Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
606564 | 2nco RC | 26723 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2nco
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 1850
_Distance_constraint_stats_list.Viol_count 1134
_Distance_constraint_stats_list.Viol_total 284.659
_Distance_constraint_stats_list.Viol_max 0.258
_Distance_constraint_stats_list.Viol_rms 0.0043
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0004
_Distance_constraint_stats_list.Viol_average_violations_only 0.0126
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 3 LYS 0.235 0.153 5 0 "[ . 1 . 2]"
1 4 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 5 LYS 0.162 0.051 1 0 "[ . 1 . 2]"
1 6 TYR 1.279 0.051 1 0 "[ . 1 . 2]"
1 7 ASN 0.392 0.047 15 0 "[ . 1 . 2]"
1 8 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 GLU 0.264 0.139 15 0 "[ . 1 . 2]"
1 10 VAL 1.063 0.050 14 0 "[ . 1 . 2]"
1 11 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 ALA 0.029 0.008 16 0 "[ . 1 . 2]"
1 13 LYS 0.065 0.009 17 0 "[ . 1 . 2]"
1 14 LEU 0.036 0.008 16 0 "[ . 1 . 2]"
1 15 ASP 0.108 0.025 11 0 "[ . 1 . 2]"
1 16 VAL 0.057 0.025 8 0 "[ . 1 . 2]"
1 17 ALA 0.108 0.013 12 0 "[ . 1 . 2]"
1 18 ARG 0.562 0.106 12 0 "[ . 1 . 2]"
1 19 ARG 0.431 0.106 12 0 "[ . 1 . 2]"
1 20 LEU 0.365 0.118 18 0 "[ . 1 . 2]"
1 21 PHE 0.439 0.073 18 0 "[ . 1 . 2]"
1 22 LYS 0.053 0.026 18 0 "[ . 1 . 2]"
1 23 ARG 0.028 0.010 16 0 "[ . 1 . 2]"
1 24 TYR 0.454 0.118 18 0 "[ . 1 . 2]"
1 25 ASP 0.114 0.016 16 0 "[ . 1 . 2]"
1 26 LYS 0.208 0.063 5 0 "[ . 1 . 2]"
1 27 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 GLY 0.019 0.019 18 0 "[ . 1 . 2]"
1 31 GLN 0.112 0.063 18 0 "[ . 1 . 2]"
1 32 LEU 0.478 0.073 18 0 "[ . 1 . 2]"
1 33 GLN 0.084 0.043 2 0 "[ . 1 . 2]"
1 34 ASP 0.031 0.008 9 0 "[ . 1 . 2]"
1 35 ASP 0.003 0.002 10 0 "[ . 1 . 2]"
1 36 GLU 0.110 0.023 16 0 "[ . 1 . 2]"
1 37 ILE 0.308 0.031 18 0 "[ . 1 . 2]"
1 38 ALA 0.290 0.021 14 0 "[ . 1 . 2]"
1 39 GLY 0.064 0.026 18 0 "[ . 1 . 2]"
1 40 LEU 0.288 0.037 18 0 "[ . 1 . 2]"
1 41 LEU 1.138 0.062 16 0 "[ . 1 . 2]"
1 42 LYS 0.217 0.015 16 0 "[ . 1 . 2]"
1 43 ASP 0.010 0.010 18 0 "[ . 1 . 2]"
1 44 THR 0.535 0.049 18 0 "[ . 1 . 2]"
1 45 TYR 1.215 0.037 14 0 "[ . 1 . 2]"
1 46 ALA 0.117 0.020 16 0 "[ . 1 . 2]"
1 47 GLU 0.059 0.025 8 0 "[ . 1 . 2]"
1 48 MET 0.092 0.012 8 0 "[ . 1 . 2]"
1 49 GLY 0.117 0.020 16 0 "[ . 1 . 2]"
1 50 MET 0.304 0.032 17 0 "[ . 1 . 2]"
1 51 SER 0.005 0.003 8 0 "[ . 1 . 2]"
1 52 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 PHE 1.062 0.037 14 0 "[ . 1 . 2]"
1 54 THR 0.251 0.018 10 0 "[ . 1 . 2]"
1 55 PRO 0.738 0.062 16 0 "[ . 1 . 2]"
1 56 THR 0.091 0.031 13 0 "[ . 1 . 2]"
1 57 LYS 0.434 0.033 15 0 "[ . 1 . 2]"
1 58 GLU 0.375 0.174 16 0 "[ . 1 . 2]"
1 59 ASP 0.022 0.017 15 0 "[ . 1 . 2]"
1 60 VAL 0.610 0.057 16 0 "[ . 1 . 2]"
1 61 LYS 0.007 0.005 20 0 "[ . 1 . 2]"
1 62 ILE 0.265 0.104 12 0 "[ . 1 . 2]"
1 63 TRP 0.902 0.063 8 0 "[ . 1 . 2]"
1 64 LEU 0.049 0.010 18 0 "[ . 1 . 2]"
1 65 GLN 0.132 0.104 12 0 "[ . 1 . 2]"
1 66 MET 0.139 0.063 8 0 "[ . 1 . 2]"
1 67 ALA 0.016 0.004 13 0 "[ . 1 . 2]"
1 68 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 ASN 0.069 0.068 18 0 "[ . 1 . 2]"
1 74 SER 0.033 0.007 12 0 "[ . 1 . 2]"
1 75 VAL 0.047 0.021 16 0 "[ . 1 . 2]"
1 76 SER 0.131 0.063 18 0 "[ . 1 . 2]"
1 77 LEU 0.374 0.056 6 0 "[ . 1 . 2]"
1 78 GLU 0.129 0.056 6 0 "[ . 1 . 2]"
1 79 GLU 0.085 0.034 11 0 "[ . 1 . 2]"
1 80 TYR 0.471 0.034 6 0 "[ . 1 . 2]"
1 81 GLU 0.732 0.136 4 0 "[ . 1 . 2]"
1 82 ASP 0.713 0.136 4 0 "[ . 1 . 2]"
1 83 LEU 0.005 0.002 1 0 "[ . 1 . 2]"
1 84 ILE 0.104 0.012 18 0 "[ . 1 . 2]"
1 85 ILE 0.244 0.018 17 0 "[ . 1 . 2]"
1 86 LYS 0.055 0.012 13 0 "[ . 1 . 2]"
1 87 SER 0.112 0.016 4 0 "[ . 1 . 2]"
1 88 LEU 0.570 0.084 2 0 "[ . 1 . 2]"
1 89 GLN 0.176 0.026 2 0 "[ . 1 . 2]"
1 90 LYS 0.605 0.088 19 0 "[ . 1 . 2]"
1 91 ALA 0.249 0.020 9 0 "[ . 1 . 2]"
1 92 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 ILE 0.572 0.061 2 0 "[ . 1 . 2]"
1 94 ARG 0.115 0.016 9 0 "[ . 1 . 2]"
1 95 VAL 0.884 0.062 13 0 "[ . 1 . 2]"
1 96 GLU 1.698 0.258 14 0 "[ . 1 . 2]"
1 97 LYS 0.697 0.181 9 0 "[ . 1 . 2]"
1 98 GLN 0.073 0.017 10 0 "[ . 1 . 2]"
1 99 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 3 LYS HA 1 3 LYS QD . . 4.010 3.356 1.976 4.163 0.153 5 0 "[ . 1 . 2]" 1
2 1 3 LYS HA 1 3 LYS QE . . 3.910 3.782 3.511 3.969 0.059 5 0 "[ . 1 . 2]" 1
3 1 3 LYS HA 1 4 PRO HA . . 4.600 4.389 4.387 4.415 . 0 0 "[ . 1 . 2]" 1
4 1 3 LYS HA 1 4 PRO HB3 . . 4.990 4.867 4.834 4.872 . 0 0 "[ . 1 . 2]" 1
5 1 3 LYS HA 1 4 PRO HD2 . . 2.970 2.487 2.151 2.519 . 0 0 "[ . 1 . 2]" 1
6 1 3 LYS HA 1 4 PRO HD3 . . 2.970 2.342 2.255 2.354 . 0 0 "[ . 1 . 2]" 1
7 1 3 LYS HA 1 4 PRO QG . . 4.550 4.059 3.859 4.079 . 0 0 "[ . 1 . 2]" 1
8 1 3 LYS QB 1 4 PRO QD . . 3.520 2.136 1.938 3.250 . 0 0 "[ . 1 . 2]" 1
9 1 3 LYS HB2 1 4 PRO HD2 . . 5.070 3.539 1.974 3.661 . 0 0 "[ . 1 . 2]" 1
10 1 3 LYS HB2 1 4 PRO HD3 . . 5.070 4.623 3.428 4.707 . 0 0 "[ . 1 . 2]" 1
11 1 3 LYS HB3 1 4 PRO HD2 . . 5.070 2.261 1.985 4.012 . 0 0 "[ . 1 . 2]" 1
12 1 3 LYS HB3 1 4 PRO HD3 . . 5.070 3.638 3.435 4.920 . 0 0 "[ . 1 . 2]" 1
13 1 3 LYS QD 1 4 PRO QD . . 4.580 3.418 1.877 4.426 . 0 0 "[ . 1 . 2]" 1
14 1 3 LYS QG 1 4 PRO QD . . 4.040 2.417 1.969 3.657 . 0 0 "[ . 1 . 2]" 1
15 1 3 LYS HG2 1 4 PRO HD2 . . 5.500 2.880 2.015 4.520 . 0 0 "[ . 1 . 2]" 1
16 1 3 LYS HG2 1 4 PRO HD3 . . 5.500 3.993 3.227 5.351 . 0 0 "[ . 1 . 2]" 1
17 1 3 LYS HG3 1 4 PRO HD2 . . 5.500 3.141 1.991 4.076 . 0 0 "[ . 1 . 2]" 1
18 1 3 LYS HG3 1 4 PRO HD3 . . 5.500 4.009 2.976 5.397 . 0 0 "[ . 1 . 2]" 1
19 1 4 PRO HA 1 5 LYS H . . 2.600 2.297 2.160 2.414 . 0 0 "[ . 1 . 2]" 1
20 1 4 PRO HA 1 6 TYR QD . . 5.370 4.605 4.395 4.902 . 0 0 "[ . 1 . 2]" 1
21 1 4 PRO HB2 1 6 TYR QD . . 4.790 4.279 3.645 4.747 . 0 0 "[ . 1 . 2]" 1
22 1 4 PRO HB2 1 6 TYR QE . . 5.130 3.778 3.036 4.373 . 0 0 "[ . 1 . 2]" 1
23 1 4 PRO HB3 1 6 TYR QD . . 5.360 5.016 4.605 5.354 . 0 0 "[ . 1 . 2]" 1
24 1 4 PRO HB3 1 6 TYR QE . . 4.200 3.672 3.064 4.060 . 0 0 "[ . 1 . 2]" 1
25 1 4 PRO HB3 1 14 LEU QD . . 5.370 3.315 2.855 3.946 . 0 0 "[ . 1 . 2]" 1
26 1 5 LYS H 1 5 LYS HB3 . . 3.490 3.279 3.205 3.381 . 0 0 "[ . 1 . 2]" 1
27 1 5 LYS H 1 5 LYS QG . . 4.400 3.979 3.759 4.258 . 0 0 "[ . 1 . 2]" 1
28 1 5 LYS H 1 6 TYR H . . 4.060 4.024 3.932 4.069 0.009 10 0 "[ . 1 . 2]" 1
29 1 5 LYS HA 1 5 LYS QD . . 4.730 3.031 2.013 4.004 . 0 0 "[ . 1 . 2]" 1
30 1 5 LYS HA 1 5 LYS HG2 . . 3.900 2.847 2.162 3.580 . 0 0 "[ . 1 . 2]" 1
31 1 5 LYS HA 1 5 LYS QG . . 3.360 2.235 2.060 2.454 . 0 0 "[ . 1 . 2]" 1
32 1 5 LYS HA 1 5 LYS HG3 . . 3.900 2.669 2.077 3.575 . 0 0 "[ . 1 . 2]" 1
33 1 5 LYS HA 1 6 TYR H . . 3.260 2.189 2.187 2.193 . 0 0 "[ . 1 . 2]" 1
34 1 5 LYS HB2 1 5 LYS QE . . 4.360 3.475 2.192 4.325 . 0 0 "[ . 1 . 2]" 1
35 1 5 LYS HB2 1 6 TYR QD . . 5.500 5.304 5.226 5.420 . 0 0 "[ . 1 . 2]" 1
36 1 5 LYS HB2 1 6 TYR QE . . 5.500 5.479 5.407 5.517 0.017 13 0 "[ . 1 . 2]" 1
37 1 5 LYS HB2 1 98 GLN QG . . 5.340 4.807 3.893 5.351 0.011 1 0 "[ . 1 . 2]" 1
38 1 5 LYS HB3 1 5 LYS QE . . 4.710 3.701 2.559 4.418 . 0 0 "[ . 1 . 2]" 1
39 1 5 LYS HB3 1 6 TYR H . . 4.270 4.048 4.007 4.078 . 0 0 "[ . 1 . 2]" 1
40 1 5 LYS HB3 1 6 TYR QD . . 4.690 4.634 4.560 4.741 0.051 1 0 "[ . 1 . 2]" 1
41 1 5 LYS HB3 1 6 TYR QE . . 5.500 5.454 5.384 5.520 0.020 1 0 "[ . 1 . 2]" 1
42 1 5 LYS HB3 1 98 GLN QG . . 4.610 3.291 2.424 3.787 . 0 0 "[ . 1 . 2]" 1
43 1 5 LYS QE 1 5 LYS QG . . 3.280 2.161 1.956 2.826 . 0 0 "[ . 1 . 2]" 1
44 1 5 LYS QG 1 6 TYR H . . 4.640 3.818 3.614 4.325 . 0 0 "[ . 1 . 2]" 1
45 1 6 TYR H 1 6 TYR HB2 . . 3.840 2.820 2.762 2.870 . 0 0 "[ . 1 . 2]" 1
46 1 6 TYR H 1 6 TYR HB3 . . 4.160 3.850 3.823 3.873 . 0 0 "[ . 1 . 2]" 1
47 1 6 TYR H 1 6 TYR QD . . 3.750 3.557 3.500 3.604 . 0 0 "[ . 1 . 2]" 1
48 1 6 TYR H 1 11 GLU QG . . 4.660 3.053 2.646 3.479 . 0 0 "[ . 1 . 2]" 1
49 1 6 TYR H 1 98 GLN QG . . 3.800 3.542 2.913 3.804 0.004 2 0 "[ . 1 . 2]" 1
50 1 6 TYR HA 1 6 TYR QD . . 2.830 2.249 2.134 2.361 . 0 0 "[ . 1 . 2]" 1
51 1 6 TYR HA 1 6 TYR QE . . 4.590 4.524 4.447 4.584 . 0 0 "[ . 1 . 2]" 1
52 1 6 TYR HA 1 7 ASN H . . 3.460 2.525 2.449 2.584 . 0 0 "[ . 1 . 2]" 1
53 1 6 TYR HA 1 10 VAL HB . . 5.370 5.194 5.071 5.348 . 0 0 "[ . 1 . 2]" 1
54 1 6 TYR HA 1 10 VAL MG1 . . 5.420 5.450 5.396 5.470 0.050 14 0 "[ . 1 . 2]" 1
55 1 6 TYR HA 1 95 VAL QG . . 4.780 3.980 3.805 4.167 . 0 0 "[ . 1 . 2]" 1
56 1 6 TYR HA 1 97 LYS HA . . 3.080 2.623 2.533 2.734 . 0 0 "[ . 1 . 2]" 1
57 1 6 TYR HA 1 97 LYS HB2 . . 5.500 5.396 5.027 5.513 0.013 10 0 "[ . 1 . 2]" 1
58 1 6 TYR HA 1 97 LYS HB3 . . 5.500 5.273 4.574 5.504 0.004 16 0 "[ . 1 . 2]" 1
59 1 6 TYR HA 1 98 GLN H . . 4.100 2.724 2.182 3.431 . 0 0 "[ . 1 . 2]" 1
60 1 6 TYR HA 1 98 GLN QG . . 3.790 2.456 2.351 2.584 . 0 0 "[ . 1 . 2]" 1
61 1 6 TYR HB2 1 7 ASN H . . 3.700 3.198 3.084 3.317 . 0 0 "[ . 1 . 2]" 1
62 1 6 TYR HB2 1 10 VAL H . . 5.500 4.509 4.416 4.636 . 0 0 "[ . 1 . 2]" 1
63 1 6 TYR HB2 1 10 VAL HB . . 4.180 2.727 2.502 2.944 . 0 0 "[ . 1 . 2]" 1
64 1 6 TYR HB2 1 10 VAL MG1 . . 3.780 3.004 2.920 3.177 . 0 0 "[ . 1 . 2]" 1
65 1 6 TYR HB2 1 10 VAL MG2 . . 4.320 3.952 3.486 4.202 . 0 0 "[ . 1 . 2]" 1
66 1 6 TYR HB2 1 11 GLU QG . . 4.340 3.087 2.743 3.626 . 0 0 "[ . 1 . 2]" 1
67 1 6 TYR HB2 1 14 LEU QD . . 4.740 3.905 3.624 4.140 . 0 0 "[ . 1 . 2]" 1
68 1 6 TYR HB2 1 98 GLN QG . . 5.340 4.658 4.470 4.914 . 0 0 "[ . 1 . 2]" 1
69 1 6 TYR HB3 1 7 ASN H . . 3.300 2.266 2.154 2.417 . 0 0 "[ . 1 . 2]" 1
70 1 6 TYR HB3 1 7 ASN QD . . 4.970 3.847 2.917 4.263 . 0 0 "[ . 1 . 2]" 1
71 1 6 TYR HB3 1 10 VAL HB . . 3.970 3.165 3.043 3.316 . 0 0 "[ . 1 . 2]" 1
72 1 6 TYR HB3 1 10 VAL MG1 . . 3.670 3.618 3.490 3.682 0.012 15 0 "[ . 1 . 2]" 1
73 1 6 TYR HB3 1 10 VAL MG2 . . 4.220 3.556 3.187 3.922 . 0 0 "[ . 1 . 2]" 1
74 1 6 TYR HB3 1 95 VAL QG . . 4.630 2.258 2.058 2.436 . 0 0 "[ . 1 . 2]" 1
75 1 6 TYR HB3 1 97 LYS HA . . 4.760 4.196 4.039 4.417 . 0 0 "[ . 1 . 2]" 1
76 1 6 TYR HB3 1 98 GLN QG . . 4.670 4.417 4.172 4.590 . 0 0 "[ . 1 . 2]" 1
77 1 6 TYR QD 1 7 ASN H . . 4.230 4.066 4.015 4.106 . 0 0 "[ . 1 . 2]" 1
78 1 6 TYR QD 1 10 VAL HB . . 3.970 3.712 3.529 3.916 . 0 0 "[ . 1 . 2]" 1
79 1 6 TYR QD 1 10 VAL MG1 . . 3.110 2.451 2.300 2.722 . 0 0 "[ . 1 . 2]" 1
80 1 6 TYR QD 1 10 VAL MG2 . . 4.430 4.346 4.087 4.442 0.012 18 0 "[ . 1 . 2]" 1
81 1 6 TYR QD 1 14 LEU QD . . 3.140 2.862 2.562 3.104 . 0 0 "[ . 1 . 2]" 1
82 1 6 TYR QD 1 85 ILE MD . . 3.720 2.421 2.242 2.697 . 0 0 "[ . 1 . 2]" 1
83 1 6 TYR QD 1 85 ILE MG . . 4.300 3.468 2.867 3.805 . 0 0 "[ . 1 . 2]" 1
84 1 6 TYR QD 1 88 LEU QD . . 5.440 5.071 4.595 5.446 0.006 8 0 "[ . 1 . 2]" 1
85 1 6 TYR QD 1 95 VAL HA . . 5.500 5.135 4.911 5.303 . 0 0 "[ . 1 . 2]" 1
86 1 6 TYR QD 1 95 VAL HB . . 4.810 4.797 4.655 4.840 0.030 9 0 "[ . 1 . 2]" 1
87 1 6 TYR QD 1 95 VAL QG . . 2.770 2.531 2.430 2.680 . 0 0 "[ . 1 . 2]" 1
88 1 6 TYR QD 1 96 GLU H . . 4.890 4.523 4.108 4.839 . 0 0 "[ . 1 . 2]" 1
89 1 6 TYR QD 1 96 GLU HA . . 4.560 4.400 3.891 4.583 0.023 3 0 "[ . 1 . 2]" 1
90 1 6 TYR QD 1 97 LYS H . . 5.000 3.869 3.553 4.140 . 0 0 "[ . 1 . 2]" 1
91 1 6 TYR QD 1 97 LYS HA . . 2.980 2.005 1.987 2.098 . 0 0 "[ . 1 . 2]" 1
92 1 6 TYR QD 1 97 LYS QB . . 4.870 3.779 3.442 3.980 . 0 0 "[ . 1 . 2]" 1
93 1 6 TYR QD 1 97 LYS QD . . 5.330 4.211 2.253 5.016 . 0 0 "[ . 1 . 2]" 1
94 1 6 TYR QD 1 97 LYS QE . . 4.890 4.401 3.674 4.907 0.017 3 0 "[ . 1 . 2]" 1
95 1 6 TYR QD 1 97 LYS HG2 . . 5.290 4.024 2.410 4.891 . 0 0 "[ . 1 . 2]" 1
96 1 6 TYR QD 1 97 LYS QG . . 4.470 2.908 2.394 4.098 . 0 0 "[ . 1 . 2]" 1
97 1 6 TYR QD 1 97 LYS HG3 . . 5.290 3.242 2.650 5.099 . 0 0 "[ . 1 . 2]" 1
98 1 6 TYR QD 1 98 GLN H . . 4.870 3.634 3.333 4.010 . 0 0 "[ . 1 . 2]" 1
99 1 6 TYR QD 1 98 GLN QG . . 4.240 4.214 4.116 4.257 0.017 10 0 "[ . 1 . 2]" 1
100 1 6 TYR QE 1 10 VAL MG1 . . 4.080 3.982 3.833 4.090 0.010 9 0 "[ . 1 . 2]" 1
101 1 6 TYR QE 1 14 LEU MD1 . . 4.560 3.559 2.886 3.895 . 0 0 "[ . 1 . 2]" 1
102 1 6 TYR QE 1 14 LEU QD . . 3.520 3.327 2.810 3.528 0.008 17 0 "[ . 1 . 2]" 1
103 1 6 TYR QE 1 14 LEU MD2 . . 4.560 4.070 3.661 4.560 0.000 3 0 "[ . 1 . 2]" 1
104 1 6 TYR QE 1 85 ILE MD . . 3.210 2.163 2.012 2.621 . 0 0 "[ . 1 . 2]" 1
105 1 6 TYR QE 1 85 ILE QG . . 4.510 2.006 1.983 2.183 . 0 0 "[ . 1 . 2]" 1
106 1 6 TYR QE 1 85 ILE MG . . 3.490 2.122 1.938 2.468 . 0 0 "[ . 1 . 2]" 1
107 1 6 TYR QE 1 95 VAL HB . . 5.500 5.232 4.801 5.495 . 0 0 "[ . 1 . 2]" 1
108 1 6 TYR QE 1 95 VAL QG . . 3.020 2.989 2.892 3.028 0.008 16 0 "[ . 1 . 2]" 1
109 1 6 TYR QE 1 97 LYS HA . . 3.640 3.576 3.471 3.651 0.011 9 0 "[ . 1 . 2]" 1
110 1 6 TYR QE 1 97 LYS QB . . 4.670 3.855 3.290 4.378 . 0 0 "[ . 1 . 2]" 1
111 1 6 TYR QE 1 97 LYS QD . . 4.350 3.516 1.926 4.336 . 0 0 "[ . 1 . 2]" 1
112 1 6 TYR QE 1 97 LYS QE . . 3.850 3.205 2.218 3.861 0.011 1 0 "[ . 1 . 2]" 1
113 1 6 TYR QE 1 97 LYS HG2 . . 4.880 4.079 1.998 4.886 0.006 16 0 "[ . 1 . 2]" 1
114 1 6 TYR QE 1 97 LYS QG . . 4.010 2.828 1.981 4.024 0.014 9 0 "[ . 1 . 2]" 1
115 1 6 TYR QE 1 97 LYS HG3 . . 4.880 3.110 2.219 4.696 . 0 0 "[ . 1 . 2]" 1
116 1 7 ASN H 1 7 ASN HB3 . . 3.750 2.824 2.765 2.890 . 0 0 "[ . 1 . 2]" 1
117 1 7 ASN H 1 7 ASN QD . . 4.890 3.100 1.970 3.602 . 0 0 "[ . 1 . 2]" 1
118 1 7 ASN H 1 8 PRO QD . . 4.760 4.324 4.320 4.326 . 0 0 "[ . 1 . 2]" 1
119 1 7 ASN H 1 10 VAL HB . . 4.590 3.924 3.838 4.071 . 0 0 "[ . 1 . 2]" 1
120 1 7 ASN H 1 10 VAL MG1 . . 4.990 4.973 4.903 5.037 0.047 15 0 "[ . 1 . 2]" 1
121 1 7 ASN H 1 10 VAL MG2 . . 5.350 4.094 3.756 4.549 . 0 0 "[ . 1 . 2]" 1
122 1 7 ASN H 1 96 GLU H . . 4.210 3.896 3.373 4.205 . 0 0 "[ . 1 . 2]" 1
123 1 7 ASN H 1 97 LYS HA . . 5.190 4.561 4.397 4.779 . 0 0 "[ . 1 . 2]" 1
124 1 7 ASN H 1 98 GLN HB3 . . 5.300 3.668 3.121 4.067 . 0 0 "[ . 1 . 2]" 1
125 1 7 ASN H 1 98 GLN QG . . 4.670 3.356 2.917 3.687 . 0 0 "[ . 1 . 2]" 1
126 1 7 ASN HA 1 8 PRO HA . . 4.460 4.387 4.386 4.388 . 0 0 "[ . 1 . 2]" 1
127 1 7 ASN HA 1 8 PRO QD . . 2.920 2.154 2.146 2.170 . 0 0 "[ . 1 . 2]" 1
128 1 7 ASN HA 1 8 PRO HG2 . . 4.720 4.600 4.591 4.621 . 0 0 "[ . 1 . 2]" 1
129 1 7 ASN HA 1 8 PRO HG3 . . 4.720 4.539 4.531 4.556 . 0 0 "[ . 1 . 2]" 1
130 1 7 ASN HA 1 98 GLN HB2 . . 4.970 4.114 3.646 4.518 . 0 0 "[ . 1 . 2]" 1
131 1 7 ASN HA 1 98 GLN QG . . 4.100 3.095 2.014 3.686 . 0 0 "[ . 1 . 2]" 1
132 1 7 ASN HB2 1 8 PRO QB . . 5.220 4.695 4.675 4.707 . 0 0 "[ . 1 . 2]" 1
133 1 7 ASN HB2 1 8 PRO QD . . 3.450 1.944 1.918 1.957 . 0 0 "[ . 1 . 2]" 1
134 1 7 ASN HB2 1 8 PRO HG2 . . 4.860 3.651 3.640 3.657 . 0 0 "[ . 1 . 2]" 1
135 1 7 ASN HB2 1 8 PRO QG . . 4.250 3.513 3.505 3.518 . 0 0 "[ . 1 . 2]" 1
136 1 7 ASN HB2 1 8 PRO HG3 . . 4.860 4.568 4.553 4.575 . 0 0 "[ . 1 . 2]" 1
137 1 7 ASN HB2 1 98 GLN HB3 . . 5.500 5.209 4.597 5.493 . 0 0 "[ . 1 . 2]" 1
138 1 7 ASN HB3 1 8 PRO QD . . 3.720 2.762 2.656 2.843 . 0 0 "[ . 1 . 2]" 1
139 1 7 ASN HB3 1 98 GLN HB2 . . 5.500 5.134 4.528 5.501 0.001 4 0 "[ . 1 . 2]" 1
140 1 7 ASN HB3 1 98 GLN HB3 . . 4.760 3.812 3.201 4.143 . 0 0 "[ . 1 . 2]" 1
141 1 7 ASN HB3 1 98 GLN QG . . 5.160 4.549 3.613 5.164 0.004 9 0 "[ . 1 . 2]" 1
142 1 7 ASN QD 1 9 GLU QB . . 4.250 3.093 1.852 4.284 0.034 14 0 "[ . 1 . 2]" 1
143 1 7 ASN QD 1 10 VAL H . . 5.230 3.243 1.842 4.333 . 0 0 "[ . 1 . 2]" 1
144 1 7 ASN QD 1 10 VAL HB . . 5.030 3.472 1.929 4.148 . 0 0 "[ . 1 . 2]" 1
145 1 7 ASN QD 1 10 VAL MG2 . . 3.780 2.225 1.815 2.659 . 0 0 "[ . 1 . 2]" 1
146 1 7 ASN HD21 1 10 VAL MG2 . . 4.320 3.431 2.838 3.957 . 0 0 "[ . 1 . 2]" 1
147 1 7 ASN HD22 1 10 VAL MG2 . . 4.320 2.254 1.834 2.703 . 0 0 "[ . 1 . 2]" 1
148 1 8 PRO HA 1 11 GLU H . . 4.270 3.440 3.314 3.573 . 0 0 "[ . 1 . 2]" 1
149 1 8 PRO HA 1 11 GLU QB . . 3.590 2.411 2.083 2.749 . 0 0 "[ . 1 . 2]" 1
150 1 8 PRO HA 1 11 GLU HG2 . . 3.940 3.775 3.472 3.940 . 0 0 "[ . 1 . 2]" 1
151 1 8 PRO HA 1 11 GLU QG . . 3.200 2.718 2.141 3.115 . 0 0 "[ . 1 . 2]" 1
152 1 8 PRO HA 1 11 GLU HG3 . . 3.940 2.811 2.151 3.330 . 0 0 "[ . 1 . 2]" 1
153 1 9 GLU H 1 9 GLU QB . . 3.230 2.332 2.112 2.674 . 0 0 "[ . 1 . 2]" 1
154 1 9 GLU H 1 10 VAL H . . 3.910 2.381 2.337 2.572 . 0 0 "[ . 1 . 2]" 1
155 1 9 GLU HA 1 9 GLU HG2 . . 3.880 3.072 2.119 3.765 . 0 0 "[ . 1 . 2]" 1
156 1 9 GLU HA 1 9 GLU QG . . 3.200 2.537 2.098 3.339 0.139 15 0 "[ . 1 . 2]" 1
157 1 9 GLU HA 1 9 GLU HG3 . . 3.880 3.009 2.162 3.860 . 0 0 "[ . 1 . 2]" 1
158 1 9 GLU HA 1 12 ALA MB . . 3.740 3.629 3.419 3.742 0.002 16 0 "[ . 1 . 2]" 1
159 1 9 GLU QB 1 10 VAL MG2 . . 4.150 2.990 2.841 3.732 . 0 0 "[ . 1 . 2]" 1
160 1 9 GLU QG 1 10 VAL H . . 4.570 4.011 2.107 4.545 . 0 0 "[ . 1 . 2]" 1
161 1 9 GLU QG 1 10 VAL MG2 . . 4.940 4.148 1.976 4.929 . 0 0 "[ . 1 . 2]" 1
162 1 10 VAL H 1 10 VAL HB . . 3.260 2.411 2.355 2.439 . 0 0 "[ . 1 . 2]" 1
163 1 10 VAL H 1 10 VAL MG1 . . 4.200 3.745 3.711 3.761 . 0 0 "[ . 1 . 2]" 1
164 1 10 VAL H 1 10 VAL MG2 . . 3.510 2.571 2.446 2.735 . 0 0 "[ . 1 . 2]" 1
165 1 10 VAL H 1 11 GLU H . . 3.400 2.298 2.284 2.318 . 0 0 "[ . 1 . 2]" 1
166 1 10 VAL HA 1 10 VAL MG1 . . 3.240 2.424 2.375 2.464 . 0 0 "[ . 1 . 2]" 1
167 1 10 VAL HA 1 10 VAL MG2 . . 3.080 2.326 2.252 2.387 . 0 0 "[ . 1 . 2]" 1
168 1 10 VAL HA 1 13 LYS H . . 4.270 3.435 3.228 3.566 . 0 0 "[ . 1 . 2]" 1
169 1 10 VAL HA 1 13 LYS HB2 . . 4.170 3.651 3.131 4.010 . 0 0 "[ . 1 . 2]" 1
170 1 10 VAL HA 1 13 LYS QD . . 5.180 3.736 2.695 4.801 . 0 0 "[ . 1 . 2]" 1
171 1 10 VAL HA 1 13 LYS HG2 . . 4.780 3.352 2.267 4.374 . 0 0 "[ . 1 . 2]" 1
172 1 10 VAL HA 1 13 LYS QG . . 4.120 2.343 1.990 2.635 . 0 0 "[ . 1 . 2]" 1
173 1 10 VAL HA 1 13 LYS HG3 . . 4.780 2.492 1.998 2.958 . 0 0 "[ . 1 . 2]" 1
174 1 10 VAL HA 1 14 LEU QD . . 5.440 5.250 4.887 5.445 0.005 16 0 "[ . 1 . 2]" 1
175 1 10 VAL HA 1 88 LEU QD . . 4.270 3.717 2.888 4.231 . 0 0 "[ . 1 . 2]" 1
176 1 10 VAL HA 1 93 ILE MG . . 4.820 4.133 3.553 4.491 . 0 0 "[ . 1 . 2]" 1
177 1 10 VAL HA 1 95 VAL QG . . 5.440 4.745 3.910 5.398 . 0 0 "[ . 1 . 2]" 1
178 1 10 VAL HB 1 11 GLU H . . 3.440 2.852 2.741 2.992 . 0 0 "[ . 1 . 2]" 1
179 1 10 VAL MG1 1 11 GLU H . . 4.410 3.488 3.345 3.614 . 0 0 "[ . 1 . 2]" 1
180 1 10 VAL MG1 1 11 GLU HA . . 4.850 3.461 3.283 3.604 . 0 0 "[ . 1 . 2]" 1
181 1 10 VAL MG1 1 13 LYS HB2 . . 5.110 2.858 2.604 3.199 . 0 0 "[ . 1 . 2]" 1
182 1 10 VAL MG1 1 14 LEU H . . 4.860 4.140 3.861 4.373 . 0 0 "[ . 1 . 2]" 1
183 1 10 VAL MG1 1 14 LEU QB . . 5.090 4.642 4.222 5.052 . 0 0 "[ . 1 . 2]" 1
184 1 10 VAL MG1 1 14 LEU QD . . 3.210 2.926 2.478 3.196 . 0 0 "[ . 1 . 2]" 1
185 1 10 VAL MG1 1 14 LEU HG . . 4.250 3.423 2.875 3.759 . 0 0 "[ . 1 . 2]" 1
186 1 10 VAL MG1 1 85 ILE HA . . 4.650 3.892 3.414 4.170 . 0 0 "[ . 1 . 2]" 1
187 1 10 VAL MG1 1 85 ILE MD . . 3.100 2.504 1.964 2.667 . 0 0 "[ . 1 . 2]" 1
188 1 10 VAL MG1 1 85 ILE MG . . 4.470 3.417 2.844 3.683 . 0 0 "[ . 1 . 2]" 1
189 1 10 VAL MG1 1 93 ILE MG . . 4.870 3.495 3.171 3.754 . 0 0 "[ . 1 . 2]" 1
