NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
454211 |
2ytw   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2ytw
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 2857
_Distance_constraint_stats_list.Viol_count 1867
_Distance_constraint_stats_list.Viol_total 405.449
_Distance_constraint_stats_list.Viol_max 0.135
_Distance_constraint_stats_list.Viol_rms 0.0041
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0004
_Distance_constraint_stats_list.Viol_average_violations_only 0.0109
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 8 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 16 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 17 LYS 0.039 0.018 17 0 "[ . 1 . 2]"
1 18 LYS 0.183 0.019 20 0 "[ . 1 . 2]"
1 19 LYS 0.421 0.046 12 0 "[ . 1 . 2]"
1 20 TYR 1.683 0.037 12 0 "[ . 1 . 2]"
1 21 ILE 0.961 0.037 12 0 "[ . 1 . 2]"
1 22 GLY 0.304 0.019 1 0 "[ . 1 . 2]"
1 23 ILE 1.485 0.097 7 0 "[ . 1 . 2]"
1 24 ARG 0.565 0.033 12 0 "[ . 1 . 2]"
1 25 MET 0.115 0.010 2 0 "[ . 1 . 2]"
1 26 MET 0.064 0.010 9 0 "[ . 1 . 2]"
1 27 SER 0.016 0.006 7 0 "[ . 1 . 2]"
1 28 LEU 0.055 0.004 7 0 "[ . 1 . 2]"
1 29 THR 0.003 0.001 11 0 "[ . 1 . 2]"
1 31 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 LYS 0.013 0.003 1 0 "[ . 1 . 2]"
1 33 ALA 0.029 0.004 6 0 "[ . 1 . 2]"
1 34 LYS 0.003 0.002 3 0 "[ . 1 . 2]"
1 35 GLU 0.013 0.003 1 0 "[ . 1 . 2]"
1 36 LEU 0.046 0.008 7 0 "[ . 1 . 2]"
1 37 LYS 0.051 0.010 7 0 "[ . 1 . 2]"
1 38 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 HIS 0.041 0.006 7 0 "[ . 1 . 2]"
1 41 ARG 0.017 0.010 7 0 "[ . 1 . 2]"
1 42 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 PHE 0.455 0.015 10 0 "[ . 1 . 2]"
1 44 PRO 0.029 0.005 17 0 "[ . 1 . 2]"
1 45 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 VAL 0.747 0.030 11 0 "[ . 1 . 2]"
1 47 ILE 0.113 0.012 10 0 "[ . 1 . 2]"
1 48 SER 0.034 0.012 10 0 "[ . 1 . 2]"
1 49 GLY 0.055 0.010 16 0 "[ . 1 . 2]"
1 50 ALA 0.012 0.004 7 0 "[ . 1 . 2]"
1 51 TYR 0.114 0.007 7 0 "[ . 1 . 2]"
1 52 ILE 0.262 0.012 13 0 "[ . 1 . 2]"
1 53 ILE 0.166 0.010 9 0 "[ . 1 . 2]"
1 54 GLU 1.012 0.033 12 0 "[ . 1 . 2]"
1 55 VAL 2.992 0.097 7 0 "[ . 1 . 2]"
1 56 ILE 1.253 0.046 19 0 "[ . 1 . 2]"
1 57 PRO 2.521 0.135 2 0 "[ . 1 . 2]"
1 58 ASP 2.521 0.135 2 0 "[ . 1 . 2]"
1 59 THR 2.173 0.074 6 0 "[ . 1 . 2]"
1 60 PRO 1.996 0.037 12 0 "[ . 1 . 2]"
1 61 ALA 1.281 0.062 10 0 "[ . 1 . 2]"
1 62 GLU 3.676 0.100 1 0 "[ . 1 . 2]"
1 63 ALA 0.313 0.027 10 0 "[ . 1 . 2]"
1 64 GLY 0.097 0.012 6 0 "[ . 1 . 2]"
1 65 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 LEU 0.288 0.015 5 0 "[ . 1 . 2]"
1 67 LYS 0.055 0.009 20 0 "[ . 1 . 2]"
1 68 GLU 0.102 0.010 11 0 "[ . 1 . 2]"
1 69 ASN 0.033 0.007 7 0 "[ . 1 . 2]"
1 70 ASP 0.050 0.007 5 0 "[ . 1 . 2]"
1 71 VAL 0.128 0.009 20 0 "[ . 1 . 2]"
1 72 ILE 0.058 0.008 16 0 "[ . 1 . 2]"
1 73 ILE 0.092 0.010 16 0 "[ . 1 . 2]"
1 74 SER 0.029 0.003 12 0 "[ . 1 . 2]"
1 75 ILE 0.103 0.007 6 0 "[ . 1 . 2]"
1 76 ASN 0.005 0.002 9 0 "[ . 1 . 2]"
1 77 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 GLN 0.005 0.001 9 0 "[ . 1 . 2]"
1 79 SER 0.000 0.000 10 0 "[ . 1 . 2]"
1 80 VAL 0.096 0.006 6 0 "[ . 1 . 2]"
1 81 VAL 0.101 0.010 15 0 "[ . 1 . 2]"
1 82 SER 0.011 0.002 6 0 "[ . 1 . 2]"
1 83 ALA 0.103 0.006 6 0 "[ . 1 . 2]"
1 84 ASN 0.012 0.012 6 0 "[ . 1 . 2]"
1 85 ASP 0.046 0.012 6 0 "[ . 1 . 2]"
1 86 VAL 0.074 0.007 10 0 "[ . 1 . 2]"
1 87 SER 0.084 0.010 2 0 "[ . 1 . 2]"
1 88 ASP 0.098 0.009 6 0 "[ . 1 . 2]"
1 89 VAL 0.419 0.032 14 0 "[ . 1 . 2]"
1 90 ILE 0.174 0.016 2 0 "[ . 1 . 2]"
1 91 LYS 0.454 0.032 14 0 "[ . 1 . 2]"
1 92 ARG 0.008 0.006 14 0 "[ . 1 . 2]"
1 93 GLU 0.122 0.010 6 0 "[ . 1 . 2]"
1 94 SER 0.178 0.020 9 0 "[ . 1 . 2]"
1 95 THR 0.255 0.015 12 0 "[ . 1 . 2]"
1 96 LEU 0.450 0.017 7 0 "[ . 1 . 2]"
1 97 ASN 0.106 0.008 10 0 "[ . 1 . 2]"
1 98 MET 0.323 0.010 10 0 "[ . 1 . 2]"
1 99 VAL 0.026 0.010 5 0 "[ . 1 . 2]"
1 100 VAL 0.057 0.008 16 0 "[ . 1 . 2]"
1 101 ARG 0.109 0.010 16 0 "[ . 1 . 2]"
1 102 ARG 0.070 0.009 7 0 "[ . 1 . 2]"
1 103 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 104 ASN 0.027 0.015 5 0 "[ . 1 . 2]"
1 105 GLU 0.034 0.015 5 0 "[ . 1 . 2]"
1 106 ASP 0.010 0.010 5 0 "[ . 1 . 2]"
1 107 ILE 0.009 0.002 13 0 "[ . 1 . 2]"
1 108 MET 0.007 0.003 9 0 "[ . 1 . 2]"
1 109 ILE 0.268 0.012 20 0 "[ . 1 . 2]"
1 110 THR 0.021 0.003 10 0 "[ . 1 . 2]"
1 111 VAL 0.532 0.027 8 0 "[ . 1 . 2]"
1 112 ILE 1.763 0.075 5 0 "[ . 1 . 2]"
1 113 PRO 1.648 0.075 5 0 "[ . 1 . 2]"
1 114 GLU 0.524 0.037 12 0 "[ . 1 . 2]"
1 115 GLU 0.024 0.009 12 0 "[ . 1 . 2]"
1 116 ILE 0.432 0.021 2 0 "[ . 1 . 2]"
1 117 ASP 0.093 0.019 17 0 "[ . 1 . 2]"
1 118 PRO 0.114 0.018 17 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 8 ARG HA 1 8 ARG QG . . 3.670 2.370 2.009 3.328 . 0 0 "[ . 1 . 2]" 1
2 1 8 ARG QB 1 8 ARG QG . . 2.300 2.038 2.013 2.083 . 0 0 "[ . 1 . 2]" 1
3 1 8 ARG QD 1 8 ARG QH1 . . 3.510 1.990 1.889 2.076 . 0 0 "[ . 1 . 2]" 1
4 1 11 LYS H 1 11 LYS QG . . 4.400 3.306 2.029 4.339 . 0 0 "[ . 1 . 2]" 1
5 1 11 LYS HA 1 11 LYS QG . . 3.680 2.564 2.065 3.413 . 0 0 "[ . 1 . 2]" 1
6 1 14 ALA HA 1 15 ILE H . . 2.850 2.405 2.164 2.694 . 0 0 "[ . 1 . 2]" 1
7 1 14 ALA HA 1 15 ILE HB . . 5.500 4.880 4.658 5.241 . 0 0 "[ . 1 . 2]" 1
8 1 14 ALA MB 1 15 ILE H . . 3.970 2.660 2.022 3.710 . 0 0 "[ . 1 . 2]" 1
9 1 15 ILE H 1 15 ILE HB . . 3.400 2.645 2.519 2.878 . 0 0 "[ . 1 . 2]" 1
10 1 15 ILE H 1 15 ILE MD . . 4.260 2.742 2.080 4.240 . 0 0 "[ . 1 . 2]" 1
11 1 15 ILE H 1 15 ILE HG12 . . 4.440 3.598 2.024 4.419 . 0 0 "[ . 1 . 2]" 1
12 1 15 ILE H 1 15 ILE QG . . 3.710 2.596 2.013 3.374 . 0 0 "[ . 1 . 2]" 1
13 1 15 ILE H 1 15 ILE HG13 . . 4.440 2.938 2.162 3.956 . 0 0 "[ . 1 . 2]" 1
14 1 15 ILE HA 1 15 ILE MD . . 4.090 3.352 1.970 3.877 . 0 0 "[ . 1 . 2]" 1
15 1 15 ILE HA 1 15 ILE HG12 . . 4.090 3.221 2.573 3.537 . 0 0 "[ . 1 . 2]" 1
16 1 15 ILE HA 1 15 ILE QG . . 3.430 2.523 2.367 3.000 . 0 0 "[ . 1 . 2]" 1
17 1 15 ILE HA 1 15 ILE HG13 . . 4.090 2.798 2.404 3.765 . 0 0 "[ . 1 . 2]" 1
18 1 15 ILE HA 1 15 ILE MG . . 3.270 2.287 2.203 2.374 . 0 0 "[ . 1 . 2]" 1
19 1 15 ILE HA 1 16 THR H . . 3.560 2.673 2.140 3.555 . 0 0 "[ . 1 . 2]" 1
20 1 15 ILE HB 1 15 ILE MD . . 3.530 2.352 1.996 3.231 . 0 0 "[ . 1 . 2]" 1
21 1 15 ILE HB 1 16 THR HA . . 5.500 4.724 4.167 5.500 . 0 0 "[ . 1 . 2]" 1
22 1 15 ILE MG 1 16 THR H . . 4.390 3.012 1.993 3.880 . 0 0 "[ . 1 . 2]" 1
23 1 16 THR H 1 16 THR HB . . 4.200 3.475 2.595 3.948 . 0 0 "[ . 1 . 2]" 1
24 1 16 THR H 1 16 THR MG . . 4.490 3.073 2.150 3.973 . 0 0 "[ . 1 . 2]" 1
25 1 16 THR HA 1 16 THR HB . . 2.950 2.675 2.353 2.939 . 0 0 "[ . 1 . 2]" 1
26 1 16 THR HA 1 16 THR MG . . 3.250 2.233 1.959 3.196 . 0 0 "[ . 1 . 2]" 1
27 1 16 THR HA 1 17 LYS H . . 2.940 2.431 2.154 2.698 . 0 0 "[ . 1 . 2]" 1
28 1 16 THR HB 1 17 LYS H . . 4.000 2.743 2.001 3.979 . 0 0 "[ . 1 . 2]" 1
29 1 16 THR MG 1 17 LYS H . . 4.180 3.036 1.938 4.108 . 0 0 "[ . 1 . 2]" 1
30 1 17 LYS H 1 17 LYS HB2 . . 3.410 2.776 2.637 3.426 0.016 17 0 "[ . 1 . 2]" 1
31 1 17 LYS H 1 17 LYS HB3 . . 4.130 3.732 3.578 4.073 . 0 0 "[ . 1 . 2]" 1
32 1 17 LYS H 1 17 LYS HG2 . . 4.030 3.159 2.546 3.894 . 0 0 "[ . 1 . 2]" 1
33 1 17 LYS H 1 17 LYS QG . . 3.420 2.422 1.986 3.077 . 0 0 "[ . 1 . 2]" 1
34 1 17 LYS H 1 17 LYS HG3 . . 4.030 2.538 2.006 3.224 . 0 0 "[ . 1 . 2]" 1
35 1 17 LYS H 1 18 LYS H . . 4.730 4.538 4.400 4.616 . 0 0 "[ . 1 . 2]" 1
36 1 17 LYS HA 1 17 LYS HD2 . . 5.280 4.407 3.884 4.961 . 0 0 "[ . 1 . 2]" 1
37 1 17 LYS HA 1 17 LYS QD . . 4.420 3.814 3.535 4.121 . 0 0 "[ . 1 . 2]" 1
38 1 17 LYS HA 1 17 LYS HD3 . . 5.280 4.225 3.748 4.680 . 0 0 "[ . 1 . 2]" 1
39 1 17 LYS HA 1 17 LYS HG2 . . 3.790 2.580 2.394 2.718 . 0 0 "[ . 1 . 2]" 1
40 1 17 LYS HA 1 17 LYS QG . . 3.310 2.507 2.312 2.589 . 0 0 "[ . 1 . 2]" 1
41 1 17 LYS HA 1 17 LYS HG3 . . 3.790 3.439 3.040 3.672 . 0 0 "[ . 1 . 2]" 1
42 1 17 LYS HA 1 18 LYS H . . 2.800 2.497 2.426 2.637 . 0 0 "[ . 1 . 2]" 1
43 1 17 LYS HA 1 18 LYS HG2 . . 4.490 4.118 3.995 4.328 . 0 0 "[ . 1 . 2]" 1
44 1 17 LYS HA 1 118 PRO HD2 . . 4.860 4.231 3.957 4.551 . 0 0 "[ . 1 . 2]" 1
45 1 17 LYS HA 1 118 PRO HD3 . . 3.740 2.528 2.226 2.913 . 0 0 "[ . 1 . 2]" 1
46 1 17 LYS HB2 1 17 LYS QD . . 3.490 2.598 2.382 2.962 . 0 0 "[ . 1 . 2]" 1
47 1 17 LYS HB2 1 17 LYS HE2 . . 5.500 4.133 2.770 5.140 . 0 0 "[ . 1 . 2]" 1
48 1 17 LYS HB2 1 17 LYS HE3 . . 5.500 4.142 3.471 4.736 . 0 0 "[ . 1 . 2]" 1
49 1 17 LYS HB2 1 18 LYS H . . 3.490 3.274 3.047 3.363 . 0 0 "[ . 1 . 2]" 1
50 1 17 LYS HB2 1 116 ILE H . . 4.860 4.633 4.001 4.861 0.001 20 0 "[ . 1 . 2]" 1
51 1 17 LYS HB3 1 17 LYS HD2 . . 3.810 2.488 2.024 3.562 . 0 0 "[ . 1 . 2]" 1
52 1 17 LYS HB3 1 17 LYS QD . . 3.140 2.207 1.995 2.383 . 0 0 "[ . 1 . 2]" 1
53 1 17 LYS HB3 1 17 LYS HD3 . . 3.810 2.804 2.021 3.371 . 0 0 "[ . 1 . 2]" 1
54 1 17 LYS HB3 1 18 LYS H . . 3.070 2.307 1.948 2.454 . 0 0 "[ . 1 . 2]" 1
55 1 17 LYS HB3 1 115 GLU HB3 . . 3.970 3.672 3.041 3.910 . 0 0 "[ . 1 . 2]" 1
56 1 17 LYS HB3 1 116 ILE H . . 4.200 3.888 3.415 4.089 . 0 0 "[ . 1 . 2]" 1
57 1 17 LYS HB3 1 117 ASP HA . . 3.920 2.878 2.730 3.204 . 0 0 "[ . 1 . 2]" 1
58 1 17 LYS HB3 1 118 PRO HD2 . . 5.300 4.878 4.559 5.318 0.018 17 0 "[ . 1 . 2]" 1
59 1 17 LYS HB3 1 118 PRO HD3 . . 4.330 3.644 3.262 4.259 . 0 0 "[ . 1 . 2]" 1
60 1 17 LYS QD 1 18 LYS H . . 5.190 4.208 3.918 4.446 . 0 0 "[ . 1 . 2]" 1
61 1 17 LYS QD 1 116 ILE H . . 5.340 4.559 4.084 4.830 . 0 0 "[ . 1 . 2]" 1
62 1 17 LYS QD 1 116 ILE HA . . 4.710 3.763 3.146 4.166 . 0 0 "[ . 1 . 2]" 1
63 1 17 LYS QD 1 117 ASP H . . 5.040 3.547 2.760 4.141 . 0 0 "[ . 1 . 2]" 1
64 1 17 LYS QD 1 117 ASP HA . . 4.600 2.519 2.019 4.050 . 0 0 "[ . 1 . 2]" 1
65 1 17 LYS HD2 1 116 ILE HA . . 5.500 4.271 3.369 5.276 . 0 0 "[ . 1 . 2]" 1
66 1 17 LYS HD3 1 116 ILE HA . . 5.500 4.486 3.499 5.481 . 0 0 "[ . 1 . 2]" 1
67 1 17 LYS QE 1 17 LYS QG . . 3.110 2.111 1.973 2.286 . 0 0 "[ . 1 . 2]" 1
68 1 17 LYS QG 1 18 LYS H . . 4.930 4.051 3.565 4.177 . 0 0 "[ . 1 . 2]" 1
69 1 17 LYS QG 1 117 ASP HA . . 4.400 2.898 2.080 3.222 . 0 0 "[ . 1 . 2]" 1
70 1 17 LYS QG 1 118 PRO HD2 . . 4.600 3.815 3.125 4.555 . 0 0 "[ . 1 . 2]" 1
71 1 17 LYS QG 1 118 PRO HD3 . . 4.400 2.642 1.984 3.565 . 0 0 "[ . 1 . 2]" 1
72 1 18 LYS H 1 18 LYS HB2 . . 4.010 3.840 3.779 3.853 . 0 0 "[ . 1 . 2]" 1
73 1 18 LYS H 1 18 LYS HB3 . . 3.740 3.075 3.010 3.097 . 0 0 "[ . 1 . 2]" 1
74 1 18 LYS H 1 18 LYS HG2 . . 4.200 2.391 2.224 2.464 . 0 0 "[ . 1 . 2]" 1
75 1 18 LYS H 1 18 LYS HG3 . . 3.670 3.251 3.119 3.488 . 0 0 "[ . 1 . 2]" 1
76 1 18 LYS H 1 19 LYS H . . 4.480 4.420 4.342 4.445 . 0 0 "[ . 1 . 2]" 1
77 1 18 LYS H 1 115 GLU HA . . 4.930 4.638 4.058 4.858 . 0 0 "[ . 1 . 2]" 1
78 1 18 LYS H 1 116 ILE MD . . 5.120 4.813 4.732 4.974 . 0 0 "[ . 1 . 2]" 1
79 1 18 LYS H 1 116 ILE HG12 . . 4.970 4.499 4.403 4.551 . 0 0 "[ . 1 . 2]" 1
80 1 18 LYS H 1 116 ILE MG . . 5.500 5.435 5.180 5.519 0.019 20 0 "[ . 1 . 2]" 1
81 1 18 LYS H 1 118 PRO HD3 . . 4.490 4.177 3.948 4.493 0.003 14 0 "[ . 1 . 2]" 1
82 1 18 LYS HA 1 18 LYS HD2 . . 4.710 4.558 4.522 4.590 . 0 0 "[ . 1 . 2]" 1
83 1 18 LYS HA 1 18 LYS HG2 . . 4.090 3.797 3.755 3.832 . 0 0 "[ . 1 . 2]" 1
84 1 18 LYS HA 1 18 LYS HG3 . . 4.200 3.701 3.673 3.734 . 0 0 "[ . 1 . 2]" 1
85 1 18 LYS HA 1 19 LYS H . . 2.760 2.252 2.169 2.296 . 0 0 "[ . 1 . 2]" 1
86 1 18 LYS HB2 1 18 LYS HE2 . . 5.310 4.592 4.471 4.661 . 0 0 "[ . 1 . 2]" 1
87 1 18 LYS HB2 1 18 LYS HE3 . . 5.500 3.721 3.342 3.956 . 0 0 "[ . 1 . 2]" 1
88 1 18 LYS HB2 1 19 LYS H . . 3.800 2.877 2.730 3.183 . 0 0 "[ . 1 . 2]" 1
89 1 18 LYS HB2 1 116 ILE MD . . 5.050 5.038 4.998 5.056 0.006 19 0 "[ . 1 . 2]" 1
90 1 18 LYS HB3 1 116 ILE MD . . 5.500 5.492 5.470 5.510 0.010 1 0 "[ . 1 . 2]" 1
91 1 18 LYS HB3 1 118 PRO HA . . 4.090 4.011 3.695 4.100 0.010 12 0 "[ . 1 . 2]" 1
92 1 18 LYS HB3 1 118 PRO QB . . 5.340 4.494 4.146 4.659 . 0 0 "[ . 1 . 2]" 1
93 1 18 LYS HD2 1 19 LYS H . . 5.500 5.010 4.705 5.503 0.003 12 0 "[ . 1 . 2]" 1
94 1 18 LYS HD2 1 116 ILE MD . . 4.780 4.605 4.448 4.786 0.006 20 0 "[ . 1 . 2]" 1
95 1 18 LYS HD3 1 116 ILE MD . . 5.180 4.451 4.133 4.635 . 0 0 "[ . 1 . 2]" 1
96 1 18 LYS HD3 1 118 PRO HA . . 3.600 2.989 2.309 3.490 . 0 0 "[ . 1 . 2]" 1
97 1 18 LYS HD3 1 118 PRO QB . . 5.340 4.274 3.761 4.666 . 0 0 "[ . 1 . 2]" 1
98 1 18 LYS HE2 1 116 ILE MD . . 4.340 2.884 2.592 3.019 . 0 0 "[ . 1 . 2]" 1
99 1 18 LYS HE2 1 116 ILE HG12 . . 5.060 4.964 4.701 5.068 0.008 7 0 "[ . 1 . 2]" 1
100 1 18 LYS HE2 1 116 ILE HG13 . . 4.700 3.952 3.735 4.052 . 0 0 "[ . 1 . 2]" 1
101 1 18 LYS HE2 1 118 PRO HA . . 4.480 3.989 3.843 4.201 . 0 0 "[ . 1 . 2]" 1
102 1 18 LYS HE3 1 18 LYS HG3 . . 3.920 2.148 2.028 2.247 . 0 0 "[ . 1 . 2]" 1
103 1 18 LYS HE3 1 19 LYS H . . 5.500 5.426 5.327 5.502 0.002 12 0 "[ . 1 . 2]" 1
104 1 18 LYS HE3 1 116 ILE MD . . 4.510 2.505 2.255 2.810 . 0 0 "[ . 1 . 2]" 1
105 1 18 LYS HE3 1 116 ILE HG12 . . 5.260 4.169 4.018 4.392 . 0 0 "[ . 1 . 2]" 1
106 1 18 LYS HE3 1 116 ILE HG13 . . 4.990 3.733 3.580 3.950 . 0 0 "[ . 1 . 2]" 1
107 1 18 LYS HE3 1 118 PRO HA . . 5.160 5.128 4.982 5.177 0.017 2 0 "[ . 1 . 2]" 1
108 1 18 LYS HG2 1 116 ILE MD . . 4.710 3.723 3.658 3.800 . 0 0 "[ . 1 . 2]" 1
109 1 18 LYS HG2 1 118 PRO HA . . 4.710 2.726 2.624 2.944 . 0 0 "[ . 1 . 2]" 1
110 1 18 LYS HG3 1 19 LYS H . . 4.560 3.853 3.723 4.222 . 0 0 "[ . 1 . 2]" 1
111 1 18 LYS HG3 1 20 TYR HB3 . . 5.040 4.106 3.882 4.211 . 0 0 "[ . 1 . 2]" 1
112 1 18 LYS HG3 1 116 ILE H . . 4.940 4.080 3.785 4.210 . 0 0 "[ . 1 . 2]" 1
113 1 18 LYS HG3 1 116 ILE MD . . 4.090 2.934 2.902 2.968 . 0 0 "[ . 1 . 2]" 1
114 1 18 LYS HG3 1 116 ILE MG . . 5.050 4.997 4.874 5.053 0.003 20 0 "[ . 1 . 2]" 1
115 1 18 LYS HG3 1 118 PRO HA . . 4.600 4.381 4.302 4.473 . 0 0 "[ . 1 . 2]" 1
116 1 19 LYS H 1 19 LYS HB2 . . 3.130 2.244 2.181 2.403 . 0 0 "[ . 1 . 2]" 1
117 1 19 LYS H 1 19 LYS HB3 . . 3.640 3.496 3.457 3.587 . 0 0 "[ . 1 . 2]" 1
118 1 19 LYS H 1 19 LYS HD2 . . 5.000 3.901 3.594 5.046 0.046 12 0 "[ . 1 . 2]" 1
119 1 19 LYS H 1 19 LYS QD . . 4.390 2.824 2.482 4.231 . 0 0 "[ . 1 . 2]" 1
120 1 19 LYS H 1 19 LYS HD3 . . 5.000 2.913 2.527 4.543 . 0 0 "[ . 1 . 2]" 1
121 1 19 LYS H 1 19 LYS HE2 . . 5.500 4.918 4.752 5.506 0.006 12 0 "[ . 1 . 2]" 1
122 1 19 LYS H 1 19 LYS HE3 . . 5.500 5.440 4.889 5.516 0.016 17 0 "[ . 1 . 2]" 1
123 1 19 LYS H 1 19 LYS QG . . 3.730 3.400 2.338 3.739 0.009 4 0 "[ . 1 . 2]" 1
124 1 19 LYS H 1 20 TYR H . . 4.730 4.588 4.574 4.635 . 0 0 "[ . 1 . 2]" 1
125 1 19 LYS H 1 90 ILE MG . . 4.490 3.889 3.774 4.170 . 0 0 "[ . 1 . 2]" 1
126 1 19 LYS H 1 91 LYS HA . . 4.710 3.705 3.488 4.204 . 0 0 "[ . 1 . 2]" 1
127 1 19 LYS H 1 91 LYS HB3 . . 4.930 2.790 2.517 3.526 . 0 0 "[ . 1 . 2]" 1
128 1 19 LYS H 1 116 ILE H . . 5.040 4.493 4.409 4.530 . 0 0 "[ . 1 . 2]" 1
129 1 19 LYS H 1 116 ILE HG12 . . 5.440 4.961 4.855 5.337 . 0 0 "[ . 1 . 2]" 1
130 1 19 LYS HA 1 19 LYS HD2 . . 4.330 3.075 2.832 3.927 . 0 0 "[ . 1 . 2]" 1
131 1 19 LYS HA 1 19 LYS QD . . 3.800 2.694 2.084 2.860 . 0 0 "[ . 1 . 2]" 1
132 1 19 LYS HA 1 19 LYS HD3 . . 4.330 3.094 2.144 3.369 . 0 0 "[ . 1 . 2]" 1
133 1 19 LYS HA 1 19 LYS HE2 . . 5.500 4.910 4.080 5.151 . 0 0 "[ . 1 . 2]" 1
134 1 19 LYS HA 1 19 LYS HE3 . . 5.500 4.895 4.420 4.967 . 0 0 "[ . 1 . 2]" 1
135 1 19 LYS HA 1 19 LYS HG2 . . 4.090 3.371 2.516 3.560 . 0 0 "[ . 1 . 2]" 1
136 1 19 LYS HA 1 19 LYS QG . . 3.530 2.358 2.223 2.831 . 0 0 "[ . 1 . 2]" 1
137 1 19 LYS HA 1 19 LYS HG3 . . 4.090 2.624 2.246 3.750 . 0 0 "[ . 1 . 2]" 1
138 1 19 LYS HA 1 20 TYR H . . 2.950 2.416 2.345 2.423 . 0 0 "[ . 1 . 2]" 1
139 1 19 LYS HA 1 20 TYR HB2 . . 5.500 5.419 5.398 5.431 . 0 0 "[ . 1 . 2]" 1
140 1 19 LYS HA 1 20 TYR HB3 . . 4.710 3.957 3.939 3.978 . 0 0 "[ . 1 . 2]" 1
141 1 19 LYS HA 1 20 TYR QD . . 4.710 3.956 3.894 3.990 . 0 0 "[ . 1 . 2]" 1
142 1 19 LYS HA 1 90 ILE MG . . 4.490 4.036 3.957 4.082 . 0 0 "[ . 1 . 2]" 1
143 1 19 LYS HA 1 115 GLU HA . . 3.690 2.267 2.004 2.334 . 0 0 "[ . 1 . 2]" 1
144 1 19 LYS HA 1 115 GLU QG . . 4.390 3.879 3.098 4.125 . 0 0 "[ . 1 . 2]" 1
145 1 19 LYS HA 1 116 ILE H . . 3.920 2.624 2.497 3.000 . 0 0 "[ . 1 . 2]" 1
146 1 19 LYS HB2 1 19 LYS HE2 . . 5.240 3.839 3.433 5.188 . 0 0 "[ . 1 . 2]" 1
147 1 19 LYS HB2 1 19 LYS HE3 . . 5.240 4.431 4.226 4.640 . 0 0 "[ . 1 . 2]" 1
148 1 19 LYS HB2 1 20 TYR H . . 4.060 3.832 3.644 3.883 . 0 0 "[ . 1 . 2]" 1
149 1 19 LYS HB2 1 91 LYS HA . . 4.330 2.861 2.620 3.390 . 0 0 "[ . 1 . 2]" 1
150 1 19 LYS HB3 1 19 LYS HE2 . . 5.190 4.314 4.188 4.636 . 0 0 "[ . 1 . 2]" 1
151 1 19 LYS HB3 1 19 LYS QE . . 4.490 3.929 3.771 3.978 . 0 0 "[ . 1 . 2]" 1
152 1 19 LYS HB3 1 19 LYS HE3 . . 5.190 4.636 4.000 4.888 . 0 0 "[ . 1 . 2]" 1
153 1 19 LYS HB3 1 20 TYR H . . 3.890 2.470 2.384 2.573 . 0 0 "[ . 1 . 2]" 1
154 1 19 LYS HB3 1 21 ILE MG . . 4.330 3.782 3.706 3.961 . 0 0 "[ . 1 . 2]" 1
155 1 19 LYS HB3 1 90 ILE MG . . 3.410 1.944 1.920 2.026 . 0 0 "[ . 1 . 2]" 1
156 1 19 LYS HB3 1 91 LYS HA . . 4.230 4.228 4.144 4.254 0.024 17 0 "[ . 1 . 2]" 1
157 1 19 LYS HB3 1 113 PRO HB2 . . 3.620 1.989 1.975 2.013 . 0 0 "[ . 1 . 2]" 1
158 1 19 LYS HB3 1 113 PRO HB3 . . 4.200 3.175 3.131 3.258 . 0 0 "[ . 1 . 2]" 1
159 1 19 LYS HB3 1 116 ILE H . . 5.500 5.257 5.170 5.513 0.013 9 0 "[ . 1 . 2]" 1
160 1 19 LYS QD 1 20 TYR H . . 5.340 4.230 3.168 4.585 . 0 0 "[ . 1 . 2]" 1
161 1 19 LYS QD 1 90 ILE MG . . 4.120 3.626 2.655 3.839 . 0 0 "[ . 1 . 2]" 1
162 1 19 LYS QD 1 91 LYS HA . . 4.370 2.512 1.979 4.125 . 0 0 "[ . 1 . 2]" 1
163 1 19 LYS QD 1 113 PRO HG2 . . 4.880 4.304 1.979 4.828 . 0 0 "[ . 1 . 2]" 1
164 1 19 LYS QD 1 115 GLU H . . 5.340 3.683 2.773 4.003 . 0 0 "[ . 1 . 2]" 1
165 1 19 LYS QD 1 115 GLU HA . . 4.330 2.199 2.055 3.217 . 0 0 "[ . 1 . 2]" 1
166 1 19 LYS QD 1 115 GLU QG . . 3.690 2.102 1.958 3.230 . 0 0 "[ . 1 . 2]" 1
167 1 19 LYS HD2 1 91 LYS HA . . 5.050 3.800 3.563 4.564 . 0 0 "[ . 1 . 2]" 1
168 1 19 LYS HD2 1 115 GLU HA . . 5.040 2.606 2.117 4.811 . 0 0 "[ . 1 . 2]" 1
169 1 19 LYS HD3 1 91 LYS HA . . 5.050 2.686 1.989 5.004 . 0 0 "[ . 1 . 2]" 1
170 1 19 LYS HD3 1 115 GLU HA . . 5.040 3.274 2.066 3.619 . 0 0 "[ . 1 . 2]" 1
171 1 19 LYS QE 1 19 LYS QG . . 3.160 2.089 2.058 2.124 . 0 0 "[ . 1 . 2]" 1
172 1 19 LYS QE 1 90 ILE MG . . 4.690 3.826 3.736 4.383 . 0 0 "[ . 1 . 2]" 1
173 1 19 LYS QE 1 91 LYS HA . . 4.100 2.502 1.990 3.808 . 0 0 "[ . 1 . 2]" 1
174 1 19 LYS QE 1 94 SER HA . . 4.160 3.356 3.211 3.863 . 0 0 "[ . 1 . 2]" 1
175 1 19 LYS QE 1 113 PRO HB2 . . 3.980 3.913 3.642 4.014 0.034 12 0 "[ . 1 . 2]" 1
176 1 19 LYS QE 1 113 PRO HG2 . . 4.120 3.427 2.954 3.895 . 0 0 "[ . 1 . 2]" 1
177 1 19 LYS QE 1 115 GLU QG . . 4.160 1.952 1.884 2.113 . 0 0 "[ . 1 . 2]" 1
178 1 19 LYS HE2 1 90 ILE MG . . 5.440 4.206 3.867 5.144 . 0 0 "[ . 1 . 2]" 1
179 1 19 LYS HE2 1 94 SER HA . . 4.840 3.959 3.530 4.845 0.005 8 0 "[ . 1 . 2]" 1
180 1 19 LYS HE2 1 113 PRO HG2 . . 4.710 3.959 3.631 4.703 . 0 0 "[ . 1 . 2]" 1
181 1 19 LYS HE2 1 115 GLU HG2 . . 5.500 3.633 2.363 4.121 . 0 0 "[ . 1 . 2]" 1
182 1 19 LYS HE2 1 115 GLU HG3 . . 5.500 3.644 1.994 5.016 . 0 0 "[ . 1 . 2]" 1
183 1 19 LYS HE3 1 90 ILE MG . . 5.440 4.747 4.034 5.044 . 0 0 "[ . 1 . 2]" 1
184 1 19 LYS HE3 1 94 SER HA . . 4.840 3.713 3.504 4.097 . 0 0 "[ . 1 . 2]" 1
185 1 19 LYS HE3 1 113 PRO HG2 . . 4.710 4.039 2.988 4.367 . 0 0 "[ . 1 . 2]" 1
186 1 19 LYS HE3 1 115 GLU HG2 . . 5.500 2.781 1.986 4.987 . 0 0 "[ . 1 . 2]" 1
187 1 19 LYS HE3 1 115 GLU HG3 . . 5.500 2.747 1.998 3.722 . 0 0 "[ . 1 . 2]" 1
188 1 19 LYS QG 1 20 TYR H . . 4.330 3.434 3.153 4.213 . 0 0 "[ . 1 . 2]" 1
189 1 19 LYS QG 1 90 ILE MG . . 3.700 2.722 2.673 2.887 . 0 0 "[ . 1 . 2]" 1
190 1 19 LYS QG 1 91 LYS HA . . 3.920 2.969 1.944 3.348 . 0 0 "[ . 1 . 2]" 1
191 1 19 LYS QG 1 113 PRO HB3 . . 4.880 3.943 3.666 4.848 . 0 0 "[ . 1 . 2]" 1
192 1 19 LYS QG 1 113 PRO HG2 . . 5.160 2.911 2.629 3.852 . 0 0 "[ . 1 . 2]" 1
193 1 19 LYS QG 1 114 GLU H . . 5.340 4.191 3.786 5.349 0.009 9 0 "[ . 1 . 2]" 1
194 1 19 LYS QG 1 115 GLU HA . . 4.600 2.576 2.292 3.489 . 0 0 "[ . 1 . 2]" 1
195 1 19 LYS QG 1 115 GLU QG . . 3.620 2.452 2.035 2.599 . 0 0 "[ . 1 . 2]" 1
196 1 19 LYS HG2 1 20 TYR H . . 5.040 4.289 4.148 4.745 . 0 0 "[ . 1 . 2]" 1
197 1 19 LYS HG2 1 90 ILE MG . . 4.350 3.054 2.773 3.935 . 0 0 "[ . 1 . 2]" 1
198 1 19 LYS HG2 1 91 LYS HA . . 4.460 3.266 2.634 3.465 . 0 0 "[ . 1 . 2]" 1
199 1 19 LYS HG3 1 20 TYR H . . 5.040 3.670 3.267 4.980 . 0 0 "[ . 1 . 2]" 1
200 1 19 LYS HG3 1 90 ILE MG . . 4.350 3.544 2.728 3.811 . 0 0 "[ . 1 . 2]" 1
201 1 19 LYS HG3 1 91 LYS HA . . 4.460 3.805 1.995 4.431 . 0 0 "[ . 1 . 2]" 1
202 1 20 TYR H 1 20 TYR HB2 . . 4.000 3.967 3.953 4.013 0.013 9 0 "[ . 1 . 2]" 1
203 1 20 TYR H 1 20 TYR HB3 . . 3.650 3.009 2.984 3.092 . 0 0 "[ . 1 . 2]" 1
204 1 20 TYR H 1 20 TYR QD . . 3.640 2.804 2.615 2.945 . 0 0 "[ . 1 . 2]" 1
205 1 20 TYR H 1 21 ILE MG . . 5.040 3.631 3.531 3.665 . 0 0 "[ . 1 . 2]" 1
206 1 20 TYR H 1 90 ILE MG . . 4.490 3.520 3.397 3.567 . 0 0 "[ . 1 . 2]" 1
207 1 20 TYR H 1 113 PRO HB2 . . 4.370 3.293 3.013 3.395 . 0 0 "[ . 1 . 2]" 1
208 1 20 TYR H 1 113 PRO HB3 . . 4.370 4.029 3.717 4.146 . 0 0 "[ . 1 . 2]" 1
209 1 20 TYR H 1 114 GLU H . . 3.820 3.165 2.872 3.277 . 0 0 "[ . 1 . 2]" 1
210 1 20 TYR H 1 116 ILE H . . 4.640 4.277 4.191 4.608 . 0 0 "[ . 1 . 2]" 1
211 1 20 TYR H 1 116 ILE MD . . 5.040 4.387 4.230 4.819 . 0 0 "[ . 1 . 2]" 1
212 1 20 TYR H 1 116 ILE MG . . 5.040 3.884 3.787 4.180 . 0 0 "[ . 1 . 2]" 1
213 1 20 TYR HA 1 20 TYR QD . . 3.710 3.646 3.635 3.668 . 0 0 "[ . 1 . 2]" 1
214 1 20 TYR HA 1 21 ILE HA . . 5.080 4.465 4.451 4.471 . 0 0 "[ . 1 . 2]" 1
215 1 20 TYR HA 1 21 ILE MG . . 4.710 3.690 3.648 3.731 . 0 0 "[ . 1 . 2]" 1
216 1 20 TYR HA 1 90 ILE MG . . 4.090 3.627 3.558 3.743 . 0 0 "[ . 1 . 2]" 1
217 1 20 TYR HA 1 116 ILE MD . . 4.710 4.229 4.149 4.499 . 0 0 "[ . 1 . 2]" 1
218 1 20 TYR HA 1 116 ILE MG . . 5.300 5.232 5.171 5.313 0.013 9 0 "[ . 1 . 2]" 1
219 1 20 TYR HB2 1 21 ILE H . . 4.710 2.995 2.945 3.102 . 0 0 "[ . 1 . 2]" 1
220 1 20 TYR HB2 1 116 ILE MD . . 3.920 2.865 2.608 2.926 . 0 0 "[ . 1 . 2]" 1
221 1 20 TYR HB2 1 116 ILE HG12 . . 4.200 4.092 3.650 4.221 0.021 2 0 "[ . 1 . 2]" 1
222 1 20 TYR HB2 1 116 ILE HG13 . . 5.330 5.217 4.860 5.345 0.015 2 0 "[ . 1 . 2]" 1
223 1 20 TYR HB2 1 116 ILE MG . . 4.350 4.336 4.213 4.364 0.014 2 0 "[ . 1 . 2]" 1
224 1 20 TYR HB3 1 21 ILE H . . 4.710 4.187 4.160 4.241 . 0 0 "[ . 1 . 2]" 1
225 1 20 TYR HB3 1 114 GLU HB2 . . 5.500 5.521 5.502 5.537 0.037 12 0 "[ . 1 . 2]" 1
226 1 20 TYR HB3 1 116 ILE H . . 4.730 4.353 3.898 4.509 . 0 0 "[ . 1 . 2]" 1
227 1 20 TYR HB3 1 116 ILE MD . . 3.920 2.030 1.931 2.372 . 0 0 "[ . 1 . 2]" 1
228 1 20 TYR HB3 1 116 ILE HG12 . . 4.330 2.383 2.009 2.491 . 0 0 "[ . 1 . 2]" 1
229 1 20 TYR HB3 1 116 ILE HG13 . . 4.710 3.722 3.435 3.815 . 0 0 "[ . 1 . 2]" 1
230 1 20 TYR HB3 1 116 ILE MG . . 3.790 3.176 3.120 3.240 . 0 0 "[ . 1 . 2]" 1
231 1 20 TYR QD 1 21 ILE H . . 4.330 3.125 3.033 3.396 . 0 0 "[ . 1 . 2]" 1
232 1 20 TYR QD 1 21 ILE HA . . 4.490 3.856 3.762 4.084 . 0 0 "[ . 1 . 2]" 1
233 1 20 TYR QD 1 22 GLY H . . 4.330 2.199 2.095 2.512 . 0 0 "[ . 1 . 2]" 1
234 1 20 TYR QD 1 22 GLY HA2 . . 4.200 3.505 3.465 3.628 . 0 0 "[ . 1 . 2]" 1
235 1 20 TYR QD 1 22 GLY QA . . 3.690 3.264 3.223 3.386 . 0 0 "[ . 1 . 2]" 1
236 1 20 TYR QD 1 22 GLY HA3 . . 4.200 3.893 3.826 4.083 . 0 0 "[ . 1 . 2]" 1
237 1 20 TYR QD 1 59 THR MG . . 4.350 3.918 3.849 4.058 . 0 0 "[ . 1 . 2]" 1
238 1 20 TYR QD 1 60 PRO HD2 . . 5.500 4.923 4.842 5.106 . 0 0 "[ . 1 . 2]" 1
239 1 20 TYR QD 1 60 PRO QD . . 4.830 4.599 4.544 4.712 . 0 0 "[ . 1 . 2]" 1
240 1 20 TYR QD 1 60 PRO HD3 . . 5.500 5.521 5.505 5.536 0.036 7 0 "[ . 1 . 2]" 1
241 1 20 TYR QD 1 60 PRO HG3 . . 5.330 5.320 5.180 5.361 0.031 7 0 "[ . 1 . 2]" 1
242 1 20 TYR QD 1 114 GLU H . . 4.710 3.721 3.144 3.933 . 0 0 "[ . 1 . 2]" 1
243 1 20 TYR QD 1 114 GLU HB2 . . 4.090 3.064 2.930 3.134 . 0 0 "[ . 1 . 2]" 1
244 1 20 TYR QD 1 114 GLU HB3 . . 4.770 4.628 4.509 4.691 . 0 0 "[ . 1 . 2]" 1
245 1 20 TYR QD 1 114 GLU QG . . 4.740 4.393 4.143 4.612 . 0 0 "[ . 1 . 2]" 1
246 1 20 TYR QD 1 116 ILE H . . 4.490 4.015 3.858 4.113 . 0 0 "[ . 1 . 2]" 1
247 1 20 TYR QD 1 116 ILE HB . . 4.710 4.446 4.342 4.705 . 0 0 "[ . 1 . 2]" 1
248 1 20 TYR QD 1 116 ILE MD . . 3.790 2.871 2.744 3.146 . 0 0 "[ . 1 . 2]" 1
249 1 20 TYR QD 1 116 ILE HG12 . . 4.330 2.891 2.751 2.969 . 0 0 "[ . 1 . 2]" 1
250 1 20 TYR QD 1 116 ILE HG13 . . 5.040 4.495 4.411 4.594 . 0 0 "[ . 1 . 2]" 1
251 1 20 TYR QD 1 116 ILE MG . . 3.640 1.969 1.899 2.131 . 0 0 "[ . 1 . 2]" 1
252 1 20 TYR QE 1 21 ILE H . . 5.000 4.907 4.878 5.003 0.003 14 0 "[ . 1 . 2]" 1
253 1 20 TYR QE 1 22 GLY H . . 5.040 3.773 3.737 3.892 . 0 0 "[ . 1 . 2]" 1
254 1 20 TYR QE 1 22 GLY HA2 . . 4.490 4.504 4.478 4.509 0.019 1 0 "[ . 1 . 2]" 1
255 1 20 TYR QE 1 22 GLY QA . . 3.760 3.731 3.710 3.771 0.011 12 0 "[ . 1 . 2]" 1
256 1 20 TYR QE 1 22 GLY HA3 . . 4.490 3.983 3.949 4.058 . 0 0 "[ . 1 . 2]" 1
257 1 20 TYR QE 1 56 ILE MG . . 4.710 4.639 4.481 4.720 0.010 13 0 "[ . 1 . 2]" 1
258 1 20 TYR QE 1 59 THR HA . . 4.860 4.398 4.319 4.664 . 0 0 "[ . 1 . 2]" 1
259 1 20 TYR QE 1 59 THR HB . . 4.670 4.406 4.326 4.672 0.002 12 0 "[ . 1 . 2]" 1
260 1 20 TYR QE 1 59 THR MG . . 3.050 2.791 2.668 2.945 . 0 0 "[ . 1 . 2]" 1
261 1 20 TYR QE 1 60 PRO HD2 . . 4.600 4.308 4.214 4.553 . 0 0 "[ . 1 . 2]" 1
262 1 20 TYR QE 1 60 PRO QD . . 4.050 3.902 3.845 4.025 . 0 0 "[ . 1 . 2]" 1
263 1 20 TYR QE 1 60 PRO HD3 . . 4.600 4.465 4.435 4.502 . 0 0 "[ . 1 . 2]" 1
264 1 20 TYR QE 1 114 GLU HB2 . . 4.200 2.566 2.394 2.668 . 0 0 "[ . 1 . 2]" 1
265 1 20 TYR QE 1 114 GLU HB3 . . 4.710 4.047 3.941 4.148 . 0 0 "[ . 1 . 2]" 1
266 1 20 TYR QE 1 114 GLU HG2 . . 5.180 4.547 3.680 5.086 . 0 0 "[ . 1 . 2]" 1
267 1 20 TYR QE 1 114 GLU QG . . 4.450 3.497 3.095 3.910 . 0 0 "[ . 1 . 2]" 1
268 1 20 TYR QE 1 114 GLU HG3 . . 5.180 3.676 3.144 4.070 . 0 0 "[ . 1 . 2]" 1
269 1 20 TYR QE 1 116 ILE HB . . 5.500 5.272 5.175 5.338 . 0 0 "[ . 1 . 2]" 1
270 1 20 TYR QE 1 116 ILE MD . . 4.460 4.101 4.016 4.149 . 0 0 "[ . 1 . 2]" 1
271 1 20 TYR QE 1 116 ILE MG . . 3.790 2.639 2.542 2.697 . 0 0 "[ . 1 . 2]" 1
272 1 21 ILE H 1 21 ILE MD . . 4.680 4.093 4.063 4.110 . 0 0 "[ . 1 . 2]" 1
273 1 21 ILE H 1 21 ILE HG12 . . 4.200 2.599 2.528 2.637 . 0 0 "[ . 1 . 2]" 1
274 1 21 ILE H 1 21 ILE HG13 . . 4.330 2.900 2.855 2.936 . 0 0 "[ . 1 . 2]" 1
275 1 21 ILE H 1 21 ILE MG . . 4.190 3.208 3.176 3.238 . 0 0 "[ . 1 . 2]" 1
276 1 21 ILE H 1 22 GLY H . . 4.490 1.881 1.875 1.885 . 0 0 "[ . 1 . 2]" 1
277 1 21 ILE H 1 22 GLY QA . . 4.910 3.723 3.716 3.732 . 0 0 "[ . 1 . 2]" 1
278 1 21 ILE H 1 23 ILE MG . . 5.110 4.147 4.116 4.163 . 0 0 "[ . 1 . 2]" 1
279 1 21 ILE HA 1 21 ILE MD . . 4.350 4.172 4.168 4.174 . 0 0 "[ . 1 . 2]" 1
280 1 21 ILE HA 1 21 ILE MG . . 3.140 2.214 2.193 2.235 . 0 0 "[ . 1 . 2]" 1
281 1 21 ILE HA 1 59 THR HA . . 5.430 4.445 4.362 4.504 . 0 0 "[ . 1 . 2]" 1
282 1 21 ILE HA 1 59 THR MG . . 4.450 3.822 3.684 3.894 . 0 0 "[ . 1 . 2]" 1
283 1 21 ILE HA 1 60 PRO HD2 . . 4.200 2.203 2.153 2.244 . 0 0 "[ . 1 . 2]" 1
284 1 21 ILE HA 1 60 PRO QD . . 3.650 2.185 2.138 2.224 . 0 0 "[ . 1 . 2]" 1
285 1 21 ILE HA 1 60 PRO HD3 . . 4.200 3.624 3.606 3.641 . 0 0 "[ . 1 . 2]" 1
286 1 21 ILE HA 1 60 PRO HG2 . . 3.690 2.483 2.436 2.602 . 0 0 "[ . 1 . 2]" 1
287 1 21 ILE HA 1 60 PRO HG3 . . 3.690 3.270 3.225 3.386 . 0 0 "[ . 1 . 2]" 1
288 1 21 ILE HA 1 61 ALA H . . 4.420 3.929 3.884 3.968 . 0 0 "[ . 1 . 2]" 1
289 1 21 ILE HA 1 61 ALA MB . . 4.200 3.729 3.678 3.777 . 0 0 "[ . 1 . 2]" 1
290 1 21 ILE HB 1 21 ILE MD . . 3.160 2.407 2.395 2.422 . 0 0 "[ . 1 . 2]" 1
291 1 21 ILE HB 1 23 ILE MG . . 4.090 3.047 2.985 3.087 . 0 0 "[ . 1 . 2]" 1
292 1 21 ILE HB 1 60 PRO HB3 . . 5.500 5.525 5.515 5.537 0.037 12 0 "[ . 1 . 2]" 1
293 1 21 ILE HB 1 60 PRO HG2 . . 4.710 2.694 2.680 2.713 . 0 0 "[ . 1 . 2]" 1
294 1 21 ILE HB 1 61 ALA H . . 4.290 3.006 2.943 3.049 . 0 0 "[ . 1 . 2]" 1
295 1 21 ILE HB 1 61 ALA HA . . 4.710 3.762 3.713 3.801 . 0 0 "[ . 1 . 2]" 1
296 1 21 ILE HB 1 61 ALA MB . . 3.560 1.896 1.883 1.914 . 0 0 "[ . 1 . 2]" 1
297 1 21 ILE HB 1 113 PRO HA . . 4.710 4.700 4.637 4.727 0.017 18 0 "[ . 1 . 2]" 1
298 1 21 ILE MD 1 21 ILE MG . . 2.500 2.118 2.093 2.147 . 0 0 "[ . 1 . 2]" 1
299 1 21 ILE MD 1 23 ILE H . . 5.040 4.806 4.780 4.834 . 0 0 "[ . 1 . 2]" 1
300 1 21 ILE MD 1 23 ILE MD . . 2.920 2.923 2.921 2.925 0.005 7 0 "[ . 1 . 2]" 1
301 1 21 ILE MD 1 23 ILE HG12 . . 4.000 2.123 2.109 2.155 . 0 0 "[ . 1 . 2]" 1
302 1 21 ILE MD 1 23 ILE QG . . 3.430 2.107 2.093 2.138 . 0 0 "[ . 1 . 2]" 1
303 1 21 ILE MD 1 23 ILE HG13 . . 4.000 3.532 3.505 3.583 . 0 0 "[ . 1 . 2]" 1
304 1 21 ILE MD 1 23 ILE MG . . 2.740 1.998 1.915 2.076 . 0 0 "[ . 1 . 2]" 1
305 1 21 ILE MD 1 25 MET ME . . 4.330 4.319 4.229 4.332 0.002 10 0 "[ . 1 . 2]" 1
306 1 21 ILE MD 1 60 PRO HG2 . . 4.710 4.272 4.205 4.307 . 0 0 "[ . 1 . 2]" 1
307 1 21 ILE MD 1 61 ALA H . . 5.250 4.431 4.406 4.457 . 0 0 "[ . 1 . 2]" 1
308 1 21 ILE MD 1 61 ALA HA . . 4.490 3.752 3.702 3.782 . 0 0 "[ . 1 . 2]" 1
