL QG 1 59 ARG H . . 4.130 3.206 3.095 3.279 . 0 0 "[ . 1 . 2]" 1
1150 1 58 VAL QG 1 59 ARG HA . . 4.260 3.471 3.277 3.613 . 0 0 "[ . 1 . 2]" 1
1151 1 58 VAL QG 1 60 SER H . . 4.770 4.627 4.518 4.770 . 0 0 "[ . 1 . 2]" 1
1152 1 58 VAL QG 1 62 VAL QG . . 3.900 3.258 2.646 3.726 . 0 0 "[ . 1 . 2]" 1
1153 1 59 ARG H 1 59 ARG HB3 . . 3.570 2.489 2.421 2.669 . 0 0 "[ . 1 . 2]" 1
1154 1 59 ARG H 1 59 ARG HG3 . . 4.060 3.795 3.676 3.917 . 0 0 "[ . 1 . 2]" 1
1155 1 59 ARG H 1 60 SER H . . 3.810 2.625 2.525 2.718 . 0 0 "[ . 1 . 2]" 1
1156 1 59 ARG HA 1 59 ARG HB2 . . 2.930 2.323 2.255 2.369 . 0 0 "[ . 1 . 2]" 1
1157 1 59 ARG HA 1 59 ARG HG2 . . 3.660 3.679 3.643 3.713 0.053 7 0 "[ . 1 . 2]" 1
1158 1 59 ARG HA 1 59 ARG HG3 . . 4.160 3.764 3.673 3.932 . 0 0 "[ . 1 . 2]" 1
1159 1 59 ARG HA 1 62 VAL QG . . 3.810 2.598 2.040 2.925 . 0 0 "[ . 1 . 2]" 1
1160 1 59 ARG HB2 1 59 ARG HD2 . . 3.710 2.968 2.632 3.611 . 0 0 "[ . 1 . 2]" 1
1161 1 59 ARG HB2 1 60 SER H . . 4.470 4.215 4.053 4.338 . 0 0 "[ . 1 . 2]" 1
1162 1 59 ARG HB3 1 60 SER H . . 4.180 4.076 4.017 4.166 . 0 0 "[ . 1 . 2]" 1
1163 1 59 ARG HG2 1 60 SER HA . . 4.520 4.539 4.524 4.575 0.055 4 0 "[ . 1 . 2]" 1
1164 1 59 ARG HG2 1 62 VAL QG . . 5.220 5.381 4.905 5.700 0.480 20 0 "[ . 1 . 2]" 1
1165 1 59 ARG HG3 1 60 SER HB2 . . 4.940 4.583 4.041 4.971 0.031 5 0 "[ . 1 . 2]" 1
1166 1 60 SER H 1 60 SER HB2 . . 3.320 2.378 2.171 2.583 . 0 0 "[ . 1 . 2]" 1
1167 1 60 SER H 1 60 SER HB3 . . 3.570 3.018 2.446 3.607 0.037 11 0 "[ . 1 . 2]" 1
1168 1 60 SER H 1 61 TYR H . . 4.420 2.780 2.657 2.856 . 0 0 "[ . 1 . 2]" 1
1169 1 60 SER HA 1 60 SER HB2 . . 2.890 2.708 2.449 2.975 0.085 11 0 "[ . 1 . 2]" 1
1170 1 60 SER HA 1 63 LYS H . . 4.170 3.322 3.035 3.691 . 0 0 "[ . 1 . 2]" 1
1171 1 60 SER HA 1 63 LYS QB . . 3.360 2.585 2.125 3.049 . 0 0 "[ . 1 . 2]" 1
1172 1 60 SER HB2 1 61 TYR H . . 4.260 3.520 2.789 4.107 . 0 0 "[ . 1 . 2]" 1
1173 1 61 TYR H 1 61 TYR HB2 . . 3.490 2.406 2.334 2.546 . 0 0 "[ . 1 . 2]" 1
1174 1 61 TYR H 1 61 TYR HB3 . . 3.490 2.668 2.533 2.786 . 0 0 "[ . 1 . 2]" 1
1175 1 61 TYR H 1 61 TYR QD . . 4.700 4.212 4.153 4.255 . 0 0 "[ . 1 . 2]" 1
1176 1 61 TYR H 1 62 VAL H . . 3.980 2.907 2.620 3.114 . 0 0 "[ . 1 . 2]" 1
1177 1 61 TYR HA 1 61 TYR QD . . 3.280 3.088 2.726 3.202 . 0 0 "[ . 1 . 2]" 1
1178 1 61 TYR HA 1 61 TYR QE . . 4.720 4.616 4.352 4.739 0.019 19 0 "[ . 1 . 2]" 1
1179 1 61 TYR HA 1 64 GLU QB . . 4.270 3.487 2.933 3.973 . 0 0 "[ . 1 . 2]" 1
1180 1 61 TYR HA 1 64 GLU HG3 . . 5.080 4.892 3.935 5.103 0.023 15 0 "[ . 1 . 2]" 1
1181 1 61 TYR HA 1 65 VAL QG . . 4.580 2.643 2.238 3.468 . 0 0 "[ . 1 . 2]" 1
1182 1 61 TYR HB2 1 62 VAL H . . 4.200 3.844 3.769 3.972 . 0 0 "[ . 1 . 2]" 1
1183 1 61 TYR HB3 1 62 VAL H . . 3.980 2.569 2.440 2.671 . 0 0 "[ . 1 . 2]" 1
1184 1 61 TYR HB3 1 62 VAL HA . . 4.630 4.388 4.269 4.572 . 0 0 "[ . 1 . 2]" 1
1185 1 61 TYR QD 1 62 VAL H . . 4.070 3.473 3.354 3.609 . 0 0 "[ . 1 . 2]" 1
1186 1 61 TYR QD 1 62 VAL HA . . 3.760 3.264 3.066 3.618 . 0 0 "[ . 1 . 2]" 1
1187 1 61 TYR QD 1 62 VAL QG . . 3.490 3.194 2.930 3.431 . 0 0 "[ . 1 . 2]" 1
1188 1 61 TYR QD 1 65 VAL QG . . 3.540 3.143 2.918 3.355 . 0 0 "[ . 1 . 2]" 1
1189 1 61 TYR QE 1 62 VAL HA . . 4.880 4.846 4.578 4.925 0.045 4 0 "[ . 1 . 2]" 1
1190 1 61 TYR QE 1 62 VAL QG . . 4.950 4.669 4.341 4.940 . 0 0 "[ . 1 . 2]" 1
1191 1 61 TYR QE 1 65 VAL HB . . 3.480 3.125 2.817 3.500 0.020 17 0 "[ . 1 . 2]" 1
1192 1 61 TYR QE 1 65 VAL QG . . 3.280 2.654 2.451 2.997 . 0 0 "[ . 1 . 2]" 1
1193 1 61 TYR QE 1 75 PHE QE . . 4.370 3.789 3.137 4.382 0.012 10 0 "[ . 1 . 2]" 1
1194 1 61 TYR QE 1 75 PHE HZ . . 4.300 3.507 2.661 4.274 . 0 0 "[ . 1 . 2]" 1
1195 1 62 VAL H 1 62 VAL HB . . 3.610 3.041 2.484 3.654 0.044 17 0 "[ . 1 . 2]" 1
1196 1 62 VAL H 1 62 VAL QG . . 3.470 2.032 1.869 2.185 . 0 0 "[ . 1 . 2]" 1
1197 1 62 VAL H 1 63 LYS H . . 3.980 2.805 2.686 2.933 . 0 0 "[ . 1 . 2]" 1
1198 1 62 VAL HA 1 63 LYS HA . . 4.930 4.757 4.643 4.886 . 0 0 "[ . 1 . 2]" 1
1199 1 62 VAL HA 1 65 VAL H . . 4.650 3.885 3.525 4.190 . 0 0 "[ . 1 . 2]" 1
1200 1 62 VAL HA 1 65 VAL HB . . 4.650 4.331 3.791 4.661 0.011 1 0 "[ . 1 . 2]" 1
1201 1 62 VAL HA 1 65 VAL QG . . 4.860 4.670 4.346 4.926 0.066 15 0 "[ . 1 . 2]" 1
1202 1 62 VAL HB 1 63 LYS H . . 4.160 3.186 2.419 3.976 . 0 0 "[ . 1 . 2]" 1
1203 1 62 VAL HB 1 63 LYS HA . . 4.350 4.386 4.361 4.425 0.075 8 0 "[ . 1 . 2]" 1
1204 1 62 VAL QG 1 63 LYS H . . 4.110 2.899 2.320 3.421 . 0 0 "[ . 1 . 2]" 1
1205 1 62 VAL QG 1 63 LYS HA . . 4.480 3.526 3.228 3.784 . 0 0 "[ . 1 . 2]" 1
1206 1 62 VAL QG 1 63 LYS QB . . 4.720 3.667 3.021 4.233 . 0 0 "[ . 1 . 2]" 1
1207 1 62 VAL QG 1 69 PRO HA . . 5.500 5.050 3.494 6.146 0.646 6 2 "[ .+ - 1 . 2]" 1
1208 1 62 VAL QG 1 71 ILE MD . . 5.500 2.153 1.945 2.484 . 0 0 "[ . 1 . 2]" 1
1209 1 62 VAL QG 1 71 ILE HG12 . . 5.500 3.658 2.805 4.330 . 0 0 "[ . 1 . 2]" 1
1210 1 62 VAL QG 1 75 PHE QE . . 3.990 3.609 2.694 4.532 0.542 1 2 "[+ . - . 2]" 1
1211 1 63 LYS H 1 64 GLU H . . 3.770 2.705 2.390 2.956 . 0 0 "[ . 1 . 2]" 1
1212 1 63 LYS HA 1 63 LYS HD2 . . 3.730 3.251 2.258 3.782 0.052 18 0 "[ . 1 . 2]" 1
1213 1 63 LYS HA 1 63 LYS HD3 . . 3.930 2.877 2.246 3.956 0.026 17 0 "[ . 1 . 2]" 1
1214 1 63 LYS QB 1 63 LYS QE . . 4.450 3.431 2.099 3.930 . 0 0 "[ . 1 . 2]" 1
1215 1 63 LYS QB 1 64 GLU HG2 . . 3.920 3.590 2.908 3.925 0.005 16 0 "[ . 1 . 2]" 1
1216 1 63 LYS HD2 1 64 GLU HG2 . . 5.080 4.105 2.261 5.114 0.034 4 0 "[ . 1 . 2]" 1
1217 1 63 LYS HD3 1 63 LYS QG . . 2.410 2.314 2.150 2.402 . 0 0 "[ . 1 . 2]" 1
1218 1 64 GLU H 1 64 GLU QB . . 3.280 2.455 2.359 2.611 . 0 0 "[ . 1 . 2]" 1
1219 1 64 GLU H 1 64 GLU HG2 . . 3.850 3.518 3.103 3.860 0.010 3 0 "[ . 1 . 2]" 1
1220 1 64 GLU H 1 64 GLU HG3 . . 4.300 2.583 2.402 2.985 . 0 0 "[ . 1 . 2]" 1
1221 1 64 GLU H 1 65 VAL QG . . 4.660 3.697 3.451 3.942 . 0 0 "[ . 1 . 2]" 1
1222 1 64 GLU HA 1 64 GLU HG2 . . 3.660 2.434 2.338 2.562 . 0 0 "[ . 1 . 2]" 1
1223 1 64 GLU HA 1 64 GLU HG3 . . 3.490 3.202 2.887 3.527 0.037 8 0 "[ . 1 . 2]" 1
1224 1 64 GLU HA 1 65 VAL QG . . 5.330 4.287 4.177 4.441 . 0 0 "[ . 1 . 2]" 1
1225 1 64 GLU QB 1 64 GLU HG3 . . 2.720 2.344 2.183 2.452 . 0 0 "[ . 1 . 2]" 1
1226 1 64 GLU QB 1 65 VAL H . . 3.640 3.041 2.830 3.232 . 0 0 "[ . 1 . 2]" 1
1227 1 64 GLU QB 1 65 VAL HA . . 4.490 4.155 3.870 4.387 . 0 0 "[ . 1 . 2]" 1
1228 1 64 GLU QB 1 65 VAL HB . . 4.970 4.665 4.431 4.893 . 0 0 "[ . 1 . 2]" 1
1229 1 64 GLU QB 1 65 VAL QG . . 3.750 2.619 2.324 2.915 . 0 0 "[ . 1 . 2]" 1
1230 1 64 GLU HG3 1 65 VAL QG . . 4.970 4.712 4.312 5.035 0.065 20 0 "[ . 1 . 2]" 1
1231 1 65 VAL H 1 65 VAL HB . . 3.570 2.722 2.603 2.867 . 0 0 "[ . 1 . 2]" 1
1232 1 65 VAL H 1 65 VAL QG . . 3.390 2.459 2.242 2.648 . 0 0 "[ . 1 . 2]" 1
1233 1 65 VAL H 1 67 GLU HA . . 5.500 4.868 4.380 5.372 . 0 0 "[ . 1 . 2]" 1
1234 1 65 VAL H 1 67 GLU HG2 . . 5.500 4.365 3.703 5.481 . 0 0 "[ . 1 . 2]" 1
1235 1 65 VAL H 1 67 GLU HG3 . . 5.500 4.290 3.664 4.897 . 0 0 "[ . 1 . 2]" 1
1236 1 65 VAL HA 1 65 VAL QG . . 3.170 2.110 2.057 2.155 . 0 0 "[ . 1 . 2]" 1
1237 1 65 VAL HB 1 66 SER H . . 4.670 2.750 2.462 3.121 . 0 0 "[ . 1 . 2]" 1
1238 1 65 VAL QG 1 66 SER H . . 4.780 3.360 3.119 3.555 . 0 0 "[ . 1 . 2]" 1
1239 1 65 VAL QG 1 66 SER HA . . 4.910 3.924 3.326 4.315 . 0 0 "[ . 1 . 2]" 1
1240 1 65 VAL QG 1 66 SER HB3 . . 5.130 4.839 3.713 5.566 0.436 8 0 "[ . 1 . 2]" 1
1241 1 66 SER HA 1 67 GLU H . . 3.560 3.250 2.352 3.563 0.003 14 0 "[ . 1 . 2]" 1
1242 1 66 SER HA 1 75 PHE QE . . 4.750 4.243 3.692 4.756 0.006 11 0 "[ . 1 . 2]" 1