190 1 10 VAL MG1 1 95 VAL HA . . 4.480 4.047 3.766 4.228 . 0 0 "[ . 1 . 2]" 1
191 1 10 VAL MG1 1 95 VAL HB . . 4.890 3.270 2.577 4.249 . 0 0 "[ . 1 . 2]" 1
192 1 10 VAL MG1 1 95 VAL MG1 . . 4.240 3.221 1.873 4.065 . 0 0 "[ . 1 . 2]" 1
193 1 10 VAL MG1 1 95 VAL QG . . 3.260 2.196 1.732 2.689 . 0 0 "[ . 1 . 2]" 1
194 1 10 VAL MG1 1 95 VAL MG2 . . 4.240 2.309 1.891 2.729 . 0 0 "[ . 1 . 2]" 1
195 1 10 VAL MG1 1 96 GLU H . . 5.500 5.225 4.715 5.458 . 0 0 "[ . 1 . 2]" 1
196 1 10 VAL MG2 1 11 GLU H . . 4.930 4.003 3.938 4.076 . 0 0 "[ . 1 . 2]" 1
197 1 10 VAL MG2 1 85 ILE MD . . 4.550 4.417 3.838 4.562 0.012 16 0 "[ . 1 . 2]" 1
198 1 10 VAL MG2 1 88 LEU QD . . 4.080 3.341 2.446 3.944 . 0 0 "[ . 1 . 2]" 1
199 1 10 VAL MG2 1 93 ILE MG . . 3.060 2.489 1.959 3.038 . 0 0 "[ . 1 . 2]" 1
200 1 10 VAL MG2 1 94 ARG HA . . 5.500 5.435 5.063 5.514 0.014 9 0 "[ . 1 . 2]" 1
201 1 10 VAL MG2 1 95 VAL HA . . 3.080 2.622 2.404 2.756 . 0 0 "[ . 1 . 2]" 1
202 1 10 VAL MG2 1 95 VAL HB . . 4.740 3.219 2.473 4.327 . 0 0 "[ . 1 . 2]" 1
203 1 10 VAL MG2 1 95 VAL QG . . 3.600 2.381 1.710 2.957 . 0 0 "[ . 1 . 2]" 1
204 1 10 VAL MG2 1 96 GLU H . . 4.340 3.849 3.159 4.096 . 0 0 "[ . 1 . 2]" 1
205 1 11 GLU H 1 11 GLU QB . . 3.330 2.355 2.231 2.494 . 0 0 "[ . 1 . 2]" 1
206 1 11 GLU H 1 11 GLU QG . . 3.630 2.430 2.130 2.693 . 0 0 "[ . 1 . 2]" 1
207 1 11 GLU H 1 12 ALA H . . 3.620 2.796 2.680 2.841 . 0 0 "[ . 1 . 2]" 1
208 1 11 GLU HA 1 14 LEU H . . 4.690 3.290 3.043 3.516 . 0 0 "[ . 1 . 2]" 1
209 1 11 GLU HA 1 14 LEU QB . . 3.590 2.988 2.471 3.503 . 0 0 "[ . 1 . 2]" 1
210 1 11 GLU HA 1 14 LEU QD . . 3.130 2.300 2.034 2.704 . 0 0 "[ . 1 . 2]" 1
211 1 11 GLU HA 1 14 LEU HG . . 4.580 3.594 3.203 3.920 . 0 0 "[ . 1 . 2]" 1
212 1 11 GLU HA 1 85 ILE MD . . 5.500 4.422 3.958 4.909 . 0 0 "[ . 1 . 2]" 1
213 1 11 GLU QB 1 12 ALA H . . 3.680 2.618 2.506 2.751 . 0 0 "[ . 1 . 2]" 1
214 1 11 GLU QG 1 12 ALA H . . 4.510 4.197 4.019 4.367 . 0 0 "[ . 1 . 2]" 1
215 1 11 GLU QG 1 14 LEU QD . . 5.280 3.449 3.053 3.972 . 0 0 "[ . 1 . 2]" 1
216 1 12 ALA H 1 12 ALA MB . . 2.800 2.069 2.024 2.232 . 0 0 "[ . 1 . 2]" 1
217 1 12 ALA H 1 13 LYS H . . 3.520 2.712 2.631 2.759 . 0 0 "[ . 1 . 2]" 1
218 1 12 ALA H 1 14 LEU H . . 4.290 4.196 4.065 4.298 0.008 16 0 "[ . 1 . 2]" 1
219 1 12 ALA H 1 15 ASP QB . . 5.200 5.096 4.851 5.202 0.002 4 0 "[ . 1 . 2]" 1
220 1 12 ALA HA 1 15 ASP H . . 4.160 3.483 3.217 3.812 . 0 0 "[ . 1 . 2]" 1
221 1 12 ALA HA 1 15 ASP HB2 . . 4.250 3.422 2.585 4.250 0.000 9 0 "[ . 1 . 2]" 1
222 1 12 ALA HA 1 15 ASP QB . . 3.420 2.845 2.561 3.163 . 0 0 "[ . 1 . 2]" 1
223 1 12 ALA HA 1 15 ASP HB3 . . 4.250 3.407 2.712 4.252 0.002 16 0 "[ . 1 . 2]" 1
224 1 12 ALA HA 1 16 VAL H . . 4.740 4.659 4.252 4.746 0.006 3 0 "[ . 1 . 2]" 1
225 1 12 ALA MB 1 13 LYS H . . 3.600 2.879 2.698 2.987 . 0 0 "[ . 1 . 2]" 1
226 1 12 ALA MB 1 15 ASP QB . . 5.340 4.023 3.697 4.393 . 0 0 "[ . 1 . 2]" 1
227 1 12 ALA MB 1 16 VAL QG . . 4.140 3.717 3.432 4.001 . 0 0 "[ . 1 . 2]" 1
228 1 13 LYS H 1 13 LYS HB2 . . 3.260 2.581 2.378 2.683 . 0 0 "[ . 1 . 2]" 1
229 1 13 LYS H 1 13 LYS HG2 . . 3.890 2.496 1.949 3.207 . 0 0 "[ . 1 . 2]" 1
230 1 13 LYS H 1 13 LYS HG3 . . 3.890 2.865 2.109 3.476 . 0 0 "[ . 1 . 2]" 1
231 1 13 LYS H 1 14 LEU H . . 3.340 2.498 2.319 2.718 . 0 0 "[ . 1 . 2]" 1
232 1 13 LYS H 1 88 LEU QD . . 4.790 4.292 4.089 4.462 . 0 0 "[ . 1 . 2]" 1
233 1 13 LYS HA 1 13 LYS HG2 . . 3.930 2.728 2.290 3.184 . 0 0 "[ . 1 . 2]" 1
234 1 13 LYS HA 1 13 LYS QG . . 3.370 2.654 2.252 3.040 . 0 0 "[ . 1 . 2]" 1
235 1 13 LYS HA 1 13 LYS HG3 . . 3.930 3.663 3.332 3.851 . 0 0 "[ . 1 . 2]" 1
236 1 13 LYS HA 1 16 VAL H . . 4.520 3.717 3.479 3.855 . 0 0 "[ . 1 . 2]" 1
237 1 13 LYS HA 1 16 VAL HB . . 3.950 3.419 3.126 3.842 . 0 0 "[ . 1 . 2]" 1
238 1 13 LYS HA 1 16 VAL QG . . 3.080 2.337 1.965 2.773 . 0 0 "[ . 1 . 2]" 1
239 1 13 LYS HA 1 48 MET ME . . 5.290 4.999 4.767 5.288 . 0 0 "[ . 1 . 2]" 1
240 1 13 LYS HB2 1 13 LYS QE . . 4.880 3.950 3.419 4.560 . 0 0 "[ . 1 . 2]" 1
241 1 13 LYS HB2 1 84 ILE MG . . 5.500 3.694 3.187 4.464 . 0 0 "[ . 1 . 2]" 1
242 1 13 LYS HB2 1 85 ILE MD . . 5.170 4.083 3.638 4.523 . 0 0 "[ . 1 . 2]" 1
243 1 13 LYS HB2 1 88 LEU QD . . 4.130 2.350 2.058 2.578 . 0 0 "[ . 1 . 2]" 1
244 1 13 LYS QD 1 88 LEU QD . . 4.270 2.222 1.730 3.267 . 0 0 "[ . 1 . 2]" 1
245 1 13 LYS QD 1 93 ILE MG . . 4.650 3.892 2.620 4.659 0.009 17 0 "[ . 1 . 2]" 1
246 1 13 LYS QE 1 50 MET ME . . 4.710 4.102 3.767 4.630 . 0 0 "[ . 1 . 2]" 1
247 1 13 LYS QE 1 88 LEU QD . . 4.170 2.302 1.647 3.386 . 0 0 "[ . 1 . 2]" 1
248 1 13 LYS QE 1 93 ILE MD . . 3.790 2.958 2.166 3.672 . 0 0 "[ . 1 . 2]" 1
249 1 13 LYS QE 1 93 ILE QG . . 4.760 3.628 2.887 4.607 . 0 0 "[ . 1 . 2]" 1
250 1 13 LYS QE 1 93 ILE MG . . 4.220 3.581 2.905 4.225 0.005 15 0 "[ . 1 . 2]" 1
251 1 13 LYS HE2 1 48 MET ME . . 5.500 4.924 3.853 5.501 0.001 2 0 "[ . 1 . 2]" 1
252 1 13 LYS HE2 1 88 LEU MD1 . . 5.500 3.414 2.030 5.148 . 0 0 "[ . 1 . 2]" 1
253 1 13 LYS HE2 1 88 LEU MD2 . . 5.500 2.555 1.914 4.375 . 0 0 "[ . 1 . 2]" 1
254 1 13 LYS HE2 1 93 ILE MD . . 4.520 3.174 2.181 4.175 . 0 0 "[ . 1 . 2]" 1
255 1 13 LYS HE2 1 93 ILE MG . . 5.020 3.761 2.956 4.640 . 0 0 "[ . 1 . 2]" 1
256 1 13 LYS HE3 1 48 MET ME . . 5.500 4.577 3.106 5.507 0.007 15 0 "[ . 1 . 2]" 1
257 1 13 LYS HE3 1 88 LEU MD1 . . 5.500 3.830 2.009 4.811 . 0 0 "[ . 1 . 2]" 1
258 1 13 LYS HE3 1 88 LEU MD2 . . 5.500 3.167 1.958 4.336 . 0 0 "[ . 1 . 2]" 1
259 1 13 LYS HE3 1 93 ILE MD . . 4.520 3.931 2.584 4.515 . 0 0 "[ . 1 . 2]" 1
260 1 13 LYS HE3 1 93 ILE MG . . 5.020 4.784 3.436 5.024 0.004 3 0 "[ . 1 . 2]" 1
261 1 13 LYS QG 1 88 LEU QD . . 3.760 2.548 1.870 3.210 . 0 0 "[ . 1 . 2]" 1
262 1 13 LYS QG 1 93 ILE MD . . 5.340 4.677 4.093 5.322 . 0 0 "[ . 1 . 2]" 1
263 1 14 LEU H 1 14 LEU QB . . 3.170 2.301 2.179 2.410 . 0 0 "[ . 1 . 2]" 1
264 1 14 LEU H 1 14 LEU QD . . 4.370 3.213 3.051 3.444 . 0 0 "[ . 1 . 2]" 1
265 1 14 LEU H 1 14 LEU HG . . 3.280 2.690 2.466 3.010 . 0 0 "[ . 1 . 2]" 1
266 1 14 LEU H 1 84 ILE MG . . 5.500 4.749 4.011 5.178 . 0 0 "[ . 1 . 2]" 1
267 1 14 LEU HA 1 14 LEU MD1 . . 3.920 3.873 3.831 3.920 0.000 8 0 "[ . 1 . 2]" 1
268 1 14 LEU HA 1 14 LEU QD . . 2.800 2.403 2.077 2.609 . 0 0 "[ . 1 . 2]" 1
269 1 14 LEU HA 1 14 LEU MD2 . . 3.920 2.428 2.086 2.650 . 0 0 "[ . 1 . 2]" 1
270 1 14 LEU HA 1 14 LEU HG . . 3.930 2.756 2.611 2.862 . 0 0 "[ . 1 . 2]" 1
271 1 14 LEU HA 1 17 ALA H . . 4.450 3.521 3.278 3.735 . 0 0 "[ . 1 . 2]" 1
272 1 14 LEU HA 1 17 ALA MB . . 3.370 3.188 2.791 3.375 0.005 4 0 "[ . 1 . 2]" 1
273 1 14 LEU HA 1 84 ILE HB . . 5.200 3.836 3.261 4.213 . 0 0 "[ . 1 . 2]" 1
274 1 14 LEU HA 1 84 ILE MG . . 3.930 3.471 2.975 3.890 . 0 0 "[ . 1 . 2]" 1
275 1 14 LEU QB 1 14 LEU QD . . 2.830 1.814 1.733 1.909 . 0 0 "[ . 1 . 2]" 1
276 1 14 LEU QB 1 15 ASP H . . 4.350 2.512 2.361 2.657 . 0 0 "[ . 1 . 2]" 1
277 1 14 LEU QB 1 15 ASP HA . . 4.630 3.825 3.779 3.871 . 0 0 "[ . 1 . 2]" 1
278 1 14 LEU QB 1 16 VAL H . . 5.340 4.430 4.288 4.609 . 0 0 "[ . 1 . 2]" 1
279 1 14 LEU QD 1 15 ASP H . . 4.760 3.980 3.812 4.105 . 0 0 "[ . 1 . 2]" 1
280 1 14 LEU QD 1 17 ALA MB . . 4.730 3.789 3.411 3.984 . 0 0 "[ . 1 . 2]" 1
281 1 14 LEU QD 1 81 GLU HA . . 3.260 2.840 2.547 3.260 0.000 16 0 "[ . 1 . 2]" 1
282 1 14 LEU QD 1 81 GLU QB . . 3.750 2.297 1.866 2.793 . 0 0 "[ . 1 . 2]" 1
283 1 14 LEU QD 1 81 GLU QG . . 3.700 3.105 2.558 3.702 0.002 20 0 "[ . 1 . 2]" 1
284 1 14 LEU QD 1 84 ILE H . . 4.580 4.003 3.585 4.566 . 0 0 "[ . 1 . 2]" 1
285 1 14 LEU QD 1 84 ILE HA . . 5.440 5.051 4.541 5.429 . 0 0 "[ . 1 . 2]" 1
286 1 14 LEU QD 1 84 ILE HB . . 3.420 2.552 2.034 2.995 . 0 0 "[ . 1 . 2]" 1
287 1 14 LEU QD 1 84 ILE MG . . 4.640 3.290 2.854 3.656 . 0 0 "[ . 1 . 2]" 1
288 1 14 LEU QD 1 85 ILE H . . 4.290 3.243 2.911 3.610 . 0 0 "[ . 1 . 2]" 1
289 1 14 LEU QD 1 85 ILE HB . . 4.990 4.291 3.954 4.554 . 0 0 "[ . 1 . 2]" 1
290 1 14 LEU QD 1 85 ILE MD . . 2.860 1.794 1.693 1.975 . 0 0 "[ . 1 . 2]" 1
291 1 14 LEU QD 1 85 ILE QG . . 3.540 2.292 1.948 2.521 . 0 0 "[ . 1 . 2]" 1
292 1 14 LEU MD1 1 85 ILE MD . . 3.300 2.097 1.838 2.495 . 0 0 "[ . 1 . 2]" 1
293 1 14 LEU MD2 1 85 ILE MD . . 3.300 1.984 1.823 2.267 . 0 0 "[ . 1 . 2]" 1
294 1 14 LEU HG 1 84 ILE MG . . 5.500 4.058 3.600 4.540 . 0 0 "[ . 1 . 2]" 1
295 1 14 LEU HG 1 85 ILE MD . . 4.770 2.372 2.080 2.658 . 0 0 "[ . 1 . 2]" 1
296 1 15 ASP H 1 15 ASP HB2 . . 3.530 2.444 2.151 2.793 . 0 0 "[ . 1 . 2]" 1
297 1 15 ASP H 1 15 ASP QB . . 2.990 2.198 2.131 2.253 . 0 0 "[ . 1 . 2]" 1
298 1 15 ASP H 1 15 ASP HB3 . . 3.530 2.792 2.299 3.530 . 0 0 "[ . 1 . 2]" 1
299 1 15 ASP H 1 16 VAL H . . 3.760 2.715 2.623 2.820 . 0 0 "[ . 1 . 2]" 1
300 1 15 ASP H 1 17 ALA H . . 4.780 4.595 4.075 4.784 0.004 1 0 "[ . 1 . 2]" 1
301 1 15 ASP HA 1 18 ARG H . . 4.260 3.478 3.168 3.733 . 0 0 "[ . 1 . 2]" 1
302 1 15 ASP HA 1 18 ARG QB . . 3.250 2.686 2.319 3.275 0.025 11 0 "[ . 1 . 2]" 1
303 1 15 ASP HA 1 18 ARG QD . . 3.060 2.763 1.961 3.064 0.004 16 0 "[ . 1 . 2]" 1
304 1 15 ASP HA 1 18 ARG QG . . 4.790 3.597 1.983 4.503 . 0 0 "[ . 1 . 2]" 1
305 1 15 ASP QB 1 16 VAL H . . 3.720 2.891 2.525 3.148 . 0 0 "[ . 1 . 2]" 1
306 1 15 ASP QB 1 16 VAL QG . . 4.540 3.340 3.052 3.537 . 0 0 "[ . 1 . 2]" 1
307 1 15 ASP HB2 1 16 VAL H . . 4.440 3.806 2.944 4.315 . 0 0 "[ . 1 . 2]" 1
308 1 15 ASP HB3 1 16 VAL H . . 4.440 3.095 2.578 3.857 . 0 0 "[ . 1 . 2]" 1
309 1 16 VAL H 1 16 VAL HB . . 3.370 2.541 2.495 2.664 . 0 0 "[ . 1 . 2]" 1
310 1 16 VAL H 1 16 VAL QG . . 3.110 2.260 2.116 2.406 . 0 0 "[ . 1 . 2]" 1
311 1 16 VAL H 1 17 ALA H . . 3.530 2.723 2.389 2.909 . 0 0 "[ . 1 . 2]" 1
312 1 16 VAL H 1 17 ALA MB . . 4.480 4.314 4.040 4.459 . 0 0 "[ . 1 . 2]" 1
313 1 16 VAL H 1 19 ARG QB . . 5.340 5.100 4.849 5.316 . 0 0 "[ . 1 . 2]" 1
314 1 16 VAL HA 1 16 VAL MG1 . . 3.120 2.337 2.306 2.399 . 0 0 "[ . 1 . 2]" 1
315 1 16 VAL HA 1 16 VAL QG . . 2.650 2.080 2.044 2.126 . 0 0 "[ . 1 . 2]" 1
316 1 16 VAL HA 1 16 VAL MG2 . . 3.120 2.335 2.277 2.399 . 0 0 "[ . 1 . 2]" 1
317 1 16 VAL HA 1 19 ARG H . . 4.210 3.609 3.363 4.015 . 0 0 "[ . 1 . 2]" 1
318 1 16 VAL HA 1 19 ARG QB . . 3.570 3.056 2.825 3.363 . 0 0 "[ . 1 . 2]" 1
319 1 16 VAL HA 1 19 ARG QG . . 4.910 4.465 3.209 4.914 0.004 10 0 "[ . 1 . 2]" 1
320 1 16 VAL HB 1 17 ALA H . . 3.520 2.434 2.160 3.010 . 0 0 "[ . 1 . 2]" 1
321 1 16 VAL HB 1 17 ALA MB . . 4.800 3.774 3.643 4.042 . 0 0 "[ . 1 . 2]" 1
322 1 16 VAL HB 1 48 MET H . . 5.240 4.885 4.575 5.124 . 0 0 "[ . 1 . 2]" 1
323 1 16 VAL HB 1 48 MET QG . . 4.370 2.264 2.009 2.839 . 0 0 "[ . 1 . 2]" 1
324 1 16 VAL QG 1 17 ALA H . . 3.610 3.096 2.879 3.447 . 0 0 "[ . 1 . 2]" 1
325 1 16 VAL QG 1 17 ALA HA . . 4.010 3.417 3.197 3.692 . 0 0 "[ . 1 . 2]" 1
326 1 16 VAL QG 1 18 ARG H . . 5.390 4.449 4.236 4.856 . 0 0 "[ . 1 . 2]" 1
327 1 16 VAL QG 1 19 ARG H . . 4.790 4.354 4.103 4.793 0.003 6 0 "[ . 1 . 2]" 1
328 1 16 VAL QG 1 44 THR HA . . 3.530 3.038 2.635 3.513 . 0 0 "[ . 1 . 2]" 1
329 1 16 VAL QG 1 44 THR HB . . 5.420 4.865 4.405 5.257 . 0 0 "[ . 1 . 2]" 1
330 1 16 VAL QG 1 47 GLU H . . 4.320 3.648 3.387 4.024 . 0 0 "[ . 1 . 2]" 1
331 1 16 VAL QG 1 47 GLU HA . . 4.060 3.687 3.534 4.038 . 0 0 "[ . 1 . 2]" 1
332 1 16 VAL QG 1 47 GLU HB2 . . 3.010 2.278 1.975 3.035 0.025 8 0 "[ . 1 . 2]" 1
333 1 16 VAL QG 1 47 GLU QG . . 3.820 3.180 2.283 3.520 . 0 0 "[ . 1 . 2]" 1
334 1 16 VAL QG 1 48 MET HA . . 3.460 2.336 2.039 3.035 . 0 0 "[ . 1 . 2]" 1
335 1 16 VAL QG 1 48 MET HB2 . . 4.780 3.648 3.211 4.285 . 0 0 "[ . 1 . 2]" 1
336 1 16 VAL QG 1 48 MET QG . . 3.350 2.053 1.733 2.483 . 0 0 "[ . 1 . 2]" 1
337 1 16 VAL MG1 1 17 ALA H . . 4.190 3.306 3.007 3.782 . 0 0 "[ . 1 . 2]" 1
338 1 16 VAL MG1 1 48 MET H . . 4.650 2.882 2.448 3.426 . 0 0 "[ . 1 . 2]" 1
339 1 16 VAL MG1 1 48 MET HA . . 4.130 2.829 2.384 3.694 . 0 0 "[ . 1 . 2]" 1
340 1 16 VAL MG1 1 48 MET HB3 . . 5.050 4.349 3.948 5.062 0.012 8 0 "[ . 1 . 2]" 1
341 1 16 VAL MG1 1 48 MET HG2 . . 5.620 2.761 2.380 3.390 . 0 0 "[ . 1 . 2]" 1
342 1 16 VAL MG1 1 48 MET HG3 . . 5.620 2.373 1.962 2.757 . 0 0 "[ . 1 . 2]" 1
343 1 16 VAL MG2 1 17 ALA H . . 4.190 3.762 3.578 3.973 . 0 0 "[ . 1 . 2]" 1
344 1 16 VAL MG2 1 48 MET H . . 4.650 4.190 3.686 4.651 0.001 11 0 "[ . 1 . 2]" 1
345 1 16 VAL MG2 1 48 MET HA . . 4.130 2.524 2.121 3.227 . 0 0 "[ . 1 . 2]" 1
346 1 16 VAL MG2 1 48 MET HB3 . . 5.050 4.259 3.852 4.950 . 0 0 "[ . 1 . 2]" 1
347 1 16 VAL MG2 1 48 MET HG2 . . 5.620 2.498 2.063 3.151 . 0 0 "[ . 1 . 2]" 1
348 1 16 VAL MG2 1 48 MET HG3 . . 5.620 3.555 3.058 4.141 . 0 0 "[ . 1 . 2]" 1
349 1 17 ALA H 1 17 ALA MB . . 3.310 2.122 2.025 2.234 . 0 0 "[ . 1 . 2]" 1
350 1 17 ALA H 1 18 ARG H . . 4.050 2.600 2.348 2.766 . 0 0 "[ . 1 . 2]" 1
351 1 17 ALA H 1 44 THR MG . . 4.170 3.468 3.026 3.926 . 0 0 "[ . 1 . 2]" 1
352 1 17 ALA H 1 48 MET QG . . 5.180 3.967 3.288 4.640 . 0 0 "[ . 1 . 2]" 1
353 1 17 ALA H 1 84 ILE MD . . 5.500 4.848 4.281 5.316 . 0 0 "[ . 1 . 2]" 1
354 1 17 ALA H 1 84 ILE HG13 . . 4.580 4.236 3.603 4.566 . 0 0 "[ . 1 . 2]" 1
355 1 17 ALA H 1 84 ILE MG . . 5.100 4.417 4.124 4.765 . 0 0 "[ . 1 . 2]" 1
356 1 17 ALA HA 1 20 LEU QD . . 4.490 3.640 3.268 4.501 0.011 18 0 "[ . 1 . 2]" 1
357 1 17 ALA HA 1 40 LEU QD . . 5.120 3.901 3.473 4.234 . 0 0 "[ . 1 . 2]" 1
358 1 17 ALA HA 1 41 LEU QD . . 5.440 5.298 4.755 5.453 0.013 12 0 "[ . 1 . 2]" 1
359 1 17 ALA HA 1 44 THR HA . . 4.320 4.005 3.727 4.274 . 0 0 "[ . 1 . 2]" 1
360 1 17 ALA HA 1 44 THR HB . . 5.090 4.885 4.533 5.099 0.009 9 0 "[ . 1 . 2]" 1
361 1 17 ALA HA 1 44 THR MG . . 3.130 2.384 1.964 2.657 . 0 0 "[ . 1 . 2]" 1
362 1 17 ALA HA 1 48 MET ME . . 5.500 5.409 4.712 5.509 0.009 12 0 "[ . 1 . 2]" 1
363 1 17 ALA HA 1 80 TYR QD . . 5.150 4.945 4.363 5.156 0.006 3 0 "[ . 1 . 2]" 1
364 1 17 ALA HA 1 80 TYR QE . . 3.290 3.123 2.864 3.289 . 0 0 "[ . 1 . 2]" 1
365 1 17 ALA HA 1 84 ILE MD . . 4.840 4.272 3.393 4.514 . 0 0 "[ . 1 . 2]" 1
366 1 17 ALA MB 1 18 ARG H . . 3.530 2.804 2.511 2.971 . 0 0 "[ . 1 . 2]" 1
367 1 17 ALA MB 1 40 LEU QD . . 4.960 3.814 3.420 4.031 . 0 0 "[ . 1 . 2]" 1
368 1 17 ALA MB 1 44 THR HB . . 5.080 4.410 4.185 4.826 . 0 0 "[ . 1 . 2]" 1
369 1 17 ALA MB 1 44 THR MG . . 2.960 2.023 1.880 2.463 . 0 0 "[ . 1 . 2]" 1
370 1 17 ALA MB 1 48 MET ME . . 4.470 4.114 3.516 4.471 0.001 18 0 "[ . 1 . 2]" 1
371 1 17 ALA MB 1 48 MET QG . . 4.820 4.110 3.620 4.821 0.001 18 0 "[ . 1 . 2]" 1
372 1 17 ALA MB 1 77 LEU QD . . 5.270 3.514 2.697 3.969 . 0 0 "[ . 1 . 2]" 1
373 1 17 ALA MB 1 80 TYR QD . . 3.550 3.224 2.588 3.505 . 0 0 "[ . 1 . 2]" 1
374 1 17 ALA MB 1 80 TYR QE . . 2.850 2.349 2.013 2.639 . 0 0 "[ . 1 . 2]" 1
375 1 17 ALA MB 1 81 GLU HA . . 5.440 3.389 2.853 3.949 . 0 0 "[ . 1 . 2]" 1
376 1 17 ALA MB 1 84 ILE HB . . 4.140 3.824 3.616 3.952 . 0 0 "[ . 1 . 2]" 1
377 1 17 ALA MB 1 84 ILE MD . . 3.200 2.468 2.030 2.798 . 0 0 "[ . 1 . 2]" 1
378 1 17 ALA MB 1 84 ILE HG12 . . 3.810 3.081 2.684 3.374 . 0 0 "[ . 1 . 2]" 1
379 1 17 ALA MB 1 84 ILE HG13 . . 3.260 2.043 1.899 2.234 . 0 0 "[ . 1 . 2]" 1
380 1 17 ALA MB 1 84 ILE MG . . 3.440 3.109 2.793 3.355 . 0 0 "[ . 1 . 2]" 1
381 1 18 ARG H 1 18 ARG HB2 . . 3.790 2.840 2.465 3.581 . 0 0 "[ . 1 . 2]" 1
382 1 18 ARG H 1 18 ARG QB . . 3.050 2.311 2.223 2.621 . 0 0 "[ . 1 . 2]" 1
383 1 18 ARG H 1 18 ARG HB3 . . 3.790 2.593 2.338 3.601 . 0 0 "[ . 1 . 2]" 1
384 1 18 ARG H 1 18 ARG HD2 . . 5.500 4.607 3.475 5.176 . 0 0 "[ . 1 . 2]" 1
385 1 18 ARG H 1 18 ARG QD . . 4.810 4.106 3.101 4.374 . 0 0 "[ . 1 . 2]" 1
386 1 18 ARG H 1 18 ARG HD3 . . 5.500 4.730 3.486 5.486 . 0 0 "[ . 1 . 2]" 1
387 1 18 ARG H 1 19 ARG H . . 3.870 2.569 2.391 2.796 . 0 0 "[ . 1 . 2]" 1
388 1 18 ARG H 1 19 ARG HA . . 5.410 5.195 5.046 5.365 . 0 0 "[ . 1 . 2]" 1
389 1 18 ARG H 1 20 LEU H . . 4.930 4.107 3.723 4.711 . 0 0 "[ . 1 . 2]" 1
390 1 18 ARG H 1 44 THR MG . . 5.500 4.986 4.742 5.277 . 0 0 "[ . 1 . 2]" 1
391 1 18 ARG H 1 77 LEU QD . . 5.040 3.731 3.108 4.078 . 0 0 "[ . 1 . 2]" 1
392 1 18 ARG HA 1 18 ARG HD2 . . 5.500 4.572 4.251 5.520 0.020 11 0 "[ . 1 . 2]" 1
393 1 18 ARG HA 1 18 ARG QD . . 4.760 4.082 3.679 4.555 . 0 0 "[ . 1 . 2]" 1
394 1 18 ARG HA 1 18 ARG HD3 . . 5.500 4.643 3.955 4.994 . 0 0 "[ . 1 . 2]" 1
395 1 18 ARG HA 1 18 ARG QG . . 3.660 2.681 2.459 3.330 . 0 0 "[ . 1 . 2]" 1
396 1 18 ARG HA 1 21 PHE HB2 . . 4.530 3.319 2.779 3.792 . 0 0 "[ . 1 . 2]" 1
397 1 18 ARG HA 1 21 PHE HB3 . . 4.710 2.930 2.407 3.269 . 0 0 "[ . 1 . 2]" 1
398 1 18 ARG HA 1 21 PHE QD . . 4.780 4.500 4.226 4.772 . 0 0 "[ . 1 . 2]" 1
399 1 18 ARG HA 1 77 LEU MD1 . . 3.810 2.013 1.883 2.938 . 0 0 "[ . 1 . 2]" 1
400 1 18 ARG HA 1 77 LEU QD . . 3.180 1.932 1.738 2.785 . 0 0 "[ . 1 . 2]" 1
401 1 18 ARG HA 1 77 LEU MD2 . . 3.810 2.766 1.958 3.457 . 0 0 "[ . 1 . 2]" 1
402 1 18 ARG HA 1 80 TYR QE . . 5.500 4.688 3.912 5.506 0.006 10 0 "[ . 1 . 2]" 1
403 1 18 ARG QB 1 18 ARG QD . . 2.980 2.113 1.948 2.447 . 0 0 "[ . 1 . 2]" 1
404 1 18 ARG QB 1 19 ARG H . . 3.380 2.852 2.103 3.486 0.106 12 0 "[ . 1 . 2]" 1
405 1 18 ARG QB 1 77 LEU QD . . 3.780 2.482 1.866 3.353 . 0 0 "[ . 1 . 2]" 1
406 1 18 ARG HB2 1 77 LEU MD1 . . 5.350 3.041 2.285 4.862 . 0 0 "[ . 1 . 2]" 1
407 1 18 ARG HB2 1 77 LEU MD2 . . 5.350 3.320 2.093 4.862 . 0 0 "[ . 1 . 2]" 1
408 1 18 ARG HB3 1 77 LEU MD1 . . 5.350 3.646 2.259 4.389 . 0 0 "[ . 1 . 2]" 1
409 1 18 ARG HB3 1 77 LEU MD2 . . 5.350 3.848 2.019 4.598 . 0 0 "[ . 1 . 2]" 1
410 1 18 ARG QD 1 77 LEU QD . . 3.890 3.341 2.408 3.895 0.005 18 0 "[ . 1 . 2]" 1
411 1 18 ARG HD2 1 19 ARG H . . 5.500 4.954 3.455 5.501 0.001 10 0 "[ . 1 . 2]" 1
412 1 18 ARG HD2 1 77 LEU MD1 . . 5.260 4.673 3.999 5.263 0.003 11 0 "[ . 1 . 2]" 1
413 1 18 ARG HD2 1 77 LEU MD2 . . 5.260 3.996 2.481 5.133 . 0 0 "[ . 1 . 2]" 1
414 1 18 ARG HD3 1 19 ARG H . . 5.500 4.655 3.569 5.518 0.018 9 0 "[ . 1 . 2]" 1
415 1 18 ARG HD3 1 77 LEU MD1 . . 5.260 4.859 4.251 5.262 0.002 10 0 "[ . 1 . 2]" 1
416 1 18 ARG HD3 1 77 LEU MD2 . . 5.260 4.163 3.493 5.072 . 0 0 "[ . 1 . 2]" 1
417 1 18 ARG QG 1 77 LEU QD . . 3.650 2.242 1.753 3.660 0.010 17 0 "[ . 1 . 2]" 1
418 1 18 ARG HG2 1 77 LEU MD1 . . 5.940 3.538 1.979 4.687 . 0 0 "[ . 1 . 2]" 1
419 1 18 ARG HG2 1 77 LEU MD2 . . 5.940 3.020 1.916 5.065 . 0 0 "[ . 1 . 2]" 1
420 1 18 ARG HG3 1 77 LEU MD1 . . 5.940 3.327 2.255 4.838 . 0 0 "[ . 1 . 2]" 1
421 1 18 ARG HG3 1 77 LEU MD2 . . 5.940 2.757 1.915 4.323 . 0 0 "[ . 1 . 2]" 1
422 1 19 ARG H 1 19 ARG QB . . 2.780 2.239 2.147 2.294 . 0 0 "[ . 1 . 2]" 1
423 1 19 ARG H 1 19 ARG QD . . 5.290 4.240 3.551 4.771 . 0 0 "[ . 1 . 2]" 1
424 1 19 ARG H 1 19 ARG QG . . 4.750 3.577 2.625 4.048 . 0 0 "[ . 1 . 2]" 1
425 1 19 ARG H 1 20 LEU H . . 3.540 2.539 2.335 2.771 . 0 0 "[ . 1 . 2]" 1
426 1 19 ARG H 1 20 LEU QB . . 4.780 4.265 4.043 4.553 . 0 0 "[ . 1 . 2]" 1
427 1 19 ARG H 1 21 PHE HB3 . . 5.500 5.121 4.657 5.430 . 0 0 "[ . 1 . 2]" 1
428 1 19 ARG HA 1 19 ARG QD . . 4.230 3.093 2.063 4.145 . 0 0 "[ . 1 . 2]" 1