309 1 21 ILE MD 1 61 ALA MB . . 3.210 1.880 1.858 1.894 . 0 0 "[ . 1 . 2]" 1
310 1 21 ILE MD 1 62 GLU H . . 5.500 5.442 5.347 5.506 0.006 7 0 "[ . 1 . 2]" 1
311 1 21 ILE MD 1 66 LEU QD . . 3.240 2.514 2.357 2.704 . 0 0 "[ . 1 . 2]" 1
312 1 21 ILE MD 1 75 ILE MD . . 5.500 5.308 5.185 5.431 . 0 0 "[ . 1 . 2]" 1
313 1 21 ILE MD 1 90 ILE HG13 . . 4.710 4.390 4.219 4.485 . 0 0 "[ . 1 . 2]" 1
314 1 21 ILE MD 1 96 LEU HB2 . . 5.050 5.058 5.052 5.067 0.017 7 0 "[ . 1 . 2]" 1
315 1 21 ILE MD 1 96 LEU QD . . 3.590 2.672 2.597 2.844 . 0 0 "[ . 1 . 2]" 1
316 1 21 ILE MD 1 98 MET ME . . 2.870 2.680 2.616 2.869 . 0 0 "[ . 1 . 2]" 1
317 1 21 ILE MD 1 111 VAL HB . . 5.040 3.996 3.936 4.023 . 0 0 "[ . 1 . 2]" 1
318 1 21 ILE MD 1 111 VAL MG1 . . 3.130 2.778 2.547 2.877 . 0 0 "[ . 1 . 2]" 1
319 1 21 ILE MD 1 111 VAL MG2 . . 4.210 3.519 3.377 3.617 . 0 0 "[ . 1 . 2]" 1
320 1 21 ILE MD 1 113 PRO HA . . 5.040 4.968 4.894 5.030 . 0 0 "[ . 1 . 2]" 1
321 1 21 ILE MD 1 113 PRO HB3 . . 4.710 3.884 3.802 3.963 . 0 0 "[ . 1 . 2]" 1
322 1 21 ILE HG12 1 21 ILE MG . . 3.380 2.205 2.189 2.221 . 0 0 "[ . 1 . 2]" 1
323 1 21 ILE HG12 1 22 GLY H . . 4.710 4.059 3.973 4.102 . 0 0 "[ . 1 . 2]" 1
324 1 21 ILE HG12 1 90 ILE HG13 . . 5.500 5.491 5.362 5.516 0.016 2 0 "[ . 1 . 2]" 1
325 1 21 ILE HG12 1 96 LEU QD . . 4.470 4.176 4.100 4.424 . 0 0 "[ . 1 . 2]" 1
326 1 21 ILE HG12 1 98 MET ME . . 5.500 4.915 4.817 5.167 . 0 0 "[ . 1 . 2]" 1
327 1 21 ILE HG12 1 113 PRO HB2 . . 5.500 5.459 5.331 5.512 0.012 2 0 "[ . 1 . 2]" 1
328 1 21 ILE HG13 1 21 ILE MG . . 3.640 3.186 3.183 3.189 . 0 0 "[ . 1 . 2]" 1
329 1 21 ILE HG13 1 23 ILE H . . 5.040 3.615 3.597 3.636 . 0 0 "[ . 1 . 2]" 1
330 1 21 ILE HG13 1 23 ILE MG . . 3.430 1.951 1.946 1.958 . 0 0 "[ . 1 . 2]" 1
331 1 21 ILE HG13 1 90 ILE MD . . 3.920 3.795 3.714 3.846 . 0 0 "[ . 1 . 2]" 1
332 1 21 ILE HG13 1 90 ILE MG . . 5.000 4.808 4.753 4.896 . 0 0 "[ . 1 . 2]" 1
333 1 21 ILE MG 1 60 PRO HB2 . . 3.890 3.387 3.351 3.433 . 0 0 "[ . 1 . 2]" 1
334 1 21 ILE MG 1 60 PRO HB3 . . 4.460 4.306 4.272 4.353 . 0 0 "[ . 1 . 2]" 1
335 1 21 ILE MG 1 60 PRO HG2 . . 3.640 1.966 1.934 2.012 . 0 0 "[ . 1 . 2]" 1
336 1 21 ILE MG 1 60 PRO HG3 . . 4.780 2.805 2.762 2.855 . 0 0 "[ . 1 . 2]" 1
337 1 21 ILE MG 1 61 ALA H . . 4.560 3.986 3.912 4.053 . 0 0 "[ . 1 . 2]" 1
338 1 21 ILE MG 1 90 ILE HA . . 5.000 4.812 4.706 4.907 . 0 0 "[ . 1 . 2]" 1
339 1 21 ILE MG 1 113 PRO HA . . 3.010 2.117 2.028 2.153 . 0 0 "[ . 1 . 2]" 1
340 1 21 ILE MG 1 113 PRO HB2 . . 3.310 3.152 3.129 3.184 . 0 0 "[ . 1 . 2]" 1
341 1 21 ILE MG 1 113 PRO HB3 . . 3.250 1.955 1.907 1.987 . 0 0 "[ . 1 . 2]" 1
342 1 21 ILE MG 1 113 PRO HD2 . . 4.770 4.560 4.486 4.598 . 0 0 "[ . 1 . 2]" 1
343 1 21 ILE MG 1 113 PRO HD3 . . 4.310 3.375 3.285 3.418 . 0 0 "[ . 1 . 2]" 1
344 1 21 ILE MG 1 113 PRO HG3 . . 4.280 3.634 3.597 3.650 . 0 0 "[ . 1 . 2]" 1
345 1 21 ILE MG 1 114 GLU H . . 3.760 3.414 3.311 3.459 . 0 0 "[ . 1 . 2]" 1
346 1 22 GLY H 1 23 ILE H . . 4.310 3.322 3.306 3.334 . 0 0 "[ . 1 . 2]" 1
347 1 22 GLY QA 1 23 ILE MG . . 3.900 3.492 3.476 3.509 . 0 0 "[ . 1 . 2]" 1
348 1 22 GLY QA 1 56 ILE H . . 4.190 3.605 3.547 3.686 . 0 0 "[ . 1 . 2]" 1
349 1 22 GLY QA 1 56 ILE HB . . 3.690 2.001 1.956 2.070 . 0 0 "[ . 1 . 2]" 1
350 1 22 GLY QA 1 56 ILE HG12 . . 4.170 3.067 3.002 3.155 . 0 0 "[ . 1 . 2]" 1
351 1 22 GLY QA 1 56 ILE HG13 . . 4.390 2.977 2.931 3.020 . 0 0 "[ . 1 . 2]" 1
352 1 22 GLY QA 1 56 ILE MG . . 4.240 3.126 3.084 3.140 . 0 0 "[ . 1 . 2]" 1
353 1 22 GLY QA 1 59 THR HG1 . . 4.910 3.297 3.229 3.390 . 0 0 "[ . 1 . 2]" 1
354 1 22 GLY QA 1 59 THR MG . . 2.860 1.887 1.870 1.920 . 0 0 "[ . 1 . 2]" 1
355 1 22 GLY HA2 1 56 ILE H . . 4.930 4.323 4.243 4.426 . 0 0 "[ . 1 . 2]" 1
356 1 22 GLY HA2 1 56 ILE HB . . 4.200 3.083 3.019 3.167 . 0 0 "[ . 1 . 2]" 1
357 1 22 GLY HA2 1 59 THR MG . . 3.560 3.370 3.335 3.446 . 0 0 "[ . 1 . 2]" 1
358 1 22 GLY HA3 1 56 ILE H . . 4.930 3.859 3.797 3.946 . 0 0 "[ . 1 . 2]" 1
359 1 22 GLY HA3 1 56 ILE HB . . 4.200 2.027 1.979 2.098 . 0 0 "[ . 1 . 2]" 1
360 1 22 GLY HA3 1 59 THR MG . . 3.560 1.896 1.879 1.930 . 0 0 "[ . 1 . 2]" 1
361 1 23 ILE H 1 23 ILE MD . . 4.330 3.803 3.777 3.828 . 0 0 "[ . 1 . 2]" 1
362 1 23 ILE H 1 23 ILE HG12 . . 4.200 3.628 3.599 3.648 . 0 0 "[ . 1 . 2]" 1
363 1 23 ILE H 1 23 ILE HG13 . . 4.200 2.299 2.288 2.318 . 0 0 "[ . 1 . 2]" 1
364 1 23 ILE H 1 23 ILE MG . . 4.000 3.060 3.038 3.081 . 0 0 "[ . 1 . 2]" 1
365 1 23 ILE H 1 24 ARG H . . 4.970 4.266 4.239 4.292 . 0 0 "[ . 1 . 2]" 1
366 1 23 ILE H 1 56 ILE MD . . 5.500 5.144 5.093 5.205 . 0 0 "[ . 1 . 2]" 1
367 1 23 ILE HA 1 23 ILE MD . . 4.330 3.780 3.760 3.805 . 0 0 "[ . 1 . 2]" 1
368 1 23 ILE HA 1 23 ILE MG . . 3.110 2.355 2.334 2.372 . 0 0 "[ . 1 . 2]" 1
369 1 23 ILE HA 1 24 ARG H . . 3.060 2.193 2.178 2.210 . 0 0 "[ . 1 . 2]" 1
370 1 23 ILE HA 1 24 ARG HG2 . . 4.870 4.536 4.330 4.834 . 0 0 "[ . 1 . 2]" 1
371 1 23 ILE HA 1 24 ARG HG3 . . 5.060 3.853 3.673 4.045 . 0 0 "[ . 1 . 2]" 1
372 1 23 ILE HA 1 52 ILE MG . . 4.460 4.210 4.143 4.300 . 0 0 "[ . 1 . 2]" 1
373 1 23 ILE HA 1 54 GLU H . . 5.300 4.972 4.911 5.018 . 0 0 "[ . 1 . 2]" 1
374 1 23 ILE HA 1 55 VAL HA . . 3.530 2.198 2.117 2.314 . 0 0 "[ . 1 . 2]" 1
375 1 23 ILE HA 1 55 VAL HB . . 4.920 4.620 4.104 5.017 0.097 7 0 "[ . 1 . 2]" 1
376 1 23 ILE HA 1 55 VAL MG1 . . 5.300 4.045 3.165 5.057 . 0 0 "[ . 1 . 2]" 1
377 1 23 ILE HA 1 55 VAL QG . . 4.260 3.158 2.906 3.450 . 0 0 "[ . 1 . 2]" 1
378 1 23 ILE HA 1 55 VAL MG2 . . 5.300 3.427 3.319 3.511 . 0 0 "[ . 1 . 2]" 1
379 1 23 ILE HA 1 56 ILE H . . 4.000 2.691 2.668 2.716 . 0 0 "[ . 1 . 2]" 1
380 1 23 ILE HA 1 56 ILE HB . . 5.100 4.515 4.437 4.570 . 0 0 "[ . 1 . 2]" 1
381 1 23 ILE HA 1 56 ILE MD . . 4.600 4.520 4.478 4.578 . 0 0 "[ . 1 . 2]" 1
382 1 23 ILE HA 1 56 ILE HG12 . . 4.330 3.406 3.332 3.458 . 0 0 "[ . 1 . 2]" 1
383 1 23 ILE HA 1 56 ILE HG13 . . 5.040 4.991 4.890 5.052 0.012 1 0 "[ . 1 . 2]" 1
384 1 23 ILE HA 1 61 ALA MB . . 4.600 4.563 4.487 4.612 0.012 3 0 "[ . 1 . 2]" 1
385 1 23 ILE HB 1 23 ILE MD . . 2.980 2.010 2.005 2.018 . 0 0 "[ . 1 . 2]" 1
386 1 23 ILE HB 1 24 ARG H . . 3.340 3.011 2.937 3.084 . 0 0 "[ . 1 . 2]" 1
387 1 23 ILE HB 1 52 ILE MG . . 3.650 3.385 3.334 3.449 . 0 0 "[ . 1 . 2]" 1
388 1 23 ILE HB 1 55 VAL HA . . 4.710 3.701 3.648 3.757 . 0 0 "[ . 1 . 2]" 1
389 1 23 ILE MD 1 24 ARG H . . 4.490 3.715 3.665 3.764 . 0 0 "[ . 1 . 2]" 1
390 1 23 ILE MD 1 25 MET H . . 4.970 3.712 3.543 3.855 . 0 0 "[ . 1 . 2]" 1
391 1 23 ILE MD 1 25 MET HB2 . . 3.740 3.633 3.559 3.700 . 0 0 "[ . 1 . 2]" 1
392 1 23 ILE MD 1 25 MET ME . . 3.050 1.961 1.939 2.107 . 0 0 "[ . 1 . 2]" 1
393 1 23 ILE MD 1 25 MET HG3 . . 3.460 1.907 1.886 1.933 . 0 0 "[ . 1 . 2]" 1
394 1 23 ILE MD 1 52 ILE HA . . 4.770 4.483 4.437 4.525 . 0 0 "[ . 1 . 2]" 1
395 1 23 ILE MD 1 52 ILE HG12 . . 4.090 3.690 3.606 3.763 . 0 0 "[ . 1 . 2]" 1
396 1 23 ILE MD 1 53 ILE H . . 5.500 5.280 5.260 5.317 . 0 0 "[ . 1 . 2]" 1
397 1 23 ILE MD 1 54 GLU H . . 5.500 5.515 5.508 5.525 0.025 14 0 "[ . 1 . 2]" 1
398 1 23 ILE QG 1 24 ARG H . . 4.410 4.238 4.197 4.273 . 0 0 "[ . 1 . 2]" 1
399 1 23 ILE QG 1 25 MET ME . . 4.600 3.704 3.672 3.845 . 0 0 "[ . 1 . 2]" 1
400 1 23 ILE QG 1 25 MET HG3 . . 4.400 3.992 3.929 4.056 . 0 0 "[ . 1 . 2]" 1
401 1 23 ILE MG 1 24 ARG H . . 4.030 3.912 3.883 3.951 . 0 0 "[ . 1 . 2]" 1
402 1 23 ILE MG 1 25 MET ME . . 5.050 4.854 4.823 4.871 . 0 0 "[ . 1 . 2]" 1
403 1 23 ILE MG 1 25 MET HG3 . . 5.000 4.925 4.850 4.991 . 0 0 "[ . 1 . 2]" 1
404 1 23 ILE MG 1 55 VAL HA . . 3.430 2.772 2.733 2.818 . 0 0 "[ . 1 . 2]" 1
405 1 23 ILE MG 1 55 VAL QG . . 3.180 1.931 1.832 2.057 . 0 0 "[ . 1 . 2]" 1
406 1 23 ILE MG 1 56 ILE H . . 4.000 3.634 3.605 3.675 . 0 0 "[ . 1 . 2]" 1
407 1 23 ILE MG 1 59 THR HB . . 5.470 4.147 4.137 4.172 . 0 0 "[ . 1 . 2]" 1
408 1 23 ILE MG 1 61 ALA H . . 5.430 4.150 4.086 4.197 . 0 0 "[ . 1 . 2]" 1
409 1 23 ILE MG 1 61 ALA HA . . 4.490 4.277 4.169 4.345 . 0 0 "[ . 1 . 2]" 1
410 1 23 ILE MG 1 61 ALA MB . . 2.700 1.993 1.908 2.051 . 0 0 "[ . 1 . 2]" 1
411 1 23 ILE MG 1 62 GLU H . . 4.640 4.347 4.282 4.413 . 0 0 "[ . 1 . 2]" 1
412 1 24 ARG H 1 24 ARG HB2 . . 3.970 2.616 2.496 2.707 . 0 0 "[ . 1 . 2]" 1
413 1 24 ARG H 1 24 ARG QB . . 3.410 2.568 2.458 2.649 . 0 0 "[ . 1 . 2]" 1
414 1 24 ARG H 1 24 ARG HB3 . . 3.970 3.741 3.690 3.772 . 0 0 "[ . 1 . 2]" 1
415 1 24 ARG H 1 24 ARG HD2 . . 5.280 4.813 4.647 4.985 . 0 0 "[ . 1 . 2]" 1
416 1 24 ARG H 1 24 ARG HD3 . . 5.500 5.113 5.035 5.181 . 0 0 "[ . 1 . 2]" 1
417 1 24 ARG H 1 24 ARG HG3 . . 4.040 2.865 2.667 3.065 . 0 0 "[ . 1 . 2]" 1
418 1 24 ARG H 1 25 MET H . . 4.860 4.375 4.295 4.430 . 0 0 "[ . 1 . 2]" 1
419 1 24 ARG H 1 25 MET HG2 . . 5.360 4.333 4.164 4.403 . 0 0 "[ . 1 . 2]" 1
420 1 24 ARG H 1 25 MET HG3 . . 5.500 4.157 3.996 4.282 . 0 0 "[ . 1 . 2]" 1
421 1 24 ARG H 1 52 ILE MD . . 5.500 5.504 5.499 5.512 0.012 13 0 "[ . 1 . 2]" 1
422 1 24 ARG H 1 52 ILE MG . . 3.840 3.436 3.377 3.494 . 0 0 "[ . 1 . 2]" 1
423 1 24 ARG H 1 53 ILE HB . . 5.140 4.898 4.828 4.967 . 0 0 "[ . 1 . 2]" 1
424 1 24 ARG H 1 54 GLU H . . 3.580 3.192 3.113 3.243 . 0 0 "[ . 1 . 2]" 1
425 1 24 ARG H 1 54 GLU HB2 . . 5.500 5.518 5.504 5.533 0.033 12 0 "[ . 1 . 2]" 1
426 1 24 ARG H 1 54 GLU HB3 . . 4.490 4.113 4.077 4.153 . 0 0 "[ . 1 . 2]" 1
427 1 24 ARG H 1 55 VAL HA . . 4.490 3.152 3.070 3.254 . 0 0 "[ . 1 . 2]" 1
428 1 24 ARG H 1 55 VAL QG . . 5.440 3.994 3.453 4.606 . 0 0 "[ . 1 . 2]" 1
429 1 24 ARG H 1 56 ILE H . . 4.180 4.008 3.952 4.071 . 0 0 "[ . 1 . 2]" 1
430 1 24 ARG H 1 56 ILE MD . . 4.770 4.776 4.770 4.782 0.012 9 0 "[ . 1 . 2]" 1
431 1 24 ARG QB 1 24 ARG HD2 . . 3.720 2.655 2.574 2.852 . 0 0 "[ . 1 . 2]" 1
432 1 24 ARG QB 1 24 ARG HD3 . . 3.310 2.125 2.044 2.186 . 0 0 "[ . 1 . 2]" 1
433 1 24 ARG QB 1 25 MET H . . 3.550 3.198 3.118 3.307 . 0 0 "[ . 1 . 2]" 1
434 1 24 ARG QB 1 53 ILE H . . 4.470 3.624 3.509 3.773 . 0 0 "[ . 1 . 2]" 1
435 1 24 ARG QB 1 53 ILE HA . . 5.340 5.084 4.973 5.164 . 0 0 "[ . 1 . 2]" 1
436 1 24 ARG QB 1 53 ILE HB . . 3.430 2.741 2.637 2.834 . 0 0 "[ . 1 . 2]" 1
437 1 24 ARG QB 1 53 ILE QG . . 4.780 4.006 3.851 4.088 . 0 0 "[ . 1 . 2]" 1
438 1 24 ARG QB 1 54 GLU H . . 3.350 2.860 2.685 3.024 . 0 0 "[ . 1 . 2]" 1
439 1 24 ARG HB2 1 25 MET H . . 4.220 4.179 4.106 4.222 0.002 11 0 "[ . 1 . 2]" 1
440 1 24 ARG HB2 1 53 ILE HB . . 4.090 2.917 2.764 3.045 . 0 0 "[ . 1 . 2]" 1
441 1 24 ARG HB2 1 53 ILE MG . . 4.710 4.110 4.006 4.182 . 0 0 "[ . 1 . 2]" 1
442 1 24 ARG HB3 1 25 MET H . . 4.220 3.320 3.214 3.454 . 0 0 "[ . 1 . 2]" 1
443 1 24 ARG HB3 1 53 ILE HB . . 4.090 3.348 3.002 3.488 . 0 0 "[ . 1 . 2]" 1
444 1 24 ARG HB3 1 53 ILE MG . . 4.710 4.390 4.165 4.476 . 0 0 "[ . 1 . 2]" 1
445 1 24 ARG HD2 1 53 ILE HB . . 5.190 4.812 4.680 4.980 . 0 0 "[ . 1 . 2]" 1
446 1 24 ARG HD2 1 53 ILE MD . . 5.500 5.447 5.357 5.501 0.001 11 0 "[ . 1 . 2]" 1
447 1 24 ARG HD2 1 53 ILE MG . . 5.040 4.837 4.718 5.040 0.000 18 0 "[ . 1 . 2]" 1
448 1 24 ARG HD2 1 54 GLU H . . 5.500 5.359 5.152 5.502 0.002 18 0 "[ . 1 . 2]" 1
449 1 24 ARG HD2 1 54 GLU HB2 . . 4.870 4.589 4.247 4.854 . 0 0 "[ . 1 . 2]" 1
450 1 24 ARG HD2 1 54 GLU HB3 . . 4.770 3.096 2.757 3.329 . 0 0 "[ . 1 . 2]" 1
451 1 24 ARG HD2 1 56 ILE MD . . 4.000 3.601 3.417 3.816 . 0 0 "[ . 1 . 2]" 1
452 1 24 ARG HD3 1 24 ARG HG2 . . 2.990 2.599 2.543 2.734 . 0 0 "[ . 1 . 2]" 1
453 1 24 ARG HD3 1 25 MET H . . 5.440 5.247 5.058 5.437 . 0 0 "[ . 1 . 2]" 1
454 1 24 ARG HD3 1 53 ILE HB . . 5.500 4.682 4.061 4.859 . 0 0 "[ . 1 . 2]" 1
455 1 24 ARG HD3 1 53 ILE MD . . 4.870 4.754 4.213 4.870 0.000 11 0 "[ . 1 . 2]" 1
456 1 24 ARG HD3 1 53 ILE MG . . 5.500 4.883 4.343 5.053 . 0 0 "[ . 1 . 2]" 1
457 1 24 ARG HG2 1 25 MET H . . 4.710 4.461 4.230 4.614 . 0 0 "[ . 1 . 2]" 1
458 1 24 ARG HG3 1 54 GLU H . . 4.710 4.626 4.328 4.704 . 0 0 "[ . 1 . 2]" 1
459 1 24 ARG HG3 1 54 GLU HG3 . . 5.350 5.133 4.810 5.348 . 0 0 "[ . 1 . 2]" 1
460 1 24 ARG HG3 1 56 ILE MD . . 3.430 3.058 3.011 3.142 . 0 0 "[ . 1 . 2]" 1
461 1 25 MET H 1 25 MET HB2 . . 3.880 2.909 2.856 2.942 . 0 0 "[ . 1 . 2]" 1
462 1 25 MET H 1 25 MET ME . . 4.490 4.038 3.923 4.187 . 0 0 "[ . 1 . 2]" 1
463 1 25 MET H 1 25 MET HG3 . . 3.520 2.865 2.768 2.951 . 0 0 "[ . 1 . 2]" 1
464 1 25 MET H 1 26 MET H . . 4.970 4.425 4.401 4.450 . 0 0 "[ . 1 . 2]" 1
465 1 25 MET H 1 53 ILE H . . 5.260 4.558 4.505 4.587 . 0 0 "[ . 1 . 2]" 1
466 1 25 MET H 1 53 ILE MD . . 4.490 4.149 3.988 4.249 . 0 0 "[ . 1 . 2]" 1
467 1 25 MET HA 1 25 MET ME . . 4.710 4.589 4.519 4.633 . 0 0 "[ . 1 . 2]" 1
468 1 25 MET HA 1 25 MET HG2 . . 3.950 2.657 2.610 2.693 . 0 0 "[ . 1 . 2]" 1
469 1 25 MET HA 1 26 MET H . . 3.150 2.344 2.317 2.366 . 0 0 "[ . 1 . 2]" 1
470 1 25 MET HA 1 26 MET HA . . 4.710 4.432 4.421 4.441 . 0 0 "[ . 1 . 2]" 1
471 1 25 MET HA 1 26 MET HG2 . . 5.040 4.556 4.238 4.805 . 0 0 "[ . 1 . 2]" 1
472 1 25 MET HA 1 26 MET HG3 . . 5.040 4.316 4.105 4.670 . 0 0 "[ . 1 . 2]" 1
473 1 25 MET HA 1 52 ILE HA . . 3.600 2.828 2.777 2.873 . 0 0 "[ . 1 . 2]" 1
474 1 25 MET HA 1 52 ILE MG . . 4.490 4.310 4.245 4.395 . 0 0 "[ . 1 . 2]" 1
475 1 25 MET HA 1 53 ILE H . . 3.560 2.508 2.414 2.573 . 0 0 "[ . 1 . 2]" 1
476 1 25 MET HA 1 53 ILE HB . . 5.040 3.873 3.822 3.940 . 0 0 "[ . 1 . 2]" 1
477 1 25 MET HA 1 53 ILE MD . . 4.090 3.119 3.072 3.187 . 0 0 "[ . 1 . 2]" 1
478 1 25 MET HA 1 53 ILE HG12 . . 4.330 3.980 3.924 4.066 . 0 0 "[ . 1 . 2]" 1
479 1 25 MET HA 1 53 ILE QG . . 3.740 2.263 2.206 2.343 . 0 0 "[ . 1 . 2]" 1
480 1 25 MET HA 1 53 ILE HG13 . . 4.330 2.276 2.217 2.357 . 0 0 "[ . 1 . 2]" 1
481 1 25 MET HA 1 53 ILE MG . . 5.000 4.918 4.873 4.971 . 0 0 "[ . 1 . 2]" 1
482 1 25 MET HA 1 54 GLU H . . 4.560 4.436 4.391 4.484 . 0 0 "[ . 1 . 2]" 1
483 1 25 MET HB2 1 25 MET ME . . 3.110 2.327 2.210 2.421 . 0 0 "[ . 1 . 2]" 1
484 1 25 MET HB2 1 26 MET HA . . 5.500 4.487 4.464 4.515 . 0 0 "[ . 1 . 2]" 1
485 1 25 MET HB2 1 83 ALA HA . . 5.500 4.761 4.603 4.980 . 0 0 "[ . 1 . 2]" 1
486 1 25 MET HB2 1 83 ALA MB . . 4.040 2.657 2.554 2.796 . 0 0 "[ . 1 . 2]" 1
487 1 25 MET HB3 1 26 MET H . . 3.310 2.642 2.591 2.704 . 0 0 "[ . 1 . 2]" 1
488 1 25 MET HB3 1 26 MET HG3 . . 5.000 4.740 4.612 4.965 . 0 0 "[ . 1 . 2]" 1
489 1 25 MET HB3 1 50 ALA HA . . 5.500 4.193 4.119 4.255 . 0 0 "[ . 1 . 2]" 1
490 1 25 MET HB3 1 51 TYR H . . 4.560 3.431 3.293 3.486 . 0 0 "[ . 1 . 2]" 1
491 1 25 MET HB3 1 51 TYR QD . . 5.300 4.928 4.885 4.999 . 0 0 "[ . 1 . 2]" 1
492 1 25 MET HB3 1 52 ILE H . . 5.140 4.831 4.733 4.930 . 0 0 "[ . 1 . 2]" 1
493 1 25 MET HB3 1 52 ILE HA . . 3.920 3.409 3.338 3.490 . 0 0 "[ . 1 . 2]" 1
494 1 25 MET HB3 1 52 ILE MG . . 5.300 5.051 5.005 5.105 . 0 0 "[ . 1 . 2]" 1
495 1 25 MET HB3 1 53 ILE H . . 4.640 4.391 4.290 4.475 . 0 0 "[ . 1 . 2]" 1
496 1 25 MET HB3 1 83 ALA HA . . 5.420 4.861 4.749 5.000 . 0 0 "[ . 1 . 2]" 1
497 1 25 MET HB3 1 83 ALA MB . . 3.830 2.942 2.838 3.027 . 0 0 "[ . 1 . 2]" 1
498 1 25 MET ME 1 25 MET HG3 . . 2.750 2.324 2.276 2.380 . 0 0 "[ . 1 . 2]" 1
499 1 25 MET ME 1 26 MET H . . 5.350 5.151 5.056 5.258 . 0 0 "[ . 1 . 2]" 1
500 1 25 MET ME 1 50 ALA MB . . 3.690 2.574 2.181 2.673 . 0 0 "[ . 1 . 2]" 1
501 1 25 MET ME 1 83 ALA HA . . 3.740 2.938 2.735 3.080 . 0 0 "[ . 1 . 2]" 1
502 1 25 MET ME 1 83 ALA MB . . 3.130 2.173 1.939 2.463 . 0 0 "[ . 1 . 2]" 1
503 1 25 MET ME 1 84 ASN HA . . 5.000 4.600 4.480 4.720 . 0 0 "[ . 1 . 2]" 1
504 1 25 MET ME 1 86 VAL H . . 4.640 4.531 4.440 4.569 . 0 0 "[ . 1 . 2]" 1
505 1 25 MET ME 1 86 VAL HA . . 5.300 5.285 5.269 5.300 0.000 16 0 "[ . 1 . 2]" 1
506 1 25 MET ME 1 86 VAL HB . . 3.750 3.747 3.713 3.757 0.007 10 0 "[ . 1 . 2]" 1
507 1 25 MET ME 1 86 VAL MG1 . . 4.050 3.940 3.829 3.988 . 0 0 "[ . 1 . 2]" 1
508 1 25 MET ME 1 86 VAL QG . . 2.700 1.882 1.863 1.917 . 0 0 "[ . 1 . 2]" 1
509 1 25 MET ME 1 86 VAL MG2 . . 4.050 1.886 1.867 1.921 . 0 0 "[ . 1 . 2]" 1
510 1 25 MET ME 1 87 SER H . . 3.920 3.923 3.915 3.930 0.010 2 0 "[ . 1 . 2]" 1
511 1 25 MET ME 1 87 SER HA . . 4.100 4.028 3.967 4.100 . 17 0 "[ . 1 . 2]" 1
512 1 25 MET ME 1 87 SER QB . . 4.080 3.202 3.103 3.827 . 0 0 "[ . 1 . 2]" 1
513 1 25 MET HG2 1 26 MET H . . 4.470 4.441 4.425 4.457 . 0 0 "[ . 1 . 2]" 1
514 1 25 MET HG2 1 52 ILE HA . . 4.720 2.073 1.997 2.153 . 0 0 "[ . 1 . 2]" 1
515 1 25 MET HG2 1 52 ILE MD . . 4.450 4.127 4.053 4.217 . 0 0 "[ . 1 . 2]" 1
516 1 25 MET HG2 1 52 ILE HG13 . . 4.710 3.811 3.714 3.971 . 0 0 "[ . 1 . 2]" 1
517 1 25 MET HG2 1 52 ILE MG . . 4.800 3.150 3.052 3.289 . 0 0 "[ . 1 . 2]" 1
518 1 25 MET HG2 1 53 ILE H . . 4.960 3.337 3.257 3.412 . 0 0 "[ . 1 . 2]" 1
519 1 25 MET HG2 1 54 GLU H . . 5.000 4.539 4.431 4.606 . 0 0 "[ . 1 . 2]" 1
520 1 26 MET H 1 26 MET HB3 . . 3.670 3.123 3.085 3.149 . 0 0 "[ . 1 . 2]" 1
521 1 26 MET H 1 26 MET ME . . 5.040 4.435 4.337 4.513 . 0 0 "[ . 1 . 2]" 1
522 1 26 MET H 1 26 MET HG2 . . 4.000 3.175 2.823 3.419 . 0 0 "[ . 1 . 2]" 1
523 1 26 MET H 1 26 MET HG3 . . 3.780 2.270 2.146 2.536 . 0 0 "[ . 1 . 2]" 1
524 1 26 MET H 1 50 ALA MB . . 5.280 5.152 5.042 5.247 . 0 0 "[ . 1 . 2]" 1
525 1 26 MET H 1 51 TYR H . . 3.740 3.719 3.591 3.742 0.002 8 0 "[ . 1 . 2]" 1
526 1 26 MET H 1 51 TYR HB2 . . 5.000 4.931 4.810 5.002 0.002 15 0 "[ . 1 . 2]" 1
527 1 26 MET H 1 51 TYR HB3 . . 4.060 3.213 3.088 3.289 . 0 0 "[ . 1 . 2]" 1
528 1 26 MET H 1 51 TYR QD . . 4.200 3.143 3.062 3.271 . 0 0 "[ . 1 . 2]" 1
529 1 26 MET H 1 52 ILE HA . . 4.700 4.431 4.371 4.489 . 0 0 "[ . 1 . 2]" 1
530 1 26 MET H 1 53 ILE H . . 4.490 4.358 4.235 4.416 . 0 0 "[ . 1 . 2]" 1
531 1 26 MET H 1 53 ILE MD . . 4.180 3.080 3.028 3.117 . 0 0 "[ . 1 . 2]" 1
532 1 26 MET H 1 53 ILE HG12 . . 4.730 4.062 4.010 4.107 . 0 0 "[ . 1 . 2]" 1
533 1 26 MET H 1 53 ILE QG . . 4.130 2.949 2.931 2.971 . 0 0 "[ . 1 . 2]" 1
534 1 26 MET H 1 53 ILE HG13 . . 4.730 3.028 3.005 3.052 . 0 0 "[ . 1 . 2]" 1
535 1 26 MET H 1 53 ILE MG . . 5.500 5.502 5.496 5.510 0.010 9 0 "[ . 1 . 2]" 1
536 1 26 MET H 1 83 ALA MB . . 4.010 3.985 3.912 4.014 0.004 10 0 "[ . 1 . 2]" 1
537 1 26 MET HA 1 26 MET ME . . 5.500 5.381 5.356 5.405 . 0 0 "[ . 1 . 2]" 1
538 1 26 MET HA 1 53 ILE MD . . 4.490 3.539 3.491 3.623 . 0 0 "[ . 1 . 2]" 1
539 1 26 MET HB2 1 27 SER H . . 4.900 2.957 2.642 3.094 . 0 0 "[ . 1 . 2]" 1
540 1 26 MET HB2 1 51 TYR HB3 . . 5.500 5.408 5.296 5.467 . 0 0 "[ . 1 . 2]" 1
541 1 26 MET HB3 1 51 TYR HB3 . . 5.500 5.322 5.159 5.396 . 0 0 "[ . 1 . 2]" 1
542 1 26 MET HB3 1 51 TYR QD . . 4.250 4.158 4.033 4.252 0.002 7 0 "[ . 1 . 2]" 1
543 1 26 MET HB3 1 51 TYR QE . . 5.500 5.246 5.171 5.366 . 0 0 "[ . 1 . 2]" 1
544 1 26 MET HB3 1 53 ILE MD . . 3.320 1.888 1.875 1.947 . 0 0 "[ . 1 . 2]" 1
545 1 26 MET HB3 1 53 ILE HG12 . . 5.120 4.000 3.950 4.161 . 0 0 "[ . 1 . 2]" 1
546 1 26 MET HB3 1 53 ILE QG . . 4.350 3.427 3.383 3.548 . 0 0 "[ . 1 . 2]" 1
547 1 26 MET HB3 1 53 ILE HG13 . . 5.120 3.727 3.660 3.847 . 0 0 "[ . 1 . 2]" 1
548 1 26 MET HB3 1 53 ILE MG . . 4.860 4.707 4.671 4.827 . 0 0 "[ . 1 . 2]" 1
549 1 26 MET ME 1 26 MET HG2 . . 3.970 2.282 2.192 2.388 . 0 0 "[ . 1 . 2]" 1
550 1 26 MET ME 1 26 MET HG3 . . 3.770 2.669 2.594 2.724 . 0 0 "[ . 1 . 2]" 1
551 1 26 MET ME 1 28 LEU HA . . 4.710 3.508 3.296 3.710 . 0 0 "[ . 1 . 2]" 1
552 1 26 MET ME 1 28 LEU QD . . 4.170 2.998 2.584 3.354 . 0 0 "[ . 1 . 2]" 1
553 1 26 MET ME 1 29 THR MG . . 5.050 4.900 4.605 5.050 0.000 12 0 "[ . 1 . 2]" 1
554 1 26 MET ME 1 32 LYS HE2 . . 4.710 2.925 2.072 3.911 . 0 0 "[ . 1 . 2]" 1
555 1 26 MET ME 1 32 LYS QE . . 3.980 2.191 1.947 2.586 . 0 0 "[ . 1 . 2]" 1
556 1 26 MET ME 1 32 LYS HE3 . . 4.710 2.554 1.994 3.888 . 0 0 "[ . 1 . 2]" 1
557 1 26 MET ME 1 32 LYS HG2 . . 3.720 2.027 1.926 2.179 . 0 0 "[ . 1 . 2]" 1
558 1 26 MET ME 1 33 ALA HA . . 5.500 5.321 5.118 5.500 . 0 0 "[ . 1 . 2]" 1
559 1 26 MET ME 1 36 LEU MD1 . . 3.790 2.500 2.208 2.743 . 0 0 "[ . 1 . 2]" 1
560 1 26 MET ME 1 36 LEU MD2 . . 3.790 3.349 3.086 3.512 . 0 0 "[ . 1 . 2]" 1
561 1 26 MET ME 1 51 TYR HA . . 5.500 5.460 5.281 5.499 . 0 0 "[ . 1 . 2]" 1
562 1 26 MET ME 1 51 TYR HB3 . . 4.740 3.274 3.075 3.347 . 0 0 "[ . 1 . 2]" 1
563 1 26 MET ME 1 51 TYR QD . . 3.640 2.416 2.290 2.545 . 0 0 "[ . 1 . 2]" 1
564 1 26 MET ME 1 51 TYR QE . . 4.000 2.697 2.547 2.862 . 0 0 "[ . 1 . 2]" 1
565 1 26 MET ME 1 53 ILE MD . . 3.900 3.378 3.251 3.563 . 0 0 "[ . 1 . 2]" 1
566 1 26 MET ME 1 53 ILE QG . . 4.600 3.422 3.265 3.562 . 0 0 "[ . 1 . 2]" 1
567 1 26 MET ME 1 53 ILE MG . . 4.580 4.468 4.340 4.580 . 0 0 "[ . 1 . 2]" 1
568 1 26 MET HG2 1 32 LYS HG2 . . 5.500 5.287 5.111 5.492 . 0 0 "[ . 1 . 2]" 1
569 1 26 MET HG2 1 51 TYR QD . . 4.090 2.305 2.084 2.531 . 0 0 "[ . 1 . 2]" 1
570 1 26 MET HG2 1 51 TYR QE . . 4.610 3.330 3.233 3.487 . 0 0 "[ . 1 . 2]" 1
571 1 26 MET HG2 1 53 ILE MD . . 3.550 1.950 1.932 1.983 . 0 0 "[ . 1 . 2]" 1
572 1 26 MET HG2 1 53 ILE HG12 . . 5.070 2.734 2.636 2.859 . 0 0 "[ . 1 . 2]" 1
573 1 26 MET HG2 1 53 ILE QG . . 4.240 2.599 2.483 2.730 . 0 0 "[ . 1 . 2]" 1
574 1 26 MET HG2 1 53 ILE HG13 . . 5.070 3.250 2.971 3.465 . 0 0 "[ . 1 . 2]" 1
575 1 26 MET HG2 1 53 ILE MG . . 4.710 4.125 4.064 4.207 . 0 0 "[ . 1 . 2]" 1
576 1 26 MET HG3 1 28 LEU HB2 . . 5.500 5.241 5.018 5.387 . 0 0 "[ . 1 . 2]" 1
577 1 26 MET HG3 1 51 TYR H . . 4.710 4.268 4.198 4.332 . 0 0 "[ . 1 . 2]" 1
578 1 26 MET HG3 1 51 TYR HB2 . . 4.330 4.273 4.116 4.332 0.002 7 0 "[ . 1 . 2]" 1
579 1 26 MET HG3 1 51 TYR HB3 . . 4.030 2.647 2.506 2.709 . 0 0 "[ . 1 . 2]" 1
580 1 26 MET HG3 1 51 TYR QD . . 3.630 2.198 2.019 2.575 . 0 0 "[ . 1 . 2]" 1
581 1 26 MET HG3 1 53 ILE HG12 . . 4.880 3.829 3.543 4.205 . 0 0 "[ . 1 . 2]" 1
582 1 26 MET HG3 1 53 ILE QG . . 4.150 3.405 3.147 3.733 . 0 0 "[ . 1 . 2]" 1
583 1 26 MET HG3 1 53 ILE HG13 . . 4.880 3.815 3.522 4.175 . 0 0 "[ . 1 . 2]" 1
584 1 27 SER HA 1 28 LEU H . . 3.040 2.152 2.150 2.153 . 0 0 "[ . 1 . 2]" 1
585 1 27 SER HA 1 28 LEU HB2 . . 4.710 4.175 4.167 4.184 . 0 0 "[ . 1 . 2]" 1
586 1 27 SER HA 1 51 TYR H . . 4.960 4.924 4.730 4.964 0.004 19 0 "[ . 1 . 2]" 1
587 1 27 SER HA 1 83 ALA H . . 4.560 3.512 3.196 3.706 . 0 0 "[ . 1 . 2]" 1
588 1 27 SER HA 1 83 ALA MB . . 4.330 2.918 2.779 3.150 . 0 0 "[ . 1 . 2]" 1
589 1 27 SER QB 1 28 LEU H . . 3.760 3.552 3.491 3.714 . 0 0 "[ . 1 . 2]" 1
590 1 27 SER QB 1 29 THR MG . . 4.200 3.578 3.387 3.773 . 0 0 "[ . 1 . 2]" 1
591 1 27 SER QB 1 83 ALA MB . . 4.660 3.988 3.823 4.201 . 0 0 "[ . 1 . 2]" 1
592 1 27 SER HB2 1 29 THR MG . . 5.040 3.924 3.537 4.914 . 0 0 "[ . 1 . 2]" 1
593 1 27 SER HB2 1 83 ALA H . . 5.500 5.311 5.080 5.506 0.006 7 0 "[ . 1 . 2]" 1
594 1 27 SER HB3 1 29 THR MG . . 5.040 4.711 3.466 5.041 0.001 11 0 "[ . 1 . 2]" 1
595 1 27 SER HB3 1 83 ALA H . . 5.500 5.177 4.757 5.501 0.001 7 0 "[ . 1 . 2]" 1
596 1 28 LEU H 1 28 LEU HB2 . . 3.370 2.074 2.054 2.088 . 0 0 "[ . 1 . 2]" 1
597 1 28 LEU H 1 28 LEU HB3 . . 3.610 3.172 3.121 3.222 . 0 0 "[ . 1 . 2]" 1
598 1 28 LEU H 1 28 LEU MD1 . . 4.600 4.038 3.965 4.126 . 0 0 "[ . 1 . 2]" 1
599 1 28 LEU H 1 28 LEU QD . . 3.850 3.681 3.645 3.706 . 0 0 "[ . 1 . 2]" 1
600 1 28 LEU H 1 28 LEU MD2 . . 4.600 4.245 4.196 4.278 . 0 0 "[ . 1 . 2]" 1
601 1 28 LEU H 1 28 LEU HG . . 4.130 3.790 3.679 3.874 . 0 0 "[ . 1 . 2]" 1
602 1 28 LEU H 1 29 THR H . . 5.120 4.567 4.532 4.624 . 0 0 "[ . 1 . 2]" 1
603 1 28 LEU H 1 49 GLY H . . 4.980 4.945 4.754 4.984 0.004 8 0 "[ . 1 . 2]" 1
604 1 28 LEU H 1 50 ALA HA . . 4.080 4.046 3.967 4.084 0.004 7 0 "[ . 1 . 2]" 1
605 1 28 LEU H 1 51 TYR H . . 4.490 3.901 3.834 3.970 . 0 0 "[ . 1 . 2]" 1
606 1 28 LEU HA 1 28 LEU MD1 . . 3.970 3.773 3.768 3.779 . 0 0 "[ . 1 . 2]" 1
607 1 28 LEU HA 1 28 LEU QD . . 3.080 2.298 2.172 2.390 . 0 0 "[ . 1 . 2]" 1
608 1 28 LEU HA 1 28 LEU MD2 . . 3.970 2.319 2.185 2.417 . 0 0 "[ . 1 . 2]" 1
609 1 28 LEU HA 1 28 LEU HG . . 3.850 2.524 2.484 2.606 . 0 0 "[ . 1 . 2]" 1
610 1 28 LEU HA 1 29 THR H . . 3.460 2.175 2.149 2.259 . 0 0 "[ . 1 . 2]" 1
611 1 28 LEU HA 1 29 THR MG . . 4.330 3.527 3.360 3.726 . 0 0 "[ . 1 . 2]" 1
612 1 28 LEU HA 1 32 LYS HB3 . . 4.490 3.457 3.305 3.770 . 0 0 "[ . 1 . 2]" 1
613 1 28 LEU HA 1 51 TYR HB3 . . 4.710 4.286 4.233 4.360 . 0 0 "[ . 1 . 2]" 1
614 1 28 LEU HA 1 51 TYR QD . . 5.330 5.331 5.325 5.334 0.004 19 0 "[ . 1 . 2]" 1
615 1 28 LEU HB2 1 28 LEU QD . . 3.140 2.231 2.167 2.343 . 0 0 "[ . 1 . 2]" 1
616 1 28 LEU HB2 1 49 GLY H . . 4.370 3.575 3.455 3.650 . 0 0 "[ . 1 . 2]" 1
617 1 28 LEU HB2 1 51 TYR H . . 4.370 3.311 3.154 3.527 . 0 0 "[ . 1 . 2]" 1
618 1 28 LEU HB2 1 51 TYR HB2 . . 4.710 3.733 3.648 3.799 . 0 0 "[ . 1 . 2]" 1
619 1 28 LEU HB2 1 51 TYR HB3 . . 5.040 3.914 3.800 4.006 . 0 0 "[ . 1 . 2]" 1
620 1 28 LEU HB2 1 51 TYR QD . . 5.500 5.468 5.405 5.502 0.002 9 0 "[ . 1 . 2]" 1
621 1 28 LEU HB3 1 28 LEU QD . . 3.060 2.077 2.031 2.103 . 0 0 "[ . 1 . 2]" 1
622 1 28 LEU HB3 1 29 THR H . . 4.970 3.524 3.181 3.696 . 0 0 "[ . 1 . 2]" 1
623 1 28 LEU HB3 1 49 GLY H . . 4.310 3.237 3.040 3.453 . 0 0 "[ . 1 . 2]" 1
624 1 28 LEU QD 1 29 THR H . . 4.160 2.266 2.031 2.428 . 0 0 "[ . 1 . 2]" 1
625 1 28 LEU QD 1 32 LYS HB2 . . 4.680 3.831 3.577 4.236 . 0 0 "[ . 1 . 2]" 1
626 1 28 LEU QD 1 32 LYS HB3 . . 4.070 2.438 2.172 2.835 . 0 0 "[ . 1 . 2]" 1
627 1 28 LEU QD 1 33 ALA H . . 4.040 2.741 2.474 2.894 . 0 0 "[ . 1 . 2]" 1
628 1 28 LEU QD 1 33 ALA HA . . 3.330 2.459 2.162 2.757 . 0 0 "[ . 1 . 2]" 1
629 1 28 LEU QD 1 33 ALA MB . . 3.090 1.933 1.846 2.166 . 0 0 "[ . 1 . 2]" 1
630 1 28 LEU QD 1 36 LEU QD . . 3.530 2.084 1.740 2.389 . 0 0 "[ . 1 . 2]" 1
631 1 28 LEU QD 1 43 PHE QD . . 4.810 4.715 4.547 4.772 . 0 0 "[ . 1 . 2]" 1
632 1 28 LEU QD 1 43 PHE HZ . . 3.460 2.424 2.110 2.633 . 0 0 "[ . 1 . 2]" 1
633 1 28 LEU QD 1 49 GLY H . . 4.270 3.025 2.824 3.221 . 0 0 "[ . 1 . 2]" 1
634 1 28 LEU QD 1 51 TYR H . . 3.910 3.150 2.889 3.534 . 0 0 "[ . 1 . 2]" 1
635 1 28 LEU QD 1 51 TYR HA . . 5.280 3.316 3.097 3.511 . 0 0 "[ . 1 . 2]" 1
636 1 28 LEU QD 1 51 TYR HB3 . . 3.730 3.232 3.074 3.391 . 0 0 "[ . 1 . 2]" 1
637 1 28 LEU QD 1 51 TYR QD . . 3.330 3.250 3.124 3.324 . 0 0 "[ . 1 . 2]" 1
638 1 28 LEU QD 1 71 VAL HB . . 4.880 4.656 4.460 4.865 . 0 0 "[ . 1 . 2]" 1
639 1 28 LEU MD1 1 43 PHE QD . . 5.500 5.160 4.881 5.266 . 0 0 "[ . 1 . 2]" 1
640 1 28 LEU MD1 1 43 PHE QE . . 4.000 3.332 3.119 3.439 . 0 0 "[ . 1 . 2]" 1
641 1 28 LEU MD1 1 43 PHE HZ . . 4.000 2.478 2.148 2.708 . 0 0 "[ . 1 . 2]" 1
642 1 28 LEU MD1 1 51 TYR H . . 5.300 3.184 2.908 3.596 . 0 0 "[ . 1 . 2]" 1
643 1 28 LEU MD1 1 51 TYR HB2 . . 3.660 2.115 1.965 2.273 . 0 0 "[ . 1 . 2]" 1
644 1 28 LEU MD1 1 51 TYR HB3 . . 4.660 3.369 3.163 3.536 . 0 0 "[ . 1 . 2]" 1
645 1 28 LEU MD1 1 51 TYR QD . . 4.500 3.356 3.205 3.468 . 0 0 "[ . 1 . 2]" 1
646 1 28 LEU MD2 1 43 PHE QD . . 5.500 5.456 5.349 5.503 0.003 7 0 "[ . 1 . 2]" 1
647 1 28 LEU MD2 1 43 PHE QE . . 4.000 3.809 3.667 3.910 . 0 0 "[ . 1 . 2]" 1
648 1 28 LEU MD2 1 43 PHE HZ . . 4.000 3.447 3.085 3.610 . 0 0 "[ . 1 . 2]" 1
649 1 28 LEU MD2 1 51 TYR H . . 5.300 5.041 4.915 5.201 . 0 0 "[ . 1 . 2]" 1
650 1 28 LEU MD2 1 51 TYR HB2 . . 3.660 3.489 3.323 3.587 . 0 0 "[ . 1 . 2]" 1
651 1 28 LEU MD2 1 51 TYR HB3 . . 4.660 4.162 3.913 4.359 . 0 0 "[ . 1 . 2]" 1
652 1 28 LEU MD2 1 51 TYR QD . . 4.500 4.356 4.173 4.496 . 0 0 "[ . 1 . 2]" 1
653 1 28 LEU HG 1 29 THR H . . 4.860 4.085 4.003 4.259 . 0 0 "[ . 1 . 2]" 1
654 1 28 LEU HG 1 51 TYR H . . 4.640 3.647 3.462 3.809 . 0 0 "[ . 1 . 2]" 1
655 1 28 LEU HG 1 51 TYR HA . . 4.490 4.419 4.270 4.491 0.001 7 0 "[ . 1 . 2]" 1
656 1 28 LEU HG 1 51 TYR HB2 . . 4.220 2.131 2.005 2.206 . 0 0 "[ . 1 . 2]" 1
657 1 28 LEU HG 1 71 VAL QG . . 4.820 4.275 4.059 4.459 . 0 0 "[ . 1 . 2]" 1
658 1 29 THR H 1 29 THR MG . . 4.000 2.646 2.506 2.795 . 0 0 "[ . 1 . 2]" 1
659 1 29 THR H 1 32 LYS H . . 4.970 3.546 3.423 3.841 . 0 0 "[ . 1 . 2]" 1
660 1 29 THR H 1 32 LYS HB2 . . 4.330 3.180 3.009 3.709 . 0 0 "[ . 1 . 2]" 1
661 1 29 THR H 1 32 LYS HB3 . . 4.000 1.999 1.948 2.375 . 0 0 "[ . 1 . 2]" 1
662 1 29 THR H 1 33 ALA H . . 4.840 3.513 3.288 3.683 . 0 0 "[ . 1 . 2]" 1
663 1 29 THR H 1 33 ALA MB . . 5.260 3.984 3.652 4.141 . 0 0 "[ . 1 . 2]" 1
664 1 29 THR MG 1 31 SER QB . . 4.660 4.433 4.280 4.592 . 0 0 "[ . 1 . 2]" 1
665 1 29 THR MG 1 32 LYS H . . 4.360 3.928 3.783 4.095 . 0 0 "[ . 1 . 2]" 1
666 1 29 THR MG 1 32 LYS HB2 . . 4.920 3.359 3.160 3.709 . 0 0 "[ . 1 . 2]" 1
667 1 29 THR MG 1 32 LYS HB3 . . 5.490 3.568 3.275 3.817 . 0 0 "[ . 1 . 2]" 1
668 1 31 SER HA 1 33 ALA H . . 4.800 4.507 4.272 4.740 . 0 0 "[ . 1 . 2]" 1
669 1 31 SER HA 1 34 LYS H . . 4.060 3.740 3.420 3.905 . 0 0 "[ . 1 . 2]" 1
670 1 31 SER HA 1 34 LYS HB2 . . 3.430 2.891 2.521 3.332 . 0 0 "[ . 1 . 2]" 1
671 1 31 SER HA 1 34 LYS QE . . 4.600 3.883 2.940 4.593 . 0 0 "[ . 1 . 2]" 1
672 1 31 SER HA 1 35 GLU H . . 5.350 4.389 4.083 4.690 . 0 0 "[ . 1 . 2]" 1
673 1 31 SER QB 1 32 LYS H . . 3.980 2.700 2.234 2.973 . 0 0 "[ . 1 . 2]" 1
674 1 31 SER QB 1 34 LYS H . . 5.340 5.219 4.836 5.339 . 0 0 "[ . 1 . 2]" 1
675 1 31 SER HB2 1 32 LYS H . . 4.700 3.204 2.254 4.024 . 0 0 "[ . 1 . 2]" 1
676 1 31 SER HB3 1 32 LYS H . . 4.700 3.274 2.442 4.139 . 0 0 "[ . 1 . 2]" 1