1243 1 66 SER HA 1 75 PHE HZ . . 4.340 3.251 2.374 4.102 . 0 0 "[ . 1 . 2]" 1
1244 1 66 SER HB3 1 67 GLU H . . 4.690 3.850 2.521 4.489 . 0 0 "[ . 1 . 2]" 1
1245 1 66 SER HB3 1 75 PHE HZ . . 4.580 2.933 2.128 4.119 . 0 0 "[ . 1 . 2]" 1
1246 1 67 GLU H 1 67 GLU QB . . 3.620 3.187 2.368 3.471 . 0 0 "[ . 1 . 2]" 1
1247 1 67 GLU H 1 67 GLU HG2 . . 4.640 3.222 2.811 3.529 . 0 0 "[ . 1 . 2]" 1
1248 1 67 GLU H 1 67 GLU HG3 . . 4.530 2.738 1.916 3.185 . 0 0 "[ . 1 . 2]" 1
1249 1 67 GLU H 1 68 TRP H . . 4.130 2.865 2.561 3.162 . 0 0 "[ . 1 . 2]" 1
1250 1 67 GLU HA 1 67 GLU HG2 . . 3.900 2.519 2.409 2.636 . 0 0 "[ . 1 . 2]" 1
1251 1 67 GLU HA 1 67 GLU HG3 . . 3.890 3.177 2.968 3.419 . 0 0 "[ . 1 . 2]" 1
1252 1 67 GLU HG3 1 68 TRP H . . 4.870 4.828 4.610 4.914 0.044 15 0 "[ . 1 . 2]" 1
1253 1 68 TRP HA 1 68 TRP HE3 . . 3.500 2.865 2.622 3.047 . 0 0 "[ . 1 . 2]" 1
1254 1 68 TRP HA 1 69 PRO HD2 . . 3.310 2.415 2.259 2.577 . 0 0 "[ . 1 . 2]" 1
1255 1 68 TRP HA 1 69 PRO HD3 . . 3.480 2.351 2.227 2.494 . 0 0 "[ . 1 . 2]" 1
1256 1 68 TRP HB2 1 68 TRP HE3 . . 3.640 2.752 2.691 2.868 . 0 0 "[ . 1 . 2]" 1
1257 1 68 TRP HB2 1 80 PHE HZ . . 4.230 3.782 3.254 4.234 0.004 2 0 "[ . 1 . 2]" 1
1258 1 68 TRP HB3 1 68 TRP HD1 . . 3.300 2.607 2.567 2.656 . 0 0 "[ . 1 . 2]" 1
1259 1 68 TRP HB3 1 70 THR H . . 4.460 4.204 3.834 4.456 . 0 0 "[ . 1 . 2]" 1
1260 1 68 TRP HB3 1 80 PHE HZ . . 4.310 3.662 3.134 4.109 . 0 0 "[ . 1 . 2]" 1
1261 1 68 TRP HD1 1 69 PRO HD2 . . 4.260 3.696 3.446 3.996 . 0 0 "[ . 1 . 2]" 1
1262 1 68 TRP HD1 1 69 PRO HG2 . . 4.460 4.473 4.214 4.508 0.048 11 0 "[ . 1 . 2]" 1
1263 1 68 TRP HD1 1 70 THR HA . . 4.680 4.611 4.402 4.727 0.047 15 0 "[ . 1 . 2]" 1
1264 1 68 TRP HD1 1 70 THR HB . . 4.550 2.553 2.261 4.400 . 0 0 "[ . 1 . 2]" 1
1265 1 68 TRP HD1 1 70 THR MG . . 4.110 4.035 3.113 4.147 0.037 10 0 "[ . 1 . 2]" 1
1266 1 68 TRP HD1 1 73 GLN QB . . 5.500 4.198 2.959 5.188 . 0 0 "[ . 1 . 2]" 1
1267 1 68 TRP HD1 1 73 GLN HE21 . . 5.500 3.019 2.796 3.341 . 0 0 "[ . 1 . 2]" 1
1268 1 68 TRP HD1 1 73 GLN HE22 . . 5.500 3.437 3.016 3.926 . 0 0 "[ . 1 . 2]" 1
1269 1 68 TRP HD1 1 73 GLN QG . . 5.500 3.716 2.816 4.828 . 0 0 "[ . 1 . 2]" 1
1270 1 68 TRP HD1 1 80 PHE QD . . 5.500 5.527 5.500 5.568 0.068 15 0 "[ . 1 . 2]" 1
1271 1 68 TRP HD1 1 80 PHE QE . . 5.500 3.595 3.426 3.815 . 0 0 "[ . 1 . 2]" 1
1272 1 68 TRP HE3 1 69 PRO HD2 . . 5.500 3.602 3.346 3.829 . 0 0 "[ . 1 . 2]" 1
1273 1 68 TRP HE3 1 69 PRO HD3 . . 5.500 4.237 4.022 4.422 . 0 0 "[ . 1 . 2]" 1
1274 1 68 TRP HZ3 1 69 PRO HD2 . . 5.500 4.791 4.448 5.119 . 0 0 "[ . 1 . 2]" 1
1275 1 68 TRP HZ3 1 69 PRO HD3 . . 5.500 5.468 5.255 5.520 0.020 8 0 "[ . 1 . 2]" 1
1276 1 69 PRO QB 1 70 THR H . . 4.620 3.354 3.051 3.695 . 0 0 "[ . 1 . 2]" 1
1277 1 69 PRO HG3 1 70 THR H . . 5.500 3.968 3.786 4.365 . 0 0 "[ . 1 . 2]" 1
1278 1 70 THR H 1 70 THR HB . . 4.060 2.656 2.359 3.707 . 0 0 "[ . 1 . 2]" 1
1279 1 70 THR H 1 70 THR MG . . 4.750 3.682 2.268 3.815 . 0 0 "[ . 1 . 2]" 1
1280 1 70 THR HA 1 70 THR MG . . 3.650 2.379 2.276 2.503 . 0 0 "[ . 1 . 2]" 1
1281 1 70 THR HA 1 71 ILE H . . 3.150 2.184 2.092 2.279 . 0 0 "[ . 1 . 2]" 1
1282 1 70 THR HA 1 71 ILE HB . . 4.680 4.494 4.073 4.685 0.005 5 0 "[ . 1 . 2]" 1
1283 1 70 THR HB 1 71 ILE H . . 4.490 3.988 2.564 4.237 . 0 0 "[ . 1 . 2]" 1
1284 1 70 THR MG 1 83 GLY HA2 . . 4.290 3.458 2.974 4.226 . 0 0 "[ . 1 . 2]" 1
1285 1 71 ILE H 1 71 ILE HB . . 3.920 2.595 2.400 2.777 . 0 0 "[ . 1 . 2]" 1
1286 1 71 ILE H 1 71 ILE HG12 . . 4.830 3.285 2.939 3.837 . 0 0 "[ . 1 . 2]" 1
1287 1 71 ILE H 1 71 ILE HG13 . . 4.890 4.376 4.140 4.636 . 0 0 "[ . 1 . 2]" 1
1288 1 71 ILE HA 1 71 ILE MD . . 3.450 2.159 2.127 2.237 . 0 0 "[ . 1 . 2]" 1
1289 1 71 ILE HA 1 71 ILE HG13 . . 4.060 3.739 3.631 3.789 . 0 0 "[ . 1 . 2]" 1
1290 1 71 ILE HA 1 72 PRO HA . . 3.260 2.240 2.095 2.516 . 0 0 "[ . 1 . 2]" 1
1291 1 71 ILE HA 1 72 PRO HB2 . . 5.100 4.645 4.559 4.720 . 0 0 "[ . 1 . 2]" 1
1292 1 71 ILE HA 1 72 PRO HB3 . . 4.460 4.402 4.274 4.553 0.093 4 0 "[ . 1 . 2]" 1
1293 1 71 ILE HA 1 73 GLN H . . 4.350 3.623 3.286 3.903 . 0 0 "[ . 1 . 2]" 1
1294 1 71 ILE HA 1 73 GLN QB . . 4.540 4.090 3.462 4.551 0.011 15 0 "[ . 1 . 2]" 1
1295 1 71 ILE HA 1 73 GLN QG . . 4.890 2.900 2.410 3.526 . 0 0 "[ . 1 . 2]" 1
1296 1 71 ILE HB 1 72 PRO HA . . 4.460 4.208 4.090 4.328 . 0 0 "[ . 1 . 2]" 1
1297 1 71 ILE MD 1 72 PRO HA . . 4.150 2.772 2.152 3.009 . 0 0 "[ . 1 . 2]" 1
1298 1 71 ILE MD 1 72 PRO HB2 . . 5.500 4.904 4.226 5.113 . 0 0 "[ . 1 . 2]" 1
1299 1 71 ILE MD 1 72 PRO HB3 . . 5.500 4.496 3.794 4.775 . 0 0 "[ . 1 . 2]" 1
1300 1 71 ILE MD 1 73 GLN H . . 4.230 3.431 2.553 4.011 . 0 0 "[ . 1 . 2]" 1
1301 1 71 ILE MD 1 73 GLN QB . . 4.370 3.566 2.704 3.968 . 0 0 "[ . 1 . 2]" 1
1302 1 71 ILE MD 1 73 GLN HE21 . . 5.050 3.007 2.361 3.642 . 0 0 "[ . 1 . 2]" 1
1303 1 71 ILE MD 1 73 GLN QG . . 4.580 2.349 2.184 2.803 . 0 0 "[ . 1 . 2]" 1
1304 1 71 ILE HG12 1 72 PRO HA . . 4.680 4.594 4.153 4.721 0.041 1 0 "[ . 1 . 2]" 1
1305 1 71 ILE HG13 1 71 ILE MG . . 3.600 2.370 2.334 2.416 . 0 0 "[ . 1 . 2]" 1
1306 1 71 ILE MG 1 72 PRO HA . . 3.350 2.100 2.033 2.180 . 0 0 "[ . 1 . 2]" 1
1307 1 71 ILE MG 1 72 PRO HG3 . . 4.450 4.388 3.105 4.469 0.019 14 0 "[ . 1 . 2]" 1
1308 1 71 ILE MG 1 73 GLN H . . 4.240 4.035 3.686 4.243 0.003 15 0 "[ . 1 . 2]" 1
1309 1 72 PRO HA 1 73 GLN H . . 3.370 2.406 2.280 2.558 . 0 0 "[ . 1 . 2]" 1
1310 1 72 PRO HB2 1 73 GLN H . . 3.980 2.659 2.363 3.294 . 0 0 "[ . 1 . 2]" 1
1311 1 72 PRO HB3 1 73 GLN H . . 3.930 3.513 2.611 3.740 . 0 0 "[ . 1 . 2]" 1
1312 1 73 GLN H 1 73 GLN QG . . 4.900 2.874 2.380 3.205 . 0 0 "[ . 1 . 2]" 1
1313 1 73 GLN HA 1 74 LEU H . . 3.250 2.258 2.199 2.362 . 0 0 "[ . 1 . 2]" 1
1314 1 73 GLN HA 1 80 PHE QE . . 4.150 3.651 2.928 4.184 0.034 5 0 "[ . 1 . 2]" 1
1315 1 73 GLN HA 1 83 GLY HA2 . . 3.850 2.430 2.133 2.873 . 0 0 "[ . 1 . 2]" 1
1316 1 73 GLN QB 1 73 GLN HE21 . . 4.280 3.357 2.382 3.945 . 0 0 "[ . 1 . 2]" 1
1317 1 73 GLN QB 1 73 GLN HE22 . . 4.770 3.947 3.511 4.236 . 0 0 "[ . 1 . 2]" 1
1318 1 73 GLN QB 1 74 LEU H . . 3.720 2.605 2.359 2.897 . 0 0 "[ . 1 . 2]" 1
1319 1 73 GLN QB 1 80 PHE QE . . 3.630 2.233 2.056 2.446 . 0 0 "[ . 1 . 2]" 1
1320 1 73 GLN QB 1 80 PHE HZ . . 4.780 4.336 3.916 4.673 . 0 0 "[ . 1 . 2]" 1
1321 1 73 GLN QG 1 80 PHE QE . . 4.930 3.106 2.410 4.064 . 0 0 "[ . 1 . 2]" 1
1322 1 74 LEU H 1 74 LEU HB2 . . 4.110 2.726 2.377 3.020 . 0 0 "[ . 1 . 2]" 1
1323 1 74 LEU H 1 74 LEU HB3 . . 3.790 2.685 2.446 2.913 . 0 0 "[ . 1 . 2]" 1
1324 1 74 LEU H 1 74 LEU MD1 . . 4.300 4.332 4.319 4.340 0.040 19 0 "[ . 1 . 2]" 1
1325 1 74 LEU H 1 74 LEU MD2 . . 4.710 4.205 3.895 4.517 . 0 0 "[ . 1 . 2]" 1
1326 1 74 LEU H 1 80 PHE QE . . 3.610 3.324 2.774 3.620 0.010 12 0 "[ . 1 . 2]" 1
1327 1 74 LEU H 1 82 GLY H . . 4.050 3.008 2.848 3.149 . 0 0 "[ . 1 . 2]" 1
1328 1 74 LEU H 1 83 GLY HA2 . . 4.910 3.768 3.470 3.918 . 0 0 "[ . 1 . 2]" 1
1329 1 74 LEU HA 1 74 LEU MD1 . . 3.140 2.248 2.128 2.434 . 0 0 "[ . 1 . 2]" 1
1330 1 74 LEU HA 1 74 LEU MD2 . . 4.330 3.045 2.169 3.849 . 0 0 "[ . 1 . 2]" 1
1331 1 74 LEU HA 1 75 PHE H . . 3.040 2.157 2.140 2.184 . 0 0 "[ . 1 . 2]" 1
1332 1 74 LEU HA 1 75 PHE QD . . 4.730 3.612 3.472 3.732 . 0 0 "[ . 1 . 2]" 1
1333 1 74 LEU HB2 1 74 LEU MD2 . . 3.560 2.317 2.276 2.355 . 0 0 "[ . 1 . 2]" 1
1334 1 74 LEU HB2 1 75 PHE H . . 4.760 4.229 4.117 4.346 . 0 0 "[ . 1 . 2]" 1
1335 1 74 LEU HB2 1 81 VAL MG1 . . 4.520 4.289 3.815 4.532 0.012 11 0 "[ . 1 . 2]" 1