429 1 19 ARG HA 1 19 ARG QG . . 3.310 2.533 2.144 3.067 . 0 0 "[ . 1 . 2]" 1
430 1 19 ARG QB 1 19 ARG QD . . 2.970 2.208 2.069 2.479 . 0 0 "[ . 1 . 2]" 1
431 1 19 ARG QB 1 20 LEU H . . 3.840 2.657 2.096 2.938 . 0 0 "[ . 1 . 2]" 1
432 1 19 ARG QD 1 20 LEU H . . 5.330 4.705 3.842 5.307 . 0 0 "[ . 1 . 2]" 1
433 1 19 ARG QG 1 20 LEU H . . 4.890 4.026 3.187 4.667 . 0 0 "[ . 1 . 2]" 1
434 1 20 LEU H 1 20 LEU QB . . 3.480 2.210 2.035 2.281 . 0 0 "[ . 1 . 2]" 1
435 1 20 LEU H 1 20 LEU MD1 . . 4.690 3.985 3.346 4.161 . 0 0 "[ . 1 . 2]" 1
436 1 20 LEU H 1 20 LEU MD2 . . 4.690 4.123 2.893 4.337 . 0 0 "[ . 1 . 2]" 1
437 1 20 LEU H 1 20 LEU HG . . 4.830 4.308 3.096 4.554 . 0 0 "[ . 1 . 2]" 1
438 1 20 LEU H 1 21 PHE H . . 3.780 2.498 2.327 2.865 . 0 0 "[ . 1 . 2]" 1
439 1 20 LEU H 1 21 PHE HB3 . . 5.500 4.740 4.505 5.121 . 0 0 "[ . 1 . 2]" 1
440 1 20 LEU H 1 23 ARG H . . 5.300 4.932 4.796 5.119 . 0 0 "[ . 1 . 2]" 1
441 1 20 LEU HA 1 20 LEU MD1 . . 3.920 2.475 1.950 3.753 . 0 0 "[ . 1 . 2]" 1
442 1 20 LEU HA 1 20 LEU QD . . 2.870 2.179 1.944 2.739 . 0 0 "[ . 1 . 2]" 1
443 1 20 LEU HA 1 20 LEU MD2 . . 3.920 3.390 2.258 3.872 . 0 0 "[ . 1 . 2]" 1
444 1 20 LEU HA 1 20 LEU HG . . 3.700 3.025 2.313 3.650 . 0 0 "[ . 1 . 2]" 1
445 1 20 LEU HA 1 23 ARG H . . 4.000 3.338 3.167 3.494 . 0 0 "[ . 1 . 2]" 1
446 1 20 LEU HA 1 23 ARG QB . . 3.220 2.618 2.371 2.894 . 0 0 "[ . 1 . 2]" 1
447 1 20 LEU HA 1 23 ARG QD . . 4.280 3.408 1.987 4.282 0.002 6 0 "[ . 1 . 2]" 1
448 1 20 LEU HA 1 24 TYR QD . . 4.540 4.309 3.623 4.544 0.004 1 0 "[ . 1 . 2]" 1
449 1 20 LEU HA 1 24 TYR QE . . 5.480 5.313 4.521 5.486 0.006 5 0 "[ . 1 . 2]" 1
450 1 20 LEU HA 1 40 LEU QD . . 4.330 4.227 3.845 4.331 0.001 19 0 "[ . 1 . 2]" 1
451 1 20 LEU QB 1 21 PHE H . . 3.560 2.684 2.441 2.862 . 0 0 "[ . 1 . 2]" 1
452 1 20 LEU QB 1 22 LYS H . . 5.340 4.941 4.640 5.243 . 0 0 "[ . 1 . 2]" 1
453 1 20 LEU QB 1 24 TYR QE . . 5.340 4.640 3.464 5.183 . 0 0 "[ . 1 . 2]" 1
454 1 20 LEU QB 1 40 LEU QD . . 3.220 2.532 1.920 2.829 . 0 0 "[ . 1 . 2]" 1
455 1 20 LEU QB 1 44 THR H . . 5.340 4.807 4.015 5.111 . 0 0 "[ . 1 . 2]" 1
456 1 20 LEU QB 1 44 THR HA . . 4.570 3.407 2.655 3.751 . 0 0 "[ . 1 . 2]" 1
457 1 20 LEU QB 1 80 TYR QE . . 5.340 3.889 3.635 4.216 . 0 0 "[ . 1 . 2]" 1
458 1 20 LEU HB2 1 21 PHE H . . 4.120 3.671 2.967 4.052 . 0 0 "[ . 1 . 2]" 1
459 1 20 LEU HB2 1 24 TYR QD . . 5.500 5.367 4.628 5.514 0.014 4 0 "[ . 1 . 2]" 1
460 1 20 LEU HB3 1 21 PHE H . . 4.120 2.804 2.473 3.286 . 0 0 "[ . 1 . 2]" 1
461 1 20 LEU HB3 1 24 TYR QD . . 5.500 4.480 3.016 5.163 . 0 0 "[ . 1 . 2]" 1
462 1 20 LEU QD 1 21 PHE H . . 4.830 4.001 3.592 4.164 . 0 0 "[ . 1 . 2]" 1
463 1 20 LEU QD 1 23 ARG H . . 5.250 4.117 3.843 4.641 . 0 0 "[ . 1 . 2]" 1
464 1 20 LEU QD 1 23 ARG QB . . 3.760 2.453 1.970 3.056 . 0 0 "[ . 1 . 2]" 1
465 1 20 LEU QD 1 23 ARG QD . . 3.560 2.434 1.906 3.038 . 0 0 "[ . 1 . 2]" 1
466 1 20 LEU QD 1 24 TYR QD . . 3.530 2.557 1.962 3.075 . 0 0 "[ . 1 . 2]" 1
467 1 20 LEU QD 1 24 TYR QE . . 3.100 2.337 1.872 2.667 . 0 0 "[ . 1 . 2]" 1
468 1 20 LEU QD 1 40 LEU QD . . 3.590 2.187 1.814 3.191 . 0 0 "[ . 1 . 2]" 1
469 1 20 LEU QD 1 43 ASP H . . 4.620 3.492 3.273 3.984 . 0 0 "[ . 1 . 2]" 1
470 1 20 LEU QD 1 43 ASP HA . . 3.940 3.613 3.429 3.907 . 0 0 "[ . 1 . 2]" 1
471 1 20 LEU QD 1 43 ASP QB . . 2.960 1.843 1.705 2.110 . 0 0 "[ . 1 . 2]" 1
472 1 20 LEU QD 1 44 THR H . . 4.110 2.662 2.382 3.401 . 0 0 "[ . 1 . 2]" 1
473 1 20 LEU QD 1 44 THR HA . . 2.800 1.969 1.888 2.482 . 0 0 "[ . 1 . 2]" 1
474 1 20 LEU QD 1 44 THR HB . . 4.410 3.707 3.454 4.456 0.046 18 0 "[ . 1 . 2]" 1
475 1 20 LEU QD 1 46 ALA MB . . 4.820 4.277 4.032 4.599 . 0 0 "[ . 1 . 2]" 1
476 1 20 LEU QD 1 47 GLU H . . 4.620 4.034 3.655 4.361 . 0 0 "[ . 1 . 2]" 1
477 1 20 LEU QD 1 47 GLU HB2 . . 3.490 3.324 2.816 3.497 0.007 11 0 "[ . 1 . 2]" 1
478 1 20 LEU QD 1 47 GLU QG . . 3.870 3.101 2.122 3.852 . 0 0 "[ . 1 . 2]" 1
479 1 20 LEU MD1 1 21 PHE H . . 5.500 4.523 3.977 4.803 . 0 0 "[ . 1 . 2]" 1
480 1 20 LEU MD1 1 24 TYR QD . . 4.980 3.191 2.093 4.862 . 0 0 "[ . 1 . 2]" 1
481 1 20 LEU MD1 1 24 TYR QE . . 4.140 2.907 1.875 4.128 . 0 0 "[ . 1 . 2]" 1
482 1 20 LEU MD1 1 40 LEU HA . . 5.500 4.592 3.205 5.069 . 0 0 "[ . 1 . 2]" 1
483 1 20 LEU MD1 1 43 ASP HA . . 5.290 4.556 3.583 5.231 . 0 0 "[ . 1 . 2]" 1
484 1 20 LEU MD2 1 21 PHE H . . 5.500 4.520 3.740 4.803 . 0 0 "[ . 1 . 2]" 1
485 1 20 LEU MD2 1 24 TYR QD . . 4.980 3.668 1.965 4.722 . 0 0 "[ . 1 . 2]" 1
486 1 20 LEU MD2 1 24 TYR QE . . 4.140 2.960 1.925 4.258 0.118 18 0 "[ . 1 . 2]" 1
487 1 20 LEU MD2 1 40 LEU HA . . 5.500 3.776 3.234 5.378 . 0 0 "[ . 1 . 2]" 1
488 1 20 LEU MD2 1 43 ASP HA . . 5.290 4.001 3.582 4.938 . 0 0 "[ . 1 . 2]" 1
489 1 20 LEU HG 1 21 PHE H . . 5.080 4.420 3.875 5.094 0.014 18 0 "[ . 1 . 2]" 1
490 1 20 LEU HG 1 24 TYR QD . . 5.020 3.458 2.570 5.009 . 0 0 "[ . 1 . 2]" 1
491 1 20 LEU HG 1 40 LEU QD . . 4.860 2.654 1.908 4.509 . 0 0 "[ . 1 . 2]" 1
492 1 20 LEU HG 1 44 THR HA . . 4.620 4.421 2.207 4.639 0.019 4 0 "[ . 1 . 2]" 1
493 1 21 PHE H 1 21 PHE HB2 . . 3.640 2.484 2.315 2.647 . 0 0 "[ . 1 . 2]" 1
494 1 21 PHE H 1 21 PHE HB3 . . 3.570 2.584 2.419 2.778 . 0 0 "[ . 1 . 2]" 1
495 1 21 PHE H 1 21 PHE QD . . 4.560 4.171 4.098 4.187 . 0 0 "[ . 1 . 2]" 1
496 1 21 PHE H 1 22 LYS H . . 4.010 2.868 2.700 3.033 . 0 0 "[ . 1 . 2]" 1
497 1 21 PHE H 1 40 LEU QD . . 4.350 3.393 2.940 3.659 . 0 0 "[ . 1 . 2]" 1
498 1 21 PHE H 1 77 LEU QD . . 4.940 3.889 3.548 4.493 . 0 0 "[ . 1 . 2]" 1
499 1 21 PHE H 1 80 TYR QE . . 4.810 3.803 3.407 4.247 . 0 0 "[ . 1 . 2]" 1
500 1 21 PHE HA 1 21 PHE QD . . 3.640 3.011 2.840 3.123 . 0 0 "[ . 1 . 2]" 1
501 1 21 PHE HA 1 21 PHE QE . . 5.270 4.695 4.604 4.762 . 0 0 "[ . 1 . 2]" 1
502 1 21 PHE HA 1 24 TYR H . . 4.790 3.573 3.306 3.742 . 0 0 "[ . 1 . 2]" 1
503 1 21 PHE HA 1 24 TYR QD . . 5.010 3.932 3.449 4.379 . 0 0 "[ . 1 . 2]" 1
504 1 21 PHE HA 1 32 LEU MD1 . . 4.940 3.589 2.643 4.950 0.010 16 0 "[ . 1 . 2]" 1
505 1 21 PHE HA 1 32 LEU QD . . 3.780 2.949 2.632 3.440 . 0 0 "[ . 1 . 2]" 1
506 1 21 PHE HA 1 32 LEU MD2 . . 4.940 4.242 2.918 4.946 0.006 9 0 "[ . 1 . 2]" 1
507 1 21 PHE HA 1 40 LEU MD1 . . 3.530 2.466 1.897 2.844 . 0 0 "[ . 1 . 2]" 1
508 1 21 PHE HA 1 40 LEU QD . . 3.060 2.265 1.866 2.516 . 0 0 "[ . 1 . 2]" 1
509 1 21 PHE HA 1 40 LEU MD2 . . 3.530 2.760 2.295 3.372 . 0 0 "[ . 1 . 2]" 1
510 1 21 PHE HA 1 77 LEU QD . . 5.360 4.406 4.168 4.728 . 0 0 "[ . 1 . 2]" 1
511 1 21 PHE HA 1 80 TYR QD . . 5.500 4.530 4.182 5.068 . 0 0 "[ . 1 . 2]" 1
512 1 21 PHE HA 1 80 TYR QE . . 4.400 4.038 3.638 4.392 . 0 0 "[ . 1 . 2]" 1
513 1 21 PHE HB2 1 22 LYS H . . 3.970 3.770 3.507 3.954 . 0 0 "[ . 1 . 2]" 1
514 1 21 PHE HB2 1 40 LEU MD1 . . 5.130 3.721 2.952 4.057 . 0 0 "[ . 1 . 2]" 1
515 1 21 PHE HB2 1 40 LEU QD . . 4.110 3.095 2.621 3.374 . 0 0 "[ . 1 . 2]" 1
516 1 21 PHE HB2 1 40 LEU MD2 . . 5.130 3.371 2.722 3.949 . 0 0 "[ . 1 . 2]" 1
517 1 21 PHE HB2 1 77 LEU MD1 . . 4.590 2.649 2.167 3.017 . 0 0 "[ . 1 . 2]" 1
518 1 21 PHE HB2 1 77 LEU QD . . 3.640 2.615 2.147 2.975 . 0 0 "[ . 1 . 2]" 1
519 1 21 PHE HB2 1 77 LEU MD2 . . 4.590 4.154 3.487 4.598 0.008 16 0 "[ . 1 . 2]" 1
520 1 21 PHE HB2 1 80 TYR QD . . 3.800 2.582 2.312 3.076 . 0 0 "[ . 1 . 2]" 1
521 1 21 PHE HB2 1 80 TYR QE . . 3.930 2.871 2.324 3.270 . 0 0 "[ . 1 . 2]" 1
522 1 21 PHE HB3 1 22 LYS H . . 3.560 2.410 2.112 2.679 . 0 0 "[ . 1 . 2]" 1
523 1 21 PHE HB3 1 22 LYS QG . . 4.760 3.730 3.065 4.496 . 0 0 "[ . 1 . 2]" 1
524 1 21 PHE HB3 1 40 LEU MD1 . . 5.080 4.771 4.136 5.083 0.003 9 0 "[ . 1 . 2]" 1
525 1 21 PHE HB3 1 40 LEU QD . . 4.420 4.186 3.793 4.426 0.006 4 0 "[ . 1 . 2]" 1
526 1 21 PHE HB3 1 40 LEU MD2 . . 5.080 4.671 4.087 5.074 . 0 0 "[ . 1 . 2]" 1
527 1 21 PHE HB3 1 77 LEU QD . . 3.870 2.298 1.896 2.807 . 0 0 "[ . 1 . 2]" 1
528 1 21 PHE HB3 1 80 TYR QD . . 4.240 3.973 3.585 4.256 0.016 4 0 "[ . 1 . 2]" 1
529 1 21 PHE HB3 1 80 TYR QE . . 4.930 4.514 3.920 4.931 0.001 19 0 "[ . 1 . 2]" 1
530 1 21 PHE QD 1 22 LYS H . . 4.150 3.130 2.556 3.304 . 0 0 "[ . 1 . 2]" 1
531 1 21 PHE QD 1 22 LYS HA . . 3.570 2.914 2.666 3.112 . 0 0 "[ . 1 . 2]" 1
532 1 21 PHE QD 1 22 LYS HB2 . . 4.760 4.601 4.187 4.765 0.005 16 0 "[ . 1 . 2]" 1
533 1 21 PHE QD 1 22 LYS HG2 . . 5.130 3.403 2.258 4.921 . 0 0 "[ . 1 . 2]" 1
534 1 21 PHE QD 1 22 LYS QG . . 4.290 2.999 2.210 3.415 . 0 0 "[ . 1 . 2]" 1
535 1 21 PHE QD 1 22 LYS HG3 . . 5.130 4.193 3.043 5.134 0.004 18 0 "[ . 1 . 2]" 1
536 1 21 PHE QD 1 24 TYR HB2 . . 5.210 4.812 4.549 4.927 . 0 0 "[ . 1 . 2]" 1
537 1 21 PHE QD 1 25 ASP QB . . 4.130 3.503 2.998 3.957 . 0 0 "[ . 1 . 2]" 1
538 1 21 PHE QD 1 30 GLY QA . . 4.480 3.976 3.237 4.478 . 0 0 "[ . 1 . 2]" 1
539 1 21 PHE QD 1 32 LEU MD1 . . 4.890 3.432 2.399 4.904 0.014 18 0 "[ . 1 . 2]" 1
540 1 21 PHE QD 1 32 LEU QD . . 3.620 2.760 2.393 3.633 0.013 16 0 "[ . 1 . 2]" 1
541 1 21 PHE QD 1 32 LEU MD2 . . 4.890 4.140 2.756 4.893 0.003 6 0 "[ . 1 . 2]" 1
542 1 21 PHE QD 1 32 LEU HG . . 5.500 4.607 3.626 5.511 0.011 17 0 "[ . 1 . 2]" 1
543 1 21 PHE QD 1 37 ILE MD . . 4.440 3.921 3.140 4.419 . 0 0 "[ . 1 . 2]" 1
544 1 21 PHE QD 1 40 LEU MD1 . . 4.360 3.708 2.469 4.329 . 0 0 "[ . 1 . 2]" 1
545 1 21 PHE QD 1 40 LEU QD . . 3.060 2.505 1.929 2.931 . 0 0 "[ . 1 . 2]" 1
546 1 21 PHE QD 1 40 LEU MD2 . . 4.360 2.820 1.935 4.266 . 0 0 "[ . 1 . 2]" 1
547 1 21 PHE QD 1 75 VAL QG . . 5.440 4.640 3.981 5.047 . 0 0 "[ . 1 . 2]" 1
548 1 21 PHE QD 1 77 LEU HA . . 4.420 3.442 2.846 3.903 . 0 0 "[ . 1 . 2]" 1
549 1 21 PHE QD 1 77 LEU QB . . 4.500 2.936 2.561 3.512 . 0 0 "[ . 1 . 2]" 1
550 1 21 PHE QD 1 77 LEU MD1 . . 3.830 3.001 2.488 3.427 . 0 0 "[ . 1 . 2]" 1
551 1 21 PHE QD 1 77 LEU QD . . 3.220 2.740 2.407 2.969 . 0 0 "[ . 1 . 2]" 1
552 1 21 PHE QD 1 77 LEU MD2 . . 3.830 3.259 2.781 3.860 0.030 4 0 "[ . 1 . 2]" 1
553 1 21 PHE QD 1 77 LEU HG . . 5.280 4.864 2.567 5.258 . 0 0 "[ . 1 . 2]" 1
554 1 21 PHE QD 1 80 TYR QB . . 4.100 3.195 2.748 3.545 . 0 0 "[ . 1 . 2]" 1
555 1 21 PHE QD 1 80 TYR QD . . 2.860 2.409 2.121 2.854 . 0 0 "[ . 1 . 2]" 1
556 1 21 PHE QE 1 22 LYS H . . 5.500 5.364 4.791 5.502 0.002 13 0 "[ . 1 . 2]" 1
557 1 21 PHE QE 1 22 LYS HA . . 4.670 4.348 3.817 4.696 0.026 18 0 "[ . 1 . 2]" 1
558 1 21 PHE QE 1 25 ASP H . . 5.200 4.967 4.694 5.216 0.016 16 0 "[ . 1 . 2]" 1
559 1 21 PHE QE 1 25 ASP HB2 . . 4.760 3.320 2.708 3.762 . 0 0 "[ . 1 . 2]" 1
560 1 21 PHE QE 1 25 ASP QB . . 4.050 3.132 2.620 3.458 . 0 0 "[ . 1 . 2]" 1
561 1 21 PHE QE 1 25 ASP HB3 . . 4.760 3.899 3.439 4.461 . 0 0 "[ . 1 . 2]" 1
562 1 21 PHE QE 1 30 GLY HA2 . . 4.100 2.361 2.003 2.772 . 0 0 "[ . 1 . 2]" 1
563 1 21 PHE QE 1 30 GLY QA . . 3.370 2.336 1.989 2.728 . 0 0 "[ . 1 . 2]" 1
564 1 21 PHE QE 1 30 GLY HA3 . . 4.100 3.776 3.414 4.119 0.019 18 0 "[ . 1 . 2]" 1
565 1 21 PHE QE 1 31 GLN HA . . 4.190 3.720 2.969 4.187 . 0 0 "[ . 1 . 2]" 1
566 1 21 PHE QE 1 32 LEU H . . 4.840 3.710 2.649 4.282 . 0 0 "[ . 1 . 2]" 1
567 1 21 PHE QE 1 32 LEU HA . . 4.940 4.763 4.468 4.943 0.003 14 0 "[ . 1 . 2]" 1
568 1 21 PHE QE 1 32 LEU QB . . 4.880 2.345 1.968 2.973 . 0 0 "[ . 1 . 2]" 1
569 1 21 PHE QE 1 32 LEU MD1 . . 4.430 3.240 2.343 4.503 0.073 18 0 "[ . 1 . 2]" 1
570 1 21 PHE QE 1 32 LEU QD . . 3.710 2.711 2.334 3.450 . 0 0 "[ . 1 . 2]" 1
571 1 21 PHE QE 1 32 LEU MD2 . . 4.430 3.842 2.671 4.435 0.005 10 0 "[ . 1 . 2]" 1
572 1 21 PHE QE 1 32 LEU HG . . 4.630 3.740 3.174 4.592 . 0 0 "[ . 1 . 2]" 1
573 1 21 PHE QE 1 37 ILE MD . . 4.010 3.379 2.667 3.994 . 0 0 "[ . 1 . 2]" 1
574 1 21 PHE QE 1 40 LEU QD . . 4.190 3.723 3.229 4.112 . 0 0 "[ . 1 . 2]" 1
575 1 21 PHE QE 1 75 VAL MG1 . . 4.400 3.541 2.281 4.356 . 0 0 "[ . 1 . 2]" 1
576 1 21 PHE QE 1 75 VAL MG2 . . 4.400 3.928 3.333 4.421 0.021 16 0 "[ . 1 . 2]" 1
577 1 21 PHE QE 1 76 SER HA . . 4.110 3.500 2.799 4.020 . 0 0 "[ . 1 . 2]" 1
578 1 21 PHE QE 1 77 LEU HA . . 4.170 3.304 2.565 3.706 . 0 0 "[ . 1 . 2]" 1
579 1 21 PHE QE 1 77 LEU QB . . 4.440 2.944 2.531 3.390 . 0 0 "[ . 1 . 2]" 1
580 1 21 PHE QE 1 77 LEU QD . . 4.470 3.606 2.973 3.968 . 0 0 "[ . 1 . 2]" 1
581 1 21 PHE QE 1 80 TYR QB . . 4.210 3.096 2.575 3.503 . 0 0 "[ . 1 . 2]" 1
582 1 21 PHE HZ 1 30 GLY QA . . 5.330 3.901 3.365 4.478 . 0 0 "[ . 1 . 2]" 1
583 1 21 PHE HZ 1 31 GLN HA . . 3.590 2.542 2.014 3.087 . 0 0 "[ . 1 . 2]" 1
584 1 21 PHE HZ 1 32 LEU H . . 4.620 3.012 2.238 3.843 . 0 0 "[ . 1 . 2]" 1
585 1 21 PHE HZ 1 32 LEU QB . . 5.040 2.866 2.410 3.720 . 0 0 "[ . 1 . 2]" 1
586 1 21 PHE HZ 1 32 LEU MD1 . . 5.300 3.941 3.193 5.269 . 0 0 "[ . 1 . 2]" 1
587 1 21 PHE HZ 1 32 LEU QD . . 4.610 3.554 3.141 4.026 . 0 0 "[ . 1 . 2]" 1
588 1 21 PHE HZ 1 32 LEU MD2 . . 5.300 4.529 3.688 5.056 . 0 0 "[ . 1 . 2]" 1
589 1 21 PHE HZ 1 32 LEU HG . . 5.490 4.161 3.142 5.493 0.003 17 0 "[ . 1 . 2]" 1
590 1 21 PHE HZ 1 75 VAL QG . . 5.300 4.152 3.312 4.806 . 0 0 "[ . 1 . 2]" 1
591 1 21 PHE HZ 1 76 SER HA . . 3.800 2.628 2.168 3.158 . 0 0 "[ . 1 . 2]" 1
592 1 21 PHE HZ 1 77 LEU HA . . 4.850 4.050 3.699 4.604 . 0 0 "[ . 1 . 2]" 1
593 1 22 LYS H 1 22 LYS HB2 . . 3.070 2.279 2.114 2.598 . 0 0 "[ . 1 . 2]" 1
594 1 22 LYS H 1 22 LYS QG . . 3.350 2.734 2.053 3.354 0.004 10 0 "[ . 1 . 2]" 1
595 1 22 LYS H 1 23 ARG H . . 3.600 2.696 2.585 2.813 . 0 0 "[ . 1 . 2]" 1
596 1 22 LYS H 1 77 LEU QD . . 5.010 3.784 2.971 4.182 . 0 0 "[ . 1 . 2]" 1
597 1 22 LYS HA 1 22 LYS QD . . 3.790 2.776 1.996 3.775 . 0 0 "[ . 1 . 2]" 1
598 1 22 LYS HA 1 22 LYS QG . . 3.480 2.412 2.066 2.698 . 0 0 "[ . 1 . 2]" 1
599 1 22 LYS HA 1 25 ASP H . . 3.810 3.513 3.209 3.817 0.007 12 0 "[ . 1 . 2]" 1
600 1 22 LYS HA 1 25 ASP QB . . 3.430 2.753 2.441 3.095 . 0 0 "[ . 1 . 2]" 1
601 1 22 LYS HB2 1 22 LYS QE . . 4.630 3.723 2.575 4.412 . 0 0 "[ . 1 . 2]" 1
602 1 22 LYS HB2 1 23 ARG H . . 3.200 2.871 2.660 3.121 . 0 0 "[ . 1 . 2]" 1
603 1 22 LYS QE 1 22 LYS QG . . 3.080 2.218 2.015 2.472 . 0 0 "[ . 1 . 2]" 1
604 1 23 ARG H 1 23 ARG QB . . 3.230 2.236 2.090 2.477 . 0 0 "[ . 1 . 2]" 1
605 1 23 ARG H 1 23 ARG HG2 . . 4.850 4.377 3.337 4.574 . 0 0 "[ . 1 . 2]" 1
606 1 23 ARG H 1 23 ARG QG . . 4.140 3.717 2.094 3.983 . 0 0 "[ . 1 . 2]" 1
607 1 23 ARG H 1 23 ARG HG3 . . 4.850 4.076 2.111 4.474 . 0 0 "[ . 1 . 2]" 1
608 1 23 ARG H 1 24 TYR H . . 3.800 2.667 2.481 2.784 . 0 0 "[ . 1 . 2]" 1
609 1 23 ARG H 1 24 TYR HB2 . . 4.670 4.565 4.366 4.680 0.010 16 0 "[ . 1 . 2]" 1
610 1 23 ARG HA 1 23 ARG QD . . 4.560 3.989 3.418 4.161 . 0 0 "[ . 1 . 2]" 1
611 1 23 ARG HA 1 23 ARG HG2 . . 4.120 2.886 2.259 3.364 . 0 0 "[ . 1 . 2]" 1
612 1 23 ARG HA 1 23 ARG QG . . 3.390 2.357 2.223 2.477 . 0 0 "[ . 1 . 2]" 1
613 1 23 ARG HA 1 23 ARG HG3 . . 4.120 2.611 2.357 3.481 . 0 0 "[ . 1 . 2]" 1
614 1 23 ARG QB 1 23 ARG QD . . 3.070 2.132 2.061 2.242 . 0 0 "[ . 1 . 2]" 1
615 1 23 ARG QB 1 24 TYR H . . 3.510 2.683 2.380 2.910 . 0 0 "[ . 1 . 2]" 1
616 1 23 ARG QB 1 24 TYR QD . . 3.990 2.978 2.822 3.234 . 0 0 "[ . 1 . 2]" 1
617 1 23 ARG QB 1 24 TYR QE . . 4.550 4.385 4.131 4.554 0.004 2 0 "[ . 1 . 2]" 1
618 1 23 ARG QD 1 24 TYR QD . . 4.780 4.182 3.122 4.709 . 0 0 "[ . 1 . 2]" 1
619 1 23 ARG QD 1 24 TYR QE . . 4.880 4.474 3.539 4.886 0.006 16 0 "[ . 1 . 2]" 1
620 1 23 ARG QG 1 24 TYR QD . . 5.340 4.384 3.551 5.055 . 0 0 "[ . 1 . 2]" 1
621 1 24 TYR H 1 24 TYR HB2 . . 3.360 2.170 2.132 2.215 . 0 0 "[ . 1 . 2]" 1
622 1 24 TYR H 1 24 TYR HB3 . . 3.760 3.461 3.437 3.472 . 0 0 "[ . 1 . 2]" 1
623 1 24 TYR H 1 24 TYR QD . . 3.810 2.748 2.502 2.990 . 0 0 "[ . 1 . 2]" 1
624 1 24 TYR H 1 40 LEU QD . . 4.770 3.899 3.402 4.211 . 0 0 "[ . 1 . 2]" 1
625 1 24 TYR HA 1 24 TYR QD . . 3.550 3.006 2.879 3.037 . 0 0 "[ . 1 . 2]" 1
626 1 24 TYR HA 1 24 TYR QE . . 4.520 4.486 4.440 4.501 . 0 0 "[ . 1 . 2]" 1
627 1 24 TYR HA 1 32 LEU MD1 . . 4.930 4.471 3.742 4.938 0.008 18 0 "[ . 1 . 2]" 1
628 1 24 TYR HA 1 32 LEU QD . . 4.110 3.862 3.504 4.112 0.002 6 0 "[ . 1 . 2]" 1
629 1 24 TYR HA 1 32 LEU MD2 . . 4.930 4.309 3.857 4.923 . 0 0 "[ . 1 . 2]" 1
630 1 24 TYR HA 1 40 LEU QD . . 5.440 4.694 4.266 4.961 . 0 0 "[ . 1 . 2]" 1
631 1 24 TYR HB2 1 25 ASP H . . 3.240 2.680 2.643 2.886 . 0 0 "[ . 1 . 2]" 1
632 1 24 TYR HB2 1 32 LEU MD1 . . 3.940 2.796 2.217 3.737 . 0 0 "[ . 1 . 2]" 1
633 1 24 TYR HB2 1 32 LEU MD2 . . 3.940 2.980 2.192 3.596 . 0 0 "[ . 1 . 2]" 1
634 1 24 TYR HB2 1 40 LEU MD1 . . 5.010 2.918 2.059 3.427 . 0 0 "[ . 1 . 2]" 1
635 1 24 TYR HB2 1 40 LEU QD . . 4.040 2.767 2.055 3.220 . 0 0 "[ . 1 . 2]" 1
636 1 24 TYR HB2 1 40 LEU MD2 . . 5.010 3.735 3.115 4.460 . 0 0 "[ . 1 . 2]" 1
637 1 24 TYR HB3 1 25 ASP H . . 5.140 2.980 2.932 3.174 . 0 0 "[ . 1 . 2]" 1
638 1 24 TYR HB3 1 32 LEU MD1 . . 4.240 2.308 1.940 2.772 . 0 0 "[ . 1 . 2]" 1
639 1 24 TYR HB3 1 32 LEU MD2 . . 4.240 2.157 1.924 2.767 . 0 0 "[ . 1 . 2]" 1
640 1 24 TYR HB3 1 40 LEU MD1 . . 5.500 3.832 2.745 4.404 . 0 0 "[ . 1 . 2]" 1
641 1 24 TYR HB3 1 40 LEU QD . . 4.590 3.489 2.737 4.026 . 0 0 "[ . 1 . 2]" 1
642 1 24 TYR HB3 1 40 LEU MD2 . . 5.500 4.386 3.642 5.415 . 0 0 "[ . 1 . 2]" 1
643 1 24 TYR QD 1 25 ASP HA . . 5.500 5.492 5.440 5.510 0.010 3 0 "[ . 1 . 2]" 1
644 1 24 TYR QD 1 32 LEU MD1 . . 4.000 3.299 2.621 3.666 . 0 0 "[ . 1 . 2]" 1
645 1 24 TYR QD 1 32 LEU MD2 . . 4.000 3.126 2.797 3.597 . 0 0 "[ . 1 . 2]" 1
646 1 24 TYR QD 1 36 GLU HA . . 5.190 4.813 4.432 5.160 . 0 0 "[ . 1 . 2]" 1
647 1 24 TYR QD 1 36 GLU QB . . 3.920 3.292 2.419 3.928 0.008 4 0 "[ . 1 . 2]" 1
648 1 24 TYR QD 1 36 GLU QG . . 4.670 3.048 1.915 4.338 . 0 0 "[ . 1 . 2]" 1
649 1 24 TYR QD 1 40 LEU HA . . 4.220 4.039 3.795 4.220 . 0 0 "[ . 1 . 2]" 1
650 1 24 TYR QD 1 40 LEU HB2 . . 5.500 3.644 3.252 4.076 . 0 0 "[ . 1 . 2]" 1
651 1 24 TYR QD 1 40 LEU HB3 . . 5.500 5.033 4.765 5.348 . 0 0 "[ . 1 . 2]" 1
652 1 24 TYR QD 1 40 LEU MD1 . . 4.270 2.616 2.144 3.538 . 0 0 "[ . 1 . 2]" 1
653 1 24 TYR QD 1 40 LEU QD . . 3.360 2.547 2.133 3.111 . 0 0 "[ . 1 . 2]" 1
654 1 24 TYR QD 1 40 LEU MD2 . . 4.270 3.888 3.329 4.153 . 0 0 "[ . 1 . 2]" 1
655 1 24 TYR QD 1 40 LEU HG . . 5.500 4.619 2.545 5.384 . 0 0 "[ . 1 . 2]" 1
656 1 24 TYR QE 1 32 LEU QD . . 4.670 4.271 3.989 4.501 . 0 0 "[ . 1 . 2]" 1
657 1 24 TYR QE 1 36 GLU HA . . 4.510 4.380 3.709 4.515 0.005 2 0 "[ . 1 . 2]" 1
658 1 24 TYR QE 1 36 GLU QB . . 4.610 4.132 3.206 4.611 0.001 15 0 "[ . 1 . 2]" 1
659 1 24 TYR QE 1 36 GLU QG . . 4.980 3.678 2.262 4.977 . 0 0 "[ . 1 . 2]" 1
660 1 24 TYR QE 1 39 GLY HA2 . . 5.440 5.368 4.966 5.466 0.026 18 0 "[ . 1 . 2]" 1
661 1 24 TYR QE 1 39 GLY HA3 . . 4.520 4.025 3.690 4.189 . 0 0 "[ . 1 . 2]" 1
662 1 24 TYR QE 1 40 LEU HA . . 3.720 2.883 2.476 3.193 . 0 0 "[ . 1 . 2]" 1
663 1 24 TYR QE 1 40 LEU QB . . 4.080 3.510 3.145 3.935 . 0 0 "[ . 1 . 2]" 1
664 1 24 TYR QE 1 40 LEU MD1 . . 4.670 2.994 2.196 4.480 . 0 0 "[ . 1 . 2]" 1
665 1 24 TYR QE 1 40 LEU QD . . 3.430 2.815 2.192 3.467 0.037 18 0 "[ . 1 . 2]" 1
666 1 24 TYR QE 1 40 LEU MD2 . . 4.670 4.418 3.151 4.689 0.019 4 0 "[ . 1 . 2]" 1