677 1 32 LYS H 1 32 LYS HB2 . . 4.000 2.542 2.447 2.666 . 0 0 "[ . 1 . 2]" 1
678 1 32 LYS H 1 32 LYS HB3 . . 3.450 2.536 2.446 2.601 . 0 0 "[ . 1 . 2]" 1
679 1 32 LYS H 1 32 LYS QD . . 5.010 4.212 4.069 4.356 . 0 0 "[ . 1 . 2]" 1
680 1 32 LYS H 1 32 LYS HG2 . . 5.080 4.617 4.605 4.645 . 0 0 "[ . 1 . 2]" 1
681 1 32 LYS H 1 32 LYS HG3 . . 5.430 4.449 4.397 4.481 . 0 0 "[ . 1 . 2]" 1
682 1 32 LYS H 1 33 ALA H . . 3.680 2.600 2.416 2.860 . 0 0 "[ . 1 . 2]" 1
683 1 32 LYS H 1 33 ALA MB . . 5.390 4.274 4.134 4.470 . 0 0 "[ . 1 . 2]" 1
684 1 32 LYS HA 1 32 LYS HD2 . . 3.640 3.031 2.000 3.610 . 0 0 "[ . 1 . 2]" 1
685 1 32 LYS HA 1 32 LYS QD . . 2.920 1.994 1.979 2.049 . 0 0 "[ . 1 . 2]" 1
686 1 32 LYS HA 1 32 LYS HD3 . . 3.640 2.438 1.999 3.584 . 0 0 "[ . 1 . 2]" 1
687 1 32 LYS HA 1 32 LYS HE2 . . 5.040 4.035 3.363 4.817 . 0 0 "[ . 1 . 2]" 1
688 1 32 LYS HA 1 32 LYS QE . . 4.330 3.638 3.264 4.086 . 0 0 "[ . 1 . 2]" 1
689 1 32 LYS HA 1 32 LYS HE3 . . 5.040 4.360 3.433 4.831 . 0 0 "[ . 1 . 2]" 1
690 1 32 LYS HA 1 32 LYS HG3 . . 3.670 2.995 2.947 3.087 . 0 0 "[ . 1 . 2]" 1
691 1 32 LYS HA 1 33 ALA HA . . 5.040 4.775 4.737 4.827 . 0 0 "[ . 1 . 2]" 1
692 1 32 LYS HA 1 35 GLU H . . 4.060 3.662 3.579 3.720 . 0 0 "[ . 1 . 2]" 1
693 1 32 LYS HA 1 35 GLU QB . . 3.340 2.900 2.470 3.038 . 0 0 "[ . 1 . 2]" 1
694 1 32 LYS HA 1 35 GLU HG2 . . 4.490 4.375 4.117 4.490 . 0 0 "[ . 1 . 2]" 1
695 1 32 LYS HA 1 35 GLU HG3 . . 4.490 4.010 3.675 4.353 . 0 0 "[ . 1 . 2]" 1
696 1 32 LYS HA 1 36 LEU H . . 4.640 4.240 4.100 4.421 . 0 0 "[ . 1 . 2]" 1
697 1 32 LYS HA 1 36 LEU QD . . 5.190 4.252 4.092 4.448 . 0 0 "[ . 1 . 2]" 1
698 1 32 LYS HB2 1 32 LYS QE . . 4.170 2.897 2.067 4.041 . 0 0 "[ . 1 . 2]" 1
699 1 32 LYS HB2 1 33 ALA H . . 4.200 3.847 3.753 3.902 . 0 0 "[ . 1 . 2]" 1
700 1 32 LYS HB3 1 32 LYS QE . . 4.910 3.750 3.360 4.254 . 0 0 "[ . 1 . 2]" 1
701 1 32 LYS HB3 1 33 ALA H . . 3.650 2.576 2.393 2.713 . 0 0 "[ . 1 . 2]" 1
702 1 32 LYS HB3 1 33 ALA HA . . 4.840 4.232 4.161 4.305 . 0 0 "[ . 1 . 2]" 1
703 1 32 LYS HB3 1 35 GLU H . . 5.500 5.490 5.447 5.503 0.003 1 0 "[ . 1 . 2]" 1
704 1 32 LYS HB3 1 36 LEU QD . . 4.670 3.668 3.516 3.896 . 0 0 "[ . 1 . 2]" 1
705 1 32 LYS QD 1 35 GLU H . . 5.010 4.994 4.894 5.011 0.001 2 0 "[ . 1 . 2]" 1
706 1 32 LYS QD 1 36 LEU H . . 5.210 4.759 4.591 5.041 . 0 0 "[ . 1 . 2]" 1
707 1 32 LYS QE 1 32 LYS HG2 . . 3.710 2.295 1.977 2.745 . 0 0 "[ . 1 . 2]" 1
708 1 32 LYS QE 1 36 LEU QD . . 4.340 3.522 1.956 4.237 . 0 0 "[ . 1 . 2]" 1
709 1 32 LYS HE2 1 36 LEU MD1 . . 6.760 4.518 2.242 5.448 . 0 0 "[ . 1 . 2]" 1
710 1 32 LYS HE2 1 36 LEU MD2 . . 6.760 5.064 2.246 6.197 . 0 0 "[ . 1 . 2]" 1
711 1 32 LYS HE3 1 36 LEU MD1 . . 6.760 4.303 2.479 5.086 . 0 0 "[ . 1 . 2]" 1
712 1 32 LYS HE3 1 36 LEU MD2 . . 6.760 4.559 2.520 5.638 . 0 0 "[ . 1 . 2]" 1
713 1 32 LYS HG2 1 51 TYR QD . . 5.500 5.336 5.144 5.499 . 0 0 "[ . 1 . 2]" 1
714 1 32 LYS HG3 1 33 ALA H . . 4.640 3.821 3.566 4.000 . 0 0 "[ . 1 . 2]" 1
715 1 32 LYS HG3 1 36 LEU H . . 4.840 4.433 4.287 4.564 . 0 0 "[ . 1 . 2]" 1
716 1 32 LYS HG3 1 36 LEU QD . . 4.150 2.040 1.940 2.302 . 0 0 "[ . 1 . 2]" 1
717 1 33 ALA H 1 33 ALA MB . . 3.090 2.200 2.117 2.240 . 0 0 "[ . 1 . 2]" 1
718 1 33 ALA H 1 34 LYS H . . 3.500 2.717 2.568 2.869 . 0 0 "[ . 1 . 2]" 1
719 1 33 ALA H 1 34 LYS HB2 . . 4.850 4.497 4.367 4.622 . 0 0 "[ . 1 . 2]" 1
720 1 33 ALA H 1 35 GLU H . . 4.970 3.937 3.759 4.155 . 0 0 "[ . 1 . 2]" 1
721 1 33 ALA HA 1 35 GLU QB . . 5.340 5.133 5.056 5.233 . 0 0 "[ . 1 . 2]" 1
722 1 33 ALA HA 1 36 LEU H . . 3.900 3.094 3.025 3.284 . 0 0 "[ . 1 . 2]" 1
723 1 33 ALA HA 1 36 LEU QB . . 3.630 2.081 1.989 2.426 . 0 0 "[ . 1 . 2]" 1
724 1 33 ALA HA 1 36 LEU QD . . 3.770 2.173 1.985 2.411 . 0 0 "[ . 1 . 2]" 1
725 1 33 ALA HA 1 36 LEU HG . . 4.310 3.570 3.333 3.799 . 0 0 "[ . 1 . 2]" 1
726 1 33 ALA HA 1 37 LYS H . . 4.710 4.279 4.112 4.551 . 0 0 "[ . 1 . 2]" 1
727 1 33 ALA HA 1 43 PHE QD . . 5.040 5.040 5.011 5.044 0.004 6 0 "[ . 1 . 2]" 1
728 1 33 ALA HA 1 43 PHE QE . . 4.330 3.883 3.633 3.975 . 0 0 "[ . 1 . 2]" 1
729 1 33 ALA MB 1 34 LYS H . . 3.430 2.352 2.085 2.487 . 0 0 "[ . 1 . 2]" 1
730 1 33 ALA MB 1 34 LYS HB2 . . 4.930 4.038 3.730 4.178 . 0 0 "[ . 1 . 2]" 1
731 1 33 ALA MB 1 35 GLU H . . 4.560 4.247 4.071 4.337 . 0 0 "[ . 1 . 2]" 1
732 1 33 ALA MB 1 36 LEU H . . 5.040 4.270 4.226 4.346 . 0 0 "[ . 1 . 2]" 1
733 1 33 ALA MB 1 36 LEU QB . . 4.910 3.559 3.433 3.845 . 0 0 "[ . 1 . 2]" 1
734 1 33 ALA MB 1 36 LEU QD . . 4.360 3.287 3.114 3.608 . 0 0 "[ . 1 . 2]" 1
735 1 33 ALA MB 1 43 PHE QD . . 4.770 4.590 4.364 4.770 0.000 7 0 "[ . 1 . 2]" 1
736 1 33 ALA MB 1 43 PHE QE . . 3.790 3.267 3.015 3.405 . 0 0 "[ . 1 . 2]" 1
737 1 33 ALA MB 1 43 PHE HZ . . 4.710 4.324 3.796 4.550 . 0 0 "[ . 1 . 2]" 1
738 1 33 ALA MB 1 47 ILE HA . . 3.690 2.002 1.952 2.182 . 0 0 "[ . 1 . 2]" 1
739 1 33 ALA MB 1 47 ILE HB . . 5.140 1.950 1.895 2.357 . 0 0 "[ . 1 . 2]" 1
740 1 33 ALA MB 1 47 ILE MG . . 3.230 1.898 1.797 2.277 . 0 0 "[ . 1 . 2]" 1
741 1 34 LYS H 1 34 LYS HB2 . . 2.920 2.113 2.063 2.195 . 0 0 "[ . 1 . 2]" 1
742 1 34 LYS H 1 34 LYS HG2 . . 4.490 4.124 3.430 4.452 . 0 0 "[ . 1 . 2]" 1
743 1 34 LYS H 1 34 LYS HG3 . . 4.490 3.409 2.866 4.263 . 0 0 "[ . 1 . 2]" 1
744 1 34 LYS H 1 35 GLU H . . 3.550 2.721 2.620 2.778 . 0 0 "[ . 1 . 2]" 1
745 1 34 LYS H 1 35 GLU QB . . 5.170 4.761 4.659 4.870 . 0 0 "[ . 1 . 2]" 1
746 1 34 LYS H 1 35 GLU QG . . 5.340 4.496 4.294 4.727 . 0 0 "[ . 1 . 2]" 1
747 1 34 LYS H 1 36 LEU H . . 4.730 4.001 3.946 4.054 . 0 0 "[ . 1 . 2]" 1
748 1 34 LYS HA 1 34 LYS QD . . 4.400 3.674 2.410 4.085 . 0 0 "[ . 1 . 2]" 1
749 1 34 LYS HA 1 34 LYS HG2 . . 4.000 2.585 2.097 3.588 . 0 0 "[ . 1 . 2]" 1
750 1 34 LYS HA 1 34 LYS QG . . 3.380 2.193 2.064 2.397 . 0 0 "[ . 1 . 2]" 1
751 1 34 LYS HA 1 34 LYS HG3 . . 4.000 2.632 2.081 3.303 . 0 0 "[ . 1 . 2]" 1
752 1 34 LYS HA 1 36 LEU H . . 4.710 4.311 4.089 4.358 . 0 0 "[ . 1 . 2]" 1
753 1 34 LYS HA 1 37 LYS H . . 4.140 3.940 3.687 4.012 . 0 0 "[ . 1 . 2]" 1
754 1 34 LYS HA 1 37 LYS HB2 . . 4.000 3.936 3.269 4.002 0.002 3 0 "[ . 1 . 2]" 1
755 1 34 LYS HB2 1 34 LYS QE . . 3.640 2.855 2.274 3.574 . 0 0 "[ . 1 . 2]" 1
756 1 34 LYS HB2 1 35 GLU H . . 3.780 3.249 3.095 3.608 . 0 0 "[ . 1 . 2]" 1
757 1 34 LYS HB2 1 36 LEU H . . 5.500 5.190 5.092 5.428 . 0 0 "[ . 1 . 2]" 1
758 1 34 LYS HB3 1 35 GLU H . . 4.060 3.320 2.972 3.564 . 0 0 "[ . 1 . 2]" 1
759 1 34 LYS HB3 1 35 GLU HA . . 4.250 4.090 3.985 4.204 . 0 0 "[ . 1 . 2]" 1
760 1 34 LYS HB3 1 36 LEU H . . 5.500 5.227 5.004 5.400 . 0 0 "[ . 1 . 2]" 1
761 1 34 LYS QE 1 34 LYS QG . . 3.090 2.192 1.995 2.492 . 0 0 "[ . 1 . 2]" 1
762 1 35 GLU H 1 35 GLU QB . . 3.230 2.373 2.301 2.440 . 0 0 "[ . 1 . 2]" 1
763 1 35 GLU H 1 35 GLU HG2 . . 4.000 2.666 2.469 2.793 . 0 0 "[ . 1 . 2]" 1
764 1 35 GLU H 1 35 GLU QG . . 3.410 2.613 2.434 2.723 . 0 0 "[ . 1 . 2]" 1
765 1 35 GLU H 1 35 GLU HG3 . . 4.000 3.766 3.522 3.976 . 0 0 "[ . 1 . 2]" 1
766 1 35 GLU H 1 36 LEU H . . 3.560 2.242 2.181 2.310 . 0 0 "[ . 1 . 2]" 1
767 1 35 GLU H 1 36 LEU HG . . 4.770 4.708 4.613 4.770 0.000 7 0 "[ . 1 . 2]" 1
768 1 35 GLU HA 1 35 GLU HG2 . . 3.790 2.837 2.714 2.972 . 0 0 "[ . 1 . 2]" 1
769 1 35 GLU HA 1 35 GLU QG . . 3.180 2.755 2.652 2.856 . 0 0 "[ . 1 . 2]" 1
770 1 35 GLU HA 1 35 GLU HG3 . . 3.790 3.746 3.688 3.786 . 0 0 "[ . 1 . 2]" 1
771 1 35 GLU HA 1 38 ASP H . . 4.710 3.368 3.164 3.640 . 0 0 "[ . 1 . 2]" 1
772 1 35 GLU HA 1 38 ASP HB2 . . 4.000 3.149 2.433 3.982 . 0 0 "[ . 1 . 2]" 1
773 1 35 GLU HA 1 38 ASP QB . . 3.460 2.788 2.405 3.077 . 0 0 "[ . 1 . 2]" 1
774 1 35 GLU HA 1 38 ASP HB3 . . 4.000 3.285 2.838 3.777 . 0 0 "[ . 1 . 2]" 1
775 1 35 GLU QB 1 36 LEU H . . 3.370 2.898 2.876 2.977 . 0 0 "[ . 1 . 2]" 1
776 1 35 GLU QB 1 36 LEU HA . . 4.420 3.947 3.941 3.976 . 0 0 "[ . 1 . 2]" 1
777 1 35 GLU QB 1 36 LEU QD . . 4.830 4.300 4.198 4.360 . 0 0 "[ . 1 . 2]" 1
778 1 35 GLU QB 1 36 LEU HG . . 4.240 4.062 3.926 4.146 . 0 0 "[ . 1 . 2]" 1
779 1 35 GLU QB 1 38 ASP QB . . 4.780 4.240 3.984 4.505 . 0 0 "[ . 1 . 2]" 1
780 1 35 GLU HB2 1 36 LEU HA . . 5.190 4.403 4.319 4.543 . 0 0 "[ . 1 . 2]" 1
781 1 35 GLU HB3 1 36 LEU HA . . 5.190 4.466 4.364 4.549 . 0 0 "[ . 1 . 2]" 1
782 1 35 GLU QG 1 36 LEU H . . 4.600 4.234 4.129 4.379 . 0 0 "[ . 1 . 2]" 1
783 1 36 LEU H 1 36 LEU HB2 . . 3.940 2.155 2.135 2.192 . 0 0 "[ . 1 . 2]" 1
784 1 36 LEU H 1 36 LEU QB . . 3.230 2.135 2.116 2.171 . 0 0 "[ . 1 . 2]" 1
785 1 36 LEU H 1 36 LEU HB3 . . 3.940 3.473 3.457 3.501 . 0 0 "[ . 1 . 2]" 1
786 1 36 LEU H 1 36 LEU MD1 . . 4.030 3.692 3.607 3.780 . 0 0 "[ . 1 . 2]" 1
787 1 36 LEU H 1 36 LEU MD2 . . 4.030 3.990 3.920 4.030 . 0 0 "[ . 1 . 2]" 1
788 1 36 LEU H 1 36 LEU HG . . 3.210 3.013 2.908 3.101 . 0 0 "[ . 1 . 2]" 1
789 1 36 LEU H 1 37 LYS HB2 . . 4.640 4.614 4.300 4.641 0.001 6 0 "[ . 1 . 2]" 1
790 1 36 LEU H 1 37 LYS HB3 . . 5.500 5.289 5.059 5.508 0.008 7 0 "[ . 1 . 2]" 1
791 1 36 LEU HA 1 36 LEU QD . . 2.830 2.084 1.969 2.271 . 0 0 "[ . 1 . 2]" 1
792 1 36 LEU HA 1 36 LEU HG . . 3.740 2.684 2.644 2.743 . 0 0 "[ . 1 . 2]" 1
793 1 36 LEU HA 1 37 LYS HA . . 5.000 4.711 4.689 4.750 . 0 0 "[ . 1 . 2]" 1
794 1 36 LEU HA 1 38 ASP H . . 5.120 4.749 4.197 5.069 . 0 0 "[ . 1 . 2]" 1
795 1 36 LEU HA 1 39 ARG H . . 4.180 3.712 3.505 3.847 . 0 0 "[ . 1 . 2]" 1
796 1 36 LEU HA 1 39 ARG HB2 . . 4.490 2.981 2.717 3.264 . 0 0 "[ . 1 . 2]" 1
797 1 36 LEU HA 1 39 ARG QB . . 3.790 2.931 2.687 3.189 . 0 0 "[ . 1 . 2]" 1
798 1 36 LEU HA 1 39 ARG HB3 . . 4.490 4.381 4.022 4.489 . 0 0 "[ . 1 . 2]" 1
799 1 36 LEU HA 1 39 ARG HD2 . . 5.330 4.726 4.057 5.322 . 0 0 "[ . 1 . 2]" 1
800 1 36 LEU HA 1 39 ARG QD . . 4.670 3.929 3.200 4.579 . 0 0 "[ . 1 . 2]" 1
801 1 36 LEU HA 1 39 ARG HD3 . . 5.330 4.258 3.265 5.184 . 0 0 "[ . 1 . 2]" 1
802 1 36 LEU HA 1 40 HIS H . . 4.730 3.763 3.446 4.051 . 0 0 "[ . 1 . 2]" 1
803 1 36 LEU HA 1 40 HIS HB2 . . 5.040 4.298 4.177 4.455 . 0 0 "[ . 1 . 2]" 1
804 1 36 LEU HA 1 40 HIS HD2 . . 4.330 2.440 2.021 3.208 . 0 0 "[ . 1 . 2]" 1
805 1 36 LEU HA 1 43 PHE QD . . 5.500 5.181 4.832 5.503 0.003 7 0 "[ . 1 . 2]" 1
806 1 36 LEU QB 1 37 LYS H . . 3.410 2.817 2.760 2.914 . 0 0 "[ . 1 . 2]" 1
807 1 36 LEU QB 1 40 HIS HD2 . . 4.600 3.207 2.807 3.658 . 0 0 "[ . 1 . 2]" 1
808 1 36 LEU QB 1 43 PHE QE . . 4.600 3.190 2.847 3.341 . 0 0 "[ . 1 . 2]" 1
809 1 36 LEU HB2 1 37 LYS H . . 4.180 2.989 2.899 3.093 . 0 0 "[ . 1 . 2]" 1
810 1 36 LEU HB2 1 43 PHE QD . . 4.710 4.327 4.082 4.486 . 0 0 "[ . 1 . 2]" 1
811 1 36 LEU HB3 1 37 LYS H . . 4.180 3.446 3.391 3.559 . 0 0 "[ . 1 . 2]" 1
812 1 36 LEU HB3 1 43 PHE QD . . 4.710 3.369 3.014 3.596 . 0 0 "[ . 1 . 2]" 1
813 1 36 LEU QD 1 37 LYS H . . 4.400 4.211 4.184 4.277 . 0 0 "[ . 1 . 2]" 1
814 1 36 LEU QD 1 39 ARG H . . 5.230 4.955 4.681 5.117 . 0 0 "[ . 1 . 2]" 1
815 1 36 LEU QD 1 39 ARG QD . . 4.460 4.201 3.678 4.454 . 0 0 "[ . 1 . 2]" 1
816 1 36 LEU QD 1 40 HIS HB2 . . 4.300 3.704 3.364 3.995 . 0 0 "[ . 1 . 2]" 1
817 1 36 LEU QD 1 40 HIS HD2 . . 3.630 2.081 1.896 2.426 . 0 0 "[ . 1 . 2]" 1
818 1 36 LEU QD 1 43 PHE QD . . 4.090 3.310 3.019 3.661 . 0 0 "[ . 1 . 2]" 1
819 1 36 LEU QD 1 43 PHE QE . . 3.920 2.517 2.064 2.847 . 0 0 "[ . 1 . 2]" 1
820 1 36 LEU QD 1 43 PHE HZ . . 4.170 2.548 2.130 2.725 . 0 0 "[ . 1 . 2]" 1
821 1 36 LEU QD 1 51 TYR QD . . 4.070 2.978 2.763 3.118 . 0 0 "[ . 1 . 2]" 1
822 1 36 LEU QD 1 51 TYR QE . . 3.410 2.820 2.696 2.961 . 0 0 "[ . 1 . 2]" 1
823 1 36 LEU QD 1 69 ASN HA . . 4.660 4.649 4.589 4.665 0.005 4 0 "[ . 1 . 2]" 1
824 1 36 LEU QD 1 69 ASN QB . . 5.280 4.668 4.537 4.759 . 0 0 "[ . 1 . 2]" 1
825 1 36 LEU QD 1 71 VAL QG . . 4.040 3.685 3.383 3.831 . 0 0 "[ . 1 . 2]" 1
826 1 36 LEU MD1 1 37 LYS H . . 5.050 4.738 4.673 4.826 . 0 0 "[ . 1 . 2]" 1
827 1 36 LEU MD1 1 43 PHE QD . . 4.710 4.022 3.725 4.222 . 0 0 "[ . 1 . 2]" 1
828 1 36 LEU MD1 1 43 PHE QE . . 5.040 2.692 2.118 2.962 . 0 0 "[ . 1 . 2]" 1
829 1 36 LEU MD1 1 51 TYR QE . . 4.000 3.291 3.102 3.507 . 0 0 "[ . 1 . 2]" 1
830 1 36 LEU MD1 1 69 ASN HA . . 5.500 5.442 5.228 5.502 0.002 17 0 "[ . 1 . 2]" 1
831 1 36 LEU MD2 1 37 LYS H . . 5.050 4.717 4.649 4.777 . 0 0 "[ . 1 . 2]" 1
832 1 36 LEU MD2 1 43 PHE QD . . 4.710 3.528 3.191 4.078 . 0 0 "[ . 1 . 2]" 1
833 1 36 LEU MD2 1 43 PHE QE . . 5.040 3.057 2.764 3.686 . 0 0 "[ . 1 . 2]" 1
834 1 36 LEU MD2 1 51 TYR QE . . 4.000 3.075 2.859 3.403 . 0 0 "[ . 1 . 2]" 1
835 1 36 LEU MD2 1 69 ASN HA . . 5.500 5.050 4.960 5.226 . 0 0 "[ . 1 . 2]" 1
836 1 36 LEU HG 1 37 LYS H . . 4.910 4.882 4.801 4.912 0.002 11 0 "[ . 1 . 2]" 1
837 1 37 LYS H 1 37 LYS HB2 . . 3.200 2.290 2.096 2.382 . 0 0 "[ . 1 . 2]" 1
838 1 37 LYS H 1 37 LYS HB3 . . 3.260 2.871 2.740 3.165 . 0 0 "[ . 1 . 2]" 1
839 1 37 LYS H 1 37 LYS QD . . 4.620 4.290 4.252 4.331 . 0 0 "[ . 1 . 2]" 1
840 1 37 LYS H 1 37 LYS QG . . 4.100 3.905 3.583 3.977 . 0 0 "[ . 1 . 2]" 1
841 1 37 LYS H 1 38 ASP H . . 3.540 2.535 2.365 2.693 . 0 0 "[ . 1 . 2]" 1
842 1 37 LYS H 1 39 ARG H . . 4.420 3.764 3.667 3.996 . 0 0 "[ . 1 . 2]" 1
843 1 37 LYS H 1 43 PHE QB . . 4.830 4.158 3.993 4.370 . 0 0 "[ . 1 . 2]" 1
844 1 37 LYS H 1 43 PHE QD . . 4.700 4.448 4.122 4.693 . 0 0 "[ . 1 . 2]" 1
845 1 37 LYS HA 1 37 LYS HD2 . . 4.600 4.053 2.401 4.237 . 0 0 "[ . 1 . 2]" 1
846 1 37 LYS HA 1 37 LYS QD . . 3.860 3.732 2.228 3.862 0.002 3 0 "[ . 1 . 2]" 1
847 1 37 LYS HA 1 37 LYS HD3 . . 4.600 4.373 2.641 4.510 . 0 0 "[ . 1 . 2]" 1
848 1 37 LYS HA 1 37 LYS HE2 . . 5.500 4.841 4.699 4.979 . 0 0 "[ . 1 . 2]" 1
849 1 37 LYS HA 1 37 LYS QE . . 4.790 4.491 4.136 4.558 . 0 0 "[ . 1 . 2]" 1
850 1 37 LYS HA 1 37 LYS HE3 . . 5.500 5.331 4.591 5.500 . 0 0 "[ . 1 . 2]" 1
851 1 37 LYS HA 1 37 LYS QG . . 3.340 2.213 2.173 2.481 . 0 0 "[ . 1 . 2]" 1
852 1 37 LYS HA 1 40 HIS H . . 4.060 3.315 3.114 3.555 . 0 0 "[ . 1 . 2]" 1
853 1 37 LYS HA 1 40 HIS HB2 . . 4.490 3.572 3.332 3.753 . 0 0 "[ . 1 . 2]" 1
854 1 37 LYS HA 1 43 PHE H . . 4.260 4.049 3.929 4.262 0.002 2 0 "[ . 1 . 2]" 1
855 1 37 LYS HA 1 43 PHE HB2 . . 3.790 2.616 2.400 2.869 . 0 0 "[ . 1 . 2]" 1
856 1 37 LYS HA 1 43 PHE QB . . 3.250 2.217 2.042 2.447 . 0 0 "[ . 1 . 2]" 1
857 1 37 LYS HA 1 43 PHE HB3 . . 3.790 2.398 2.128 2.655 . 0 0 "[ . 1 . 2]" 1
858 1 37 LYS HA 1 43 PHE QD . . 4.090 3.697 3.507 3.877 . 0 0 "[ . 1 . 2]" 1
859 1 37 LYS HB2 1 38 ASP H . . 4.490 3.481 3.077 3.818 . 0 0 "[ . 1 . 2]" 1
860 1 37 LYS HB2 1 43 PHE QB . . 4.600 3.488 3.265 3.813 . 0 0 "[ . 1 . 2]" 1
861 1 37 LYS HB2 1 43 PHE QD . . 4.000 3.450 3.139 3.588 . 0 0 "[ . 1 . 2]" 1
862 1 37 LYS HB2 1 43 PHE QE . . 5.040 4.906 4.560 5.040 0.000 7 0 "[ . 1 . 2]" 1
863 1 37 LYS HB3 1 38 ASP H . . 4.000 2.514 2.195 2.938 . 0 0 "[ . 1 . 2]" 1
864 1 37 LYS QD 1 43 PHE QB . . 4.300 3.381 1.958 3.654 . 0 0 "[ . 1 . 2]" 1
865 1 37 LYS HD2 1 43 PHE QD . . 4.710 3.275 3.036 4.717 0.007 7 0 "[ . 1 . 2]" 1
866 1 37 LYS HD3 1 43 PHE QD . . 4.710 4.615 3.756 4.711 0.001 11 0 "[ . 1 . 2]" 1
867 1 37 LYS QE 1 37 LYS QG . . 3.290 2.020 1.950 2.088 . 0 0 "[ . 1 . 2]" 1
868 1 37 LYS QE 1 41 ARG HA . . 5.340 5.087 3.954 5.341 0.001 14 0 "[ . 1 . 2]" 1
869 1 37 LYS HE2 1 43 PHE QD . . 5.500 5.468 5.059 5.501 0.001 16 0 "[ . 1 . 2]" 1
870 1 37 LYS HE3 1 43 PHE QD . . 5.500 4.770 4.593 5.276 . 0 0 "[ . 1 . 2]" 1
871 1 37 LYS QG 1 43 PHE H . . 5.010 4.360 4.213 4.686 . 0 0 "[ . 1 . 2]" 1
872 1 37 LYS QG 1 43 PHE QB . . 3.720 2.098 1.977 2.506 . 0 0 "[ . 1 . 2]" 1
873 1 37 LYS QG 1 43 PHE QD . . 3.660 3.189 2.145 3.659 . 0 0 "[ . 1 . 2]" 1
874 1 37 LYS HG2 1 38 ASP H . . 5.500 4.342 3.895 4.934 . 0 0 "[ . 1 . 2]" 1
875 1 37 LYS HG2 1 41 ARG HA . . 5.500 4.437 4.147 5.292 . 0 0 "[ . 1 . 2]" 1
876 1 37 LYS HG3 1 38 ASP H . . 5.500 4.841 4.638 5.072 . 0 0 "[ . 1 . 2]" 1
877 1 37 LYS HG3 1 41 ARG HA . . 5.500 4.660 4.411 5.510 0.010 7 0 "[ . 1 . 2]" 1
878 1 38 ASP H 1 38 ASP HB2 . . 3.690 2.205 2.068 2.455 . 0 0 "[ . 1 . 2]" 1
879 1 38 ASP H 1 38 ASP QB . . 3.240 2.135 2.048 2.252 . 0 0 "[ . 1 . 2]" 1
880 1 38 ASP H 1 38 ASP HB3 . . 3.690 2.984 2.609 3.333 . 0 0 "[ . 1 . 2]" 1
881 1 38 ASP H 1 39 ARG H . . 3.590 2.619 2.409 2.812 . 0 0 "[ . 1 . 2]" 1
882 1 38 ASP QB 1 39 ARG H . . 3.650 2.914 2.604 2.989 . 0 0 "[ . 1 . 2]" 1
883 1 38 ASP HB2 1 39 ARG H . . 4.180 3.696 3.313 4.047 . 0 0 "[ . 1 . 2]" 1
884 1 38 ASP HB3 1 39 ARG H . . 4.180 3.075 2.679 3.387 . 0 0 "[ . 1 . 2]" 1
885 1 39 ARG H 1 39 ARG HB2 . . 3.760 2.305 2.142 2.383 . 0 0 "[ . 1 . 2]" 1
886 1 39 ARG H 1 39 ARG QB . . 3.170 2.277 2.121 2.352 . 0 0 "[ . 1 . 2]" 1
887 1 39 ARG H 1 39 ARG HB3 . . 3.760 3.547 3.334 3.614 . 0 0 "[ . 1 . 2]" 1
888 1 39 ARG H 1 39 ARG HG2 . . 4.370 4.077 3.719 4.370 . 0 0 "[ . 1 . 2]" 1
889 1 39 ARG H 1 39 ARG QG . . 3.690 3.018 2.691 3.648 . 0 0 "[ . 1 . 2]" 1
890 1 39 ARG H 1 39 ARG HG3 . . 4.370 3.120 2.746 3.908 . 0 0 "[ . 1 . 2]" 1
891 1 39 ARG H 1 40 HIS H . . 3.300 2.241 2.135 2.379 . 0 0 "[ . 1 . 2]" 1
892 1 39 ARG H 1 40 HIS HD2 . . 5.440 4.416 3.361 5.440 . 0 0 "[ . 1 . 2]" 1
893 1 39 ARG HA 1 39 ARG HD2 . . 5.300 4.627 3.100 4.821 . 0 0 "[ . 1 . 2]" 1
894 1 39 ARG HA 1 39 ARG QD . . 4.570 3.966 3.018 4.105 . 0 0 "[ . 1 . 2]" 1
895 1 39 ARG HA 1 39 ARG HD3 . . 5.300 4.350 4.153 4.459 . 0 0 "[ . 1 . 2]" 1
896 1 39 ARG HA 1 39 ARG HG2 . . 3.850 2.504 2.215 3.523 . 0 0 "[ . 1 . 2]" 1
897 1 39 ARG HA 1 39 ARG HG3 . . 3.850 2.840 2.226 3.220 . 0 0 "[ . 1 . 2]" 1
898 1 39 ARG QB 1 39 ARG QD . . 3.200 2.088 2.011 2.206 . 0 0 "[ . 1 . 2]" 1
899 1 39 ARG QB 1 40 HIS H . . 3.500 2.742 2.420 2.983 . 0 0 "[ . 1 . 2]" 1
900 1 39 ARG QB 1 40 HIS HD2 . . 4.330 3.168 2.174 4.248 . 0 0 "[ . 1 . 2]" 1
901 1 39 ARG HB2 1 40 HIS H . . 4.000 2.874 2.504 3.311 . 0 0 "[ . 1 . 2]" 1
902 1 39 ARG HB2 1 40 HIS HD2 . . 5.040 3.358 2.221 5.011 . 0 0 "[ . 1 . 2]" 1
903 1 39 ARG HB3 1 40 HIS H . . 4.000 3.505 2.993 3.836 . 0 0 "[ . 1 . 2]" 1
904 1 39 ARG HB3 1 40 HIS HD2 . . 5.040 3.978 2.999 5.039 . 0 0 "[ . 1 . 2]" 1
905 1 39 ARG QG 1 40 HIS H . . 4.730 4.328 4.180 4.556 . 0 0 "[ . 1 . 2]" 1
906 1 40 HIS H 1 40 HIS HB2 . . 3.320 2.746 2.645 2.835 . 0 0 "[ . 1 . 2]" 1
907 1 40 HIS H 1 40 HIS HD2 . . 4.560 3.261 2.245 4.306 . 0 0 "[ . 1 . 2]" 1
908 1 40 HIS H 1 43 PHE QB . . 4.720 3.957 3.857 4.095 . 0 0 "[ . 1 . 2]" 1
909 1 40 HIS HB2 1 43 PHE H . . 4.140 3.036 2.958 3.253 . 0 0 "[ . 1 . 2]" 1
910 1 40 HIS HB2 1 43 PHE HB2 . . 4.000 2.340 2.311 2.405 . 0 0 "[ . 1 . 2]" 1
911 1 40 HIS HB2 1 43 PHE QB . . 3.350 2.325 2.297 2.386 . 0 0 "[ . 1 . 2]" 1
912 1 40 HIS HB2 1 43 PHE HB3 . . 4.000 4.002 4.000 4.006 0.006 7 0 "[ . 1 . 2]" 1
913 1 40 HIS HB2 1 43 PHE QD . . 3.790 3.096 2.943 3.513 . 0 0 "[ . 1 . 2]" 1
914 1 40 HIS HB2 1 43 PHE QE . . 5.500 4.998 4.866 5.284 . 0 0 "[ . 1 . 2]" 1
915 1 40 HIS HB3 1 42 ASP H . . 4.470 3.310 3.198 3.656 . 0 0 "[ . 1 . 2]" 1
916 1 40 HIS HB3 1 43 PHE H . . 4.460 3.178 3.120 3.269 . 0 0 "[ . 1 . 2]" 1
917 1 40 HIS HD2 1 43 PHE QD . . 5.500 4.212 3.381 5.009 . 0 0 "[ . 1 . 2]" 1
918 1 41 ARG H 1 41 ARG HG2 . . 5.360 4.000 2.091 4.654 . 0 0 "[ . 1 . 2]" 1
919 1 41 ARG H 1 41 ARG QG . . 4.550 3.528 2.075 4.044 . 0 0 "[ . 1 . 2]" 1
920 1 41 ARG H 1 41 ARG HG3 . . 5.360 4.041 2.274 4.606 . 0 0 "[ . 1 . 2]" 1
921 1 41 ARG HA 1 41 ARG HD2 . . 5.300 4.162 2.273 5.054 . 0 0 "[ . 1 . 2]" 1
922 1 41 ARG HA 1 41 ARG QD . . 4.560 3.664 2.193 4.236 . 0 0 "[ . 1 . 2]" 1
923 1 41 ARG HA 1 41 ARG HD3 . . 5.300 4.198 2.684 5.031 . 0 0 "[ . 1 . 2]" 1
924 1 41 ARG HA 1 41 ARG HG2 . . 4.160 3.195 2.416 4.140 . 0 0 "[ . 1 . 2]" 1
925 1 41 ARG HA 1 41 ARG QG . . 3.430 2.624 2.211 3.375 . 0 0 "[ . 1 . 2]" 1
926 1 41 ARG HA 1 41 ARG HG3 . . 4.160 3.009 2.254 3.853 . 0 0 "[ . 1 . 2]" 1
927 1 41 ARG HA 1 43 PHE H . . 4.370 3.923 3.772 3.988 . 0 0 "[ . 1 . 2]" 1
928 1 41 ARG QB 1 41 ARG QD . . 3.250 2.081 1.960 2.326 . 0 0 "[ . 1 . 2]" 1
929 1 41 ARG QB 1 41 ARG QG . . 2.280 2.046 2.006 2.087 . 0 0 "[ . 1 . 2]" 1
930 1 41 ARG QB 1 42 ASP H . . 3.920 3.031 2.886 3.599 . 0 0 "[ . 1 . 2]" 1
931 1 41 ARG QB 1 43 PHE H . . 5.010 4.788 4.587 5.001 . 0 0 "[ . 1 . 2]" 1
932 1 41 ARG QG 1 42 ASP H . . 4.560 3.738 2.116 4.288 . 0 0 "[ . 1 . 2]" 1
933 1 41 ARG QG 1 43 PHE H . . 5.300 5.040 4.354 5.306 0.006 13 0 "[ . 1 . 2]" 1
934 1 42 ASP H 1 42 ASP HB2 . . 4.060 2.362 2.070 3.570 . 0 0 "[ . 1 . 2]" 1
935 1 42 ASP H 1 42 ASP QB . . 3.530 2.238 2.049 2.681 . 0 0 "[ . 1 . 2]" 1
936 1 42 ASP H 1 42 ASP HB3 . . 4.060 3.156 2.357 3.593 . 0 0 "[ . 1 . 2]" 1
937 1 42 ASP H 1 43 PHE H . . 3.510 2.605 2.572 2.759 . 0 0 "[ . 1 . 2]" 1
938 1 42 ASP HB2 1 43 PHE H . . 4.730 3.408 2.859 4.106 . 0 0 "[ . 1 . 2]" 1
939 1 42 ASP HB3 1 43 PHE H . . 4.730 3.337 2.822 4.182 . 0 0 "[ . 1 . 2]" 1
940 1 43 PHE H 1 43 PHE HB2 . . 3.280 2.104 2.098 2.139 . 0 0 "[ . 1 . 2]" 1
941 1 43 PHE H 1 43 PHE QB . . 2.870 2.072 2.067 2.098 . 0 0 "[ . 1 . 2]" 1
942 1 43 PHE H 1 43 PHE HB3 . . 3.280 3.110 3.032 3.124 . 0 0 "[ . 1 . 2]" 1
943 1 43 PHE H 1 43 PHE QD . . 4.220 3.581 3.550 3.749 . 0 0 "[ . 1 . 2]" 1
944 1 43 PHE H 1 44 PRO QD . . 4.720 4.293 4.283 4.304 . 0 0 "[ . 1 . 2]" 1
945 1 43 PHE HA 1 43 PHE QD . . 3.640 2.736 2.517 2.845 . 0 0 "[ . 1 . 2]" 1
946 1 43 PHE HA 1 44 PRO HD2 . . 3.740 2.187 2.160 2.192 . 0 0 "[ . 1 . 2]" 1
947 1 43 PHE HA 1 44 PRO QD . . 3.010 1.976 1.962 1.978 . 0 0 "[ . 1 . 2]" 1
948 1 43 PHE HA 1 44 PRO HD3 . . 3.740 2.251 2.251 2.252 . 0 0 "[ . 1 . 2]" 1
949 1 43 PHE HA 1 44 PRO HG2 . . 4.710 4.341 4.319 4.345 . 0 0 "[ . 1 . 2]" 1
950 1 43 PHE HA 1 44 PRO HG3 . . 4.600 4.362 4.351 4.364 . 0 0 "[ . 1 . 2]" 1
951 1 43 PHE QB 1 44 PRO QD . . 4.360 3.153 3.137 3.233 . 0 0 "[ . 1 . 2]" 1
952 1 43 PHE QB 1 71 VAL QG . . 5.280 4.655 4.205 4.759 . 0 0 "[ . 1 . 2]" 1
953 1 43 PHE QD 1 44 PRO HD2 . . 4.200 2.806 2.794 2.955 . 0 0 "[ . 1 . 2]" 1
954 1 43 PHE QD 1 44 PRO HD3 . . 4.200 4.026 3.907 4.060 . 0 0 "[ . 1 . 2]" 1
955 1 43 PHE QD 1 44 PRO HG2 . . 4.710 3.659 3.600 4.024 . 0 0 "[ . 1 . 2]" 1
956 1 43 PHE QD 1 44 PRO HG3 . . 5.050 4.854 4.833 5.010 . 0 0 "[ . 1 . 2]" 1
957 1 43 PHE QD 1 46 VAL MG2 . . 5.040 3.627 3.575 3.967 . 0 0 "[ . 1 . 2]" 1
958 1 43 PHE QD 1 51 TYR QD . . 4.710 4.684 4.426 4.712 0.002 17 0 "[ . 1 . 2]" 1
959 1 43 PHE QD 1 51 TYR QE . . 4.490 3.688 3.602 3.746 . 0 0 "[ . 1 . 2]" 1
960 1 43 PHE QD 1 71 VAL QG . . 4.670 3.532 3.188 3.635 . 0 0 "[ . 1 . 2]" 1
961 1 43 PHE QE 1 44 PRO QD . . 4.910 3.507 3.472 3.534 . 0 0 "[ . 1 . 2]" 1
962 1 43 PHE QE 1 44 PRO HG2 . . 4.710 3.988 3.753 4.192 . 0 0 "[ . 1 . 2]" 1
963 1 43 PHE QE 1 46 VAL MG1 . . 5.500 5.513 5.507 5.515 0.015 10 0 "[ . 1 . 2]" 1
964 1 43 PHE QE 1 46 VAL MG2 . . 4.060 3.104 3.090 3.231 . 0 0 "[ . 1 . 2]" 1
965 1 43 PHE QE 1 47 ILE MG . . 4.600 3.458 3.397 3.686 . 0 0 "[ . 1 . 2]" 1
966 1 43 PHE QE 1 51 TYR QD . . 4.200 2.433 2.297 2.508 . 0 0 "[ . 1 . 2]" 1
967 1 43 PHE QE 1 51 TYR QE . . 4.090 2.084 1.998 2.594 . 0 0 "[ . 1 . 2]" 1
968 1 43 PHE QE 1 71 VAL MG1 . . 4.410 3.448 3.101 3.813 . 0 0 "[ . 1 . 2]" 1
969 1 43 PHE QE 1 71 VAL QG . . 3.720 2.509 2.465 2.633 . 0 0 "[ . 1 . 2]" 1
970 1 43 PHE QE 1 71 VAL MG2 . . 4.410 2.580 2.534 2.705 . 0 0 "[ . 1 . 2]" 1
971 1 43 PHE HZ 1 46 VAL MG2 . . 4.490 4.410 4.037 4.437 . 0 0 "[ . 1 . 2]" 1
972 1 43 PHE HZ 1 47 ILE MG . . 5.350 5.355 5.352 5.357 0.007 8 0 "[ . 1 . 2]" 1
973 1 43 PHE HZ 1 71 VAL QG . . 3.720 2.239 2.199 2.389 . 0 0 "[ . 1 . 2]" 1
974 1 44 PRO HA 1 45 ASP H . . 2.990 2.645 2.639 2.647 . 0 0 "[ . 1 . 2]" 1
975 1 44 PRO HA 1 45 ASP HA . . 4.920 4.370 4.368 4.377 . 0 0 "[ . 1 . 2]" 1
976 1 44 PRO HA 1 45 ASP HB2 . . 4.710 4.404 4.340 4.456 . 0 0 "[ . 1 . 2]" 1
977 1 44 PRO HA 1 45 ASP HB3 . . 5.300 5.156 5.055 5.293 . 0 0 "[ . 1 . 2]" 1
978 1 44 PRO HA 1 46 VAL H . . 4.710 4.421 4.383 4.477 . 0 0 "[ . 1 . 2]" 1
979 1 44 PRO HB2 1 45 ASP H . . 3.820 2.056 2.052 2.069 . 0 0 "[ . 1 . 2]" 1
980 1 44 PRO HB2 1 45 ASP HA . . 4.710 4.375 4.363 4.379 . 0 0 "[ . 1 . 2]" 1
981 1 44 PRO HB2 1 46 VAL H . . 4.060 3.106 2.934 3.164 . 0 0 "[ . 1 . 2]" 1
982 1 44 PRO HB2 1 46 VAL MG1 . . 3.600 2.580 2.476 2.699 . 0 0 "[ . 1 . 2]" 1
983 1 44 PRO HB2 1 46 VAL MG2 . . 3.740 2.926 2.767 3.012 . 0 0 "[ . 1 . 2]" 1
984 1 44 PRO HB2 1 71 VAL HB . . 5.020 4.936 4.453 5.022 0.002 15 0 "[ . 1 . 2]" 1
985 1 44 PRO HB2 1 71 VAL QG . . 5.360 4.586 4.206 4.660 . 0 0 "[ . 1 . 2]" 1
986 1 44 PRO HB3 1 45 ASP H . . 3.840 3.202 3.201 3.206 . 0 0 "[ . 1 . 2]" 1
987 1 44 PRO HB3 1 46 VAL H . . 4.710 4.646 4.516 4.710 . 0 0 "[ . 1 . 2]" 1
988 1 44 PRO HB3 1 71 VAL QG . . 5.440 4.805 4.325 4.898 . 0 0 "[ . 1 . 2]" 1
989 1 44 PRO QD 1 71 VAL HB . . 4.070 3.947 3.226 4.065 . 0 0 "[ . 1 . 2]" 1
990 1 44 PRO HG2 1 46 VAL MG1 . . 3.870 3.266 3.110 3.611 . 0 0 "[ . 1 . 2]" 1
991 1 44 PRO HG2 1 46 VAL MG2 . . 3.740 1.881 1.877 1.921 . 0 0 "[ . 1 . 2]" 1
992 1 44 PRO HG2 1 71 VAL H . . 5.500 5.489 5.407 5.505 0.005 17 0 "[ . 1 . 2]" 1
993 1 44 PRO HG2 1 71 VAL HB . . 4.560 3.341 2.913 3.417 . 0 0 "[ . 1 . 2]" 1
994 1 44 PRO HG2 1 71 VAL QG . . 3.720 2.964 2.642 3.026 . 0 0 "[ . 1 . 2]" 1
995 1 44 PRO HG3 1 45 ASP H . . 4.730 4.648 4.644 4.658 . 0 0 "[ . 1 . 2]" 1
996 1 44 PRO HG3 1 71 VAL H . . 4.580 4.250 4.072 4.327 . 0 0 "[ . 1 . 2]" 1
997 1 44 PRO HG3 1 71 VAL QG . . 3.770 3.091 2.701 3.175 . 0 0 "[ . 1 . 2]" 1
998 1 44 PRO HG3 1 101 ARG H . . 4.560 4.018 3.858 4.136 . 0 0 "[ . 1 . 2]" 1
999 1 45 ASP H 1 45 ASP HB2 . . 3.540 2.621 2.499 2.718 . 0 0 "[ . 1 . 2]" 1
1000 1 45 ASP H 1 45 ASP HB3 . . 3.410 2.669 2.591 2.794 . 0 0 "[ . 1 . 2]" 1
1001 1 45 ASP H 1 46 VAL H . . 3.470 3.133 3.022 3.179 . 0 0 "[ . 1 . 2]" 1
1002 1 45 ASP H 1 46 VAL MG1 . . 4.020 3.253 3.137 3.266 . 0 0 "[ . 1 . 2]" 1
1003 1 45 ASP H 1 46 VAL MG2 . . 4.400 4.094 3.977 4.138 . 0 0 "[ . 1 . 2]" 1
1004 1 45 ASP HA 1 46 VAL H . . 2.920 2.764 2.729 2.813 . 0 0 "[ . 1 . 2]" 1
1005 1 45 ASP HA 1 46 VAL MG1 . . 4.600 4.326 4.317 4.352 . 0 0 "[ . 1 . 2]" 1
1006 1 45 ASP HA 1 46 VAL MG2 . . 4.770 4.643 4.561 4.673 . 0 0 "[ . 1 . 2]" 1
1007 1 45 ASP HB2 1 46 VAL H . . 4.700 4.603 4.576 4.621 . 0 0 "[ . 1 . 2]" 1
1008 1 45 ASP HB2 1 46 VAL MG1 . . 5.000 4.737 4.635 4.808 . 0 0 "[ . 1 . 2]" 1
1009 1 45 ASP HB3 1 46 VAL H . . 4.330 4.240 4.202 4.265 . 0 0 "[ . 1 . 2]" 1
1010 1 45 ASP HB3 1 46 VAL MG1 . . 4.490 3.604 3.573 3.724 . 0 0 "[ . 1 . 2]" 1
1011 1 46 VAL H 1 46 VAL HB . . 3.830 3.854 3.834 3.860 0.030 11 0 "[ . 1 . 2]" 1
1012 1 46 VAL H 1 46 VAL MG1 . . 2.990 2.880 2.823 2.890 . 0 0 "[ . 1 . 2]" 1
1013 1 46 VAL H 1 46 VAL MG2 . . 3.520 2.186 2.110 2.205 . 0 0 "[ . 1 . 2]" 1
1014 1 46 VAL H 1 47 ILE MG . . 5.050 4.073 4.007 4.468 . 0 0 "[ . 1 . 2]" 1
1015 1 46 VAL HA 1 46 VAL MG1 . . 3.460 2.329 2.316 2.357 . 0 0 "[ . 1 . 2]" 1
1016 1 46 VAL HA 1 46 VAL MG2 . . 3.390 3.186 3.185 3.189 . 0 0 "[ . 1 . 2]" 1
1017 1 46 VAL HA 1 47 ILE H . . 3.050 2.389 2.225 2.546 . 0 0 "[ . 1 . 2]" 1
1018 1 46 VAL HA 1 47 ILE QG . . 4.390 3.403 3.367 3.478 . 0 0 "[ . 1 . 2]" 1
1019 1 46 VAL HB 1 47 ILE H . . 3.740 2.452 2.141 2.892 . 0 0 "[ . 1 . 2]" 1
1020 1 46 VAL HB 1 48 SER H . . 3.430 2.867 2.709 3.370 . 0 0 "[ . 1 . 2]" 1
1021 1 46 VAL MG1 1 47 ILE H . . 4.370 3.797 3.683 3.918 . 0 0 "[ . 1 . 2]" 1
1022 1 46 VAL MG1 1 71 VAL HB . . 5.410 4.325 4.115 4.647 . 0 0 "[ . 1 . 2]" 1
1023 1 46 VAL MG2 1 47 ILE H . . 3.800 3.326 3.015 3.698 . 0 0 "[ . 1 . 2]" 1
1024 1 46 VAL MG2 1 47 ILE HA . . 4.330 3.569 3.490 3.875 . 0 0 "[ . 1 . 2]" 1
1025 1 47 ILE H 1 47 ILE MD . . 4.330 4.069 3.745 4.093 . 0 0 "[ . 1 . 2]" 1
1026 1 47 ILE H 1 47 ILE HG12 . . 4.060 2.813 2.097 2.858 . 0 0 "[ . 1 . 2]" 1
1027 1 47 ILE H 1 47 ILE QG . . 3.470 2.392 2.022 2.424 . 0 0 "[ . 1 . 2]" 1
1028 1 47 ILE H 1 47 ILE HG13 . . 4.060 2.605 2.593 2.666 . 0 0 "[ . 1 . 2]" 1
1029 1 47 ILE H 1 47 ILE MG . . 3.690 3.374 3.088 3.391 . 0 0 "[ . 1 . 2]" 1
1030 1 47 ILE H 1 48 SER H . . 3.200 2.076 1.889 2.096 . 0 0 "[ . 1 . 2]" 1
1031 1 47 ILE H 1 48 SER QB . . 4.850 3.745 3.660 4.182 . 0 0 "[ . 1 . 2]" 1
1032 1 47 ILE HA 1 47 ILE MD . . 4.200 4.160 4.146 4.174 . 0 0 "[ . 1 . 2]" 1
1033 1 47 ILE HA 1 47 ILE QG . . 3.670 3.294 3.293 3.295 . 0 0 "[ . 1 . 2]" 1
1034 1 47 ILE HA 1 47 ILE MG . . 3.130 2.128 2.123 2.132 . 0 0 "[ . 1 . 2]" 1
1035 1 47 ILE HA 1 48 SER H . . 3.460 2.965 2.933 3.472 0.012 10 0 "[ . 1 . 2]" 1
1036 1 47 ILE HB 1 47 ILE MD . . 3.170 2.257 2.149 2.335 . 0 0 "[ . 1 . 2]" 1
1037 1 47 ILE HB 1 48 SER H . . 4.530 4.353 3.798 4.386 . 0 0 "[ . 1 . 2]" 1
1038 1 47 ILE MD 1 48 SER H . . 5.050 4.995 4.010 5.051 0.001 12 0 "[ . 1 . 2]" 1
1039 1 47 ILE QG 1 47 ILE MG . . 3.180 2.092 2.073 2.222 . 0 0 "[ . 1 . 2]" 1
1040 1 47 ILE QG 1 48 SER H . . 3.790 3.510 2.289 3.584 . 0 0 "[ . 1 . 2]" 1
1041 1 47 ILE QG 1 48 SER QB . . 4.040 3.915 3.690 3.976 . 0 0 "[ . 1 . 2]" 1
1042 1 47 ILE HG12 1 48 SER H . . 4.610 4.524 3.068 4.611 0.001 18 0 "[ . 1 . 2]" 1
1043 1 47 ILE HG13 1 48 SER H . . 4.610 3.658 2.363 3.736 . 0 0 "[ . 1 . 2]" 1
1044 1 47 ILE MG 1 48 SER H . . 5.320 4.367 4.134 4.381 . 0 0 "[ . 1 . 2]" 1
1045 1 48 SER H 1 48 SER QB . . 3.560 2.863 2.594 2.918 . 0 0 "[ . 1 . 2]" 1