1336 1 74 LEU HB3 1 74 LEU MD2 . . 3.280 2.806 2.372 3.220 . 0 0 "[ . 1 . 2]" 1
1337 1 74 LEU HB3 1 81 VAL MG1 . . 4.190 3.096 2.384 3.447 . 0 0 "[ . 1 . 2]" 1
1338 1 74 LEU HB3 1 82 GLY H . . 4.450 3.347 3.081 3.673 . 0 0 "[ . 1 . 2]" 1
1339 1 74 LEU MD1 1 75 PHE H . . 3.370 1.905 1.817 2.072 . 0 0 "[ . 1 . 2]" 1
1340 1 74 LEU MD1 1 81 VAL MG1 . . 3.960 3.956 3.783 4.000 0.040 20 0 "[ . 1 . 2]" 1
1341 1 74 LEU MD2 1 75 PHE H . . 4.610 3.930 3.374 4.436 . 0 0 "[ . 1 . 2]" 1
1342 1 74 LEU HG 1 75 PHE H . . 4.280 3.705 2.975 4.345 0.065 1 0 "[ . 1 . 2]" 1
1343 1 75 PHE H 1 75 PHE HB2 . . 3.820 2.563 2.489 2.638 . 0 0 "[ . 1 . 2]" 1
1344 1 75 PHE H 1 75 PHE HB3 . . 3.960 3.684 3.636 3.732 . 0 0 "[ . 1 . 2]" 1
1345 1 75 PHE H 1 75 PHE QD . . 3.370 3.100 2.936 3.274 . 0 0 "[ . 1 . 2]" 1
1346 1 75 PHE H 1 76 ILE H . . 4.450 4.385 4.348 4.421 . 0 0 "[ . 1 . 2]" 1
1347 1 75 PHE HA 1 75 PHE QD . . 3.830 3.190 3.148 3.231 . 0 0 "[ . 1 . 2]" 1
1348 1 75 PHE HA 1 76 ILE H . . 2.990 2.218 2.189 2.253 . 0 0 "[ . 1 . 2]" 1
1349 1 75 PHE HA 1 80 PHE HA . . 3.550 2.500 2.377 2.584 . 0 0 "[ . 1 . 2]" 1
1350 1 75 PHE HA 1 80 PHE QD . . 4.450 4.282 3.960 4.461 0.011 11 0 "[ . 1 . 2]" 1
1351 1 75 PHE HA 1 81 VAL H . . 3.600 2.907 2.594 3.075 . 0 0 "[ . 1 . 2]" 1
1352 1 75 PHE HA 1 81 VAL MG2 . . 3.710 2.762 2.399 3.474 . 0 0 "[ . 1 . 2]" 1
1353 1 75 PHE HB2 1 76 ILE H . . 4.340 4.176 4.079 4.244 . 0 0 "[ . 1 . 2]" 1
1354 1 75 PHE HB3 1 76 ILE H . . 4.150 3.032 2.911 3.128 . 0 0 "[ . 1 . 2]" 1
1355 1 75 PHE HB3 1 78 ALA HA . . 4.470 3.802 3.456 4.133 . 0 0 "[ . 1 . 2]" 1
1356 1 75 PHE HB3 1 79 GLU H . . 4.260 3.860 3.549 4.261 0.001 11 0 "[ . 1 . 2]" 1
1357 1 75 PHE QD 1 76 ILE H . . 4.260 4.043 3.892 4.185 . 0 0 "[ . 1 . 2]" 1
1358 1 75 PHE QD 1 78 ALA H . . 4.610 4.594 4.402 4.629 0.019 10 0 "[ . 1 . 2]" 1
1359 1 75 PHE QD 1 78 ALA HA . . 3.710 3.379 3.153 3.629 . 0 0 "[ . 1 . 2]" 1
1360 1 75 PHE QD 1 79 GLU H . . 4.090 3.645 3.295 3.925 . 0 0 "[ . 1 . 2]" 1
1361 1 75 PHE QD 1 80 PHE H . . 4.130 3.689 3.378 4.107 . 0 0 "[ . 1 . 2]" 1
1362 1 75 PHE QD 1 80 PHE HA . . 3.690 3.275 3.143 3.376 . 0 0 "[ . 1 . 2]" 1
1363 1 75 PHE QE 1 80 PHE H . . 4.380 3.597 3.304 4.378 . 0 0 "[ . 1 . 2]" 1
1364 1 75 PHE QE 1 80 PHE HA . . 4.800 3.780 3.589 4.026 . 0 0 "[ . 1 . 2]" 1
1365 1 75 PHE QE 1 80 PHE HB2 . . 4.800 3.017 2.760 3.198 . 0 0 "[ . 1 . 2]" 1
1366 1 75 PHE QE 1 80 PHE HB3 . . 4.520 4.251 4.082 4.471 . 0 0 "[ . 1 . 2]" 1
1367 1 75 PHE QE 1 80 PHE QD . . 3.620 2.991 2.779 3.272 . 0 0 "[ . 1 . 2]" 1
1368 1 75 PHE HZ 1 80 PHE HB2 . . 4.670 3.102 2.930 3.537 . 0 0 "[ . 1 . 2]" 1
1369 1 75 PHE HZ 1 80 PHE QD . . 4.030 3.826 3.421 4.040 0.010 20 0 "[ . 1 . 2]" 1
1370 1 76 ILE H 1 76 ILE HB . . 3.570 2.782 2.681 2.849 . 0 0 "[ . 1 . 2]" 1
1371 1 76 ILE H 1 76 ILE MD . . 4.630 4.150 4.008 4.656 0.026 10 0 "[ . 1 . 2]" 1
1372 1 76 ILE H 1 76 ILE HG13 . . 4.510 4.303 3.344 4.474 . 0 0 "[ . 1 . 2]" 1
1373 1 76 ILE H 1 76 ILE MG . . 4.660 3.926 3.878 3.960 . 0 0 "[ . 1 . 2]" 1
1374 1 76 ILE H 1 79 GLU H . . 3.730 3.121 2.840 3.362 . 0 0 "[ . 1 . 2]" 1
1375 1 76 ILE H 1 80 PHE HA . . 4.530 3.971 3.852 4.109 . 0 0 "[ . 1 . 2]" 1
1376 1 76 ILE H 1 81 VAL H . . 4.480 4.392 4.069 4.499 0.019 15 0 "[ . 1 . 2]" 1
1377 1 76 ILE H 1 81 VAL MG2 . . 3.520 2.474 2.194 2.814 . 0 0 "[ . 1 . 2]" 1
1378 1 76 ILE HA 1 76 ILE MD . . 3.510 2.323 2.145 3.549 0.039 10 0 "[ . 1 . 2]" 1
1379 1 76 ILE HA 1 76 ILE HG12 . . 3.740 2.941 2.144 3.100 . 0 0 "[ . 1 . 2]" 1
1380 1 76 ILE HA 1 76 ILE HG13 . . 3.840 3.710 3.075 3.804 . 0 0 "[ . 1 . 2]" 1
1381 1 76 ILE HA 1 76 ILE MG . . 3.320 2.403 2.337 2.521 . 0 0 "[ . 1 . 2]" 1
1382 1 76 ILE HA 1 77 LYS HA . . 4.400 4.352 4.263 4.407 0.007 1 0 "[ . 1 . 2]" 1
1383 1 76 ILE HA 1 77 LYS QG . . 4.630 4.132 3.922 4.452 . 0 0 "[ . 1 . 2]" 1
1384 1 76 ILE HA 1 81 VAL MG2 . . 4.590 4.155 3.962 4.342 . 0 0 "[ . 1 . 2]" 1
1385 1 76 ILE HA 1 99 MET ME . . 4.700 4.737 4.718 4.750 0.050 7 0 "[ . 1 . 2]" 1
1386 1 76 ILE HB 1 76 ILE MD . . 3.430 3.243 2.761 3.304 . 0 0 "[ . 1 . 2]" 1
1387 1 76 ILE HB 1 81 VAL MG1 . . 5.130 4.377 4.031 4.862 . 0 0 "[ . 1 . 2]" 1
1388 1 76 ILE HB 1 81 VAL MG2 . . 3.320 2.449 2.222 2.822 . 0 0 "[ . 1 . 2]" 1
1389 1 76 ILE HB 1 99 MET ME . . 3.110 2.233 2.145 2.346 . 0 0 "[ . 1 . 2]" 1
1390 1 76 ILE MD 1 99 MET ME . . 4.420 3.396 2.024 3.631 . 0 0 "[ . 1 . 2]" 1
1391 1 76 ILE HG12 1 76 ILE MG . . 3.430 3.179 2.654 3.242 . 0 0 "[ . 1 . 2]" 1
1392 1 76 ILE HG12 1 81 VAL MG2 . . 3.690 2.329 2.064 3.692 0.002 11 0 "[ . 1 . 2]" 1
1393 1 76 ILE HG12 1 99 MET ME . . 3.910 3.249 3.026 3.948 0.038 11 0 "[ . 1 . 2]" 1
1394 1 76 ILE HG13 1 76 ILE MG . . 3.400 2.474 2.369 3.235 . 0 0 "[ . 1 . 2]" 1
1395 1 76 ILE HG13 1 99 MET ME . . 3.110 2.259 2.079 2.884 . 0 0 "[ . 1 . 2]" 1
1396 1 76 ILE MG 1 77 LYS H . . 4.040 2.608 2.506 2.739 . 0 0 "[ . 1 . 2]" 1
1397 1 76 ILE MG 1 77 LYS HA . . 4.280 4.101 3.985 4.175 . 0 0 "[ . 1 . 2]" 1
1398 1 76 ILE MG 1 77 LYS HB2 . . 4.010 2.824 2.462 3.048 . 0 0 "[ . 1 . 2]" 1
1399 1 76 ILE MG 1 77 LYS QG . . 3.370 2.497 2.238 2.842 . 0 0 "[ . 1 . 2]" 1
1400 1 76 ILE MG 1 78 ALA H . . 5.380 4.968 4.787 5.149 . 0 0 "[ . 1 . 2]" 1
1401 1 76 ILE MG 1 99 MET ME . . 2.760 2.666 2.369 2.771 0.011 10 0 "[ . 1 . 2]" 1
1402 1 76 ILE MG 1 100 LEU HA . . 4.310 4.128 3.816 4.343 0.033 7 0 "[ . 1 . 2]" 1
1403 1 77 LYS H 1 77 LYS QG . . 4.550 2.603 2.422 2.732 . 0 0 "[ . 1 . 2]" 1
1404 1 77 LYS H 1 78 ALA H . . 4.270 3.154 3.011 3.336 . 0 0 "[ . 1 . 2]" 1
1405 1 77 LYS HA 1 77 LYS QD . . 3.710 2.522 2.212 3.513 . 0 0 "[ . 1 . 2]" 1
1406 1 77 LYS HA 1 77 LYS QG . . 3.420 2.740 2.235 2.910 . 0 0 "[ . 1 . 2]" 1
1407 1 77 LYS HA 1 78 ALA H . . 3.270 2.552 2.428 2.762 . 0 0 "[ . 1 . 2]" 1
1408 1 77 LYS HA 1 78 ALA HA . . 4.760 4.595 4.481 4.732 . 0 0 "[ . 1 . 2]" 1
1409 1 77 LYS HB2 1 77 LYS QD . . 3.860 3.263 2.784 3.389 . 0 0 "[ . 1 . 2]" 1
1410 1 77 LYS HB2 1 77 LYS HE3 . . 5.020 4.585 4.516 4.710 . 0 0 "[ . 1 . 2]" 1
1411 1 77 LYS HB2 1 103 LYS QG . . 4.190 3.179 2.760 3.818 . 0 0 "[ . 1 . 2]" 1
1412 1 77 LYS HB3 1 77 LYS HE2 . . 4.490 4.481 4.282 4.545 0.055 9 0 "[ . 1 . 2]" 1
1413 1 77 LYS HB3 1 77 LYS HE3 . . 4.760 4.088 3.771 4.621 . 0 0 "[ . 1 . 2]" 1
1414 1 77 LYS QD 1 105 ILE MD . . 3.530 3.497 2.893 3.581 0.051 9 0 "[ . 1 . 2]" 1
1415 1 77 LYS HE2 1 77 LYS QG . . 3.280 2.370 2.215 2.540 . 0 0 "[ . 1 . 2]" 1
1416 1 77 LYS HE2 1 103 LYS QG . . 4.940 3.966 3.359 4.581 . 0 0 "[ . 1 . 2]" 1
1417 1 77 LYS HE2 1 105 ILE MD . . 4.220 2.429 1.925 3.360 . 0 0 "[ . 1 . 2]" 1
1418 1 77 LYS HE2 1 105 ILE HG13 . . 4.930 3.376 2.591 4.534 . 0 0 "[ . 1 . 2]" 1
1419 1 77 LYS HE3 1 77 LYS QG . . 3.280 2.362 2.236 2.598 . 0 0 "[ . 1 . 2]" 1
1420 1 77 LYS HE3 1 105 ILE MD . . 4.180 3.364 2.424 4.116 . 0 0 "[ . 1 . 2]" 1
1421 1 77 LYS QG 1 78 ALA H . . 4.860 4.756 4.390 4.877 0.017 4 0 "[ . 1 . 2]" 1
1422 1 78 ALA H 1 78 ALA HA . . 2.900 2.208 2.163 2.239 . 0 0 "[ . 1 . 2]" 1
1423 1 78 ALA H 1 78 ALA MB . . 3.450 2.825 2.743 2.937 . 0 0 "[ . 1 . 2]" 1
1424 1 78 ALA H 1 79 GLU H . . 3.570 3.057 2.850 3.204 . 0 0 "[ . 1 . 2]" 1
1425 1 78 ALA HA 1 79 GLU HA . . 4.420 4.409 4.245 4.474 0.054 2 0 "[ . 1 . 2]" 1
1426 1 78 ALA MB 1 79 GLU H . . 4.070 3.684 3.576 3.802 . 0 0 "[ . 1 . 2]" 1
1427 1 78 ALA MB 1 79 GLU HA . . 4.800 4.405 4.305 4.485 . 0 0 "[ . 1 . 2]" 1
1428 1 79 GLU H 1 79 GLU HB2 . . 3.240 2.673 2.302 3.024 . 0 0 "[ . 1 . 2]" 1
1429 1 79 GLU H 1 79 GLU HB3 . . 3.480 3.016 2.473 3.542 0.062 20 0 "[ . 1 . 2]" 1