667 1 24 TYR QE 1 43 ASP QB . . 3.530 2.963 2.594 3.293 . 0 0 "[ . 1 . 2]" 1
668 1 25 ASP H 1 25 ASP HB2 . . 3.480 2.498 2.222 2.765 . 0 0 "[ . 1 . 2]" 1
669 1 25 ASP H 1 25 ASP QB . . 3.050 2.215 2.154 2.252 . 0 0 "[ . 1 . 2]" 1
670 1 25 ASP H 1 25 ASP HB3 . . 3.480 2.587 2.326 2.892 . 0 0 "[ . 1 . 2]" 1
671 1 25 ASP H 1 32 LEU QD . . 4.610 2.762 2.157 3.142 . 0 0 "[ . 1 . 2]" 1
672 1 25 ASP H 1 32 LEU HG . . 5.500 4.487 3.672 5.511 0.011 3 0 "[ . 1 . 2]" 1
673 1 25 ASP HA 1 26 LYS H . . 3.050 2.201 2.152 2.359 . 0 0 "[ . 1 . 2]" 1
674 1 25 ASP HA 1 26 LYS HA . . 4.580 4.451 4.421 4.565 . 0 0 "[ . 1 . 2]" 1
675 1 25 ASP HA 1 32 LEU QD . . 3.190 2.567 1.947 3.173 . 0 0 "[ . 1 . 2]" 1
676 1 25 ASP QB 1 32 LEU QD . . 3.680 2.634 1.965 3.080 . 0 0 "[ . 1 . 2]" 1
677 1 25 ASP HB2 1 26 LYS H . . 4.800 4.502 4.352 4.645 . 0 0 "[ . 1 . 2]" 1
678 1 25 ASP HB3 1 26 LYS H . . 4.800 4.414 4.197 4.547 . 0 0 "[ . 1 . 2]" 1
679 1 26 LYS H 1 26 LYS QB . . 3.120 2.451 2.179 2.629 . 0 0 "[ . 1 . 2]" 1
680 1 26 LYS H 1 26 LYS QG . . 3.440 2.399 1.957 3.007 . 0 0 "[ . 1 . 2]" 1
681 1 26 LYS H 1 27 ASP H . . 3.260 2.426 2.312 2.713 . 0 0 "[ . 1 . 2]" 1
682 1 26 LYS H 1 27 ASP QB . . 5.120 4.428 4.070 5.005 . 0 0 "[ . 1 . 2]" 1
683 1 26 LYS H 1 32 LEU QD . . 4.730 3.975 3.338 4.644 . 0 0 "[ . 1 . 2]" 1
684 1 26 LYS HA 1 26 LYS QD . . 3.900 3.474 2.023 3.913 0.013 4 0 "[ . 1 . 2]" 1
685 1 26 LYS HA 1 26 LYS QG . . 3.320 2.663 2.215 3.383 0.063 5 0 "[ . 1 . 2]" 1
686 1 26 LYS QB 1 27 ASP H . . 3.520 2.987 2.522 3.519 . 0 0 "[ . 1 . 2]" 1
687 1 26 LYS QD 1 26 LYS QG . . 2.360 2.054 2.012 2.092 . 0 0 "[ . 1 . 2]" 1
688 1 26 LYS QG 1 27 ASP H . . 4.470 3.717 2.029 4.469 . 0 0 "[ . 1 . 2]" 1
689 1 26 LYS QG 1 32 LEU QD . . 5.280 4.771 3.896 5.283 0.003 9 0 "[ . 1 . 2]" 1
690 1 27 ASP H 1 28 GLY H . . 3.290 2.526 2.208 2.579 . 0 0 "[ . 1 . 2]" 1
691 1 27 ASP H 1 28 GLY QA . . 5.220 4.411 4.136 4.456 . 0 0 "[ . 1 . 2]" 1
692 1 27 ASP H 1 29 SER H . . 4.350 4.079 3.835 4.196 . 0 0 "[ . 1 . 2]" 1
693 1 27 ASP HA 1 28 GLY QA . . 4.690 4.298 4.257 4.319 . 0 0 "[ . 1 . 2]" 1
694 1 27 ASP QB 1 28 GLY H . . 4.210 3.194 3.127 3.697 . 0 0 "[ . 1 . 2]" 1
695 1 28 GLY H 1 29 SER H . . 3.660 2.714 2.557 2.787 . 0 0 "[ . 1 . 2]" 1
696 1 28 GLY H 1 30 GLY H . . 4.800 4.090 3.919 4.282 . 0 0 "[ . 1 . 2]" 1
697 1 29 SER H 1 29 SER QB . . 3.700 2.460 2.206 2.925 . 0 0 "[ . 1 . 2]" 1
698 1 29 SER H 1 30 GLY H . . 3.420 2.286 2.019 2.521 . 0 0 "[ . 1 . 2]" 1
699 1 29 SER HA 1 29 SER QB . . 2.610 2.327 2.172 2.481 . 0 0 "[ . 1 . 2]" 1
700 1 29 SER QB 1 31 GLN H . . 4.790 3.278 2.520 4.122 . 0 0 "[ . 1 . 2]" 1
701 1 30 GLY H 1 31 GLN H . . 3.590 2.267 2.108 2.597 . 0 0 "[ . 1 . 2]" 1
702 1 31 GLN H 1 31 GLN QB . . 3.460 2.657 2.293 3.303 . 0 0 "[ . 1 . 2]" 1
703 1 31 GLN H 1 31 GLN QG . . 4.210 3.239 2.207 4.155 . 0 0 "[ . 1 . 2]" 1
704 1 31 GLN HA 1 31 GLN HG2 . . 4.230 3.021 2.296 3.842 . 0 0 "[ . 1 . 2]" 1
705 1 31 GLN HA 1 31 GLN QG . . 3.570 2.577 2.124 3.325 . 0 0 "[ . 1 . 2]" 1
706 1 31 GLN HA 1 31 GLN HG3 . . 4.230 2.986 2.157 3.870 . 0 0 "[ . 1 . 2]" 1
707 1 31 GLN HA 1 32 LEU H . . 3.460 2.264 2.160 2.507 . 0 0 "[ . 1 . 2]" 1
708 1 31 GLN HA 1 32 LEU QB . . 5.180 3.976 3.765 4.122 . 0 0 "[ . 1 . 2]" 1
709 1 31 GLN HA 1 76 SER HA . . 3.350 2.282 2.019 2.711 . 0 0 "[ . 1 . 2]" 1
710 1 31 GLN HA 1 76 SER HB2 . . 5.460 4.285 2.692 5.082 . 0 0 "[ . 1 . 2]" 1
711 1 31 GLN HA 1 76 SER QB . . 4.630 3.509 2.367 4.121 . 0 0 "[ . 1 . 2]" 1
712 1 31 GLN HA 1 76 SER HB3 . . 5.460 3.975 2.386 5.383 . 0 0 "[ . 1 . 2]" 1
713 1 31 GLN QB 1 31 GLN QE . . 3.930 3.066 2.118 3.691 . 0 0 "[ . 1 . 2]" 1
714 1 31 GLN QB 1 32 LEU H . . 4.360 2.967 2.337 3.685 . 0 0 "[ . 1 . 2]" 1
715 1 31 GLN QB 1 76 SER HA . . 4.370 3.946 2.708 4.409 0.039 16 0 "[ . 1 . 2]" 1
716 1 31 GLN QG 1 32 LEU H . . 4.400 3.495 2.256 4.369 . 0 0 "[ . 1 . 2]" 1
717 1 31 GLN QG 1 76 SER HA . . 4.590 3.733 2.664 4.653 0.063 18 0 "[ . 1 . 2]" 1
718 1 32 LEU H 1 32 LEU QB . . 3.630 2.583 2.267 2.770 . 0 0 "[ . 1 . 2]" 1
719 1 32 LEU HA 1 32 LEU MD1 . . 3.880 3.139 1.949 3.831 . 0 0 "[ . 1 . 2]" 1
720 1 32 LEU HA 1 32 LEU QD . . 2.900 2.076 1.872 2.348 . 0 0 "[ . 1 . 2]" 1
721 1 32 LEU HA 1 32 LEU MD2 . . 3.880 2.634 1.970 3.864 . 0 0 "[ . 1 . 2]" 1
722 1 32 LEU HA 1 32 LEU HG . . 4.060 2.854 2.582 3.663 . 0 0 "[ . 1 . 2]" 1
723 1 32 LEU HA 1 33 GLN H . . 3.220 2.324 2.145 2.566 . 0 0 "[ . 1 . 2]" 1
724 1 32 LEU HA 1 33 GLN HG2 . . 5.500 4.382 3.631 5.500 0.000 12 0 "[ . 1 . 2]" 1
725 1 32 LEU HA 1 33 GLN HG3 . . 5.500 4.810 3.640 5.543 0.043 2 0 "[ . 1 . 2]" 1
726 1 32 LEU HA 1 36 GLU QB . . 5.340 4.409 3.880 4.943 . 0 0 "[ . 1 . 2]" 1
727 1 32 LEU QB 1 33 GLN H . . 3.820 2.937 2.105 3.735 . 0 0 "[ . 1 . 2]" 1
728 1 32 LEU QB 1 36 GLU QB . . 4.540 3.404 2.682 4.468 . 0 0 "[ . 1 . 2]" 1
729 1 32 LEU QB 1 37 ILE MD . . 4.510 2.609 1.986 2.989 . 0 0 "[ . 1 . 2]" 1
730 1 32 LEU QB 1 75 VAL QG . . 4.060 2.875 2.299 3.545 . 0 0 "[ . 1 . 2]" 1
731 1 32 LEU HB2 1 33 GLN H . . 4.620 4.044 3.613 4.443 . 0 0 "[ . 1 . 2]" 1
732 1 32 LEU HB2 1 37 ILE MD . . 5.120 3.431 2.955 4.345 . 0 0 "[ . 1 . 2]" 1
733 1 32 LEU HB3 1 33 GLN H . . 4.620 3.061 2.119 4.058 . 0 0 "[ . 1 . 2]" 1
734 1 32 LEU HB3 1 37 ILE MD . . 5.120 2.774 2.004 3.285 . 0 0 "[ . 1 . 2]" 1
735 1 32 LEU QD 1 33 GLN H . . 4.320 2.514 1.870 3.239 . 0 0 "[ . 1 . 2]" 1
736 1 32 LEU QD 1 36 GLU HA . . 5.440 4.508 4.020 4.880 . 0 0 "[ . 1 . 2]" 1
737 1 32 LEU QD 1 36 GLU QB . . 3.640 2.338 1.782 2.789 . 0 0 "[ . 1 . 2]" 1
738 1 32 LEU QD 1 36 GLU QG . . 5.280 2.688 2.101 3.856 . 0 0 "[ . 1 . 2]" 1
739 1 32 LEU QD 1 37 ILE HA . . 4.630 3.846 2.904 4.324 . 0 0 "[ . 1 . 2]" 1
740 1 32 LEU QD 1 37 ILE MD . . 3.770 2.695 1.852 3.188 . 0 0 "[ . 1 . 2]" 1
741 1 32 LEU QD 1 37 ILE HG12 . . 4.600 4.182 2.952 4.604 0.004 4 0 "[ . 1 . 2]" 1
742 1 32 LEU QD 1 37 ILE MG . . 4.970 4.656 4.005 4.976 0.006 4 0 "[ . 1 . 2]" 1
743 1 32 LEU QD 1 40 LEU QD . . 3.090 2.023 1.778 2.888 . 0 0 "[ . 1 . 2]" 1
744 1 32 LEU QD 1 75 VAL QG . . 4.340 3.775 3.192 4.260 . 0 0 "[ . 1 . 2]" 1
745 1 32 LEU MD1 1 33 GLN H . . 5.500 3.628 1.877 5.048 . 0 0 "[ . 1 . 2]" 1
746 1 32 LEU MD1 1 36 GLU HB2 . . 5.940 3.959 2.056 5.252 . 0 0 "[ . 1 . 2]" 1
747 1 32 LEU MD1 1 36 GLU HB3 . . 5.940 3.345 1.895 4.341 . 0 0 "[ . 1 . 2]" 1
748 1 32 LEU MD1 1 37 ILE HA . . 5.500 4.652 3.407 5.508 0.008 12 0 "[ . 1 . 2]" 1
749 1 32 LEU MD1 1 37 ILE MD . . 4.650 3.339 2.398 4.308 . 0 0 "[ . 1 . 2]" 1
750 1 32 LEU MD1 1 37 ILE HG12 . . 5.500 4.933 2.964 5.510 0.010 3 0 "[ . 1 . 2]" 1
751 1 32 LEU MD2 1 33 GLN H . . 5.500 3.170 2.337 4.520 . 0 0 "[ . 1 . 2]" 1
752 1 32 LEU MD2 1 36 GLU HB2 . . 5.940 3.316 2.327 4.433 . 0 0 "[ . 1 . 2]" 1
753 1 32 LEU MD2 1 36 GLU HB3 . . 5.940 2.778 2.149 4.110 . 0 0 "[ . 1 . 2]" 1
754 1 32 LEU MD2 1 37 ILE HA . . 5.500 4.711 2.915 5.523 0.023 18 0 "[ . 1 . 2]" 1
755 1 32 LEU MD2 1 37 ILE MD . . 4.650 3.557 1.855 4.398 . 0 0 "[ . 1 . 2]" 1
756 1 32 LEU MD2 1 37 ILE HG12 . . 5.500 4.913 3.414 5.524 0.024 16 0 "[ . 1 . 2]" 1
757 1 32 LEU HG 1 33 GLN H . . 4.690 3.878 1.950 4.684 . 0 0 "[ . 1 . 2]" 1
758 1 32 LEU HG 1 36 GLU QG . . 5.340 4.824 3.646 5.363 0.023 16 0 "[ . 1 . 2]" 1
759 1 33 GLN H 1 33 GLN QB . . 3.320 2.422 2.222 2.641 . 0 0 "[ . 1 . 2]" 1
760 1 33 GLN H 1 33 GLN QG . . 4.090 2.489 1.937 3.149 . 0 0 "[ . 1 . 2]" 1
761 1 33 GLN HA 1 74 SER HA . . 4.480 4.275 3.115 4.487 0.007 12 0 "[ . 1 . 2]" 1
762 1 33 GLN QB 1 34 ASP H . . 4.070 2.743 2.440 3.089 . 0 0 "[ . 1 . 2]" 1
763 1 33 GLN QB 1 35 ASP H . . 3.740 2.718 2.405 3.072 . 0 0 "[ . 1 . 2]" 1
764 1 33 GLN QB 1 35 ASP QB . . 3.970 3.166 2.850 3.758 . 0 0 "[ . 1 . 2]" 1
765 1 33 GLN QB 1 36 GLU H . . 3.790 2.798 2.377 3.582 . 0 0 "[ . 1 . 2]" 1
766 1 33 GLN HB2 1 35 ASP H . . 4.380 3.556 2.420 4.380 0.000 20 0 "[ . 1 . 2]" 1
767 1 33 GLN HB3 1 35 ASP H . . 4.380 3.125 2.451 4.382 0.002 10 0 "[ . 1 . 2]" 1
768 1 34 ASP H 1 34 ASP QB . . 3.490 2.397 2.194 2.729 . 0 0 "[ . 1 . 2]" 1
769 1 34 ASP H 1 75 VAL QG . . 5.280 3.406 2.582 4.301 . 0 0 "[ . 1 . 2]" 1
770 1 34 ASP HA 1 37 ILE H . . 4.720 3.331 3.078 3.620 . 0 0 "[ . 1 . 2]" 1
771 1 34 ASP HA 1 37 ILE HB . . 4.550 3.338 2.870 3.686 . 0 0 "[ . 1 . 2]" 1
772 1 34 ASP HA 1 37 ILE MD . . 3.740 3.554 3.237 3.748 0.008 16 0 "[ . 1 . 2]" 1
773 1 34 ASP HA 1 37 ILE HG12 . . 3.480 2.185 1.997 2.425 . 0 0 "[ . 1 . 2]" 1
774 1 34 ASP HA 1 37 ILE MG . . 4.390 4.215 3.941 4.398 0.008 9 0 "[ . 1 . 2]" 1
775 1 34 ASP HA 1 64 LEU QD . . 4.230 3.475 2.535 4.208 . 0 0 "[ . 1 . 2]" 1
776 1 34 ASP HA 1 75 VAL QG . . 3.720 2.750 1.997 3.519 . 0 0 "[ . 1 . 2]" 1
777 1 34 ASP QB 1 64 LEU QD . . 3.970 3.176 2.024 3.978 0.008 18 0 "[ . 1 . 2]" 1
778 1 34 ASP QB 1 75 VAL QG . . 4.120 3.375 2.456 4.115 . 0 0 "[ . 1 . 2]" 1
779 1 35 ASP H 1 35 ASP QB . . 2.920 2.302 2.135 2.498 . 0 0 "[ . 1 . 2]" 1
780 1 35 ASP H 1 36 GLU H . . 3.670 2.626 2.393 2.738 . 0 0 "[ . 1 . 2]" 1
781 1 35 ASP HA 1 35 ASP QB . . 2.480 2.392 2.174 2.480 0.000 12 0 "[ . 1 . 2]" 1
782 1 35 ASP HA 1 37 ILE H . . 4.980 4.042 3.847 4.386 . 0 0 "[ . 1 . 2]" 1
783 1 35 ASP HA 1 38 ALA H . . 5.120 3.867 3.668 4.126 . 0 0 "[ . 1 . 2]" 1
784 1 35 ASP HA 1 38 ALA MB . . 3.890 3.622 3.428 3.862 . 0 0 "[ . 1 . 2]" 1
785 1 36 GLU H 1 36 GLU QB . . 3.350 2.212 2.140 2.563 . 0 0 "[ . 1 . 2]" 1
786 1 36 GLU H 1 36 GLU QG . . 4.160 3.391 2.296 4.075 . 0 0 "[ . 1 . 2]" 1
787 1 36 GLU H 1 37 ILE H . . 3.350 2.455 2.324 2.667 . 0 0 "[ . 1 . 2]" 1
788 1 36 GLU H 1 37 ILE HG12 . . 4.660 3.762 3.613 4.029 . 0 0 "[ . 1 . 2]" 1
789 1 36 GLU HA 1 36 GLU HG2 . . 3.670 3.037 2.187 3.670 . 0 0 "[ . 1 . 2]" 1
790 1 36 GLU HA 1 36 GLU HG3 . . 3.670 3.044 2.093 3.647 . 0 0 "[ . 1 . 2]" 1
791 1 36 GLU HA 1 37 ILE MD . . 5.500 5.438 5.210 5.518 0.018 18 0 "[ . 1 . 2]" 1
792 1 36 GLU HA 1 38 ALA H . . 5.500 4.166 3.710 4.560 . 0 0 "[ . 1 . 2]" 1
793 1 36 GLU HA 1 38 ALA MB . . 5.010 4.433 4.108 4.802 . 0 0 "[ . 1 . 2]" 1
794 1 36 GLU QB 1 37 ILE HG12 . . 5.150 3.819 3.732 3.902 . 0 0 "[ . 1 . 2]" 1
795 1 36 GLU QG 1 37 ILE H . . 4.830 4.446 3.955 4.762 . 0 0 "[ . 1 . 2]" 1
796 1 37 ILE H 1 37 ILE HB . . 3.350 2.582 2.536 2.623 . 0 0 "[ . 1 . 2]" 1
797 1 37 ILE H 1 37 ILE MD . . 4.370 3.162 2.956 3.296 . 0 0 "[ . 1 . 2]" 1
798 1 37 ILE H 1 37 ILE HG12 . . 3.350 2.024 1.955 2.104 . 0 0 "[ . 1 . 2]" 1
799 1 37 ILE H 1 37 ILE MG . . 4.020 3.764 3.763 3.767 . 0 0 "[ . 1 . 2]" 1
800 1 37 ILE H 1 38 ALA H . . 3.710 2.763 2.648 2.903 . 0 0 "[ . 1 . 2]" 1
801 1 37 ILE HA 1 37 ILE MD . . 3.260 2.017 1.970 2.064 . 0 0 "[ . 1 . 2]" 1
802 1 37 ILE HA 1 37 ILE HG12 . . 3.750 3.043 3.005 3.136 . 0 0 "[ . 1 . 2]" 1
803 1 37 ILE HA 1 37 ILE MG . . 3.240 2.331 2.280 2.400 . 0 0 "[ . 1 . 2]" 1
804 1 37 ILE HA 1 40 LEU HB2 . . 4.010 3.218 2.523 3.760 . 0 0 "[ . 1 . 2]" 1
805 1 37 ILE HA 1 40 LEU QB . . 3.390 2.145 1.969 2.408 . 0 0 "[ . 1 . 2]" 1
806 1 37 ILE HA 1 40 LEU HB3 . . 4.010 2.222 1.997 3.045 . 0 0 "[ . 1 . 2]" 1
807 1 37 ILE HA 1 40 LEU MD1 . . 4.870 4.279 2.745 4.866 . 0 0 "[ . 1 . 2]" 1
808 1 37 ILE HA 1 40 LEU QD . . 3.660 2.800 2.488 3.096 . 0 0 "[ . 1 . 2]" 1
809 1 37 ILE HA 1 40 LEU MD2 . . 4.870 3.124 2.500 4.770 . 0 0 "[ . 1 . 2]" 1
810 1 37 ILE HA 1 40 LEU HG . . 4.810 4.224 3.797 4.834 0.024 18 0 "[ . 1 . 2]" 1
811 1 37 ILE HA 1 60 VAL MG1 . . 5.500 5.187 4.591 5.505 0.005 17 0 "[ . 1 . 2]" 1
812 1 37 ILE HA 1 80 TYR QE . . 5.300 4.746 4.250 5.174 . 0 0 "[ . 1 . 2]" 1
813 1 37 ILE HB 1 38 ALA H . . 3.950 2.586 2.301 2.992 . 0 0 "[ . 1 . 2]" 1
814 1 37 ILE HB 1 38 ALA MB . . 4.380 4.074 3.890 4.217 . 0 0 "[ . 1 . 2]" 1
815 1 37 ILE HB 1 41 LEU QD . . 4.600 4.437 3.872 4.607 0.007 1 0 "[ . 1 . 2]" 1
816 1 37 ILE HB 1 60 VAL MG1 . . 3.990 3.243 2.901 3.533 . 0 0 "[ . 1 . 2]" 1
817 1 37 ILE MD 1 37 ILE MG . . 3.020 2.025 1.930 2.107 . 0 0 "[ . 1 . 2]" 1
818 1 37 ILE MD 1 40 LEU MD1 . . 4.790 4.069 2.430 4.790 . 0 0 "[ . 1 . 2]" 1
819 1 37 ILE MD 1 40 LEU QD . . 3.680 2.376 2.015 2.798 . 0 0 "[ . 1 . 2]" 1
820 1 37 ILE MD 1 40 LEU MD2 . . 4.790 2.749 2.019 4.732 . 0 0 "[ . 1 . 2]" 1
821 1 37 ILE MD 1 75 VAL MG1 . . 3.660 2.265 1.828 2.801 . 0 0 "[ . 1 . 2]" 1
822 1 37 ILE MD 1 75 VAL QG . . 3.140 2.169 1.795 2.652 . 0 0 "[ . 1 . 2]" 1
823 1 37 ILE MD 1 75 VAL MG2 . . 3.660 2.892 1.928 3.427 . 0 0 "[ . 1 . 2]" 1
824 1 37 ILE MD 1 80 TYR H . . 5.500 5.423 5.231 5.531 0.031 18 0 "[ . 1 . 2]" 1
825 1 37 ILE MD 1 80 TYR HA . . 5.000 4.356 3.872 4.879 . 0 0 "[ . 1 . 2]" 1
826 1 37 ILE MD 1 80 TYR QB . . 5.340 3.350 3.074 3.832 . 0 0 "[ . 1 . 2]" 1
827 1 37 ILE MD 1 80 TYR QD . . 3.680 3.210 2.760 3.677 . 0 0 "[ . 1 . 2]" 1
828 1 37 ILE MD 1 80 TYR QE . . 4.560 3.637 3.348 4.021 . 0 0 "[ . 1 . 2]" 1
829 1 37 ILE HG12 1 37 ILE MG . . 3.410 3.197 3.186 3.202 . 0 0 "[ . 1 . 2]" 1
830 1 37 ILE HG12 1 40 LEU QD . . 5.440 4.470 4.152 4.748 . 0 0 "[ . 1 . 2]" 1
831 1 37 ILE HG12 1 75 VAL QG . . 3.730 2.943 2.418 3.547 . 0 0 "[ . 1 . 2]" 1
832 1 37 ILE MG 1 38 ALA H . . 3.980 3.448 3.152 3.795 . 0 0 "[ . 1 . 2]" 1
833 1 37 ILE MG 1 38 ALA HA . . 4.000 3.504 3.272 3.721 . 0 0 "[ . 1 . 2]" 1
834 1 37 ILE MG 1 38 ALA MB . . 4.850 4.244 4.001 4.437 . 0 0 "[ . 1 . 2]" 1
835 1 37 ILE MG 1 40 LEU QD . . 4.030 3.279 2.705 3.849 . 0 0 "[ . 1 . 2]" 1
836 1 37 ILE MG 1 41 LEU HA . . 5.330 4.769 4.519 5.036 . 0 0 "[ . 1 . 2]" 1
837 1 37 ILE MG 1 41 LEU HB2 . . 4.230 3.842 3.547 4.192 . 0 0 "[ . 1 . 2]" 1
838 1 37 ILE MG 1 41 LEU HB3 . . 5.460 4.927 4.742 5.248 . 0 0 "[ . 1 . 2]" 1
839 1 37 ILE MG 1 41 LEU QD . . 2.930 2.392 1.858 2.600 . 0 0 "[ . 1 . 2]" 1
840 1 37 ILE MG 1 41 LEU HG . . 3.980 2.911 2.493 3.891 . 0 0 "[ . 1 . 2]" 1
841 1 37 ILE MG 1 80 TYR HA . . 5.500 4.867 4.452 5.220 . 0 0 "[ . 1 . 2]" 1
842 1 37 ILE MG 1 80 TYR QB . . 5.340 4.692 4.190 5.171 . 0 0 "[ . 1 . 2]" 1
843 1 37 ILE MG 1 80 TYR QD . . 3.530 3.335 2.961 3.533 0.003 18 0 "[ . 1 . 2]" 1
844 1 37 ILE MG 1 80 TYR QE . . 3.160 2.866 2.510 3.162 0.002 16 0 "[ . 1 . 2]" 1
845 1 38 ALA H 1 38 ALA MB . . 3.110 2.097 2.030 2.226 . 0 0 "[ . 1 . 2]" 1
846 1 38 ALA H 1 39 GLY H . . 3.970 2.919 2.799 3.013 . 0 0 "[ . 1 . 2]" 1
847 1 38 ALA HA 1 40 LEU H . . 5.160 4.422 4.137 4.864 . 0 0 "[ . 1 . 2]" 1
848 1 38 ALA HA 1 41 LEU H . . 4.270 3.962 3.728 4.168 . 0 0 "[ . 1 . 2]" 1
849 1 38 ALA HA 1 41 LEU HB2 . . 3.860 3.406 3.066 3.761 . 0 0 "[ . 1 . 2]" 1
850 1 38 ALA HA 1 41 LEU QD . . 3.590 3.396 2.926 3.572 . 0 0 "[ . 1 . 2]" 1
851 1 38 ALA HA 1 60 VAL MG1 . . 4.650 3.808 2.807 4.461 . 0 0 "[ . 1 . 2]" 1
852 1 38 ALA HA 1 60 VAL MG2 . . 4.230 3.860 3.269 4.202 . 0 0 "[ . 1 . 2]" 1
853 1 38 ALA MB 1 39 GLY H . . 3.790 2.454 2.235 2.738 . 0 0 "[ . 1 . 2]" 1
854 1 38 ALA MB 1 39 GLY HA2 . . 4.580 3.737 3.652 3.822 . 0 0 "[ . 1 . 2]" 1
855 1 38 ALA MB 1 39 GLY HA3 . . 4.390 4.011 3.888 4.177 . 0 0 "[ . 1 . 2]" 1
856 1 38 ALA MB 1 40 LEU H . . 5.310 4.290 4.088 4.525 . 0 0 "[ . 1 . 2]" 1
857 1 38 ALA MB 1 41 LEU HB2 . . 5.500 4.753 4.457 5.027 . 0 0 "[ . 1 . 2]" 1
858 1 38 ALA MB 1 41 LEU QD . . 4.610 4.489 4.143 4.614 0.004 18 0 "[ . 1 . 2]" 1
859 1 38 ALA MB 1 42 LYS HB2 . . 5.500 5.423 5.199 5.515 0.015 16 0 "[ . 1 . 2]" 1
860 1 38 ALA MB 1 57 LYS QB . . 5.080 4.998 4.122 5.101 0.021 14 0 "[ . 1 . 2]" 1
861 1 38 ALA MB 1 57 LYS QE . . 4.730 3.264 2.110 4.740 0.010 15 0 "[ . 1 . 2]" 1
862 1 38 ALA MB 1 60 VAL MG1 . . 4.960 4.047 3.164 4.664 . 0 0 "[ . 1 . 2]" 1
863 1 38 ALA MB 1 60 VAL MG2 . . 5.040 4.212 3.674 4.636 . 0 0 "[ . 1 . 2]" 1
864 1 39 GLY H 1 40 LEU H . . 3.560 2.522 2.369 2.615 . 0 0 "[ . 1 . 2]" 1
865 1 39 GLY HA2 1 42 LYS H . . 4.640 3.423 3.249 3.746 . 0 0 "[ . 1 . 2]" 1
866 1 39 GLY HA2 1 42 LYS HB2 . . 4.420 3.023 2.785 3.368 . 0 0 "[ . 1 . 2]" 1
867 1 39 GLY HA2 1 42 LYS HB3 . . 3.860 3.424 3.128 3.861 0.001 10 0 "[ . 1 . 2]" 1
868 1 39 GLY HA2 1 42 LYS QD . . 4.700 4.068 3.558 4.703 0.003 3 0 "[ . 1 . 2]" 1
869 1 39 GLY HA2 1 43 ASP H . . 5.390 4.939 4.629 5.167 . 0 0 "[ . 1 . 2]" 1
870 1 39 GLY HA3 1 42 LYS HB2 . . 5.490 4.638 4.310 4.980 . 0 0 "[ . 1 . 2]" 1
871 1 39 GLY HA3 1 42 LYS HB3 . . 5.420 4.575 4.346 5.080 . 0 0 "[ . 1 . 2]" 1
872 1 40 LEU H 1 40 LEU HB2 . . 3.430 2.654 2.191 2.838 . 0 0 "[ . 1 . 2]" 1
873 1 40 LEU H 1 40 LEU HB3 . . 3.430 2.397 2.238 2.948 . 0 0 "[ . 1 . 2]" 1
874 1 40 LEU H 1 40 LEU QD . . 4.370 3.733 3.688 3.763 . 0 0 "[ . 1 . 2]" 1
875 1 40 LEU H 1 40 LEU HG . . 5.500 4.301 4.140 4.449 . 0 0 "[ . 1 . 2]" 1
876 1 40 LEU H 1 41 LEU H . . 3.870 2.645 2.495 2.836 . 0 0 "[ . 1 . 2]" 1
877 1 40 LEU HA 1 40 LEU MD1 . . 4.350 2.589 2.130 3.802 . 0 0 "[ . 1 . 2]" 1
878 1 40 LEU HA 1 40 LEU QD . . 3.020 2.328 2.120 3.027 0.007 20 0 "[ . 1 . 2]" 1
879 1 40 LEU HA 1 40 LEU MD2 . . 4.350 3.645 2.372 3.950 . 0 0 "[ . 1 . 2]" 1
880 1 40 LEU HA 1 40 LEU HG . . 4.080 3.162 2.423 3.463 . 0 0 "[ . 1 . 2]" 1
881 1 40 LEU HA 1 43 ASP H . . 4.560 3.699 3.487 3.798 . 0 0 "[ . 1 . 2]" 1
882 1 40 LEU HA 1 43 ASP QB . . 3.700 3.525 3.115 3.710 0.010 18 0 "[ . 1 . 2]" 1
883 1 40 LEU QB 1 41 LEU H . . 3.540 2.648 2.367 2.869 . 0 0 "[ . 1 . 2]" 1
884 1 40 LEU HB2 1 41 LEU H . . 4.410 3.938 3.406 4.149 . 0 0 "[ . 1 . 2]" 1
885 1 40 LEU HB3 1 41 LEU H . . 4.410 2.693 2.404 2.925 . 0 0 "[ . 1 . 2]" 1
886 1 40 LEU QD 1 41 LEU H . . 5.040 3.668 3.067 3.916 . 0 0 "[ . 1 . 2]" 1
887 1 40 LEU QD 1 41 LEU HA . . 5.410 3.674 2.814 4.012 . 0 0 "[ . 1 . 2]" 1
888 1 40 LEU QD 1 41 LEU QD . . 5.190 3.656 2.828 4.064 . 0 0 "[ . 1 . 2]" 1
889 1 40 LEU QD 1 43 ASP QB . . 4.340 3.429 2.905 4.239 . 0 0 "[ . 1 . 2]" 1
890 1 40 LEU QD 1 44 THR H . . 4.460 3.632 2.951 4.039 . 0 0 "[ . 1 . 2]" 1
891 1 40 LEU QD 1 80 TYR QD . . 3.800 3.274 3.052 3.727 . 0 0 "[ . 1 . 2]" 1
892 1 40 LEU QD 1 80 TYR QE . . 3.250 2.475 2.287 2.715 . 0 0 "[ . 1 . 2]" 1
893 1 40 LEU MD1 1 80 TYR QD . . 4.640 4.467 3.382 4.662 0.022 4 0 "[ . 1 . 2]" 1
894 1 40 LEU MD1 1 80 TYR QE . . 3.880 3.179 2.693 3.651 . 0 0 "[ . 1 . 2]" 1
895 1 40 LEU MD2 1 80 TYR QD . . 4.640 3.479 3.095 4.450 . 0 0 "[ . 1 . 2]" 1
896 1 40 LEU MD2 1 80 TYR QE . . 3.880 2.594 2.350 2.852 . 0 0 "[ . 1 . 2]" 1
897 1 40 LEU HG 1 80 TYR QE . . 5.090 3.744 3.118 5.103 0.013 18 0 "[ . 1 . 2]" 1
898 1 41 LEU H 1 41 LEU HB2 . . 3.620 2.159 2.110 2.253 . 0 0 "[ . 1 . 2]" 1
899 1 41 LEU H 1 41 LEU HB3 . . 3.750 3.474 3.431 3.533 . 0 0 "[ . 1 . 2]" 1
900 1 41 LEU H 1 41 LEU QD . . 4.170 3.190 2.021 3.489 . 0 0 "[ . 1 . 2]" 1
901 1 41 LEU H 1 42 LYS H . . 3.910 2.649 2.536 2.834 . 0 0 "[ . 1 . 2]" 1
902 1 41 LEU HA 1 41 LEU MD1 . . 4.140 3.463 2.072 3.814 . 0 0 "[ . 1 . 2]" 1
903 1 41 LEU HA 1 41 LEU QD . . 2.920 2.129 1.991 2.272 . 0 0 "[ . 1 . 2]" 1
904 1 41 LEU HA 1 41 LEU MD2 . . 4.140 2.245 2.102 2.578 . 0 0 "[ . 1 . 2]" 1
905 1 41 LEU HA 1 44 THR H . . 4.300 3.065 2.961 3.530 . 0 0 "[ . 1 . 2]" 1