1046 1 48 SER H 1 49 GLY H . . 4.730 3.991 3.847 4.486 . 0 0 "[ . 1 . 2]" 1
1047 1 48 SER H 1 71 VAL QG . . 5.010 3.418 3.303 4.545 . 0 0 "[ . 1 . 2]" 1
1048 1 48 SER QB 1 49 GLY H . . 3.960 3.412 3.178 3.549 . 0 0 "[ . 1 . 2]" 1
1049 1 48 SER QB 1 81 VAL HA . . 3.440 3.329 3.175 3.413 . 0 0 "[ . 1 . 2]" 1
1050 1 48 SER QB 1 81 VAL HB . . 3.790 3.422 3.382 3.475 . 0 0 "[ . 1 . 2]" 1
1051 1 48 SER QB 1 81 VAL MG1 . . 3.340 2.633 2.415 2.783 . 0 0 "[ . 1 . 2]" 1
1052 1 48 SER QB 1 81 VAL MG2 . . 4.640 4.636 4.607 4.644 0.004 1 0 "[ . 1 . 2]" 1
1053 1 48 SER HB2 1 49 GLY HA3 . . 5.500 5.030 4.857 5.130 . 0 0 "[ . 1 . 2]" 1
1054 1 48 SER HB3 1 49 GLY HA3 . . 5.500 5.057 4.964 5.097 . 0 0 "[ . 1 . 2]" 1
1055 1 49 GLY H 1 50 ALA H . . 4.580 4.317 4.268 4.421 . 0 0 "[ . 1 . 2]" 1
1056 1 49 GLY H 1 71 VAL QG . . 4.340 4.010 3.913 4.270 . 0 0 "[ . 1 . 2]" 1
1057 1 49 GLY H 1 81 VAL HA . . 3.780 3.768 3.731 3.783 0.003 9 0 "[ . 1 . 2]" 1
1058 1 49 GLY H 1 81 VAL MG1 . . 4.850 4.808 4.763 4.850 0.000 15 0 "[ . 1 . 2]" 1
1059 1 49 GLY HA2 1 50 ALA H . . 3.430 2.955 2.641 3.029 . 0 0 "[ . 1 . 2]" 1
1060 1 49 GLY HA2 1 50 ALA MB . . 5.040 4.093 4.062 4.128 . 0 0 "[ . 1 . 2]" 1
1061 1 49 GLY HA2 1 71 VAL QG . . 4.240 4.181 4.079 4.249 0.009 16 0 "[ . 1 . 2]" 1
1062 1 49 GLY HA2 1 72 ILE HB . . 5.330 4.933 4.567 5.213 . 0 0 "[ . 1 . 2]" 1
1063 1 49 GLY HA2 1 73 ILE HA . . 4.710 4.420 4.324 4.494 . 0 0 "[ . 1 . 2]" 1
1064 1 49 GLY HA2 1 73 ILE MG . . 5.140 5.139 5.133 5.150 0.010 16 0 "[ . 1 . 2]" 1
1065 1 49 GLY HA2 1 80 VAL HB . . 5.500 4.609 4.510 4.763 . 0 0 "[ . 1 . 2]" 1
1066 1 49 GLY HA2 1 80 VAL MG1 . . 5.500 5.478 5.394 5.501 0.001 20 0 "[ . 1 . 2]" 1
1067 1 49 GLY HA2 1 80 VAL MG2 . . 3.640 3.006 2.897 3.068 . 0 0 "[ . 1 . 2]" 1
1068 1 49 GLY HA2 1 81 VAL HA . . 4.090 2.553 2.413 2.948 . 0 0 "[ . 1 . 2]" 1
1069 1 49 GLY HA2 1 81 VAL MG1 . . 5.260 4.152 4.003 4.494 . 0 0 "[ . 1 . 2]" 1
1070 1 49 GLY HA2 1 86 VAL QG . . 5.210 4.214 3.961 4.267 . 0 0 "[ . 1 . 2]" 1
1071 1 49 GLY HA3 1 50 ALA H . . 3.360 2.246 2.200 2.487 . 0 0 "[ . 1 . 2]" 1
1072 1 49 GLY HA3 1 71 VAL QG . . 3.420 2.764 2.681 2.832 . 0 0 "[ . 1 . 2]" 1
1073 1 49 GLY HA3 1 72 ILE MG . . 5.350 4.959 4.785 5.155 . 0 0 "[ . 1 . 2]" 1
1074 1 49 GLY HA3 1 73 ILE MG . . 4.250 4.085 4.045 4.139 . 0 0 "[ . 1 . 2]" 1
1075 1 50 ALA H 1 50 ALA MB . . 3.230 2.410 2.300 2.452 . 0 0 "[ . 1 . 2]" 1
1076 1 50 ALA H 1 51 TYR H . . 4.730 4.323 4.274 4.434 . 0 0 "[ . 1 . 2]" 1
1077 1 50 ALA H 1 71 VAL HA . . 4.530 3.776 3.655 4.235 . 0 0 "[ . 1 . 2]" 1
1078 1 50 ALA H 1 71 VAL QG . . 3.550 3.028 2.848 3.448 . 0 0 "[ . 1 . 2]" 1
1079 1 50 ALA H 1 72 ILE H . . 4.000 2.707 2.524 3.026 . 0 0 "[ . 1 . 2]" 1
1080 1 50 ALA H 1 72 ILE HB . . 3.820 2.876 2.544 3.101 . 0 0 "[ . 1 . 2]" 1
1081 1 50 ALA H 1 80 VAL MG2 . . 3.670 3.468 3.153 3.620 . 0 0 "[ . 1 . 2]" 1
1082 1 50 ALA H 1 86 VAL QG . . 4.190 3.494 3.287 3.612 . 0 0 "[ . 1 . 2]" 1
1083 1 50 ALA HA 1 51 TYR H . . 3.100 2.141 2.141 2.143 . 0 0 "[ . 1 . 2]" 1
1084 1 50 ALA HA 1 72 ILE MD . . 4.990 4.500 4.222 4.752 . 0 0 "[ . 1 . 2]" 1
1085 1 50 ALA HA 1 83 ALA HA . . 4.490 3.191 3.065 3.286 . 0 0 "[ . 1 . 2]" 1
1086 1 50 ALA HA 1 83 ALA MB . . 3.560 2.517 2.281 2.744 . 0 0 "[ . 1 . 2]" 1
1087 1 50 ALA HA 1 86 VAL QG . . 4.460 3.831 3.717 3.875 . 0 0 "[ . 1 . 2]" 1
1088 1 50 ALA MB 1 51 TYR H . . 3.700 3.253 3.191 3.296 . 0 0 "[ . 1 . 2]" 1
1089 1 50 ALA MB 1 51 TYR HB2 . . 5.500 5.377 5.345 5.391 . 0 0 "[ . 1 . 2]" 1
1090 1 50 ALA MB 1 52 ILE H . . 5.490 4.839 4.717 4.912 . 0 0 "[ . 1 . 2]" 1
1091 1 50 ALA MB 1 72 ILE H . . 4.000 3.136 3.047 3.255 . 0 0 "[ . 1 . 2]" 1
1092 1 50 ALA MB 1 72 ILE HB . . 2.930 2.714 2.559 2.812 . 0 0 "[ . 1 . 2]" 1
1093 1 50 ALA MB 1 72 ILE MD . . 3.060 1.976 1.797 2.176 . 0 0 "[ . 1 . 2]" 1
1094 1 50 ALA MB 1 72 ILE QG . . 4.600 3.584 3.176 3.752 . 0 0 "[ . 1 . 2]" 1
1095 1 50 ALA MB 1 72 ILE MG . . 3.870 3.801 3.620 3.869 . 0 0 "[ . 1 . 2]" 1
1096 1 50 ALA MB 1 80 VAL MG2 . . 3.490 3.274 3.150 3.475 . 0 0 "[ . 1 . 2]" 1
1097 1 50 ALA MB 1 83 ALA HA . . 3.170 1.944 1.892 2.095 . 0 0 "[ . 1 . 2]" 1
1098 1 50 ALA MB 1 83 ALA MB . . 3.290 2.231 2.117 2.390 . 0 0 "[ . 1 . 2]" 1
1099 1 50 ALA MB 1 86 VAL H . . 4.490 3.963 3.915 4.118 . 0 0 "[ . 1 . 2]" 1
1100 1 50 ALA MB 1 86 VAL HA . . 5.040 5.028 4.970 5.040 0.000 14 0 "[ . 1 . 2]" 1
1101 1 50 ALA MB 1 86 VAL HB . . 3.740 3.719 3.599 3.743 0.003 9 0 "[ . 1 . 2]" 1
1102 1 50 ALA MB 1 86 VAL QG . . 2.950 1.903 1.789 1.952 . 0 0 "[ . 1 . 2]" 1
1103 1 51 TYR H 1 51 TYR HB2 . . 3.470 2.887 2.856 2.923 . 0 0 "[ . 1 . 2]" 1
1104 1 51 TYR H 1 51 TYR HB3 . . 3.280 2.396 2.383 2.421 . 0 0 "[ . 1 . 2]" 1
1105 1 51 TYR H 1 51 TYR QD . . 4.220 4.173 4.160 4.197 . 0 0 "[ . 1 . 2]" 1
1106 1 51 TYR H 1 71 VAL QG . . 5.440 4.297 4.225 4.611 . 0 0 "[ . 1 . 2]" 1
1107 1 51 TYR H 1 86 VAL QG . . 5.440 5.118 5.060 5.147 . 0 0 "[ . 1 . 2]" 1
1108 1 51 TYR HA 1 51 TYR QD . . 3.530 2.664 2.588 2.698 . 0 0 "[ . 1 . 2]" 1
1109 1 51 TYR HA 1 52 ILE H . . 3.090 2.141 2.138 2.145 . 0 0 "[ . 1 . 2]" 1
1110 1 51 TYR HA 1 52 ILE HB . . 5.040 4.627 4.618 4.633 . 0 0 "[ . 1 . 2]" 1
1111 1 51 TYR HA 1 52 ILE HG13 . . 5.040 3.798 3.763 3.841 . 0 0 "[ . 1 . 2]" 1
1112 1 51 TYR HA 1 71 VAL MG1 . . 4.380 3.854 3.612 4.221 . 0 0 "[ . 1 . 2]" 1
1113 1 51 TYR HA 1 71 VAL QG . . 3.390 2.880 2.769 3.239 . 0 0 "[ . 1 . 2]" 1
1114 1 51 TYR HA 1 71 VAL MG2 . . 4.380 2.973 2.867 3.365 . 0 0 "[ . 1 . 2]" 1
1115 1 51 TYR HA 1 72 ILE H . . 4.500 4.458 4.334 4.499 . 0 0 "[ . 1 . 2]" 1
1116 1 51 TYR HA 1 72 ILE MD . . 5.500 4.931 4.808 5.498 . 0 0 "[ . 1 . 2]" 1
1117 1 51 TYR HB2 1 52 ILE H . . 4.560 4.215 4.173 4.269 . 0 0 "[ . 1 . 2]" 1
1118 1 51 TYR HB2 1 71 VAL QG . . 3.980 3.308 3.162 3.608 . 0 0 "[ . 1 . 2]" 1
1119 1 51 TYR HB3 1 52 ILE H . . 4.640 4.325 4.291 4.376 . 0 0 "[ . 1 . 2]" 1
1120 1 51 TYR HB3 1 53 ILE QG . . 5.210 4.193 4.122 4.233 . 0 0 "[ . 1 . 2]" 1
1121 1 51 TYR HB3 1 71 VAL QG . . 5.440 4.555 4.410 4.866 . 0 0 "[ . 1 . 2]" 1
1122 1 51 TYR QD 1 52 ILE H . . 4.090 3.414 3.320 3.523 . 0 0 "[ . 1 . 2]" 1
1123 1 51 TYR QD 1 52 ILE HA . . 4.770 4.685 4.620 4.737 . 0 0 "[ . 1 . 2]" 1
1124 1 51 TYR QD 1 53 ILE HA . . 4.330 4.283 4.234 4.330 0.000 14 0 "[ . 1 . 2]" 1
1125 1 51 TYR QD 1 53 ILE MD . . 3.920 3.296 3.205 3.374 . 0 0 "[ . 1 . 2]" 1
1126 1 51 TYR QD 1 53 ILE HG12 . . 4.090 2.553 2.483 2.575 . 0 0 "[ . 1 . 2]" 1
1127 1 51 TYR QD 1 53 ILE QG . . 3.430 2.429 2.360 2.458 . 0 0 "[ . 1 . 2]" 1
1128 1 51 TYR QD 1 53 ILE HG13 . . 4.090 3.045 2.950 3.112 . 0 0 "[ . 1 . 2]" 1
1129 1 51 TYR QD 1 53 ILE MG . . 4.410 4.410 4.378 4.414 0.004 2 0 "[ . 1 . 2]" 1
1130 1 51 TYR QD 1 69 ASN HA . . 4.090 3.766 3.634 3.947 . 0 0 "[ . 1 . 2]" 1
1131 1 51 TYR QD 1 71 VAL QG . . 3.110 2.583 2.343 2.779 . 0 0 "[ . 1 . 2]" 1
1132 1 51 TYR QE 1 53 ILE HA . . 3.640 3.142 3.041 3.276 . 0 0 "[ . 1 . 2]" 1
1133 1 51 TYR QE 1 53 ILE MD . . 3.790 3.330 3.273 3.469 . 0 0 "[ . 1 . 2]" 1
1134 1 51 TYR QE 1 53 ILE HG12 . . 4.090 2.020 1.998 2.149 . 0 0 "[ . 1 . 2]" 1
1135 1 51 TYR QE 1 53 ILE QG . . 3.560 2.010 1.988 2.135 . 0 0 "[ . 1 . 2]" 1
1136 1 51 TYR QE 1 53 ILE HG13 . . 4.090 3.593 3.565 3.702 . 0 0 "[ . 1 . 2]" 1
1137 1 51 TYR QE 1 53 ILE MG . . 3.790 3.086 2.963 3.166 . 0 0 "[ . 1 . 2]" 1
1138 1 51 TYR QE 1 69 ASN H . . 4.350 4.217 4.073 4.351 0.001 14 0 "[ . 1 . 2]" 1
1139 1 51 TYR QE 1 69 ASN HA . . 3.230 2.353 2.166 2.511 . 0 0 "[ . 1 . 2]" 1
1140 1 51 TYR QE 1 69 ASN HB2 . . 4.860 4.748 4.399 4.867 0.007 7 0 "[ . 1 . 2]" 1
1141 1 51 TYR QE 1 69 ASN QB . . 4.070 3.299 2.945 3.437 . 0 0 "[ . 1 . 2]" 1
1142 1 51 TYR QE 1 69 ASN HB3 . . 4.860 3.366 2.992 3.515 . 0 0 "[ . 1 . 2]" 1
1143 1 51 TYR QE 1 71 VAL QG . . 4.530 4.029 3.798 4.109 . 0 0 "[ . 1 . 2]" 1
1144 1 52 ILE H 1 52 ILE HB . . 3.380 2.506 2.499 2.511 . 0 0 "[ . 1 . 2]" 1
1145 1 52 ILE H 1 52 ILE MD . . 3.850 3.771 3.744 3.796 . 0 0 "[ . 1 . 2]" 1
1146 1 52 ILE H 1 52 ILE HG12 . . 3.690 3.571 3.534 3.602 . 0 0 "[ . 1 . 2]" 1
1147 1 52 ILE H 1 52 ILE HG13 . . 3.640 2.386 2.342 2.424 . 0 0 "[ . 1 . 2]" 1
1148 1 52 ILE H 1 52 ILE MG . . 4.060 3.783 3.779 3.788 . 0 0 "[ . 1 . 2]" 1
1149 1 52 ILE H 1 53 ILE H . . 4.430 4.428 4.379 4.436 0.006 10 0 "[ . 1 . 2]" 1
1150 1 52 ILE H 1 53 ILE HA . . 5.330 5.190 5.160 5.224 . 0 0 "[ . 1 . 2]" 1
1151 1 52 ILE H 1 69 ASN H . . 4.970 4.272 4.178 4.393 . 0 0 "[ . 1 . 2]" 1
1152 1 52 ILE H 1 69 ASN HA . . 4.840 4.245 4.125 4.396 . 0 0 "[ . 1 . 2]" 1
1153 1 52 ILE H 1 70 ASP H . . 4.220 2.735 2.403 3.114 . 0 0 "[ . 1 . 2]" 1
1154 1 52 ILE H 1 70 ASP HB2 . . 5.280 3.861 3.495 3.944 . 0 0 "[ . 1 . 2]" 1
1155 1 52 ILE H 1 70 ASP QB . . 4.420 3.605 3.305 3.681 . 0 0 "[ . 1 . 2]" 1
1156 1 52 ILE H 1 70 ASP HB3 . . 5.280 4.325 3.984 4.427 . 0 0 "[ . 1 . 2]" 1
1157 1 52 ILE H 1 71 VAL QG . . 4.300 3.899 3.784 4.218 . 0 0 "[ . 1 . 2]" 1
1158 1 52 ILE HA 1 52 ILE MD . . 3.920 3.815 3.809 3.818 . 0 0 "[ . 1 . 2]" 1
1159 1 52 ILE HA 1 52 ILE HG12 . . 3.710 2.507 2.498 2.513 . 0 0 "[ . 1 . 2]" 1
1160 1 52 ILE HA 1 52 ILE HG13 . . 3.690 3.058 3.055 3.063 . 0 0 "[ . 1 . 2]" 1
1161 1 52 ILE HA 1 52 ILE MG . . 3.350 2.373 2.344 2.397 . 0 0 "[ . 1 . 2]" 1
1162 1 52 ILE HA 1 53 ILE H . . 3.160 2.140 2.139 2.143 . 0 0 "[ . 1 . 2]" 1
1163 1 52 ILE HA 1 53 ILE HB . . 4.870 4.760 4.753 4.767 . 0 0 "[ . 1 . 2]" 1
1164 1 52 ILE HA 1 53 ILE QG . . 4.600 3.535 3.514 3.576 . 0 0 "[ . 1 . 2]" 1
1165 1 52 ILE HA 1 54 GLU H . . 3.870 3.618 3.566 3.678 . 0 0 "[ . 1 . 2]" 1
1166 1 52 ILE HB 1 52 ILE MD . . 3.250 2.356 2.351 2.371 . 0 0 "[ . 1 . 2]" 1
1167 1 52 ILE HB 1 53 ILE H . . 4.710 4.279 4.258 4.330 . 0 0 "[ . 1 . 2]" 1
1168 1 52 ILE HB 1 66 LEU QD . . 5.440 5.072 4.874 5.198 . 0 0 "[ . 1 . 2]" 1
1169 1 52 ILE HB 1 68 GLU HA . . 4.200 3.041 2.975 3.090 . 0 0 "[ . 1 . 2]" 1
1170 1 52 ILE HB 1 69 ASN H . . 3.780 3.133 3.043 3.248 . 0 0 "[ . 1 . 2]" 1
1171 1 52 ILE HB 1 70 ASP H . . 3.540 2.106 2.034 2.231 . 0 0 "[ . 1 . 2]" 1
1172 1 52 ILE HB 1 70 ASP HB2 . . 4.330 2.514 2.360 2.626 . 0 0 "[ . 1 . 2]" 1
1173 1 52 ILE HB 1 70 ASP QB . . 3.800 2.483 2.340 2.590 . 0 0 "[ . 1 . 2]" 1
1174 1 52 ILE HB 1 70 ASP HB3 . . 4.330 3.863 3.598 3.966 . 0 0 "[ . 1 . 2]" 1
1175 1 52 ILE MD 1 52 ILE MG . . 2.770 2.053 2.033 2.063 . 0 0 "[ . 1 . 2]" 1
1176 1 52 ILE MD 1 53 ILE H . . 5.500 5.201 5.174 5.257 . 0 0 "[ . 1 . 2]" 1
1177 1 52 ILE MD 1 66 LEU HB2 . . 4.030 3.667 3.473 3.830 . 0 0 "[ . 1 . 2]" 1
1178 1 52 ILE MD 1 66 LEU HB3 . . 3.470 2.219 2.066 2.455 . 0 0 "[ . 1 . 2]" 1
1179 1 52 ILE MD 1 67 LYS H . . 3.540 3.305 3.163 3.545 0.005 6 0 "[ . 1 . 2]" 1
1180 1 52 ILE MD 1 68 GLU HA . . 4.490 3.935 3.855 4.015 . 0 0 "[ . 1 . 2]" 1
1181 1 52 ILE MD 1 69 ASN H . . 5.300 4.799 4.714 4.918 . 0 0 "[ . 1 . 2]" 1
1182 1 52 ILE MD 1 70 ASP H . . 3.820 3.487 3.423 3.653 . 0 0 "[ . 1 . 2]" 1
1183 1 52 ILE MD 1 70 ASP HA . . 4.490 4.492 4.480 4.497 0.007 5 0 "[ . 1 . 2]" 1
1184 1 52 ILE MD 1 70 ASP HB2 . . 3.480 1.962 1.952 1.975 . 0 0 "[ . 1 . 2]" 1
1185 1 52 ILE MD 1 70 ASP QB . . 2.960 1.908 1.902 1.912 . 0 0 "[ . 1 . 2]" 1
1186 1 52 ILE MD 1 70 ASP HB3 . . 3.480 2.612 2.486 2.655 . 0 0 "[ . 1 . 2]" 1
1187 1 52 ILE HG12 1 52 ILE MG . . 3.600 2.384 2.353 2.414 . 0 0 "[ . 1 . 2]" 1
1188 1 52 ILE HG12 1 53 ILE H . . 5.240 4.456 4.439 4.492 . 0 0 "[ . 1 . 2]" 1
1189 1 52 ILE HG12 1 66 LEU HB3 . . 5.140 4.564 4.381 4.950 . 0 0 "[ . 1 . 2]" 1
1190 1 52 ILE HG12 1 68 GLU HA . . 5.500 5.492 5.420 5.510 0.010 11 0 "[ . 1 . 2]" 1
1191 1 52 ILE HG12 1 70 ASP H . . 5.250 4.852 4.779 4.978 . 0 0 "[ . 1 . 2]" 1
1192 1 52 ILE HG13 1 70 ASP HB2 . . 4.710 3.161 2.809 3.257 . 0 0 "[ . 1 . 2]" 1
1193 1 52 ILE HG13 1 70 ASP QB . . 4.000 2.901 2.631 2.989 . 0 0 "[ . 1 . 2]" 1
1194 1 52 ILE HG13 1 70 ASP HB3 . . 4.710 3.384 3.026 3.511 . 0 0 "[ . 1 . 2]" 1
1195 1 52 ILE HG13 1 71 VAL H . . 5.500 5.036 4.962 5.103 . 0 0 "[ . 1 . 2]" 1
1196 1 52 ILE MG 1 53 ILE H . . 3.940 2.732 2.554 2.964 . 0 0 "[ . 1 . 2]" 1
1197 1 52 ILE MG 1 53 ILE HA . . 4.460 3.936 3.878 3.990 . 0 0 "[ . 1 . 2]" 1
1198 1 52 ILE MG 1 53 ILE HB . . 5.170 4.514 4.427 4.604 . 0 0 "[ . 1 . 2]" 1
1199 1 52 ILE MG 1 54 GLU H . . 3.430 2.265 2.070 2.471 . 0 0 "[ . 1 . 2]" 1
1200 1 52 ILE MG 1 54 GLU HA . . 4.260 3.286 3.190 3.365 . 0 0 "[ . 1 . 2]" 1
1201 1 52 ILE MG 1 55 VAL H . . 5.040 3.703 3.645 3.779 . 0 0 "[ . 1 . 2]" 1
1202 1 52 ILE MG 1 55 VAL HA . . 4.200 3.736 3.675 3.781 . 0 0 "[ . 1 . 2]" 1
1203 1 52 ILE MG 1 61 ALA MB . . 5.250 5.036 4.979 5.080 . 0 0 "[ . 1 . 2]" 1
1204 1 52 ILE MG 1 66 LEU HA . . 5.500 5.082 4.945 5.435 . 0 0 "[ . 1 . 2]" 1
1205 1 52 ILE MG 1 66 LEU HB2 . . 5.500 4.887 4.752 5.003 . 0 0 "[ . 1 . 2]" 1
1206 1 52 ILE MG 1 66 LEU HB3 . . 4.180 3.753 3.631 3.819 . 0 0 "[ . 1 . 2]" 1
1207 1 52 ILE MG 1 68 GLU H . . 4.460 4.017 3.774 4.196 . 0 0 "[ . 1 . 2]" 1
1208 1 52 ILE MG 1 68 GLU HA . . 3.180 2.147 1.981 2.292 . 0 0 "[ . 1 . 2]" 1
1209 1 52 ILE MG 1 68 GLU HB2 . . 4.830 3.988 3.916 4.047 . 0 0 "[ . 1 . 2]" 1
1210 1 52 ILE MG 1 68 GLU HB3 . . 5.500 4.735 4.662 4.791 . 0 0 "[ . 1 . 2]" 1
1211 1 52 ILE MG 1 68 GLU HG2 . . 4.970 4.304 4.196 4.412 . 0 0 "[ . 1 . 2]" 1
1212 1 52 ILE MG 1 68 GLU HG3 . . 4.420 3.157 2.990 3.304 . 0 0 "[ . 1 . 2]" 1
1213 1 52 ILE MG 1 69 ASN H . . 3.740 3.312 3.242 3.445 . 0 0 "[ . 1 . 2]" 1
1214 1 52 ILE MG 1 69 ASN HA . . 5.300 4.980 4.901 5.084 . 0 0 "[ . 1 . 2]" 1
1215 1 52 ILE MG 1 70 ASP H . . 4.000 3.646 3.501 3.818 . 0 0 "[ . 1 . 2]" 1
1216 1 52 ILE MG 1 70 ASP QB . . 4.080 3.441 3.364 3.514 . 0 0 "[ . 1 . 2]" 1
1217 1 53 ILE H 1 53 ILE HB . . 3.550 2.632 2.625 2.642 . 0 0 "[ . 1 . 2]" 1
1218 1 53 ILE H 1 53 ILE MD . . 3.920 3.677 3.621 3.702 . 0 0 "[ . 1 . 2]" 1
1219 1 53 ILE H 1 53 ILE HG12 . . 4.090 3.407 3.341 3.461 . 0 0 "[ . 1 . 2]" 1
1220 1 53 ILE H 1 53 ILE QG . . 3.420 2.162 2.084 2.213 . 0 0 "[ . 1 . 2]" 1
1221 1 53 ILE H 1 53 ILE HG13 . . 4.090 2.186 2.105 2.240 . 0 0 "[ . 1 . 2]" 1
1222 1 53 ILE H 1 53 ILE MG . . 3.920 3.811 3.796 3.819 . 0 0 "[ . 1 . 2]" 1
1223 1 53 ILE H 1 54 GLU H . . 3.010 2.240 2.195 2.328 . 0 0 "[ . 1 . 2]" 1
1224 1 53 ILE H 1 54 GLU HB2 . . 5.500 5.378 5.344 5.436 . 0 0 "[ . 1 . 2]" 1
1225 1 53 ILE HA 1 53 ILE MD . . 4.030 3.869 3.867 3.871 . 0 0 "[ . 1 . 2]" 1
1226 1 53 ILE HA 1 53 ILE HG12 . . 4.000 2.626 2.623 2.630 . 0 0 "[ . 1 . 2]" 1
1227 1 53 ILE HA 1 53 ILE HG13 . . 4.000 3.156 3.145 3.172 . 0 0 "[ . 1 . 2]" 1
1228 1 53 ILE HA 1 53 ILE MG . . 3.230 2.282 2.232 2.362 . 0 0 "[ . 1 . 2]" 1
1229 1 53 ILE HA 1 68 GLU HA . . 5.450 4.724 4.599 4.853 . 0 0 "[ . 1 . 2]" 1
1230 1 53 ILE HA 1 68 GLU HG2 . . 4.840 3.776 3.586 3.979 . 0 0 "[ . 1 . 2]" 1
1231 1 53 ILE HA 1 68 GLU HG3 . . 4.540 3.338 3.269 3.459 . 0 0 "[ . 1 . 2]" 1
1232 1 53 ILE HA 1 69 ASN H . . 4.710 3.653 3.544 3.829 . 0 0 "[ . 1 . 2]" 1
1233 1 53 ILE HB 1 53 ILE MD . . 3.460 2.393 2.376 2.408 . 0 0 "[ . 1 . 2]" 1
1234 1 53 ILE HB 1 54 GLU H . . 3.430 2.938 2.861 2.967 . 0 0 "[ . 1 . 2]" 1
1235 1 53 ILE HB 1 54 GLU HB2 . . 4.710 4.173 4.145 4.195 . 0 0 "[ . 1 . 2]" 1
1236 1 53 ILE MD 1 54 GLU H . . 4.770 4.760 4.704 4.777 0.007 13 0 "[ . 1 . 2]" 1
1237 1 53 ILE QG 1 54 GLU H . . 4.910 3.901 3.873 3.915 . 0 0 "[ . 1 . 2]" 1
1238 1 53 ILE MG 1 54 GLU H . . 4.090 3.877 3.807 3.901 . 0 0 "[ . 1 . 2]" 1
1239 1 53 ILE MG 1 54 GLU HB3 . . 4.710 3.818 3.717 3.867 . 0 0 "[ . 1 . 2]" 1
1240 1 54 GLU H 1 54 GLU HB2 . . 3.920 3.595 3.583 3.605 . 0 0 "[ . 1 . 2]" 1
1241 1 54 GLU H 1 54 GLU HG3 . . 5.460 4.618 4.610 4.622 . 0 0 "[ . 1 . 2]" 1
1242 1 54 GLU H 1 55 VAL H . . 4.640 4.124 4.087 4.180 . 0 0 "[ . 1 . 2]" 1
1243 1 54 GLU H 1 55 VAL HA . . 4.970 4.528 4.507 4.556 . 0 0 "[ . 1 . 2]" 1
1244 1 54 GLU H 1 55 VAL QG . . 5.250 4.216 3.688 4.829 . 0 0 "[ . 1 . 2]" 1
1245 1 54 GLU H 1 68 GLU HA . . 4.970 4.339 4.239 4.504 . 0 0 "[ . 1 . 2]" 1
1246 1 54 GLU H 1 68 GLU HG3 . . 5.190 3.604 3.516 3.759 . 0 0 "[ . 1 . 2]" 1
1247 1 54 GLU HA 1 54 GLU HG2 . . 4.000 3.597 3.589 3.608 . 0 0 "[ . 1 . 2]" 1
1248 1 54 GLU HA 1 54 GLU HG3 . . 3.600 2.504 2.489 2.516 . 0 0 "[ . 1 . 2]" 1
1249 1 54 GLU HA 1 55 VAL H . . 2.790 2.195 2.178 2.227 . 0 0 "[ . 1 . 2]" 1
1250 1 54 GLU HA 1 55 VAL HA . . 4.710 4.390 4.385 4.398 . 0 0 "[ . 1 . 2]" 1
1251 1 54 GLU HA 1 55 VAL HB . . 5.480 4.634 4.591 4.679 . 0 0 "[ . 1 . 2]" 1
1252 1 54 GLU HA 1 55 VAL QG . . 4.960 3.556 3.523 3.576 . 0 0 "[ . 1 . 2]" 1
1253 1 54 GLU HA 1 68 GLU HA . . 4.420 3.656 3.545 3.764 . 0 0 "[ . 1 . 2]" 1
1254 1 54 GLU HA 1 68 GLU HB2 . . 3.560 3.223 3.115 3.345 . 0 0 "[ . 1 . 2]" 1
1255 1 54 GLU HA 1 68 GLU HB3 . . 4.900 4.643 4.532 4.752 . 0 0 "[ . 1 . 2]" 1
1256 1 54 GLU HA 1 68 GLU HG3 . . 3.580 2.478 2.359 2.572 . 0 0 "[ . 1 . 2]" 1
1257 1 54 GLU HB2 1 55 VAL H . . 4.060 4.048 3.982 4.076 0.016 12 0 "[ . 1 . 2]" 1
1258 1 54 GLU HB2 1 56 ILE MD . . 5.420 5.155 5.103 5.198 . 0 0 "[ . 1 . 2]" 1
1259 1 54 GLU HB3 1 55 VAL H . . 4.140 4.110 4.029 4.160 0.020 18 0 "[ . 1 . 2]" 1
1260 1 54 GLU HG2 1 55 VAL H . . 4.000 3.512 3.353 3.616 . 0 0 "[ . 1 . 2]" 1
1261 1 54 GLU HG2 1 55 VAL HA . . 5.340 4.359 4.288 4.417 . 0 0 "[ . 1 . 2]" 1
1262 1 54 GLU HG2 1 56 ILE HA . . 5.500 3.949 3.910 4.010 . 0 0 "[ . 1 . 2]" 1
1263 1 54 GLU HG2 1 56 ILE MD . . 4.330 2.661 2.578 2.725 . 0 0 "[ . 1 . 2]" 1
1264 1 54 GLU HG2 1 56 ILE HG12 . . 4.490 4.337 4.295 4.376 . 0 0 "[ . 1 . 2]" 1
1265 1 54 GLU HG2 1 56 ILE HG13 . . 5.500 5.504 5.500 5.509 0.009 7 0 "[ . 1 . 2]" 1
1266 1 54 GLU HG3 1 55 VAL H . . 3.560 2.285 2.124 2.370 . 0 0 "[ . 1 . 2]" 1
1267 1 54 GLU HG3 1 56 ILE MD . . 4.200 3.889 3.822 3.993 . 0 0 "[ . 1 . 2]" 1
1268 1 54 GLU HG3 1 56 ILE HG12 . . 5.500 5.501 5.498 5.502 0.002 13 0 "[ . 1 . 2]" 1
1269 1 55 VAL H 1 55 VAL HB . . 3.210 2.865 2.623 3.173 . 0 0 "[ . 1 . 2]" 1
1270 1 55 VAL H 1 55 VAL MG1 . . 3.890 2.977 1.907 3.858 . 0 0 "[ . 1 . 2]" 1
1271 1 55 VAL H 1 55 VAL QG . . 3.230 2.300 1.901 2.672 . 0 0 "[ . 1 . 2]" 1
1272 1 55 VAL H 1 55 VAL MG2 . . 3.890 3.178 2.630 3.804 . 0 0 "[ . 1 . 2]" 1
1273 1 55 VAL H 1 56 ILE H . . 4.440 4.157 4.123 4.179 . 0 0 "[ . 1 . 2]" 1
1274 1 55 VAL H 1 56 ILE MD . . 4.850 4.851 4.828 4.861 0.011 20 0 "[ . 1 . 2]" 1
1275 1 55 VAL H 1 68 GLU H . . 4.980 4.677 4.477 4.895 . 0 0 "[ . 1 . 2]" 1
1276 1 55 VAL H 1 68 GLU HB2 . . 4.490 3.760 3.705 3.772 . 0 0 "[ . 1 . 2]" 1
1277 1 55 VAL H 1 68 GLU HB3 . . 5.500 5.496 5.446 5.506 0.006 16 0 "[ . 1 . 2]" 1
1278 1 55 VAL H 1 68 GLU HG3 . . 4.250 4.247 4.226 4.253 0.003 16 0 "[ . 1 . 2]" 1
1279 1 55 VAL HA 1 55 VAL MG1 . . 3.270 2.708 2.281 3.179 . 0 0 "[ . 1 . 2]" 1
1280 1 55 VAL HA 1 55 VAL MG2 . . 3.270 2.376 2.311 2.429 . 0 0 "[ . 1 . 2]" 1
1281 1 55 VAL HA 1 56 ILE H . . 2.930 2.164 2.161 2.166 . 0 0 "[ . 1 . 2]" 1
1282 1 55 VAL HA 1 56 ILE HG12 . . 4.330 3.874 3.852 3.897 . 0 0 "[ . 1 . 2]" 1
1283 1 55 VAL HA 1 61 ALA MB . . 4.600 4.642 4.620 4.662 0.062 10 0 "[ . 1 . 2]" 1
1284 1 55 VAL HB 1 56 ILE H . . 4.800 4.360 4.348 4.370 . 0 0 "[ . 1 . 2]" 1
1285 1 55 VAL HB 1 62 GLU H . . 5.500 5.482 5.393 5.552 0.052 16 0 "[ . 1 . 2]" 1
1286 1 55 VAL HB 1 67 LYS HA . . 4.850 3.904 3.691 4.692 . 0 0 "[ . 1 . 2]" 1
1287 1 55 VAL HB 1 68 GLU H . . 5.360 4.745 4.413 5.113 . 0 0 "[ . 1 . 2]" 1
1288 1 55 VAL QG 1 56 ILE H . . 3.270 2.956 2.857 3.064 . 0 0 "[ . 1 . 2]" 1
1289 1 55 VAL QG 1 59 THR H . . 5.280 4.570 4.445 4.696 . 0 0 "[ . 1 . 2]" 1
1290 1 55 VAL QG 1 59 THR HB . . 5.440 4.294 4.242 4.342 . 0 0 "[ . 1 . 2]" 1
1291 1 55 VAL QG 1 59 THR HG1 . . 3.670 2.526 2.447 2.579 . 0 0 "[ . 1 . 2]" 1
1292 1 55 VAL QG 1 59 THR MG . . 4.310 3.637 3.577 3.677 . 0 0 "[ . 1 . 2]" 1
1293 1 55 VAL QG 1 61 ALA H . . 4.460 4.012 3.961 4.075 . 0 0 "[ . 1 . 2]" 1
1294 1 55 VAL QG 1 61 ALA MB . . 2.960 2.384 2.198 2.548 . 0 0 "[ . 1 . 2]" 1
1295 1 55 VAL QG 1 62 GLU H . . 3.490 2.900 2.817 2.974 . 0 0 "[ . 1 . 2]" 1
1296 1 55 VAL QG 1 62 GLU HA . . 3.110 2.055 1.919 2.207 . 0 0 "[ . 1 . 2]" 1
1297 1 55 VAL QG 1 62 GLU HB2 . . 3.270 1.993 1.899 2.105 . 0 0 "[ . 1 . 2]" 1
1298 1 55 VAL QG 1 62 GLU HB3 . . 3.280 3.060 2.944 3.165 . 0 0 "[ . 1 . 2]" 1
1299 1 55 VAL QG 1 62 GLU HG3 . . 4.180 3.710 3.405 3.954 . 0 0 "[ . 1 . 2]" 1
1300 1 55 VAL QG 1 63 ALA H . . 4.530 4.476 4.375 4.557 0.027 10 0 "[ . 1 . 2]" 1
1301 1 55 VAL QG 1 66 LEU H . . 5.250 4.443 4.133 4.506 . 0 0 "[ . 1 . 2]" 1
1302 1 55 VAL QG 1 66 LEU HB2 . . 3.980 2.953 2.766 3.210 . 0 0 "[ . 1 . 2]" 1
1303 1 55 VAL QG 1 66 LEU HB3 . . 4.420 3.158 2.742 3.642 . 0 0 "[ . 1 . 2]" 1
1304 1 55 VAL QG 1 67 LYS H . . 4.680 4.169 3.906 4.541 . 0 0 "[ . 1 . 2]" 1
1305 1 55 VAL QG 1 67 LYS HA . . 3.090 2.640 2.235 2.913 . 0 0 "[ . 1 . 2]" 1
1306 1 55 VAL QG 1 67 LYS QB . . 4.600 4.163 3.861 4.479 . 0 0 "[ . 1 . 2]" 1
1307 1 55 VAL QG 1 67 LYS QD . . 5.280 3.885 2.933 4.392 . 0 0 "[ . 1 . 2]" 1
1308 1 55 VAL QG 1 67 LYS QG . . 4.830 4.068 3.661 4.413 . 0 0 "[ . 1 . 2]" 1
1309 1 55 VAL QG 1 68 GLU H . . 3.380 3.206 2.776 3.383 0.003 8 0 "[ . 1 . 2]" 1
1310 1 55 VAL QG 1 68 GLU HA . . 3.830 3.462 3.142 3.832 0.002 13 0 "[ . 1 . 2]" 1
1311 1 55 VAL QG 1 68 GLU HB2 . . 4.940 3.681 3.423 3.946 . 0 0 "[ . 1 . 2]" 1
1312 1 55 VAL QG 1 68 GLU HB3 . . 5.440 4.887 4.688 5.079 . 0 0 "[ . 1 . 2]" 1
1313 1 55 VAL QG 1 68 GLU HG3 . . 4.860 4.441 4.224 4.644 . 0 0 "[ . 1 . 2]" 1
1314 1 55 VAL MG1 1 56 ILE H . . 4.540 3.503 2.910 4.213 . 0 0 "[ . 1 . 2]" 1
1315 1 55 VAL MG1 1 62 GLU HA . . 4.490 2.495 2.146 2.911 . 0 0 "[ . 1 . 2]" 1
1316 1 55 VAL MG1 1 62 GLU HB2 . . 4.710 2.395 1.977 2.809 . 0 0 "[ . 1 . 2]" 1
1317 1 55 VAL MG1 1 66 LEU HA . . 5.300 5.307 5.301 5.315 0.015 5 0 "[ . 1 . 2]" 1
1318 1 55 VAL MG2 1 56 ILE H . . 4.540 3.722 3.132 4.210 . 0 0 "[ . 1 . 2]" 1
1319 1 55 VAL MG2 1 62 GLU HA . . 4.490 2.993 1.950 3.879 . 0 0 "[ . 1 . 2]" 1
1320 1 55 VAL MG2 1 62 GLU HB2 . . 4.710 3.325 1.934 4.475 . 0 0 "[ . 1 . 2]" 1
1321 1 55 VAL MG2 1 66 LEU HA . . 5.300 4.727 4.315 5.302 0.002 6 0 "[ . 1 . 2]" 1
1322 1 56 ILE H 1 56 ILE HB . . 3.060 2.660 2.642 2.673 . 0 0 "[ . 1 . 2]" 1
1323 1 56 ILE H 1 56 ILE MD . . 3.740 2.827 2.776 2.902 . 0 0 "[ . 1 . 2]" 1
1324 1 56 ILE H 1 56 ILE HG12 . . 3.280 1.971 1.953 1.992 . 0 0 "[ . 1 . 2]" 1
1325 1 56 ILE H 1 56 ILE HG13 . . 3.580 3.537 3.525 3.550 . 0 0 "[ . 1 . 2]" 1
1326 1 56 ILE H 1 56 ILE MG . . 3.790 3.764 3.762 3.765 . 0 0 "[ . 1 . 2]" 1
1327 1 56 ILE H 1 57 PRO HD2 . . 5.030 4.757 4.755 4.760 . 0 0 "[ . 1 . 2]" 1
1328 1 56 ILE H 1 57 PRO HD3 . . 5.040 4.811 4.809 4.813 . 0 0 "[ . 1 . 2]" 1
1329 1 56 ILE H 1 59 THR HG1 . . 4.310 3.973 3.953 4.012 . 0 0 "[ . 1 . 2]" 1
1330 1 56 ILE H 1 59 THR MG . . 4.340 3.840 3.812 3.929 . 0 0 "[ . 1 . 2]" 1
1331 1 56 ILE H 1 61 ALA MB . . 5.500 5.225 5.190 5.244 . 0 0 "[ . 1 . 2]" 1
1332 1 56 ILE HA 1 56 ILE MD . . 3.430 1.985 1.952 2.042 . 0 0 "[ . 1 . 2]" 1
1333 1 56 ILE HA 1 56 ILE HG12 . . 3.690 3.176 3.158 3.191 . 0 0 "[ . 1 . 2]" 1
1334 1 56 ILE HA 1 56 ILE HG13 . . 3.750 3.709 3.704 3.715 . 0 0 "[ . 1 . 2]" 1
1335 1 56 ILE HA 1 56 ILE MG . . 3.030 2.399 2.392 2.407 . 0 0 "[ . 1 . 2]" 1
1336 1 56 ILE HA 1 57 PRO HD2 . . 2.960 2.129 2.126 2.132 . 0 0 "[ . 1 . 2]" 1
1337 1 56 ILE HA 1 57 PRO HD3 . . 3.070 2.255 2.254 2.256 . 0 0 "[ . 1 . 2]" 1
1338 1 56 ILE HA 1 57 PRO HG2 . . 4.350 4.296 4.293 4.298 . 0 0 "[ . 1 . 2]" 1
1339 1 56 ILE HA 1 57 PRO HG3 . . 4.350 4.341 4.340 4.342 . 0 0 "[ . 1 . 2]" 1
1340 1 56 ILE HA 1 59 THR MG . . 4.460 4.093 4.065 4.186 . 0 0 "[ . 1 . 2]" 1
1341 1 56 ILE HB 1 56 ILE MD . . 3.310 3.222 3.215 3.228 . 0 0 "[ . 1 . 2]" 1
1342 1 56 ILE HB 1 57 PRO HD2 . . 4.380 3.984 3.974 3.995 . 0 0 "[ . 1 . 2]" 1
1343 1 56 ILE HB 1 59 THR HG1 . . 4.200 3.303 3.285 3.319 . 0 0 "[ . 1 . 2]" 1
1344 1 56 ILE HB 1 59 THR MG . . 2.930 1.982 1.966 2.056 . 0 0 "[ . 1 . 2]" 1
1345 1 56 ILE MD 1 56 ILE MG . . 2.740 1.972 1.940 1.992 . 0 0 "[ . 1 . 2]" 1
1346 1 56 ILE MD 1 57 PRO HD2 . . 4.710 2.828 2.644 2.968 . 0 0 "[ . 1 . 2]" 1
1347 1 56 ILE MD 1 57 PRO HD3 . . 3.560 3.458 3.355 3.527 . 0 0 "[ . 1 . 2]" 1
1348 1 56 ILE MD 1 57 PRO QG . . 5.350 4.321 4.230 4.391 . 0 0 "[ . 1 . 2]" 1
1349 1 56 ILE MD 1 59 THR HG1 . . 5.500 5.541 5.536 5.546 0.046 19 0 "[ . 1 . 2]" 1
1350 1 56 ILE HG12 1 57 PRO HD2 . . 5.040 4.793 4.775 4.809 . 0 0 "[ . 1 . 2]" 1
1351 1 56 ILE HG12 1 57 PRO HD3 . . 5.500 5.423 5.405 5.439 . 0 0 "[ . 1 . 2]" 1
1352 1 56 ILE HG13 1 57 PRO HD2 . . 4.710 4.584 4.575 4.596 . 0 0 "[ . 1 . 2]" 1
1353 1 56 ILE MG 1 57 PRO HB2 . . 4.600 4.385 4.382 4.390 . 0 0 "[ . 1 . 2]" 1
1354 1 56 ILE MG 1 57 PRO HB3 . . 5.040 4.656 4.652 4.661 . 0 0 "[ . 1 . 2]" 1
1355 1 56 ILE MG 1 57 PRO HD2 . . 3.310 1.871 1.865 1.877 . 0 0 "[ . 1 . 2]" 1
1356 1 56 ILE MG 1 57 PRO HD3 . . 3.320 3.232 3.223 3.242 . 0 0 "[ . 1 . 2]" 1
1357 1 56 ILE MG 1 57 PRO HG2 . . 4.490 3.076 3.068 3.085 . 0 0 "[ . 1 . 2]" 1
1358 1 56 ILE MG 1 57 PRO QG . . 3.790 2.982 2.975 2.991 . 0 0 "[ . 1 . 2]" 1
1359 1 56 ILE MG 1 57 PRO HG3 . . 4.490 4.006 3.998 4.015 . 0 0 "[ . 1 . 2]" 1
1360 1 56 ILE MG 1 59 THR H . . 4.840 4.697 4.665 4.769 . 0 0 "[ . 1 . 2]" 1
1361 1 56 ILE MG 1 59 THR HG1 . . 4.330 4.102 4.074 4.136 . 0 0 "[ . 1 . 2]" 1
1362 1 56 ILE MG 1 59 THR MG . . 2.740 2.496 2.458 2.567 . 0 0 "[ . 1 . 2]" 1
1363 1 57 PRO HA 1 58 ASP H . . 2.850 2.362 2.353 2.373 . 0 0 "[ . 1 . 2]" 1
1364 1 57 PRO HA 1 58 ASP HB2 . . 5.040 4.706 4.651 4.755 . 0 0 "[ . 1 . 2]" 1
1365 1 57 PRO HA 1 59 THR H . . 3.800 3.286 3.259 3.314 . 0 0 "[ . 1 . 2]" 1
1366 1 57 PRO HA 1 59 THR HG1 . . 4.710 4.250 4.203 4.264 . 0 0 "[ . 1 . 2]" 1
1367 1 57 PRO HA 1 62 GLU H . . 5.330 5.294 5.265 5.322 . 0 0 "[ . 1 . 2]" 1
1368 1 57 PRO HA 1 62 GLU HB2 . . 3.790 3.243 3.197 3.269 . 0 0 "[ . 1 . 2]" 1
1369 1 57 PRO HA 1 62 GLU HB3 . . 4.490 3.381 3.338 3.424 . 0 0 "[ . 1 . 2]" 1
1370 1 57 PRO HA 1 62 GLU HG2 . . 4.430 3.996 3.892 4.121 . 0 0 "[ . 1 . 2]" 1
1371 1 57 PRO HA 1 62 GLU HG3 . . 4.850 4.413 4.381 4.455 . 0 0 "[ . 1 . 2]" 1
1372 1 57 PRO HB2 1 58 ASP H . . 4.000 2.710 2.681 2.733 . 0 0 "[ . 1 . 2]" 1
1373 1 57 PRO HB2 1 58 ASP HB2 . . 4.330 3.282 3.243 3.333 . 0 0 "[ . 1 . 2]" 1
1374 1 57 PRO HB2 1 58 ASP HB3 . . 4.490 4.374 4.277 4.452 . 0 0 "[ . 1 . 2]" 1
1375 1 57 PRO HB2 1 59 THR H . . 5.030 4.857 4.827 4.890 . 0 0 "[ . 1 . 2]" 1
1376 1 57 PRO HB3 1 58 ASP H . . 3.690 3.503 3.489 3.515 . 0 0 "[ . 1 . 2]" 1
1377 1 57 PRO HB3 1 58 ASP HA . . 5.500 5.626 5.614 5.635 0.135 2 0 "[ . 1 . 2]" 1
1378 1 57 PRO HB3 1 58 ASP HB2 . . 5.040 4.980 4.936 5.031 . 0 0 "[ . 1 . 2]" 1
1379 1 57 PRO HD2 1 59 THR MG . . 5.470 4.353 4.337 4.420 . 0 0 "[ . 1 . 2]" 1
1380 1 57 PRO HD3 1 59 THR MG . . 5.500 5.087 5.067 5.158 . 0 0 "[ . 1 . 2]" 1
1381 1 57 PRO QG 1 58 ASP H . . 4.420 4.230 4.212 4.245 . 0 0 "[ . 1 . 2]" 1
1382 1 58 ASP H 1 58 ASP HA . . 2.910 2.275 2.275 2.276 . 0 0 "[ . 1 . 2]" 1
1383 1 58 ASP H 1 58 ASP HB2 . . 4.000 3.096 3.088 3.111 . 0 0 "[ . 1 . 2]" 1
1384 1 58 ASP H 1 58 ASP HB3 . . 3.850 3.788 3.741 3.830 . 0 0 "[ . 1 . 2]" 1
1385 1 58 ASP H 1 59 THR H . . 3.370 2.601 2.598 2.605 . 0 0 "[ . 1 . 2]" 1
1386 1 58 ASP H 1 59 THR MG . . 4.970 4.151 4.133 4.167 . 0 0 "[ . 1 . 2]" 1
1387 1 58 ASP H 1 62 GLU HB2 . . 4.850 4.671 4.655 4.687 . 0 0 "[ . 1 . 2]" 1
1388 1 58 ASP H 1 62 GLU HB3 . . 4.710 3.876 3.851 3.906 . 0 0 "[ . 1 . 2]" 1
1389 1 58 ASP H 1 62 GLU HG2 . . 4.470 3.931 3.843 4.024 . 0 0 "[ . 1 . 2]" 1
1390 1 58 ASP HA 1 59 THR H . . 3.250 2.954 2.939 2.971 . 0 0 "[ . 1 . 2]" 1
1391 1 58 ASP HA 1 62 GLU HB3 . . 5.500 5.066 5.038 5.096 . 0 0 "[ . 1 . 2]" 1
1392 1 58 ASP HA 1 62 GLU HG2 . . 5.500 5.181 5.129 5.239 . 0 0 "[ . 1 . 2]" 1
1393 1 58 ASP HB2 1 59 THR H . . 4.560 4.468 4.446 4.502 . 0 0 "[ . 1 . 2]" 1
1394 1 58 ASP HB2 1 59 THR MG . . 4.710 4.529 4.475 4.606 . 0 0 "[ . 1 . 2]" 1
1395 1 58 ASP HB3 1 59 THR H . . 4.490 4.055 4.033 4.078 . 0 0 "[ . 1 . 2]" 1
1396 1 58 ASP HB3 1 59 THR MG . . 5.040 3.419 3.378 3.467 . 0 0 "[ . 1 . 2]" 1
1397 1 59 THR H 1 59 THR HG1 . . 3.640 3.330 3.316 3.347 . 0 0 "[ . 1 . 2]" 1
1398 1 59 THR H 1 59 THR MG . . 3.410 2.678 2.667 2.701 . 0 0 "[ . 1 . 2]" 1
1399 1 59 THR H 1 60 PRO HD2 . . 5.280 4.800 4.799 4.802 . 0 0 "[ . 1 . 2]" 1
1400 1 59 THR H 1 60 PRO QD . . 4.530 4.368 4.366 4.370 . 0 0 "[ . 1 . 2]" 1
1401 1 59 THR H 1 60 PRO HD3 . . 5.280 5.023 5.016 5.029 . 0 0 "[ . 1 . 2]" 1
1402 1 59 THR H 1 62 GLU H . . 3.820 3.759 3.735 3.784 . 0 0 "[ . 1 . 2]" 1
1403 1 59 THR H 1 62 GLU HA . . 5.500 5.554 5.541 5.574 0.074 6 0 "[ . 1 . 2]" 1
1404 1 59 THR H 1 62 GLU HB2 . . 4.220 3.993 3.962 4.035 . 0 0 "[ . 1 . 2]" 1
1405 1 59 THR H 1 62 GLU HB3 . . 3.250 2.640 2.625 2.662 . 0 0 "[ . 1 . 2]" 1
1406 1 59 THR H 1 62 GLU HG2 . . 3.980 3.971 3.938 3.990 0.010 11 0 "[ . 1 . 2]" 1
1407 1 59 THR H 1 63 ALA H . . 4.480 4.416 4.324 4.483 0.003 18 0 "[ . 1 . 2]" 1
1408 1 59 THR H 1 63 ALA MB . . 5.040 4.840 4.777 4.923 . 0 0 "[ . 1 . 2]" 1
1409 1 59 THR HA 1 59 THR MG . . 3.170 2.462 2.459 2.467 . 0 0 "[ . 1 . 2]" 1
1410 1 59 THR HA 1 60 PRO HD2 . . 3.600 2.440 2.437 2.443 . 0 0 "[ . 1 . 2]" 1