1430 1 79 GLU H 1 79 GLU HG3 . . 4.380 4.230 3.426 4.500 0.120 15 0 "[ . 1 . 2]" 1
1431 1 79 GLU HA 1 79 GLU HG2 . . 3.810 2.830 2.298 3.806 . 0 0 "[ . 1 . 2]" 1
1432 1 79 GLU HA 1 79 GLU HG3 . . 3.930 2.374 2.156 3.245 . 0 0 "[ . 1 . 2]" 1
1433 1 79 GLU HA 1 80 PHE H . . 3.170 2.224 2.135 2.303 . 0 0 "[ . 1 . 2]" 1
1434 1 79 GLU HA 1 80 PHE HB3 . . 4.590 4.481 4.322 4.591 0.001 8 0 "[ . 1 . 2]" 1
1435 1 79 GLU HB2 1 80 PHE H . . 4.580 4.256 4.021 4.356 . 0 0 "[ . 1 . 2]" 1
1436 1 79 GLU HB3 1 80 PHE H . . 3.880 3.598 2.803 3.919 0.039 15 0 "[ . 1 . 2]" 1
1437 1 79 GLU HG2 1 80 PHE H . . 4.490 2.964 2.298 4.495 0.005 3 0 "[ . 1 . 2]" 1
1438 1 79 GLU HG3 1 80 PHE H . . 4.310 3.416 2.648 4.360 0.050 10 0 "[ . 1 . 2]" 1
1439 1 80 PHE H 1 80 PHE HB2 . . 3.220 2.714 2.519 3.035 . 0 0 "[ . 1 . 2]" 1
1440 1 80 PHE H 1 80 PHE HB3 . . 3.380 2.291 2.204 2.345 . 0 0 "[ . 1 . 2]" 1
1441 1 80 PHE H 1 80 PHE QD . . 4.150 4.141 4.043 4.188 0.038 10 0 "[ . 1 . 2]" 1
1442 1 80 PHE HA 1 80 PHE QD . . 3.100 2.689 2.411 2.889 . 0 0 "[ . 1 . 2]" 1
1443 1 80 PHE HA 1 81 VAL H . . 3.100 2.176 2.134 2.228 . 0 0 "[ . 1 . 2]" 1
1444 1 80 PHE HA 1 81 VAL HA . . 4.760 4.462 4.420 4.501 . 0 0 "[ . 1 . 2]" 1
1445 1 80 PHE HA 1 81 VAL HB . . 4.740 4.287 3.995 4.635 . 0 0 "[ . 1 . 2]" 1
1446 1 80 PHE HA 1 81 VAL MG2 . . 4.760 3.561 3.301 4.212 . 0 0 "[ . 1 . 2]" 1
1447 1 80 PHE HA 1 82 GLY H . . 4.520 4.229 4.057 4.431 . 0 0 "[ . 1 . 2]" 1
1448 1 80 PHE HB2 1 81 VAL H . . 4.740 4.014 3.926 4.124 . 0 0 "[ . 1 . 2]" 1
1449 1 80 PHE HB3 1 81 VAL H . . 4.610 4.185 4.075 4.295 . 0 0 "[ . 1 . 2]" 1
1450 1 80 PHE QD 1 81 VAL H . . 3.600 2.965 2.616 3.207 . 0 0 "[ . 1 . 2]" 1
1451 1 80 PHE QD 1 82 GLY H . . 4.170 3.538 3.206 3.831 . 0 0 "[ . 1 . 2]" 1
1452 1 80 PHE QE 1 82 GLY HA2 . . 3.830 3.100 2.969 3.225 . 0 0 "[ . 1 . 2]" 1
1453 1 80 PHE QE 1 82 GLY HA3 . . 4.860 4.388 4.295 4.502 . 0 0 "[ . 1 . 2]" 1
1454 1 80 PHE HZ 1 82 GLY HA2 . . 3.960 2.456 2.224 2.597 . 0 0 "[ . 1 . 2]" 1
1455 1 80 PHE HZ 1 82 GLY HA3 . . 4.330 4.162 3.957 4.308 . 0 0 "[ . 1 . 2]" 1
1456 1 81 VAL H 1 81 VAL HB . . 3.530 2.440 2.290 2.593 . 0 0 "[ . 1 . 2]" 1
1457 1 81 VAL H 1 81 VAL MG1 . . 4.230 3.777 3.514 3.891 . 0 0 "[ . 1 . 2]" 1
1458 1 81 VAL H 1 81 VAL MG2 . . 3.520 2.820 2.425 3.261 . 0 0 "[ . 1 . 2]" 1
1459 1 81 VAL H 1 82 GLY H . . 3.790 2.260 2.140 2.425 . 0 0 "[ . 1 . 2]" 1
1460 1 81 VAL HA 1 81 VAL MG1 . . 3.310 2.584 2.379 2.878 . 0 0 "[ . 1 . 2]" 1
1461 1 81 VAL HA 1 81 VAL MG2 . . 3.160 2.283 2.115 2.529 . 0 0 "[ . 1 . 2]" 1
1462 1 81 VAL HA 1 99 MET ME . . 4.910 4.327 3.960 4.916 0.006 1 0 "[ . 1 . 2]" 1
1463 1 81 VAL MG1 1 82 GLY H . . 4.170 3.327 2.841 3.674 . 0 0 "[ . 1 . 2]" 1
1464 1 81 VAL MG1 1 82 GLY HA3 . . 5.030 3.510 3.176 3.739 . 0 0 "[ . 1 . 2]" 1
1465 1 81 VAL MG1 1 99 MET ME . . 3.440 2.849 2.310 3.383 . 0 0 "[ . 1 . 2]" 1
1466 1 81 VAL MG2 1 82 GLY H . . 4.470 4.066 3.787 4.343 . 0 0 "[ . 1 . 2]" 1
1467 1 81 VAL MG2 1 99 MET ME . . 3.900 2.111 1.973 2.450 . 0 0 "[ . 1 . 2]" 1
1468 1 82 GLY HA2 1 83 GLY H . . 3.480 2.528 2.416 2.680 . 0 0 "[ . 1 . 2]" 1
1469 1 82 GLY HA2 1 86 ILE HB . . 4.110 3.959 3.745 4.117 0.007 18 0 "[ . 1 . 2]" 1
1470 1 82 GLY HA2 1 86 ILE MG . . 4.170 3.771 3.463 4.175 0.005 1 0 "[ . 1 . 2]" 1
1471 1 82 GLY HA3 1 83 GLY H . . 3.560 2.547 2.401 2.632 . 0 0 "[ . 1 . 2]" 1
1472 1 82 GLY HA3 1 86 ILE HB . . 3.300 2.497 2.318 2.734 . 0 0 "[ . 1 . 2]" 1
1473 1 82 GLY HA3 1 86 ILE HG13 . . 3.890 2.962 2.227 3.890 . 8 0 "[ . 1 . 2]" 1
1474 1 82 GLY HA3 1 86 ILE MG . . 3.720 2.528 2.319 3.101 . 0 0 "[ . 1 . 2]" 1
1475 1 83 GLY H 1 86 ILE HB . . 4.180 2.916 2.684 3.199 . 0 0 "[ . 1 . 2]" 1
1476 1 83 GLY H 1 86 ILE MD . . 4.720 4.285 3.829 4.725 0.005 1 0 "[ . 1 . 2]" 1
1477 1 83 GLY H 1 86 ILE MG . . 4.440 3.960 3.730 4.302 . 0 0 "[ . 1 . 2]" 1
1478 1 83 GLY HA2 1 84 LEU H . . 3.540 2.651 2.512 2.761 . 0 0 "[ . 1 . 2]" 1
1479 1 84 LEU H 1 84 LEU HB2 . . 3.660 2.378 1.985 2.530 . 0 0 "[ . 1 . 2]" 1
1480 1 84 LEU H 1 84 LEU HB3 . . 3.620 2.477 2.361 2.917 . 0 0 "[ . 1 . 2]" 1
1481 1 84 LEU H 1 84 LEU MD1 . . 4.930 4.204 3.997 4.277 . 0 0 "[ . 1 . 2]" 1
1482 1 84 LEU H 1 84 LEU MD2 . . 4.830 4.149 4.047 4.295 . 0 0 "[ . 1 . 2]" 1
1483 1 84 LEU H 1 84 LEU HG . . 4.990 4.447 3.909 4.539 . 0 0 "[ . 1 . 2]" 1
1484 1 84 LEU HA 1 84 LEU MD1 . . 4.420 3.423 3.297 3.847 . 0 0 "[ . 1 . 2]" 1
1485 1 84 LEU HA 1 84 LEU MD2 . . 3.140 2.189 2.106 2.368 . 0 0 "[ . 1 . 2]" 1
1486 1 84 LEU HA 1 84 LEU HG . . 3.690 3.644 2.717 3.710 0.020 18 0 "[ . 1 . 2]" 1
1487 1 84 LEU HA 1 87 VAL H . . 4.110 3.531 3.392 4.066 . 0 0 "[ . 1 . 2]" 1
1488 1 84 LEU HA 1 87 VAL MG1 . . 3.460 3.263 1.998 3.485 0.025 13 0 "[ . 1 . 2]" 1
1489 1 84 LEU HB2 1 84 LEU MD1 . . 3.430 3.150 2.292 3.231 . 0 0 "[ . 1 . 2]" 1
1490 1 84 LEU HB3 1 84 LEU MD2 . . 3.260 3.228 2.610 3.270 0.010 11 0 "[ . 1 . 2]" 1
1491 1 84 LEU MD2 1 85 ASP H . . 4.460 4.402 4.062 4.475 0.015 15 0 "[ . 1 . 2]" 1
1492 1 84 LEU MD2 1 85 ASP HA . . 4.850 4.622 4.015 4.794 . 0 0 "[ . 1 . 2]" 1
1493 1 84 LEU MD2 1 88 THR MG . . 3.610 2.443 2.138 3.024 . 0 0 "[ . 1 . 2]" 1
1494 1 85 ASP H 1 86 ILE H . . 4.400 2.760 2.595 2.957 . 0 0 "[ . 1 . 2]" 1
1495 1 85 ASP HA 1 85 ASP HB3 . . 2.990 2.916 2.528 3.027 0.037 6 0 "[ . 1 . 2]" 1
1496 1 85 ASP HA 1 88 THR MG . . 4.720 4.101 3.643 4.391 . 0 0 "[ . 1 . 2]" 1
1497 1 85 ASP HB2 1 86 ILE H . . 3.760 3.568 2.580 3.831 0.071 17 0 "[ . 1 . 2]" 1
1498 1 85 ASP HB2 1 86 ILE HG12 . . 4.980 4.450 2.752 4.982 0.002 11 0 "[ . 1 . 2]" 1
1499 1 85 ASP HB3 1 86 ILE H . . 3.640 2.852 2.390 3.662 0.022 18 0 "[ . 1 . 2]" 1
1500 1 85 ASP HB3 1 86 ILE HB . . 5.500 5.029 4.675 5.526 0.026 19 0 "[ . 1 . 2]" 1
1501 1 85 ASP HB3 1 86 ILE MD . . 5.170 3.331 2.813 3.752 . 0 0 "[ . 1 . 2]" 1
1502 1 86 ILE H 1 86 ILE HB . . 3.220 2.512 2.387 2.637 . 0 0 "[ . 1 . 2]" 1
1503 1 86 ILE H 1 86 ILE MD . . 3.730 3.251 2.968 3.530 . 0 0 "[ . 1 . 2]" 1
1504 1 86 ILE H 1 86 ILE HG12 . . 3.800 2.293 2.125 2.547 . 0 0 "[ . 1 . 2]" 1
1505 1 86 ILE H 1 86 ILE HG13 . . 3.880 3.735 3.646 3.880 . 0 0 "[ . 1 . 2]" 1
1506 1 86 ILE H 1 86 ILE MG . . 3.910 3.805 3.771 3.829 . 0 0 "[ . 1 . 2]" 1
1507 1 86 ILE H 1 87 VAL H . . 3.570 2.747 2.465 2.953 . 0 0 "[ . 1 . 2]" 1
1508 1 86 ILE H 1 87 VAL MG1 . . 4.710 4.222 3.753 4.461 . 0 0 "[ . 1 . 2]" 1
1509 1 86 ILE HA 1 86 ILE MD . . 3.270 2.166 2.113 2.257 . 0 0 "[ . 1 . 2]" 1
1510 1 86 ILE HA 1 86 ILE HG12 . . 3.670 3.219 3.106 3.370 . 0 0 "[ . 1 . 2]" 1
1511 1 86 ILE HA 1 86 ILE MG . . 3.060 2.418 2.305 2.489 . 0 0 "[ . 1 . 2]" 1
1512 1 86 ILE HA 1 87 VAL HA . . 5.030 4.795 4.737 4.940 . 0 0 "[ . 1 . 2]" 1
1513 1 86 ILE HA 1 89 LYS QB . . 3.220 2.494 2.232 3.195 . 0 0 "[ . 1 . 2]" 1
1514 1 86 ILE HA 1 89 LYS QE . . 4.600 4.399 3.994 4.650 0.050 5 0 "[ . 1 . 2]" 1
1515 1 86 ILE HB 1 87 VAL H . . 3.680 2.657 2.528 2.995 . 0 0 "[ . 1 . 2]" 1
1516 1 86 ILE HB 1 87 VAL MG1 . . 4.590 3.554 3.216 4.296 . 0 0 "[ . 1 . 2]" 1
1517 1 86 ILE MD 1 87 VAL H . . 4.770 4.765 4.677 4.792 0.022 14 0 "[ . 1 . 2]" 1
1518 1 86 ILE MD 1 89 LYS QB . . 4.810 3.517 3.273 3.884 . 0 0 "[ . 1 . 2]" 1
1519 1 86 ILE MD 1 89 LYS QE . . 5.190 5.006 4.752 5.194 0.004 13 0 "[ . 1 . 2]" 1
1520 1 86 ILE HG12 1 86 ILE MG . . 3.640 3.232 3.214 3.239 . 0 0 "[ . 1 . 2]" 1
1521 1 86 ILE HG13 1 86 ILE MG . . 3.650 2.297 2.249 2.322 . 0 0 "[ . 1 . 2]" 1
1522 1 86 ILE MG 1 87 VAL H . . 3.870 3.384 3.251 3.676 . 0 0 "[ . 1 . 2]" 1