906 1 41 LEU HA 1 44 THR HB . . 3.360 2.026 1.986 2.190 . 0 0 "[ . 1 . 2]" 1
907 1 41 LEU HA 1 44 THR MG . . 3.900 3.454 3.371 3.676 . 0 0 "[ . 1 . 2]" 1
908 1 41 LEU HA 1 45 TYR QD . . 4.160 3.471 3.212 3.639 . 0 0 "[ . 1 . 2]" 1
909 1 41 LEU HA 1 45 TYR QE . . 4.690 4.615 4.375 4.709 0.019 8 0 "[ . 1 . 2]" 1
910 1 41 LEU HA 1 48 MET ME . . 5.070 4.886 4.569 5.064 . 0 0 "[ . 1 . 2]" 1
911 1 41 LEU HA 1 80 TYR QE . . 4.760 4.253 4.075 4.579 . 0 0 "[ . 1 . 2]" 1
912 1 41 LEU HA 1 84 ILE MD . . 4.410 3.972 3.729 4.232 . 0 0 "[ . 1 . 2]" 1
913 1 41 LEU HB2 1 42 LYS H . . 3.480 2.897 2.707 2.998 . 0 0 "[ . 1 . 2]" 1
914 1 41 LEU HB2 1 45 TYR QD . . 5.500 4.847 4.677 5.033 . 0 0 "[ . 1 . 2]" 1
915 1 41 LEU HB2 1 45 TYR QE . . 5.500 5.167 4.867 5.397 . 0 0 "[ . 1 . 2]" 1
916 1 41 LEU HB2 1 54 THR MG . . 5.500 5.384 4.815 5.517 0.017 4 0 "[ . 1 . 2]" 1
917 1 41 LEU HB2 1 55 PRO HG3 . . 3.690 3.165 2.957 3.397 . 0 0 "[ . 1 . 2]" 1
918 1 41 LEU HB2 1 80 TYR QE . . 5.260 5.131 4.774 5.262 0.002 6 0 "[ . 1 . 2]" 1
919 1 41 LEU HB3 1 42 LYS H . . 3.540 3.328 3.259 3.410 . 0 0 "[ . 1 . 2]" 1
920 1 41 LEU HB3 1 42 LYS HA . . 4.310 4.045 3.998 4.081 . 0 0 "[ . 1 . 2]" 1
921 1 41 LEU HB3 1 44 THR H . . 5.500 4.910 4.740 5.430 . 0 0 "[ . 1 . 2]" 1
922 1 41 LEU HB3 1 44 THR HB . . 5.290 4.039 3.862 4.465 . 0 0 "[ . 1 . 2]" 1
923 1 41 LEU HB3 1 45 TYR QD . . 4.650 3.256 3.020 3.523 . 0 0 "[ . 1 . 2]" 1
924 1 41 LEU HB3 1 45 TYR QE . . 5.450 3.726 3.385 4.005 . 0 0 "[ . 1 . 2]" 1
925 1 41 LEU HB3 1 54 THR MG . . 4.840 4.649 4.144 4.842 0.002 6 0 "[ . 1 . 2]" 1
926 1 41 LEU HB3 1 55 PRO QB . . 4.840 3.795 3.714 3.905 . 0 0 "[ . 1 . 2]" 1
927 1 41 LEU HB3 1 60 VAL MG2 . . 5.500 4.906 4.320 5.150 . 0 0 "[ . 1 . 2]" 1
928 1 41 LEU HB3 1 80 TYR QE . . 5.500 5.444 5.187 5.517 0.017 10 0 "[ . 1 . 2]" 1
929 1 41 LEU QD 1 42 LYS H . . 5.440 4.102 3.849 4.209 . 0 0 "[ . 1 . 2]" 1
930 1 41 LEU QD 1 44 THR HB . . 3.970 2.607 2.470 3.004 . 0 0 "[ . 1 . 2]" 1
931 1 41 LEU QD 1 45 TYR QD . . 3.510 2.130 2.001 2.251 . 0 0 "[ . 1 . 2]" 1
932 1 41 LEU QD 1 45 TYR QE . . 2.900 1.983 1.888 2.111 . 0 0 "[ . 1 . 2]" 1
933 1 41 LEU QD 1 54 THR HA . . 5.440 5.205 5.040 5.458 0.018 10 0 "[ . 1 . 2]" 1
934 1 41 LEU QD 1 55 PRO QB . . 3.660 2.278 2.001 3.132 . 0 0 "[ . 1 . 2]" 1
935 1 41 LEU QD 1 55 PRO QD . . 4.320 3.324 3.176 3.525 . 0 0 "[ . 1 . 2]" 1
936 1 41 LEU QD 1 60 VAL HA . . 4.290 4.295 4.241 4.347 0.057 16 0 "[ . 1 . 2]" 1
937 1 41 LEU QD 1 63 TRP HE3 . . 5.440 3.558 3.306 3.783 . 0 0 "[ . 1 . 2]" 1
938 1 41 LEU QD 1 63 TRP HZ3 . . 4.750 2.761 2.385 3.374 . 0 0 "[ . 1 . 2]" 1
939 1 41 LEU QD 1 80 TYR QD . . 4.920 4.037 3.419 4.311 . 0 0 "[ . 1 . 2]" 1
940 1 41 LEU QD 1 80 TYR QE . . 3.340 2.436 1.920 2.792 . 0 0 "[ . 1 . 2]" 1
941 1 41 LEU QD 1 83 LEU QD . . 3.410 2.185 1.782 2.494 . 0 0 "[ . 1 . 2]" 1
942 1 41 LEU QD 1 84 ILE HA . . 5.440 3.586 3.243 3.927 . 0 0 "[ . 1 . 2]" 1
943 1 41 LEU QD 1 84 ILE MD . . 3.060 2.011 1.824 2.423 . 0 0 "[ . 1 . 2]" 1
944 1 41 LEU QD 1 84 ILE HG13 . . 4.710 4.187 3.894 4.710 0.000 12 0 "[ . 1 . 2]" 1
945 1 41 LEU QD 1 87 SER QB . . 4.980 3.286 3.022 3.553 . 0 0 "[ . 1 . 2]" 1
946 1 41 LEU MD1 1 44 THR HB . . 4.930 4.525 2.791 4.979 0.049 18 0 "[ . 1 . 2]" 1
947 1 41 LEU MD1 1 55 PRO HD2 . . 5.500 4.250 4.107 4.633 . 0 0 "[ . 1 . 2]" 1
948 1 41 LEU MD1 1 55 PRO HD3 . . 5.500 3.868 3.620 4.213 . 0 0 "[ . 1 . 2]" 1
949 1 41 LEU MD1 1 55 PRO HG3 . . 4.420 2.120 1.947 2.617 . 0 0 "[ . 1 . 2]" 1
950 1 41 LEU MD1 1 80 TYR QE . . 4.060 3.275 2.427 3.773 . 0 0 "[ . 1 . 2]" 1
951 1 41 LEU MD1 1 84 ILE MD . . 4.010 3.281 2.177 3.728 . 0 0 "[ . 1 . 2]" 1
952 1 41 LEU MD2 1 44 THR HB . . 4.930 2.865 2.477 4.151 . 0 0 "[ . 1 . 2]" 1
953 1 41 LEU MD2 1 55 PRO HD2 . . 5.500 5.001 4.440 5.554 0.054 10 0 "[ . 1 . 2]" 1
954 1 41 LEU MD2 1 55 PRO HD3 . . 5.500 4.320 3.614 5.562 0.062 16 0 "[ . 1 . 2]" 1
955 1 41 LEU MD2 1 55 PRO HG3 . . 4.420 2.995 2.330 3.741 . 0 0 "[ . 1 . 2]" 1
956 1 41 LEU MD2 1 80 TYR QE . . 4.060 2.524 1.973 3.057 . 0 0 "[ . 1 . 2]" 1
957 1 41 LEU MD2 1 84 ILE MD . . 4.010 2.267 1.832 3.653 . 0 0 "[ . 1 . 2]" 1
958 1 41 LEU HG 1 45 TYR QD . . 4.950 4.877 4.560 4.965 0.015 4 0 "[ . 1 . 2]" 1
959 1 41 LEU HG 1 45 TYR QE . . 4.720 4.527 3.763 4.725 0.005 18 0 "[ . 1 . 2]" 1
960 1 41 LEU HG 1 60 VAL MG2 . . 4.680 4.268 2.646 4.705 0.025 6 0 "[ . 1 . 2]" 1
961 1 41 LEU HG 1 80 TYR QE . . 4.230 3.029 2.375 4.239 0.009 16 0 "[ . 1 . 2]" 1
962 1 41 LEU HG 1 83 LEU QD . . 4.640 3.469 3.053 3.803 . 0 0 "[ . 1 . 2]" 1
963 1 41 LEU HG 1 84 ILE MD . . 4.870 3.823 3.324 4.777 . 0 0 "[ . 1 . 2]" 1
964 1 42 LYS H 1 42 LYS HB2 . . 3.590 2.355 2.171 2.509 . 0 0 "[ . 1 . 2]" 1
965 1 42 LYS H 1 42 LYS HB3 . . 3.380 2.713 2.542 2.947 . 0 0 "[ . 1 . 2]" 1
966 1 42 LYS H 1 43 ASP H . . 3.510 2.849 2.806 2.949 . 0 0 "[ . 1 . 2]" 1
967 1 42 LYS H 1 44 THR H . . 5.110 3.923 3.840 4.241 . 0 0 "[ . 1 . 2]" 1
968 1 42 LYS H 1 54 THR MG . . 5.280 5.182 4.799 5.293 0.013 11 0 "[ . 1 . 2]" 1
969 1 42 LYS HA 1 42 LYS QD . . 4.040 3.658 2.191 4.048 0.008 7 0 "[ . 1 . 2]" 1
970 1 42 LYS HA 1 42 LYS HG2 . . 3.840 3.049 2.344 3.753 . 0 0 "[ . 1 . 2]" 1
971 1 42 LYS HA 1 42 LYS HG3 . . 3.840 2.656 2.234 3.535 . 0 0 "[ . 1 . 2]" 1
972 1 42 LYS HA 1 45 TYR H . . 4.400 4.185 4.054 4.291 . 0 0 "[ . 1 . 2]" 1
973 1 42 LYS HA 1 45 TYR HB2 . . 4.010 3.658 3.383 3.781 . 0 0 "[ . 1 . 2]" 1
974 1 42 LYS HA 1 45 TYR HB3 . . 5.340 5.165 4.772 5.344 0.004 13 0 "[ . 1 . 2]" 1
975 1 42 LYS HA 1 45 TYR QD . . 5.230 4.806 4.628 4.922 . 0 0 "[ . 1 . 2]" 1
976 1 42 LYS HA 1 54 THR MG . . 3.770 3.695 3.448 3.777 0.007 6 0 "[ . 1 . 2]" 1
977 1 42 LYS HB2 1 43 ASP H . . 4.550 3.739 3.347 3.882 . 0 0 "[ . 1 . 2]" 1
978 1 42 LYS HB2 1 54 THR MG . . 4.630 4.575 4.442 4.642 0.012 2 0 "[ . 1 . 2]" 1
979 1 42 LYS HB3 1 42 LYS QD . . 3.720 2.596 2.050 3.295 . 0 0 "[ . 1 . 2]" 1
980 1 42 LYS HB3 1 43 ASP H . . 3.610 2.517 2.193 2.659 . 0 0 "[ . 1 . 2]" 1
981 1 42 LYS QE 1 42 LYS QG . . 3.290 2.174 2.057 2.338 . 0 0 "[ . 1 . 2]" 1
982 1 42 LYS QG 1 43 ASP H . . 4.590 3.826 3.482 4.223 . 0 0 "[ . 1 . 2]" 1
983 1 42 LYS QG 1 43 ASP HA . . 4.830 4.036 3.634 4.667 . 0 0 "[ . 1 . 2]" 1
984 1 43 ASP H 1 43 ASP QB . . 3.240 2.295 2.191 2.509 . 0 0 "[ . 1 . 2]" 1
985 1 43 ASP H 1 44 THR H . . 3.560 2.352 2.313 2.618 . 0 0 "[ . 1 . 2]" 1
986 1 43 ASP H 1 44 THR HA . . 5.500 4.973 4.932 5.220 . 0 0 "[ . 1 . 2]" 1
987 1 43 ASP H 1 46 ALA H . . 5.240 4.999 4.741 5.118 . 0 0 "[ . 1 . 2]" 1
988 1 43 ASP HA 1 46 ALA H . . 3.910 3.602 3.395 3.830 . 0 0 "[ . 1 . 2]" 1
989 1 43 ASP HA 1 46 ALA MB . . 3.060 2.645 2.431 2.756 . 0 0 "[ . 1 . 2]" 1
990 1 43 ASP QB 1 44 THR H . . 3.440 2.868 2.488 2.980 . 0 0 "[ . 1 . 2]" 1
991 1 43 ASP QB 1 44 THR HA . . 4.350 3.973 3.848 4.086 . 0 0 "[ . 1 . 2]" 1
992 1 43 ASP QB 1 46 ALA MB . . 5.100 4.120 3.824 4.366 . 0 0 "[ . 1 . 2]" 1
993 1 44 THR H 1 44 THR HB . . 3.330 2.512 2.477 2.562 . 0 0 "[ . 1 . 2]" 1
994 1 44 THR H 1 44 THR MG . . 3.980 3.764 3.760 3.766 . 0 0 "[ . 1 . 2]" 1
995 1 44 THR H 1 45 TYR H . . 4.330 2.783 2.682 2.921 . 0 0 "[ . 1 . 2]" 1
996 1 44 THR H 1 45 TYR QD . . 4.810 4.519 4.361 4.818 0.008 16 0 "[ . 1 . 2]" 1
997 1 44 THR H 1 46 ALA H . . 5.500 4.133 3.858 4.338 . 0 0 "[ . 1 . 2]" 1
998 1 44 THR HA 1 44 THR MG . . 3.120 2.351 2.319 2.374 . 0 0 "[ . 1 . 2]" 1
999 1 44 THR HA 1 47 GLU H . . 4.480 3.700 3.452 3.877 . 0 0 "[ . 1 . 2]" 1
1000 1 44 THR HA 1 47 GLU HB2 . . 3.910 3.163 2.967 3.502 . 0 0 "[ . 1 . 2]" 1
1001 1 44 THR HB 1 45 TYR H . . 3.660 2.340 2.235 2.537 . 0 0 "[ . 1 . 2]" 1
1002 1 44 THR HB 1 45 TYR QD . . 3.760 2.887 2.812 3.014 . 0 0 "[ . 1 . 2]" 1
1003 1 44 THR HB 1 45 TYR QE . . 4.850 4.579 4.468 4.807 . 0 0 "[ . 1 . 2]" 1
1004 1 44 THR HB 1 48 MET ME . . 4.510 3.562 3.236 4.039 . 0 0 "[ . 1 . 2]" 1
1005 1 44 THR HB 1 80 TYR QE . . 5.500 4.770 4.423 5.122 . 0 0 "[ . 1 . 2]" 1
1006 1 44 THR HB 1 84 ILE MD . . 4.220 3.589 3.250 3.961 . 0 0 "[ . 1 . 2]" 1
1007 1 44 THR MG 1 45 TYR H . . 3.940 3.219 3.102 3.402 . 0 0 "[ . 1 . 2]" 1
1008 1 44 THR MG 1 45 TYR HA . . 4.350 3.446 3.387 3.532 . 0 0 "[ . 1 . 2]" 1
1009 1 44 THR MG 1 45 TYR HB2 . . 5.300 4.760 4.662 4.844 . 0 0 "[ . 1 . 2]" 1
1010 1 44 THR MG 1 45 TYR HB3 . . 5.500 5.405 5.341 5.490 . 0 0 "[ . 1 . 2]" 1
1011 1 44 THR MG 1 45 TYR QD . . 3.200 3.177 3.053 3.222 0.022 9 0 "[ . 1 . 2]" 1
1012 1 44 THR MG 1 45 TYR QE . . 4.090 4.088 4.016 4.105 0.015 18 0 "[ . 1 . 2]" 1
1013 1 44 THR MG 1 46 ALA H . . 5.500 4.965 4.625 5.206 . 0 0 "[ . 1 . 2]" 1
1014 1 44 THR MG 1 47 GLU HB2 . . 4.980 4.144 3.790 4.830 . 0 0 "[ . 1 . 2]" 1
1015 1 44 THR MG 1 48 MET H . . 4.940 4.122 3.779 4.361 . 0 0 "[ . 1 . 2]" 1
1016 1 44 THR MG 1 48 MET HB2 . . 4.560 3.959 3.787 4.248 . 0 0 "[ . 1 . 2]" 1
1017 1 44 THR MG 1 48 MET QG . . 4.140 2.450 2.200 2.695 . 0 0 "[ . 1 . 2]" 1
1018 1 44 THR MG 1 80 TYR QE . . 3.730 3.410 2.936 3.741 0.011 18 0 "[ . 1 . 2]" 1
1019 1 44 THR MG 1 84 ILE MD . . 3.210 2.151 1.842 2.507 . 0 0 "[ . 1 . 2]" 1
1020 1 44 THR MG 1 84 ILE HG13 . . 4.640 3.271 2.779 3.709 . 0 0 "[ . 1 . 2]" 1
1021 1 44 THR MG 1 84 ILE MG . . 3.710 3.191 2.821 3.448 . 0 0 "[ . 1 . 2]" 1
1022 1 45 TYR H 1 45 TYR HB2 . . 3.500 2.192 2.145 2.240 . 0 0 "[ . 1 . 2]" 1
1023 1 45 TYR H 1 45 TYR HB3 . . 4.000 3.496 3.456 3.527 . 0 0 "[ . 1 . 2]" 1
1024 1 45 TYR H 1 45 TYR QD . . 3.550 2.342 2.187 2.561 . 0 0 "[ . 1 . 2]" 1
1025 1 45 TYR H 1 46 ALA H . . 3.670 2.787 2.654 2.871 . 0 0 "[ . 1 . 2]" 1
1026 1 45 TYR H 1 47 GLU HB2 . . 5.500 5.465 5.347 5.504 0.004 12 0 "[ . 1 . 2]" 1
1027 1 45 TYR H 1 48 MET ME . . 4.840 3.401 3.137 3.704 . 0 0 "[ . 1 . 2]" 1
1028 1 45 TYR HA 1 45 TYR QD . . 3.510 2.932 2.837 2.991 . 0 0 "[ . 1 . 2]" 1
1029 1 45 TYR HA 1 45 TYR QE . . 4.580 4.470 4.424 4.504 . 0 0 "[ . 1 . 2]" 1
1030 1 45 TYR HA 1 48 MET H . . 4.010 3.266 3.166 3.486 . 0 0 "[ . 1 . 2]" 1
1031 1 45 TYR HA 1 48 MET HB2 . . 3.940 2.184 2.072 2.548 . 0 0 "[ . 1 . 2]" 1
1032 1 45 TYR HA 1 48 MET HB3 . . 4.390 3.711 3.551 4.160 . 0 0 "[ . 1 . 2]" 1
1033 1 45 TYR HA 1 48 MET ME . . 3.080 1.949 1.890 2.141 . 0 0 "[ . 1 . 2]" 1
1034 1 45 TYR HA 1 48 MET HG2 . . 5.020 4.641 4.395 4.843 . 0 0 "[ . 1 . 2]" 1
1035 1 45 TYR HA 1 48 MET QG . . 4.330 3.227 2.876 3.516 . 0 0 "[ . 1 . 2]" 1
1036 1 45 TYR HA 1 48 MET HG3 . . 5.020 3.294 2.916 3.616 . 0 0 "[ . 1 . 2]" 1
1037 1 45 TYR HA 1 50 MET HB2 . . 4.920 3.320 3.069 3.575 . 0 0 "[ . 1 . 2]" 1
1038 1 45 TYR HA 1 50 MET HB3 . . 5.180 4.950 4.754 5.190 0.010 18 0 "[ . 1 . 2]" 1
1039 1 45 TYR HB2 1 46 ALA H . . 3.920 2.789 2.691 3.142 . 0 0 "[ . 1 . 2]" 1
1040 1 45 TYR HB2 1 46 ALA MB . . 5.400 4.341 4.260 4.454 . 0 0 "[ . 1 . 2]" 1
1041 1 45 TYR HB2 1 50 MET HB2 . . 5.500 4.299 4.155 4.552 . 0 0 "[ . 1 . 2]" 1
1042 1 45 TYR HB2 1 54 THR MG . . 5.500 4.402 4.274 4.833 . 0 0 "[ . 1 . 2]" 1
1043 1 45 TYR HB3 1 46 ALA H . . 5.500 3.180 3.041 3.519 . 0 0 "[ . 1 . 2]" 1
1044 1 45 TYR HB3 1 48 MET ME . . 5.390 3.875 3.747 4.050 . 0 0 "[ . 1 . 2]" 1
1045 1 45 TYR HB3 1 54 THR MG . . 5.500 4.863 4.630 5.505 0.005 19 0 "[ . 1 . 2]" 1
1046 1 45 TYR QD 1 48 MET ME . . 3.250 2.740 2.566 2.963 . 0 0 "[ . 1 . 2]" 1
1047 1 45 TYR QD 1 50 MET HA . . 5.230 4.597 4.542 4.694 . 0 0 "[ . 1 . 2]" 1
1048 1 45 TYR QD 1 50 MET HB2 . . 3.460 2.023 1.989 2.249 . 0 0 "[ . 1 . 2]" 1
1049 1 45 TYR QD 1 50 MET HB3 . . 3.370 2.501 2.349 2.687 . 0 0 "[ . 1 . 2]" 1
1050 1 45 TYR QD 1 50 MET ME . . 4.120 3.555 2.887 4.047 . 0 0 "[ . 1 . 2]" 1
1051 1 45 TYR QD 1 50 MET HG2 . . 5.500 4.171 3.899 4.566 . 0 0 "[ . 1 . 2]" 1
1052 1 45 TYR QD 1 50 MET QG . . 4.660 3.170 2.916 3.578 . 0 0 "[ . 1 . 2]" 1
1053 1 45 TYR QD 1 50 MET HG3 . . 5.500 3.288 2.990 3.746 . 0 0 "[ . 1 . 2]" 1
1054 1 45 TYR QD 1 53 PHE HB2 . . 3.690 3.315 2.794 3.460 . 0 0 "[ . 1 . 2]" 1
1055 1 45 TYR QD 1 53 PHE HB3 . . 4.170 4.101 3.544 4.180 0.010 14 0 "[ . 1 . 2]" 1
1056 1 45 TYR QD 1 54 THR HA . . 4.800 4.061 3.840 4.484 . 0 0 "[ . 1 . 2]" 1
1057 1 45 TYR QD 1 55 PRO HD2 . . 5.500 4.605 4.439 4.706 . 0 0 "[ . 1 . 2]" 1
1058 1 45 TYR QD 1 55 PRO QD . . 4.780 3.391 3.271 3.470 . 0 0 "[ . 1 . 2]" 1
1059 1 45 TYR QD 1 55 PRO HD3 . . 5.500 3.491 3.367 3.578 . 0 0 "[ . 1 . 2]" 1
1060 1 45 TYR QD 1 55 PRO HG2 . . 5.350 5.204 4.905 5.368 0.018 4 0 "[ . 1 . 2]" 1
1061 1 45 TYR QD 1 84 ILE MD . . 4.230 3.933 3.685 4.118 . 0 0 "[ . 1 . 2]" 1
1062 1 45 TYR QE 1 48 MET ME . . 3.320 3.053 2.775 3.230 . 0 0 "[ . 1 . 2]" 1
1063 1 45 TYR QE 1 50 MET HB2 . . 5.130 3.792 3.603 3.876 . 0 0 "[ . 1 . 2]" 1
1064 1 45 TYR QE 1 50 MET HB3 . . 3.790 3.383 3.316 3.543 . 0 0 "[ . 1 . 2]" 1
1065 1 45 TYR QE 1 50 MET ME . . 3.490 2.931 2.095 3.498 0.008 13 0 "[ . 1 . 2]" 1
1066 1 45 TYR QE 1 53 PHE HA . . 4.970 4.977 4.897 5.007 0.037 14 0 "[ . 1 . 2]" 1
1067 1 45 TYR QE 1 53 PHE HB2 . . 3.590 3.350 3.048 3.481 . 0 0 "[ . 1 . 2]" 1
1068 1 45 TYR QE 1 53 PHE HB3 . . 3.620 3.017 2.520 3.112 . 0 0 "[ . 1 . 2]" 1
1069 1 45 TYR QE 1 53 PHE QD . . 4.790 4.753 4.198 4.824 0.034 2 0 "[ . 1 . 2]" 1
1070 1 45 TYR QE 1 54 THR HA . . 4.920 4.198 4.070 4.716 . 0 0 "[ . 1 . 2]" 1
1071 1 45 TYR QE 1 55 PRO HA . . 5.470 4.536 4.364 4.784 . 0 0 "[ . 1 . 2]" 1
1072 1 45 TYR QE 1 55 PRO QD . . 4.050 3.207 3.062 3.273 . 0 0 "[ . 1 . 2]" 1
1073 1 45 TYR QE 1 55 PRO HG2 . . 4.760 4.712 4.462 4.781 0.021 9 0 "[ . 1 . 2]" 1
1074 1 45 TYR QE 1 55 PRO HG3 . . 3.920 3.089 2.832 3.182 . 0 0 "[ . 1 . 2]" 1
1075 1 45 TYR QE 1 83 LEU QD . . 4.910 4.228 3.759 4.561 . 0 0 "[ . 1 . 2]" 1
1076 1 45 TYR QE 1 84 ILE HA . . 4.570 4.336 4.039 4.572 0.002 4 0 "[ . 1 . 2]" 1
1077 1 45 TYR QE 1 84 ILE MD . . 3.310 3.213 3.038 3.318 0.008 5 0 "[ . 1 . 2]" 1
1078 1 45 TYR QE 1 84 ILE MG . . 4.760 4.006 3.645 4.249 . 0 0 "[ . 1 . 2]" 1
1079 1 45 TYR QE 1 87 SER HA . . 5.480 5.284 5.019 5.491 0.011 17 0 "[ . 1 . 2]" 1
1080 1 45 TYR QE 1 87 SER HB2 . . 4.440 3.443 3.194 3.672 . 0 0 "[ . 1 . 2]" 1
1081 1 45 TYR QE 1 87 SER HB3 . . 4.440 4.125 3.437 4.447 0.007 8 0 "[ . 1 . 2]" 1
1082 1 45 TYR QE 1 88 LEU QD . . 4.170 4.003 3.714 4.174 0.004 4 0 "[ . 1 . 2]" 1
1083 1 45 TYR QE 1 91 ALA MB . . 4.380 3.579 2.466 4.260 . 0 0 "[ . 1 . 2]" 1
1084 1 46 ALA H 1 46 ALA MB . . 2.870 2.220 2.071 2.236 . 0 0 "[ . 1 . 2]" 1
1085 1 46 ALA H 1 47 GLU H . . 3.600 2.860 2.558 2.936 . 0 0 "[ . 1 . 2]" 1
1086 1 46 ALA HA 1 49 GLY H . . 4.330 3.608 3.455 3.740 . 0 0 "[ . 1 . 2]" 1
1087 1 46 ALA MB 1 47 GLU H . . 3.150 2.440 2.321 2.654 . 0 0 "[ . 1 . 2]" 1
1088 1 46 ALA MB 1 47 GLU HA . . 4.540 3.817 3.700 3.878 . 0 0 "[ . 1 . 2]" 1
1089 1 46 ALA MB 1 47 GLU HB2 . . 4.600 4.165 3.775 4.370 . 0 0 "[ . 1 . 2]" 1
1090 1 46 ALA MB 1 47 GLU QG . . 5.000 3.579 3.196 4.755 . 0 0 "[ . 1 . 2]" 1
1091 1 46 ALA MB 1 48 MET H . . 4.600 4.283 4.169 4.592 . 0 0 "[ . 1 . 2]" 1
1092 1 46 ALA MB 1 49 GLY H . . 5.190 4.578 4.487 4.686 . 0 0 "[ . 1 . 2]" 1
1093 1 46 ALA MB 1 49 GLY HA2 . . 5.500 5.491 5.341 5.520 0.020 16 0 "[ . 1 . 2]" 1
1094 1 47 GLU H 1 47 GLU HB2 . . 2.980 2.246 2.080 2.329 . 0 0 "[ . 1 . 2]" 1
1095 1 47 GLU H 1 47 GLU QG . . 4.080 2.909 2.530 3.912 . 0 0 "[ . 1 . 2]" 1
1096 1 47 GLU H 1 48 MET H . . 3.840 2.519 2.402 2.573 . 0 0 "[ . 1 . 2]" 1
1097 1 47 GLU H 1 48 MET HB2 . . 5.210 4.506 4.431 4.682 . 0 0 "[ . 1 . 2]" 1
1098 1 47 GLU HA 1 47 GLU HB2 . . 3.010 2.972 2.686 3.012 0.002 16 0 "[ . 1 . 2]" 1
1099 1 47 GLU HA 1 47 GLU HG2 . . 4.060 2.732 2.208 3.643 . 0 0 "[ . 1 . 2]" 1
1100 1 47 GLU HA 1 47 GLU QG . . 3.490 2.470 2.162 2.800 . 0 0 "[ . 1 . 2]" 1
1101 1 47 GLU HA 1 47 GLU HG3 . . 4.060 3.250 2.277 3.715 . 0 0 "[ . 1 . 2]" 1
1102 1 47 GLU HB2 1 48 MET H . . 3.710 3.084 2.789 3.527 . 0 0 "[ . 1 . 2]" 1
1103 1 47 GLU QG 1 48 MET H . . 5.340 4.438 4.241 4.703 . 0 0 "[ . 1 . 2]" 1
1104 1 48 MET H 1 48 MET HB2 . . 3.560 2.250 2.175 2.421 . 0 0 "[ . 1 . 2]" 1
1105 1 48 MET H 1 48 MET HG2 . . 4.270 3.689 3.368 3.944 . 0 0 "[ . 1 . 2]" 1
1106 1 48 MET H 1 48 MET QG . . 3.480 2.763 2.335 2.939 . 0 0 "[ . 1 . 2]" 1
1107 1 48 MET H 1 48 MET HG3 . . 4.270 2.855 2.381 3.033 . 0 0 "[ . 1 . 2]" 1
1108 1 48 MET HA 1 48 MET ME . . 4.560 4.442 4.359 4.562 0.002 17 0 "[ . 1 . 2]" 1
1109 1 48 MET HA 1 48 MET HG2 . . 3.670 2.268 2.193 2.404 . 0 0 "[ . 1 . 2]" 1
1110 1 48 MET HA 1 48 MET HG3 . . 3.670 3.078 2.901 3.211 . 0 0 "[ . 1 . 2]" 1
1111 1 48 MET HB2 1 48 MET ME . . 3.580 2.314 2.099 2.491 . 0 0 "[ . 1 . 2]" 1
1112 1 48 MET HB2 1 50 MET H . . 4.680 2.961 2.750 3.114 . 0 0 "[ . 1 . 2]" 1
1113 1 48 MET HB3 1 48 MET ME . . 3.780 2.784 2.556 3.056 . 0 0 "[ . 1 . 2]" 1
1114 1 48 MET HB3 1 49 GLY H . . 4.350 3.746 3.626 3.935 . 0 0 "[ . 1 . 2]" 1
1115 1 48 MET HB3 1 50 MET QG . . 4.290 2.507 2.240 2.930 . 0 0 "[ . 1 . 2]" 1
1116 1 48 MET ME 1 48 MET QG . . 3.330 2.369 2.231 2.475 . 0 0 "[ . 1 . 2]" 1
1117 1 48 MET ME 1 50 MET HB2 . . 4.120 3.436 3.142 3.746 . 0 0 "[ . 1 . 2]" 1
1118 1 48 MET ME 1 50 MET HB3 . . 5.110 4.401 4.240 4.734 . 0 0 "[ . 1 . 2]" 1
1119 1 48 MET ME 1 50 MET ME . . 4.510 4.241 3.699 4.521 0.011 14 0 "[ . 1 . 2]" 1
1120 1 48 MET ME 1 50 MET HG2 . . 4.780 3.149 2.705 4.086 . 0 0 "[ . 1 . 2]" 1
1121 1 48 MET ME 1 50 MET QG . . 4.200 2.458 2.064 2.746 . 0 0 "[ . 1 . 2]" 1
1122 1 48 MET ME 1 50 MET HG3 . . 4.780 2.590 2.097 2.883 . 0 0 "[ . 1 . 2]" 1
1123 1 48 MET ME 1 84 ILE MD . . 3.840 2.807 2.203 3.261 . 0 0 "[ . 1 . 2]" 1
1124 1 48 MET ME 1 84 ILE HG13 . . 4.830 4.272 3.912 4.595 . 0 0 "[ . 1 . 2]" 1
1125 1 48 MET ME 1 84 ILE MG . . 3.460 2.283 2.059 2.494 . 0 0 "[ . 1 . 2]" 1
1126 1 48 MET ME 1 88 LEU QD . . 3.180 2.663 2.208 3.155 . 0 0 "[ . 1 . 2]" 1
1127 1 48 MET QG 1 49 GLY H . . 4.580 4.400 4.255 4.491 . 0 0 "[ . 1 . 2]" 1
1128 1 48 MET HG2 1 49 GLY H . . 5.260 5.085 5.022 5.148 . 0 0 "[ . 1 . 2]" 1
1129 1 48 MET HG3 1 49 GLY H . . 5.260 4.822 4.572 4.966 . 0 0 "[ . 1 . 2]" 1
1130 1 49 GLY H 1 50 MET H . . 3.300 2.479 2.439 2.519 . 0 0 "[ . 1 . 2]" 1
1131 1 49 GLY H 1 50 MET HB2 . . 5.500 4.550 4.458 4.646 . 0 0 "[ . 1 . 2]" 1
1132 1 49 GLY HA2 1 50 MET HA . . 5.500 4.810 4.751 4.842 . 0 0 "[ . 1 . 2]" 1
1133 1 50 MET H 1 50 MET HB2 . . 3.830 2.579 2.477 2.661 . 0 0 "[ . 1 . 2]" 1
1134 1 50 MET H 1 50 MET HB3 . . 3.950 3.590 3.582 3.600 . 0 0 "[ . 1 . 2]" 1
1135 1 50 MET H 1 50 MET QG . . 4.080 2.040 1.936 2.200 . 0 0 "[ . 1 . 2]" 1
1136 1 50 MET H 1 51 SER H . . 4.740 4.527 4.518 4.531 . 0 0 "[ . 1 . 2]" 1
1137 1 50 MET HA 1 50 MET ME . . 4.010 3.018 2.296 3.712 . 0 0 "[ . 1 . 2]" 1
1138 1 50 MET HA 1 50 MET HG2 . . 3.840 3.029 2.496 3.268 . 0 0 "[ . 1 . 2]" 1
1139 1 50 MET HA 1 50 MET QG . . 3.140 2.908 2.439 3.086 . 0 0 "[ . 1 . 2]" 1
1140 1 50 MET HA 1 50 MET HG3 . . 3.840 3.779 3.429 3.832 . 0 0 "[ . 1 . 2]" 1
1141 1 50 MET HA 1 53 PHE QD . . 3.940 3.681 3.366 3.883 . 0 0 "[ . 1 . 2]" 1
1142 1 50 MET HA 1 53 PHE QE . . 5.240 5.205 4.691 5.260 0.020 10 0 "[ . 1 . 2]" 1