1411 1 59 THR HA 1 60 PRO QD . . 3.060 2.114 2.112 2.115 . 0 0 "[ . 1 . 2]" 1
1412 1 59 THR HA 1 60 PRO HD3 . . 3.600 2.316 2.314 2.318 . 0 0 "[ . 1 . 2]" 1
1413 1 59 THR HA 1 60 PRO HG2 . . 4.770 4.545 4.543 4.547 . 0 0 "[ . 1 . 2]" 1
1414 1 59 THR HA 1 60 PRO HG3 . . 4.710 4.497 4.495 4.499 . 0 0 "[ . 1 . 2]" 1
1415 1 59 THR HA 1 61 ALA H . . 4.970 3.901 3.899 3.903 . 0 0 "[ . 1 . 2]" 1
1416 1 59 THR HB 1 60 PRO HD2 . . 3.530 1.832 1.828 1.838 . 0 0 "[ . 1 . 2]" 1
1417 1 59 THR HB 1 60 PRO HD3 . . 3.530 3.292 3.289 3.296 . 0 0 "[ . 1 . 2]" 1
1418 1 59 THR HB 1 60 PRO HG2 . . 4.710 3.705 3.699 3.712 . 0 0 "[ . 1 . 2]" 1
1419 1 59 THR HB 1 60 PRO HG3 . . 4.710 4.512 4.507 4.519 . 0 0 "[ . 1 . 2]" 1
1420 1 59 THR HB 1 61 ALA H . . 3.720 2.631 2.622 2.638 . 0 0 "[ . 1 . 2]" 1
1421 1 59 THR HB 1 61 ALA MB . . 3.740 3.251 3.217 3.278 . 0 0 "[ . 1 . 2]" 1
1422 1 59 THR HB 1 62 GLU H . . 4.310 3.730 3.686 3.772 . 0 0 "[ . 1 . 2]" 1
1423 1 59 THR HG1 1 59 THR MG . . 2.870 1.957 1.945 1.974 . 0 0 "[ . 1 . 2]" 1
1424 1 59 THR HG1 1 61 ALA H . . 4.730 3.530 3.512 3.555 . 0 0 "[ . 1 . 2]" 1
1425 1 59 THR HG1 1 61 ALA MB . . 4.490 3.287 3.206 3.386 . 0 0 "[ . 1 . 2]" 1
1426 1 59 THR HG1 1 62 GLU H . . 3.550 3.026 2.920 3.127 . 0 0 "[ . 1 . 2]" 1
1427 1 59 THR HG1 1 62 GLU HB2 . . 4.330 3.447 3.422 3.482 . 0 0 "[ . 1 . 2]" 1
1428 1 59 THR HG1 1 62 GLU HB3 . . 4.490 3.214 3.168 3.257 . 0 0 "[ . 1 . 2]" 1
1429 1 59 THR HG1 1 62 GLU HG2 . . 5.500 5.496 5.476 5.509 0.009 12 0 "[ . 1 . 2]" 1
1430 1 59 THR MG 1 60 PRO HD2 . . 4.090 3.165 3.154 3.180 . 0 0 "[ . 1 . 2]" 1
1431 1 59 THR MG 1 60 PRO QD . . 3.530 3.044 3.033 3.057 . 0 0 "[ . 1 . 2]" 1
1432 1 59 THR MG 1 60 PRO HD3 . . 4.090 3.949 3.933 3.965 . 0 0 "[ . 1 . 2]" 1
1433 1 59 THR MG 1 61 ALA H . . 4.370 4.111 4.110 4.113 . 0 0 "[ . 1 . 2]" 1
1434 1 59 THR MG 1 62 GLU H . . 4.310 4.279 4.228 4.329 0.019 12 0 "[ . 1 . 2]" 1
1435 1 59 THR MG 1 62 GLU HB2 . . 5.050 4.592 4.561 4.627 . 0 0 "[ . 1 . 2]" 1
1436 1 59 THR MG 1 62 GLU HB3 . . 4.710 4.123 4.107 4.158 . 0 0 "[ . 1 . 2]" 1
1437 1 60 PRO HA 1 61 ALA HA . . 5.200 4.636 4.633 4.639 . 0 0 "[ . 1 . 2]" 1
1438 1 60 PRO HA 1 63 ALA H . . 3.970 3.866 3.756 3.975 0.005 5 0 "[ . 1 . 2]" 1
1439 1 60 PRO HA 1 63 ALA MB . . 3.660 3.374 3.283 3.524 . 0 0 "[ . 1 . 2]" 1
1440 1 60 PRO HA 1 64 GLY H . . 4.140 4.119 4.032 4.152 0.012 6 0 "[ . 1 . 2]" 1
1441 1 60 PRO HA 1 111 VAL MG1 . . 4.490 3.752 3.728 3.800 . 0 0 "[ . 1 . 2]" 1
1442 1 60 PRO HA 1 112 ILE H . . 5.040 4.308 4.090 4.407 . 0 0 "[ . 1 . 2]" 1
1443 1 60 PRO HB2 1 61 ALA H . . 4.040 3.817 3.814 3.819 . 0 0 "[ . 1 . 2]" 1
1444 1 60 PRO HB2 1 61 ALA MB . . 4.710 4.515 4.500 4.532 . 0 0 "[ . 1 . 2]" 1
1445 1 60 PRO HB2 1 111 VAL MG1 . . 3.310 1.958 1.949 1.969 . 0 0 "[ . 1 . 2]" 1
1446 1 60 PRO HB2 1 112 ILE H . . 4.430 2.404 2.112 2.527 . 0 0 "[ . 1 . 2]" 1
1447 1 60 PRO HB2 1 112 ILE HB . . 5.200 3.734 3.539 3.825 . 0 0 "[ . 1 . 2]" 1
1448 1 60 PRO HB2 1 113 PRO HA . . 4.450 3.832 3.795 3.913 . 0 0 "[ . 1 . 2]" 1
1449 1 60 PRO HB2 1 114 GLU H . . 5.500 5.254 5.147 5.512 0.012 14 0 "[ . 1 . 2]" 1
1450 1 60 PRO HB2 1 114 GLU QG . . 4.910 4.830 4.757 4.900 . 0 0 "[ . 1 . 2]" 1
1451 1 60 PRO HB3 1 61 ALA H . . 4.480 4.421 4.419 4.423 . 0 0 "[ . 1 . 2]" 1
1452 1 60 PRO HB3 1 61 ALA MB . . 5.500 5.520 5.512 5.531 0.031 11 0 "[ . 1 . 2]" 1
1453 1 60 PRO HB3 1 63 ALA MB . . 5.500 5.278 5.202 5.382 . 0 0 "[ . 1 . 2]" 1
1454 1 60 PRO HB3 1 111 VAL MG1 . . 3.750 3.533 3.512 3.563 . 0 0 "[ . 1 . 2]" 1
1455 1 60 PRO HB3 1 111 VAL MG2 . . 5.500 5.518 5.511 5.527 0.027 8 0 "[ . 1 . 2]" 1
1456 1 60 PRO HB3 1 112 ILE H . . 4.260 3.528 3.283 3.624 . 0 0 "[ . 1 . 2]" 1
1457 1 60 PRO HB3 1 113 PRO HA . . 4.710 4.405 4.284 4.457 . 0 0 "[ . 1 . 2]" 1
1458 1 60 PRO HB3 1 114 GLU H . . 5.350 5.123 5.024 5.360 0.010 9 0 "[ . 1 . 2]" 1
1459 1 60 PRO HB3 1 114 GLU QG . . 4.240 4.003 3.957 4.050 . 0 0 "[ . 1 . 2]" 1
1460 1 60 PRO QD 1 61 ALA H . . 3.780 2.796 2.793 2.798 . 0 0 "[ . 1 . 2]" 1
1461 1 60 PRO QD 1 61 ALA MB . . 5.210 3.773 3.714 3.818 . 0 0 "[ . 1 . 2]" 1
1462 1 60 PRO QD 1 114 GLU QG . . 4.540 3.839 3.644 4.021 . 0 0 "[ . 1 . 2]" 1
1463 1 60 PRO HD2 1 61 ALA H . . 4.490 2.859 2.855 2.861 . 0 0 "[ . 1 . 2]" 1
1464 1 60 PRO HD3 1 61 ALA H . . 4.490 3.955 3.953 3.957 . 0 0 "[ . 1 . 2]" 1
1465 1 60 PRO HG2 1 61 ALA H . . 4.430 3.078 3.072 3.083 . 0 0 "[ . 1 . 2]" 1
1466 1 60 PRO HG2 1 113 PRO HA . . 3.690 3.095 2.947 3.162 . 0 0 "[ . 1 . 2]" 1
1467 1 60 PRO HG2 1 114 GLU H . . 4.710 4.307 4.248 4.424 . 0 0 "[ . 1 . 2]" 1
1468 1 60 PRO HG2 1 114 GLU QG . . 4.710 4.531 4.451 4.623 . 0 0 "[ . 1 . 2]" 1
1469 1 60 PRO HG3 1 61 ALA H . . 4.710 4.413 4.409 4.416 . 0 0 "[ . 1 . 2]" 1
1470 1 60 PRO HG3 1 111 VAL MG1 . . 4.420 3.814 3.757 3.839 . 0 0 "[ . 1 . 2]" 1
1471 1 60 PRO HG3 1 113 PRO HA . . 4.490 2.811 2.571 2.900 . 0 0 "[ . 1 . 2]" 1
1472 1 60 PRO HG3 1 114 GLU H . . 3.740 3.240 3.178 3.396 . 0 0 "[ . 1 . 2]" 1
1473 1 60 PRO HG3 1 114 GLU QG . . 3.680 2.951 2.846 3.115 . 0 0 "[ . 1 . 2]" 1
1474 1 61 ALA H 1 61 ALA MB . . 3.030 2.192 2.151 2.226 . 0 0 "[ . 1 . 2]" 1
1475 1 61 ALA H 1 62 GLU H . . 3.540 2.207 2.183 2.237 . 0 0 "[ . 1 . 2]" 1
1476 1 61 ALA H 1 63 ALA H . . 4.430 3.925 3.852 3.987 . 0 0 "[ . 1 . 2]" 1
1477 1 61 ALA H 1 111 VAL MG1 . . 4.000 3.400 3.345 3.458 . 0 0 "[ . 1 . 2]" 1
1478 1 61 ALA H 1 111 VAL MG2 . . 4.490 4.313 4.264 4.350 . 0 0 "[ . 1 . 2]" 1
1479 1 61 ALA HA 1 64 GLY H . . 4.000 3.400 3.365 3.487 . 0 0 "[ . 1 . 2]" 1
1480 1 61 ALA HA 1 64 GLY HA3 . . 4.710 3.505 3.422 3.563 . 0 0 "[ . 1 . 2]" 1
1481 1 61 ALA HA 1 66 LEU HB2 . . 4.710 3.664 3.502 4.082 . 0 0 "[ . 1 . 2]" 1
1482 1 61 ALA HA 1 66 LEU HB3 . . 5.500 5.204 5.061 5.460 . 0 0 "[ . 1 . 2]" 1
1483 1 61 ALA HA 1 66 LEU QD . . 3.520 3.160 2.540 3.384 . 0 0 "[ . 1 . 2]" 1
1484 1 61 ALA HA 1 98 MET ME . . 5.300 4.737 4.603 4.872 . 0 0 "[ . 1 . 2]" 1
1485 1 61 ALA HA 1 109 ILE MG . . 4.460 4.120 4.028 4.250 . 0 0 "[ . 1 . 2]" 1
1486 1 61 ALA HA 1 111 VAL HA . . 4.710 4.278 4.046 4.418 . 0 0 "[ . 1 . 2]" 1
1487 1 61 ALA HA 1 111 VAL HB . . 5.040 4.204 4.108 4.322 . 0 0 "[ . 1 . 2]" 1
1488 1 61 ALA HA 1 111 VAL MG1 . . 3.270 2.184 2.064 2.360 . 0 0 "[ . 1 . 2]" 1
1489 1 61 ALA HA 1 111 VAL MG2 . . 3.210 1.944 1.914 1.972 . 0 0 "[ . 1 . 2]" 1
1490 1 61 ALA MB 1 62 GLU H . . 3.370 2.811 2.710 2.888 . 0 0 "[ . 1 . 2]" 1
1491 1 61 ALA MB 1 62 GLU HA . . 4.490 3.823 3.737 3.895 . 0 0 "[ . 1 . 2]" 1
1492 1 61 ALA MB 1 62 GLU HB2 . . 4.770 4.527 4.503 4.558 . 0 0 "[ . 1 . 2]" 1
1493 1 61 ALA MB 1 63 ALA H . . 4.840 4.678 4.637 4.755 . 0 0 "[ . 1 . 2]" 1
1494 1 61 ALA MB 1 64 GLY HA3 . . 5.040 4.909 4.812 4.974 . 0 0 "[ . 1 . 2]" 1
1495 1 61 ALA MB 1 66 LEU H . . 4.870 4.329 4.227 4.559 . 0 0 "[ . 1 . 2]" 1
1496 1 61 ALA MB 1 66 LEU QD . . 2.880 2.212 1.961 2.440 . 0 0 "[ . 1 . 2]" 1
1497 1 61 ALA MB 1 111 VAL MG1 . . 3.560 2.460 2.372 2.532 . 0 0 "[ . 1 . 2]" 1
1498 1 62 GLU H 1 62 GLU HB2 . . 3.330 3.023 3.007 3.039 . 0 0 "[ . 1 . 2]" 1
1499 1 62 GLU H 1 62 GLU HB3 . . 3.280 2.153 2.139 2.166 . 0 0 "[ . 1 . 2]" 1
1500 1 62 GLU H 1 62 GLU HG2 . . 3.920 4.012 4.002 4.020 0.100 1 0 "[ . 1 . 2]" 1
1501 1 62 GLU H 1 63 ALA H . . 3.190 2.601 2.481 2.722 . 0 0 "[ . 1 . 2]" 1
1502 1 62 GLU H 1 63 ALA MB . . 4.650 4.316 4.233 4.428 . 0 0 "[ . 1 . 2]" 1
1503 1 62 GLU H 1 64 GLY H . . 4.730 3.834 3.708 3.997 . 0 0 "[ . 1 . 2]" 1
1504 1 62 GLU HA 1 62 GLU HG3 . . 3.030 2.865 2.834 2.901 . 0 0 "[ . 1 . 2]" 1
1505 1 62 GLU HA 1 63 ALA HA . . 4.770 4.697 4.663 4.729 . 0 0 "[ . 1 . 2]" 1
1506 1 62 GLU HA 1 63 ALA MB . . 5.040 5.015 4.997 5.033 . 0 0 "[ . 1 . 2]" 1
1507 1 62 GLU HA 1 64 GLY H . . 5.040 4.394 4.288 4.534 . 0 0 "[ . 1 . 2]" 1
1508 1 62 GLU HA 1 65 GLY H . . 4.480 3.995 3.939 4.081 . 0 0 "[ . 1 . 2]" 1
1509 1 62 GLU HA 1 66 LEU H . . 4.770 4.404 3.584 4.629 . 0 0 "[ . 1 . 2]" 1
1510 1 62 GLU HB2 1 63 ALA H . . 4.270 4.083 4.025 4.147 . 0 0 "[ . 1 . 2]" 1
1511 1 62 GLU HB2 1 63 ALA MB . . 5.330 5.324 5.289 5.340 0.010 4 0 "[ . 1 . 2]" 1
1512 1 62 GLU HB3 1 63 ALA H . . 4.000 2.844 2.778 2.922 . 0 0 "[ . 1 . 2]" 1
1513 1 62 GLU HB3 1 64 GLY H . . 5.040 4.973 4.891 5.036 . 0 0 "[ . 1 . 2]" 1
1514 1 62 GLU HG2 1 63 ALA H . . 3.310 2.962 2.747 3.187 . 0 0 "[ . 1 . 2]" 1
1515 1 62 GLU HG2 1 63 ALA HA . . 4.410 3.393 3.267 3.537 . 0 0 "[ . 1 . 2]" 1
1516 1 62 GLU HG2 1 63 ALA MB . . 4.150 3.300 3.168 3.364 . 0 0 "[ . 1 . 2]" 1
1517 1 62 GLU HG3 1 63 ALA HA . . 4.870 3.757 3.680 3.854 . 0 0 "[ . 1 . 2]" 1
1518 1 63 ALA H 1 63 ALA MB . . 2.790 2.224 2.059 2.283 . 0 0 "[ . 1 . 2]" 1
1519 1 63 ALA H 1 64 GLY H . . 3.470 2.424 2.311 2.534 . 0 0 "[ . 1 . 2]" 1
1520 1 63 ALA H 1 64 GLY HA3 . . 4.840 4.702 4.595 4.803 . 0 0 "[ . 1 . 2]" 1
1521 1 63 ALA H 1 65 GLY H . . 4.840 4.216 4.153 4.310 . 0 0 "[ . 1 . 2]" 1
1522 1 63 ALA HA 1 65 GLY H . . 4.330 4.062 3.720 4.300 . 0 0 "[ . 1 . 2]" 1
1523 1 63 ALA MB 1 64 GLY H . . 3.250 2.786 2.648 2.886 . 0 0 "[ . 1 . 2]" 1
1524 1 63 ALA MB 1 64 GLY HA2 . . 4.200 3.845 3.747 3.905 . 0 0 "[ . 1 . 2]" 1
1525 1 63 ALA MB 1 64 GLY HA3 . . 4.770 4.378 4.301 4.430 . 0 0 "[ . 1 . 2]" 1
1526 1 63 ALA MB 1 65 GLY H . . 5.050 4.553 4.354 4.721 . 0 0 "[ . 1 . 2]" 1
1527 1 63 ALA MB 1 111 VAL MG1 . . 5.500 5.283 5.216 5.447 . 0 0 "[ . 1 . 2]" 1
1528 1 64 GLY H 1 65 GLY H . . 3.270 2.745 2.647 2.802 . 0 0 "[ . 1 . 2]" 1
1529 1 64 GLY H 1 65 GLY HA2 . . 5.350 5.094 5.021 5.161 . 0 0 "[ . 1 . 2]" 1
1530 1 64 GLY H 1 65 GLY HA3 . . 5.500 5.354 5.281 5.399 . 0 0 "[ . 1 . 2]" 1
1531 1 64 GLY H 1 66 LEU H . . 4.370 4.242 4.005 4.346 . 0 0 "[ . 1 . 2]" 1
1532 1 64 GLY H 1 109 ILE MG . . 4.960 4.406 4.322 4.543 . 0 0 "[ . 1 . 2]" 1
1533 1 64 GLY H 1 111 VAL MG1 . . 4.490 4.350 4.286 4.494 0.004 14 0 "[ . 1 . 2]" 1
1534 1 64 GLY H 1 111 VAL MG2 . . 4.200 3.356 3.248 3.555 . 0 0 "[ . 1 . 2]" 1
1535 1 64 GLY HA2 1 65 GLY HA3 . . 4.770 4.581 4.520 4.611 . 0 0 "[ . 1 . 2]" 1
1536 1 64 GLY HA2 1 109 ILE MG . . 4.090 3.655 3.453 3.909 . 0 0 "[ . 1 . 2]" 1
1537 1 64 GLY HA2 1 111 VAL HA . . 4.090 4.086 3.983 4.101 0.011 18 0 "[ . 1 . 2]" 1
1538 1 64 GLY HA2 1 111 VAL MG2 . . 3.790 3.571 3.427 3.775 . 0 0 "[ . 1 . 2]" 1
1539 1 64 GLY HA3 1 66 LEU H . . 4.640 3.692 3.603 3.917 . 0 0 "[ . 1 . 2]" 1
1540 1 64 GLY HA3 1 66 LEU HG . . 5.500 4.318 3.977 4.534 . 0 0 "[ . 1 . 2]" 1
1541 1 64 GLY HA3 1 109 ILE MG . . 3.920 2.849 2.651 3.104 . 0 0 "[ . 1 . 2]" 1
1542 1 64 GLY HA3 1 111 VAL HA . . 4.090 3.408 3.344 3.495 . 0 0 "[ . 1 . 2]" 1
1543 1 64 GLY HA3 1 111 VAL MG1 . . 4.490 3.967 3.853 4.121 . 0 0 "[ . 1 . 2]" 1
1544 1 64 GLY HA3 1 111 VAL MG2 . . 3.530 2.201 2.110 2.395 . 0 0 "[ . 1 . 2]" 1
1545 1 65 GLY H 1 66 LEU H . . 3.280 2.135 1.890 2.251 . 0 0 "[ . 1 . 2]" 1
1546 1 65 GLY H 1 66 LEU HB2 . . 4.730 3.996 3.919 4.058 . 0 0 "[ . 1 . 2]" 1
1547 1 65 GLY H 1 66 LEU HB3 . . 5.500 5.434 5.352 5.492 . 0 0 "[ . 1 . 2]" 1
1548 1 65 GLY H 1 66 LEU HG . . 5.370 4.163 3.956 4.362 . 0 0 "[ . 1 . 2]" 1
1549 1 65 GLY H 1 109 ILE MG . . 4.340 3.152 3.047 3.266 . 0 0 "[ . 1 . 2]" 1
1550 1 65 GLY H 1 111 VAL MG2 . . 4.560 3.941 3.774 4.199 . 0 0 "[ . 1 . 2]" 1
1551 1 65 GLY HA2 1 109 ILE MD . . 4.880 3.222 3.140 3.325 . 0 0 "[ . 1 . 2]" 1
1552 1 65 GLY HA2 1 109 ILE MG . . 4.660 3.689 3.444 3.906 . 0 0 "[ . 1 . 2]" 1
1553 1 65 GLY HA3 1 66 LEU HG . . 5.040 4.724 4.608 4.813 . 0 0 "[ . 1 . 2]" 1
1554 1 65 GLY HA3 1 109 ILE MD . . 4.200 1.913 1.897 1.923 . 0 0 "[ . 1 . 2]" 1
1555 1 65 GLY HA3 1 109 ILE MG . . 4.890 2.426 2.057 2.742 . 0 0 "[ . 1 . 2]" 1
1556 1 66 LEU H 1 66 LEU HB2 . . 3.220 2.470 2.377 2.548 . 0 0 "[ . 1 . 2]" 1
1557 1 66 LEU H 1 66 LEU HB3 . . 3.720 3.582 3.570 3.604 . 0 0 "[ . 1 . 2]" 1
1558 1 66 LEU H 1 66 LEU MD1 . . 4.000 3.736 3.656 3.784 . 0 0 "[ . 1 . 2]" 1
1559 1 66 LEU H 1 66 LEU QD . . 3.490 3.002 2.874 3.328 . 0 0 "[ . 1 . 2]" 1
1560 1 66 LEU H 1 66 LEU MD2 . . 4.000 3.169 2.992 3.690 . 0 0 "[ . 1 . 2]" 1
1561 1 66 LEU H 1 66 LEU HG . . 3.260 2.318 2.167 2.693 . 0 0 "[ . 1 . 2]" 1
1562 1 66 LEU H 1 67 LYS H . . 4.640 4.382 4.346 4.465 . 0 0 "[ . 1 . 2]" 1
1563 1 66 LEU H 1 109 ILE MD . . 4.490 3.600 3.523 4.008 . 0 0 "[ . 1 . 2]" 1
1564 1 66 LEU H 1 109 ILE MG . . 3.690 2.105 1.995 2.851 . 0 0 "[ . 1 . 2]" 1
1565 1 66 LEU HA 1 66 LEU MD1 . . 4.090 3.824 3.814 3.858 . 0 0 "[ . 1 . 2]" 1
1566 1 66 LEU HA 1 66 LEU QD . . 2.950 2.059 1.951 2.185 . 0 0 "[ . 1 . 2]" 1
1567 1 66 LEU HA 1 66 LEU MD2 . . 4.090 2.067 1.956 2.197 . 0 0 "[ . 1 . 2]" 1
1568 1 66 LEU HA 1 66 LEU HG . . 3.920 3.178 3.037 3.251 . 0 0 "[ . 1 . 2]" 1
1569 1 66 LEU HA 1 67 LYS H . . 3.030 2.154 2.138 2.163 . 0 0 "[ . 1 . 2]" 1
1570 1 66 LEU HA 1 67 LYS QB . . 4.280 4.262 4.203 4.284 0.004 16 0 "[ . 1 . 2]" 1
1571 1 66 LEU HA 1 67 LYS QG . . 5.010 4.453 4.143 4.533 . 0 0 "[ . 1 . 2]" 1
1572 1 66 LEU HA 1 102 ARG QH1 . . 4.180 4.164 4.061 4.189 0.009 7 0 "[ . 1 . 2]" 1
1573 1 66 LEU HA 1 102 ARG QH2 . . 5.050 2.331 2.140 2.418 . 0 0 "[ . 1 . 2]" 1
1574 1 66 LEU HA 1 109 ILE MD . . 3.740 3.741 3.704 3.752 0.012 20 0 "[ . 1 . 2]" 1
1575 1 66 LEU HA 1 109 ILE HG13 . . 5.070 3.442 3.327 3.633 . 0 0 "[ . 1 . 2]" 1
1576 1 66 LEU HA 1 109 ILE MG . . 3.860 3.087 3.009 3.210 . 0 0 "[ . 1 . 2]" 1
1577 1 66 LEU HB2 1 66 LEU QD . . 3.120 2.285 2.245 2.347 . 0 0 "[ . 1 . 2]" 1
1578 1 66 LEU HB2 1 67 LYS H . . 4.490 4.393 4.294 4.458 . 0 0 "[ . 1 . 2]" 1
1579 1 66 LEU HB2 1 109 ILE MG . . 4.090 3.582 3.479 3.801 . 0 0 "[ . 1 . 2]" 1
1580 1 66 LEU HB2 1 111 VAL MG2 . . 4.330 3.837 3.668 4.268 . 0 0 "[ . 1 . 2]" 1
1581 1 66 LEU HB3 1 66 LEU QD . . 3.020 2.070 2.028 2.114 . 0 0 "[ . 1 . 2]" 1
1582 1 66 LEU HB3 1 67 LYS H . . 3.740 3.664 3.411 3.741 0.001 16 0 "[ . 1 . 2]" 1
1583 1 66 LEU QD 1 67 LYS H . . 3.630 3.602 3.430 3.636 0.006 14 0 "[ . 1 . 2]" 1
1584 1 66 LEU QD 1 70 ASP QB . . 3.740 3.496 3.364 3.593 . 0 0 "[ . 1 . 2]" 1
1585 1 66 LEU QD 1 71 VAL H . . 5.440 5.439 5.393 5.444 0.004 16 0 "[ . 1 . 2]" 1
1586 1 66 LEU QD 1 98 MET HB2 . . 4.060 2.891 2.645 3.188 . 0 0 "[ . 1 . 2]" 1
1587 1 66 LEU QD 1 98 MET ME . . 3.070 1.949 1.843 2.209 . 0 0 "[ . 1 . 2]" 1
1588 1 66 LEU QD 1 98 MET HG2 . . 5.200 4.079 3.927 4.427 . 0 0 "[ . 1 . 2]" 1
1589 1 66 LEU QD 1 98 MET HG3 . . 4.420 3.263 3.067 3.532 . 0 0 "[ . 1 . 2]" 1
1590 1 66 LEU QD 1 100 VAL HB . . 4.630 3.522 3.408 3.649 . 0 0 "[ . 1 . 2]" 1
1591 1 66 LEU QD 1 102 ARG QH1 . . 4.850 4.683 4.520 4.806 . 0 0 "[ . 1 . 2]" 1
1592 1 66 LEU QD 1 109 ILE HA . . 4.960 4.613 4.502 4.844 . 0 0 "[ . 1 . 2]" 1
1593 1 66 LEU QD 1 109 ILE MG . . 2.970 2.044 1.917 2.277 . 0 0 "[ . 1 . 2]" 1
1594 1 66 LEU MD1 1 98 MET HB2 . . 5.390 4.305 4.112 4.554 . 0 0 "[ . 1 . 2]" 1
1595 1 66 LEU MD1 1 98 MET ME . . 4.290 1.966 1.853 2.239 . 0 0 "[ . 1 . 2]" 1
1596 1 66 LEU MD2 1 98 MET HB2 . . 5.390 2.938 2.675 3.255 . 0 0 "[ . 1 . 2]" 1
1597 1 66 LEU MD2 1 98 MET ME . . 4.290 3.256 3.125 3.487 . 0 0 "[ . 1 . 2]" 1
1598 1 66 LEU HG 1 111 VAL MG2 . . 3.380 2.614 2.537 2.924 . 0 0 "[ . 1 . 2]" 1
1599 1 67 LYS H 1 67 LYS HB2 . . 3.840 2.396 2.354 2.465 . 0 0 "[ . 1 . 2]" 1
1600 1 67 LYS H 1 67 LYS QB . . 3.210 2.363 2.323 2.429 . 0 0 "[ . 1 . 2]" 1
1601 1 67 LYS H 1 67 LYS HB3 . . 3.840 3.599 3.571 3.664 . 0 0 "[ . 1 . 2]" 1
1602 1 67 LYS H 1 67 LYS QD . . 4.910 4.626 4.478 4.800 . 0 0 "[ . 1 . 2]" 1
1603 1 67 LYS H 1 67 LYS QG . . 3.720 3.258 3.134 3.363 . 0 0 "[ . 1 . 2]" 1
1604 1 67 LYS H 1 70 ASP HB2 . . 4.970 3.600 3.435 3.808 . 0 0 "[ . 1 . 2]" 1
1605 1 67 LYS H 1 70 ASP QB . . 4.220 3.426 3.274 3.620 . 0 0 "[ . 1 . 2]" 1
1606 1 67 LYS H 1 70 ASP HB3 . . 4.970 4.296 4.124 4.560 . 0 0 "[ . 1 . 2]" 1
1607 1 67 LYS H 1 102 ARG QH1 . . 4.070 3.958 3.834 4.069 . 0 0 "[ . 1 . 2]" 1
1608 1 67 LYS H 1 102 ARG QH2 . . 4.730 2.384 1.935 2.488 . 0 0 "[ . 1 . 2]" 1
1609 1 67 LYS H 1 109 ILE MD . . 5.000 4.661 4.573 4.856 . 0 0 "[ . 1 . 2]" 1
1610 1 67 LYS H 1 109 ILE MG . . 5.040 4.848 4.766 5.041 0.001 6 0 "[ . 1 . 2]" 1
1611 1 67 LYS HA 1 67 LYS HD2 . . 3.850 3.260 2.380 3.838 . 0 0 "[ . 1 . 2]" 1
1612 1 67 LYS HA 1 67 LYS QD . . 3.380 2.630 2.274 2.896 . 0 0 "[ . 1 . 2]" 1
1613 1 67 LYS HA 1 67 LYS HD3 . . 3.850 3.026 2.297 3.789 . 0 0 "[ . 1 . 2]" 1
1614 1 67 LYS HA 1 67 LYS QG . . 3.280 2.365 2.235 2.524 . 0 0 "[ . 1 . 2]" 1
1615 1 67 LYS HA 1 68 GLU H . . 2.870 2.462 2.266 2.591 . 0 0 "[ . 1 . 2]" 1
1616 1 67 LYS HA 1 68 GLU HB2 . . 5.320 4.479 4.448 4.497 . 0 0 "[ . 1 . 2]" 1
1617 1 67 LYS QB 1 67 LYS QE . . 4.380 3.115 2.036 3.665 . 0 0 "[ . 1 . 2]" 1
1618 1 67 LYS QB 1 68 GLU H . . 3.250 2.319 2.041 2.767 . 0 0 "[ . 1 . 2]" 1
1619 1 67 LYS QB 1 68 GLU HA . . 5.340 4.374 4.247 4.565 . 0 0 "[ . 1 . 2]" 1
1620 1 67 LYS QB 1 70 ASP QB . . 5.180 4.277 4.076 4.569 . 0 0 "[ . 1 . 2]" 1
1621 1 67 LYS HB2 1 68 GLU H . . 4.090 3.741 3.524 4.033 . 0 0 "[ . 1 . 2]" 1
1622 1 67 LYS HB2 1 102 ARG HH21 . . 5.500 3.765 2.479 3.890 . 0 0 "[ . 1 . 2]" 1
1623 1 67 LYS HB2 1 102 ARG HH22 . . 5.500 3.693 2.852 3.815 . 0 0 "[ . 1 . 2]" 1
1624 1 67 LYS HB3 1 68 GLU H . . 4.090 2.343 2.055 2.818 . 0 0 "[ . 1 . 2]" 1
1625 1 67 LYS HB3 1 102 ARG HH21 . . 5.500 5.407 4.194 5.499 . 0 0 "[ . 1 . 2]" 1
1626 1 67 LYS HB3 1 102 ARG HH22 . . 5.500 5.386 4.497 5.499 . 0 0 "[ . 1 . 2]" 1
1627 1 67 LYS QD 1 68 GLU H . . 4.340 2.803 2.575 3.155 . 0 0 "[ . 1 . 2]" 1
1628 1 67 LYS QE 1 67 LYS QG . . 3.340 2.140 1.950 2.574 . 0 0 "[ . 1 . 2]" 1
1629 1 67 LYS QG 1 68 GLU H . . 4.360 3.913 3.790 4.217 . 0 0 "[ . 1 . 2]" 1
1630 1 67 LYS QG 1 102 ARG QD . . 4.300 4.282 4.025 4.309 0.009 20 0 "[ . 1 . 2]" 1
1631 1 67 LYS QG 1 102 ARG HE . . 5.340 5.235 4.307 5.340 0.000 19 0 "[ . 1 . 2]" 1
1632 1 67 LYS QG 1 102 ARG QH1 . . 4.410 3.400 3.134 3.497 . 0 0 "[ . 1 . 2]" 1
1633 1 67 LYS HG2 1 68 GLU H . . 5.160 4.198 4.063 4.515 . 0 0 "[ . 1 . 2]" 1
1634 1 67 LYS HG3 1 68 GLU H . . 5.160 4.685 4.409 5.058 . 0 0 "[ . 1 . 2]" 1
1635 1 68 GLU H 1 68 GLU HB2 . . 3.210 2.309 2.244 2.400 . 0 0 "[ . 1 . 2]" 1
1636 1 68 GLU H 1 68 GLU HB3 . . 3.380 2.777 2.717 2.844 . 0 0 "[ . 1 . 2]" 1
1637 1 68 GLU H 1 68 GLU HG2 . . 5.250 4.574 4.536 4.595 . 0 0 "[ . 1 . 2]" 1
1638 1 68 GLU H 1 68 GLU HG3 . . 4.810 4.272 4.202 4.352 . 0 0 "[ . 1 . 2]" 1
1639 1 68 GLU H 1 69 ASN H . . 4.700 4.635 4.618 4.647 . 0 0 "[ . 1 . 2]" 1
1640 1 68 GLU HA 1 68 GLU HG3 . . 4.010 2.344 2.288 2.481 . 0 0 "[ . 1 . 2]" 1
1641 1 68 GLU HA 1 69 ASN H . . 2.910 2.302 2.272 2.338 . 0 0 "[ . 1 . 2]" 1
1642 1 68 GLU HA 1 69 ASN HA . . 4.580 4.465 4.447 4.488 . 0 0 "[ . 1 . 2]" 1
1643 1 68 GLU HA 1 69 ASN QB . . 5.200 4.747 4.713 4.780 . 0 0 "[ . 1 . 2]" 1
1644 1 68 GLU HA 1 70 ASP H . . 4.000 3.628 3.263 3.989 . 0 0 "[ . 1 . 2]" 1
1645 1 68 GLU HB2 1 69 ASN H . . 4.200 4.074 3.981 4.133 . 0 0 "[ . 1 . 2]" 1
1646 1 68 GLU HB2 1 69 ASN QD . . 5.340 4.475 3.806 5.272 . 0 0 "[ . 1 . 2]" 1
1647 1 68 GLU HB3 1 69 ASN H . . 4.200 3.572 3.516 3.638 . 0 0 "[ . 1 . 2]" 1
1648 1 68 GLU HG2 1 69 ASN H . . 4.080 2.368 2.078 2.550 . 0 0 "[ . 1 . 2]" 1
1649 1 68 GLU HG2 1 69 ASN HB2 . . 5.040 4.438 4.318 4.547 . 0 0 "[ . 1 . 2]" 1
1650 1 68 GLU HG2 1 69 ASN HB3 . . 5.040 4.706 4.490 4.785 . 0 0 "[ . 1 . 2]" 1
1651 1 68 GLU HG2 1 69 ASN HD21 . . 4.780 3.667 2.825 4.396 . 0 0 "[ . 1 . 2]" 1
1652 1 68 GLU HG2 1 69 ASN QD . . 4.180 2.848 2.260 3.446 . 0 0 "[ . 1 . 2]" 1
1653 1 68 GLU HG2 1 69 ASN HD22 . . 4.780 2.970 2.377 3.601 . 0 0 "[ . 1 . 2]" 1
1654 1 69 ASN H 1 69 ASN QD . . 4.840 3.652 2.725 4.273 . 0 0 "[ . 1 . 2]" 1
1655 1 69 ASN H 1 70 ASP H . . 3.560 2.687 2.611 2.808 . 0 0 "[ . 1 . 2]" 1
1656 1 69 ASN HA 1 69 ASN QD . . 4.400 3.502 2.184 4.167 . 0 0 "[ . 1 . 2]" 1
1657 1 69 ASN QB 1 69 ASN QD . . 3.050 2.189 2.065 2.541 . 0 0 "[ . 1 . 2]" 1
1658 1 69 ASN QB 1 70 ASP H . . 4.270 3.876 3.767 3.915 . 0 0 "[ . 1 . 2]" 1
1659 1 69 ASN HB2 1 70 ASP H . . 4.850 4.219 4.029 4.330 . 0 0 "[ . 1 . 2]" 1
1660 1 69 ASN HB3 1 70 ASP H . . 4.850 4.523 4.466 4.567 . 0 0 "[ . 1 . 2]" 1
1661 1 70 ASP H 1 70 ASP HB2 . . 3.580 2.342 2.209 2.418 . 0 0 "[ . 1 . 2]" 1
1662 1 70 ASP H 1 70 ASP HB3 . . 3.580 3.475 3.346 3.524 . 0 0 "[ . 1 . 2]" 1
1663 1 70 ASP HA 1 71 VAL H . . 2.950 2.403 2.345 2.439 . 0 0 "[ . 1 . 2]" 1
1664 1 70 ASP HA 1 71 VAL QG . . 4.180 3.120 3.097 3.155 . 0 0 "[ . 1 . 2]" 1
1665 1 70 ASP QB 1 71 VAL H . . 3.460 2.548 2.456 2.646 . 0 0 "[ . 1 . 2]" 1
1666 1 70 ASP QB 1 71 VAL QG . . 5.280 4.009 3.976 4.049 . 0 0 "[ . 1 . 2]" 1
1667 1 70 ASP QB 1 100 VAL HB . . 4.080 3.782 3.703 3.952 . 0 0 "[ . 1 . 2]" 1
1668 1 70 ASP QB 1 100 VAL QG . . 3.130 2.181 2.096 2.383 . 0 0 "[ . 1 . 2]" 1
1669 1 70 ASP HB2 1 71 VAL H . . 4.280 3.945 3.884 4.012 . 0 0 "[ . 1 . 2]" 1
1670 1 70 ASP HB3 1 71 VAL H . . 4.280 2.580 2.483 2.684 . 0 0 "[ . 1 . 2]" 1
1671 1 71 VAL H 1 71 VAL HB . . 3.430 2.909 2.876 2.935 . 0 0 "[ . 1 . 2]" 1
1672 1 71 VAL H 1 71 VAL QG . . 3.530 2.745 2.710 2.769 . 0 0 "[ . 1 . 2]" 1
1673 1 71 VAL H 1 72 ILE H . . 4.370 3.954 3.671 4.037 . 0 0 "[ . 1 . 2]" 1
1674 1 71 VAL H 1 73 ILE MG . . 5.500 5.489 5.396 5.502 0.002 3 0 "[ . 1 . 2]" 1
1675 1 71 VAL H 1 100 VAL HA . . 4.560 4.347 4.238 4.392 . 0 0 "[ . 1 . 2]" 1
1676 1 71 VAL H 1 100 VAL HB . . 4.490 4.084 3.979 4.206 . 0 0 "[ . 1 . 2]" 1
1677 1 71 VAL H 1 100 VAL QG . . 3.410 1.906 1.876 2.023 . 0 0 "[ . 1 . 2]" 1
1678 1 71 VAL H 1 101 ARG H . . 3.970 3.972 3.965 3.979 0.009 20 0 "[ . 1 . 2]" 1
1679 1 71 VAL H 1 101 ARG HB2 . . 5.460 5.277 5.215 5.336 . 0 0 "[ . 1 . 2]" 1
1680 1 71 VAL HB 1 72 ILE H . . 4.640 4.310 4.275 4.407 . 0 0 "[ . 1 . 2]" 1
1681 1 71 VAL HB 1 100 VAL HA . . 5.500 5.100 5.062 5.183 . 0 0 "[ . 1 . 2]" 1
1682 1 71 VAL HB 1 101 ARG H . . 4.330 4.260 4.207 4.336 0.006 10 0 "[ . 1 . 2]" 1
1683 1 71 VAL HB 1 101 ARG HB2 . . 4.600 4.466 4.275 4.564 . 0 0 "[ . 1 . 2]" 1
1684 1 71 VAL QG 1 72 ILE H . . 3.340 2.913 2.805 3.227 . 0 0 "[ . 1 . 2]" 1
1685 1 71 VAL QG 1 101 ARG H . . 5.280 4.625 4.592 4.673 . 0 0 "[ . 1 . 2]" 1
1686 1 71 VAL MG1 1 72 ILE H . . 4.390 2.968 2.846 3.332 . 0 0 "[ . 1 . 2]" 1
1687 1 71 VAL MG2 1 72 ILE H . . 4.390 4.246 4.222 4.321 . 0 0 "[ . 1 . 2]" 1
1688 1 72 ILE H 1 72 ILE HB . . 3.320 2.518 2.506 2.541 . 0 0 "[ . 1 . 2]" 1
1689 1 72 ILE H 1 72 ILE MD . . 3.740 2.779 2.669 3.296 . 0 0 "[ . 1 . 2]" 1
1690 1 72 ILE H 1 72 ILE HG12 . . 4.090 3.868 3.621 3.928 . 0 0 "[ . 1 . 2]" 1
1691 1 72 ILE H 1 72 ILE QG . . 3.260 2.425 2.158 2.510 . 0 0 "[ . 1 . 2]" 1
1692 1 72 ILE H 1 72 ILE HG13 . . 4.090 2.451 2.175 2.540 . 0 0 "[ . 1 . 2]" 1
1693 1 72 ILE H 1 72 ILE MG . . 3.990 3.775 3.765 3.779 . 0 0 "[ . 1 . 2]" 1
1694 1 72 ILE H 1 73 ILE H . . 4.730 4.538 4.514 4.570 . 0 0 "[ . 1 . 2]" 1
1695 1 72 ILE H 1 100 VAL QG . . 4.060 4.052 3.942 4.068 0.008 16 0 "[ . 1 . 2]" 1
1696 1 72 ILE HA 1 72 ILE MD . . 4.030 3.820 3.798 3.884 . 0 0 "[ . 1 . 2]" 1
1697 1 72 ILE HA 1 72 ILE HG12 . . 4.200 3.055 2.715 3.133 . 0 0 "[ . 1 . 2]" 1
1698 1 72 ILE HA 1 72 ILE QG . . 3.690 2.407 2.388 2.457 . 0 0 "[ . 1 . 2]" 1
1699 1 72 ILE HA 1 72 ILE HG13 . . 4.200 2.526 2.485 2.806 . 0 0 "[ . 1 . 2]" 1
1700 1 72 ILE HA 1 72 ILE MG . . 3.140 2.303 2.274 2.347 . 0 0 "[ . 1 . 2]" 1
1701 1 72 ILE HA 1 73 ILE H . . 3.210 2.158 2.151 2.169 . 0 0 "[ . 1 . 2]" 1
1702 1 72 ILE HA 1 73 ILE HG12 . . 4.490 4.326 4.267 4.349 . 0 0 "[ . 1 . 2]" 1
1703 1 72 ILE HA 1 73 ILE HG13 . . 4.710 4.026 3.980 4.061 . 0 0 "[ . 1 . 2]" 1
1704 1 72 ILE HA 1 73 ILE MG . . 4.330 3.966 3.889 3.993 . 0 0 "[ . 1 . 2]" 1
1705 1 72 ILE HA 1 74 SER H . . 3.970 3.684 3.657 3.706 . 0 0 "[ . 1 . 2]" 1
1706 1 72 ILE HA 1 75 ILE HG13 . . 5.500 5.320 5.243 5.419 . 0 0 "[ . 1 . 2]" 1
1707 1 72 ILE HA 1 99 VAL HB . . 5.500 5.408 5.297 5.495 . 0 0 "[ . 1 . 2]" 1
1708 1 72 ILE HA 1 100 VAL HA . . 3.490 2.987 2.916 3.079 . 0 0 "[ . 1 . 2]" 1
1709 1 72 ILE HA 1 100 VAL HB . . 4.380 3.493 3.454 3.584 . 0 0 "[ . 1 . 2]" 1
1710 1 72 ILE HA 1 100 VAL QG . . 4.230 3.388 3.332 3.491 . 0 0 "[ . 1 . 2]" 1
1711 1 72 ILE HA 1 101 ARG H . . 4.800 4.731 4.656 4.803 0.003 11 0 "[ . 1 . 2]" 1
1712 1 72 ILE HB 1 72 ILE MD . . 2.500 2.125 2.038 2.333 . 0 0 "[ . 1 . 2]" 1
1713 1 72 ILE HB 1 73 ILE H . . 4.260 4.139 4.095 4.179 . 0 0 "[ . 1 . 2]" 1
1714 1 72 ILE HB 1 74 SER H . . 4.850 4.733 4.694 4.816 . 0 0 "[ . 1 . 2]" 1
1715 1 72 ILE HB 1 86 VAL QG . . 3.540 2.345 2.244 2.591 . 0 0 "[ . 1 . 2]" 1
1716 1 72 ILE MD 1 72 ILE MG . . 2.770 2.688 2.277 2.770 . 0 0 "[ . 1 . 2]" 1
1717 1 72 ILE MD 1 86 VAL HB . . 3.880 2.871 2.447 3.039 . 0 0 "[ . 1 . 2]" 1
1718 1 72 ILE MD 1 98 MET HB2 . . 5.500 4.823 4.491 5.001 . 0 0 "[ . 1 . 2]" 1
1719 1 72 ILE MD 1 98 MET HB3 . . 4.120 3.938 3.572 4.084 . 0 0 "[ . 1 . 2]" 1
1720 1 72 ILE QG 1 73 ILE H . . 4.910 4.138 4.111 4.174 . 0 0 "[ . 1 . 2]" 1
1721 1 72 ILE QG 1 98 MET HB2 . . 4.860 3.785 3.650 3.997 . 0 0 "[ . 1 . 2]" 1
1722 1 72 ILE MG 1 73 ILE H . . 3.380 2.318 2.223 2.384 . 0 0 "[ . 1 . 2]" 1
1723 1 72 ILE MG 1 74 SER H . . 3.350 2.175 2.090 2.244 . 0 0 "[ . 1 . 2]" 1
1724 1 72 ILE MG 1 74 SER HA . . 4.040 3.629 3.579 3.669 . 0 0 "[ . 1 . 2]" 1
1725 1 72 ILE MG 1 75 ILE HA . . 4.490 3.971 3.920 4.054 . 0 0 "[ . 1 . 2]" 1
1726 1 72 ILE MG 1 75 ILE HG13 . . 3.490 2.072 2.034 2.173 . 0 0 "[ . 1 . 2]" 1
1727 1 72 ILE MG 1 80 VAL H . . 5.040 4.222 4.090 4.371 . 0 0 "[ . 1 . 2]" 1
1728 1 72 ILE MG 1 86 VAL HA . . 5.000 4.474 4.321 4.594 . 0 0 "[ . 1 . 2]" 1
1729 1 72 ILE MG 1 86 VAL HB . . 4.320 3.632 3.440 3.737 . 0 0 "[ . 1 . 2]" 1
1730 1 72 ILE MG 1 98 MET HA . . 4.490 3.406 3.320 3.643 . 0 0 "[ . 1 . 2]" 1
1731 1 72 ILE MG 1 98 MET HB2 . . 4.170 3.966 3.831 4.134 . 0 0 "[ . 1 . 2]" 1
1732 1 72 ILE MG 1 98 MET HB3 . . 3.790 2.426 2.298 2.670 . 0 0 "[ . 1 . 2]" 1
1733 1 72 ILE MG 1 98 MET HG2 . . 4.740 3.793 3.615 4.046 . 0 0 "[ . 1 . 2]" 1
1734 1 72 ILE MG 1 98 MET HG3 . . 5.000 4.675 4.502 4.875 . 0 0 "[ . 1 . 2]" 1
1735 1 72 ILE MG 1 100 VAL HA . . 4.670 4.355 4.291 4.503 . 0 0 "[ . 1 . 2]" 1
1736 1 73 ILE H 1 73 ILE HB . . 3.920 3.684 3.677 3.696 . 0 0 "[ . 1 . 2]" 1
1737 1 73 ILE H 1 73 ILE MD . . 3.920 3.679 3.655 3.695 . 0 0 "[ . 1 . 2]" 1
1738 1 73 ILE H 1 73 ILE HG12 . . 3.590 2.701 2.665 2.740 . 0 0 "[ . 1 . 2]" 1
1739 1 73 ILE H 1 73 ILE HG13 . . 3.740 1.993 1.952 2.026 . 0 0 "[ . 1 . 2]" 1
1740 1 73 ILE H 1 73 ILE MG . . 3.640 2.928 2.867 2.982 . 0 0 "[ . 1 . 2]" 1
1741 1 73 ILE H 1 74 SER H . . 3.010 2.029 1.985 2.065 . 0 0 "[ . 1 . 2]" 1
1742 1 73 ILE H 1 74 SER HB2 . . 5.300 5.170 5.120 5.210 . 0 0 "[ . 1 . 2]" 1
1743 1 73 ILE H 1 74 SER HB3 . . 5.110 4.606 4.563 4.645 . 0 0 "[ . 1 . 2]" 1
1744 1 73 ILE H 1 99 VAL HB . . 4.170 4.066 3.954 4.154 . 0 0 "[ . 1 . 2]" 1
1745 1 73 ILE H 1 99 VAL MG1 . . 4.610 4.578 4.477 4.611 0.001 9 0 "[ . 1 . 2]" 1
1746 1 73 ILE H 1 100 VAL HA . . 3.800 3.428 3.371 3.491 . 0 0 "[ . 1 . 2]" 1
1747 1 73 ILE H 1 101 ARG H . . 5.220 5.058 4.992 5.113 . 0 0 "[ . 1 . 2]" 1
1748 1 73 ILE HA 1 73 ILE MD . . 4.210 4.037 4.020 4.054 . 0 0 "[ . 1 . 2]" 1
1749 1 73 ILE HA 1 73 ILE MG . . 3.060 2.153 2.138 2.218 . 0 0 "[ . 1 . 2]" 1
1750 1 73 ILE HA 1 80 VAL MG2 . . 4.330 3.140 2.973 3.351 . 0 0 "[ . 1 . 2]" 1
1751 1 73 ILE HB 1 73 ILE MD . . 3.140 2.035 2.002 2.050 . 0 0 "[ . 1 . 2]" 1
1752 1 73 ILE HB 1 74 SER H . . 4.170 3.870 3.857 3.881 . 0 0 "[ . 1 . 2]" 1
1753 1 73 ILE HB 1 74 SER HB3 . . 5.040 4.530 4.422 4.601 . 0 0 "[ . 1 . 2]" 1
1754 1 73 ILE HB 1 80 VAL MG2 . . 5.330 4.918 4.778 5.115 . 0 0 "[ . 1 . 2]" 1
1755 1 73 ILE MD 1 73 ILE MG . . 2.900 2.743 2.718 2.786 . 0 0 "[ . 1 . 2]" 1
1756 1 73 ILE MD 1 74 SER H . . 4.050 3.430 3.401 3.451 . 0 0 "[ . 1 . 2]" 1
1757 1 73 ILE MD 1 74 SER HA . . 5.500 4.563 4.503 4.637 . 0 0 "[ . 1 . 2]" 1
1758 1 73 ILE MD 1 74 SER HB2 . . 3.790 3.138 3.032 3.277 . 0 0 "[ . 1 . 2]" 1
1759 1 73 ILE MD 1 74 SER HB3 . . 3.640 2.618 2.586 2.672 . 0 0 "[ . 1 . 2]" 1
1760 1 73 ILE MD 1 99 VAL HB . . 3.210 2.847 2.740 2.911 . 0 0 "[ . 1 . 2]" 1
1761 1 73 ILE MD 1 100 VAL HA . . 5.500 4.712 4.649 4.776 . 0 0 "[ . 1 . 2]" 1
1762 1 73 ILE MD 1 101 ARG H . . 5.500 5.259 5.208 5.300 . 0 0 "[ . 1 . 2]" 1
1763 1 73 ILE MD 1 101 ARG HA . . 5.500 5.491 5.446 5.510 0.010 16 0 "[ . 1 . 2]" 1
1764 1 73 ILE MD 1 101 ARG QD . . 4.260 4.186 3.947 4.262 0.002 16 0 "[ . 1 . 2]" 1
1765 1 73 ILE MD 1 101 ARG HE . . 4.170 3.456 3.140 3.720 . 0 0 "[ . 1 . 2]" 1
1766 1 73 ILE MD 1 101 ARG HG2 . . 4.000 3.525 3.461 3.555 . 0 0 "[ . 1 . 2]" 1
1767 1 73 ILE MD 1 101 ARG QH2 . . 4.600 4.224 3.796 4.593 . 0 0 "[ . 1 . 2]" 1
1768 1 73 ILE HG12 1 74 SER H . . 4.060 3.736 3.688 3.771 . 0 0 "[ . 1 . 2]" 1
1769 1 73 ILE HG12 1 99 VAL HB . . 4.330 3.941 3.898 3.980 . 0 0 "[ . 1 . 2]" 1
1770 1 73 ILE HG12 1 100 VAL HA . . 4.330 3.535 3.465 3.589 . 0 0 "[ . 1 . 2]" 1
1771 1 73 ILE HG12 1 101 ARG H . . 5.040 4.222 4.189 4.253 . 0 0 "[ . 1 . 2]" 1
1772 1 73 ILE HG12 1 101 ARG HE . . 4.780 4.449 4.119 4.713 . 0 0 "[ . 1 . 2]" 1
1773 1 73 ILE HG12 1 101 ARG HG2 . . 4.710 3.134 3.063 3.219 . 0 0 "[ . 1 . 2]" 1
1774 1 73 ILE HG13 1 73 ILE MG . . 3.490 3.012 2.997 3.041 . 0 0 "[ . 1 . 2]" 1