1523 1 86 ILE MG 1 87 VAL HA . . 4.270 3.447 3.256 3.697 . 0 0 "[ . 1 . 2]" 1
1524 1 86 ILE MG 1 88 THR H . . 4.940 4.958 4.942 4.969 0.029 7 0 "[ . 1 . 2]" 1
1525 1 86 ILE MG 1 90 MET H . . 5.100 3.835 3.541 4.046 . 0 0 "[ . 1 . 2]" 1
1526 1 86 ILE MG 1 90 MET HG2 . . 4.570 3.742 3.458 3.984 . 0 0 "[ . 1 . 2]" 1
1527 1 87 VAL H 1 87 VAL MG1 . . 3.240 2.173 1.966 2.332 . 0 0 "[ . 1 . 2]" 1
1528 1 87 VAL H 1 87 VAL MG2 . . 4.500 2.481 2.106 3.813 . 0 0 "[ . 1 . 2]" 1
1529 1 87 VAL H 1 88 THR H . . 3.750 2.741 2.667 2.849 . 0 0 "[ . 1 . 2]" 1
1530 1 87 VAL H 1 88 THR MG . . 4.500 4.485 4.289 4.526 0.026 16 0 "[ . 1 . 2]" 1
1531 1 87 VAL HA 1 87 VAL MG1 . . 3.100 2.481 2.272 3.199 0.099 5 0 "[ . 1 . 2]" 1
1532 1 87 VAL HA 1 87 VAL MG2 . . 3.310 3.119 2.295 3.276 . 0 0 "[ . 1 . 2]" 1
1533 1 87 VAL HA 1 88 THR HA . . 4.780 4.739 4.638 4.819 0.039 1 0 "[ . 1 . 2]" 1
1534 1 87 VAL HA 1 90 MET H . . 4.200 3.560 3.335 3.848 . 0 0 "[ . 1 . 2]" 1
1535 1 87 VAL HA 1 90 MET HB2 . . 4.450 2.688 2.553 3.076 . 0 0 "[ . 1 . 2]" 1
1536 1 87 VAL HA 1 90 MET HB3 . . 4.910 4.312 4.206 4.667 . 0 0 "[ . 1 . 2]" 1
1537 1 87 VAL HA 1 90 MET HG2 . . 5.060 4.925 4.517 5.105 0.045 16 0 "[ . 1 . 2]" 1
1538 1 87 VAL HB 1 88 THR H . . 3.830 3.871 3.847 3.921 0.091 5 0 "[ . 1 . 2]" 1
1539 1 87 VAL MG1 1 88 THR H . . 4.530 3.721 2.138 4.138 . 0 0 "[ . 1 . 2]" 1
1540 1 87 VAL MG2 1 88 THR H . . 3.800 2.523 2.309 3.508 . 0 0 "[ . 1 . 2]" 1
1541 1 87 VAL MG2 1 88 THR MG . . 3.250 2.507 2.241 3.298 0.048 5 0 "[ . 1 . 2]" 1
1542 1 88 THR H 1 88 THR HB . . 3.660 3.658 3.577 3.680 0.020 16 0 "[ . 1 . 2]" 1
1543 1 88 THR H 1 88 THR MG . . 3.420 2.473 2.249 2.570 . 0 0 "[ . 1 . 2]" 1
1544 1 88 THR H 1 89 LYS H . . 3.590 2.681 2.559 2.754 . 0 0 "[ . 1 . 2]" 1
1545 1 88 THR HA 1 88 THR MG . . 3.120 2.314 2.215 2.398 . 0 0 "[ . 1 . 2]" 1
1546 1 88 THR HA 1 89 LYS HA . . 4.870 4.840 4.746 4.883 0.013 9 0 "[ . 1 . 2]" 1
1547 1 88 THR HA 1 90 MET H . . 4.760 4.537 4.352 4.668 . 0 0 "[ . 1 . 2]" 1
1548 1 88 THR HA 1 91 LEU H . . 4.070 3.145 3.011 3.330 . 0 0 "[ . 1 . 2]" 1
1549 1 88 THR HA 1 91 LEU HB2 . . 3.260 2.588 2.207 2.772 . 0 0 "[ . 1 . 2]" 1
1550 1 88 THR HA 1 91 LEU HB3 . . 3.930 2.822 2.591 3.042 . 0 0 "[ . 1 . 2]" 1
1551 1 88 THR HA 1 91 LEU MD1 . . 3.960 3.145 2.790 3.283 . 0 0 "[ . 1 . 2]" 1
1552 1 88 THR HA 1 91 LEU MD2 . . 4.670 4.628 4.486 4.685 0.015 5 0 "[ . 1 . 2]" 1
1553 1 88 THR HA 1 91 LEU HG . . 4.920 4.875 4.515 4.953 0.033 8 0 "[ . 1 . 2]" 1
1554 1 88 THR HA 1 92 GLU H . . 4.420 3.952 3.647 4.323 . 0 0 "[ . 1 . 2]" 1
1555 1 88 THR HB 1 89 LYS H . . 3.650 3.661 3.581 3.693 0.043 18 0 "[ . 1 . 2]" 1
1556 1 88 THR HB 1 89 LYS QB . . 5.500 5.429 5.290 5.564 0.064 16 0 "[ . 1 . 2]" 1
1557 1 88 THR HB 1 89 LYS QE . . 3.910 3.349 2.847 3.673 . 0 0 "[ . 1 . 2]" 1
1558 1 88 THR HB 1 91 LEU MD1 . . 5.020 4.563 4.297 4.759 . 0 0 "[ . 1 . 2]" 1
1559 1 88 THR MG 1 89 LYS H . . 4.220 4.098 3.960 4.178 . 0 0 "[ . 1 . 2]" 1
1560 1 88 THR MG 1 91 LEU MD1 . . 4.310 3.362 3.076 3.610 . 0 0 "[ . 1 . 2]" 1
1561 1 89 LYS H 1 89 LYS QB . . 3.060 2.240 2.095 2.596 . 0 0 "[ . 1 . 2]" 1
1562 1 89 LYS H 1 89 LYS HG2 . . 5.500 3.904 2.119 4.450 . 0 0 "[ . 1 . 2]" 1
1563 1 89 LYS H 1 89 LYS HG3 . . 3.980 3.973 3.559 4.034 0.054 14 0 "[ . 1 . 2]" 1
1564 1 89 LYS H 1 90 MET H . . 3.640 2.830 2.684 2.963 . 0 0 "[ . 1 . 2]" 1
1565 1 89 LYS H 1 91 LEU H . . 4.520 4.113 3.922 4.334 . 0 0 "[ . 1 . 2]" 1
1566 1 89 LYS HA 1 89 LYS HG2 . . 3.610 3.502 3.275 3.566 . 0 0 "[ . 1 . 2]" 1
1567 1 89 LYS HA 1 89 LYS HG3 . . 3.670 2.574 2.124 3.745 0.075 1 0 "[ . 1 . 2]" 1
1568 1 89 LYS HA 1 92 GLU H . . 3.920 3.585 3.320 3.853 . 0 0 "[ . 1 . 2]" 1
1569 1 89 LYS HA 1 92 GLU QB . . 3.250 2.854 2.443 3.268 0.018 20 0 "[ . 1 . 2]" 1
1570 1 89 LYS HA 1 92 GLU HG3 . . 4.640 3.647 2.949 4.101 . 0 0 "[ . 1 . 2]" 1
1571 1 89 LYS QB 1 89 LYS HD2 . . 3.290 2.756 2.480 3.375 0.085 8 0 "[ . 1 . 2]" 1
1572 1 89 LYS QB 1 89 LYS QE . . 3.250 2.851 2.420 3.244 . 0 0 "[ . 1 . 2]" 1
1573 1 89 LYS QB 1 90 MET H . . 3.530 2.574 2.412 2.761 . 0 0 "[ . 1 . 2]" 1
1574 1 89 LYS QE 1 92 GLU HG3 . . 4.410 4.079 3.377 4.438 0.028 20 0 "[ . 1 . 2]" 1
1575 1 89 LYS HG3 1 90 MET H . . 4.830 4.869 4.830 4.905 0.075 19 0 "[ . 1 . 2]" 1
1576 1 90 MET H 1 90 MET HB2 . . 3.620 2.525 2.403 2.730 . 0 0 "[ . 1 . 2]" 1
1577 1 90 MET H 1 90 MET HB3 . . 4.130 3.609 3.566 3.685 . 0 0 "[ . 1 . 2]" 1
1578 1 90 MET H 1 90 MET ME . . 4.730 4.745 4.695 4.761 0.031 16 0 "[ . 1 . 2]" 1
1579 1 90 MET H 1 90 MET HG2 . . 3.800 3.470 3.126 3.645 . 0 0 "[ . 1 . 2]" 1
1580 1 90 MET H 1 90 MET HG3 . . 3.480 2.303 2.108 2.398 . 0 0 "[ . 1 . 2]" 1
1581 1 90 MET H 1 91 LEU H . . 3.890 2.841 2.709 2.939 . 0 0 "[ . 1 . 2]" 1
1582 1 90 MET HA 1 90 MET ME . . 4.350 3.901 3.611 4.104 . 0 0 "[ . 1 . 2]" 1
1583 1 90 MET HA 1 90 MET HG2 . . 4.130 2.562 2.509 2.700 . 0 0 "[ . 1 . 2]" 1
1584 1 90 MET HA 1 90 MET HG3 . . 3.740 3.098 2.971 3.354 . 0 0 "[ . 1 . 2]" 1
1585 1 90 MET HA 1 95 ASP HB2 . . 3.630 2.973 2.308 3.662 0.032 12 0 "[ . 1 . 2]" 1
1586 1 90 MET HA 1 95 ASP HB3 . . 3.920 3.546 2.834 3.964 0.044 13 0 "[ . 1 . 2]" 1
1587 1 90 MET HA 1 96 LEU H . . 4.340 3.610 3.480 3.860 . 0 0 "[ . 1 . 2]" 1
1588 1 90 MET HB2 1 91 LEU H . . 4.400 2.861 2.670 3.023 . 0 0 "[ . 1 . 2]" 1
1589 1 90 MET HB2 1 96 LEU H . . 4.490 3.849 3.676 3.994 . 0 0 "[ . 1 . 2]" 1
1590 1 90 MET HB2 1 96 LEU HA . . 4.870 4.138 3.912 4.380 . 0 0 "[ . 1 . 2]" 1
1591 1 90 MET HB2 1 96 LEU HB3 . . 3.970 3.944 3.810 4.031 0.061 4 0 "[ . 1 . 2]" 1
1592 1 90 MET HB2 1 96 LEU MD2 . . 5.500 3.723 3.277 4.143 . 0 0 "[ . 1 . 2]" 1
1593 1 90 MET HB3 1 91 LEU H . . 4.840 3.787 3.585 3.948 . 0 0 "[ . 1 . 2]" 1
1594 1 90 MET HB3 1 96 LEU H . . 3.980 2.552 2.371 2.735 . 0 0 "[ . 1 . 2]" 1
1595 1 90 MET HB3 1 96 LEU HA . . 4.580 3.174 2.870 3.377 . 0 0 "[ . 1 . 2]" 1
1596 1 90 MET HB3 1 96 LEU HB3 . . 3.820 3.698 3.563 3.852 0.032 17 0 "[ . 1 . 2]" 1
1597 1 90 MET HB3 1 96 LEU MD2 . . 4.520 3.803 3.518 4.097 . 0 0 "[ . 1 . 2]" 1
1598 1 90 MET ME 1 90 MET HG2 . . 3.040 2.484 2.384 2.601 . 0 0 "[ . 1 . 2]" 1
1599 1 90 MET ME 1 90 MET HG3 . . 3.770 3.421 3.364 3.475 . 0 0 "[ . 1 . 2]" 1
1600 1 90 MET ME 1 95 ASP HB2 . . 3.980 3.610 2.979 4.000 0.020 12 0 "[ . 1 . 2]" 1
1601 1 90 MET ME 1 95 ASP HB3 . . 3.390 2.557 2.200 2.994 . 0 0 "[ . 1 . 2]" 1
1602 1 90 MET ME 1 96 LEU H . . 3.930 3.426 3.191 3.831 . 0 0 "[ . 1 . 2]" 1
1603 1 90 MET ME 1 96 LEU HA . . 3.150 2.217 2.035 2.441 . 0 0 "[ . 1 . 2]" 1
1604 1 90 MET ME 1 96 LEU HB3 . . 4.210 4.222 4.162 4.245 0.035 1 0 "[ . 1 . 2]" 1
1605 1 90 MET ME 1 96 LEU MD2 . . 3.240 2.733 2.261 3.177 . 0 0 "[ . 1 . 2]" 1
1606 1 90 MET ME 1 99 MET HB2 . . 3.490 3.372 3.036 3.510 0.020 14 0 "[ . 1 . 2]" 1
1607 1 90 MET ME 1 99 MET ME . . 2.690 2.556 2.270 2.703 0.013 18 0 "[ . 1 . 2]" 1
1608 1 90 MET HG3 1 96 LEU MD2 . . 5.500 5.353 5.026 5.544 0.044 4 0 "[ . 1 . 2]" 1
1609 1 91 LEU H 1 91 LEU HB2 . . 3.390 2.153 2.058 2.214 . 0 0 "[ . 1 . 2]" 1
1610 1 91 LEU H 1 91 LEU HB3 . . 3.470 2.831 2.731 3.041 . 0 0 "[ . 1 . 2]" 1
1611 1 91 LEU H 1 91 LEU MD1 . . 4.230 4.063 3.896 4.123 . 0 0 "[ . 1 . 2]" 1
1612 1 91 LEU H 1 91 LEU HG . . 4.440 4.155 3.917 4.235 . 0 0 "[ . 1 . 2]" 1
1613 1 91 LEU H 1 92 GLU H . . 3.590 2.782 2.610 2.914 . 0 0 "[ . 1 . 2]" 1
1614 1 91 LEU H 1 93 SER H . . 4.590 4.109 3.910 4.328 . 0 0 "[ . 1 . 2]" 1
1615 1 91 LEU H 1 96 LEU HB2 . . 4.610 3.321 2.980 3.674 . 0 0 "[ . 1 . 2]" 1
1616 1 91 LEU H 1 96 LEU MD1 . . 4.410 4.040 2.987 4.445 0.035 15 0 "[ . 1 . 2]" 1