1143 1 50 MET HB2 1 53 PHE QD . . 4.870 4.805 4.416 4.877 0.007 11 0 "[ . 1 . 2]" 1
1144 1 50 MET HB2 1 93 ILE MD . . 5.500 5.396 4.905 5.520 0.020 16 0 "[ . 1 . 2]" 1
1145 1 50 MET HB3 1 50 MET ME . . 3.590 2.028 1.953 2.248 . 0 0 "[ . 1 . 2]" 1
1146 1 50 MET HB3 1 53 PHE QD . . 4.080 3.180 2.787 3.281 . 0 0 "[ . 1 . 2]" 1
1147 1 50 MET ME 1 50 MET HG2 . . 3.790 3.332 2.318 3.400 . 0 0 "[ . 1 . 2]" 1
1148 1 50 MET ME 1 50 MET HG3 . . 3.790 2.523 2.306 3.376 . 0 0 "[ . 1 . 2]" 1
1149 1 50 MET ME 1 53 PHE HB2 . . 3.840 2.810 2.577 3.194 . 0 0 "[ . 1 . 2]" 1
1150 1 50 MET ME 1 53 PHE HB3 . . 4.330 3.206 2.660 3.733 . 0 0 "[ . 1 . 2]" 1
1151 1 50 MET ME 1 53 PHE QD . . 3.580 2.377 1.962 2.951 . 0 0 "[ . 1 . 2]" 1
1152 1 50 MET ME 1 53 PHE QE . . 4.770 3.720 3.254 4.194 . 0 0 "[ . 1 . 2]" 1
1153 1 50 MET ME 1 53 PHE HZ . . 5.490 5.270 4.811 5.522 0.032 17 0 "[ . 1 . 2]" 1
1154 1 50 MET ME 1 88 LEU HA . . 4.010 3.395 2.737 3.914 . 0 0 "[ . 1 . 2]" 1
1155 1 50 MET ME 1 88 LEU QD . . 3.090 2.866 1.999 3.101 0.011 17 0 "[ . 1 . 2]" 1
1156 1 50 MET ME 1 91 ALA HA . . 4.630 4.002 3.849 4.247 . 0 0 "[ . 1 . 2]" 1
1157 1 50 MET ME 1 91 ALA MB . . 3.070 1.847 1.738 2.056 . 0 0 "[ . 1 . 2]" 1
1158 1 50 MET ME 1 93 ILE MD . . 3.140 1.920 1.830 2.236 . 0 0 "[ . 1 . 2]" 1
1159 1 50 MET ME 1 93 ILE QG . . 3.890 3.279 2.588 3.893 0.003 11 0 "[ . 1 . 2]" 1
1160 1 50 MET ME 1 93 ILE MG . . 5.110 4.784 4.425 5.097 . 0 0 "[ . 1 . 2]" 1
1161 1 50 MET QG 1 53 PHE QD . . 5.330 4.799 4.238 5.008 . 0 0 "[ . 1 . 2]" 1
1162 1 51 SER H 1 51 SER HB2 . . 4.130 2.923 2.521 3.602 . 0 0 "[ . 1 . 2]" 1
1163 1 51 SER H 1 51 SER QB . . 3.530 2.673 2.423 3.145 . 0 0 "[ . 1 . 2]" 1
1164 1 51 SER H 1 51 SER HB3 . . 4.130 3.521 2.472 3.822 . 0 0 "[ . 1 . 2]" 1
1165 1 51 SER HB2 1 53 PHE H . . 5.500 5.330 4.837 5.503 0.003 8 0 "[ . 1 . 2]" 1
1166 1 51 SER HB3 1 53 PHE H . . 5.500 5.181 4.890 5.502 0.002 19 0 "[ . 1 . 2]" 1
1167 1 52 ASN HA 1 52 ASN QB . . 2.550 2.411 2.274 2.485 . 0 0 "[ . 1 . 2]" 1
1168 1 52 ASN HA 1 54 THR H . . 5.110 5.033 5.002 5.058 . 0 0 "[ . 1 . 2]" 1
1169 1 52 ASN QB 1 53 PHE H . . 4.310 3.776 3.696 3.860 . 0 0 "[ . 1 . 2]" 1
1170 1 52 ASN QB 1 53 PHE QD . . 5.060 3.990 3.872 4.121 . 0 0 "[ . 1 . 2]" 1
1171 1 52 ASN QB 1 53 PHE QE . . 4.700 3.997 3.829 4.294 . 0 0 "[ . 1 . 2]" 1
1172 1 52 ASN QB 1 53 PHE HZ . . 5.340 4.569 4.265 5.005 . 0 0 "[ . 1 . 2]" 1
1173 1 52 ASN HB2 1 53 PHE H . . 5.130 4.231 4.004 4.527 . 0 0 "[ . 1 . 2]" 1
1174 1 52 ASN HB3 1 53 PHE H . . 5.130 4.303 3.979 4.548 . 0 0 "[ . 1 . 2]" 1
1175 1 53 PHE H 1 53 PHE HB2 . . 3.520 2.777 2.707 2.863 . 0 0 "[ . 1 . 2]" 1
1176 1 53 PHE H 1 53 PHE HB3 . . 4.040 3.851 3.814 3.895 . 0 0 "[ . 1 . 2]" 1
1177 1 53 PHE H 1 53 PHE QD . . 4.110 3.842 3.723 3.991 . 0 0 "[ . 1 . 2]" 1
1178 1 53 PHE H 1 54 THR H . . 3.880 3.726 3.626 3.793 . 0 0 "[ . 1 . 2]" 1
1179 1 53 PHE HA 1 53 PHE QD . . 3.340 2.159 1.996 2.327 . 0 0 "[ . 1 . 2]" 1
1180 1 53 PHE HA 1 53 PHE QE . . 4.410 4.325 4.241 4.398 . 0 0 "[ . 1 . 2]" 1
1181 1 53 PHE HA 1 91 ALA MB . . 5.080 4.802 4.420 5.100 0.020 8 0 "[ . 1 . 2]" 1
1182 1 53 PHE HB2 1 54 THR H . . 5.090 4.501 4.462 4.542 . 0 0 "[ . 1 . 2]" 1
1183 1 53 PHE HB2 1 91 ALA MB . . 4.720 3.491 3.067 3.734 . 0 0 "[ . 1 . 2]" 1
1184 1 53 PHE HB3 1 91 ALA H . . 5.370 5.346 5.201 5.388 0.018 7 0 "[ . 1 . 2]" 1
1185 1 53 PHE HB3 1 91 ALA MB . . 4.260 2.792 2.326 3.201 . 0 0 "[ . 1 . 2]" 1
1186 1 53 PHE QD 1 91 ALA HA . . 4.420 3.840 3.478 4.318 . 0 0 "[ . 1 . 2]" 1
1187 1 53 PHE QD 1 91 ALA MB . . 3.830 3.123 2.765 3.339 . 0 0 "[ . 1 . 2]" 1
1188 1 53 PHE QE 1 91 ALA HA . . 4.500 4.133 3.912 4.326 . 0 0 "[ . 1 . 2]" 1
1189 1 53 PHE QE 1 91 ALA MB . . 4.040 3.756 3.348 3.941 . 0 0 "[ . 1 . 2]" 1
1190 1 53 PHE QE 1 93 ILE MD . . 5.500 5.341 4.901 5.512 0.012 18 0 "[ . 1 . 2]" 1
1191 1 53 PHE HZ 1 91 ALA HA . . 5.110 5.005 4.736 5.125 0.015 4 0 "[ . 1 . 2]" 1
1192 1 53 PHE HZ 1 91 ALA MB . . 4.800 4.647 4.318 4.820 0.020 9 0 "[ . 1 . 2]" 1
1193 1 54 THR H 1 54 THR HB . . 3.320 3.239 2.967 3.310 . 0 0 "[ . 1 . 2]" 1
1194 1 54 THR H 1 54 THR MG . . 4.220 3.630 3.567 3.803 . 0 0 "[ . 1 . 2]" 1
1195 1 54 THR H 1 55 PRO QD . . 4.570 4.351 4.301 4.369 . 0 0 "[ . 1 . 2]" 1
1196 1 54 THR HA 1 54 THR MG . . 3.280 2.021 1.986 2.093 . 0 0 "[ . 1 . 2]" 1
1197 1 54 THR HA 1 55 PRO HD2 . . 3.590 2.230 2.112 2.293 . 0 0 "[ . 1 . 2]" 1
1198 1 54 THR HA 1 55 PRO HD3 . . 3.590 2.259 2.254 2.268 . 0 0 "[ . 1 . 2]" 1
1199 1 54 THR HA 1 55 PRO HG2 . . 5.170 4.377 4.282 4.427 . 0 0 "[ . 1 . 2]" 1
1200 1 54 THR HA 1 55 PRO HG3 . . 4.710 4.383 4.337 4.413 . 0 0 "[ . 1 . 2]" 1
1201 1 54 THR HB 1 55 PRO QD . . 4.390 3.017 2.801 3.548 . 0 0 "[ . 1 . 2]" 1
1202 1 54 THR MG 1 55 PRO HD2 . . 3.940 1.963 1.920 2.009 . 0 0 "[ . 1 . 2]" 1
1203 1 54 THR MG 1 55 PRO QD . . 3.340 1.945 1.905 1.987 . 0 0 "[ . 1 . 2]" 1
1204 1 54 THR MG 1 55 PRO HD3 . . 3.940 3.163 3.125 3.231 . 0 0 "[ . 1 . 2]" 1
1205 1 54 THR MG 1 55 PRO HG2 . . 4.290 3.573 3.362 3.643 . 0 0 "[ . 1 . 2]" 1
1206 1 55 PRO HA 1 56 THR H . . 3.170 2.160 2.150 2.196 . 0 0 "[ . 1 . 2]" 1
1207 1 55 PRO HA 1 56 THR MG . . 4.720 4.610 4.029 4.751 0.031 13 0 "[ . 1 . 2]" 1
1208 1 55 PRO HA 1 60 VAL MG2 . . 4.680 4.236 3.927 4.657 . 0 0 "[ . 1 . 2]" 1
1209 1 55 PRO QB 1 56 THR H . . 3.940 3.488 3.367 3.648 . 0 0 "[ . 1 . 2]" 1
1210 1 55 PRO QB 1 59 ASP QB . . 4.710 4.324 3.823 4.538 . 0 0 "[ . 1 . 2]" 1
1211 1 55 PRO QB 1 60 VAL MG2 . . 3.580 2.410 1.890 2.834 . 0 0 "[ . 1 . 2]" 1
1212 1 55 PRO QB 1 63 TRP HH2 . . 3.920 2.773 2.589 2.893 . 0 0 "[ . 1 . 2]" 1
1213 1 55 PRO QB 1 63 TRP HZ3 . . 3.790 2.163 1.902 2.346 . 0 0 "[ . 1 . 2]" 1
1214 1 55 PRO QB 1 87 SER QB . . 4.820 2.920 2.530 3.134 . 0 0 "[ . 1 . 2]" 1
1215 1 55 PRO HB2 1 56 THR H . . 4.510 3.750 3.602 3.946 . 0 0 "[ . 1 . 2]" 1
1216 1 55 PRO HB2 1 63 TRP HH2 . . 4.590 3.459 3.261 3.616 . 0 0 "[ . 1 . 2]" 1
1217 1 55 PRO HB2 1 63 TRP HZ3 . . 4.500 2.415 2.111 2.611 . 0 0 "[ . 1 . 2]" 1
1218 1 55 PRO HB3 1 56 THR H . . 4.510 4.152 4.047 4.295 . 0 0 "[ . 1 . 2]" 1
1219 1 55 PRO HB3 1 63 TRP HH2 . . 4.590 2.923 2.716 3.134 . 0 0 "[ . 1 . 2]" 1
1220 1 55 PRO HB3 1 63 TRP HZ3 . . 4.500 2.461 2.023 2.827 . 0 0 "[ . 1 . 2]" 1
1221 1 55 PRO QD 1 60 VAL MG2 . . 5.350 4.839 4.299 5.267 . 0 0 "[ . 1 . 2]" 1
1222 1 55 PRO HG2 1 63 TRP HH2 . . 5.500 5.506 5.385 5.526 0.026 8 0 "[ . 1 . 2]" 1
1223 1 55 PRO HG2 1 63 TRP HZ3 . . 4.720 4.544 4.131 4.717 . 0 0 "[ . 1 . 2]" 1
1224 1 55 PRO HG3 1 63 TRP HH2 . . 5.500 5.220 4.961 5.399 . 0 0 "[ . 1 . 2]" 1
1225 1 55 PRO HG3 1 63 TRP HZ3 . . 4.730 4.135 3.665 4.508 . 0 0 "[ . 1 . 2]" 1
1226 1 55 PRO HG3 1 84 ILE MD . . 5.500 5.113 4.718 5.329 . 0 0 "[ . 1 . 2]" 1
1227 1 56 THR H 1 56 THR MG . . 3.360 2.946 2.308 3.141 . 0 0 "[ . 1 . 2]" 1
1228 1 56 THR H 1 59 ASP H . . 4.950 4.725 4.500 4.909 . 0 0 "[ . 1 . 2]" 1
1229 1 56 THR H 1 59 ASP QB . . 3.830 3.277 2.861 3.586 . 0 0 "[ . 1 . 2]" 1
1230 1 56 THR HA 1 56 THR HB . . 2.840 2.723 2.536 2.780 . 0 0 "[ . 1 . 2]" 1
1231 1 56 THR HA 1 56 THR MG . . 2.750 2.089 1.955 2.318 . 0 0 "[ . 1 . 2]" 1
1232 1 56 THR HA 1 57 LYS H . . 3.300 2.222 2.220 2.224 . 0 0 "[ . 1 . 2]" 1
1233 1 56 THR HA 1 58 GLU H . . 4.530 4.293 3.873 4.535 0.005 20 0 "[ . 1 . 2]" 1
1234 1 56 THR HB 1 57 LYS H . . 3.380 3.069 2.906 3.146 . 0 0 "[ . 1 . 2]" 1
1235 1 56 THR HB 1 58 GLU H . . 3.890 2.992 2.499 3.446 . 0 0 "[ . 1 . 2]" 1
1236 1 56 THR HB 1 58 GLU QB . . 4.530 3.452 2.999 4.165 . 0 0 "[ . 1 . 2]" 1
1237 1 56 THR MG 1 57 LYS H . . 4.170 3.171 2.955 3.669 . 0 0 "[ . 1 . 2]" 1
1238 1 56 THR MG 1 57 LYS QB . . 5.260 4.634 4.351 5.254 . 0 0 "[ . 1 . 2]" 1
1239 1 57 LYS H 1 57 LYS HB2 . . 3.640 2.518 2.232 3.589 . 0 0 "[ . 1 . 2]" 1
1240 1 57 LYS H 1 57 LYS HB3 . . 3.640 3.189 2.406 3.596 . 0 0 "[ . 1 . 2]" 1
1241 1 57 LYS H 1 57 LYS QG . . 4.410 2.937 2.024 4.059 . 0 0 "[ . 1 . 2]" 1
1242 1 57 LYS H 1 58 GLU H . . 3.820 2.702 2.475 2.849 . 0 0 "[ . 1 . 2]" 1
1243 1 57 LYS H 1 60 VAL MG2 . . 4.590 4.148 3.944 4.241 . 0 0 "[ . 1 . 2]" 1
1244 1 57 LYS HA 1 57 LYS QB . . 2.460 2.372 2.173 2.470 0.010 8 0 "[ . 1 . 2]" 1
1245 1 57 LYS HA 1 57 LYS QD . . 3.680 2.646 1.977 3.693 0.013 15 0 "[ . 1 . 2]" 1
1246 1 57 LYS HA 1 57 LYS QE . . 4.010 3.568 1.987 4.043 0.033 15 0 "[ . 1 . 2]" 1
1247 1 57 LYS HA 1 57 LYS QG . . 3.400 2.712 2.177 3.419 0.019 15 0 "[ . 1 . 2]" 1
1248 1 57 LYS HA 1 60 VAL HB . . 3.410 2.920 2.651 3.220 . 0 0 "[ . 1 . 2]" 1
1249 1 57 LYS HA 1 60 VAL MG1 . . 4.280 4.188 4.000 4.305 0.025 12 0 "[ . 1 . 2]" 1
1250 1 57 LYS HA 1 60 VAL MG2 . . 3.240 2.326 1.974 2.592 . 0 0 "[ . 1 . 2]" 1
1251 1 57 LYS QB 1 57 LYS QD . . 3.320 2.286 1.933 2.582 . 0 0 "[ . 1 . 2]" 1
1252 1 57 LYS QB 1 60 VAL MG2 . . 4.440 4.145 3.753 4.413 . 0 0 "[ . 1 . 2]" 1
1253 1 57 LYS QE 1 57 LYS QG . . 3.210 2.236 2.010 2.498 . 0 0 "[ . 1 . 2]" 1
1254 1 57 LYS QG 1 58 GLU H . . 4.330 3.803 2.186 4.339 0.009 14 0 "[ . 1 . 2]" 1
1255 1 57 LYS QG 1 60 VAL MG2 . . 5.330 4.172 3.290 4.923 . 0 0 "[ . 1 . 2]" 1
1256 1 58 GLU H 1 58 GLU HB2 . . 3.380 2.444 2.137 3.554 0.174 16 0 "[ . 1 . 2]" 1
1257 1 58 GLU H 1 58 GLU QB . . 2.950 2.205 2.108 2.279 . 0 0 "[ . 1 . 2]" 1
1258 1 58 GLU H 1 58 GLU HB3 . . 3.380 2.721 2.290 3.212 . 0 0 "[ . 1 . 2]" 1
1259 1 58 GLU H 1 58 GLU HG2 . . 4.670 4.336 2.579 4.638 . 0 0 "[ . 1 . 2]" 1
1260 1 58 GLU H 1 58 GLU HG3 . . 4.670 4.299 3.856 4.535 . 0 0 "[ . 1 . 2]" 1
1261 1 58 GLU H 1 59 ASP H . . 3.480 2.637 2.348 2.745 . 0 0 "[ . 1 . 2]" 1
1262 1 58 GLU H 1 60 VAL H . . 5.060 4.251 3.858 4.454 . 0 0 "[ . 1 . 2]" 1
1263 1 58 GLU HA 1 58 GLU HG2 . . 3.970 3.126 2.322 3.802 . 0 0 "[ . 1 . 2]" 1
1264 1 58 GLU HA 1 58 GLU QG . . 3.440 2.531 2.052 3.318 . 0 0 "[ . 1 . 2]" 1
1265 1 58 GLU HA 1 58 GLU HG3 . . 3.970 2.776 2.069 3.725 . 0 0 "[ . 1 . 2]" 1
1266 1 58 GLU QB 1 59 ASP H . . 3.810 2.965 2.798 3.554 . 0 0 "[ . 1 . 2]" 1
1267 1 58 GLU QG 1 59 ASP H . . 4.560 4.022 2.273 4.577 0.017 15 0 "[ . 1 . 2]" 1
1268 1 58 GLU HG2 1 62 ILE MD . . 5.120 3.281 2.151 4.539 . 0 0 "[ . 1 . 2]" 1
1269 1 58 GLU HG3 1 62 ILE MD . . 5.120 3.659 2.294 4.843 . 0 0 "[ . 1 . 2]" 1
1270 1 59 ASP H 1 59 ASP QB . . 3.480 2.276 2.164 2.439 . 0 0 "[ . 1 . 2]" 1
1271 1 59 ASP H 1 60 VAL H . . 3.770 2.415 2.334 2.495 . 0 0 "[ . 1 . 2]" 1
1272 1 59 ASP H 1 60 VAL MG2 . . 4.800 3.904 3.778 4.005 . 0 0 "[ . 1 . 2]" 1
1273 1 59 ASP HA 1 62 ILE H . . 4.610 3.358 3.112 3.553 . 0 0 "[ . 1 . 2]" 1
1274 1 59 ASP HA 1 62 ILE HB . . 3.610 2.771 2.532 2.965 . 0 0 "[ . 1 . 2]" 1
1275 1 59 ASP HA 1 62 ILE MD . . 3.610 2.303 2.018 2.772 . 0 0 "[ . 1 . 2]" 1
1276 1 59 ASP HA 1 62 ILE MG . . 4.240 4.136 3.924 4.244 0.004 14 0 "[ . 1 . 2]" 1
1277 1 59 ASP HA 1 63 TRP H . . 4.810 4.048 3.799 4.360 . 0 0 "[ . 1 . 2]" 1
1278 1 59 ASP QB 1 60 VAL H . . 3.840 2.646 2.422 2.956 . 0 0 "[ . 1 . 2]" 1
1279 1 59 ASP QB 1 60 VAL MG2 . . 4.610 3.301 3.134 3.446 . 0 0 "[ . 1 . 2]" 1
1280 1 60 VAL H 1 60 VAL HB . . 3.620 2.563 2.505 2.603 . 0 0 "[ . 1 . 2]" 1
1281 1 60 VAL H 1 60 VAL MG2 . . 3.040 2.184 2.070 2.293 . 0 0 "[ . 1 . 2]" 1
1282 1 60 VAL H 1 63 TRP HZ3 . . 5.500 4.686 4.318 5.014 . 0 0 "[ . 1 . 2]" 1
1283 1 60 VAL HA 1 60 VAL MG1 . . 3.250 2.352 2.308 2.410 . 0 0 "[ . 1 . 2]" 1
1284 1 60 VAL HA 1 60 VAL MG2 . . 3.090 2.343 2.287 2.385 . 0 0 "[ . 1 . 2]" 1
1285 1 60 VAL HA 1 63 TRP H . . 5.450 3.482 3.206 3.765 . 0 0 "[ . 1 . 2]" 1
1286 1 60 VAL HA 1 63 TRP HA . . 5.500 5.422 5.208 5.536 0.036 12 0 "[ . 1 . 2]" 1
1287 1 60 VAL HA 1 63 TRP HB2 . . 4.230 2.752 2.530 2.957 . 0 0 "[ . 1 . 2]" 1
1288 1 60 VAL HA 1 63 TRP HB3 . . 4.590 4.329 4.152 4.548 . 0 0 "[ . 1 . 2]" 1
1289 1 60 VAL HA 1 63 TRP HE3 . . 3.600 2.274 2.033 2.569 . 0 0 "[ . 1 . 2]" 1
1290 1 60 VAL HA 1 63 TRP HZ3 . . 5.210 3.652 3.489 3.967 . 0 0 "[ . 1 . 2]" 1
1291 1 60 VAL HA 1 83 LEU MD1 . . 4.890 3.167 2.537 3.722 . 0 0 "[ . 1 . 2]" 1
1292 1 60 VAL HA 1 83 LEU QD . . 3.880 2.985 2.519 3.440 . 0 0 "[ . 1 . 2]" 1
1293 1 60 VAL HA 1 83 LEU MD2 . . 4.890 3.963 2.834 4.822 . 0 0 "[ . 1 . 2]" 1
1294 1 60 VAL HB 1 61 LYS H . . 3.850 2.538 2.265 2.882 . 0 0 "[ . 1 . 2]" 1
1295 1 60 VAL MG1 1 61 LYS H . . 3.770 3.360 3.041 3.692 . 0 0 "[ . 1 . 2]" 1
1296 1 60 VAL MG1 1 61 LYS HA . . 4.370 3.426 3.174 3.689 . 0 0 "[ . 1 . 2]" 1
1297 1 60 VAL MG1 1 63 TRP HB2 . . 4.980 3.735 3.496 3.915 . 0 0 "[ . 1 . 2]" 1
1298 1 60 VAL MG1 1 63 TRP HE3 . . 4.390 3.302 3.141 3.497 . 0 0 "[ . 1 . 2]" 1
1299 1 60 VAL MG1 1 63 TRP HZ3 . . 4.500 4.287 4.082 4.509 0.009 7 0 "[ . 1 . 2]" 1
1300 1 60 VAL MG1 1 64 LEU QB . . 4.380 4.012 3.434 4.390 0.010 18 0 "[ . 1 . 2]" 1
1301 1 60 VAL MG1 1 83 LEU QD . . 4.010 2.460 1.972 2.920 . 0 0 "[ . 1 . 2]" 1
1302 1 60 VAL MG2 1 61 LYS H . . 4.270 3.831 3.731 3.933 . 0 0 "[ . 1 . 2]" 1
1303 1 60 VAL MG2 1 63 TRP HB2 . . 4.920 4.571 4.367 4.668 . 0 0 "[ . 1 . 2]" 1
1304 1 60 VAL MG2 1 63 TRP HE3 . . 4.080 3.141 3.020 3.323 . 0 0 "[ . 1 . 2]" 1
1305 1 60 VAL MG2 1 63 TRP HH2 . . 4.340 4.037 3.720 4.328 . 0 0 "[ . 1 . 2]" 1
1306 1 60 VAL MG2 1 63 TRP HZ3 . . 4.220 2.709 2.504 2.982 . 0 0 "[ . 1 . 2]" 1
1307 1 61 LYS H 1 61 LYS QB . . 2.810 2.243 2.141 2.455 . 0 0 "[ . 1 . 2]" 1
1308 1 61 LYS H 1 61 LYS HG2 . . 4.730 4.038 2.155 4.643 . 0 0 "[ . 1 . 2]" 1
1309 1 61 LYS H 1 61 LYS QG . . 4.150 3.572 2.136 4.062 . 0 0 "[ . 1 . 2]" 1
1310 1 61 LYS H 1 61 LYS HG3 . . 4.730 4.136 2.587 4.486 . 0 0 "[ . 1 . 2]" 1
1311 1 61 LYS H 1 63 TRP H . . 5.500 4.184 3.964 4.402 . 0 0 "[ . 1 . 2]" 1
1312 1 61 LYS HA 1 61 LYS QD . . 3.750 2.799 2.021 3.705 . 0 0 "[ . 1 . 2]" 1
1313 1 61 LYS HA 1 61 LYS HG2 . . 3.990 3.165 2.188 3.811 . 0 0 "[ . 1 . 2]" 1
1314 1 61 LYS HA 1 61 LYS QG . . 3.400 2.493 2.166 2.963 . 0 0 "[ . 1 . 2]" 1
1315 1 61 LYS HA 1 61 LYS HG3 . . 3.990 2.976 2.237 3.772 . 0 0 "[ . 1 . 2]" 1
1316 1 61 LYS HA 1 63 TRP H . . 5.320 4.545 4.229 4.737 . 0 0 "[ . 1 . 2]" 1
1317 1 61 LYS HA 1 64 LEU QB . . 3.980 3.168 2.906 3.451 . 0 0 "[ . 1 . 2]" 1
1318 1 61 LYS HA 1 64 LEU QD . . 4.060 3.422 2.423 4.065 0.005 20 0 "[ . 1 . 2]" 1
1319 1 61 LYS QB 1 62 ILE QG . . 4.430 3.048 2.933 3.184 . 0 0 "[ . 1 . 2]" 1
1320 1 61 LYS QD 1 61 LYS QE . . 2.360 2.047 2.006 2.090 . 0 0 "[ . 1 . 2]" 1
1321 1 62 ILE H 1 62 ILE HB . . 3.300 2.513 2.478 2.565 . 0 0 "[ . 1 . 2]" 1
1322 1 62 ILE H 1 62 ILE MD . . 4.540 3.446 3.299 3.602 . 0 0 "[ . 1 . 2]" 1
1323 1 62 ILE H 1 62 ILE HG12 . . 4.270 3.600 3.472 3.765 . 0 0 "[ . 1 . 2]" 1
1324 1 62 ILE H 1 62 ILE QG . . 3.560 2.191 2.012 2.388 . 0 0 "[ . 1 . 2]" 1
1325 1 62 ILE H 1 62 ILE HG13 . . 4.270 2.211 2.025 2.415 . 0 0 "[ . 1 . 2]" 1
1326 1 62 ILE H 1 62 ILE MG . . 4.780 3.770 3.757 3.779 . 0 0 "[ . 1 . 2]" 1
1327 1 62 ILE H 1 63 TRP H . . 3.750 2.536 2.307 2.769 . 0 0 "[ . 1 . 2]" 1
1328 1 62 ILE HA 1 62 ILE MD . . 3.880 3.871 3.843 3.882 0.002 20 0 "[ . 1 . 2]" 1
1329 1 62 ILE HA 1 62 ILE HG12 . . 3.660 2.648 2.567 2.707 . 0 0 "[ . 1 . 2]" 1
1330 1 62 ILE HA 1 62 ILE HG13 . . 3.660 2.871 2.796 2.973 . 0 0 "[ . 1 . 2]" 1
1331 1 62 ILE HA 1 62 ILE MG . . 3.050 2.358 2.292 2.402 . 0 0 "[ . 1 . 2]" 1
1332 1 62 ILE HA 1 65 GLN HB2 . . 4.540 3.327 2.329 4.644 0.104 12 0 "[ . 1 . 2]" 1
1333 1 62 ILE HA 1 65 GLN QB . . 3.910 2.630 2.262 3.758 . 0 0 "[ . 1 . 2]" 1
1334 1 62 ILE HA 1 65 GLN HB3 . . 4.540 3.035 2.302 4.300 . 0 0 "[ . 1 . 2]" 1
1335 1 62 ILE HA 1 65 GLN QG . . 4.690 3.987 1.878 4.691 0.001 15 0 "[ . 1 . 2]" 1
1336 1 62 ILE HB 1 62 ILE MD . . 3.310 2.290 2.203 2.384 . 0 0 "[ . 1 . 2]" 1
1337 1 62 ILE HB 1 63 TRP H . . 4.100 2.610 2.473 2.829 . 0 0 "[ . 1 . 2]" 1
1338 1 62 ILE HB 1 63 TRP HD1 . . 5.220 3.892 3.516 4.393 . 0 0 "[ . 1 . 2]" 1
1339 1 62 ILE HB 1 63 TRP HE1 . . 5.470 4.808 4.303 5.310 . 0 0 "[ . 1 . 2]" 1
1340 1 62 ILE MD 1 62 ILE MG . . 2.770 2.125 1.989 2.322 . 0 0 "[ . 1 . 2]" 1
1341 1 62 ILE HG12 1 62 ILE MG . . 3.450 2.297 2.175 2.359 . 0 0 "[ . 1 . 2]" 1
1342 1 62 ILE HG13 1 62 ILE MG . . 3.450 3.186 3.167 3.200 . 0 0 "[ . 1 . 2]" 1
1343 1 62 ILE MG 1 63 TRP H . . 4.380 3.453 3.391 3.567 . 0 0 "[ . 1 . 2]" 1
1344 1 62 ILE MG 1 63 TRP HA . . 4.150 3.480 3.409 3.596 . 0 0 "[ . 1 . 2]" 1
1345 1 62 ILE MG 1 63 TRP HB2 . . 5.500 5.235 5.153 5.318 . 0 0 "[ . 1 . 2]" 1
1346 1 62 ILE MG 1 63 TRP HB3 . . 5.500 5.487 5.379 5.518 0.018 8 0 "[ . 1 . 2]" 1
1347 1 62 ILE MG 1 63 TRP HD1 . . 3.580 3.401 3.170 3.586 0.006 8 0 "[ . 1 . 2]" 1
1348 1 62 ILE MG 1 63 TRP HE1 . . 4.900 4.674 4.275 4.901 0.001 5 0 "[ . 1 . 2]" 1
1349 1 62 ILE MG 1 65 GLN H . . 5.390 4.517 4.042 4.875 . 0 0 "[ . 1 . 2]" 1
1350 1 62 ILE MG 1 65 GLN QB . . 4.690 3.606 3.127 4.668 . 0 0 "[ . 1 . 2]" 1
1351 1 62 ILE MG 1 66 MET ME . . 3.420 2.491 1.855 3.432 0.012 8 0 "[ . 1 . 2]" 1
1352 1 62 ILE MG 1 66 MET HG2 . . 5.260 4.256 2.258 5.255 . 0 0 "[ . 1 . 2]" 1
1353 1 62 ILE MG 1 66 MET QG . . 4.430 3.289 1.921 4.425 . 0 0 "[ . 1 . 2]" 1
1354 1 62 ILE MG 1 66 MET HG3 . . 5.260 3.576 1.937 5.249 . 0 0 "[ . 1 . 2]" 1
1355 1 63 TRP H 1 63 TRP HB2 . . 3.150 2.449 2.303 2.601 . 0 0 "[ . 1 . 2]" 1
1356 1 63 TRP H 1 63 TRP HD1 . . 4.650 3.358 3.041 3.750 . 0 0 "[ . 1 . 2]" 1
1357 1 63 TRP H 1 63 TRP HE3 . . 5.500 4.432 4.346 4.539 . 0 0 "[ . 1 . 2]" 1
1358 1 63 TRP HA 1 63 TRP HD1 . . 2.630 2.132 2.027 2.288 . 0 0 "[ . 1 . 2]" 1
1359 1 63 TRP HA 1 63 TRP HE1 . . 5.020 4.644 4.532 4.795 . 0 0 "[ . 1 . 2]" 1
1360 1 63 TRP HA 1 63 TRP HE3 . . 5.470 5.220 5.191 5.245 . 0 0 "[ . 1 . 2]" 1
1361 1 63 TRP HA 1 64 LEU QD . . 5.440 5.067 4.380 5.438 . 0 0 "[ . 1 . 2]" 1
1362 1 63 TRP HA 1 66 MET HB2 . . 4.920 3.416 2.525 4.862 . 0 0 "[ . 1 . 2]" 1
1363 1 63 TRP HA 1 66 MET QB . . 4.090 3.048 2.497 4.007 . 0 0 "[ . 1 . 2]" 1
1364 1 63 TRP HA 1 66 MET HB3 . . 4.920 3.916 3.046 4.574 . 0 0 "[ . 1 . 2]" 1
1365 1 63 TRP HA 1 66 MET ME . . 4.670 3.692 2.509 4.380 . 0 0 "[ . 1 . 2]" 1
1366 1 63 TRP HA 1 66 MET QG . . 5.340 4.240 1.965 5.332 . 0 0 "[ . 1 . 2]" 1
1367 1 63 TRP HA 1 83 LEU QD . . 5.440 4.206 3.986 4.633 . 0 0 "[ . 1 . 2]" 1
1368 1 63 TRP HA 1 86 LYS QD . . 4.910 3.027 2.061 3.893 . 0 0 "[ . 1 . 2]" 1
1369 1 63 TRP HA 1 86 LYS QE . . 5.340 4.394 3.052 5.346 0.006 5 0 "[ . 1 . 2]" 1
1370 1 63 TRP HB2 1 63 TRP HE3 . . 3.850 2.608 2.558 2.652 . 0 0 "[ . 1 . 2]" 1
1371 1 63 TRP HB2 1 63 TRP HZ3 . . 5.420 4.984 4.944 5.019 . 0 0 "[ . 1 . 2]" 1
1372 1 63 TRP HB2 1 64 LEU QB . . 5.050 4.365 3.861 4.764 . 0 0 "[ . 1 . 2]" 1
1373 1 63 TRP HB2 1 64 LEU QD . . 5.440 3.754 2.697 4.398 . 0 0 "[ . 1 . 2]" 1
1374 1 63 TRP HB2 1 83 LEU MD1 . . 5.120 2.453 1.959 3.708 . 0 0 "[ . 1 . 2]" 1
1375 1 63 TRP HB2 1 83 LEU QD . . 4.090 2.212 1.952 2.674 . 0 0 "[ . 1 . 2]" 1
1376 1 63 TRP HB2 1 83 LEU MD2 . . 5.120 3.652 2.014 4.369 . 0 0 "[ . 1 . 2]" 1
1377 1 63 TRP HB2 1 83 LEU HG . . 5.500 3.105 2.468 4.905 . 0 0 "[ . 1 . 2]" 1
1378 1 63 TRP HB3 1 63 TRP HE3 . . 4.000 3.336 3.275 3.408 . 0 0 "[ . 1 . 2]" 1