1775 1 73 ILE HG13 1 74 SER H . . 3.740 2.096 2.065 2.120 . 0 0 "[ . 1 . 2]" 1
1776 1 73 ILE HG13 1 74 SER HA . . 5.490 4.454 4.423 4.497 . 0 0 "[ . 1 . 2]" 1
1777 1 73 ILE HG13 1 74 SER HB2 . . 4.710 3.948 3.876 4.054 . 0 0 "[ . 1 . 2]" 1
1778 1 73 ILE HG13 1 74 SER HB3 . . 4.490 3.236 3.198 3.285 . 0 0 "[ . 1 . 2]" 1
1779 1 73 ILE HG13 1 99 VAL HB . . 4.000 2.852 2.777 2.915 . 0 0 "[ . 1 . 2]" 1
1780 1 73 ILE HG13 1 100 VAL HA . . 5.500 4.108 4.083 4.133 . 0 0 "[ . 1 . 2]" 1
1781 1 73 ILE HG13 1 101 ARG H . . 5.500 5.497 5.481 5.506 0.006 12 0 "[ . 1 . 2]" 1
1782 1 73 ILE MG 1 74 SER H . . 4.760 4.121 4.108 4.135 . 0 0 "[ . 1 . 2]" 1
1783 1 73 ILE MG 1 74 SER HB2 . . 5.500 5.354 5.304 5.367 . 0 0 "[ . 1 . 2]" 1
1784 1 73 ILE MG 1 74 SER HB3 . . 5.500 5.411 5.377 5.445 . 0 0 "[ . 1 . 2]" 1
1785 1 73 ILE MG 1 99 VAL HB . . 5.300 5.272 5.225 5.303 0.003 5 0 "[ . 1 . 2]" 1
1786 1 73 ILE MG 1 100 VAL HA . . 4.200 3.958 3.918 4.164 . 0 0 "[ . 1 . 2]" 1
1787 1 73 ILE MG 1 101 ARG H . . 4.200 4.004 3.964 4.178 . 0 0 "[ . 1 . 2]" 1
1788 1 73 ILE MG 1 101 ARG HB2 . . 4.330 4.145 4.100 4.192 . 0 0 "[ . 1 . 2]" 1
1789 1 73 ILE MG 1 101 ARG HB3 . . 5.300 5.293 5.240 5.308 0.008 16 0 "[ . 1 . 2]" 1
1790 1 73 ILE MG 1 101 ARG HE . . 5.030 4.201 4.046 4.321 . 0 0 "[ . 1 . 2]" 1
1791 1 74 SER H 1 74 SER HB2 . . 4.200 3.516 3.486 3.554 . 0 0 "[ . 1 . 2]" 1
1792 1 74 SER H 1 74 SER HB3 . . 4.090 2.929 2.899 2.971 . 0 0 "[ . 1 . 2]" 1
1793 1 74 SER H 1 75 ILE H . . 4.370 4.346 4.325 4.354 . 0 0 "[ . 1 . 2]" 1
1794 1 74 SER H 1 80 VAL MG1 . . 4.600 4.529 4.472 4.600 0.000 6 0 "[ . 1 . 2]" 1
1795 1 74 SER H 1 98 MET HA . . 4.960 4.755 4.578 4.867 . 0 0 "[ . 1 . 2]" 1
1796 1 74 SER H 1 99 VAL H . . 3.280 3.230 3.128 3.283 0.003 12 0 "[ . 1 . 2]" 1
1797 1 74 SER H 1 99 VAL HB . . 3.740 3.294 3.151 3.404 . 0 0 "[ . 1 . 2]" 1
1798 1 74 SER H 1 99 VAL MG1 . . 5.210 4.528 4.428 4.622 . 0 0 "[ . 1 . 2]" 1
1799 1 74 SER H 1 99 VAL MG2 . . 4.600 4.301 4.177 4.379 . 0 0 "[ . 1 . 2]" 1
1800 1 74 SER HA 1 75 ILE H . . 2.860 2.326 2.301 2.356 . 0 0 "[ . 1 . 2]" 1
1801 1 74 SER HA 1 75 ILE HA . . 4.710 4.482 4.466 4.492 . 0 0 "[ . 1 . 2]" 1
1802 1 74 SER HA 1 75 ILE HB . . 4.710 4.485 4.477 4.499 . 0 0 "[ . 1 . 2]" 1
1803 1 74 SER HA 1 78 GLN H . . 4.640 4.310 4.248 4.364 . 0 0 "[ . 1 . 2]" 1
1804 1 74 SER HA 1 79 SER HA . . 3.410 2.068 1.999 2.322 . 0 0 "[ . 1 . 2]" 1
1805 1 74 SER HA 1 79 SER HB2 . . 5.500 5.024 4.887 5.304 . 0 0 "[ . 1 . 2]" 1
1806 1 74 SER HA 1 79 SER HB3 . . 5.500 4.562 4.319 5.023 . 0 0 "[ . 1 . 2]" 1
1807 1 74 SER HA 1 80 VAL H . . 3.450 2.372 2.265 2.415 . 0 0 "[ . 1 . 2]" 1
1808 1 74 SER HA 1 80 VAL MG1 . . 3.190 2.850 2.717 2.936 . 0 0 "[ . 1 . 2]" 1
1809 1 74 SER HA 1 80 VAL MG2 . . 4.330 3.132 3.000 3.229 . 0 0 "[ . 1 . 2]" 1
1810 1 74 SER HA 1 99 VAL HB . . 5.500 5.133 4.993 5.240 . 0 0 "[ . 1 . 2]" 1
1811 1 74 SER HB2 1 75 ILE H . . 4.110 3.797 3.737 3.869 . 0 0 "[ . 1 . 2]" 1
1812 1 74 SER HB2 1 78 GLN H . . 5.140 4.692 4.626 4.738 . 0 0 "[ . 1 . 2]" 1
1813 1 74 SER HB2 1 78 GLN HA . . 5.500 5.175 5.077 5.233 . 0 0 "[ . 1 . 2]" 1
1814 1 74 SER HB2 1 79 SER HA . . 3.790 2.282 2.219 2.353 . 0 0 "[ . 1 . 2]" 1
1815 1 74 SER HB2 1 80 VAL H . . 4.560 3.850 3.732 3.895 . 0 0 "[ . 1 . 2]" 1
1816 1 74 SER HB2 1 99 VAL HB . . 4.750 4.450 4.291 4.588 . 0 0 "[ . 1 . 2]" 1
1817 1 74 SER HB2 1 99 VAL MG2 . . 5.140 4.656 4.544 4.786 . 0 0 "[ . 1 . 2]" 1
1818 1 74 SER HB3 1 75 ILE H . . 3.850 3.841 3.800 3.852 0.002 15 0 "[ . 1 . 2]" 1
1819 1 74 SER HB3 1 75 ILE HA . . 4.710 4.702 4.675 4.711 0.001 17 0 "[ . 1 . 2]" 1
1820 1 74 SER HB3 1 78 GLN H . . 5.030 4.808 4.617 4.864 . 0 0 "[ . 1 . 2]" 1
1821 1 74 SER HB3 1 79 SER HA . . 3.920 3.845 3.777 3.920 0.000 10 0 "[ . 1 . 2]" 1
1822 1 74 SER HB3 1 80 VAL H . . 5.030 5.027 4.993 5.033 0.003 8 0 "[ . 1 . 2]" 1
1823 1 74 SER HB3 1 99 VAL H . . 4.640 4.364 4.156 4.495 . 0 0 "[ . 1 . 2]" 1
1824 1 74 SER HB3 1 99 VAL HB . . 3.560 2.783 2.628 2.918 . 0 0 "[ . 1 . 2]" 1
1825 1 74 SER HB3 1 99 VAL MG1 . . 4.710 3.922 3.767 4.026 . 0 0 "[ . 1 . 2]" 1
1826 1 74 SER HB3 1 99 VAL MG2 . . 3.640 3.169 3.061 3.281 . 0 0 "[ . 1 . 2]" 1
1827 1 75 ILE H 1 75 ILE HB . . 3.560 2.891 2.852 2.898 . 0 0 "[ . 1 . 2]" 1
1828 1 75 ILE H 1 75 ILE MD . . 4.710 4.363 4.326 4.378 . 0 0 "[ . 1 . 2]" 1
1829 1 75 ILE H 1 75 ILE HG12 . . 4.640 4.137 4.111 4.145 . 0 0 "[ . 1 . 2]" 1
1830 1 75 ILE H 1 75 ILE HG13 . . 4.100 3.172 3.129 3.191 . 0 0 "[ . 1 . 2]" 1
1831 1 75 ILE H 1 75 ILE MG . . 4.000 3.930 3.918 3.933 . 0 0 "[ . 1 . 2]" 1
1832 1 75 ILE H 1 76 ASN H . . 4.730 4.156 4.145 4.203 . 0 0 "[ . 1 . 2]" 1
1833 1 75 ILE H 1 78 GLN H . . 3.380 2.493 2.466 2.538 . 0 0 "[ . 1 . 2]" 1
1834 1 75 ILE H 1 78 GLN HB2 . . 4.370 3.960 3.897 3.994 . 0 0 "[ . 1 . 2]" 1
1835 1 75 ILE H 1 78 GLN HB3 . . 4.490 3.876 3.751 3.911 . 0 0 "[ . 1 . 2]" 1
1836 1 75 ILE H 1 79 SER HA . . 3.940 3.656 3.592 3.861 . 0 0 "[ . 1 . 2]" 1
1837 1 75 ILE H 1 80 VAL H . . 4.260 4.241 4.034 4.262 0.002 4 0 "[ . 1 . 2]" 1
1838 1 75 ILE H 1 80 VAL MG1 . . 3.310 3.008 2.898 3.138 . 0 0 "[ . 1 . 2]" 1
1839 1 75 ILE H 1 80 VAL MG2 . . 4.490 4.219 4.116 4.339 . 0 0 "[ . 1 . 2]" 1
1840 1 75 ILE HA 1 75 ILE MD . . 3.850 3.812 3.809 3.815 . 0 0 "[ . 1 . 2]" 1
1841 1 75 ILE HA 1 75 ILE HG12 . . 4.200 2.506 2.499 2.510 . 0 0 "[ . 1 . 2]" 1
1842 1 75 ILE HA 1 75 ILE HG13 . . 4.090 3.056 3.052 3.059 . 0 0 "[ . 1 . 2]" 1
1843 1 75 ILE HA 1 75 ILE MG . . 3.060 2.393 2.347 2.397 . 0 0 "[ . 1 . 2]" 1
1844 1 75 ILE HA 1 76 ASN H . . 2.840 2.148 2.146 2.151 . 0 0 "[ . 1 . 2]" 1
1845 1 75 ILE HA 1 98 MET H . . 4.930 4.379 4.187 4.459 . 0 0 "[ . 1 . 2]" 1
1846 1 75 ILE HA 1 98 MET HA . . 3.790 2.127 2.043 2.229 . 0 0 "[ . 1 . 2]" 1
1847 1 75 ILE HA 1 98 MET HG2 . . 4.600 3.699 3.393 3.892 . 0 0 "[ . 1 . 2]" 1
1848 1 75 ILE HA 1 99 VAL H . . 4.070 3.705 3.582 3.841 . 0 0 "[ . 1 . 2]" 1
1849 1 75 ILE HB 1 75 ILE MD . . 3.080 2.412 2.381 2.444 . 0 0 "[ . 1 . 2]" 1
1850 1 75 ILE HB 1 76 ASN H . . 4.490 4.202 4.181 4.210 . 0 0 "[ . 1 . 2]" 1
1851 1 75 ILE HB 1 78 GLN HB3 . . 5.000 4.715 4.680 4.731 . 0 0 "[ . 1 . 2]" 1
1852 1 75 ILE HB 1 80 VAL MG2 . . 4.350 4.211 4.128 4.315 . 0 0 "[ . 1 . 2]" 1
1853 1 75 ILE HB 1 89 VAL MG2 . . 3.560 2.724 2.535 2.874 . 0 0 "[ . 1 . 2]" 1
1854 1 75 ILE MD 1 75 ILE MG . . 2.530 1.969 1.908 2.035 . 0 0 "[ . 1 . 2]" 1
1855 1 75 ILE MD 1 76 ASN H . . 5.350 5.088 5.064 5.103 . 0 0 "[ . 1 . 2]" 1
1856 1 75 ILE MD 1 86 VAL H . . 5.040 4.070 4.045 4.153 . 0 0 "[ . 1 . 2]" 1
1857 1 75 ILE MD 1 86 VAL HA . . 3.430 1.969 1.964 1.982 . 0 0 "[ . 1 . 2]" 1
1858 1 75 ILE MD 1 86 VAL HB . . 3.590 1.984 1.906 2.003 . 0 0 "[ . 1 . 2]" 1
1859 1 75 ILE MD 1 87 SER H . . 5.260 4.710 4.623 4.731 . 0 0 "[ . 1 . 2]" 1
1860 1 75 ILE MD 1 88 ASP H . . 5.500 5.355 5.279 5.405 . 0 0 "[ . 1 . 2]" 1
1861 1 75 ILE MD 1 89 VAL H . . 5.040 4.552 4.386 4.648 . 0 0 "[ . 1 . 2]" 1
1862 1 75 ILE MD 1 89 VAL HB . . 3.710 3.429 3.357 3.627 . 0 0 "[ . 1 . 2]" 1
1863 1 75 ILE MD 1 98 MET HA . . 4.490 3.785 3.604 3.948 . 0 0 "[ . 1 . 2]" 1
1864 1 75 ILE MD 1 98 MET HB2 . . 5.100 4.547 4.365 4.685 . 0 0 "[ . 1 . 2]" 1
1865 1 75 ILE MD 1 98 MET ME . . 2.870 2.832 2.588 2.875 0.005 2 0 "[ . 1 . 2]" 1
1866 1 75 ILE MD 1 98 MET HG2 . . 3.970 2.640 2.455 2.882 . 0 0 "[ . 1 . 2]" 1
1867 1 75 ILE MD 1 98 MET HG3 . . 4.200 3.922 3.771 4.108 . 0 0 "[ . 1 . 2]" 1
1868 1 75 ILE MD 1 99 VAL H . . 5.000 4.649 4.444 4.813 . 0 0 "[ . 1 . 2]" 1
1869 1 75 ILE HG12 1 76 ASN H . . 4.390 4.382 4.361 4.392 0.002 9 0 "[ . 1 . 2]" 1
1870 1 75 ILE HG12 1 98 MET HA . . 4.710 2.181 2.001 2.316 . 0 0 "[ . 1 . 2]" 1
1871 1 75 ILE HG12 1 98 MET HB2 . . 4.480 3.977 3.874 4.114 . 0 0 "[ . 1 . 2]" 1
1872 1 75 ILE HG12 1 98 MET HG2 . . 3.550 2.456 2.233 2.647 . 0 0 "[ . 1 . 2]" 1
1873 1 75 ILE HG12 1 98 MET HG3 . . 4.680 3.999 3.806 4.162 . 0 0 "[ . 1 . 2]" 1
1874 1 75 ILE HG12 1 99 VAL H . . 4.310 3.382 3.150 3.584 . 0 0 "[ . 1 . 2]" 1
1875 1 75 ILE HG13 1 75 ILE MG . . 3.380 3.202 3.186 3.204 . 0 0 "[ . 1 . 2]" 1
1876 1 75 ILE HG13 1 76 ASN H . . 5.330 5.083 5.074 5.087 . 0 0 "[ . 1 . 2]" 1
1877 1 75 ILE HG13 1 86 VAL QG . . 4.460 2.976 2.750 3.047 . 0 0 "[ . 1 . 2]" 1
1878 1 75 ILE HG13 1 98 MET HA . . 4.710 3.577 3.477 3.693 . 0 0 "[ . 1 . 2]" 1
1879 1 75 ILE MG 1 76 ASN H . . 3.440 2.674 2.407 2.706 . 0 0 "[ . 1 . 2]" 1
1880 1 75 ILE MG 1 76 ASN HB2 . . 4.330 2.262 2.237 2.554 . 0 0 "[ . 1 . 2]" 1
1881 1 75 ILE MG 1 76 ASN QB . . 3.640 2.246 2.221 2.525 . 0 0 "[ . 1 . 2]" 1
1882 1 75 ILE MG 1 76 ASN HB3 . . 4.330 3.800 3.755 3.974 . 0 0 "[ . 1 . 2]" 1
1883 1 75 ILE MG 1 76 ASN HD21 . . 4.200 3.029 2.894 3.354 . 0 0 "[ . 1 . 2]" 1
1884 1 75 ILE MG 1 76 ASN HD22 . . 4.600 4.436 4.311 4.562 . 0 0 "[ . 1 . 2]" 1
1885 1 75 ILE MG 1 77 GLY H . . 4.730 4.490 4.428 4.515 . 0 0 "[ . 1 . 2]" 1
1886 1 75 ILE MG 1 78 GLN H . . 5.040 4.676 4.655 4.727 . 0 0 "[ . 1 . 2]" 1
1887 1 75 ILE MG 1 78 GLN HB2 . . 5.000 4.997 4.969 5.001 0.001 9 0 "[ . 1 . 2]" 1
1888 1 75 ILE MG 1 78 GLN HB3 . . 5.500 5.497 5.475 5.501 0.001 9 0 "[ . 1 . 2]" 1
1889 1 75 ILE MG 1 89 VAL H . . 4.650 4.653 4.650 4.657 0.007 6 0 "[ . 1 . 2]" 1
1890 1 75 ILE MG 1 89 VAL HA . . 5.050 4.789 4.681 4.895 . 0 0 "[ . 1 . 2]" 1
1891 1 75 ILE MG 1 89 VAL HB . . 3.560 2.615 2.515 2.743 . 0 0 "[ . 1 . 2]" 1
1892 1 75 ILE MG 1 89 VAL MG1 . . 2.810 2.027 1.915 2.300 . 0 0 "[ . 1 . 2]" 1
1893 1 75 ILE MG 1 89 VAL MG2 . . 2.940 2.617 2.501 2.690 . 0 0 "[ . 1 . 2]" 1
1894 1 75 ILE MG 1 93 GLU QG . . 5.340 4.690 4.565 4.898 . 0 0 "[ . 1 . 2]" 1
1895 1 75 ILE MG 1 96 LEU H . . 5.500 5.442 5.272 5.500 0.000 4 0 "[ . 1 . 2]" 1
1896 1 75 ILE MG 1 96 LEU HA . . 3.530 3.187 3.013 3.256 . 0 0 "[ . 1 . 2]" 1
1897 1 75 ILE MG 1 97 ASN H . . 3.610 3.077 2.935 3.269 . 0 0 "[ . 1 . 2]" 1
1898 1 75 ILE MG 1 97 ASN HA . . 4.600 4.486 4.360 4.577 . 0 0 "[ . 1 . 2]" 1
1899 1 75 ILE MG 1 97 ASN QB . . 5.340 3.887 3.729 4.063 . 0 0 "[ . 1 . 2]" 1
1900 1 75 ILE MG 1 98 MET H . . 4.220 3.537 3.393 3.711 . 0 0 "[ . 1 . 2]" 1
1901 1 75 ILE MG 1 98 MET HA . . 3.920 2.810 2.588 3.163 . 0 0 "[ . 1 . 2]" 1
1902 1 75 ILE MG 1 98 MET HB3 . . 4.650 3.900 3.793 4.000 . 0 0 "[ . 1 . 2]" 1
1903 1 75 ILE MG 1 98 MET ME . . 3.790 3.337 2.921 3.506 . 0 0 "[ . 1 . 2]" 1
1904 1 75 ILE MG 1 98 MET HG2 . . 3.350 2.071 1.961 2.195 . 0 0 "[ . 1 . 2]" 1
1905 1 75 ILE MG 1 98 MET HG3 . . 4.200 3.505 3.374 3.693 . 0 0 "[ . 1 . 2]" 1
1906 1 75 ILE MG 1 99 VAL H . . 5.500 4.758 4.572 4.983 . 0 0 "[ . 1 . 2]" 1
1907 1 76 ASN H 1 77 GLY H . . 3.700 2.616 2.613 2.628 . 0 0 "[ . 1 . 2]" 1
1908 1 76 ASN H 1 78 GLN H . . 4.970 4.074 4.064 4.109 . 0 0 "[ . 1 . 2]" 1
1909 1 76 ASN H 1 89 VAL MG1 . . 5.040 4.469 4.392 4.637 . 0 0 "[ . 1 . 2]" 1
1910 1 76 ASN H 1 97 ASN H . . 3.920 3.286 2.929 3.508 . 0 0 "[ . 1 . 2]" 1
1911 1 76 ASN H 1 97 ASN HB2 . . 4.560 2.602 2.397 2.943 . 0 0 "[ . 1 . 2]" 1
1912 1 76 ASN H 1 97 ASN QB . . 3.780 2.514 2.358 2.789 . 0 0 "[ . 1 . 2]" 1
1913 1 76 ASN H 1 97 ASN HB3 . . 4.560 3.362 3.183 3.569 . 0 0 "[ . 1 . 2]" 1
1914 1 76 ASN H 1 98 MET HA . . 4.030 3.482 3.364 3.646 . 0 0 "[ . 1 . 2]" 1
1915 1 76 ASN H 1 98 MET HG2 . . 5.140 4.618 4.372 4.785 . 0 0 "[ . 1 . 2]" 1
1916 1 76 ASN H 1 99 VAL H . . 5.500 5.337 5.201 5.502 0.002 6 0 "[ . 1 . 2]" 1
1917 1 76 ASN H 1 99 VAL MG2 . . 4.710 4.114 3.944 4.360 . 0 0 "[ . 1 . 2]" 1
1918 1 76 ASN HA 1 76 ASN HD21 . . 4.340 3.766 3.503 4.021 . 0 0 "[ . 1 . 2]" 1
1919 1 76 ASN HA 1 76 ASN HD22 . . 4.740 4.082 3.935 4.227 . 0 0 "[ . 1 . 2]" 1
1920 1 76 ASN HA 1 77 GLY H . . 3.290 2.973 2.957 2.979 . 0 0 "[ . 1 . 2]" 1
1921 1 76 ASN HA 1 77 GLY HA2 . . 5.190 4.810 4.805 4.818 . 0 0 "[ . 1 . 2]" 1
1922 1 76 ASN HA 1 77 GLY QA . . 4.530 4.060 4.057 4.063 . 0 0 "[ . 1 . 2]" 1
1923 1 76 ASN HA 1 77 GLY HA3 . . 5.190 4.375 4.370 4.376 . 0 0 "[ . 1 . 2]" 1
1924 1 76 ASN HA 1 97 ASN HA . . 5.500 4.962 4.784 5.068 . 0 0 "[ . 1 . 2]" 1
1925 1 76 ASN HA 1 97 ASN HB2 . . 4.090 2.064 2.000 2.273 . 0 0 "[ . 1 . 2]" 1
1926 1 76 ASN HA 1 97 ASN QB . . 3.530 2.048 1.985 2.245 . 0 0 "[ . 1 . 2]" 1
1927 1 76 ASN HA 1 97 ASN HB3 . . 4.090 3.438 3.282 3.678 . 0 0 "[ . 1 . 2]" 1
1928 1 76 ASN HA 1 97 ASN HD21 . . 4.520 3.591 2.794 4.336 . 0 0 "[ . 1 . 2]" 1
1929 1 76 ASN HA 1 97 ASN HD22 . . 5.450 4.913 4.356 5.318 . 0 0 "[ . 1 . 2]" 1
1930 1 76 ASN QB 1 76 ASN HD22 . . 3.510 3.231 3.217 3.252 . 0 0 "[ . 1 . 2]" 1
1931 1 76 ASN QB 1 77 GLY H . . 4.060 3.746 3.741 3.759 . 0 0 "[ . 1 . 2]" 1
1932 1 76 ASN QB 1 78 GLN H . . 5.200 3.845 3.818 3.919 . 0 0 "[ . 1 . 2]" 1
1933 1 76 ASN QB 1 89 VAL MG1 . . 3.860 2.283 2.135 2.543 . 0 0 "[ . 1 . 2]" 1
1934 1 76 ASN QB 1 89 VAL MG2 . . 4.870 3.265 3.072 3.405 . 0 0 "[ . 1 . 2]" 1
1935 1 76 ASN HB2 1 76 ASN HD22 . . 4.000 3.436 3.433 3.448 . 0 0 "[ . 1 . 2]" 1
1936 1 76 ASN HB2 1 77 GLY H . . 4.640 4.299 4.279 4.334 . 0 0 "[ . 1 . 2]" 1
1937 1 76 ASN HB2 1 89 VAL MG1 . . 4.490 2.315 2.162 2.590 . 0 0 "[ . 1 . 2]" 1
1938 1 76 ASN HB3 1 76 ASN HD22 . . 4.000 3.931 3.850 3.996 . 0 0 "[ . 1 . 2]" 1
1939 1 76 ASN HB3 1 77 GLY H . . 4.640 4.123 4.111 4.134 . 0 0 "[ . 1 . 2]" 1
1940 1 76 ASN HB3 1 89 VAL MG1 . . 4.490 3.489 3.296 3.703 . 0 0 "[ . 1 . 2]" 1
1941 1 76 ASN HD21 1 89 VAL HB . . 5.050 4.622 4.440 4.843 . 0 0 "[ . 1 . 2]" 1
1942 1 76 ASN HD21 1 89 VAL MG1 . . 4.330 2.111 1.998 2.281 . 0 0 "[ . 1 . 2]" 1
1943 1 76 ASN HD21 1 89 VAL MG2 . . 4.710 4.046 3.908 4.212 . 0 0 "[ . 1 . 2]" 1
1944 1 76 ASN HD21 1 93 GLU HB2 . . 4.200 2.961 2.404 3.435 . 0 0 "[ . 1 . 2]" 1
1945 1 76 ASN HD21 1 93 GLU HB3 . . 4.530 3.883 3.453 4.397 . 0 0 "[ . 1 . 2]" 1
1946 1 76 ASN HD21 1 93 GLU HG2 . . 4.710 3.987 3.558 4.637 . 0 0 "[ . 1 . 2]" 1
1947 1 76 ASN HD21 1 93 GLU QG . . 3.890 2.826 2.490 3.470 . 0 0 "[ . 1 . 2]" 1
1948 1 76 ASN HD21 1 93 GLU HG3 . . 4.710 2.892 2.528 3.583 . 0 0 "[ . 1 . 2]" 1
1949 1 76 ASN HD21 1 96 LEU HA . . 4.490 3.141 2.640 3.434 . 0 0 "[ . 1 . 2]" 1
1950 1 76 ASN HD21 1 96 LEU QD . . 4.280 3.411 2.956 3.677 . 0 0 "[ . 1 . 2]" 1
1951 1 76 ASN HD21 1 97 ASN H . . 4.370 3.168 2.691 3.652 . 0 0 "[ . 1 . 2]" 1
1952 1 76 ASN HD22 1 89 VAL MG1 . . 4.200 3.302 3.190 3.461 . 0 0 "[ . 1 . 2]" 1
1953 1 76 ASN HD22 1 89 VAL MG2 . . 5.500 5.391 5.225 5.494 . 0 0 "[ . 1 . 2]" 1
1954 1 76 ASN HD22 1 93 GLU HB2 . . 4.710 2.740 2.325 3.133 . 0 0 "[ . 1 . 2]" 1
1955 1 76 ASN HD22 1 93 GLU HB3 . . 4.330 2.886 2.558 3.358 . 0 0 "[ . 1 . 2]" 1
1956 1 76 ASN HD22 1 93 GLU QG . . 4.140 2.782 2.561 3.241 . 0 0 "[ . 1 . 2]" 1
1957 1 76 ASN HD22 1 95 THR H . . 4.560 4.050 3.827 4.369 . 0 0 "[ . 1 . 2]" 1
1958 1 76 ASN HD22 1 95 THR HB . . 5.040 3.526 3.355 3.634 . 0 0 "[ . 1 . 2]" 1
1959 1 76 ASN HD22 1 95 THR MG . . 4.970 4.855 4.689 4.966 . 0 0 "[ . 1 . 2]" 1
1960 1 76 ASN HD22 1 96 LEU HA . . 4.980 3.736 3.283 4.032 . 0 0 "[ . 1 . 2]" 1
1961 1 76 ASN HD22 1 96 LEU QD . . 4.550 4.148 3.642 4.525 . 0 0 "[ . 1 . 2]" 1
1962 1 76 ASN HD22 1 97 ASN H . . 4.000 3.578 3.208 3.847 . 0 0 "[ . 1 . 2]" 1
1963 1 77 GLY H 1 78 GLN H . . 3.340 2.385 2.373 2.412 . 0 0 "[ . 1 . 2]" 1
1964 1 77 GLY H 1 78 GLN HB2 . . 5.120 4.555 4.517 4.573 . 0 0 "[ . 1 . 2]" 1
1965 1 77 GLY HA2 1 78 GLN HA . . 5.460 4.428 4.422 4.430 . 0 0 "[ . 1 . 2]" 1
1966 1 77 GLY HA3 1 78 GLN HA . . 5.460 4.564 4.563 4.565 . 0 0 "[ . 1 . 2]" 1
1967 1 78 GLN H 1 78 GLN HB2 . . 3.100 2.590 2.582 2.601 . 0 0 "[ . 1 . 2]" 1
1968 1 78 GLN H 1 78 GLN HB3 . . 3.530 3.421 3.393 3.446 . 0 0 "[ . 1 . 2]" 1
1969 1 78 GLN H 1 80 VAL MG1 . . 5.470 4.718 4.688 4.813 . 0 0 "[ . 1 . 2]" 1
1970 1 78 GLN HA 1 78 GLN QG . . 3.290 2.132 2.001 2.466 . 0 0 "[ . 1 . 2]" 1
1971 1 78 GLN HA 1 79 SER H . . 3.040 2.139 2.138 2.144 . 0 0 "[ . 1 . 2]" 1
1972 1 78 GLN HA 1 79 SER QB . . 4.500 4.222 4.045 4.465 . 0 0 "[ . 1 . 2]" 1
1973 1 78 GLN HB2 1 79 SER H . . 4.580 4.536 4.493 4.551 . 0 0 "[ . 1 . 2]" 1
1974 1 78 GLN HB2 1 89 VAL MG2 . . 4.710 4.280 4.013 4.492 . 0 0 "[ . 1 . 2]" 1
1975 1 78 GLN HB3 1 78 GLN QG . . 2.630 2.314 2.129 2.524 . 0 0 "[ . 1 . 2]" 1
1976 1 78 GLN HB3 1 79 SER H . . 4.220 3.713 3.633 3.745 . 0 0 "[ . 1 . 2]" 1
1977 1 78 GLN HB3 1 79 SER QB . . 5.340 5.193 5.119 5.263 . 0 0 "[ . 1 . 2]" 1
1978 1 78 GLN HB3 1 89 VAL MG2 . . 5.000 4.378 4.131 4.626 . 0 0 "[ . 1 . 2]" 1
1979 1 78 GLN QG 1 79 SER H . . 4.390 3.653 3.305 4.172 . 0 0 "[ . 1 . 2]" 1
1980 1 78 GLN QG 1 89 VAL MG2 . . 5.260 5.010 4.822 5.244 . 0 0 "[ . 1 . 2]" 1
1981 1 79 SER H 1 79 SER QB . . 3.210 2.240 2.060 2.509 . 0 0 "[ . 1 . 2]" 1
1982 1 79 SER H 1 80 VAL H . . 4.730 4.560 4.500 4.573 . 0 0 "[ . 1 . 2]" 1
1983 1 79 SER HA 1 80 VAL H . . 2.880 2.160 2.140 2.167 . 0 0 "[ . 1 . 2]" 1
1984 1 79 SER HA 1 80 VAL MG1 . . 3.920 3.674 3.616 3.742 . 0 0 "[ . 1 . 2]" 1
1985 1 79 SER HA 1 80 VAL MG2 . . 4.090 3.938 3.925 3.946 . 0 0 "[ . 1 . 2]" 1
1986 1 79 SER QB 1 80 VAL H . . 3.730 3.217 3.094 3.428 . 0 0 "[ . 1 . 2]" 1
1987 1 79 SER QB 1 81 VAL MG1 . . 4.020 3.792 3.689 3.878 . 0 0 "[ . 1 . 2]" 1
1988 1 79 SER HB2 1 80 VAL MG1 . . 5.500 5.346 5.198 5.468 . 0 0 "[ . 1 . 2]" 1
1989 1 79 SER HB3 1 80 VAL MG1 . . 5.500 5.027 4.979 5.168 . 0 0 "[ . 1 . 2]" 1
1990 1 80 VAL H 1 80 VAL HB . . 3.830 3.757 3.703 3.767 . 0 0 "[ . 1 . 2]" 1
1991 1 80 VAL H 1 80 VAL MG1 . . 3.190 2.708 2.562 2.758 . 0 0 "[ . 1 . 2]" 1
1992 1 80 VAL H 1 80 VAL MG2 . . 3.760 2.173 2.139 2.177 . 0 0 "[ . 1 . 2]" 1
1993 1 80 VAL H 1 81 VAL H . . 4.730 4.523 4.515 4.564 . 0 0 "[ . 1 . 2]" 1
1994 1 80 VAL H 1 81 VAL MG1 . . 4.910 4.377 4.228 4.495 . 0 0 "[ . 1 . 2]" 1
1995 1 80 VAL HA 1 80 VAL MG1 . . 3.160 2.310 2.306 2.325 . 0 0 "[ . 1 . 2]" 1
1996 1 80 VAL HA 1 80 VAL MG2 . . 3.320 3.184 3.183 3.185 . 0 0 "[ . 1 . 2]" 1
1997 1 80 VAL HA 1 81 VAL H . . 3.010 2.336 2.319 2.411 . 0 0 "[ . 1 . 2]" 1
1998 1 80 VAL HA 1 81 VAL MG1 . . 3.930 3.785 3.692 3.882 . 0 0 "[ . 1 . 2]" 1
1999 1 80 VAL HA 1 81 VAL MG2 . . 3.740 3.474 3.295 3.521 . 0 0 "[ . 1 . 2]" 1
2000 1 80 VAL HA 1 82 SER H . . 4.330 4.035 4.012 4.127 . 0 0 "[ . 1 . 2]" 1
2001 1 80 VAL HA 1 85 ASP QB . . 4.240 3.537 3.263 3.613 . 0 0 "[ . 1 . 2]" 1
2002 1 80 VAL HA 1 86 VAL QG . . 5.060 4.445 4.369 4.533 . 0 0 "[ . 1 . 2]" 1
2003 1 80 VAL HB 1 81 VAL H . . 4.330 2.564 2.389 2.608 . 0 0 "[ . 1 . 2]" 1
2004 1 80 VAL HB 1 82 SER H . . 4.430 2.727 2.672 2.742 . 0 0 "[ . 1 . 2]" 1
2005 1 80 VAL HB 1 85 ASP HB2 . . 4.200 2.925 2.499 2.987 . 0 0 "[ . 1 . 2]" 1
2006 1 80 VAL HB 1 85 ASP HB3 . . 4.200 2.771 2.386 2.846 . 0 0 "[ . 1 . 2]" 1
2007 1 80 VAL HB 1 86 VAL H . . 4.730 3.668 3.607 3.799 . 0 0 "[ . 1 . 2]" 1
2008 1 80 VAL HB 1 86 VAL QG . . 3.820 2.601 2.519 2.785 . 0 0 "[ . 1 . 2]" 1
2009 1 80 VAL MG1 1 81 VAL H . . 4.260 3.816 3.759 3.833 . 0 0 "[ . 1 . 2]" 1
2010 1 80 VAL MG1 1 82 SER H . . 4.370 4.335 4.282 4.351 . 0 0 "[ . 1 . 2]" 1
2011 1 80 VAL MG1 1 85 ASP HB2 . . 4.200 3.699 3.345 3.764 . 0 0 "[ . 1 . 2]" 1
2012 1 80 VAL MG1 1 85 ASP QB . . 3.500 2.610 2.195 2.706 . 0 0 "[ . 1 . 2]" 1
2013 1 80 VAL MG1 1 85 ASP HB3 . . 4.200 2.668 2.226 2.774 . 0 0 "[ . 1 . 2]" 1
2014 1 80 VAL MG1 1 86 VAL QG . . 2.800 2.113 1.962 2.340 . 0 0 "[ . 1 . 2]" 1
2015 1 80 VAL MG2 1 81 VAL H . . 3.790 3.476 3.325 3.511 . 0 0 "[ . 1 . 2]" 1
2016 1 80 VAL MG2 1 82 SER H . . 3.640 3.094 2.840 3.148 . 0 0 "[ . 1 . 2]" 1
2017 1 80 VAL MG2 1 83 ALA HA . . 4.860 4.633 4.603 4.647 . 0 0 "[ . 1 . 2]" 1
2018 1 80 VAL MG2 1 83 ALA MB . . 5.500 5.503 5.501 5.506 0.006 6 0 "[ . 1 . 2]" 1
2019 1 80 VAL MG2 1 85 ASP HB2 . . 4.290 4.250 3.887 4.291 0.001 14 0 "[ . 1 . 2]" 1
2020 1 80 VAL MG2 1 85 ASP HB3 . . 4.290 4.232 3.867 4.292 0.002 8 0 "[ . 1 . 2]" 1
2021 1 80 VAL MG2 1 86 VAL H . . 4.330 3.956 3.809 4.049 . 0 0 "[ . 1 . 2]" 1
2022 1 80 VAL MG2 1 86 VAL HA . . 4.090 4.021 3.956 4.092 0.002 10 0 "[ . 1 . 2]" 1
2023 1 80 VAL MG2 1 86 VAL QG . . 2.830 1.883 1.856 1.905 . 0 0 "[ . 1 . 2]" 1
2024 1 81 VAL H 1 81 VAL HB . . 3.820 3.824 3.821 3.830 0.010 15 0 "[ . 1 . 2]" 1
2025 1 81 VAL H 1 81 VAL MG1 . . 3.740 3.268 3.216 3.316 . 0 0 "[ . 1 . 2]" 1
2026 1 81 VAL H 1 81 VAL MG2 . . 3.170 2.175 2.069 2.271 . 0 0 "[ . 1 . 2]" 1
2027 1 81 VAL H 1 82 SER H . . 3.000 2.154 2.127 2.169 . 0 0 "[ . 1 . 2]" 1
2028 1 81 VAL H 1 85 ASP HB2 . . 4.220 3.337 3.044 3.404 . 0 0 "[ . 1 . 2]" 1
2029 1 81 VAL H 1 85 ASP HB3 . . 4.220 3.888 3.695 3.954 . 0 0 "[ . 1 . 2]" 1
2030 1 81 VAL HA 1 81 VAL MG1 . . 3.140 2.191 2.122 2.312 . 0 0 "[ . 1 . 2]" 1
2031 1 81 VAL HA 1 81 VAL MG2 . . 3.190 3.184 3.178 3.191 0.001 2 0 "[ . 1 . 2]" 1
2032 1 81 VAL HA 1 82 SER H . . 3.550 2.994 2.988 3.000 . 0 0 "[ . 1 . 2]" 1
2033 1 81 VAL HB 1 82 SER H . . 4.410 4.371 4.368 4.373 . 0 0 "[ . 1 . 2]" 1
2034 1 81 VAL MG1 1 82 SER H . . 4.460 4.376 4.355 4.386 . 0 0 "[ . 1 . 2]" 1
2035 1 81 VAL MG2 1 82 SER H . . 3.610 3.403 3.357 3.530 . 0 0 "[ . 1 . 2]" 1
2036 1 81 VAL MG2 1 82 SER QB . . 3.560 3.052 2.867 3.511 . 0 0 "[ . 1 . 2]" 1
2037 1 81 VAL MG2 1 85 ASP HB2 . . 5.000 4.281 4.075 4.429 . 0 0 "[ . 1 . 2]" 1
2038 1 81 VAL MG2 1 85 ASP QB . . 4.370 4.035 3.869 4.148 . 0 0 "[ . 1 . 2]" 1
2039 1 81 VAL MG2 1 85 ASP HB3 . . 5.000 4.934 4.791 5.002 0.002 15 0 "[ . 1 . 2]" 1
2040 1 82 SER H 1 82 SER HB2 . . 4.060 3.264 2.916 4.045 . 0 0 "[ . 1 . 2]" 1
2041 1 82 SER H 1 82 SER HB3 . . 4.060 3.429 2.921 3.910 . 0 0 "[ . 1 . 2]" 1
2042 1 82 SER H 1 85 ASP H . . 4.030 4.027 3.993 4.032 0.002 6 0 "[ . 1 . 2]" 1
2043 1 82 SER H 1 85 ASP QB . . 3.530 2.921 2.889 2.954 . 0 0 "[ . 1 . 2]" 1
2044 1 82 SER H 1 86 VAL H . . 4.840 4.318 4.286 4.377 . 0 0 "[ . 1 . 2]" 1
2045 1 82 SER QB 1 83 ALA H . . 3.680 3.339 3.011 3.650 . 0 0 "[ . 1 . 2]" 1
2046 1 82 SER QB 1 83 ALA MB . . 4.910 4.499 4.197 4.837 . 0 0 "[ . 1 . 2]" 1
2047 1 82 SER QB 1 84 ASN QB . . 4.100 3.133 2.675 3.950 . 0 0 "[ . 1 . 2]" 1
2048 1 82 SER QB 1 85 ASP H . . 4.140 2.693 2.361 3.520 . 0 0 "[ . 1 . 2]" 1
2049 1 82 SER QB 1 85 ASP QB . . 5.180 2.819 2.535 3.547 . 0 0 "[ . 1 . 2]" 1
2050 1 82 SER HB2 1 83 ALA H . . 4.430 4.119 3.136 4.386 . 0 0 "[ . 1 . 2]" 1
2051 1 82 SER HB3 1 83 ALA H . . 4.430 3.663 3.085 4.343 . 0 0 "[ . 1 . 2]" 1
2052 1 83 ALA H 1 83 ALA MB . . 3.460 2.151 2.116 2.170 . 0 0 "[ . 1 . 2]" 1
2053 1 83 ALA HA 1 84 ASN HA . . 4.860 4.730 4.713 4.743 . 0 0 "[ . 1 . 2]" 1
2054 1 83 ALA HA 1 85 ASP H . . 4.730 3.992 3.962 4.239 . 0 0 "[ . 1 . 2]" 1
2055 1 83 ALA HA 1 86 VAL H . . 4.060 3.475 3.461 3.516 . 0 0 "[ . 1 . 2]" 1
2056 1 83 ALA HA 1 86 VAL HB . . 5.000 4.798 4.735 4.828 . 0 0 "[ . 1 . 2]" 1
2057 1 83 ALA HA 1 86 VAL MG1 . . 3.750 3.108 3.011 3.266 . 0 0 "[ . 1 . 2]" 1
2058 1 83 ALA HA 1 86 VAL MG2 . . 3.750 1.956 1.938 1.971 . 0 0 "[ . 1 . 2]" 1
2059 1 83 ALA MB 1 84 ASN HA . . 4.490 3.908 3.897 3.919 . 0 0 "[ . 1 . 2]" 1
2060 1 83 ALA MB 1 86 VAL H . . 4.730 4.728 4.700 4.735 0.005 6 0 "[ . 1 . 2]" 1
2061 1 83 ALA MB 1 86 VAL MG1 . . 4.460 4.359 4.292 4.434 . 0 0 "[ . 1 . 2]" 1
2062 1 83 ALA MB 1 86 VAL QG . . 3.730 3.050 3.028 3.069 . 0 0 "[ . 1 . 2]" 1
2063 1 83 ALA MB 1 86 VAL MG2 . . 4.460 3.114 3.083 3.133 . 0 0 "[ . 1 . 2]" 1
2064 1 84 ASN HA 1 86 VAL H . . 5.040 4.547 4.420 4.603 . 0 0 "[ . 1 . 2]" 1
2065 1 84 ASN HA 1 87 SER H . . 3.740 3.586 3.416 3.638 . 0 0 "[ . 1 . 2]" 1
2066 1 84 ASN HA 1 87 SER QB . . 4.020 3.221 2.789 3.541 . 0 0 "[ . 1 . 2]" 1
2067 1 84 ASN QB 1 85 ASP H . . 3.440 2.985 2.907 3.452 0.012 6 0 "[ . 1 . 2]" 1
2068 1 84 ASN QB 1 87 SER H . . 5.340 4.969 4.854 5.087 . 0 0 "[ . 1 . 2]" 1
2069 1 84 ASN HB2 1 85 ASP H . . 3.940 3.460 3.042 3.934 . 0 0 "[ . 1 . 2]" 1
2070 1 84 ASN HB3 1 85 ASP H . . 3.940 3.374 2.996 3.822 . 0 0 "[ . 1 . 2]" 1
2071 1 85 ASP H 1 85 ASP HB2 . . 4.000 2.140 2.121 2.147 . 0 0 "[ . 1 . 2]" 1
2072 1 85 ASP H 1 85 ASP QB . . 3.270 2.120 2.101 2.126 . 0 0 "[ . 1 . 2]" 1
2073 1 85 ASP H 1 85 ASP HB3 . . 4.000 3.432 3.396 3.440 . 0 0 "[ . 1 . 2]" 1
2074 1 85 ASP H 1 86 VAL H . . 3.390 2.510 2.465 2.639 . 0 0 "[ . 1 . 2]" 1
2075 1 85 ASP H 1 86 VAL MG1 . . 4.560 4.103 4.007 4.238 . 0 0 "[ . 1 . 2]" 1
2076 1 85 ASP H 1 86 VAL MG2 . . 4.560 3.618 3.503 3.773 . 0 0 "[ . 1 . 2]" 1
2077 1 85 ASP H 1 87 SER H . . 4.310 3.805 3.787 3.888 . 0 0 "[ . 1 . 2]" 1
2078 1 85 ASP HA 1 86 VAL HA . . 5.040 4.787 4.753 4.799 . 0 0 "[ . 1 . 2]" 1
2079 1 85 ASP HA 1 86 VAL MG1 . . 5.050 5.043 5.000 5.053 0.003 16 0 "[ . 1 . 2]" 1
2080 1 85 ASP HA 1 86 VAL MG2 . . 5.050 4.955 4.892 5.001 . 0 0 "[ . 1 . 2]" 1
2081 1 85 ASP HA 1 87 SER H . . 4.390 3.972 3.925 4.124 . 0 0 "[ . 1 . 2]" 1
2082 1 85 ASP HA 1 88 ASP QB . . 3.610 2.658 2.465 2.804 . 0 0 "[ . 1 . 2]" 1
2083 1 85 ASP HA 1 89 VAL MG2 . . 5.310 4.809 4.598 5.025 . 0 0 "[ . 1 . 2]" 1
2084 1 85 ASP QB 1 86 VAL H . . 3.370 2.658 2.630 2.732 . 0 0 "[ . 1 . 2]" 1
2085 1 85 ASP QB 1 86 VAL HA . . 4.330 3.794 3.770 3.828 . 0 0 "[ . 1 . 2]" 1
2086 1 85 ASP QB 1 86 VAL QG . . 3.900 3.178 3.134 3.215 . 0 0 "[ . 1 . 2]" 1
2087 1 85 ASP HB2 1 86 VAL H . . 3.870 2.868 2.839 2.948 . 0 0 "[ . 1 . 2]" 1
2088 1 85 ASP HB2 1 86 VAL HA . . 5.040 4.828 4.812 4.894 . 0 0 "[ . 1 . 2]" 1
2089 1 85 ASP HB3 1 86 VAL H . . 3.870 3.143 3.041 3.251 . 0 0 "[ . 1 . 2]" 1
2090 1 85 ASP HB3 1 86 VAL HA . . 5.040 3.968 3.920 4.012 . 0 0 "[ . 1 . 2]" 1
2091 1 86 VAL H 1 86 VAL HB . . 3.820 3.615 3.613 3.621 . 0 0 "[ . 1 . 2]" 1
2092 1 86 VAL H 1 86 VAL MG1 . . 3.500 2.305 2.200 2.418 . 0 0 "[ . 1 . 2]" 1
2093 1 86 VAL H 1 86 VAL QG . . 2.880 1.934 1.857 1.964 . 0 0 "[ . 1 . 2]" 1
2094 1 86 VAL H 1 86 VAL MG2 . . 3.500 2.081 2.002 2.105 . 0 0 "[ . 1 . 2]" 1
2095 1 86 VAL H 1 87 SER H . . 3.160 2.608 2.538 2.634 . 0 0 "[ . 1 . 2]" 1
2096 1 86 VAL H 1 87 SER HA . . 5.300 5.218 5.162 5.250 . 0 0 "[ . 1 . 2]" 1
2097 1 86 VAL H 1 87 SER QB . . 4.910 4.588 4.339 4.769 . 0 0 "[ . 1 . 2]" 1
2098 1 86 VAL H 1 88 ASP H . . 5.180 4.080 4.010 4.102 . 0 0 "[ . 1 . 2]" 1
2099 1 86 VAL HA 1 86 VAL MG1 . . 3.320 2.262 2.237 2.332 . 0 0 "[ . 1 . 2]" 1
2100 1 86 VAL HA 1 86 VAL QG . . 2.770 2.219 2.197 2.279 . 0 0 "[ . 1 . 2]" 1
2101 1 86 VAL HA 1 86 VAL MG2 . . 3.320 3.202 3.200 3.203 . 0 0 "[ . 1 . 2]" 1
2102 1 86 VAL HA 1 87 SER HA . . 5.500 4.707 4.693 4.720 . 0 0 "[ . 1 . 2]" 1
2103 1 86 VAL HA 1 88 ASP H . . 4.970 4.042 3.990 4.110 . 0 0 "[ . 1 . 2]" 1
2104 1 86 VAL HA 1 89 VAL H . . 3.920 3.710 3.577 3.818 . 0 0 "[ . 1 . 2]" 1
2105 1 86 VAL HA 1 89 VAL HB . . 4.210 3.810 3.669 4.078 . 0 0 "[ . 1 . 2]" 1
2106 1 86 VAL HA 1 89 VAL MG2 . . 3.560 2.844 2.531 2.989 . 0 0 "[ . 1 . 2]" 1
2107 1 86 VAL HA 1 98 MET ME . . 5.390 5.043 4.758 5.234 . 0 0 "[ . 1 . 2]" 1
2108 1 86 VAL HB 1 87 SER H . . 4.010 3.958 3.861 3.977 . 0 0 "[ . 1 . 2]" 1
2109 1 86 VAL HB 1 87 SER HA . . 4.710 4.530 4.458 4.544 . 0 0 "[ . 1 . 2]" 1
2110 1 86 VAL HB 1 87 SER QB . . 5.340 5.123 5.051 5.342 0.002 15 0 "[ . 1 . 2]" 1
2111 1 86 VAL QG 1 87 SER H . . 3.480 2.293 2.223 2.307 . 0 0 "[ . 1 . 2]" 1
2112 1 86 VAL QG 1 87 SER QB . . 3.410 2.948 2.889 3.256 . 0 0 "[ . 1 . 2]" 1
2113 1 86 VAL QG 1 88 ASP H . . 4.990 4.091 4.059 4.107 . 0 0 "[ . 1 . 2]" 1
2114 1 86 VAL MG1 1 87 SER H . . 4.250 4.022 3.991 4.041 . 0 0 "[ . 1 . 2]" 1
2115 1 86 VAL MG2 1 87 SER H . . 4.250 2.306 2.233 2.321 . 0 0 "[ . 1 . 2]" 1
2116 1 87 SER H 1 87 SER QB . . 3.200 2.404 2.135 2.632 . 0 0 "[ . 1 . 2]" 1
2117 1 87 SER H 1 88 ASP QB . . 4.850 4.105 4.019 4.254 . 0 0 "[ . 1 . 2]" 1
2118 1 87 SER H 1 89 VAL H . . 4.970 4.279 4.154 4.411 . 0 0 "[ . 1 . 2]" 1
2119 1 87 SER H 1 90 ILE MD . . 4.540 4.407 4.375 4.442 . 0 0 "[ . 1 . 2]" 1
2120 1 87 SER H 1 90 ILE HG13 . . 5.280 4.638 4.619 4.719 . 0 0 "[ . 1 . 2]" 1
2121 1 87 SER HA 1 88 ASP H . . 3.550 3.453 3.441 3.461 . 0 0 "[ . 1 . 2]" 1
2122 1 87 SER HA 1 88 ASP QB . . 5.340 5.201 5.149 5.282 . 0 0 "[ . 1 . 2]" 1
2123 1 87 SER HA 1 89 VAL H . . 4.840 4.355 4.078 4.571 . 0 0 "[ . 1 . 2]" 1
2124 1 87 SER HA 1 90 ILE H . . 4.370 3.495 3.361 3.585 . 0 0 "[ . 1 . 2]" 1
2125 1 87 SER HA 1 90 ILE HB . . 3.920 3.609 3.561 3.663 . 0 0 "[ . 1 . 2]" 1
2126 1 87 SER HA 1 90 ILE MD . . 3.540 2.015 1.965 2.087 . 0 0 "[ . 1 . 2]" 1
2127 1 87 SER QB 1 88 ASP H . . 4.260 3.527 2.976 3.615 . 0 0 "[ . 1 . 2]" 1
2128 1 87 SER QB 1 90 ILE HB . . 4.400 4.278 4.086 4.376 . 0 0 "[ . 1 . 2]" 1
2129 1 87 SER QB 1 90 ILE MD . . 3.230 2.750 2.582 3.043 . 0 0 "[ . 1 . 2]" 1
2130 1 87 SER QB 1 90 ILE HG12 . . 5.340 5.206 5.000 5.344 0.004 16 0 "[ . 1 . 2]" 1
2131 1 87 SER HB2 1 88 ASP H . . 4.950 4.040 3.176 4.292 . 0 0 "[ . 1 . 2]" 1
2132 1 87 SER HB3 1 88 ASP H . . 4.950 3.909 3.546 4.102 . 0 0 "[ . 1 . 2]" 1
2133 1 88 ASP H 1 88 ASP HB2 . . 3.510 2.121 2.070 2.221 . 0 0 "[ . 1 . 2]" 1
2134 1 88 ASP H 1 88 ASP QB . . 2.970 2.099 2.049 2.198 . 0 0 "[ . 1 . 2]" 1
2135 1 88 ASP H 1 88 ASP HB3 . . 3.510 3.356 3.115 3.518 0.008 17 0 "[ . 1 . 2]" 1
2136 1 88 ASP H 1 89 VAL H . . 3.220 2.637 2.521 2.710 . 0 0 "[ . 1 . 2]" 1
2137 1 88 ASP H 1 89 VAL MG2 . . 4.320 4.020 3.856 4.094 . 0 0 "[ . 1 . 2]" 1
2138 1 88 ASP H 1 90 ILE MD . . 5.500 4.814 4.785 4.852 . 0 0 "[ . 1 . 2]" 1