1617 1 91 LEU HA 1 91 LEU MD1 . . 4.160 3.760 3.695 3.820 . 0 0 "[ . 1 . 2]" 1
1618 1 91 LEU HA 1 91 LEU MD2 . . 2.980 2.683 2.541 2.825 . 0 0 "[ . 1 . 2]" 1
1619 1 91 LEU HA 1 91 LEU HG . . 4.120 2.425 2.315 2.545 . 0 0 "[ . 1 . 2]" 1
1620 1 91 LEU HA 1 96 LEU HB2 . . 3.370 3.208 2.792 3.387 0.017 9 0 "[ . 1 . 2]" 1
1621 1 91 LEU HA 1 96 LEU HB3 . . 3.660 2.609 2.125 3.566 . 0 0 "[ . 1 . 2]" 1
1622 1 91 LEU HA 1 96 LEU MD1 . . 3.620 3.339 3.062 3.583 . 0 0 "[ . 1 . 2]" 1
1623 1 91 LEU HB2 1 91 LEU MD1 . . 3.180 2.241 2.188 2.282 . 0 0 "[ . 1 . 2]" 1
1624 1 91 LEU HB2 1 92 GLU H . . 3.460 3.474 3.255 3.506 0.046 16 0 "[ . 1 . 2]" 1
1625 1 91 LEU HB2 1 96 LEU MD1 . . 4.080 3.237 2.419 3.584 . 0 0 "[ . 1 . 2]" 1
1626 1 91 LEU HB3 1 91 LEU MD2 . . 2.850 2.410 2.357 2.488 . 0 0 "[ . 1 . 2]" 1
1627 1 91 LEU HB3 1 92 GLU H . . 3.960 2.408 2.232 2.536 . 0 0 "[ . 1 . 2]" 1
1628 1 91 LEU MD1 1 92 GLU H . . 4.510 4.431 4.204 4.533 0.023 19 0 "[ . 1 . 2]" 1
1629 1 91 LEU MD1 1 96 LEU MD1 . . 3.180 3.172 2.974 3.198 0.018 20 0 "[ . 1 . 2]" 1
1630 1 91 LEU MD2 1 92 GLU H . . 4.800 3.676 3.418 4.052 . 0 0 "[ . 1 . 2]" 1
1631 1 91 LEU MD2 1 92 GLU HA . . 4.550 3.643 3.359 4.306 . 0 0 "[ . 1 . 2]" 1
1632 1 91 LEU MD2 1 92 GLU HG2 . . 4.740 4.074 3.351 4.754 0.014 2 0 "[ . 1 . 2]" 1
1633 1 91 LEU MD2 1 96 LEU HB3 . . 4.790 4.470 4.080 4.796 0.006 4 0 "[ . 1 . 2]" 1
1634 1 91 LEU HG 1 92 GLU H . . 5.500 4.908 4.787 5.012 . 0 0 "[ . 1 . 2]" 1
1635 1 92 GLU H 1 92 GLU QB . . 2.980 2.445 2.328 2.619 . 0 0 "[ . 1 . 2]" 1
1636 1 92 GLU H 1 92 GLU HG2 . . 4.020 3.111 2.223 3.576 . 0 0 "[ . 1 . 2]" 1
1637 1 92 GLU H 1 92 GLU HG3 . . 3.370 2.441 2.129 3.408 0.038 19 0 "[ . 1 . 2]" 1
1638 1 92 GLU H 1 93 SER H . . 3.730 2.809 2.704 3.045 . 0 0 "[ . 1 . 2]" 1
1639 1 92 GLU HA 1 92 GLU QB . . 2.740 2.393 2.347 2.463 . 0 0 "[ . 1 . 2]" 1
1640 1 92 GLU HA 1 92 GLU HG2 . . 3.230 2.380 2.205 2.780 . 0 0 "[ . 1 . 2]" 1
1641 1 92 GLU HA 1 92 GLU HG3 . . 3.610 3.258 2.782 3.658 0.048 19 0 "[ . 1 . 2]" 1
1642 1 92 GLU HA 1 93 SER HA . . 4.920 4.783 4.706 4.875 . 0 0 "[ . 1 . 2]" 1
1643 1 92 GLU HA 1 94 GLY H . . 4.410 3.932 3.734 4.273 . 0 0 "[ . 1 . 2]" 1
1644 1 92 GLU QB 1 92 GLU HG2 . . 2.610 2.433 2.275 2.569 . 0 0 "[ . 1 . 2]" 1
1645 1 92 GLU QB 1 93 SER H . . 3.440 2.599 2.256 3.009 . 0 0 "[ . 1 . 2]" 1
1646 1 92 GLU QB 1 94 GLY H . . 4.580 4.525 4.422 4.606 0.026 12 0 "[ . 1 . 2]" 1
1647 1 92 GLU HG2 1 93 SER H . . 4.800 4.829 4.545 4.899 0.099 7 0 "[ . 1 . 2]" 1
1648 1 92 GLU HG3 1 93 SER H . . 4.790 4.482 4.267 4.817 0.027 19 0 "[ . 1 . 2]" 1
1649 1 93 SER H 1 93 SER HB2 . . 3.620 2.786 2.197 3.650 0.030 7 0 "[ . 1 . 2]" 1
1650 1 93 SER H 1 93 SER HB3 . . 3.440 2.880 2.412 3.547 0.107 10 0 "[ . 1 . 2]" 1
1651 1 93 SER H 1 94 GLY H . . 3.080 2.702 2.331 2.881 . 0 0 "[ . 1 . 2]" 1
1652 1 93 SER HA 1 93 SER HB2 . . 2.850 2.615 2.326 2.961 0.111 2 0 "[ . 1 . 2]" 1
1653 1 93 SER HA 1 93 SER HB3 . . 2.960 2.672 2.314 3.011 0.051 13 0 "[ . 1 . 2]" 1
1654 1 94 GLY H 1 95 ASP H . . 3.230 2.923 2.697 3.238 0.008 10 0 "[ . 1 . 2]" 1
1655 1 94 GLY H 1 96 LEU H . . 4.320 3.992 3.757 4.248 . 0 0 "[ . 1 . 2]" 1
1656 1 94 GLY HA2 1 97 LYS H . . 4.420 3.582 3.234 3.993 . 0 0 "[ . 1 . 2]" 1
1657 1 95 ASP H 1 95 ASP HB2 . . 3.310 2.242 2.032 2.442 . 0 0 "[ . 1 . 2]" 1
1658 1 95 ASP H 1 95 ASP HB3 . . 3.510 3.227 2.688 3.542 0.032 19 0 "[ . 1 . 2]" 1
1659 1 95 ASP H 1 96 LEU H . . 3.500 2.871 2.621 3.171 . 0 0 "[ . 1 . 2]" 1
1660 1 95 ASP HA 1 98 LYS H . . 3.700 3.294 3.090 3.499 . 0 0 "[ . 1 . 2]" 1
1661 1 95 ASP HA 1 98 LYS HB2 . . 3.540 2.861 2.264 3.434 . 0 0 "[ . 1 . 2]" 1
1662 1 95 ASP HA 1 98 LYS HB3 . . 3.010 2.376 2.144 2.710 . 0 0 "[ . 1 . 2]" 1
1663 1 95 ASP HA 1 98 LYS HG3 . . 5.060 4.608 3.718 5.098 0.038 10 0 "[ . 1 . 2]" 1
1664 1 95 ASP HA 1 99 MET H . . 4.290 4.018 3.898 4.260 . 0 0 "[ . 1 . 2]" 1
1665 1 95 ASP HB2 1 96 LEU H . . 4.020 3.325 2.696 3.894 . 0 0 "[ . 1 . 2]" 1
1666 1 95 ASP HB3 1 96 LEU H . . 4.180 3.270 2.535 3.852 . 0 0 "[ . 1 . 2]" 1
1667 1 95 ASP HB3 1 98 LYS H . . 5.200 5.238 5.207 5.264 0.064 16 0 "[ . 1 . 2]" 1
1668 1 96 LEU H 1 96 LEU HB2 . . 3.250 2.329 2.105 2.491 . 0 0 "[ . 1 . 2]" 1
1669 1 96 LEU H 1 96 LEU HB3 . . 3.520 2.633 2.403 3.005 . 0 0 "[ . 1 . 2]" 1
1670 1 96 LEU H 1 96 LEU MD1 . . 4.410 4.210 4.157 4.278 . 0 0 "[ . 1 . 2]" 1
1671 1 96 LEU H 1 96 LEU MD2 . . 4.160 4.182 4.147 4.218 0.058 1 0 "[ . 1 . 2]" 1
1672 1 96 LEU H 1 96 LEU HG . . 5.070 4.339 3.958 4.534 . 0 0 "[ . 1 . 2]" 1
1673 1 96 LEU H 1 97 LYS H . . 3.520 2.681 2.583 2.769 . 0 0 "[ . 1 . 2]" 1
1674 1 96 LEU H 1 98 LYS H . . 4.190 3.797 3.679 3.988 . 0 0 "[ . 1 . 2]" 1
1675 1 96 LEU HA 1 96 LEU MD1 . . 4.280 3.569 3.307 3.852 . 0 0 "[ . 1 . 2]" 1
1676 1 96 LEU HA 1 96 LEU MD2 . . 2.940 2.150 2.069 2.201 . 0 0 "[ . 1 . 2]" 1
1677 1 96 LEU HA 1 96 LEU HG . . 3.890 3.356 2.630 3.731 . 0 0 "[ . 1 . 2]" 1
1678 1 96 LEU HA 1 98 LYS H . . 4.890 4.313 4.203 4.430 . 0 0 "[ . 1 . 2]" 1
1679 1 96 LEU HA 1 99 MET HB2 . . 3.590 3.177 2.663 3.594 0.004 12 0 "[ . 1 . 2]" 1
1680 1 96 LEU HB2 1 97 LYS H . . 3.720 3.629 3.313 3.770 0.050 12 0 "[ . 1 . 2]" 1
1681 1 96 LEU HB3 1 96 LEU MD1 . . 3.650 2.253 2.209 2.309 . 0 0 "[ . 1 . 2]" 1
1682 1 96 LEU HB3 1 96 LEU MD2 . . 3.370 3.012 2.495 3.255 . 0 0 "[ . 1 . 2]" 1
1683 1 96 LEU HB3 1 97 LYS H . . 4.070 2.500 2.376 2.828 . 0 0 "[ . 1 . 2]" 1
1684 1 96 LEU MD1 1 97 LYS H . . 4.700 3.637 3.073 4.648 . 0 0 "[ . 1 . 2]" 1
1685 1 96 LEU MD2 1 98 LYS H . . 5.460 5.338 5.094 5.465 0.005 9 0 "[ . 1 . 2]" 1
1686 1 97 LYS H 1 97 LYS HB2 . . 2.900 2.366 2.271 2.464 . 0 0 "[ . 1 . 2]" 1
1687 1 97 LYS H 1 97 LYS HB3 . . 3.530 3.560 3.546 3.574 0.044 14 0 "[ . 1 . 2]" 1
1688 1 97 LYS H 1 97 LYS HG2 . . 4.090 3.658 3.385 4.019 . 0 0 "[ . 1 . 2]" 1
1689 1 97 LYS H 1 97 LYS HG3 . . 4.730 2.463 2.212 2.961 . 0 0 "[ . 1 . 2]" 1
1690 1 97 LYS H 1 98 LYS H . . 3.420 2.654 2.532 2.782 . 0 0 "[ . 1 . 2]" 1
1691 1 97 LYS H 1 100 LEU MD1 . . 5.030 4.289 3.671 4.641 . 0 0 "[ . 1 . 2]" 1
1692 1 97 LYS HA 1 97 LYS HB3 . . 2.750 2.529 2.466 2.663 . 0 0 "[ . 1 . 2]" 1
1693 1 97 LYS HA 1 97 LYS HG2 . . 3.540 2.498 2.239 2.679 . 0 0 "[ . 1 . 2]" 1
1694 1 97 LYS HA 1 97 LYS HG3 . . 3.410 2.971 2.736 3.145 . 0 0 "[ . 1 . 2]" 1
1695 1 97 LYS HA 1 100 LEU H . . 3.820 3.485 3.189 3.707 . 0 0 "[ . 1 . 2]" 1
1696 1 97 LYS HA 1 100 LEU HB2 . . 3.840 3.006 2.404 3.574 . 0 0 "[ . 1 . 2]" 1
1697 1 97 LYS HA 1 100 LEU MD1 . . 3.280 2.136 2.044 2.233 . 0 0 "[ . 1 . 2]" 1
1698 1 97 LYS HA 1 100 LEU MD2 . . 4.720 4.562 4.214 4.739 0.019 17 0 "[ . 1 . 2]" 1
1699 1 97 LYS HB2 1 98 LYS H . . 3.560 2.890 2.700 3.053 . 0 0 "[ . 1 . 2]" 1
1700 1 97 LYS HB3 1 97 LYS QE . . 4.610 2.727 1.959 4.231 . 0 0 "[ . 1 . 2]" 1
1701 1 97 LYS HB3 1 97 LYS HG2 . . 2.750 2.462 2.409 2.561 . 0 0 "[ . 1 . 2]" 1
1702 1 97 LYS HB3 1 97 LYS HG3 . . 3.010 3.030 3.025 3.035 0.025 13 0 "[ . 1 . 2]" 1
1703 1 97 LYS HB3 1 98 LYS H . . 4.060 3.716 3.338 3.907 . 0 0 "[ . 1 . 2]" 1
1704 1 97 LYS HB3 1 100 LEU MD1 . . 4.490 4.023 3.518 4.436 . 0 0 "[ . 1 . 2]" 1
1705 1 97 LYS QE 1 97 LYS HG2 . . 3.460 2.537 2.356 3.357 . 0 0 "[ . 1 . 2]" 1
1706 1 98 LYS H 1 98 LYS HB2 . . 2.770 2.394 2.142 2.644 . 0 0 "[ . 1 . 2]" 1
1707 1 98 LYS H 1 98 LYS HB3 . . 3.130 2.666 2.458 3.116 . 0 0 "[ . 1 . 2]" 1
1708 1 98 LYS H 1 98 LYS HG2 . . 4.620 4.460 3.873 4.615 . 0 0 "[ . 1 . 2]" 1
1709 1 98 LYS H 1 99 MET H . . 3.300 2.892 2.720 3.034 . 0 0 "[ . 1 . 2]" 1