1379 1 63 TRP HB3 1 83 LEU MD1 . . 4.730 2.724 2.144 3.739 . 0 0 "[ . 1 . 2]" 1
1380 1 63 TRP HB3 1 83 LEU MD2 . . 4.730 3.549 1.967 4.186 . 0 0 "[ . 1 . 2]" 1
1381 1 63 TRP HB3 1 83 LEU HG . . 5.500 2.624 2.000 5.129 . 0 0 "[ . 1 . 2]" 1
1382 1 63 TRP HB3 1 86 LYS QB . . 5.340 3.717 2.793 4.551 . 0 0 "[ . 1 . 2]" 1
1383 1 63 TRP HB3 1 86 LYS QD . . 5.340 3.811 2.930 4.879 . 0 0 "[ . 1 . 2]" 1
1384 1 63 TRP HD1 1 66 MET HB2 . . 5.500 4.714 3.948 5.563 0.063 8 0 "[ . 1 . 2]" 1
1385 1 63 TRP HD1 1 66 MET HB3 . . 5.500 5.149 4.173 5.507 0.007 6 0 "[ . 1 . 2]" 1
1386 1 63 TRP HD1 1 66 MET ME . . 3.810 3.517 2.731 3.825 0.015 8 0 "[ . 1 . 2]" 1
1387 1 63 TRP HD1 1 83 LEU QD . . 5.440 4.881 4.585 5.244 . 0 0 "[ . 1 . 2]" 1
1388 1 63 TRP HD1 1 86 LYS QB . . 4.750 3.201 2.622 3.936 . 0 0 "[ . 1 . 2]" 1
1389 1 63 TRP HD1 1 86 LYS HD2 . . 4.240 3.001 2.037 4.236 . 0 0 "[ . 1 . 2]" 1
1390 1 63 TRP HD1 1 86 LYS HD3 . . 4.240 2.703 2.098 3.806 . 0 0 "[ . 1 . 2]" 1
1391 1 63 TRP HD1 1 86 LYS HE2 . . 5.500 4.561 2.512 5.411 . 0 0 "[ . 1 . 2]" 1
1392 1 63 TRP HD1 1 86 LYS HE3 . . 5.500 4.356 2.235 5.369 . 0 0 "[ . 1 . 2]" 1
1393 1 63 TRP HD1 1 86 LYS QG . . 5.340 3.495 2.289 4.468 . 0 0 "[ . 1 . 2]" 1
1394 1 63 TRP HE1 1 66 MET ME . . 5.500 4.843 4.269 5.299 . 0 0 "[ . 1 . 2]" 1
1395 1 63 TRP HE1 1 86 LYS QB . . 5.320 3.144 2.162 4.052 . 0 0 "[ . 1 . 2]" 1
1396 1 63 TRP HE1 1 86 LYS QG . . 5.340 3.256 1.972 5.163 . 0 0 "[ . 1 . 2]" 1
1397 1 63 TRP HE1 1 90 LYS QB . . 5.340 4.744 4.254 5.212 . 0 0 "[ . 1 . 2]" 1
1398 1 63 TRP HE1 1 90 LYS QD . . 5.340 4.878 4.253 5.315 . 0 0 "[ . 1 . 2]" 1
1399 1 63 TRP HE3 1 64 LEU QD . . 5.440 4.726 3.849 5.443 0.003 20 0 "[ . 1 . 2]" 1
1400 1 63 TRP HE3 1 83 LEU MD1 . . 4.360 2.406 1.938 3.039 . 0 0 "[ . 1 . 2]" 1
1401 1 63 TRP HE3 1 83 LEU QD . . 3.790 2.064 1.803 2.287 . 0 0 "[ . 1 . 2]" 1
1402 1 63 TRP HE3 1 83 LEU MD2 . . 4.360 2.450 1.963 2.932 . 0 0 "[ . 1 . 2]" 1
1403 1 63 TRP HE3 1 83 LEU HG . . 5.340 2.720 2.086 4.223 . 0 0 "[ . 1 . 2]" 1
1404 1 63 TRP HE3 1 87 SER QB . . 3.970 3.704 3.260 3.978 0.008 20 0 "[ . 1 . 2]" 1
1405 1 63 TRP HH2 1 87 SER HA . . 3.380 2.905 2.588 3.274 . 0 0 "[ . 1 . 2]" 1
1406 1 63 TRP HH2 1 87 SER HB2 . . 4.690 2.685 2.262 4.549 . 0 0 "[ . 1 . 2]" 1
1407 1 63 TRP HH2 1 87 SER QB . . 4.060 2.467 2.228 2.863 . 0 0 "[ . 1 . 2]" 1
1408 1 63 TRP HH2 1 87 SER HB3 . . 4.690 3.472 2.581 3.937 . 0 0 "[ . 1 . 2]" 1
1409 1 63 TRP HH2 1 90 LYS QB . . 4.360 4.135 3.794 4.384 0.024 8 0 "[ . 1 . 2]" 1
1410 1 63 TRP HH2 1 90 LYS QD . . 3.940 2.397 2.144 3.206 . 0 0 "[ . 1 . 2]" 1
1411 1 63 TRP HH2 1 90 LYS HG2 . . 4.750 4.701 4.441 4.772 0.022 17 0 "[ . 1 . 2]" 1
1412 1 63 TRP HZ2 1 87 SER HA . . 3.780 2.606 2.415 2.959 . 0 0 "[ . 1 . 2]" 1
1413 1 63 TRP HZ2 1 87 SER QB . . 4.890 3.686 3.455 4.215 . 0 0 "[ . 1 . 2]" 1
1414 1 63 TRP HZ2 1 90 LYS HB2 . . 4.520 4.142 3.218 4.537 0.017 16 0 "[ . 1 . 2]" 1
1415 1 63 TRP HZ2 1 90 LYS QB . . 3.680 3.051 2.726 3.282 . 0 0 "[ . 1 . 2]" 1
1416 1 63 TRP HZ2 1 90 LYS HB3 . . 4.520 3.168 2.796 3.538 . 0 0 "[ . 1 . 2]" 1
1417 1 63 TRP HZ2 1 90 LYS QD . . 3.550 2.418 1.956 2.790 . 0 0 "[ . 1 . 2]" 1
1418 1 63 TRP HZ2 1 90 LYS QE . . 5.050 3.393 2.424 4.559 . 0 0 "[ . 1 . 2]" 1
1419 1 63 TRP HZ2 1 90 LYS HG2 . . 4.950 4.737 4.370 4.955 0.005 16 0 "[ . 1 . 2]" 1
1420 1 63 TRP HZ3 1 83 LEU QD . . 4.790 3.048 2.617 3.322 . 0 0 "[ . 1 . 2]" 1
1421 1 63 TRP HZ3 1 87 SER HA . . 4.730 4.316 3.807 4.679 . 0 0 "[ . 1 . 2]" 1
1422 1 63 TRP HZ3 1 87 SER HB2 . . 4.860 3.104 2.603 4.203 . 0 0 "[ . 1 . 2]" 1
1423 1 63 TRP HZ3 1 87 SER QB . . 4.030 2.744 2.505 2.971 . 0 0 "[ . 1 . 2]" 1
1424 1 63 TRP HZ3 1 87 SER HB3 . . 4.860 3.234 2.642 3.578 . 0 0 "[ . 1 . 2]" 1
1425 1 64 LEU H 1 65 GLN H . . 3.890 2.498 2.366 2.810 . 0 0 "[ . 1 . 2]" 1
1426 1 64 LEU HA 1 64 LEU MD1 . . 4.220 2.972 1.964 3.973 . 0 0 "[ . 1 . 2]" 1
1427 1 64 LEU HA 1 64 LEU QD . . 3.060 2.088 1.892 2.384 . 0 0 "[ . 1 . 2]" 1
1428 1 64 LEU HA 1 64 LEU MD2 . . 4.220 2.719 1.957 3.825 . 0 0 "[ . 1 . 2]" 1
1429 1 64 LEU HA 1 64 LEU HG . . 4.170 3.055 2.538 3.680 . 0 0 "[ . 1 . 2]" 1
1430 1 64 LEU HA 1 67 ALA MB . . 4.030 3.139 1.970 4.031 0.001 9 0 "[ . 1 . 2]" 1
1431 1 64 LEU QB 1 64 LEU QD . . 2.740 1.927 1.845 2.072 . 0 0 "[ . 1 . 2]" 1
1432 1 64 LEU QB 1 65 GLN H . . 4.130 2.620 2.239 2.959 . 0 0 "[ . 1 . 2]" 1
1433 1 64 LEU HB2 1 64 LEU MD1 . . 3.590 2.472 2.054 3.188 . 0 0 "[ . 1 . 2]" 1
1434 1 64 LEU HB2 1 64 LEU MD2 . . 3.590 2.765 2.286 3.194 . 0 0 "[ . 1 . 2]" 1
1435 1 64 LEU HB2 1 65 GLN H . . 4.730 2.924 2.283 3.775 . 0 0 "[ . 1 . 2]" 1
1436 1 64 LEU HB3 1 64 LEU MD1 . . 3.590 2.619 2.227 3.195 . 0 0 "[ . 1 . 2]" 1
1437 1 64 LEU HB3 1 64 LEU MD2 . . 3.590 2.459 2.114 3.192 . 0 0 "[ . 1 . 2]" 1
1438 1 64 LEU HB3 1 65 GLN H . . 4.730 3.272 2.664 3.720 . 0 0 "[ . 1 . 2]" 1
1439 1 64 LEU QD 1 67 ALA MB . . 4.280 3.726 2.894 4.284 0.004 13 0 "[ . 1 . 2]" 1
1440 1 64 LEU MD1 1 65 GLN H . . 5.500 4.520 4.042 4.839 . 0 0 "[ . 1 . 2]" 1
1441 1 64 LEU MD2 1 65 GLN H . . 5.500 4.596 4.174 4.884 . 0 0 "[ . 1 . 2]" 1
1442 1 65 GLN H 1 65 GLN QB . . 3.580 2.259 2.155 2.409 . 0 0 "[ . 1 . 2]" 1
1443 1 65 GLN H 1 65 GLN QG . . 4.520 3.636 2.444 4.095 . 0 0 "[ . 1 . 2]" 1
1444 1 65 GLN HA 1 65 GLN QG . . 3.480 2.556 2.162 3.360 . 0 0 "[ . 1 . 2]" 1
1445 1 66 MET H 1 66 MET HB2 . . 4.150 2.469 2.110 3.696 . 0 0 "[ . 1 . 2]" 1
1446 1 66 MET H 1 66 MET QB . . 3.570 2.281 2.092 2.753 . 0 0 "[ . 1 . 2]" 1
1447 1 66 MET H 1 66 MET HB3 . . 4.150 3.127 2.518 3.590 . 0 0 "[ . 1 . 2]" 1
1448 1 66 MET H 1 66 MET HG2 . . 4.910 4.025 2.235 4.698 . 0 0 "[ . 1 . 2]" 1
1449 1 66 MET H 1 66 MET QG . . 4.250 3.399 2.211 4.075 . 0 0 "[ . 1 . 2]" 1
1450 1 66 MET H 1 66 MET HG3 . . 4.910 3.806 2.648 4.690 . 0 0 "[ . 1 . 2]" 1
1451 1 66 MET HA 1 66 MET ME . . 5.330 4.230 3.519 4.505 . 0 0 "[ . 1 . 2]" 1
1452 1 66 MET HA 1 66 MET QG . . 3.510 2.354 2.109 3.338 . 0 0 "[ . 1 . 2]" 1
1453 1 66 MET QB 1 67 ALA H . . 4.350 3.133 2.655 3.879 . 0 0 "[ . 1 . 2]" 1
1454 1 66 MET HB2 1 67 ALA H . . 5.020 3.656 2.819 4.338 . 0 0 "[ . 1 . 2]" 1
1455 1 66 MET HB3 1 67 ALA H . . 5.020 3.529 2.917 4.372 . 0 0 "[ . 1 . 2]" 1
1456 1 67 ALA H 1 68 ASP H . . 4.590 2.337 1.934 3.028 . 0 0 "[ . 1 . 2]" 1
1457 1 67 ALA MB 1 68 ASP H . . 4.640 2.888 2.087 3.532 . 0 0 "[ . 1 . 2]" 1
1458 1 69 THR HA 1 69 THR MG . . 3.300 2.682 1.962 3.199 . 0 0 "[ . 1 . 2]" 1
1459 1 70 ASN HA 1 70 ASN HD21 . . 4.800 3.688 2.001 4.418 . 0 0 "[ . 1 . 2]" 1
1460 1 70 ASN HA 1 70 ASN QD . . 4.040 3.436 1.985 4.041 0.001 12 0 "[ . 1 . 2]" 1
1461 1 70 ASN HA 1 70 ASN HD22 . . 4.800 4.226 3.337 4.868 0.068 18 0 "[ . 1 . 2]" 1
1462 1 75 VAL QG 1 76 SER H . . 4.890 2.305 1.973 2.754 . 0 0 "[ . 1 . 2]" 1
1463 1 75 VAL QG 1 76 SER HA . . 5.440 3.439 3.222 3.709 . 0 0 "[ . 1 . 2]" 1
1464 1 75 VAL QG 1 79 GLU QB . . 3.970 2.332 1.866 3.720 . 0 0 "[ . 1 . 2]" 1
1465 1 75 VAL QG 1 79 GLU QG . . 4.700 3.354 2.015 4.678 . 0 0 "[ . 1 . 2]" 1
1466 1 75 VAL QG 1 80 TYR H . . 4.120 3.278 2.857 3.700 . 0 0 "[ . 1 . 2]" 1
1467 1 75 VAL QG 1 80 TYR HA . . 4.940 3.380 3.054 3.786 . 0 0 "[ . 1 . 2]" 1
1468 1 75 VAL QG 1 80 TYR QB . . 4.150 2.773 2.316 3.071 . 0 0 "[ . 1 . 2]" 1
1469 1 75 VAL QG 1 80 TYR QD . . 4.130 3.794 3.452 4.042 . 0 0 "[ . 1 . 2]" 1
1470 1 75 VAL QG 1 80 TYR QE . . 5.440 5.143 4.778 5.454 0.014 6 0 "[ . 1 . 2]" 1
1471 1 76 SER H 1 79 GLU H . . 4.710 3.595 3.267 4.201 . 0 0 "[ . 1 . 2]" 1
1472 1 76 SER H 1 79 GLU QB . . 3.780 2.803 1.982 3.799 0.019 18 0 "[ . 1 . 2]" 1
1473 1 76 SER H 1 79 GLU QG . . 4.660 2.972 1.989 3.898 . 0 0 "[ . 1 . 2]" 1
1474 1 76 SER HA 1 78 GLU H . . 4.760 4.572 4.172 4.760 0.000 8 0 "[ . 1 . 2]" 1
1475 1 76 SER QB 1 77 LEU H . . 3.720 2.360 1.932 3.392 . 0 0 "[ . 1 . 2]" 1
1476 1 76 SER QB 1 78 GLU H . . 3.690 2.898 2.512 3.459 . 0 0 "[ . 1 . 2]" 1
1477 1 76 SER HB2 1 77 LEU H . . 4.340 3.195 1.950 4.148 . 0 0 "[ . 1 . 2]" 1
1478 1 76 SER HB3 1 77 LEU H . . 4.340 2.656 1.949 3.694 . 0 0 "[ . 1 . 2]" 1
1479 1 77 LEU H 1 77 LEU HB2 . . 3.730 2.633 2.341 2.842 . 0 0 "[ . 1 . 2]" 1
1480 1 77 LEU H 1 77 LEU HB3 . . 3.730 2.402 2.264 2.706 . 0 0 "[ . 1 . 2]" 1
1481 1 77 LEU HA 1 77 LEU MD1 . . 4.020 2.307 1.971 3.709 . 0 0 "[ . 1 . 2]" 1
1482 1 77 LEU HA 1 77 LEU QD . . 2.990 2.216 1.965 2.890 . 0 0 "[ . 1 . 2]" 1
1483 1 77 LEU HA 1 77 LEU MD2 . . 4.020 3.800 2.998 3.957 . 0 0 "[ . 1 . 2]" 1
1484 1 77 LEU HA 1 77 LEU HG . . 4.130 3.245 2.416 3.422 . 0 0 "[ . 1 . 2]" 1
1485 1 77 LEU HA 1 80 TYR HA . . 5.310 4.924 4.605 5.313 0.003 8 0 "[ . 1 . 2]" 1
1486 1 77 LEU HA 1 80 TYR QD . . 4.390 3.237 3.140 3.301 . 0 0 "[ . 1 . 2]" 1
1487 1 77 LEU HA 1 80 TYR QE . . 5.500 5.484 5.335 5.521 0.021 16 0 "[ . 1 . 2]" 1
1488 1 77 LEU QB 1 78 GLU H . . 3.360 2.597 2.446 2.736 . 0 0 "[ . 1 . 2]" 1
1489 1 77 LEU QB 1 80 TYR H . . 5.340 4.786 4.587 5.067 . 0 0 "[ . 1 . 2]" 1
1490 1 77 LEU QB 1 80 TYR QB . . 5.180 3.953 3.665 4.237 . 0 0 "[ . 1 . 2]" 1
1491 1 77 LEU HB2 1 78 GLU H . . 4.050 3.934 3.647 4.063 0.013 11 0 "[ . 1 . 2]" 1
1492 1 77 LEU HB3 1 78 GLU H . . 4.050 2.635 2.477 2.782 . 0 0 "[ . 1 . 2]" 1
1493 1 77 LEU QD 1 80 TYR QB . . 3.820 2.638 2.110 3.236 . 0 0 "[ . 1 . 2]" 1
1494 1 77 LEU QD 1 80 TYR QD . . 3.170 2.515 1.973 2.834 . 0 0 "[ . 1 . 2]" 1
1495 1 77 LEU QD 1 80 TYR QE . . 4.120 3.982 3.527 4.154 0.034 6 0 "[ . 1 . 2]" 1
1496 1 77 LEU QD 1 81 GLU H . . 4.360 3.311 2.724 4.023 . 0 0 "[ . 1 . 2]" 1
1497 1 77 LEU QD 1 81 GLU HA . . 5.050 3.822 3.266 4.295 . 0 0 "[ . 1 . 2]" 1
1498 1 77 LEU QD 1 81 GLU QB . . 4.720 3.587 2.504 4.682 . 0 0 "[ . 1 . 2]" 1
1499 1 77 LEU QD 1 81 GLU QG . . 4.110 2.633 1.967 3.961 . 0 0 "[ . 1 . 2]" 1
1500 1 77 LEU HG 1 78 GLU HA . . 5.500 3.701 3.230 5.556 0.056 6 0 "[ . 1 . 2]" 1
1501 1 77 LEU HG 1 81 GLU QG . . 5.300 3.340 2.266 5.311 0.011 4 0 "[ . 1 . 2]" 1
1502 1 78 GLU H 1 78 GLU QB . . 2.860 2.438 2.198 2.630 . 0 0 "[ . 1 . 2]" 1
1503 1 78 GLU H 1 78 GLU HG2 . . 4.170 3.006 1.952 4.059 . 0 0 "[ . 1 . 2]" 1
1504 1 78 GLU H 1 78 GLU QG . . 3.530 2.299 1.938 3.284 . 0 0 "[ . 1 . 2]" 1
1505 1 78 GLU H 1 78 GLU HG3 . . 4.170 2.839 1.970 3.921 . 0 0 "[ . 1 . 2]" 1
1506 1 78 GLU H 1 79 GLU H . . 3.480 2.811 2.654 3.022 . 0 0 "[ . 1 . 2]" 1
1507 1 78 GLU HA 1 81 GLU H . . 4.900 3.916 3.440 4.429 . 0 0 "[ . 1 . 2]" 1
1508 1 78 GLU HA 1 81 GLU QG . . 4.610 3.267 2.309 3.930 . 0 0 "[ . 1 . 2]" 1
1509 1 78 GLU QB 1 79 GLU H . . 3.750 2.880 2.087 3.521 . 0 0 "[ . 1 . 2]" 1
1510 1 79 GLU H 1 79 GLU HB2 . . 3.780 2.689 2.339 3.644 . 0 0 "[ . 1 . 2]" 1
1511 1 79 GLU H 1 79 GLU QB . . 3.140 2.532 2.309 2.623 . 0 0 "[ . 1 . 2]" 1
1512 1 79 GLU H 1 79 GLU HB3 . . 3.780 3.522 2.594 3.644 . 0 0 "[ . 1 . 2]" 1
1513 1 79 GLU H 1 79 GLU HG2 . . 3.740 2.855 2.113 3.774 0.034 11 0 "[ . 1 . 2]" 1
1514 1 79 GLU H 1 79 GLU HG3 . . 3.740 2.998 1.973 3.745 0.005 8 0 "[ . 1 . 2]" 1
1515 1 79 GLU H 1 80 TYR H . . 3.800 2.393 2.287 2.796 . 0 0 "[ . 1 . 2]" 1
1516 1 79 GLU H 1 81 GLU H . . 5.430 4.028 3.706 4.466 . 0 0 "[ . 1 . 2]" 1
1517 1 79 GLU HA 1 79 GLU HG2 . . 3.910 3.080 2.367 3.799 . 0 0 "[ . 1 . 2]" 1
1518 1 79 GLU HA 1 79 GLU QG . . 3.410 2.767 2.308 3.333 . 0 0 "[ . 1 . 2]" 1
1519 1 79 GLU HA 1 79 GLU HG3 . . 3.910 3.396 2.454 3.847 . 0 0 "[ . 1 . 2]" 1
1520 1 79 GLU HA 1 82 ASP QB . . 3.800 3.374 2.767 3.802 0.002 13 0 "[ . 1 . 2]" 1
1521 1 79 GLU QB 1 80 TYR H . . 3.670 2.834 2.355 3.492 . 0 0 "[ . 1 . 2]" 1
1522 1 80 TYR H 1 80 TYR QB . . 3.040 2.248 2.213 2.274 . 0 0 "[ . 1 . 2]" 1
1523 1 80 TYR H 1 80 TYR QD . . 4.220 4.186 4.132 4.207 . 0 0 "[ . 1 . 2]" 1
1524 1 80 TYR HA 1 80 TYR QD . . 2.910 2.188 1.997 2.469 . 0 0 "[ . 1 . 2]" 1
1525 1 80 TYR HA 1 80 TYR QE . . 4.680 4.453 4.291 4.618 . 0 0 "[ . 1 . 2]" 1
1526 1 80 TYR HA 1 83 LEU QB . . 4.210 2.475 2.120 2.927 . 0 0 "[ . 1 . 2]" 1
1527 1 80 TYR HA 1 83 LEU MD1 . . 5.350 3.553 2.908 4.969 . 0 0 "[ . 1 . 2]" 1
1528 1 80 TYR HA 1 83 LEU QD . . 4.110 3.206 2.803 3.740 . 0 0 "[ . 1 . 2]" 1
1529 1 80 TYR HA 1 83 LEU MD2 . . 5.350 3.834 3.396 4.374 . 0 0 "[ . 1 . 2]" 1
1530 1 80 TYR QB 1 81 GLU H . . 4.160 2.760 2.268 3.003 . 0 0 "[ . 1 . 2]" 1
1531 1 80 TYR QB 1 83 LEU QD . . 5.280 4.240 3.696 4.767 . 0 0 "[ . 1 . 2]" 1
1532 1 80 TYR QD 1 81 GLU H . . 4.570 4.148 3.494 4.403 . 0 0 "[ . 1 . 2]" 1
1533 1 80 TYR QD 1 83 LEU QB . . 4.030 2.691 2.208 3.190 . 0 0 "[ . 1 . 2]" 1
1534 1 80 TYR QD 1 83 LEU MD1 . . 4.060 2.973 2.333 3.705 . 0 0 "[ . 1 . 2]" 1
1535 1 80 TYR QD 1 83 LEU QD . . 3.570 2.609 2.084 3.329 . 0 0 "[ . 1 . 2]" 1
1536 1 80 TYR QD 1 83 LEU MD2 . . 4.060 2.937 2.333 3.771 . 0 0 "[ . 1 . 2]" 1
1537 1 80 TYR QD 1 84 ILE MD . . 4.540 3.683 3.265 4.396 . 0 0 "[ . 1 . 2]" 1
1538 1 80 TYR QD 1 84 ILE HG12 . . 5.120 4.009 3.598 4.314 . 0 0 "[ . 1 . 2]" 1
1539 1 80 TYR QD 1 84 ILE HG13 . . 5.460 4.851 4.561 5.238 . 0 0 "[ . 1 . 2]" 1
1540 1 80 TYR QE 1 83 LEU MD1 . . 4.540 3.584 2.770 4.441 . 0 0 "[ . 1 . 2]" 1
1541 1 80 TYR QE 1 83 LEU QD . . 3.810 2.528 1.918 3.287 . 0 0 "[ . 1 . 2]" 1
1542 1 80 TYR QE 1 83 LEU MD2 . . 4.540 2.823 1.932 4.542 0.002 6 0 "[ . 1 . 2]" 1
1543 1 80 TYR QE 1 84 ILE MD . . 3.660 2.525 2.021 3.030 . 0 0 "[ . 1 . 2]" 1
1544 1 80 TYR QE 1 84 ILE HG13 . . 4.750 4.228 3.873 4.583 . 0 0 "[ . 1 . 2]" 1
1545 1 80 TYR QE 1 84 ILE MG . . 5.500 5.141 4.793 5.466 . 0 0 "[ . 1 . 2]" 1
1546 1 81 GLU H 1 81 GLU HB2 . . 3.830 2.605 2.170 3.591 . 0 0 "[ . 1 . 2]" 1
1547 1 81 GLU H 1 81 GLU HB3 . . 3.830 3.271 2.445 3.589 . 0 0 "[ . 1 . 2]" 1
1548 1 81 GLU H 1 81 GLU HG2 . . 3.930 3.145 1.946 3.928 . 0 0 "[ . 1 . 2]" 1
1549 1 81 GLU H 1 81 GLU QG . . 3.290 2.529 1.932 2.879 . 0 0 "[ . 1 . 2]" 1
1550 1 81 GLU H 1 81 GLU HG3 . . 3.930 3.120 2.250 3.774 . 0 0 "[ . 1 . 2]" 1
1551 1 81 GLU H 1 82 ASP H . . 3.690 2.819 2.739 2.977 . 0 0 "[ . 1 . 2]" 1
1552 1 81 GLU HA 1 81 GLU HG2 . . 3.920 2.747 2.162 3.717 . 0 0 "[ . 1 . 2]" 1
1553 1 81 GLU HA 1 81 GLU QG . . 3.370 2.594 2.124 3.339 . 0 0 "[ . 1 . 2]" 1
1554 1 81 GLU HA 1 81 GLU HG3 . . 3.920 3.301 2.649 3.896 . 0 0 "[ . 1 . 2]" 1
1555 1 81 GLU HA 1 84 ILE H . . 4.590 3.739 3.498 4.085 . 0 0 "[ . 1 . 2]" 1
1556 1 81 GLU HA 1 84 ILE HB . . 4.350 3.774 3.255 4.357 0.007 18 0 "[ . 1 . 2]" 1
1557 1 81 GLU HA 1 84 ILE MD . . 5.210 4.673 4.176 5.216 0.006 13 0 "[ . 1 . 2]" 1
1558 1 81 GLU HA 1 84 ILE HG12 . . 5.120 3.277 2.790 3.849 . 0 0 "[ . 1 . 2]" 1
1559 1 81 GLU HA 1 85 ILE MD . . 5.430 5.266 5.020 5.439 0.009 12 0 "[ . 1 . 2]" 1
1560 1 81 GLU QB 1 82 ASP HA . . 4.360 3.918 3.742 4.364 0.004 9 0 "[ . 1 . 2]" 1
1561 1 81 GLU HB2 1 82 ASP H . . 3.750 2.792 2.219 3.765 0.015 9 0 "[ . 1 . 2]" 1
1562 1 81 GLU HB3 1 82 ASP H . . 3.750 3.289 2.889 3.886 0.136 4 0 "[ . 1 . 2]" 1
1563 1 81 GLU QG 1 82 ASP H . . 5.250 3.612 1.909 4.345 . 0 0 "[ . 1 . 2]" 1
1564 1 82 ASP H 1 82 ASP QB . . 3.070 2.245 2.056 2.427 . 0 0 "[ . 1 . 2]" 1
1565 1 82 ASP H 1 83 LEU H . . 3.550 2.649 2.435 2.859 . 0 0 "[ . 1 . 2]" 1
1566 1 82 ASP H 1 83 LEU QB . . 5.340 4.357 4.154 4.528 . 0 0 "[ . 1 . 2]" 1
1567 1 82 ASP HA 1 85 ILE H . . 4.620 3.368 3.004 3.620 . 0 0 "[ . 1 . 2]" 1
1568 1 82 ASP HA 1 85 ILE HB . . 3.470 3.267 2.477 3.478 0.008 7 0 "[ . 1 . 2]" 1
1569 1 82 ASP HA 1 85 ILE MD . . 4.050 3.933 3.736 4.054 0.004 17 0 "[ . 1 . 2]" 1
1570 1 82 ASP HA 1 85 ILE HG12 . . 4.750 2.455 2.218 2.685 . 0 0 "[ . 1 . 2]" 1
1571 1 82 ASP HA 1 85 ILE QG . . 4.010 2.322 2.103 2.482 . 0 0 "[ . 1 . 2]" 1
1572 1 82 ASP HA 1 85 ILE HG13 . . 4.750 2.882 2.609 3.096 . 0 0 "[ . 1 . 2]" 1
1573 1 82 ASP HA 1 85 ILE MG . . 4.500 4.319 3.760 4.490 . 0 0 "[ . 1 . 2]" 1
1574 1 83 LEU H 1 83 LEU HB2 . . 3.940 2.517 2.183 2.730 . 0 0 "[ . 1 . 2]" 1
1575 1 83 LEU H 1 83 LEU QB . . 3.260 2.203 2.122 2.233 . 0 0 "[ . 1 . 2]" 1
1576 1 83 LEU H 1 83 LEU HB3 . . 3.940 2.505 2.295 2.892 . 0 0 "[ . 1 . 2]" 1
1577 1 83 LEU H 1 83 LEU QD . . 4.300 3.614 3.385 3.700 . 0 0 "[ . 1 . 2]" 1
1578 1 83 LEU H 1 84 ILE H . . 3.810 2.774 2.598 2.978 . 0 0 "[ . 1 . 2]" 1
1579 1 83 LEU H 1 84 ILE HG12 . . 4.840 4.286 4.039 4.503 . 0 0 "[ . 1 . 2]" 1
1580 1 83 LEU HA 1 83 LEU MD1 . . 4.180 3.405 2.608 3.576 . 0 0 "[ . 1 . 2]" 1
1581 1 83 LEU HA 1 83 LEU QD . . 3.500 2.964 1.909 3.195 . 0 0 "[ . 1 . 2]" 1
1582 1 83 LEU HA 1 83 LEU MD2 . . 4.180 3.290 1.956 3.669 . 0 0 "[ . 1 . 2]" 1
1583 1 83 LEU HA 1 86 LYS H . . 4.530 3.785 3.546 4.111 . 0 0 "[ . 1 . 2]" 1
1584 1 83 LEU HA 1 86 LYS HB2 . . 5.190 3.794 3.392 4.302 . 0 0 "[ . 1 . 2]" 1
1585 1 83 LEU HA 1 86 LYS QB . . 4.350 3.442 3.218 3.781 . 0 0 "[ . 1 . 2]" 1
1586 1 83 LEU HA 1 86 LYS HB3 . . 5.190 4.333 3.442 5.192 0.002 1 0 "[ . 1 . 2]" 1
1587 1 83 LEU HA 1 86 LYS QD . . 4.940 4.273 2.411 4.911 . 0 0 "[ . 1 . 2]" 1
1588 1 83 LEU QB 1 84 ILE H . . 3.920 2.535 2.136 2.938 . 0 0 "[ . 1 . 2]" 1
1589 1 83 LEU QB 1 84 ILE MD . . 4.450 3.512 2.904 3.822 . 0 0 "[ . 1 . 2]" 1
1590 1 83 LEU HB2 1 84 ILE H . . 4.470 3.856 3.400 4.187 . 0 0 "[ . 1 . 2]" 1
1591 1 83 LEU HB3 1 84 ILE H . . 4.470 2.572 2.159 3.001 . 0 0 "[ . 1 . 2]" 1
1592 1 83 LEU QD 1 84 ILE HA . . 5.050 2.736 2.321 3.268 . 0 0 "[ . 1 . 2]" 1
1593 1 83 LEU QD 1 84 ILE MD . . 3.880 2.250 1.942 2.846 . 0 0 "[ . 1 . 2]" 1
1594 1 83 LEU QD 1 87 SER H . . 5.190 3.965 3.400 4.318 . 0 0 "[ . 1 . 2]" 1
1595 1 83 LEU QD 1 87 SER QB . . 3.740 2.736 2.126 3.419 . 0 0 "[ . 1 . 2]" 1
1596 1 84 ILE H 1 84 ILE HB . . 3.550 2.582 2.505 2.655 . 0 0 "[ . 1 . 2]" 1
1597 1 84 ILE H 1 84 ILE MD . . 4.030 3.149 2.880 3.422 . 0 0 "[ . 1 . 2]" 1
1598 1 84 ILE H 1 84 ILE HG12 . . 3.690 2.056 1.944 2.247 . 0 0 "[ . 1 . 2]" 1
1599 1 84 ILE H 1 84 ILE HG13 . . 4.820 3.563 3.479 3.710 . 0 0 "[ . 1 . 2]" 1
1600 1 84 ILE H 1 85 ILE H . . 3.910 2.710 2.404 2.843 . 0 0 "[ . 1 . 2]" 1
1601 1 84 ILE HA 1 84 ILE MD . . 3.150 2.018 1.956 2.119 . 0 0 "[ . 1 . 2]" 1
1602 1 84 ILE HA 1 84 ILE HG12 . . 4.130 3.074 3.017 3.166 . 0 0 "[ . 1 . 2]" 1
1603 1 84 ILE HA 1 84 ILE HG13 . . 4.210 3.724 3.705 3.760 . 0 0 "[ . 1 . 2]" 1
1604 1 84 ILE HA 1 84 ILE MG . . 3.210 2.338 2.288 2.392 . 0 0 "[ . 1 . 2]" 1
1605 1 84 ILE HA 1 87 SER H . . 4.350 3.383 3.232 3.613 . 0 0 "[ . 1 . 2]" 1
1606 1 84 ILE HA 1 88 LEU QD . . 4.700 4.164 3.546 4.579 . 0 0 "[ . 1 . 2]" 1
1607 1 84 ILE HB 1 84 ILE MD . . 3.640 3.219 3.216 3.230 . 0 0 "[ . 1 . 2]" 1
1608 1 84 ILE HB 1 85 ILE HA . . 4.750 4.180 4.108 4.213 . 0 0 "[ . 1 . 2]" 1
1609 1 84 ILE HB 1 85 ILE MD . . 5.040 3.435 3.249 3.792 . 0 0 "[ . 1 . 2]" 1
1610 1 84 ILE HB 1 85 ILE QG . . 4.700 3.517 3.421 3.656 . 0 0 "[ . 1 . 2]" 1
1611 1 84 ILE HB 1 87 SER H . . 5.500 5.369 5.213 5.512 0.012 18 0 "[ . 1 . 2]" 1
1612 1 84 ILE MD 1 87 SER H . . 5.500 4.890 4.760 5.092 . 0 0 "[ . 1 . 2]" 1
1613 1 84 ILE MD 1 87 SER QB . . 4.420 3.629 3.247 3.880 . 0 0 "[ . 1 . 2]" 1
1614 1 84 ILE HG12 1 84 ILE MG . . 3.620 3.194 3.184 3.203 . 0 0 "[ . 1 . 2]" 1