2139 1 88 ASP HA 1 89 VAL HA . . 5.370 4.821 4.781 4.853 . 0 0 "[ . 1 . 2]" 1
2140 1 88 ASP HA 1 89 VAL MG2 . . 5.500 4.912 4.840 4.946 . 0 0 "[ . 1 . 2]" 1
2141 1 88 ASP HA 1 90 ILE H . . 4.730 3.896 3.846 4.006 . 0 0 "[ . 1 . 2]" 1
2142 1 88 ASP HA 1 90 ILE HB . . 4.740 4.639 4.550 4.749 0.009 6 0 "[ . 1 . 2]" 1
2143 1 88 ASP HA 1 90 ILE MD . . 5.300 5.294 5.241 5.305 0.005 6 0 "[ . 1 . 2]" 1
2144 1 88 ASP HA 1 91 LYS H . . 4.100 3.573 3.496 3.696 . 0 0 "[ . 1 . 2]" 1
2145 1 88 ASP HA 1 91 LYS QD . . 3.670 2.708 1.962 3.674 0.004 17 0 "[ . 1 . 2]" 1
2146 1 88 ASP HA 1 91 LYS HG2 . . 4.460 3.097 2.622 3.416 . 0 0 "[ . 1 . 2]" 1
2147 1 88 ASP HA 1 91 LYS HG3 . . 4.460 3.862 2.750 4.459 . 0 0 "[ . 1 . 2]" 1
2148 1 88 ASP QB 1 89 VAL H . . 3.280 2.655 2.554 2.802 . 0 0 "[ . 1 . 2]" 1
2149 1 88 ASP QB 1 89 VAL HA . . 4.410 3.769 3.691 3.888 . 0 0 "[ . 1 . 2]" 1
2150 1 88 ASP QB 1 91 LYS QD . . 4.520 4.152 3.732 4.525 0.005 6 0 "[ . 1 . 2]" 1
2151 1 88 ASP QB 1 91 LYS QG . . 4.540 4.190 3.868 4.449 . 0 0 "[ . 1 . 2]" 1
2152 1 88 ASP QB 1 92 ARG QB . . 4.490 3.436 3.288 3.611 . 0 0 "[ . 1 . 2]" 1
2153 1 88 ASP QB 1 92 ARG QG . . 5.180 4.893 4.575 5.081 . 0 0 "[ . 1 . 2]" 1
2154 1 88 ASP HB2 1 89 VAL H . . 3.740 2.994 2.703 3.367 . 0 0 "[ . 1 . 2]" 1
2155 1 88 ASP HB2 1 89 VAL MG2 . . 4.200 3.753 3.440 4.135 . 0 0 "[ . 1 . 2]" 1
2156 1 88 ASP HB3 1 89 VAL H . . 3.740 3.036 2.758 3.497 . 0 0 "[ . 1 . 2]" 1
2157 1 88 ASP HB3 1 89 VAL MG2 . . 4.200 3.484 3.185 3.922 . 0 0 "[ . 1 . 2]" 1
2158 1 89 VAL H 1 89 VAL HB . . 3.150 2.616 2.583 2.679 . 0 0 "[ . 1 . 2]" 1
2159 1 89 VAL H 1 89 VAL MG1 . . 3.790 3.763 3.758 3.768 . 0 0 "[ . 1 . 2]" 1
2160 1 89 VAL H 1 89 VAL MG2 . . 3.010 2.094 1.919 2.185 . 0 0 "[ . 1 . 2]" 1
2161 1 89 VAL H 1 90 ILE H . . 3.450 2.675 2.567 2.765 . 0 0 "[ . 1 . 2]" 1
2162 1 89 VAL H 1 90 ILE HB . . 5.350 5.076 5.002 5.138 . 0 0 "[ . 1 . 2]" 1
2163 1 89 VAL H 1 90 ILE HG13 . . 4.370 3.921 3.733 4.059 . 0 0 "[ . 1 . 2]" 1
2164 1 89 VAL H 1 91 LYS H . . 4.850 4.533 4.485 4.633 . 0 0 "[ . 1 . 2]" 1
2165 1 89 VAL H 1 92 ARG H . . 4.800 4.588 4.555 4.604 . 0 0 "[ . 1 . 2]" 1
2166 1 89 VAL H 1 92 ARG QB . . 4.480 4.093 3.939 4.159 . 0 0 "[ . 1 . 2]" 1
2167 1 89 VAL HA 1 89 VAL MG1 . . 3.160 2.297 2.243 2.369 . 0 0 "[ . 1 . 2]" 1
2168 1 89 VAL HA 1 89 VAL MG2 . . 2.950 2.397 2.386 2.445 . 0 0 "[ . 1 . 2]" 1
2169 1 89 VAL HA 1 91 LYS H . . 4.560 4.336 4.314 4.377 . 0 0 "[ . 1 . 2]" 1
2170 1 89 VAL HA 1 92 ARG H . . 3.700 3.129 3.084 3.189 . 0 0 "[ . 1 . 2]" 1
2171 1 89 VAL HA 1 92 ARG HA . . 5.500 4.776 4.645 4.850 . 0 0 "[ . 1 . 2]" 1
2172 1 89 VAL HA 1 92 ARG QB . . 3.410 1.991 1.954 2.073 . 0 0 "[ . 1 . 2]" 1
2173 1 89 VAL HA 1 92 ARG QD . . 4.390 4.134 3.678 4.362 . 0 0 "[ . 1 . 2]" 1
2174 1 89 VAL HA 1 92 ARG QG . . 3.730 3.619 3.559 3.699 . 0 0 "[ . 1 . 2]" 1
2175 1 89 VAL HA 1 93 GLU H . . 4.370 2.954 2.869 2.996 . 0 0 "[ . 1 . 2]" 1
2176 1 89 VAL HA 1 93 GLU HG2 . . 4.490 3.229 3.134 3.412 . 0 0 "[ . 1 . 2]" 1
2177 1 89 VAL HA 1 93 GLU HG3 . . 4.490 4.485 4.349 4.496 0.006 14 0 "[ . 1 . 2]" 1
2178 1 89 VAL HB 1 90 ILE H . . 3.640 2.973 2.856 3.050 . 0 0 "[ . 1 . 2]" 1
2179 1 89 VAL HB 1 90 ILE HA . . 4.350 4.228 4.135 4.275 . 0 0 "[ . 1 . 2]" 1
2180 1 89 VAL HB 1 90 ILE HG13 . . 4.280 3.755 3.721 3.828 . 0 0 "[ . 1 . 2]" 1
2181 1 89 VAL HB 1 92 ARG H . . 5.500 5.307 5.221 5.369 . 0 0 "[ . 1 . 2]" 1
2182 1 89 VAL HB 1 96 LEU QD . . 3.400 2.821 2.597 2.960 . 0 0 "[ . 1 . 2]" 1
2183 1 89 VAL HB 1 98 MET ME . . 4.760 4.539 4.261 4.696 . 0 0 "[ . 1 . 2]" 1
2184 1 89 VAL MG1 1 90 ILE H . . 4.030 3.796 3.752 3.892 . 0 0 "[ . 1 . 2]" 1
2185 1 89 VAL MG1 1 90 ILE HA . . 3.870 3.771 3.735 3.866 . 0 0 "[ . 1 . 2]" 1
2186 1 89 VAL MG1 1 90 ILE HG13 . . 5.030 4.689 4.604 4.841 . 0 0 "[ . 1 . 2]" 1
2187 1 89 VAL MG1 1 91 LYS H . . 5.450 5.137 5.095 5.232 . 0 0 "[ . 1 . 2]" 1
2188 1 89 VAL MG1 1 92 ARG H . . 4.560 4.372 4.282 4.471 . 0 0 "[ . 1 . 2]" 1
2189 1 89 VAL MG1 1 92 ARG QB . . 3.850 3.160 3.059 3.240 . 0 0 "[ . 1 . 2]" 1
2190 1 89 VAL MG1 1 93 GLU H . . 4.180 2.968 2.867 3.067 . 0 0 "[ . 1 . 2]" 1
2191 1 89 VAL MG1 1 93 GLU HB2 . . 3.090 2.561 2.466 2.639 . 0 0 "[ . 1 . 2]" 1
2192 1 89 VAL MG1 1 93 GLU HG2 . . 3.380 2.422 2.341 2.613 . 0 0 "[ . 1 . 2]" 1
2193 1 89 VAL MG1 1 93 GLU QG . . 2.950 2.246 2.171 2.362 . 0 0 "[ . 1 . 2]" 1
2194 1 89 VAL MG1 1 93 GLU HG3 . . 3.380 2.662 2.552 2.721 . 0 0 "[ . 1 . 2]" 1
2195 1 89 VAL MG1 1 96 LEU HA . . 4.200 3.054 2.823 3.147 . 0 0 "[ . 1 . 2]" 1
2196 1 89 VAL MG1 1 96 LEU QD . . 2.880 1.984 1.871 2.131 . 0 0 "[ . 1 . 2]" 1
2197 1 89 VAL MG1 1 97 ASN H . . 4.370 3.944 3.768 4.111 . 0 0 "[ . 1 . 2]" 1
2198 1 89 VAL MG1 1 98 MET ME . . 5.300 4.567 4.438 4.723 . 0 0 "[ . 1 . 2]" 1
2199 1 89 VAL MG2 1 90 ILE H . . 4.310 3.910 3.825 3.955 . 0 0 "[ . 1 . 2]" 1
2200 1 89 VAL MG2 1 90 ILE HG13 . . 5.360 4.811 4.716 4.866 . 0 0 "[ . 1 . 2]" 1
2201 1 89 VAL MG2 1 91 LYS H . . 5.500 5.513 5.503 5.532 0.032 14 0 "[ . 1 . 2]" 1
2202 1 89 VAL MG2 1 92 ARG H . . 5.300 4.944 4.908 4.989 . 0 0 "[ . 1 . 2]" 1
2203 1 89 VAL MG2 1 92 ARG QB . . 3.980 3.610 3.533 3.666 . 0 0 "[ . 1 . 2]" 1
2204 1 89 VAL MG2 1 92 ARG QD . . 5.160 4.607 4.074 4.932 . 0 0 "[ . 1 . 2]" 1
2205 1 89 VAL MG2 1 93 GLU H . . 4.710 4.701 4.609 4.720 0.010 6 0 "[ . 1 . 2]" 1
2206 1 89 VAL MG2 1 93 GLU HB2 . . 5.040 4.958 4.877 5.020 . 0 0 "[ . 1 . 2]" 1
2207 1 89 VAL MG2 1 93 GLU HG2 . . 4.410 4.114 4.015 4.245 . 0 0 "[ . 1 . 2]" 1
2208 1 89 VAL MG2 1 93 GLU QG . . 3.830 3.774 3.725 3.831 0.001 2 0 "[ . 1 . 2]" 1
2209 1 89 VAL MG2 1 93 GLU HG3 . . 4.410 4.390 4.352 4.417 0.007 9 0 "[ . 1 . 2]" 1
2210 1 89 VAL MG2 1 96 LEU QD . . 4.340 3.861 3.678 3.957 . 0 0 "[ . 1 . 2]" 1
2211 1 89 VAL MG2 1 98 MET ME . . 5.500 5.180 4.826 5.353 . 0 0 "[ . 1 . 2]" 1
2212 1 90 ILE H 1 90 ILE HB . . 3.230 2.625 2.606 2.636 . 0 0 "[ . 1 . 2]" 1
2213 1 90 ILE H 1 90 ILE MD . . 3.750 3.559 3.532 3.571 . 0 0 "[ . 1 . 2]" 1
2214 1 90 ILE H 1 90 ILE HG12 . . 3.740 3.152 3.116 3.190 . 0 0 "[ . 1 . 2]" 1
2215 1 90 ILE H 1 90 ILE HG13 . . 3.270 1.963 1.946 1.994 . 0 0 "[ . 1 . 2]" 1
2216 1 90 ILE H 1 90 ILE MG . . 3.920 3.764 3.762 3.766 . 0 0 "[ . 1 . 2]" 1
2217 1 90 ILE H 1 91 LYS H . . 3.370 2.718 2.665 2.870 . 0 0 "[ . 1 . 2]" 1
2218 1 90 ILE H 1 91 LYS QG . . 5.340 4.307 3.886 4.595 . 0 0 "[ . 1 . 2]" 1
2219 1 90 ILE H 1 92 ARG H . . 4.970 3.695 3.645 3.786 . 0 0 "[ . 1 . 2]" 1
2220 1 90 ILE H 1 96 LEU QD . . 3.820 3.100 2.929 3.186 . 0 0 "[ . 1 . 2]" 1
2221 1 90 ILE HA 1 90 ILE MD . . 3.970 3.831 3.818 3.849 . 0 0 "[ . 1 . 2]" 1
2222 1 90 ILE HA 1 90 ILE HG12 . . 3.140 2.557 2.524 2.592 . 0 0 "[ . 1 . 2]" 1
2223 1 90 ILE HA 1 90 ILE HG13 . . 3.350 3.130 3.104 3.152 . 0 0 "[ . 1 . 2]" 1
2224 1 90 ILE HA 1 90 ILE MG . . 2.820 2.341 2.334 2.344 . 0 0 "[ . 1 . 2]" 1
2225 1 90 ILE HA 1 92 ARG H . . 4.640 4.378 4.286 4.506 . 0 0 "[ . 1 . 2]" 1
2226 1 90 ILE HA 1 93 GLU H . . 4.600 4.421 4.324 4.519 . 0 0 "[ . 1 . 2]" 1
2227 1 90 ILE HA 1 96 LEU MD1 . . 3.790 2.590 2.194 2.732 . 0 0 "[ . 1 . 2]" 1
2228 1 90 ILE HA 1 96 LEU QD . . 3.110 1.861 1.794 1.893 . 0 0 "[ . 1 . 2]" 1
2229 1 90 ILE HA 1 96 LEU MD2 . . 3.790 1.911 1.894 1.936 . 0 0 "[ . 1 . 2]" 1
2230 1 90 ILE HA 1 98 MET ME . . 5.500 4.798 4.697 4.915 . 0 0 "[ . 1 . 2]" 1
2231 1 90 ILE HA 1 113 PRO HB3 . . 4.170 4.121 4.042 4.174 0.004 9 0 "[ . 1 . 2]" 1
2232 1 90 ILE HA 1 113 PRO HG2 . . 4.710 3.742 3.691 3.834 . 0 0 "[ . 1 . 2]" 1
2233 1 90 ILE HA 1 113 PRO HG3 . . 4.090 2.547 2.431 2.601 . 0 0 "[ . 1 . 2]" 1
2234 1 90 ILE HB 1 90 ILE MD . . 3.240 2.452 2.388 2.462 . 0 0 "[ . 1 . 2]" 1
2235 1 90 ILE HB 1 91 LYS H . . 3.350 2.511 2.421 2.550 . 0 0 "[ . 1 . 2]" 1
2236 1 90 ILE MD 1 91 LYS H . . 4.710 4.496 4.436 4.531 . 0 0 "[ . 1 . 2]" 1
2237 1 90 ILE HG13 1 91 LYS H . . 5.120 4.045 3.995 4.081 . 0 0 "[ . 1 . 2]" 1
2238 1 90 ILE HG13 1 96 LEU QD . . 4.060 2.915 2.753 3.023 . 0 0 "[ . 1 . 2]" 1
2239 1 90 ILE MG 1 91 LYS H . . 3.610 3.541 3.422 3.596 . 0 0 "[ . 1 . 2]" 1
2240 1 90 ILE MG 1 91 LYS HA . . 3.790 3.730 3.668 3.768 . 0 0 "[ . 1 . 2]" 1
2241 1 90 ILE MG 1 113 PRO HA . . 4.330 3.891 3.862 3.947 . 0 0 "[ . 1 . 2]" 1
2242 1 90 ILE MG 1 113 PRO HB2 . . 3.920 2.129 2.082 2.228 . 0 0 "[ . 1 . 2]" 1
2243 1 90 ILE MG 1 113 PRO HB3 . . 3.130 2.081 2.046 2.122 . 0 0 "[ . 1 . 2]" 1
2244 1 90 ILE MG 1 113 PRO HG2 . . 3.560 2.949 2.850 3.007 . 0 0 "[ . 1 . 2]" 1
2245 1 90 ILE MG 1 113 PRO HG3 . . 3.250 2.303 2.118 2.391 . 0 0 "[ . 1 . 2]" 1
2246 1 91 LYS H 1 91 LYS HB3 . . 3.020 2.721 2.610 2.864 . 0 0 "[ . 1 . 2]" 1
2247 1 91 LYS H 1 91 LYS HD2 . . 5.000 3.518 1.953 4.599 . 0 0 "[ . 1 . 2]" 1
2248 1 91 LYS H 1 91 LYS QD . . 4.240 3.227 1.937 4.103 . 0 0 "[ . 1 . 2]" 1
2249 1 91 LYS H 1 91 LYS HD3 . . 5.000 3.945 2.940 4.646 . 0 0 "[ . 1 . 2]" 1
2250 1 91 LYS H 1 91 LYS HE2 . . 5.500 4.952 3.771 5.382 . 0 0 "[ . 1 . 2]" 1
2251 1 91 LYS H 1 91 LYS HE3 . . 5.500 4.840 3.985 5.454 . 0 0 "[ . 1 . 2]" 1
2252 1 91 LYS H 1 91 LYS HG2 . . 3.940 2.475 2.220 3.292 . 0 0 "[ . 1 . 2]" 1
2253 1 91 LYS H 1 91 LYS QG . . 3.260 2.270 1.921 2.451 . 0 0 "[ . 1 . 2]" 1
2254 1 91 LYS H 1 91 LYS HG3 . . 3.940 3.232 1.948 3.893 . 0 0 "[ . 1 . 2]" 1
2255 1 91 LYS H 1 92 ARG H . . 3.310 2.233 2.225 2.252 . 0 0 "[ . 1 . 2]" 1
2256 1 91 LYS H 1 93 GLU H . . 4.700 4.414 4.392 4.437 . 0 0 "[ . 1 . 2]" 1
2257 1 91 LYS H 1 96 LEU QD . . 5.370 4.389 4.257 4.438 . 0 0 "[ . 1 . 2]" 1
2258 1 91 LYS HA 1 91 LYS QD . . 4.240 4.152 3.644 4.249 0.009 17 0 "[ . 1 . 2]" 1
2259 1 91 LYS HA 1 91 LYS HG2 . . 4.250 3.742 3.565 4.218 . 0 0 "[ . 1 . 2]" 1
2260 1 91 LYS HA 1 91 LYS QG . . 3.480 3.345 3.330 3.428 . 0 0 "[ . 1 . 2]" 1
2261 1 91 LYS HA 1 91 LYS HG3 . . 4.250 3.847 3.566 4.184 . 0 0 "[ . 1 . 2]" 1
2262 1 91 LYS HB2 1 91 LYS QE . . 4.230 2.925 2.575 3.685 . 0 0 "[ . 1 . 2]" 1
2263 1 91 LYS QD 1 92 ARG H . . 4.190 3.869 2.917 4.143 . 0 0 "[ . 1 . 2]" 1
2264 1 91 LYS HD2 1 92 ARG H . . 4.940 4.347 3.170 4.942 0.002 3 0 "[ . 1 . 2]" 1
2265 1 91 LYS HD3 1 92 ARG H . . 4.940 4.375 3.409 4.714 . 0 0 "[ . 1 . 2]" 1
2266 1 91 LYS QG 1 92 ARG H . . 4.460 2.280 2.177 2.461 . 0 0 "[ . 1 . 2]" 1
2267 1 92 ARG H 1 92 ARG HB2 . . 3.400 2.447 2.273 2.549 . 0 0 "[ . 1 . 2]" 1
2268 1 92 ARG H 1 92 ARG QB . . 2.780 2.252 2.183 2.278 . 0 0 "[ . 1 . 2]" 1
2269 1 92 ARG H 1 92 ARG HB3 . . 3.400 2.650 2.543 2.820 . 0 0 "[ . 1 . 2]" 1
2270 1 92 ARG H 1 92 ARG HD2 . . 5.500 4.540 4.094 5.139 . 0 0 "[ . 1 . 2]" 1
2271 1 92 ARG H 1 92 ARG HD3 . . 5.500 4.903 4.534 5.329 . 0 0 "[ . 1 . 2]" 1
2272 1 92 ARG H 1 92 ARG HG2 . . 4.750 4.624 4.569 4.662 . 0 0 "[ . 1 . 2]" 1
2273 1 92 ARG H 1 92 ARG QG . . 4.110 4.023 3.999 4.047 . 0 0 "[ . 1 . 2]" 1
2274 1 92 ARG H 1 92 ARG HG3 . . 4.750 4.424 4.370 4.455 . 0 0 "[ . 1 . 2]" 1
2275 1 92 ARG H 1 93 GLU H . . 3.020 2.705 2.615 2.778 . 0 0 "[ . 1 . 2]" 1
2276 1 92 ARG H 1 93 GLU QG . . 4.540 4.477 4.427 4.546 0.006 14 0 "[ . 1 . 2]" 1
2277 1 92 ARG HA 1 92 ARG HD2 . . 5.010 2.970 2.525 3.385 . 0 0 "[ . 1 . 2]" 1
2278 1 92 ARG HA 1 92 ARG QD . . 4.290 2.892 2.498 3.267 . 0 0 "[ . 1 . 2]" 1
2279 1 92 ARG HA 1 92 ARG HD3 . . 5.010 4.057 3.722 4.487 . 0 0 "[ . 1 . 2]" 1
2280 1 92 ARG HA 1 92 ARG HG2 . . 3.920 3.651 3.492 3.709 . 0 0 "[ . 1 . 2]" 1
2281 1 92 ARG HA 1 92 ARG HG3 . . 3.920 2.430 2.237 2.541 . 0 0 "[ . 1 . 2]" 1
2282 1 92 ARG HA 1 93 GLU QG . . 4.920 4.581 4.506 4.617 . 0 0 "[ . 1 . 2]" 1
2283 1 92 ARG QB 1 92 ARG QD . . 3.070 2.079 1.967 2.182 . 0 0 "[ . 1 . 2]" 1
2284 1 92 ARG QB 1 93 GLU H . . 3.340 2.162 2.147 2.210 . 0 0 "[ . 1 . 2]" 1
2285 1 92 ARG QB 1 93 GLU QG . . 3.580 2.424 2.280 2.539 . 0 0 "[ . 1 . 2]" 1
2286 1 92 ARG HB2 1 93 GLU H . . 4.200 3.547 3.423 3.626 . 0 0 "[ . 1 . 2]" 1
2287 1 92 ARG HB3 1 93 GLU H . . 4.200 2.181 2.167 2.234 . 0 0 "[ . 1 . 2]" 1
2288 1 92 ARG QD 1 93 GLU QG . . 4.760 4.544 4.230 4.749 . 0 0 "[ . 1 . 2]" 1
2289 1 92 ARG QG 1 93 GLU QG . . 3.550 2.793 2.538 3.048 . 0 0 "[ . 1 . 2]" 1
2290 1 92 ARG HG2 1 93 GLU H . . 5.040 3.950 3.664 4.287 . 0 0 "[ . 1 . 2]" 1
2291 1 92 ARG HG3 1 93 GLU H . . 5.040 4.005 3.866 4.327 . 0 0 "[ . 1 . 2]" 1
2292 1 93 GLU H 1 93 GLU HB2 . . 3.160 2.699 2.636 2.734 . 0 0 "[ . 1 . 2]" 1
2293 1 93 GLU H 1 93 GLU HB3 . . 3.920 3.727 3.712 3.754 . 0 0 "[ . 1 . 2]" 1
2294 1 93 GLU H 1 93 GLU HG2 . . 4.060 2.361 2.325 2.419 . 0 0 "[ . 1 . 2]" 1
2295 1 93 GLU H 1 93 GLU QG . . 3.330 2.338 2.304 2.392 . 0 0 "[ . 1 . 2]" 1
2296 1 93 GLU H 1 93 GLU HG3 . . 4.060 3.794 3.766 3.850 . 0 0 "[ . 1 . 2]" 1
2297 1 93 GLU H 1 94 SER H . . 4.840 4.532 4.513 4.541 . 0 0 "[ . 1 . 2]" 1
2298 1 93 GLU H 1 96 LEU QD . . 4.160 3.873 3.598 3.985 . 0 0 "[ . 1 . 2]" 1
2299 1 93 GLU HA 1 93 GLU QG . . 3.540 3.058 2.973 3.072 . 0 0 "[ . 1 . 2]" 1
2300 1 93 GLU HA 1 94 SER H . . 3.520 2.271 2.271 2.272 . 0 0 "[ . 1 . 2]" 1
2301 1 93 GLU HB2 1 94 SER H . . 4.310 3.698 3.685 3.751 . 0 0 "[ . 1 . 2]" 1
2302 1 93 GLU HB2 1 95 THR H . . 3.920 3.550 3.297 3.922 0.002 8 0 "[ . 1 . 2]" 1
2303 1 93 GLU HB2 1 96 LEU QD . . 3.550 3.334 3.142 3.462 . 0 0 "[ . 1 . 2]" 1
2304 1 93 GLU HB3 1 94 SER H . . 4.060 2.812 2.792 2.817 . 0 0 "[ . 1 . 2]" 1
2305 1 93 GLU HB3 1 95 THR H . . 3.550 3.115 2.930 3.498 . 0 0 "[ . 1 . 2]" 1
2306 1 93 GLU QG 1 96 LEU QD . . 4.740 4.233 4.065 4.319 . 0 0 "[ . 1 . 2]" 1
2307 1 94 SER H 1 95 THR H . . 3.300 2.627 2.558 2.816 . 0 0 "[ . 1 . 2]" 1
2308 1 94 SER HA 1 96 LEU QD . . 5.250 4.887 4.526 5.011 . 0 0 "[ . 1 . 2]" 1
2309 1 94 SER HA 1 112 ILE MG . . 5.040 5.049 5.042 5.060 0.020 9 0 "[ . 1 . 2]" 1
2310 1 94 SER HA 1 113 PRO HD2 . . 5.000 4.456 4.385 4.509 . 0 0 "[ . 1 . 2]" 1
2311 1 94 SER HA 1 113 PRO HG2 . . 4.490 3.812 3.706 3.952 . 0 0 "[ . 1 . 2]" 1
2312 1 94 SER QB 1 95 THR H . . 4.070 2.694 2.380 2.882 . 0 0 "[ . 1 . 2]" 1
2313 1 94 SER QB 1 95 THR MG . . 5.010 4.524 4.442 4.645 . 0 0 "[ . 1 . 2]" 1
2314 1 94 SER QB 1 112 ILE MD . . 4.600 4.409 4.252 4.504 . 0 0 "[ . 1 . 2]" 1
2315 1 94 SER HB2 1 95 THR H . . 4.800 2.905 2.591 3.309 . 0 0 "[ . 1 . 2]" 1
2316 1 94 SER HB3 1 95 THR H . . 4.800 3.419 2.463 4.075 . 0 0 "[ . 1 . 2]" 1
2317 1 95 THR H 1 95 THR HB . . 3.350 2.928 2.844 2.998 . 0 0 "[ . 1 . 2]" 1
2318 1 95 THR H 1 95 THR MG . . 4.160 3.790 3.779 3.818 . 0 0 "[ . 1 . 2]" 1
2319 1 95 THR H 1 96 LEU H . . 4.730 4.536 4.497 4.576 . 0 0 "[ . 1 . 2]" 1
2320 1 95 THR H 1 96 LEU QD . . 4.550 4.481 4.209 4.553 0.003 13 0 "[ . 1 . 2]" 1
2321 1 95 THR H 1 96 LEU HG . . 5.500 5.100 4.944 5.190 . 0 0 "[ . 1 . 2]" 1
2322 1 95 THR HA 1 95 THR MG . . 3.110 2.004 1.974 2.046 . 0 0 "[ . 1 . 2]" 1
2323 1 95 THR HA 1 96 LEU H . . 2.820 2.480 2.415 2.548 . 0 0 "[ . 1 . 2]" 1
2324 1 95 THR HA 1 96 LEU HA . . 5.300 4.494 4.467 4.530 . 0 0 "[ . 1 . 2]" 1
2325 1 95 THR HA 1 96 LEU HB2 . . 4.710 4.471 4.417 4.652 . 0 0 "[ . 1 . 2]" 1
2326 1 95 THR HA 1 96 LEU MD1 . . 5.140 4.882 4.773 4.988 . 0 0 "[ . 1 . 2]" 1
2327 1 95 THR HA 1 96 LEU QD . . 4.120 4.051 3.791 4.122 0.002 4 0 "[ . 1 . 2]" 1
2328 1 95 THR HA 1 96 LEU MD2 . . 5.140 4.329 3.979 4.453 . 0 0 "[ . 1 . 2]" 1
2329 1 95 THR HA 1 112 ILE MD . . 3.410 2.631 2.584 2.683 . 0 0 "[ . 1 . 2]" 1
2330 1 95 THR HA 1 112 ILE HG13 . . 5.500 5.510 5.504 5.515 0.015 12 0 "[ . 1 . 2]" 1
2331 1 95 THR HA 1 112 ILE MG . . 4.350 4.017 3.927 4.119 . 0 0 "[ . 1 . 2]" 1
2332 1 95 THR HA 1 113 PRO HD2 . . 4.130 3.020 2.913 3.275 . 0 0 "[ . 1 . 2]" 1
2333 1 95 THR HA 1 113 PRO HD3 . . 4.200 4.080 3.993 4.208 0.008 8 0 "[ . 1 . 2]" 1
2334 1 95 THR HB 1 96 LEU H . . 4.120 2.965 2.743 3.186 . 0 0 "[ . 1 . 2]" 1
2335 1 95 THR HB 1 96 LEU QD . . 4.990 4.775 4.667 4.825 . 0 0 "[ . 1 . 2]" 1
2336 1 95 THR HB 1 97 ASN HD21 . . 4.970 2.969 2.734 3.502 . 0 0 "[ . 1 . 2]" 1
2337 1 95 THR HB 1 97 ASN HD22 . . 4.710 2.966 2.500 3.520 . 0 0 "[ . 1 . 2]" 1
2338 1 95 THR HB 1 112 ILE MD . . 4.490 4.344 4.280 4.394 . 0 0 "[ . 1 . 2]" 1
2339 1 95 THR MG 1 96 LEU H . . 3.280 2.026 1.999 2.061 . 0 0 "[ . 1 . 2]" 1
2340 1 95 THR MG 1 96 LEU HA . . 4.770 4.217 4.095 4.309 . 0 0 "[ . 1 . 2]" 1
2341 1 95 THR MG 1 96 LEU HB2 . . 5.330 4.206 4.151 4.294 . 0 0 "[ . 1 . 2]" 1
2342 1 95 THR MG 1 96 LEU QD . . 4.930 4.402 4.259 4.451 . 0 0 "[ . 1 . 2]" 1
2343 1 95 THR MG 1 97 ASN H . . 4.330 4.190 4.048 4.288 . 0 0 "[ . 1 . 2]" 1
2344 1 95 THR MG 1 97 ASN HA . . 4.810 4.369 4.200 4.477 . 0 0 "[ . 1 . 2]" 1
2345 1 95 THR MG 1 97 ASN HB2 . . 5.500 5.024 4.757 5.268 . 0 0 "[ . 1 . 2]" 1
2346 1 95 THR MG 1 97 ASN QB . . 4.790 4.651 4.488 4.789 . 0 0 "[ . 1 . 2]" 1
2347 1 95 THR MG 1 97 ASN HB3 . . 5.500 5.498 5.469 5.503 0.003 16 0 "[ . 1 . 2]" 1
2348 1 95 THR MG 1 97 ASN HD21 . . 3.930 3.214 2.439 3.884 . 0 0 "[ . 1 . 2]" 1
2349 1 95 THR MG 1 97 ASN HD22 . . 3.750 2.657 2.208 3.139 . 0 0 "[ . 1 . 2]" 1
2350 1 95 THR MG 1 111 VAL HB . . 5.500 5.270 5.071 5.386 . 0 0 "[ . 1 . 2]" 1
2351 1 95 THR MG 1 112 ILE MD . . 2.780 1.966 1.894 2.016 . 0 0 "[ . 1 . 2]" 1
2352 1 96 LEU H 1 96 LEU HB2 . . 3.490 2.753 2.690 2.837 . 0 0 "[ . 1 . 2]" 1
2353 1 96 LEU H 1 96 LEU HB3 . . 4.060 3.839 3.805 3.879 . 0 0 "[ . 1 . 2]" 1
2354 1 96 LEU H 1 96 LEU MD1 . . 4.320 4.294 4.150 4.329 0.009 15 0 "[ . 1 . 2]" 1
2355 1 96 LEU H 1 96 LEU QD . . 3.690 3.617 3.468 3.675 . 0 0 "[ . 1 . 2]" 1
2356 1 96 LEU H 1 96 LEU MD2 . . 4.320 3.894 3.711 3.974 . 0 0 "[ . 1 . 2]" 1
2357 1 96 LEU H 1 96 LEU HG . . 4.560 3.258 2.960 3.347 . 0 0 "[ . 1 . 2]" 1
2358 1 96 LEU H 1 97 ASN H . . 4.560 3.734 3.591 3.840 . 0 0 "[ . 1 . 2]" 1
2359 1 96 LEU H 1 110 THR HA . . 4.710 3.857 3.710 3.917 . 0 0 "[ . 1 . 2]" 1
2360 1 96 LEU H 1 110 THR MG . . 4.030 3.221 3.055 3.326 . 0 0 "[ . 1 . 2]" 1
2361 1 96 LEU H 1 111 VAL H . . 3.670 2.878 2.683 2.966 . 0 0 "[ . 1 . 2]" 1
2362 1 96 LEU H 1 111 VAL HB . . 4.640 4.363 4.152 4.485 . 0 0 "[ . 1 . 2]" 1
2363 1 96 LEU H 1 112 ILE MD . . 3.680 3.313 3.203 3.473 . 0 0 "[ . 1 . 2]" 1
2364 1 96 LEU H 1 113 PRO HD2 . . 4.730 4.268 4.113 4.480 . 0 0 "[ . 1 . 2]" 1
2365 1 96 LEU H 1 113 PRO HD3 . . 4.440 4.309 4.163 4.449 0.009 8 0 "[ . 1 . 2]" 1
2366 1 96 LEU HA 1 96 LEU MD1 . . 4.090 3.850 3.823 3.897 . 0 0 "[ . 1 . 2]" 1
2367 1 96 LEU HA 1 96 LEU QD . . 3.040 1.956 1.946 1.980 . 0 0 "[ . 1 . 2]" 1
2368 1 96 LEU HA 1 96 LEU MD2 . . 4.090 1.962 1.951 1.986 . 0 0 "[ . 1 . 2]" 1
2369 1 96 LEU HA 1 97 ASN H . . 2.820 2.225 2.198 2.255 . 0 0 "[ . 1 . 2]" 1
2370 1 96 LEU HA 1 97 ASN HA . . 5.430 4.443 4.434 4.460 . 0 0 "[ . 1 . 2]" 1
2371 1 96 LEU HA 1 97 ASN HD21 . . 5.150 3.893 3.512 4.642 . 0 0 "[ . 1 . 2]" 1
2372 1 96 LEU HA 1 98 MET H . . 5.360 4.547 4.512 4.634 . 0 0 "[ . 1 . 2]" 1
2373 1 96 LEU HA 1 98 MET ME . . 4.200 4.204 4.201 4.207 0.007 14 0 "[ . 1 . 2]" 1
2374 1 96 LEU HA 1 98 MET HG2 . . 4.990 4.304 4.167 4.397 . 0 0 "[ . 1 . 2]" 1
2375 1 96 LEU HA 1 98 MET HG3 . . 5.000 4.671 4.608 4.822 . 0 0 "[ . 1 . 2]" 1
2376 1 96 LEU HA 1 111 VAL H . . 4.840 4.462 4.433 4.497 . 0 0 "[ . 1 . 2]" 1
2377 1 96 LEU HB2 1 96 LEU MD1 . . 3.330 2.359 2.347 2.381 . 0 0 "[ . 1 . 2]" 1
2378 1 96 LEU HB2 1 96 LEU QD . . 2.900 2.299 2.289 2.317 . 0 0 "[ . 1 . 2]" 1
2379 1 96 LEU HB2 1 96 LEU MD2 . . 3.330 3.178 3.177 3.180 . 0 0 "[ . 1 . 2]" 1
2380 1 96 LEU HB2 1 97 ASN H . . 4.950 4.461 4.373 4.486 . 0 0 "[ . 1 . 2]" 1
2381 1 96 LEU HB2 1 98 MET ME . . 3.270 3.099 2.770 3.263 . 0 0 "[ . 1 . 2]" 1
2382 1 96 LEU HB2 1 98 MET HG3 . . 4.710 3.823 3.492 3.932 . 0 0 "[ . 1 . 2]" 1
2383 1 96 LEU HB2 1 109 ILE MG . . 5.500 5.086 5.024 5.161 . 0 0 "[ . 1 . 2]" 1
2384 1 96 LEU HB2 1 110 THR HA . . 5.000 4.097 4.029 4.150 . 0 0 "[ . 1 . 2]" 1
2385 1 96 LEU HB2 1 110 THR MG . . 5.500 4.540 4.425 4.626 . 0 0 "[ . 1 . 2]" 1
2386 1 96 LEU HB2 1 111 VAL H . . 3.740 2.309 2.242 2.432 . 0 0 "[ . 1 . 2]" 1
2387 1 96 LEU HB2 1 111 VAL HB . . 4.160 2.000 1.991 2.070 . 0 0 "[ . 1 . 2]" 1
2388 1 96 LEU HB2 1 111 VAL MG1 . . 4.150 3.415 3.346 3.612 . 0 0 "[ . 1 . 2]" 1
2389 1 96 LEU HB2 1 111 VAL MG2 . . 4.090 3.442 3.317 3.492 . 0 0 "[ . 1 . 2]" 1
2390 1 96 LEU HB3 1 96 LEU MD1 . . 3.560 2.343 2.315 2.355 . 0 0 "[ . 1 . 2]" 1
2391 1 96 LEU HB3 1 96 LEU QD . . 3.030 2.093 2.083 2.106 . 0 0 "[ . 1 . 2]" 1
2392 1 96 LEU HB3 1 96 LEU MD2 . . 3.560 2.356 2.343 2.374 . 0 0 "[ . 1 . 2]" 1
2393 1 96 LEU HB3 1 97 ASN H . . 4.250 3.936 3.873 4.001 . 0 0 "[ . 1 . 2]" 1
2394 1 96 LEU HB3 1 98 MET ME . . 3.700 2.071 2.023 2.298 . 0 0 "[ . 1 . 2]" 1
2395 1 96 LEU HB3 1 98 MET HG2 . . 4.000 3.088 2.981 3.141 . 0 0 "[ . 1 . 2]" 1
2396 1 96 LEU HB3 1 98 MET HG3 . . 3.920 2.874 2.777 3.153 . 0 0 "[ . 1 . 2]" 1
2397 1 96 LEU HB3 1 111 VAL H . . 4.160 3.663 3.520 4.024 . 0 0 "[ . 1 . 2]" 1
2398 1 96 LEU HB3 1 111 VAL HB . . 4.090 3.082 2.961 3.470 . 0 0 "[ . 1 . 2]" 1
2399 1 96 LEU QD 1 97 ASN H . . 4.110 3.723 3.635 3.841 . 0 0 "[ . 1 . 2]" 1
2400 1 96 LEU QD 1 98 MET ME . . 2.450 1.980 1.920 2.081 . 0 0 "[ . 1 . 2]" 1
2401 1 96 LEU QD 1 98 MET HG2 . . 4.940 3.731 3.638 3.970 . 0 0 "[ . 1 . 2]" 1
2402 1 96 LEU QD 1 98 MET HG3 . . 4.460 3.790 3.708 3.995 . 0 0 "[ . 1 . 2]" 1
2403 1 96 LEU QD 1 111 VAL H . . 4.670 3.851 3.791 3.899 . 0 0 "[ . 1 . 2]" 1
2404 1 96 LEU QD 1 111 VAL HB . . 3.440 2.116 2.064 2.176 . 0 0 "[ . 1 . 2]" 1
2405 1 96 LEU QD 1 112 ILE H . . 5.060 4.416 4.312 4.511 . 0 0 "[ . 1 . 2]" 1
2406 1 96 LEU QD 1 113 PRO HB3 . . 4.170 2.602 2.489 2.917 . 0 0 "[ . 1 . 2]" 1
2407 1 96 LEU QD 1 113 PRO HD2 . . 3.540 3.279 3.228 3.345 . 0 0 "[ . 1 . 2]" 1
2408 1 96 LEU QD 1 113 PRO HD3 . . 3.450 2.072 1.940 2.224 . 0 0 "[ . 1 . 2]" 1
2409 1 96 LEU MD1 1 98 MET HG3 . . 5.500 4.065 3.991 4.204 . 0 0 "[ . 1 . 2]" 1
2410 1 96 LEU MD1 1 113 PRO HD2 . . 4.120 3.462 3.378 3.554 . 0 0 "[ . 1 . 2]" 1
2411 1 96 LEU MD1 1 113 PRO HD3 . . 4.290 2.083 1.946 2.243 . 0 0 "[ . 1 . 2]" 1
2412 1 96 LEU MD1 1 113 PRO HG2 . . 3.870 3.542 3.498 3.698 . 0 0 "[ . 1 . 2]" 1
2413 1 96 LEU MD2 1 98 MET HG3 . . 5.500 4.542 4.381 4.999 . 0 0 "[ . 1 . 2]" 1
2414 1 96 LEU MD2 1 113 PRO HD2 . . 4.120 4.063 3.907 4.119 . 0 0 "[ . 1 . 2]" 1
2415 1 96 LEU MD2 1 113 PRO HD3 . . 4.290 3.715 3.660 3.736 . 0 0 "[ . 1 . 2]" 1
2416 1 96 LEU MD2 1 113 PRO HG2 . . 3.870 3.874 3.870 3.878 0.008 8 0 "[ . 1 . 2]" 1
2417 1 96 LEU HG 1 97 ASN H . . 5.500 5.258 5.232 5.299 . 0 0 "[ . 1 . 2]" 1
2418 1 96 LEU HG 1 111 VAL H . . 5.500 4.386 4.102 4.499 . 0 0 "[ . 1 . 2]" 1
2419 1 96 LEU HG 1 113 PRO HD2 . . 4.000 2.796 2.726 2.964 . 0 0 "[ . 1 . 2]" 1
2420 1 96 LEU HG 1 113 PRO HD3 . . 3.790 2.210 2.136 2.408 . 0 0 "[ . 1 . 2]" 1
2421 1 97 ASN H 1 97 ASN HB2 . . 3.700 2.364 2.252 2.459 . 0 0 "[ . 1 . 2]" 1
2422 1 97 ASN H 1 97 ASN QB . . 3.100 2.333 2.227 2.422 . 0 0 "[ . 1 . 2]" 1
2423 1 97 ASN H 1 97 ASN HB3 . . 3.700 3.601 3.527 3.646 . 0 0 "[ . 1 . 2]" 1
2424 1 97 ASN H 1 97 ASN HD21 . . 4.180 2.352 1.902 2.932 . 0 0 "[ . 1 . 2]" 1
2425 1 97 ASN H 1 97 ASN HD22 . . 4.560 3.885 3.480 4.178 . 0 0 "[ . 1 . 2]" 1
2426 1 97 ASN H 1 98 MET ME . . 5.350 5.277 5.235 5.343 . 0 0 "[ . 1 . 2]" 1
2427 1 97 ASN H 1 98 MET HG2 . . 5.280 4.417 4.370 4.505 . 0 0 "[ . 1 . 2]" 1
2428 1 97 ASN HA 1 97 ASN HD21 . . 4.560 3.498 2.904 4.049 . 0 0 "[ . 1 . 2]" 1
2429 1 97 ASN HA 1 98 MET H . . 2.820 2.403 2.378 2.414 . 0 0 "[ . 1 . 2]" 1
2430 1 97 ASN HA 1 98 MET HB2 . . 5.330 4.994 4.980 5.005 . 0 0 "[ . 1 . 2]" 1
2431 1 97 ASN HA 1 98 MET HG2 . . 4.770 4.743 4.635 4.772 0.002 16 0 "[ . 1 . 2]" 1
2432 1 97 ASN HA 1 98 MET HG3 . . 4.600 4.460 4.409 4.539 . 0 0 "[ . 1 . 2]" 1
2433 1 97 ASN HA 1 109 ILE MG . . 5.500 5.503 5.499 5.508 0.008 10 0 "[ . 1 . 2]" 1
2434 1 97 ASN HA 1 110 THR H . . 5.220 4.845 4.723 4.911 . 0 0 "[ . 1 . 2]" 1
2435 1 97 ASN HA 1 110 THR HA . . 3.430 2.945 2.856 2.999 . 0 0 "[ . 1 . 2]" 1
2436 1 97 ASN HA 1 110 THR MG . . 3.920 3.771 3.673 3.843 . 0 0 "[ . 1 . 2]" 1
2437 1 97 ASN HA 1 111 VAL H . . 4.330 4.235 4.193 4.282 . 0 0 "[ . 1 . 2]" 1
2438 1 97 ASN QB 1 97 ASN HD21 . . 3.100 2.327 2.112 2.547 . 0 0 "[ . 1 . 2]" 1
2439 1 97 ASN QB 1 97 ASN HD22 . . 3.520 3.329 3.249 3.404 . 0 0 "[ . 1 . 2]" 1
2440 1 97 ASN QB 1 98 MET H . . 3.990 3.883 3.873 3.893 . 0 0 "[ . 1 . 2]" 1
2441 1 97 ASN QB 1 99 VAL MG2 . . 5.340 3.893 3.851 3.926 . 0 0 "[ . 1 . 2]" 1
2442 1 97 ASN QB 1 108 MET ME . . 4.090 2.413 1.990 2.972 . 0 0 "[ . 1 . 2]" 1
2443 1 97 ASN HB2 1 98 MET H . . 4.700 4.523 4.482 4.574 . 0 0 "[ . 1 . 2]" 1
2444 1 97 ASN HB2 1 110 THR MG . . 5.500 5.466 5.264 5.503 0.003 10 0 "[ . 1 . 2]" 1
2445 1 97 ASN HB3 1 98 MET H . . 4.700 4.230 4.201 4.248 . 0 0 "[ . 1 . 2]" 1
2446 1 97 ASN HB3 1 110 THR MG . . 5.500 5.298 5.071 5.496 . 0 0 "[ . 1 . 2]" 1
2447 1 97 ASN HD22 1 110 THR MG . . 4.260 3.644 2.983 4.151 . 0 0 "[ . 1 . 2]" 1
2448 1 98 MET H 1 98 MET HB2 . . 3.500 2.689 2.680 2.701 . 0 0 "[ . 1 . 2]" 1
2449 1 98 MET H 1 98 MET HB3 . . 3.820 3.615 3.614 3.617 . 0 0 "[ . 1 . 2]" 1
2450 1 98 MET H 1 98 MET ME . . 4.490 4.097 4.058 4.184 . 0 0 "[ . 1 . 2]" 1
2451 1 98 MET H 1 98 MET HG2 . . 3.840 2.729 2.624 2.755 . 0 0 "[ . 1 . 2]" 1
2452 1 98 MET H 1 98 MET HG3 . . 3.510 2.279 2.248 2.347 . 0 0 "[ . 1 . 2]" 1
2453 1 98 MET H 1 99 VAL H . . 4.730 4.608 4.608 4.609 . 0 0 "[ . 1 . 2]" 1
2454 1 98 MET H 1 109 ILE H . . 3.920 3.284 3.200 3.369 . 0 0 "[ . 1 . 2]" 1
2455 1 98 MET H 1 109 ILE HB . . 4.310 3.462 3.403 3.550 . 0 0 "[ . 1 . 2]" 1
2456 1 98 MET H 1 109 ILE MG . . 4.700 4.280 4.246 4.331 . 0 0 "[ . 1 . 2]" 1
2457 1 98 MET H 1 110 THR H . . 5.500 5.086 5.002 5.131 . 0 0 "[ . 1 . 2]" 1
2458 1 98 MET H 1 110 THR HA . . 3.790 3.723 3.622 3.782 . 0 0 "[ . 1 . 2]" 1
2459 1 98 MET H 1 110 THR MG . . 5.330 5.181 5.061 5.248 . 0 0 "[ . 1 . 2]" 1
2460 1 98 MET H 1 111 VAL H . . 4.370 4.321 4.251 4.371 0.001 8 0 "[ . 1 . 2]" 1
2461 1 98 MET HA 1 98 MET ME . . 5.050 4.822 4.763 4.850 . 0 0 "[ . 1 . 2]" 1
2462 1 98 MET HA 1 98 MET HG2 . . 3.920 2.607 2.598 2.620 . 0 0 "[ . 1 . 2]" 1
2463 1 98 MET HA 1 98 MET HG3 . . 4.090 3.578 3.564 3.635 . 0 0 "[ . 1 . 2]" 1
2464 1 98 MET HA 1 99 VAL H . . 2.920 2.364 2.363 2.365 . 0 0 "[ . 1 . 2]" 1
2465 1 98 MET HA 1 99 VAL HB . . 4.710 4.593 4.560 4.621 . 0 0 "[ . 1 . 2]" 1
2466 1 98 MET HA 1 99 VAL MG2 . . 4.090 3.419 3.325 3.469 . 0 0 "[ . 1 . 2]" 1
2467 1 98 MET HA 1 108 MET ME . . 5.450 5.140 4.618 5.453 0.003 9 0 "[ . 1 . 2]" 1
2468 1 98 MET HB2 1 99 VAL H . . 4.100 3.470 3.456 3.479 . 0 0 "[ . 1 . 2]" 1
2469 1 98 MET HB2 1 100 VAL QG . . 5.440 4.610 4.537 4.708 . 0 0 "[ . 1 . 2]" 1
2470 1 98 MET HB2 1 109 ILE H . . 4.140 3.345 3.298 3.465 . 0 0 "[ . 1 . 2]" 1
2471 1 98 MET HB2 1 109 ILE HB . . 3.690 2.058 1.997 2.155 . 0 0 "[ . 1 . 2]" 1
2472 1 98 MET HB2 1 109 ILE MD . . 5.300 4.748 4.694 4.862 . 0 0 "[ . 1 . 2]" 1
2473 1 98 MET HB2 1 109 ILE HG12 . . 4.760 3.670 3.590 3.798 . 0 0 "[ . 1 . 2]" 1
2474 1 98 MET HB2 1 109 ILE HG13 . . 5.180 3.805 3.666 4.026 . 0 0 "[ . 1 . 2]" 1
2475 1 98 MET HB2 1 109 ILE MG . . 4.330 3.505 3.439 3.564 . 0 0 "[ . 1 . 2]" 1
2476 1 98 MET HB3 1 99 VAL H . . 3.740 2.605 2.600 2.611 . 0 0 "[ . 1 . 2]" 1
2477 1 98 MET HB3 1 109 ILE H . . 5.040 4.728 4.686 4.852 . 0 0 "[ . 1 . 2]" 1
2478 1 98 MET HB3 1 109 ILE HB . . 4.460 3.760 3.698 3.849 . 0 0 "[ . 1 . 2]" 1
2479 1 98 MET ME 1 98 MET HG2 . . 3.450 2.659 2.544 2.705 . 0 0 "[ . 1 . 2]" 1
2480 1 98 MET ME 1 98 MET HG3 . . 3.330 2.238 2.188 2.433 . 0 0 "[ . 1 . 2]" 1
2481 1 98 MET ME 1 109 ILE MG . . 4.780 3.957 3.824 4.240 . 0 0 "[ . 1 . 2]" 1
2482 1 98 MET ME 1 111 VAL H . . 4.460 4.451 4.415 4.466 0.006 17 0 "[ . 1 . 2]" 1
2483 1 98 MET ME 1 111 VAL HA . . 5.500 5.494 5.367 5.507 0.007 20 0 "[ . 1 . 2]" 1
2484 1 98 MET HG2 1 99 VAL H . . 4.770 4.509 4.499 4.542 . 0 0 "[ . 1 . 2]" 1
2485 1 98 MET HG2 1 109 ILE H . . 5.500 5.506 5.502 5.510 0.010 10 0 "[ . 1 . 2]" 1
2486 1 98 MET HG2 1 109 ILE HB . . 5.050 4.652 4.583 4.763 . 0 0 "[ . 1 . 2]" 1
2487 1 98 MET HG2 1 109 ILE MG . . 5.500 5.138 5.060 5.226 . 0 0 "[ . 1 . 2]" 1
2488 1 98 MET HG3 1 99 VAL H . . 5.300 5.116 5.111 5.130 . 0 0 "[ . 1 . 2]" 1
2489 1 98 MET HG3 1 109 ILE HB . . 4.330 3.310 3.245 3.420 . 0 0 "[ . 1 . 2]" 1
2490 1 98 MET HG3 1 109 ILE MG . . 4.200 3.655 3.584 3.765 . 0 0 "[ . 1 . 2]" 1
2491 1 98 MET HG3 1 110 THR HA . . 5.000 4.784 4.635 4.862 . 0 0 "[ . 1 . 2]" 1
2492 1 98 MET HG3 1 111 VAL H . . 4.730 4.393 4.327 4.454 . 0 0 "[ . 1 . 2]" 1
2493 1 98 MET HG3 1 111 VAL HB . . 4.710 4.134 4.090 4.175 . 0 0 "[ . 1 . 2]" 1
2494 1 98 MET HG3 1 111 VAL MG2 . . 4.490 3.571 3.419 3.685 . 0 0 "[ . 1 . 2]" 1
2495 1 99 VAL H 1 99 VAL HB . . 3.370 2.814 2.798 2.831 . 0 0 "[ . 1 . 2]" 1
2496 1 99 VAL H 1 99 VAL MG1 . . 4.050 3.922 3.913 3.934 . 0 0 "[ . 1 . 2]" 1
2497 1 99 VAL H 1 99 VAL MG2 . . 3.340 2.938 2.865 2.990 . 0 0 "[ . 1 . 2]" 1
2498 1 99 VAL H 1 100 VAL H . . 4.560 3.821 3.809 3.846 . 0 0 "[ . 1 . 2]" 1
2499 1 99 VAL H 1 100 VAL HA . . 4.700 4.586 4.558 4.619 . 0 0 "[ . 1 . 2]" 1
2500 1 99 VAL HA 1 107 ILE H . . 5.130 4.195 3.847 4.517 . 0 0 "[ . 1 . 2]" 1
2501 1 99 VAL HA 1 108 MET HA . . 3.600 2.485 2.377 2.625 . 0 0 "[ . 1 . 2]" 1