1710 1 98 LYS HA 1 98 LYS HB2 . . 2.830 2.538 2.412 2.747 . 0 0 "[ . 1 . 2]" 1
1711 1 98 LYS HA 1 98 LYS HG2 . . 3.790 2.873 2.262 3.805 0.015 3 0 "[ . 1 . 2]" 1
1712 1 98 LYS HA 1 98 LYS HG3 . . 3.570 2.813 2.328 3.600 0.030 13 0 "[ . 1 . 2]" 1
1713 1 98 LYS HA 1 101 ARG H . . 3.790 3.779 3.511 3.835 0.045 19 0 "[ . 1 . 2]" 1
1714 1 98 LYS HA 1 101 ARG QD . . 4.410 3.045 2.315 3.940 . 0 0 "[ . 1 . 2]" 1
1715 1 98 LYS HA 1 101 ARG HG2 . . 4.710 2.363 2.089 2.911 . 0 0 "[ . 1 . 2]" 1
1716 1 98 LYS HA 1 102 ASP H . . 4.570 4.093 3.896 4.394 . 0 0 "[ . 1 . 2]" 1
1717 1 98 LYS HB2 1 98 LYS QE . . 4.300 3.348 1.891 4.315 0.015 20 0 "[ . 1 . 2]" 1
1718 1 98 LYS HB2 1 99 MET H . . 3.960 3.888 3.479 3.990 0.030 3 0 "[ . 1 . 2]" 1
1719 1 98 LYS HB3 1 98 LYS QE . . 4.410 3.356 2.019 4.251 . 0 0 "[ . 1 . 2]" 1
1720 1 98 LYS HB3 1 99 MET H . . 3.510 2.664 2.528 2.836 . 0 0 "[ . 1 . 2]" 1
1721 1 98 LYS QE 1 98 LYS HG2 . . 3.760 2.873 2.280 3.553 . 0 0 "[ . 1 . 2]" 1
1722 1 98 LYS QE 1 98 LYS HG3 . . 3.780 2.565 2.247 3.361 . 0 0 "[ . 1 . 2]" 1
1723 1 98 LYS HG2 1 99 MET H . . 5.130 4.234 3.358 5.142 0.012 13 0 "[ . 1 . 2]" 1
1724 1 99 MET H 1 99 MET HB2 . . 3.430 2.098 2.073 2.129 . 0 0 "[ . 1 . 2]" 1
1725 1 99 MET H 1 99 MET HB3 . . 3.200 3.134 3.045 3.214 0.014 13 0 "[ . 1 . 2]" 1
1726 1 99 MET H 1 99 MET ME . . 4.340 4.358 4.342 4.379 0.039 3 0 "[ . 1 . 2]" 1
1727 1 99 MET H 1 99 MET HG2 . . 4.120 4.108 4.030 4.143 0.023 14 0 "[ . 1 . 2]" 1
1728 1 99 MET H 1 99 MET HG3 . . 3.830 3.867 3.826 3.903 0.073 19 0 "[ . 1 . 2]" 1
1729 1 99 MET H 1 100 LEU H . . 3.750 2.896 2.701 2.960 . 0 0 "[ . 1 . 2]" 1
1730 1 99 MET H 1 100 LEU HB2 . . 5.180 5.147 4.939 5.200 0.020 14 0 "[ . 1 . 2]" 1
1731 1 99 MET HA 1 99 MET HB3 . . 2.840 2.902 2.873 2.922 0.082 11 0 "[ . 1 . 2]" 1
1732 1 99 MET HA 1 99 MET HG2 . . 3.190 2.056 2.039 2.082 . 0 0 "[ . 1 . 2]" 1
1733 1 99 MET HA 1 102 ASP HB2 . . 2.970 2.922 2.331 3.017 0.047 18 0 "[ . 1 . 2]" 1
1734 1 99 MET HA 1 102 ASP HB3 . . 3.650 2.981 2.480 3.632 . 0 0 "[ . 1 . 2]" 1
1735 1 99 MET HB2 1 99 MET ME . . 2.590 2.596 2.552 2.619 0.029 7 0 "[ . 1 . 2]" 1
1736 1 99 MET HB2 1 100 LEU H . . 3.830 3.486 3.305 3.660 . 0 0 "[ . 1 . 2]" 1
1737 1 99 MET HB3 1 99 MET ME . . 3.060 2.232 2.124 2.349 . 0 0 "[ . 1 . 2]" 1
1738 1 99 MET HB3 1 100 LEU H . . 3.780 2.845 2.586 3.044 . 0 0 "[ . 1 . 2]" 1
1739 1 99 MET HB3 1 100 LEU HA . . 4.870 3.943 3.836 4.035 . 0 0 "[ . 1 . 2]" 1
1740 1 99 MET HB3 1 100 LEU MD2 . . 4.390 4.007 3.731 4.220 . 0 0 "[ . 1 . 2]" 1
1741 1 99 MET ME 1 99 MET HG2 . . 3.350 3.376 3.365 3.387 0.037 18 0 "[ . 1 . 2]" 1
1742 1 99 MET ME 1 99 MET HG3 . . 3.060 2.519 2.484 2.575 . 0 0 "[ . 1 . 2]" 1
1743 1 99 MET HG2 1 100 LEU H . . 5.060 4.858 4.729 4.957 . 0 0 "[ . 1 . 2]" 1
1744 1 99 MET HG2 1 103 LYS HD3 . . 4.570 3.138 2.870 3.475 . 0 0 "[ . 1 . 2]" 1
1745 1 99 MET HG2 1 103 LYS QG . . 4.740 4.120 3.626 4.553 . 0 0 "[ . 1 . 2]" 1
1746 1 100 LEU H 1 100 LEU HB2 . . 3.540 2.546 2.501 2.614 . 0 0 "[ . 1 . 2]" 1
1747 1 100 LEU H 1 100 LEU HB3 . . 3.620 3.622 3.600 3.637 0.017 5 0 "[ . 1 . 2]" 1
1748 1 100 LEU H 1 100 LEU MD1 . . 4.100 3.415 3.233 3.560 . 0 0 "[ . 1 . 2]" 1
1749 1 100 LEU H 1 100 LEU MD2 . . 3.580 3.470 3.262 3.593 0.013 19 0 "[ . 1 . 2]" 1
1750 1 100 LEU H 1 100 LEU HG . . 3.800 2.194 2.092 2.281 . 0 0 "[ . 1 . 2]" 1
1751 1 100 LEU HA 1 100 LEU MD1 . . 4.240 3.907 3.881 3.931 . 0 0 "[ . 1 . 2]" 1
1752 1 100 LEU HA 1 100 LEU MD2 . . 3.010 2.265 2.230 2.300 . 0 0 "[ . 1 . 2]" 1
1753 1 100 LEU HA 1 100 LEU HG . . 3.500 3.066 2.916 3.192 . 0 0 "[ . 1 . 2]" 1
1754 1 100 LEU HA 1 105 ILE H . . 4.490 3.409 3.257 3.612 . 0 0 "[ . 1 . 2]" 1
1755 1 100 LEU HA 1 105 ILE HB . . 3.710 2.558 2.354 2.796 . 0 0 "[ . 1 . 2]" 1
1756 1 100 LEU HA 1 105 ILE MG . . 4.890 3.884 3.666 4.103 . 0 0 "[ . 1 . 2]" 1
1757 1 100 LEU HB2 1 100 LEU MD1 . . 3.490 2.199 2.156 2.230 . 0 0 "[ . 1 . 2]" 1
1758 1 100 LEU HB2 1 101 ARG H . . 3.820 2.335 2.257 2.458 . 0 0 "[ . 1 . 2]" 1
1759 1 100 LEU HB2 1 105 ILE H . . 4.930 4.952 4.822 4.978 0.048 5 0 "[ . 1 . 2]" 1
1760 1 100 LEU HB2 1 105 ILE HB . . 4.370 4.200 3.971 4.373 0.003 20 0 "[ . 1 . 2]" 1
1761 1 100 LEU HB2 1 107 CYS HB3 . . 4.610 4.301 3.988 4.498 . 0 0 "[ . 1 . 2]" 1
1762 1 100 LEU HB3 1 100 LEU MD1 . . 3.170 2.413 2.329 2.498 . 0 0 "[ . 1 . 2]" 1
1763 1 100 LEU HB3 1 100 LEU MD2 . . 3.160 2.354 2.309 2.415 . 0 0 "[ . 1 . 2]" 1
1764 1 100 LEU HB3 1 101 ARG H . . 3.870 3.435 3.375 3.520 . 0 0 "[ . 1 . 2]" 1
1765 1 100 LEU HB3 1 105 ILE HB . . 3.850 2.603 2.330 2.785 . 0 0 "[ . 1 . 2]" 1
1766 1 100 LEU HB3 1 107 CYS HB2 . . 4.720 4.548 4.205 4.761 0.041 4 0 "[ . 1 . 2]" 1
1767 1 100 LEU MD1 1 101 ARG H . . 4.070 4.116 4.091 4.157 0.087 19 0 "[ . 1 . 2]" 1
1768 1 100 LEU MD1 1 107 CYS HB2 . . 4.460 2.911 2.689 3.348 . 0 0 "[ . 1 . 2]" 1
1769 1 100 LEU MD1 1 107 CYS HB3 . . 3.530 2.309 2.104 2.820 . 0 0 "[ . 1 . 2]" 1
1770 1 100 LEU MD2 1 101 ARG H . . 5.010 4.741 4.663 4.818 . 0 0 "[ . 1 . 2]" 1
1771 1 100 LEU MD2 1 105 ILE HB . . 3.310 2.456 2.271 2.666 . 0 0 "[ . 1 . 2]" 1
1772 1 100 LEU MD2 1 107 CYS HB3 . . 4.900 3.504 3.199 3.882 . 0 0 "[ . 1 . 2]" 1
1773 1 101 ARG H 1 101 ARG QB . . 2.790 2.408 2.190 2.583 . 0 0 "[ . 1 . 2]" 1
1774 1 101 ARG H 1 101 ARG QD . . 4.160 3.960 3.655 4.187 0.027 6 0 "[ . 1 . 2]" 1
1775 1 101 ARG H 1 101 ARG HG2 . . 3.520 2.546 2.093 2.898 . 0 0 "[ . 1 . 2]" 1
1776 1 101 ARG H 1 101 ARG HG3 . . 3.990 3.691 3.364 4.020 0.030 10 0 "[ . 1 . 2]" 1
1777 1 101 ARG H 1 102 ASP H . . 3.390 2.763 2.648 2.853 . 0 0 "[ . 1 . 2]" 1
1778 1 101 ARG HA 1 101 ARG QB . . 2.730 2.128 2.095 2.151 . 0 0 "[ . 1 . 2]" 1
1779 1 101 ARG HA 1 101 ARG HG3 . . 3.630 3.673 3.632 3.717 0.087 13 0 "[ . 1 . 2]" 1
1780 1 101 ARG HA 1 102 ASP H . . 3.480 3.495 3.467 3.514 0.034 6 0 "[ . 1 . 2]" 1
1781 1 101 ARG HA 1 102 ASP HA . . 4.820 4.785 4.710 4.839 0.019 11 0 "[ . 1 . 2]" 1
1782 1 101 ARG HA 1 104 GLY H . . 3.420 3.345 3.150 3.438 0.018 4 0 "[ . 1 . 2]" 1
1783 1 101 ARG HA 1 105 ILE H . . 3.940 3.757 3.447 3.950 0.010 15 0 "[ . 1 . 2]" 1
1784 1 101 ARG QB 1 101 ARG QD . . 2.920 2.278 2.071 2.579 . 0 0 "[ . 1 . 2]" 1
1785 1 101 ARG QB 1 101 ARG HG2 . . 2.530 2.359 2.303 2.412 . 0 0 "[ . 1 . 2]" 1
1786 1 101 ARG QB 1 102 ASP H . . 3.520 3.554 3.523 3.585 0.065 13 0 "[ . 1 . 2]" 1
1787 1 101 ARG QB 1 102 ASP HA . . 4.880 4.723 4.568 4.884 0.004 11 0 "[ . 1 . 2]" 1
1788 1 101 ARG QB 1 102 ASP HB2 . . 5.260 5.234 5.068 5.318 0.058 20 0 "[ . 1 . 2]" 1
1789 1 101 ARG QB 1 103 LYS H . . 5.500 5.290 5.101 5.425 . 0 0 "[ . 1 . 2]" 1
1790 1 101 ARG QB 1 110 LEU QB . . 3.450 3.457 3.314 3.537 0.087 15 0 "[ . 1 . 2]" 1
1791 1 101 ARG QB 1 110 LEU MD2 . . 4.260 2.720 2.041 3.387 . 0 0 "[ . 1 . 2]" 1
1792 1 101 ARG QD 1 101 ARG HG3 . . 2.670 2.378 2.205 2.454 . 0 0 "[ . 1 . 2]" 1
1793 1 101 ARG QD 1 110 LEU QB . . 4.640 2.801 2.344 3.390 . 0 0 "[ . 1 . 2]" 1
1794 1 101 ARG QD 1 110 LEU MD1 . . 5.310 2.752 2.151 3.945 . 0 0 "[ . 1 . 2]" 1
1795 1 101 ARG QD 1 110 LEU MD2 . . 4.540 3.666 2.568 4.545 0.005 4 0 "[ . 1 . 2]" 1
1796 1 101 ARG HG2 1 102 ASP H . . 4.000 2.697 2.557 2.849 . 0 0 "[ . 1 . 2]" 1
1797 1 101 ARG HG2 1 102 ASP HA . . 4.860 4.712 4.142 4.899 0.039 12 0 "[ . 1 . 2]" 1
1798 1 101 ARG HG3 1 102 ASP H . . 4.880 2.764 2.403 3.250 . 0 0 "[ . 1 . 2]" 1
1799 1 101 ARG HG3 1 102 ASP HA . . 4.600 3.624 3.298 3.912 . 0 0 "[ . 1 . 2]" 1
1800 1 101 ARG HG3 1 102 ASP HB2 . . 4.890 3.887 3.563 4.243 . 0 0 "[ . 1 . 2]" 1