1615 1 84 ILE HG13 1 84 ILE MG . . 3.710 2.318 2.239 2.382 . 0 0 "[ . 1 . 2]" 1
1616 1 84 ILE MG 1 85 ILE H . . 3.980 3.503 3.381 3.646 . 0 0 "[ . 1 . 2]" 1
1617 1 84 ILE MG 1 85 ILE HA . . 3.790 3.555 3.414 3.793 0.003 13 0 "[ . 1 . 2]" 1
1618 1 84 ILE MG 1 85 ILE MD . . 3.950 3.409 3.186 3.625 . 0 0 "[ . 1 . 2]" 1
1619 1 84 ILE MG 1 87 SER H . . 5.180 4.377 4.147 4.670 . 0 0 "[ . 1 . 2]" 1
1620 1 84 ILE MG 1 87 SER QB . . 4.610 3.918 3.027 4.346 . 0 0 "[ . 1 . 2]" 1
1621 1 84 ILE MG 1 88 LEU HA . . 4.730 4.602 4.266 4.732 0.002 12 0 "[ . 1 . 2]" 1
1622 1 84 ILE MG 1 88 LEU HB2 . . 4.070 3.905 3.649 4.072 0.002 20 0 "[ . 1 . 2]" 1
1623 1 84 ILE MG 1 88 LEU MD1 . . 3.710 2.134 1.878 2.526 . 0 0 "[ . 1 . 2]" 1
1624 1 84 ILE MG 1 88 LEU QD . . 3.250 2.090 1.861 2.387 . 0 0 "[ . 1 . 2]" 1
1625 1 84 ILE MG 1 88 LEU MD2 . . 3.710 3.121 2.512 3.609 . 0 0 "[ . 1 . 2]" 1
1626 1 84 ILE MG 1 88 LEU HG . . 4.320 2.855 2.095 4.330 0.010 2 0 "[ . 1 . 2]" 1
1627 1 85 ILE H 1 85 ILE HB . . 3.110 2.634 2.590 2.661 . 0 0 "[ . 1 . 2]" 1
1628 1 85 ILE H 1 85 ILE MD . . 4.180 2.956 2.837 3.122 . 0 0 "[ . 1 . 2]" 1
1629 1 85 ILE H 1 85 ILE HG12 . . 3.760 1.967 1.944 2.021 . 0 0 "[ . 1 . 2]" 1
1630 1 85 ILE H 1 85 ILE QG . . 3.160 1.957 1.935 2.010 . 0 0 "[ . 1 . 2]" 1
1631 1 85 ILE H 1 85 ILE HG13 . . 3.760 3.519 3.494 3.561 . 0 0 "[ . 1 . 2]" 1
1632 1 85 ILE H 1 85 ILE MG . . 3.990 3.763 3.761 3.766 . 0 0 "[ . 1 . 2]" 1
1633 1 85 ILE H 1 86 LYS H . . 3.910 2.946 2.811 3.058 . 0 0 "[ . 1 . 2]" 1
1634 1 85 ILE HA 1 85 ILE MD . . 3.150 2.095 1.980 2.178 . 0 0 "[ . 1 . 2]" 1
1635 1 85 ILE HA 1 85 ILE QG . . 3.640 2.970 2.897 3.008 . 0 0 "[ . 1 . 2]" 1
1636 1 85 ILE HA 1 85 ILE MG . . 3.220 2.329 2.254 2.383 . 0 0 "[ . 1 . 2]" 1
1637 1 85 ILE HA 1 88 LEU H . . 5.110 3.514 3.338 3.711 . 0 0 "[ . 1 . 2]" 1
1638 1 85 ILE HA 1 88 LEU HB2 . . 4.310 2.787 2.551 2.925 . 0 0 "[ . 1 . 2]" 1
1639 1 85 ILE HA 1 88 LEU HB3 . . 4.420 4.351 4.036 4.431 0.011 12 0 "[ . 1 . 2]" 1
1640 1 85 ILE HA 1 88 LEU QD . . 3.530 2.551 2.126 2.942 . 0 0 "[ . 1 . 2]" 1
1641 1 85 ILE HA 1 88 LEU HG . . 5.190 4.253 3.416 5.208 0.018 17 0 "[ . 1 . 2]" 1
1642 1 85 ILE HA 1 95 VAL MG1 . . 4.810 4.416 3.892 4.774 . 0 0 "[ . 1 . 2]" 1
1643 1 85 ILE HA 1 95 VAL QG . . 4.220 3.811 3.259 4.167 . 0 0 "[ . 1 . 2]" 1
1644 1 85 ILE HA 1 95 VAL MG2 . . 4.810 4.207 3.396 4.652 . 0 0 "[ . 1 . 2]" 1
1645 1 85 ILE HB 1 85 ILE MD . . 3.690 3.224 3.215 3.231 . 0 0 "[ . 1 . 2]" 1
1646 1 85 ILE HB 1 86 LYS H . . 3.910 2.258 2.052 2.524 . 0 0 "[ . 1 . 2]" 1
1647 1 85 ILE HB 1 88 LEU HB2 . . 5.500 5.444 5.314 5.512 0.012 14 0 "[ . 1 . 2]" 1
1648 1 85 ILE HB 1 95 VAL MG1 . . 5.500 5.045 4.363 5.402 . 0 0 "[ . 1 . 2]" 1
1649 1 85 ILE HB 1 95 VAL MG2 . . 5.500 5.253 4.747 5.503 0.003 19 0 "[ . 1 . 2]" 1
1650 1 85 ILE MD 1 85 ILE MG . . 2.850 1.991 1.923 2.102 . 0 0 "[ . 1 . 2]" 1
1651 1 85 ILE MD 1 86 LYS H . . 4.880 4.536 4.477 4.607 . 0 0 "[ . 1 . 2]" 1
1652 1 85 ILE MD 1 88 LEU HB2 . . 4.880 4.074 3.868 4.254 . 0 0 "[ . 1 . 2]" 1
1653 1 85 ILE MD 1 88 LEU HB3 . . 5.500 5.076 4.777 5.282 . 0 0 "[ . 1 . 2]" 1
1654 1 85 ILE MD 1 88 LEU QD . . 4.390 2.788 2.303 3.149 . 0 0 "[ . 1 . 2]" 1
1655 1 85 ILE MD 1 88 LEU HG . . 5.500 4.914 4.226 5.505 0.005 2 0 "[ . 1 . 2]" 1
1656 1 85 ILE MD 1 95 VAL HB . . 4.780 4.519 4.151 4.780 0.000 13 0 "[ . 1 . 2]" 1
1657 1 85 ILE MD 1 95 VAL MG1 . . 4.410 3.644 2.557 4.402 . 0 0 "[ . 1 . 2]" 1
1658 1 85 ILE MD 1 95 VAL QG . . 3.190 2.858 2.478 3.193 0.003 19 0 "[ . 1 . 2]" 1
1659 1 85 ILE MD 1 95 VAL MG2 . . 4.410 3.149 2.633 3.551 . 0 0 "[ . 1 . 2]" 1
1660 1 85 ILE QG 1 85 ILE MG . . 3.290 2.256 2.193 2.312 . 0 0 "[ . 1 . 2]" 1
1661 1 85 ILE MG 1 86 LYS H . . 4.260 3.206 3.037 3.439 . 0 0 "[ . 1 . 2]" 1
1662 1 85 ILE MG 1 88 LEU HB2 . . 4.590 3.845 3.701 4.034 . 0 0 "[ . 1 . 2]" 1
1663 1 85 ILE MG 1 89 GLN H . . 5.500 4.591 4.268 4.775 . 0 0 "[ . 1 . 2]" 1
1664 1 85 ILE MG 1 89 GLN HB2 . . 5.390 5.138 4.838 5.401 0.011 7 0 "[ . 1 . 2]" 1
1665 1 85 ILE MG 1 89 GLN HG2 . . 4.490 3.823 3.447 4.341 . 0 0 "[ . 1 . 2]" 1
1666 1 85 ILE MG 1 89 GLN HG3 . . 4.070 3.577 3.129 3.942 . 0 0 "[ . 1 . 2]" 1
1667 1 85 ILE MG 1 95 VAL HB . . 4.150 3.533 2.903 4.080 . 0 0 "[ . 1 . 2]" 1
1668 1 86 LYS H 1 86 LYS QB . . 3.050 2.280 2.100 2.624 . 0 0 "[ . 1 . 2]" 1
1669 1 86 LYS H 1 86 LYS QG . . 4.160 3.262 1.984 3.976 . 0 0 "[ . 1 . 2]" 1
1670 1 86 LYS H 1 87 SER H . . 4.180 2.652 2.521 2.751 . 0 0 "[ . 1 . 2]" 1
1671 1 86 LYS HA 1 86 LYS QD . . 4.590 3.950 3.664 4.137 . 0 0 "[ . 1 . 2]" 1
1672 1 86 LYS HA 1 86 LYS HG2 . . 3.950 2.936 2.230 3.415 . 0 0 "[ . 1 . 2]" 1
1673 1 86 LYS HA 1 86 LYS QG . . 3.360 2.287 2.112 2.545 . 0 0 "[ . 1 . 2]" 1
1674 1 86 LYS HA 1 86 LYS HG3 . . 3.950 2.613 2.147 3.583 . 0 0 "[ . 1 . 2]" 1
1675 1 86 LYS HA 1 89 GLN H . . 4.240 3.490 3.274 3.783 . 0 0 "[ . 1 . 2]" 1
1676 1 86 LYS HA 1 89 GLN HB2 . . 3.510 3.211 2.869 3.510 . 4 0 "[ . 1 . 2]" 1
1677 1 86 LYS HA 1 89 GLN HG2 . . 4.650 3.968 3.279 4.652 0.002 4 0 "[ . 1 . 2]" 1
1678 1 86 LYS HA 1 89 GLN HG3 . . 4.440 2.740 2.005 3.807 . 0 0 "[ . 1 . 2]" 1
1679 1 86 LYS HA 1 95 VAL QG . . 4.950 4.817 4.167 4.962 0.012 13 0 "[ . 1 . 2]" 1
1680 1 86 LYS QB 1 87 SER H . . 3.420 2.781 2.482 2.929 . 0 0 "[ . 1 . 2]" 1
1681 1 86 LYS HB2 1 87 SER H . . 4.120 3.406 2.517 4.016 . 0 0 "[ . 1 . 2]" 1
1682 1 86 LYS HB3 1 87 SER H . . 4.120 3.249 2.600 4.026 . 0 0 "[ . 1 . 2]" 1
1683 1 86 LYS QE 1 86 LYS QG . . 3.270 2.223 2.043 2.553 . 0 0 "[ . 1 . 2]" 1
1684 1 87 SER H 1 87 SER HB2 . . 3.930 3.491 2.836 3.583 . 0 0 "[ . 1 . 2]" 1
1685 1 87 SER H 1 87 SER QB . . 3.400 2.319 2.222 2.795 . 0 0 "[ . 1 . 2]" 1
1686 1 87 SER H 1 87 SER HB3 . . 3.930 2.421 2.245 3.559 . 0 0 "[ . 1 . 2]" 1
1687 1 87 SER H 1 88 LEU H . . 3.820 2.494 2.381 2.644 . 0 0 "[ . 1 . 2]" 1
1688 1 87 SER HA 1 90 LYS QD . . 3.500 2.462 1.950 3.447 . 0 0 "[ . 1 . 2]" 1
1689 1 87 SER HA 1 90 LYS QE . . 5.340 4.200 3.457 4.886 . 0 0 "[ . 1 . 2]" 1
1690 1 87 SER HA 1 90 LYS HG2 . . 4.250 3.914 3.604 4.266 0.016 4 0 "[ . 1 . 2]" 1
1691 1 87 SER QB 1 90 LYS QD . . 5.180 3.026 2.433 4.291 . 0 0 "[ . 1 . 2]" 1
1692 1 87 SER HB2 1 88 LEU H . . 4.450 4.073 3.143 4.325 . 0 0 "[ . 1 . 2]" 1
1693 1 87 SER HB3 1 88 LEU H . . 4.450 3.838 3.576 4.292 . 0 0 "[ . 1 . 2]" 1
1694 1 88 LEU H 1 88 LEU HB2 . . 3.950 2.210 2.085 2.391 . 0 0 "[ . 1 . 2]" 1
1695 1 88 LEU H 1 88 LEU HB3 . . 3.880 3.499 3.400 3.572 . 0 0 "[ . 1 . 2]" 1
1696 1 88 LEU H 1 88 LEU MD1 . . 4.790 3.359 2.240 3.831 . 0 0 "[ . 1 . 2]" 1
1697 1 88 LEU H 1 88 LEU QD . . 4.170 3.123 2.223 3.514 . 0 0 "[ . 1 . 2]" 1
1698 1 88 LEU H 1 88 LEU MD2 . . 4.790 3.910 3.509 4.193 . 0 0 "[ . 1 . 2]" 1
1699 1 88 LEU H 1 88 LEU HG . . 4.230 3.273 2.412 4.314 0.084 2 0 "[ . 1 . 2]" 1
1700 1 88 LEU H 1 89 GLN H . . 3.960 2.466 2.323 2.788 . 0 0 "[ . 1 . 2]" 1
1701 1 88 LEU HA 1 88 LEU MD1 . . 4.120 3.430 2.050 3.857 . 0 0 "[ . 1 . 2]" 1
1702 1 88 LEU HA 1 88 LEU QD . . 3.010 2.068 1.961 2.334 . 0 0 "[ . 1 . 2]" 1
1703 1 88 LEU HA 1 88 LEU MD2 . . 4.120 2.474 1.967 3.796 . 0 0 "[ . 1 . 2]" 1
1704 1 88 LEU HA 1 88 LEU HG . . 4.180 2.736 2.569 2.946 . 0 0 "[ . 1 . 2]" 1
1705 1 88 LEU HA 1 91 ALA MB . . 3.560 3.037 2.813 3.502 . 0 0 "[ . 1 . 2]" 1
1706 1 88 LEU HA 1 93 ILE HB . . 4.190 3.903 3.555 4.156 . 0 0 "[ . 1 . 2]" 1
1707 1 88 LEU HA 1 93 ILE MD . . 3.120 2.507 2.080 2.968 . 0 0 "[ . 1 . 2]" 1
1708 1 88 LEU HB2 1 89 GLN H . . 4.280 3.059 2.491 3.325 . 0 0 "[ . 1 . 2]" 1
1709 1 88 LEU HB2 1 93 ILE HB . . 4.400 3.947 3.738 4.153 . 0 0 "[ . 1 . 2]" 1
1710 1 88 LEU HB2 1 93 ILE MD . . 5.060 3.716 3.447 4.182 . 0 0 "[ . 1 . 2]" 1
1711 1 88 LEU HB2 1 93 ILE MG . . 5.300 4.208 3.921 4.502 . 0 0 "[ . 1 . 2]" 1
1712 1 88 LEU HB3 1 89 GLN H . . 3.870 3.601 3.145 3.815 . 0 0 "[ . 1 . 2]" 1
1713 1 88 LEU HB3 1 93 ILE HB . . 4.560 2.372 1.988 2.561 . 0 0 "[ . 1 . 2]" 1
1714 1 88 LEU HB3 1 93 ILE MD . . 4.720 2.311 1.968 2.791 . 0 0 "[ . 1 . 2]" 1
1715 1 88 LEU HB3 1 93 ILE MG . . 4.490 2.988 2.673 3.210 . 0 0 "[ . 1 . 2]" 1
1716 1 88 LEU HB3 1 95 VAL QG . . 4.430 3.950 2.815 4.437 0.007 10 0 "[ . 1 . 2]" 1
1717 1 88 LEU QD 1 89 GLN H . . 5.440 4.204 3.985 4.329 . 0 0 "[ . 1 . 2]" 1
1718 1 88 LEU QD 1 91 ALA H . . 5.140 4.737 4.483 5.024 . 0 0 "[ . 1 . 2]" 1
1719 1 88 LEU QD 1 91 ALA MB . . 4.130 3.500 3.003 4.038 . 0 0 "[ . 1 . 2]" 1
1720 1 88 LEU QD 1 93 ILE MD . . 3.960 2.044 1.774 2.705 . 0 0 "[ . 1 . 2]" 1
1721 1 88 LEU QD 1 93 ILE QG . . 4.320 3.339 2.491 3.886 . 0 0 "[ . 1 . 2]" 1
1722 1 88 LEU QD 1 95 VAL QG . . 4.030 3.556 2.650 4.020 . 0 0 "[ . 1 . 2]" 1
1723 1 88 LEU MD1 1 93 ILE HB . . 4.370 4.232 4.074 4.431 0.061 2 0 "[ . 1 . 2]" 1
1724 1 88 LEU MD2 1 93 ILE HB . . 4.370 3.508 3.101 3.762 . 0 0 "[ . 1 . 2]" 1
1725 1 88 LEU HG 1 93 ILE MD . . 4.300 3.384 1.907 4.112 . 0 0 "[ . 1 . 2]" 1
1726 1 88 LEU HG 1 93 ILE MG . . 5.260 4.698 2.984 5.279 0.019 5 0 "[ . 1 . 2]" 1
1727 1 89 GLN H 1 89 GLN HB2 . . 3.350 2.418 2.281 2.628 . 0 0 "[ . 1 . 2]" 1
1728 1 89 GLN H 1 89 GLN HB3 . . 3.730 3.581 3.546 3.611 . 0 0 "[ . 1 . 2]" 1
1729 1 89 GLN H 1 89 GLN HG3 . . 3.440 3.059 2.322 3.444 0.004 9 0 "[ . 1 . 2]" 1
1730 1 89 GLN H 1 90 LYS H . . 3.640 2.537 2.408 2.736 . 0 0 "[ . 1 . 2]" 1
1731 1 89 GLN H 1 91 ALA H . . 4.450 4.068 3.993 4.197 . 0 0 "[ . 1 . 2]" 1
1732 1 89 GLN H 1 92 GLY H . . 5.090 4.963 4.804 5.076 . 0 0 "[ . 1 . 2]" 1
1733 1 89 GLN H 1 93 ILE MD . . 5.500 4.538 4.029 4.806 . 0 0 "[ . 1 . 2]" 1
1734 1 89 GLN H 1 95 VAL QG . . 4.530 4.332 3.629 4.543 0.013 3 0 "[ . 1 . 2]" 1
1735 1 89 GLN HA 1 89 GLN HG2 . . 3.550 2.484 2.247 2.639 . 0 0 "[ . 1 . 2]" 1
1736 1 89 GLN HA 1 89 GLN HG3 . . 4.170 3.631 3.321 3.762 . 0 0 "[ . 1 . 2]" 1
1737 1 89 GLN HA 1 93 ILE H . . 3.740 3.019 2.369 3.746 0.006 12 0 "[ . 1 . 2]" 1
1738 1 89 GLN HA 1 93 ILE HB . . 4.750 3.482 2.964 4.019 . 0 0 "[ . 1 . 2]" 1
1739 1 89 GLN HA 1 93 ILE MD . . 5.500 4.299 3.941 4.625 . 0 0 "[ . 1 . 2]" 1
1740 1 89 GLN HA 1 93 ILE MG . . 5.220 4.534 4.070 5.037 . 0 0 "[ . 1 . 2]" 1
1741 1 89 GLN HA 1 95 VAL QG . . 4.180 3.998 3.682 4.191 0.011 7 0 "[ . 1 . 2]" 1
1742 1 89 GLN HB2 1 95 VAL QG . . 4.950 4.738 4.163 4.968 0.018 2 0 "[ . 1 . 2]" 1
1743 1 89 GLN QE 1 95 VAL HB . . 4.750 3.751 2.220 4.747 . 0 0 "[ . 1 . 2]" 1
1744 1 89 GLN QE 1 95 VAL QG . . 4.480 2.583 1.967 3.830 . 0 0 "[ . 1 . 2]" 1
1745 1 89 GLN HG2 1 93 ILE MD . . 5.500 5.407 4.907 5.526 0.026 2 0 "[ . 1 . 2]" 1
1746 1 89 GLN HG2 1 95 VAL MG1 . . 5.030 3.281 2.057 5.037 0.007 9 0 "[ . 1 . 2]" 1
1747 1 89 GLN HG2 1 95 VAL QG . . 3.770 2.505 2.055 2.918 . 0 0 "[ . 1 . 2]" 1
1748 1 89 GLN HG2 1 95 VAL MG2 . . 5.030 4.091 2.288 5.026 . 0 0 "[ . 1 . 2]" 1
1749 1 89 GLN HG3 1 95 VAL QG . . 3.810 3.368 2.550 3.801 . 0 0 "[ . 1 . 2]" 1
1750 1 90 LYS H 1 90 LYS HB2 . . 3.680 3.463 2.977 3.573 . 0 0 "[ . 1 . 2]" 1
1751 1 90 LYS H 1 90 LYS QB . . 3.050 2.247 2.147 2.323 . 0 0 "[ . 1 . 2]" 1
1752 1 90 LYS H 1 90 LYS HB3 . . 3.680 2.278 2.195 2.353 . 0 0 "[ . 1 . 2]" 1
1753 1 90 LYS H 1 90 LYS QD . . 4.580 3.559 3.149 4.536 . 0 0 "[ . 1 . 2]" 1
1754 1 90 LYS H 1 90 LYS HG2 . . 4.030 2.900 2.583 4.118 0.088 19 0 "[ . 1 . 2]" 1
1755 1 90 LYS H 1 91 ALA H . . 3.500 2.602 2.335 2.724 . 0 0 "[ . 1 . 2]" 1
1756 1 90 LYS H 1 91 ALA MB . . 4.400 4.243 4.001 4.392 . 0 0 "[ . 1 . 2]" 1
1757 1 90 LYS HA 1 90 LYS QE . . 5.340 4.780 3.633 5.347 0.007 14 0 "[ . 1 . 2]" 1
1758 1 90 LYS QB 1 90 LYS QE . . 3.450 2.682 1.971 3.403 . 0 0 "[ . 1 . 2]" 1
1759 1 90 LYS QD 1 90 LYS HG2 . . 2.490 2.198 2.151 2.483 . 0 0 "[ . 1 . 2]" 1
1760 1 90 LYS QE 1 90 LYS HG2 . . 3.490 3.178 2.027 3.518 0.028 2 0 "[ . 1 . 2]" 1
1761 1 90 LYS HG2 1 91 ALA H . . 4.260 2.411 2.052 3.649 . 0 0 "[ . 1 . 2]" 1
1762 1 90 LYS HG2 1 91 ALA HA . . 4.780 3.736 3.486 4.036 . 0 0 "[ . 1 . 2]" 1
1763 1 90 LYS HG2 1 91 ALA MB . . 4.370 3.213 2.927 3.986 . 0 0 "[ . 1 . 2]" 1
1764 1 91 ALA H 1 91 ALA MB . . 2.980 2.143 2.067 2.222 . 0 0 "[ . 1 . 2]" 1
1765 1 91 ALA MB 1 92 GLY QA . . 4.890 3.860 3.827 3.902 . 0 0 "[ . 1 . 2]" 1
1766 1 91 ALA MB 1 93 ILE H . . 4.000 3.211 2.720 3.825 . 0 0 "[ . 1 . 2]" 1
1767 1 91 ALA MB 1 93 ILE MD . . 3.340 1.953 1.787 2.298 . 0 0 "[ . 1 . 2]" 1
1768 1 93 ILE H 1 93 ILE HB . . 3.040 2.509 2.428 2.591 . 0 0 "[ . 1 . 2]" 1
1769 1 93 ILE H 1 93 ILE MD . . 3.570 2.789 1.942 3.480 . 0 0 "[ . 1 . 2]" 1
1770 1 93 ILE H 1 93 ILE QG . . 4.250 2.630 2.084 3.089 . 0 0 "[ . 1 . 2]" 1
1771 1 93 ILE HA 1 93 ILE QG . . 3.420 2.364 2.226 2.453 . 0 0 "[ . 1 . 2]" 1
1772 1 93 ILE HA 1 93 ILE MG . . 3.050 2.366 2.317 2.406 . 0 0 "[ . 1 . 2]" 1
1773 1 93 ILE HA 1 94 ARG H . . 2.730 2.174 2.141 2.227 . 0 0 "[ . 1 . 2]" 1
1774 1 93 ILE HB 1 93 ILE MD . . 3.430 2.111 2.002 2.241 . 0 0 "[ . 1 . 2]" 1
1775 1 93 ILE HB 1 94 ARG H . . 4.590 4.280 3.946 4.454 . 0 0 "[ . 1 . 2]" 1
1776 1 93 ILE HB 1 95 VAL QG . . 4.640 4.145 3.171 4.655 0.015 6 0 "[ . 1 . 2]" 1
1777 1 93 ILE QG 1 93 ILE MG . . 3.010 2.088 1.940 2.205 . 0 0 "[ . 1 . 2]" 1
1778 1 93 ILE QG 1 94 ARG H . . 5.060 4.182 3.978 4.318 . 0 0 "[ . 1 . 2]" 1
1779 1 93 ILE MG 1 94 ARG H . . 3.210 2.826 2.098 3.213 0.003 17 0 "[ . 1 . 2]" 1
1780 1 93 ILE MG 1 94 ARG HA . . 4.390 4.060 3.691 4.334 . 0 0 "[ . 1 . 2]" 1
1781 1 93 ILE MG 1 94 ARG QB . . 5.200 4.063 3.718 4.349 . 0 0 "[ . 1 . 2]" 1
1782 1 93 ILE MG 1 95 VAL HA . . 4.390 4.049 3.617 4.354 . 0 0 "[ . 1 . 2]" 1
1783 1 93 ILE MG 1 95 VAL HB . . 4.470 3.783 3.253 4.512 0.042 2 0 "[ . 1 . 2]" 1
1784 1 94 ARG H 1 94 ARG QB . . 2.880 2.273 2.213 2.374 . 0 0 "[ . 1 . 2]" 1
1785 1 94 ARG HA 1 94 ARG HD2 . . 4.910 4.161 2.933 4.835 . 0 0 "[ . 1 . 2]" 1
1786 1 94 ARG HA 1 94 ARG QD . . 4.180 3.523 2.083 4.178 . 0 0 "[ . 1 . 2]" 1
1787 1 94 ARG HA 1 94 ARG HD3 . . 4.910 3.994 2.095 4.847 . 0 0 "[ . 1 . 2]" 1
1788 1 94 ARG HA 1 94 ARG HG2 . . 3.790 3.110 2.331 3.777 . 0 0 "[ . 1 . 2]" 1
1789 1 94 ARG HA 1 94 ARG QG . . 3.310 2.449 2.296 2.831 . 0 0 "[ . 1 . 2]" 1
1790 1 94 ARG HA 1 94 ARG HG3 . . 3.790 2.723 2.355 3.454 . 0 0 "[ . 1 . 2]" 1
1791 1 94 ARG HA 1 95 VAL H . . 2.840 2.158 2.140 2.201 . 0 0 "[ . 1 . 2]" 1
1792 1 94 ARG HA 1 95 VAL MG1 . . 5.500 4.296 3.565 5.516 0.016 9 0 "[ . 1 . 2]" 1
1793 1 94 ARG HA 1 95 VAL QG . . 4.130 3.624 3.519 3.792 . 0 0 "[ . 1 . 2]" 1
1794 1 94 ARG HA 1 95 VAL MG2 . . 5.500 4.855 3.597 5.485 . 0 0 "[ . 1 . 2]" 1
1795 1 94 ARG QB 1 94 ARG QD . . 3.000 2.209 1.954 2.619 . 0 0 "[ . 1 . 2]" 1
1796 1 94 ARG QB 1 95 VAL H . . 4.190 3.804 3.613 3.952 . 0 0 "[ . 1 . 2]" 1
1797 1 94 ARG QB 1 95 VAL HA . . 4.970 4.515 4.308 4.718 . 0 0 "[ . 1 . 2]" 1
1798 1 94 ARG HD2 1 95 VAL H . . 5.500 4.897 3.558 5.502 0.002 9 0 "[ . 1 . 2]" 1
1799 1 94 ARG HD3 1 95 VAL H . . 5.500 4.887 2.700 5.510 0.010 6 0 "[ . 1 . 2]" 1
1800 1 94 ARG QG 1 95 VAL H . . 4.070 2.881 2.355 3.295 . 0 0 "[ . 1 . 2]" 1
1801 1 94 ARG HG2 1 95 VAL H . . 4.690 3.583 2.382 4.702 0.012 9 0 "[ . 1 . 2]" 1
1802 1 94 ARG HG3 1 95 VAL H . . 4.690 3.489 2.564 4.693 0.003 2 0 "[ . 1 . 2]" 1
1803 1 95 VAL H 1 95 VAL HB . . 3.440 3.040 2.579 3.407 . 0 0 "[ . 1 . 2]" 1
1804 1 95 VAL H 1 95 VAL QG . . 3.350 2.172 1.914 2.669 . 0 0 "[ . 1 . 2]" 1
1805 1 95 VAL HA 1 95 VAL MG1 . . 3.340 2.895 2.340 3.185 . 0 0 "[ . 1 . 2]" 1
1806 1 95 VAL HA 1 95 VAL QG . . 2.710 2.240 2.094 2.343 . 0 0 "[ . 1 . 2]" 1
1807 1 95 VAL HA 1 95 VAL MG2 . . 3.340 2.378 2.320 2.483 . 0 0 "[ . 1 . 2]" 1
1808 1 95 VAL HA 1 96 GLU H . . 3.010 2.146 2.141 2.160 . 0 0 "[ . 1 . 2]" 1
1809 1 95 VAL HB 1 96 GLU H . . 4.460 4.250 4.091 4.318 . 0 0 "[ . 1 . 2]" 1
1810 1 95 VAL QG 1 96 GLU H . . 3.730 2.779 2.555 2.975 . 0 0 "[ . 1 . 2]" 1
1811 1 95 VAL QG 1 96 GLU HA . . 4.140 3.504 3.291 3.755 . 0 0 "[ . 1 . 2]" 1
1812 1 95 VAL QG 1 96 GLU QG . . 5.280 4.586 3.961 5.147 . 0 0 "[ . 1 . 2]" 1
1813 1 95 VAL QG 1 97 LYS HA . . 5.160 4.466 4.231 4.798 . 0 0 "[ . 1 . 2]" 1
1814 1 95 VAL MG1 1 96 GLU HA . . 5.480 4.008 3.608 4.251 . 0 0 "[ . 1 . 2]" 1
1815 1 95 VAL MG2 1 96 GLU HA . . 5.480 4.302 3.464 5.542 0.062 13 0 "[ . 1 . 2]" 1
1816 1 96 GLU H 1 96 GLU QB . . 3.540 2.532 2.323 3.240 . 0 0 "[ . 1 . 2]" 1
1817 1 96 GLU H 1 96 GLU QG . . 3.930 3.513 2.341 3.974 0.044 6 0 "[ . 1 . 2]" 1
1818 1 96 GLU HA 1 96 GLU QG . . 3.120 2.585 2.059 3.378 0.258 14 0 "[ . 1 . 2]" 1
1819 1 96 GLU HA 1 97 LYS H . . 2.890 2.306 2.174 2.416 . 0 0 "[ . 1 . 2]" 1
1820 1 96 GLU HA 1 97 LYS HB2 . . 5.500 4.355 4.193 5.019 . 0 0 "[ . 1 . 2]" 1
1821 1 96 GLU HA 1 97 LYS HB3 . . 5.500 5.426 5.002 5.681 0.181 9 0 "[ . 1 . 2]" 1
1822 1 96 GLU QB 1 96 GLU QG . . 2.370 2.047 1.996 2.084 . 0 0 "[ . 1 . 2]" 1
1823 1 96 GLU QB 1 97 LYS H . . 4.210 3.052 2.371 3.641 . 0 0 "[ . 1 . 2]" 1
1824 1 96 GLU QG 1 97 LYS H . . 4.370 2.990 1.983 4.362 . 0 0 "[ . 1 . 2]" 1
1825 1 97 LYS H 1 97 LYS QB . . 3.590 2.201 2.041 2.680 . 0 0 "[ . 1 . 2]" 1
1826 1 97 LYS H 1 97 LYS QG . . 4.190 3.465 1.917 4.021 . 0 0 "[ . 1 . 2]" 1
1827 1 97 LYS HA 1 97 LYS QD . . 5.070 3.562 2.068 4.230 . 0 0 "[ . 1 . 2]" 1
1828 1 97 LYS HA 1 97 LYS HG2 . . 4.080 2.940 2.162 3.583 . 0 0 "[ . 1 . 2]" 1
1829 1 97 LYS HA 1 97 LYS HG3 . . 4.080 2.535 2.023 3.862 . 0 0 "[ . 1 . 2]" 1
1830 1 97 LYS HA 1 98 GLN H . . 2.930 2.216 2.140 2.408 . 0 0 "[ . 1 . 2]" 1
1831 1 97 LYS QB 1 97 LYS QD . . 3.260 2.144 2.017 2.569 . 0 0 "[ . 1 . 2]" 1
1832 1 97 LYS QB 1 98 GLN H . . 4.430 3.305 2.442 3.794 . 0 0 "[ . 1 . 2]" 1
1833 1 97 LYS QG 1 98 GLN H . . 4.460 3.243 2.576 4.429 . 0 0 "[ . 1 . 2]" 1
1834 1 98 GLN H 1 98 GLN HB3 . . 3.520 3.054 2.701 3.336 . 0 0 "[ . 1 . 2]" 1
1835 1 98 GLN H 1 98 GLN QG . . 3.660 2.101 1.916 2.445 . 0 0 "[ . 1 . 2]" 1
1836 1 98 GLN HA 1 98 GLN QG . . 3.580 3.354 3.317 3.444 . 0 0 "[ . 1 . 2]" 1
1837 1 98 GLN HB2 1 99 SER H . . 4.890 2.767 2.559 3.348 . 0 0 "[ . 1 . 2]" 1
1838 1 99 SER HA 1 99 SER QB . . 2.570 2.249 2.172 2.445 . 0 0 "[ . 1 . 2]" 1
1839 1 99 SER HA 1 100 LEU H . . 3.300 2.274 2.141 2.564 . 0 0 "[ . 1 . 2]" 1
1840 1 100 LEU H 1 100 LEU HG . . 4.610 3.545 1.958 4.581 . 0 0 "[ . 1 . 2]" 1
1841 1 100 LEU HA 1 100 LEU QD . . 3.770 2.621 1.934 3.406 . 0 0 "[ . 1 . 2]" 1
1842 1 100 LEU HA 1 101 VAL H . . 3.420 2.277 2.141 2.645 . 0 0 "[ . 1 . 2]" 1
1843 1 100 LEU HA 1 101 VAL HA . . 4.590 4.394 4.329 4.530 . 0 0 "[ . 1 . 2]" 1
1844 1 100 LEU QB 1 101 VAL H . . 4.380 3.104 2.034 3.957 . 0 0 "[ . 1 . 2]" 1
1845 1 100 LEU HG 1 101 VAL H . . 5.010 3.963 2.027 4.964 . 0 0 "[ . 1 . 2]" 1
1846 1 101 VAL H 1 101 VAL HB . . 4.140 2.860 2.529 3.819 . 0 0 "[ . 1 . 2]" 1
1847 1 101 VAL H 1 101 VAL MG1 . . 4.600 3.249 1.930 3.911 . 0 0 "[ . 1 . 2]" 1
1848 1 101 VAL H 1 101 VAL QG . . 3.970 2.348 1.878 2.836 . 0 0 "[ . 1 . 2]" 1
1849 1 101 VAL H 1 101 VAL MG2 . . 4.600 2.754 2.048 3.818 . 0 0 "[ . 1 . 2]" 1
1850 1 101 VAL HA 1 102 PHE H . . 3.240 2.205 2.140 2.357 . 0 0 "[ . 1 . 2]" 1
stop_
save_