2502 1 99 VAL HB 1 100 VAL H . . 4.490 4.420 4.409 4.433 . 0 0 "[ . 1 . 2]" 1
2503 1 99 VAL HB 1 100 VAL HA . . 5.500 4.852 4.829 4.896 . 0 0 "[ . 1 . 2]" 1
2504 1 99 VAL HB 1 106 ASP QB . . 4.880 4.510 4.247 4.750 . 0 0 "[ . 1 . 2]" 1
2505 1 99 VAL MG1 1 100 VAL H . . 3.640 3.247 3.141 3.340 . 0 0 "[ . 1 . 2]" 1
2506 1 99 VAL MG1 1 101 ARG HA . . 5.290 4.610 4.509 4.672 . 0 0 "[ . 1 . 2]" 1
2507 1 99 VAL MG1 1 101 ARG HE . . 5.500 4.869 4.539 5.109 . 0 0 "[ . 1 . 2]" 1
2508 1 99 VAL MG1 1 106 ASP H . . 5.220 5.028 4.676 5.193 . 0 0 "[ . 1 . 2]" 1
2509 1 99 VAL MG1 1 106 ASP HA . . 3.690 3.482 3.225 3.700 0.010 5 0 "[ . 1 . 2]" 1
2510 1 99 VAL MG1 1 106 ASP HB2 . . 3.430 2.225 1.894 3.325 . 0 0 "[ . 1 . 2]" 1
2511 1 99 VAL MG1 1 106 ASP HB3 . . 3.430 3.128 2.047 3.397 . 0 0 "[ . 1 . 2]" 1
2512 1 99 VAL MG1 1 107 ILE H . . 3.990 3.115 2.649 3.393 . 0 0 "[ . 1 . 2]" 1
2513 1 99 VAL MG1 1 108 MET H . . 4.610 4.405 4.258 4.554 . 0 0 "[ . 1 . 2]" 1
2514 1 99 VAL MG1 1 108 MET HA . . 4.000 3.516 3.389 3.675 . 0 0 "[ . 1 . 2]" 1
2515 1 99 VAL MG1 1 108 MET ME . . 4.000 3.813 3.471 4.000 . 0 0 "[ . 1 . 2]" 1
2516 1 99 VAL MG1 1 108 MET HG2 . . 4.090 3.384 3.165 3.620 . 0 0 "[ . 1 . 2]" 1
2517 1 99 VAL MG1 1 108 MET HG3 . . 4.090 3.984 3.818 4.090 0.000 14 0 "[ . 1 . 2]" 1
2518 1 99 VAL MG1 1 109 ILE H . . 5.350 5.022 4.913 5.167 . 0 0 "[ . 1 . 2]" 1
2519 1 99 VAL MG2 1 100 VAL H . . 4.250 4.240 4.221 4.252 0.002 17 0 "[ . 1 . 2]" 1
2520 1 99 VAL MG2 1 106 ASP QB . . 4.370 4.186 4.011 4.294 . 0 0 "[ . 1 . 2]" 1
2521 1 99 VAL MG2 1 108 MET HA . . 3.690 2.775 2.660 2.900 . 0 0 "[ . 1 . 2]" 1
2522 1 99 VAL MG2 1 108 MET HB3 . . 4.330 4.062 3.852 4.329 . 0 0 "[ . 1 . 2]" 1
2523 1 99 VAL MG2 1 108 MET ME . . 3.190 2.281 1.972 2.575 . 0 0 "[ . 1 . 2]" 1
2524 1 99 VAL MG2 1 108 MET HG2 . . 3.740 2.223 2.076 2.417 . 0 0 "[ . 1 . 2]" 1
2525 1 99 VAL MG2 1 108 MET HG3 . . 3.790 3.582 3.423 3.754 . 0 0 "[ . 1 . 2]" 1
2526 1 99 VAL MG2 1 109 ILE H . . 4.100 3.754 3.676 3.882 . 0 0 "[ . 1 . 2]" 1
2527 1 100 VAL H 1 100 VAL HB . . 3.640 2.800 2.760 2.823 . 0 0 "[ . 1 . 2]" 1
2528 1 100 VAL H 1 100 VAL QG . . 3.000 2.131 1.997 2.173 . 0 0 "[ . 1 . 2]" 1
2529 1 100 VAL H 1 106 ASP HA . . 5.330 5.087 4.906 5.193 . 0 0 "[ . 1 . 2]" 1
2530 1 100 VAL H 1 107 ILE H . . 4.090 3.503 3.307 3.716 . 0 0 "[ . 1 . 2]" 1
2531 1 100 VAL H 1 107 ILE HB . . 4.490 4.013 3.760 4.350 . 0 0 "[ . 1 . 2]" 1
2532 1 100 VAL H 1 108 MET HA . . 4.090 3.850 3.681 4.018 . 0 0 "[ . 1 . 2]" 1
2533 1 100 VAL H 1 109 ILE H . . 4.580 4.331 4.233 4.578 . 0 0 "[ . 1 . 2]" 1
2534 1 100 VAL H 1 109 ILE HB . . 5.120 4.659 4.543 4.717 . 0 0 "[ . 1 . 2]" 1
2535 1 100 VAL H 1 109 ILE HG12 . . 4.930 2.992 2.859 3.119 . 0 0 "[ . 1 . 2]" 1
2536 1 100 VAL HA 1 100 VAL MG1 . . 3.540 3.186 3.184 3.201 . 0 0 "[ . 1 . 2]" 1
2537 1 100 VAL HA 1 100 VAL QG . . 2.960 2.145 2.141 2.156 . 0 0 "[ . 1 . 2]" 1
2538 1 100 VAL HA 1 100 VAL MG2 . . 3.540 2.180 2.176 2.193 . 0 0 "[ . 1 . 2]" 1
2539 1 100 VAL HA 1 101 ARG H . . 3.020 2.293 2.291 2.298 . 0 0 "[ . 1 . 2]" 1
2540 1 100 VAL HA 1 101 ARG HB2 . . 5.180 4.498 4.476 4.536 . 0 0 "[ . 1 . 2]" 1
2541 1 100 VAL HA 1 101 ARG HG2 . . 4.710 3.911 3.835 3.961 . 0 0 "[ . 1 . 2]" 1
2542 1 100 VAL HB 1 101 ARG H . . 4.090 3.974 3.968 3.975 . 0 0 "[ . 1 . 2]" 1
2543 1 100 VAL HB 1 102 ARG HE . . 5.500 4.841 4.624 5.499 . 0 0 "[ . 1 . 2]" 1
2544 1 100 VAL QG 1 101 ARG H . . 3.390 1.930 1.900 2.025 . 0 0 "[ . 1 . 2]" 1
2545 1 100 VAL QG 1 101 ARG HB2 . . 3.980 3.633 3.616 3.668 . 0 0 "[ . 1 . 2]" 1
2546 1 100 VAL QG 1 102 ARG QD . . 3.690 3.327 3.157 3.552 . 0 0 "[ . 1 . 2]" 1
2547 1 100 VAL QG 1 102 ARG QH2 . . 4.610 1.961 1.851 2.427 . 0 0 "[ . 1 . 2]" 1
2548 1 100 VAL QG 1 107 ILE H . . 4.070 3.229 2.825 3.379 . 0 0 "[ . 1 . 2]" 1
2549 1 100 VAL QG 1 107 ILE HB . . 3.380 2.662 2.424 2.880 . 0 0 "[ . 1 . 2]" 1
2550 1 100 VAL QG 1 109 ILE H . . 5.440 4.796 4.715 5.022 . 0 0 "[ . 1 . 2]" 1
2551 1 100 VAL MG1 1 101 ARG H . . 4.330 3.553 3.495 3.563 . 0 0 "[ . 1 . 2]" 1
2552 1 100 VAL MG1 1 101 ARG HA . . 5.500 4.058 3.990 4.077 . 0 0 "[ . 1 . 2]" 1
2553 1 100 VAL MG1 1 102 ARG HE . . 4.710 2.186 1.938 2.955 . 0 0 "[ . 1 . 2]" 1
2554 1 100 VAL MG2 1 101 ARG H . . 4.330 1.939 1.907 2.037 . 0 0 "[ . 1 . 2]" 1
2555 1 100 VAL MG2 1 101 ARG HA . . 5.500 4.029 4.008 4.036 . 0 0 "[ . 1 . 2]" 1
2556 1 100 VAL MG2 1 102 ARG HE . . 4.710 2.924 2.703 3.420 . 0 0 "[ . 1 . 2]" 1
2557 1 101 ARG H 1 101 ARG HB2 . . 3.740 2.357 2.341 2.382 . 0 0 "[ . 1 . 2]" 1
2558 1 101 ARG H 1 101 ARG HB3 . . 3.800 3.603 3.594 3.615 . 0 0 "[ . 1 . 2]" 1
2559 1 101 ARG H 1 101 ARG HG3 . . 4.430 3.884 3.852 3.939 . 0 0 "[ . 1 . 2]" 1
2560 1 101 ARG H 1 102 ARG H . . 4.970 4.383 4.381 4.391 . 0 0 "[ . 1 . 2]" 1
2561 1 101 ARG HA 1 101 ARG HD2 . . 3.850 2.956 2.687 3.093 . 0 0 "[ . 1 . 2]" 1
2562 1 101 ARG HA 1 101 ARG HD3 . . 3.850 2.386 2.257 2.541 . 0 0 "[ . 1 . 2]" 1
2563 1 101 ARG HA 1 101 ARG HE . . 4.840 4.700 4.613 4.783 . 0 0 "[ . 1 . 2]" 1
2564 1 101 ARG HA 1 102 ARG H . . 3.000 2.141 2.140 2.142 . 0 0 "[ . 1 . 2]" 1
2565 1 101 ARG HA 1 105 GLU H . . 4.930 4.208 3.935 4.848 . 0 0 "[ . 1 . 2]" 1
2566 1 101 ARG HA 1 106 ASP HA . . 3.560 2.364 2.015 2.519 . 0 0 "[ . 1 . 2]" 1
2567 1 101 ARG HA 1 107 ILE H . . 4.060 3.281 3.078 3.555 . 0 0 "[ . 1 . 2]" 1
2568 1 101 ARG HB2 1 101 ARG HE . . 4.770 4.577 4.526 4.628 . 0 0 "[ . 1 . 2]" 1
2569 1 101 ARG HB2 1 102 ARG H . . 5.040 4.404 4.387 4.416 . 0 0 "[ . 1 . 2]" 1
2570 1 101 ARG HB2 1 106 ASP HA . . 5.500 5.067 4.943 5.219 . 0 0 "[ . 1 . 2]" 1
2571 1 101 ARG HB3 1 101 ARG HE . . 4.970 4.278 4.144 4.371 . 0 0 "[ . 1 . 2]" 1
2572 1 101 ARG HB3 1 102 ARG H . . 4.430 3.538 3.526 3.543 . 0 0 "[ . 1 . 2]" 1
2573 1 101 ARG QD 1 101 ARG QH1 . . 3.540 1.908 1.885 1.956 . 0 0 "[ . 1 . 2]" 1
2574 1 101 ARG QD 1 102 ARG H . . 3.660 3.637 3.583 3.662 0.002 12 0 "[ . 1 . 2]" 1
2575 1 101 ARG QD 1 105 GLU H . . 4.120 3.473 3.167 4.110 . 0 0 "[ . 1 . 2]" 1
2576 1 101 ARG HD2 1 102 ARG H . . 4.330 4.144 3.937 4.271 . 0 0 "[ . 1 . 2]" 1
2577 1 101 ARG HD2 1 105 GLU H . . 4.910 3.633 3.269 4.421 . 0 0 "[ . 1 . 2]" 1
2578 1 101 ARG HD2 1 106 ASP HA . . 4.710 3.556 3.150 3.965 . 0 0 "[ . 1 . 2]" 1
2579 1 101 ARG HD3 1 102 ARG H . . 4.330 4.038 3.928 4.310 . 0 0 "[ . 1 . 2]" 1
2580 1 101 ARG HD3 1 105 GLU H . . 4.910 4.445 4.212 4.888 . 0 0 "[ . 1 . 2]" 1
2581 1 101 ARG HD3 1 106 ASP HA . . 4.710 2.107 2.003 2.620 . 0 0 "[ . 1 . 2]" 1
2582 1 101 ARG HG2 1 102 ARG H . . 5.040 4.854 4.787 4.921 . 0 0 "[ . 1 . 2]" 1
2583 1 101 ARG QH1 1 105 GLU H . . 4.920 3.457 3.106 3.877 . 0 0 "[ . 1 . 2]" 1
2584 1 102 ARG H 1 102 ARG HB2 . . 3.540 2.495 2.424 2.574 . 0 0 "[ . 1 . 2]" 1
2585 1 102 ARG H 1 102 ARG QG . . 4.230 3.932 3.838 4.038 . 0 0 "[ . 1 . 2]" 1
2586 1 102 ARG H 1 105 GLU H . . 3.780 3.298 3.105 3.726 . 0 0 "[ . 1 . 2]" 1
2587 1 102 ARG H 1 105 GLU HB2 . . 5.350 5.278 5.045 5.356 0.006 5 0 "[ . 1 . 2]" 1
2588 1 102 ARG H 1 105 GLU HG3 . . 4.980 3.634 3.116 4.310 . 0 0 "[ . 1 . 2]" 1
2589 1 102 ARG H 1 106 ASP HA . . 4.030 3.438 2.769 3.665 . 0 0 "[ . 1 . 2]" 1
2590 1 102 ARG H 1 107 ILE H . . 4.560 3.804 3.470 4.136 . 0 0 "[ . 1 . 2]" 1
2591 1 102 ARG H 1 107 ILE MD . . 4.100 3.348 3.144 3.887 . 0 0 "[ . 1 . 2]" 1
2592 1 102 ARG H 1 107 ILE HG13 . . 4.840 3.144 2.853 3.533 . 0 0 "[ . 1 . 2]" 1
2593 1 102 ARG HA 1 102 ARG HE . . 5.280 3.992 3.534 4.427 . 0 0 "[ . 1 . 2]" 1
2594 1 102 ARG HA 1 103 GLY H . . 3.010 2.164 2.144 2.206 . 0 0 "[ . 1 . 2]" 1
2595 1 102 ARG HA 1 107 ILE MD . . 5.050 4.242 4.089 4.625 . 0 0 "[ . 1 . 2]" 1
2596 1 102 ARG HB2 1 102 ARG QD . . 3.720 2.191 2.023 2.300 . 0 0 "[ . 1 . 2]" 1
2597 1 102 ARG HB2 1 102 ARG HE . . 4.080 3.254 2.985 3.510 . 0 0 "[ . 1 . 2]" 1
2598 1 102 ARG HB2 1 103 GLY H . . 4.770 4.551 4.419 4.652 . 0 0 "[ . 1 . 2]" 1
2599 1 102 ARG HB2 1 106 ASP HA . . 5.500 5.225 4.412 5.484 . 0 0 "[ . 1 . 2]" 1
2600 1 102 ARG HB2 1 107 ILE MD . . 3.300 2.049 1.962 2.389 . 0 0 "[ . 1 . 2]" 1
2601 1 102 ARG HB2 1 107 ILE HG13 . . 4.810 3.139 3.021 3.355 . 0 0 "[ . 1 . 2]" 1
2602 1 102 ARG HB3 1 102 ARG HE . . 4.430 4.324 4.198 4.431 0.001 6 0 "[ . 1 . 2]" 1
2603 1 102 ARG HB3 1 103 GLY H . . 4.970 3.815 3.485 4.103 . 0 0 "[ . 1 . 2]" 1
2604 1 102 ARG QD 1 107 ILE MD . . 3.350 2.015 1.867 2.281 . 0 0 "[ . 1 . 2]" 1
2605 1 102 ARG QD 1 107 ILE HG12 . . 5.160 4.839 4.483 5.161 0.001 10 0 "[ . 1 . 2]" 1
2606 1 102 ARG QD 1 107 ILE MG . . 4.600 3.684 3.528 3.863 . 0 0 "[ . 1 . 2]" 1
2607 1 102 ARG HD2 1 107 ILE MD . . 4.000 2.027 1.884 2.299 . 0 0 "[ . 1 . 2]" 1
2608 1 102 ARG HD3 1 107 ILE MD . . 4.000 3.507 3.043 3.821 . 0 0 "[ . 1 . 2]" 1
2609 1 102 ARG HE 1 102 ARG HG2 . . 4.140 3.413 3.309 3.512 . 0 0 "[ . 1 . 2]" 1
2610 1 102 ARG HE 1 102 ARG QG . . 3.500 2.111 2.078 2.197 . 0 0 "[ . 1 . 2]" 1
2611 1 102 ARG HE 1 102 ARG HG3 . . 4.140 2.132 2.098 2.219 . 0 0 "[ . 1 . 2]" 1
2612 1 102 ARG HE 1 107 ILE HB . . 5.500 4.808 4.602 5.237 . 0 0 "[ . 1 . 2]" 1
2613 1 102 ARG HE 1 107 ILE MD . . 4.330 4.069 3.965 4.229 . 0 0 "[ . 1 . 2]" 1
2614 1 102 ARG HE 1 109 ILE MD . . 5.330 4.600 4.471 5.120 . 0 0 "[ . 1 . 2]" 1
2615 1 102 ARG QG 1 103 GLY H . . 4.290 3.479 3.212 3.906 . 0 0 "[ . 1 . 2]" 1
2616 1 102 ARG HG2 1 103 GLY H . . 4.960 3.882 3.451 4.363 . 0 0 "[ . 1 . 2]" 1
2617 1 102 ARG HG3 1 103 GLY H . . 4.960 3.962 3.621 4.528 . 0 0 "[ . 1 . 2]" 1
2618 1 102 ARG QH1 1 107 ILE MD . . 4.560 3.244 2.806 3.438 . 0 0 "[ . 1 . 2]" 1
2619 1 102 ARG QH1 1 109 ILE MD . . 3.950 2.370 2.270 2.599 . 0 0 "[ . 1 . 2]" 1
2620 1 102 ARG HH11 1 109 ILE HG13 . . 5.500 5.495 5.483 5.503 0.003 14 0 "[ . 1 . 2]" 1
2621 1 102 ARG HH12 1 109 ILE HG13 . . 5.500 4.276 4.232 4.395 . 0 0 "[ . 1 . 2]" 1
2622 1 102 ARG QH2 1 107 ILE MD . . 4.760 4.741 4.707 4.761 0.001 6 0 "[ . 1 . 2]" 1
2623 1 102 ARG QH2 1 109 ILE MD . . 4.170 2.470 2.290 3.244 . 0 0 "[ . 1 . 2]" 1
2624 1 102 ARG HH21 1 107 ILE MD . . 5.500 5.267 5.201 5.355 . 0 0 "[ . 1 . 2]" 1
2625 1 102 ARG HH22 1 107 ILE MD . . 5.500 5.381 5.319 5.443 . 0 0 "[ . 1 . 2]" 1
2626 1 103 GLY H 1 104 ASN H . . 4.260 3.820 2.385 4.218 . 0 0 "[ . 1 . 2]" 1
2627 1 103 GLY QA 1 104 ASN H . . 2.990 2.334 2.180 2.702 . 0 0 "[ . 1 . 2]" 1
2628 1 103 GLY QA 1 104 ASN QB . . 4.780 3.826 3.494 3.992 . 0 0 "[ . 1 . 2]" 1
2629 1 103 GLY QA 1 105 GLU H . . 4.350 3.918 3.507 4.062 . 0 0 "[ . 1 . 2]" 1
2630 1 103 GLY HA2 1 105 GLU H . . 5.140 4.957 4.335 5.138 . 0 0 "[ . 1 . 2]" 1
2631 1 103 GLY HA3 1 105 GLU H . . 5.140 4.110 3.611 4.259 . 0 0 "[ . 1 . 2]" 1
2632 1 104 ASN H 1 104 ASN HB2 . . 4.130 2.935 2.695 3.790 . 0 0 "[ . 1 . 2]" 1
2633 1 104 ASN H 1 104 ASN QB . . 3.390 2.827 2.639 3.054 . 0 0 "[ . 1 . 2]" 1
2634 1 104 ASN H 1 104 ASN HB3 . . 4.130 3.850 3.221 3.978 . 0 0 "[ . 1 . 2]" 1
2635 1 104 ASN H 1 104 ASN HD21 . . 5.500 4.111 3.391 4.845 . 0 0 "[ . 1 . 2]" 1
2636 1 104 ASN H 1 104 ASN QD . . 4.710 3.934 3.333 4.541 . 0 0 "[ . 1 . 2]" 1
2637 1 104 ASN H 1 104 ASN HD22 . . 5.500 5.096 3.943 5.489 . 0 0 "[ . 1 . 2]" 1
2638 1 104 ASN H 1 105 GLU H . . 3.200 2.269 1.897 2.684 . 0 0 "[ . 1 . 2]" 1
2639 1 104 ASN H 1 105 GLU HG2 . . 4.830 2.872 2.495 4.235 . 0 0 "[ . 1 . 2]" 1
2640 1 104 ASN QB 1 104 ASN QD . . 3.050 2.236 2.063 2.557 . 0 0 "[ . 1 . 2]" 1
2641 1 104 ASN QB 1 105 GLU H . . 3.860 3.818 3.742 3.875 0.015 5 0 "[ . 1 . 2]" 1
2642 1 104 ASN QB 1 105 GLU HG2 . . 4.330 3.935 3.744 4.338 0.008 5 0 "[ . 1 . 2]" 1
2643 1 104 ASN HB2 1 105 GLU H . . 4.480 4.233 4.169 4.312 . 0 0 "[ . 1 . 2]" 1
2644 1 104 ASN HB2 1 105 GLU HG2 . . 5.040 4.206 3.927 5.015 . 0 0 "[ . 1 . 2]" 1
2645 1 104 ASN HB3 1 105 GLU H . . 4.480 4.353 4.107 4.433 . 0 0 "[ . 1 . 2]" 1
2646 1 104 ASN HB3 1 105 GLU HG2 . . 5.040 4.840 4.717 5.045 0.005 5 0 "[ . 1 . 2]" 1
2647 1 105 GLU H 1 105 GLU HB2 . . 4.130 3.902 3.773 3.940 . 0 0 "[ . 1 . 2]" 1
2648 1 105 GLU H 1 105 GLU HG2 . . 3.590 2.766 2.328 3.004 . 0 0 "[ . 1 . 2]" 1
2649 1 105 GLU H 1 105 GLU HG3 . . 4.080 2.900 2.711 3.070 . 0 0 "[ . 1 . 2]" 1
2650 1 105 GLU H 1 106 ASP H . . 4.640 4.366 4.324 4.429 . 0 0 "[ . 1 . 2]" 1
2651 1 105 GLU H 1 107 ILE MD . . 5.450 4.942 4.773 5.277 . 0 0 "[ . 1 . 2]" 1
2652 1 105 GLU HA 1 105 GLU HG2 . . 4.030 3.724 3.625 3.773 . 0 0 "[ . 1 . 2]" 1
2653 1 105 GLU HA 1 106 ASP H . . 2.830 2.467 2.232 2.630 . 0 0 "[ . 1 . 2]" 1
2654 1 105 GLU HA 1 106 ASP HA . . 4.710 4.369 4.332 4.413 . 0 0 "[ . 1 . 2]" 1
2655 1 105 GLU HA 1 106 ASP QB . . 4.660 4.358 4.143 4.660 . 0 0 "[ . 1 . 2]" 1
2656 1 105 GLU HB2 1 106 ASP H . . 3.530 2.305 1.955 2.892 . 0 0 "[ . 1 . 2]" 1
2657 1 105 GLU HB2 1 106 ASP HA . . 5.040 4.536 4.389 4.854 . 0 0 "[ . 1 . 2]" 1
2658 1 105 GLU HB2 1 106 ASP QB . . 5.160 4.775 4.480 5.127 . 0 0 "[ . 1 . 2]" 1
2659 1 105 GLU HB2 1 107 ILE HG12 . . 5.000 4.738 4.269 4.998 . 0 0 "[ . 1 . 2]" 1
2660 1 105 GLU HB2 1 107 ILE HG13 . . 4.770 4.419 3.992 4.626 . 0 0 "[ . 1 . 2]" 1
2661 1 105 GLU HG3 1 106 ASP H . . 4.200 3.914 3.631 4.187 . 0 0 "[ . 1 . 2]" 1
2662 1 105 GLU HG3 1 107 ILE MD . . 3.790 3.225 2.828 3.789 . 0 0 "[ . 1 . 2]" 1
2663 1 105 GLU HG3 1 107 ILE HG12 . . 4.710 3.738 3.338 4.119 . 0 0 "[ . 1 . 2]" 1
2664 1 105 GLU HG3 1 107 ILE HG13 . . 4.530 3.113 2.844 3.585 . 0 0 "[ . 1 . 2]" 1
2665 1 106 ASP H 1 106 ASP HB2 . . 3.920 3.570 2.642 3.720 . 0 0 "[ . 1 . 2]" 1
2666 1 106 ASP H 1 106 ASP QB . . 3.190 2.768 2.502 3.045 . 0 0 "[ . 1 . 2]" 1
2667 1 106 ASP H 1 106 ASP HB3 . . 3.920 2.967 2.550 3.694 . 0 0 "[ . 1 . 2]" 1
2668 1 106 ASP H 1 107 ILE H . . 4.640 4.482 4.343 4.589 . 0 0 "[ . 1 . 2]" 1
2669 1 106 ASP HA 1 107 ILE H . . 2.890 2.176 2.139 2.231 . 0 0 "[ . 1 . 2]" 1
2670 1 106 ASP HA 1 107 ILE HB . . 5.000 4.632 4.564 4.703 . 0 0 "[ . 1 . 2]" 1
2671 1 106 ASP HA 1 107 ILE HG12 . . 5.300 4.967 4.824 5.078 . 0 0 "[ . 1 . 2]" 1
2672 1 106 ASP HA 1 107 ILE HG13 . . 4.710 3.592 3.442 3.742 . 0 0 "[ . 1 . 2]" 1
2673 1 106 ASP QB 1 107 ILE H . . 3.750 3.083 2.855 3.345 . 0 0 "[ . 1 . 2]" 1
2674 1 106 ASP HB2 1 107 ILE H . . 4.530 3.262 2.953 4.183 . 0 0 "[ . 1 . 2]" 1
2675 1 106 ASP HB3 1 107 ILE H . . 4.530 4.049 3.034 4.307 . 0 0 "[ . 1 . 2]" 1
2676 1 107 ILE H 1 107 ILE HB . . 3.540 2.717 2.621 2.810 . 0 0 "[ . 1 . 2]" 1
2677 1 107 ILE H 1 107 ILE MD . . 4.330 4.020 3.837 4.220 . 0 0 "[ . 1 . 2]" 1
2678 1 107 ILE H 1 107 ILE HG12 . . 4.030 3.937 3.751 4.029 . 0 0 "[ . 1 . 2]" 1
2679 1 107 ILE H 1 107 ILE HG13 . . 3.780 2.776 2.523 2.983 . 0 0 "[ . 1 . 2]" 1
2680 1 107 ILE H 1 107 ILE MG . . 3.920 3.883 3.843 3.919 . 0 0 "[ . 1 . 2]" 1
2681 1 107 ILE H 1 108 MET H . . 4.490 4.376 4.232 4.492 0.002 13 0 "[ . 1 . 2]" 1
2682 1 107 ILE HA 1 107 ILE MD . . 3.870 3.860 3.823 3.871 0.001 15 0 "[ . 1 . 2]" 1
2683 1 107 ILE HA 1 107 ILE HG12 . . 3.740 2.594 2.523 2.615 . 0 0 "[ . 1 . 2]" 1
2684 1 107 ILE HA 1 107 ILE HG13 . . 4.090 3.040 2.976 3.113 . 0 0 "[ . 1 . 2]" 1
2685 1 107 ILE HA 1 107 ILE MG . . 3.090 2.344 2.260 2.381 . 0 0 "[ . 1 . 2]" 1
2686 1 107 ILE HA 1 108 MET H . . 2.710 2.178 2.141 2.221 . 0 0 "[ . 1 . 2]" 1
2687 1 107 ILE HA 1 108 MET HA . . 4.810 4.359 4.352 4.384 . 0 0 "[ . 1 . 2]" 1
2688 1 107 ILE HA 1 108 MET HB2 . . 4.600 4.401 4.351 4.523 . 0 0 "[ . 1 . 2]" 1
2689 1 107 ILE HA 1 108 MET HG2 . . 5.300 5.113 4.840 5.255 . 0 0 "[ . 1 . 2]" 1
2690 1 107 ILE HA 1 108 MET HG3 . . 4.710 4.390 4.078 4.618 . 0 0 "[ . 1 . 2]" 1
2691 1 107 ILE HB 1 107 ILE MD . . 3.230 2.302 2.264 2.354 . 0 0 "[ . 1 . 2]" 1
2692 1 107 ILE HB 1 108 MET H . . 4.260 4.052 3.914 4.228 . 0 0 "[ . 1 . 2]" 1
2693 1 107 ILE HB 1 109 ILE MD . . 3.560 3.232 2.980 3.402 . 0 0 "[ . 1 . 2]" 1
2694 1 107 ILE HB 1 109 ILE HG12 . . 4.270 4.184 4.026 4.258 . 0 0 "[ . 1 . 2]" 1
2695 1 107 ILE MD 1 108 MET H . . 5.330 5.044 4.916 5.217 . 0 0 "[ . 1 . 2]" 1
2696 1 107 ILE HG12 1 108 MET H . . 4.640 4.403 4.329 4.532 . 0 0 "[ . 1 . 2]" 1
2697 1 107 ILE HG13 1 108 MET H . . 5.300 5.030 4.978 5.142 . 0 0 "[ . 1 . 2]" 1
2698 1 107 ILE MG 1 108 MET H . . 3.310 2.458 2.055 2.828 . 0 0 "[ . 1 . 2]" 1
2699 1 107 ILE MG 1 108 MET HA . . 4.490 3.983 3.892 4.151 . 0 0 "[ . 1 . 2]" 1
2700 1 107 ILE MG 1 109 ILE H . . 4.710 4.674 4.632 4.712 0.002 6 0 "[ . 1 . 2]" 1
2701 1 108 MET H 1 108 MET HB2 . . 3.200 2.278 2.234 2.385 . 0 0 "[ . 1 . 2]" 1
2702 1 108 MET H 1 108 MET HB3 . . 3.680 3.551 3.525 3.612 . 0 0 "[ . 1 . 2]" 1
2703 1 108 MET H 1 108 MET ME . . 5.350 5.160 5.057 5.268 . 0 0 "[ . 1 . 2]" 1
2704 1 108 MET H 1 108 MET HG2 . . 3.850 3.630 3.492 3.752 . 0 0 "[ . 1 . 2]" 1
2705 1 108 MET H 1 108 MET HG3 . . 4.000 2.938 2.727 3.233 . 0 0 "[ . 1 . 2]" 1
2706 1 108 MET H 1 109 ILE H . . 4.700 4.576 4.546 4.599 . 0 0 "[ . 1 . 2]" 1
2707 1 108 MET HA 1 108 MET ME . . 4.710 3.857 3.639 4.051 . 0 0 "[ . 1 . 2]" 1
2708 1 108 MET HA 1 108 MET HG2 . . 3.850 2.242 2.165 2.336 . 0 0 "[ . 1 . 2]" 1
2709 1 108 MET HA 1 108 MET HG3 . . 3.790 3.196 3.139 3.327 . 0 0 "[ . 1 . 2]" 1
2710 1 108 MET HA 1 109 ILE H . . 2.760 2.203 2.171 2.224 . 0 0 "[ . 1 . 2]" 1
2711 1 108 MET HA 1 109 ILE HA . . 5.170 4.407 4.396 4.425 . 0 0 "[ . 1 . 2]" 1
2712 1 108 MET HA 1 109 ILE HB . . 4.870 4.637 4.590 4.703 . 0 0 "[ . 1 . 2]" 1
2713 1 108 MET HA 1 109 ILE HG12 . . 4.490 3.545 3.423 3.644 . 0 0 "[ . 1 . 2]" 1
2714 1 108 MET HA 1 109 ILE MG . . 5.500 5.435 5.420 5.446 . 0 0 "[ . 1 . 2]" 1
2715 1 108 MET HB2 1 109 ILE H . . 4.480 4.190 4.083 4.280 . 0 0 "[ . 1 . 2]" 1
2716 1 108 MET HB3 1 109 ILE H . . 3.760 3.059 2.960 3.212 . 0 0 "[ . 1 . 2]" 1
2717 1 108 MET HB3 1 109 ILE HA . . 4.710 4.370 4.250 4.460 . 0 0 "[ . 1 . 2]" 1
2718 1 108 MET ME 1 109 ILE H . . 5.040 4.641 4.170 4.916 . 0 0 "[ . 1 . 2]" 1
2719 1 108 MET HG2 1 109 ILE H . . 4.310 3.903 3.785 4.098 . 0 0 "[ . 1 . 2]" 1
2720 1 108 MET HG3 1 109 ILE H . . 5.500 5.055 4.981 5.135 . 0 0 "[ . 1 . 2]" 1
2721 1 109 ILE H 1 109 ILE HB . . 3.360 2.724 2.667 2.835 . 0 0 "[ . 1 . 2]" 1
2722 1 109 ILE H 1 109 ILE MD . . 4.330 3.664 3.600 3.718 . 0 0 "[ . 1 . 2]" 1
2723 1 109 ILE H 1 109 ILE HG12 . . 3.680 2.783 2.671 2.875 . 0 0 "[ . 1 . 2]" 1
2724 1 109 ILE H 1 109 ILE MG . . 4.090 3.890 3.866 3.935 . 0 0 "[ . 1 . 2]" 1
2725 1 109 ILE H 1 110 THR H . . 4.840 3.949 3.864 3.995 . 0 0 "[ . 1 . 2]" 1
2726 1 109 ILE HA 1 109 ILE MD . . 3.050 1.977 1.961 2.092 . 0 0 "[ . 1 . 2]" 1
2727 1 109 ILE HA 1 109 ILE HG12 . . 3.430 3.126 3.095 3.147 . 0 0 "[ . 1 . 2]" 1
2728 1 109 ILE HA 1 109 ILE MG . . 3.090 2.275 2.257 2.306 . 0 0 "[ . 1 . 2]" 1
2729 1 109 ILE HA 1 110 THR H . . 2.690 2.198 2.197 2.199 . 0 0 "[ . 1 . 2]" 1
2730 1 109 ILE HA 1 110 THR HA . . 4.940 4.447 4.445 4.449 . 0 0 "[ . 1 . 2]" 1
2731 1 109 ILE HA 1 110 THR HB . . 5.170 4.838 4.787 4.895 . 0 0 "[ . 1 . 2]" 1
2732 1 109 ILE HB 1 109 ILE MD . . 3.350 3.217 3.215 3.220 . 0 0 "[ . 1 . 2]" 1
2733 1 109 ILE HB 1 110 THR H . . 4.540 4.404 4.373 4.424 . 0 0 "[ . 1 . 2]" 1
2734 1 109 ILE MD 1 110 THR H . . 4.000 3.823 3.767 3.897 . 0 0 "[ . 1 . 2]" 1
2735 1 109 ILE HG12 1 110 THR H . . 5.410 5.178 5.148 5.204 . 0 0 "[ . 1 . 2]" 1
2736 1 109 ILE HG13 1 109 ILE MG . . 2.910 2.287 2.235 2.354 . 0 0 "[ . 1 . 2]" 1
2737 1 109 ILE MG 1 110 THR H . . 3.370 3.240 3.118 3.315 . 0 0 "[ . 1 . 2]" 1
2738 1 109 ILE MG 1 110 THR HA . . 4.460 4.212 4.159 4.241 . 0 0 "[ . 1 . 2]" 1
2739 1 109 ILE MG 1 110 THR HB . . 5.050 4.992 4.903 5.051 0.001 10 0 "[ . 1 . 2]" 1
2740 1 109 ILE MG 1 111 VAL H . . 4.350 4.242 4.099 4.354 0.004 9 0 "[ . 1 . 2]" 1
2741 1 109 ILE MG 1 111 VAL HB . . 5.060 4.189 4.072 4.440 . 0 0 "[ . 1 . 2]" 1
2742 1 109 ILE MG 1 111 VAL MG2 . . 2.590 2.054 1.953 2.193 . 0 0 "[ . 1 . 2]" 1
2743 1 110 THR H 1 110 THR HB . . 3.000 2.666 2.609 2.726 . 0 0 "[ . 1 . 2]" 1
2744 1 110 THR H 1 110 THR MG . . 3.950 3.796 3.788 3.802 . 0 0 "[ . 1 . 2]" 1
2745 1 110 THR H 1 111 VAL MG2 . . 4.360 4.111 4.056 4.213 . 0 0 "[ . 1 . 2]" 1
2746 1 110 THR HA 1 110 THR MG . . 3.100 2.264 2.216 2.361 . 0 0 "[ . 1 . 2]" 1
2747 1 110 THR HA 1 111 VAL H . . 2.800 2.143 2.141 2.148 . 0 0 "[ . 1 . 2]" 1
2748 1 110 THR HA 1 111 VAL HA . . 5.300 4.396 4.394 4.399 . 0 0 "[ . 1 . 2]" 1
2749 1 110 THR HA 1 111 VAL HB . . 4.770 4.613 4.591 4.645 . 0 0 "[ . 1 . 2]" 1
2750 1 110 THR HA 1 111 VAL MG2 . . 4.200 3.735 3.692 3.774 . 0 0 "[ . 1 . 2]" 1
2751 1 110 THR HB 1 111 VAL H . . 4.650 4.197 4.133 4.253 . 0 0 "[ . 1 . 2]" 1
2752 1 110 THR HB 1 111 VAL HA . . 5.500 4.629 4.578 4.684 . 0 0 "[ . 1 . 2]" 1
2753 1 110 THR HB 1 111 VAL MG2 . . 5.500 4.813 4.740 4.912 . 0 0 "[ . 1 . 2]" 1
2754 1 110 THR HB 1 112 ILE MD . . 5.500 4.649 4.444 4.772 . 0 0 "[ . 1 . 2]" 1
2755 1 110 THR MG 1 111 VAL H . . 3.260 2.928 2.800 3.038 . 0 0 "[ . 1 . 2]" 1
2756 1 110 THR MG 1 111 VAL HA . . 4.170 3.862 3.734 3.976 . 0 0 "[ . 1 . 2]" 1
2757 1 110 THR MG 1 111 VAL HB . . 5.500 5.047 4.898 5.120 . 0 0 "[ . 1 . 2]" 1
2758 1 110 THR MG 1 112 ILE H . . 4.850 4.735 4.621 4.813 . 0 0 "[ . 1 . 2]" 1
2759 1 110 THR MG 1 112 ILE HG12 . . 3.600 3.585 3.473 3.602 0.002 19 0 "[ . 1 . 2]" 1
2760 1 111 VAL H 1 111 VAL HB . . 3.370 2.655 2.615 2.693 . 0 0 "[ . 1 . 2]" 1
2761 1 111 VAL H 1 111 VAL MG1 . . 4.330 3.851 3.834 3.865 . 0 0 "[ . 1 . 2]" 1
2762 1 111 VAL H 1 111 VAL MG2 . . 3.590 2.820 2.780 2.869 . 0 0 "[ . 1 . 2]" 1
2763 1 111 VAL H 1 112 ILE H . . 4.640 4.432 4.414 4.456 . 0 0 "[ . 1 . 2]" 1
2764 1 111 VAL H 1 112 ILE MD . . 4.490 3.846 3.683 3.997 . 0 0 "[ . 1 . 2]" 1
2765 1 111 VAL H 1 112 ILE HG12 . . 5.500 4.946 4.879 4.996 . 0 0 "[ . 1 . 2]" 1
2766 1 111 VAL HA 1 111 VAL MG1 . . 3.160 2.333 2.327 2.345 . 0 0 "[ . 1 . 2]" 1
2767 1 111 VAL HA 1 111 VAL MG2 . . 3.030 2.410 2.375 2.420 . 0 0 "[ . 1 . 2]" 1
2768 1 111 VAL HA 1 112 ILE H . . 2.770 2.219 2.200 2.225 . 0 0 "[ . 1 . 2]" 1
2769 1 111 VAL HA 1 112 ILE HB . . 4.870 4.710 4.686 4.735 . 0 0 "[ . 1 . 2]" 1
2770 1 111 VAL HA 1 112 ILE MD . . 4.090 3.888 3.777 4.029 . 0 0 "[ . 1 . 2]" 1
2771 1 111 VAL HA 1 112 ILE HG12 . . 4.490 3.501 3.449 3.558 . 0 0 "[ . 1 . 2]" 1
2772 1 111 VAL HB 1 112 ILE H . . 4.430 3.991 3.971 4.044 . 0 0 "[ . 1 . 2]" 1
2773 1 111 VAL HB 1 112 ILE MD . . 5.330 4.984 4.823 5.098 . 0 0 "[ . 1 . 2]" 1
2774 1 111 VAL MG1 1 112 ILE H . . 3.310 2.061 2.015 2.181 . 0 0 "[ . 1 . 2]" 1
2775 1 111 VAL MG1 1 112 ILE HB . . 4.490 4.238 4.190 4.316 . 0 0 "[ . 1 . 2]" 1
2776 1 111 VAL MG1 1 113 PRO HA . . 4.000 3.507 3.493 3.552 . 0 0 "[ . 1 . 2]" 1
2777 1 111 VAL MG1 1 113 PRO HB3 . . 4.090 3.409 3.373 3.427 . 0 0 "[ . 1 . 2]" 1
2778 1 111 VAL MG1 1 113 PRO HD2 . . 4.500 3.865 3.752 3.910 . 0 0 "[ . 1 . 2]" 1
2779 1 111 VAL MG2 1 112 ILE H . . 3.920 3.863 3.836 3.893 . 0 0 "[ . 1 . 2]" 1
2780 1 112 ILE H 1 112 ILE HB . . 3.160 2.689 2.651 2.743 . 0 0 "[ . 1 . 2]" 1
2781 1 112 ILE H 1 112 ILE MD . . 3.610 3.409 3.334 3.487 . 0 0 "[ . 1 . 2]" 1
2782 1 112 ILE H 1 112 ILE HG12 . . 3.780 2.584 2.509 2.619 . 0 0 "[ . 1 . 2]" 1
2783 1 112 ILE H 1 112 ILE HG13 . . 4.090 4.022 3.962 4.062 . 0 0 "[ . 1 . 2]" 1
2784 1 112 ILE H 1 112 ILE MG . . 3.920 3.870 3.855 3.891 . 0 0 "[ . 1 . 2]" 1
2785 1 112 ILE H 1 113 PRO HD2 . . 4.640 4.365 4.341 4.388 . 0 0 "[ . 1 . 2]" 1
2786 1 112 ILE H 1 113 PRO HD3 . . 4.990 3.786 3.743 3.825 . 0 0 "[ . 1 . 2]" 1
2787 1 112 ILE HB 1 112 ILE MD . . 3.250 3.222 3.215 3.229 . 0 0 "[ . 1 . 2]" 1
2788 1 112 ILE MD 1 112 ILE MG . . 2.660 2.085 2.032 2.164 . 0 0 "[ . 1 . 2]" 1
2789 1 112 ILE MD 1 113 PRO HD2 . . 4.130 3.403 3.291 3.483 . 0 0 "[ . 1 . 2]" 1
2790 1 112 ILE MD 1 113 PRO HD3 . . 4.330 4.119 4.010 4.170 . 0 0 "[ . 1 . 2]" 1
2791 1 112 ILE MD 1 113 PRO HG2 . . 5.350 5.288 5.198 5.351 0.001 14 0 "[ . 1 . 2]" 1
2792 1 112 ILE HG12 1 112 ILE MG . . 3.290 3.183 3.182 3.183 . 0 0 "[ . 1 . 2]" 1
2793 1 112 ILE HG13 1 112 ILE MG . . 3.110 2.267 2.254 2.273 . 0 0 "[ . 1 . 2]" 1
2794 1 112 ILE MG 1 113 PRO HA . . 5.040 4.534 4.497 4.585 . 0 0 "[ . 1 . 2]" 1
2795 1 112 ILE MG 1 113 PRO HB2 . . 5.500 5.420 5.388 5.457 . 0 0 "[ . 1 . 2]" 1
2796 1 112 ILE MG 1 113 PRO HD2 . . 4.020 3.120 3.079 3.143 . 0 0 "[ . 1 . 2]" 1
2797 1 112 ILE MG 1 113 PRO HD3 . . 4.170 4.239 4.221 4.245 0.075 5 0 "[ . 1 . 2]" 1
2798 1 112 ILE MG 1 113 PRO HG2 . . 4.490 4.385 4.359 4.396 . 0 0 "[ . 1 . 2]" 1
2799 1 112 ILE MG 1 113 PRO HG3 . . 5.410 5.325 5.304 5.331 . 0 0 "[ . 1 . 2]" 1
2800 1 112 ILE MG 1 114 GLU QG . . 4.920 3.862 3.527 4.351 . 0 0 "[ . 1 . 2]" 1
2801 1 113 PRO HA 1 114 GLU H . . 2.990 2.167 2.155 2.211 . 0 0 "[ . 1 . 2]" 1
2802 1 113 PRO HA 1 114 GLU HB2 . . 5.000 4.789 4.767 4.803 . 0 0 "[ . 1 . 2]" 1
2803 1 113 PRO HA 1 114 GLU QG . . 4.390 3.540 3.446 3.655 . 0 0 "[ . 1 . 2]" 1
2804 1 113 PRO HB2 1 114 GLU H . . 3.540 3.441 3.191 3.520 . 0 0 "[ . 1 . 2]" 1
2805 1 113 PRO HB3 1 114 GLU H . . 4.030 3.941 3.780 3.992 . 0 0 "[ . 1 . 2]" 1
2806 1 114 GLU H 1 114 GLU HB2 . . 3.610 2.662 2.638 2.711 . 0 0 "[ . 1 . 2]" 1
2807 1 114 GLU H 1 114 GLU HB3 . . 3.740 3.676 3.655 3.742 0.002 17 0 "[ . 1 . 2]" 1
2808 1 114 GLU H 1 114 GLU QG . . 3.820 2.274 2.127 2.614 . 0 0 "[ . 1 . 2]" 1
2809 1 114 GLU H 1 115 GLU H . . 4.640 4.546 4.490 4.566 . 0 0 "[ . 1 . 2]" 1
2810 1 114 GLU HA 1 114 GLU QG . . 3.710 2.764 2.510 3.121 . 0 0 "[ . 1 . 2]" 1
2811 1 114 GLU HB2 1 115 GLU H . . 3.870 3.865 3.832 3.879 0.009 12 0 "[ . 1 . 2]" 1
2812 1 114 GLU HB2 1 116 ILE MG . . 4.330 3.021 2.987 3.110 . 0 0 "[ . 1 . 2]" 1
2813 1 114 GLU HB3 1 115 GLU H . . 3.050 3.008 2.953 3.057 0.007 12 0 "[ . 1 . 2]" 1
2814 1 115 GLU H 1 115 GLU HB2 . . 3.360 2.537 2.101 2.675 . 0 0 "[ . 1 . 2]" 1
2815 1 115 GLU H 1 115 GLU HB3 . . 3.750 3.560 3.307 3.622 . 0 0 "[ . 1 . 2]" 1
2816 1 115 GLU H 1 115 GLU HG2 . . 4.200 3.448 2.555 4.158 . 0 0 "[ . 1 . 2]" 1
2817 1 115 GLU H 1 115 GLU QG . . 3.410 2.569 2.246 3.383 . 0 0 "[ . 1 . 2]" 1
2818 1 115 GLU H 1 115 GLU HG3 . . 4.200 2.701 2.410 3.582 . 0 0 "[ . 1 . 2]" 1
2819 1 115 GLU H 1 116 ILE MG . . 4.640 4.391 4.329 4.496 . 0 0 "[ . 1 . 2]" 1
2820 1 115 GLU HA 1 115 GLU HG2 . . 4.000 2.862 2.086 3.492 . 0 0 "[ . 1 . 2]" 1
2821 1 115 GLU HA 1 115 GLU QG . . 3.460 2.432 2.066 2.549 . 0 0 "[ . 1 . 2]" 1
2822 1 115 GLU HA 1 115 GLU HG3 . . 4.000 3.044 2.606 3.682 . 0 0 "[ . 1 . 2]" 1
2823 1 115 GLU HA 1 116 ILE H . . 2.830 2.148 2.139 2.151 . 0 0 "[ . 1 . 2]" 1
2824 1 115 GLU HA 1 116 ILE HG12 . . 4.710 4.044 4.012 4.126 . 0 0 "[ . 1 . 2]" 1
2825 1 115 GLU HA 1 116 ILE MG . . 4.490 3.848 3.795 3.918 . 0 0 "[ . 1 . 2]" 1
2826 1 115 GLU HB2 1 116 ILE H . . 4.720 4.332 4.228 4.589 . 0 0 "[ . 1 . 2]" 1
2827 1 115 GLU HB3 1 116 ILE H . . 4.100 3.697 3.614 3.831 . 0 0 "[ . 1 . 2]" 1
2828 1 115 GLU QG 1 116 ILE H . . 4.600 4.278 3.449 4.496 . 0 0 "[ . 1 . 2]" 1
2829 1 116 ILE H 1 116 ILE HB . . 3.790 3.730 3.706 3.759 . 0 0 "[ . 1 . 2]" 1
2830 1 116 ILE H 1 116 ILE MD . . 4.330 3.826 3.805 3.877 . 0 0 "[ . 1 . 2]" 1
2831 1 116 ILE H 1 116 ILE HG12 . . 3.490 2.234 2.179 2.362 . 0 0 "[ . 1 . 2]" 1
2832 1 116 ILE H 1 116 ILE HG13 . . 3.720 2.719 2.556 2.803 . 0 0 "[ . 1 . 2]" 1
2833 1 116 ILE H 1 116 ILE MG . . 3.640 2.697 2.666 2.816 . 0 0 "[ . 1 . 2]" 1
2834 1 116 ILE H 1 117 ASP H . . 4.580 4.523 4.495 4.541 . 0 0 "[ . 1 . 2]" 1
2835 1 116 ILE HA 1 116 ILE MD . . 4.330 4.154 4.130 4.167 . 0 0 "[ . 1 . 2]" 1
2836 1 116 ILE HA 1 116 ILE HG12 . . 4.200 3.810 3.790 3.853 . 0 0 "[ . 1 . 2]" 1
2837 1 116 ILE HA 1 116 ILE MG . . 3.160 2.350 2.305 2.378 . 0 0 "[ . 1 . 2]" 1
2838 1 116 ILE HA 1 117 ASP H . . 2.910 2.284 2.261 2.314 . 0 0 "[ . 1 . 2]" 1
2839 1 116 ILE HA 1 117 ASP QB . . 4.910 4.301 4.243 4.361 . 0 0 "[ . 1 . 2]" 1
2840 1 116 ILE HB 1 116 ILE MD . . 3.000 2.250 2.177 2.309 . 0 0 "[ . 1 . 2]" 1
2841 1 116 ILE HB 1 117 ASP H . . 3.240 2.684 2.599 2.751 . 0 0 "[ . 1 . 2]" 1
2842 1 116 ILE HB 1 117 ASP QB . . 4.910 4.196 3.967 4.488 . 0 0 "[ . 1 . 2]" 1
2843 1 116 ILE MD 1 117 ASP H . . 4.430 4.315 4.176 4.342 . 0 0 "[ . 1 . 2]" 1
2844 1 116 ILE HG12 1 117 ASP H . . 5.010 4.965 4.879 5.029 0.019 17 0 "[ . 1 . 2]" 1
2845 1 116 ILE HG13 1 116 ILE MG . . 3.600 3.187 3.165 3.195 . 0 0 "[ . 1 . 2]" 1
2846 1 116 ILE HG13 1 117 ASP H . . 4.140 3.957 3.860 4.026 . 0 0 "[ . 1 . 2]" 1
2847 1 116 ILE MG 1 117 ASP H . . 3.740 3.734 3.699 3.746 0.006 17 0 "[ . 1 . 2]" 1
2848 1 116 ILE MG 1 117 ASP QB . . 5.340 5.124 5.021 5.265 . 0 0 "[ . 1 . 2]" 1
2849 1 117 ASP H 1 117 ASP HB2 . . 3.780 2.667 2.157 3.516 . 0 0 "[ . 1 . 2]" 1
2850 1 117 ASP H 1 117 ASP QB . . 3.140 2.190 2.137 2.222 . 0 0 "[ . 1 . 2]" 1
2851 1 117 ASP H 1 117 ASP HB3 . . 3.780 3.057 2.210 3.532 . 0 0 "[ . 1 . 2]" 1
2852 1 117 ASP H 1 118 PRO HD2 . . 5.000 4.722 4.712 4.743 . 0 0 "[ . 1 . 2]" 1
2853 1 117 ASP H 1 118 PRO HD3 . . 5.040 5.035 5.016 5.047 0.007 17 0 "[ . 1 . 2]" 1
2854 1 117 ASP HA 1 118 PRO HG2 . . 4.710 4.579 4.537 4.603 . 0 0 "[ . 1 . 2]" 1
2855 1 117 ASP HA 1 118 PRO HG3 . . 4.710 4.523 4.489 4.541 . 0 0 "[ . 1 . 2]" 1
2856 1 117 ASP QB 1 118 PRO HD2 . . 3.430 2.015 1.955 2.139 . 0 0 "[ . 1 . 2]" 1
2857 1 117 ASP QB 1 118 PRO HD3 . . 3.790 3.352 3.258 3.468 . 0 0 "[ . 1 . 2]" 1
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