1801 1 102 ASP H 1 102 ASP HB2 . . 3.020 2.217 2.035 2.290 . 0 0 "[ . 1 . 2]" 1
1802 1 102 ASP H 1 102 ASP HB3 . . 3.340 2.963 2.645 3.393 0.053 20 0 "[ . 1 . 2]" 1
1803 1 102 ASP H 1 103 LYS H . . 3.380 2.730 2.630 2.837 . 0 0 "[ . 1 . 2]" 1
1804 1 102 ASP HA 1 102 ASP HB3 . . 2.890 2.934 2.685 2.987 0.097 11 0 "[ . 1 . 2]" 1
1805 1 102 ASP HA 1 104 GLY H . . 4.140 4.134 3.948 4.176 0.036 14 0 "[ . 1 . 2]" 1
1806 1 102 ASP HB2 1 103 LYS H . . 3.530 3.461 2.723 3.615 0.085 2 0 "[ . 1 . 2]" 1
1807 1 102 ASP HB2 1 103 LYS HD2 . . 4.940 4.816 4.170 5.005 0.065 9 0 "[ . 1 . 2]" 1
1808 1 102 ASP HB3 1 103 LYS H . . 3.820 2.658 2.360 3.225 . 0 0 "[ . 1 . 2]" 1
1809 1 102 ASP HB3 1 103 LYS HA . . 4.540 4.156 3.976 4.295 . 0 0 "[ . 1 . 2]" 1
1810 1 102 ASP HB3 1 103 LYS HD2 . . 4.550 3.213 2.964 3.419 . 0 0 "[ . 1 . 2]" 1
1811 1 102 ASP HB3 1 103 LYS HD3 . . 4.490 2.411 2.165 2.632 . 0 0 "[ . 1 . 2]" 1
1812 1 103 LYS H 1 103 LYS HB2 . . 3.450 2.263 2.154 2.329 . 0 0 "[ . 1 . 2]" 1
1813 1 103 LYS H 1 103 LYS HB3 . . 3.570 3.535 3.463 3.582 0.012 12 0 "[ . 1 . 2]" 1
1814 1 103 LYS H 1 103 LYS HD2 . . 4.250 3.426 3.247 3.573 . 0 0 "[ . 1 . 2]" 1
1815 1 103 LYS H 1 103 LYS HD3 . . 3.690 2.552 2.359 2.799 . 0 0 "[ . 1 . 2]" 1
1816 1 103 LYS HA 1 103 LYS HD2 . . 3.430 2.295 2.131 2.431 . 0 0 "[ . 1 . 2]" 1
1817 1 103 LYS HA 1 103 LYS HD3 . . 3.020 3.097 3.076 3.121 0.101 17 0 "[ . 1 . 2]" 1
1818 1 103 LYS HA 1 104 GLY HA3 . . 4.530 4.488 4.346 4.553 0.023 19 0 "[ . 1 . 2]" 1
1819 1 103 LYS HB2 1 104 GLY H . . 3.910 3.625 3.313 3.911 0.001 5 0 "[ . 1 . 2]" 1
1820 1 103 LYS HB3 1 103 LYS HD2 . . 3.860 3.794 3.618 3.871 0.011 15 0 "[ . 1 . 2]" 1
1821 1 103 LYS HB3 1 104 GLY HA3 . . 4.800 4.846 4.812 4.865 0.065 13 0 "[ . 1 . 2]" 1
1822 1 103 LYS HB3 1 105 ILE MD . . 3.890 2.557 2.317 2.960 . 0 0 "[ . 1 . 2]" 1
1823 1 104 GLY H 1 104 GLY HA2 . . 2.780 2.342 2.328 2.369 . 0 0 "[ . 1 . 2]" 1
1824 1 104 GLY H 1 105 ILE H . . 3.150 2.620 2.491 2.754 . 0 0 "[ . 1 . 2]" 1
1825 1 105 ILE H 1 105 ILE HB . . 3.180 2.443 2.275 2.531 . 0 0 "[ . 1 . 2]" 1
1826 1 105 ILE H 1 105 ILE MD . . 3.700 3.506 2.859 3.723 0.023 15 0 "[ . 1 . 2]" 1
1827 1 105 ILE H 1 105 ILE HG12 . . 4.160 3.413 2.139 4.022 . 0 0 "[ . 1 . 2]" 1
1828 1 105 ILE H 1 105 ILE HG13 . . 3.550 2.841 2.346 3.641 0.091 10 0 "[ . 1 . 2]" 1
1829 1 105 ILE H 1 105 ILE MG . . 3.880 3.807 3.746 3.852 . 0 0 "[ . 1 . 2]" 1
1830 1 105 ILE H 1 106 THR H . . 4.620 4.598 4.536 4.645 0.025 19 0 "[ . 1 . 2]" 1
1831 1 105 ILE HA 1 105 ILE MD . . 3.820 3.418 2.140 3.849 0.029 1 0 "[ . 1 . 2]" 1
1832 1 105 ILE HA 1 105 ILE HG12 . . 4.200 2.688 2.401 3.394 . 0 0 "[ . 1 . 2]" 1
1833 1 105 ILE HA 1 105 ILE HG13 . . 3.570 3.053 2.671 3.650 0.080 17 0 "[ . 1 . 2]" 1
1834 1 105 ILE HA 1 105 ILE MG . . 3.060 2.467 2.347 2.648 . 0 0 "[ . 1 . 2]" 1
1835 1 105 ILE HA 1 106 THR H . . 2.500 2.208 2.115 2.305 . 0 0 "[ . 1 . 2]" 1
1836 1 105 ILE MD 1 106 THR H . . 5.210 4.634 3.671 5.131 . 0 0 "[ . 1 . 2]" 1
1837 1 105 ILE HG12 1 106 THR H . . 5.330 4.366 3.813 5.191 . 0 0 "[ . 1 . 2]" 1
1838 1 105 ILE HG13 1 105 ILE MG . . 3.360 2.986 2.164 3.260 . 0 0 "[ . 1 . 2]" 1
1839 1 105 ILE HG13 1 106 THR H . . 4.960 4.893 4.636 4.997 0.037 9 0 "[ . 1 . 2]" 1
1840 1 105 ILE MG 1 106 THR H . . 3.440 2.366 2.196 2.664 . 0 0 "[ . 1 . 2]" 1
1841 1 105 ILE MG 1 106 THR HA . . 4.720 4.160 4.016 4.367 . 0 0 "[ . 1 . 2]" 1
1842 1 105 ILE MG 1 106 THR HB . . 4.550 4.184 3.983 4.369 . 0 0 "[ . 1 . 2]" 1
1843 1 105 ILE MG 1 106 THR MG . . 3.380 2.763 2.498 3.027 . 0 0 "[ . 1 . 2]" 1
1844 1 106 THR H 1 106 THR HB . . 3.140 2.432 2.232 2.670 . 0 0 "[ . 1 . 2]" 1
1845 1 106 THR H 1 106 THR MG . . 3.810 2.337 2.185 2.628 . 0 0 "[ . 1 . 2]" 1
1846 1 106 THR HA 1 106 THR MG . . 3.300 3.285 3.264 3.306 0.006 15 0 "[ . 1 . 2]" 1
1847 1 106 THR HA 1 107 CYS H . . 2.710 2.218 2.178 2.275 . 0 0 "[ . 1 . 2]" 1
1848 1 106 THR HB 1 107 CYS H . . 4.680 4.407 4.199 4.549 . 0 0 "[ . 1 . 2]" 1
1849 1 107 CYS H 1 107 CYS HB2 . . 3.960 3.984 3.933 4.013 0.053 17 0 "[ . 1 . 2]" 1
1850 1 107 CYS H 1 107 CYS HB3 . . 4.080 3.518 3.422 3.624 . 0 0 "[ . 1 . 2]" 1
1851 1 107 CYS H 1 108 ARG H . . 4.630 4.377 4.324 4.436 . 0 0 "[ . 1 . 2]" 1
1852 1 107 CYS H 1 110 LEU MD2 . . 4.570 4.395 3.766 4.635 0.065 6 0 "[ . 1 . 2]" 1
1853 1 107 CYS HA 1 107 CYS HB3 . . 2.780 2.403 2.344 2.465 . 0 0 "[ . 1 . 2]" 1
1854 1 107 CYS HA 1 108 ARG H . . 2.880 2.325 2.174 2.491 . 0 0 "[ . 1 . 2]" 1
1855 1 107 CYS HA 1 108 ARG HB2 . . 4.840 4.685 4.495 4.868 0.028 6 0 "[ . 1 . 2]" 1
1856 1 107 CYS HB2 1 108 ARG H . . 3.370 2.404 2.233 2.621 . 0 0 "[ . 1 . 2]" 1
1857 1 107 CYS HB2 1 110 LEU MD2 . . 5.200 3.881 3.066 4.261 . 0 0 "[ . 1 . 2]" 1
1858 1 107 CYS HB3 1 108 ARG H . . 3.640 3.646 3.538 3.687 0.047 10 0 "[ . 1 . 2]" 1
1859 1 107 CYS HB3 1 110 LEU MD2 . . 4.540 4.508 4.081 4.588 0.048 5 0 "[ . 1 . 2]" 1
1860 1 108 ARG H 1 108 ARG HB2 . . 3.110 2.383 2.245 2.527 . 0 0 "[ . 1 . 2]" 1
1861 1 108 ARG H 1 108 ARG HB3 . . 3.550 3.566 3.518 3.593 0.043 7 0 "[ . 1 . 2]" 1
1862 1 108 ARG H 1 108 ARG QD . . 4.930 3.746 3.527 4.253 . 0 0 "[ . 1 . 2]" 1
1863 1 108 ARG H 1 108 ARG HD3 . . 4.640 4.259 3.669 4.725 0.085 10 0 "[ . 1 . 2]" 1
1864 1 108 ARG H 1 108 ARG HG2 . . 3.990 3.293 2.287 3.904 . 0 0 "[ . 1 . 2]" 1
1865 1 108 ARG HA 1 108 ARG HB3 . . 3.000 2.516 2.427 2.637 . 0 0 "[ . 1 . 2]" 1
1866 1 108 ARG HA 1 108 ARG QD . . 4.310 3.526 2.098 4.256 . 0 0 "[ . 1 . 2]" 1
1867 1 108 ARG HA 1 108 ARG HG2 . . 3.690 2.763 2.276 3.619 . 0 0 "[ . 1 . 2]" 1
1868 1 108 ARG HA 1 108 ARG HG3 . . 3.620 3.173 2.689 3.689 0.069 6 0 "[ . 1 . 2]" 1
1869 1 108 ARG HA 1 109 ASP H . . 2.840 2.318 2.177 2.430 . 0 0 "[ . 1 . 2]" 1
1870 1 108 ARG HA 1 109 ASP HB2 . . 4.580 4.478 4.151 4.644 0.064 20 0 "[ . 1 . 2]" 1
1871 1 108 ARG HB2 1 108 ARG QD . . 3.730 2.786 2.298 3.552 . 0 0 "[ . 1 . 2]" 1
1872 1 108 ARG HB2 1 109 ASP H . . 4.500 3.636 3.392 3.862 . 0 0 "[ . 1 . 2]" 1
1873 1 108 ARG HB2 1 109 ASP HB2 . . 5.330 5.339 5.132 5.427 0.097 10 0 "[ . 1 . 2]" 1
1874 1 108 ARG HB3 1 108 ARG QD . . 3.570 2.666 2.346 3.165 . 0 0 "[ . 1 . 2]" 1
1875 1 108 ARG HB3 1 109 ASP H . . 3.590 2.393 2.106 2.621 . 0 0 "[ . 1 . 2]" 1
1876 1 108 ARG HB3 1 109 ASP HB2 . . 4.430 3.953 3.737 4.328 . 0 0 "[ . 1 . 2]" 1
1877 1 109 ASP H 1 109 ASP HB2 . . 3.240 2.221 1.978 2.459 . 0 0 "[ . 1 . 2]" 1
1878 1 109 ASP H 1 109 ASP HB3 . . 4.020 3.291 2.697 3.576 . 0 0 "[ . 1 . 2]" 1
1879 1 109 ASP H 1 110 LEU H . . 4.300 4.365 4.251 4.408 0.108 12 0 "[ . 1 . 2]" 1
1880 1 109 ASP HA 1 109 ASP HB3 . . 2.950 2.777 2.566 3.005 0.055 3 0 "[ . 1 . 2]" 1
1881 1 109 ASP HA 1 110 LEU H . . 2.540 1.996 1.921 2.110 . 0 0 "[ . 1 . 2]" 1
1882 1 109 ASP HA 1 110 LEU QB . . 4.430 4.198 3.939 4.430 . 0 0 "[ . 1 . 2]" 1
1883 1 109 ASP HA 1 110 LEU MD2 . . 4.950 3.471 2.724 4.351 . 0 0 "[ . 1 . 2]" 1
1884 1 109 ASP HB2 1 110 LEU H . . 4.790 4.279 4.040 4.446 . 0 0 "[ . 1 . 2]" 1
1885 1 110 LEU H 1 110 LEU QB . . 2.740 2.400 2.065 2.698 . 0 0 "[ . 1 . 2]" 1
1886 1 110 LEU H 1 110 LEU MD2 . . 3.900 2.665 2.043 3.252 . 0 0 "[ . 1 . 2]" 1
1887 1 110 LEU HA 1 110 LEU QB . . 2.790 2.407 2.261 2.584 . 0 0 "[ . 1 . 2]" 1
1888 1 110 LEU HA 1 110 LEU MD1 . . 3.980 2.860 2.124 3.929 . 0 0 "[ . 1 . 2]" 1
1889 1 110 LEU HA 1 110 LEU MD2 . . 3.220 2.659 2.196 3.224 0.004 4 0 "[ . 1 . 2]" 1
1890 1 110 LEU QB 1 110 LEU MD1 . . 2.980 2.219 2.064 2.382 . 0 0 "[ . 1 . 2]" 1
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