Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
575166 | 2mmz RC | 19872 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2mmz
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 1913
_Distance_constraint_stats_list.Viol_count 6258
_Distance_constraint_stats_list.Viol_total 5979.970
_Distance_constraint_stats_list.Viol_max 1.397
_Distance_constraint_stats_list.Viol_rms 0.0318
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0078
_Distance_constraint_stats_list.Viol_average_violations_only 0.0478
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 3 PHE 0.233 0.046 18 0 "[ . 1 . 2]"
1 4 THR 1.181 0.225 14 0 "[ . 1 . 2]"
1 5 MET 2.966 0.225 14 0 "[ . 1 . 2]"
1 6 GLY 0.389 0.076 20 0 "[ . 1 . 2]"
1 7 ALA 0.104 0.070 4 0 "[ . 1 . 2]"
1 8 GLY 0.265 0.070 4 0 "[ . 1 . 2]"
1 9 GLY 0.188 0.045 16 0 "[ . 1 . 2]"
1 10 GLY 0.027 0.027 9 0 "[ . 1 . 2]"
1 11 GLY 1.069 0.078 18 0 "[ . 1 . 2]"
1 12 SER 2.457 0.081 5 0 "[ . 1 . 2]"
1 13 ALA 1.274 0.064 20 0 "[ . 1 . 2]"
1 14 GLU 10.508 0.830 17 11 "[* * * *1* ***+ -*]"
1 15 GLN 13.027 0.830 17 11 "[* * * *1* ***+ -*]"
1 16 LEU 3.874 0.089 13 0 "[ . 1 . 2]"
1 17 ASP 1.769 0.113 2 0 "[ . 1 . 2]"
1 18 ALA 3.052 0.113 5 0 "[ . 1 . 2]"
1 19 LEU 11.261 0.502 5 1 "[ + 1 . 2]"
1 20 VAL 3.944 0.115 4 0 "[ . 1 . 2]"
1 21 LYS 13.211 0.502 5 1 "[ + 1 . 2]"
1 22 LYS 5.448 0.163 19 0 "[ . 1 . 2]"
1 23 ASP 3.845 0.120 16 0 "[ . 1 . 2]"
1 24 LYS 9.247 0.134 20 0 "[ . 1 . 2]"
1 25 VAL 8.620 0.122 3 0 "[ . 1 . 2]"
1 26 VAL 2.742 0.112 5 0 "[ . 1 . 2]"
1 27 VAL 11.795 0.181 6 0 "[ . 1 . 2]"
1 28 PHE 10.329 0.228 17 0 "[ . 1 . 2]"
1 29 LEU 12.520 0.225 16 0 "[ . 1 . 2]"
1 30 LYS 9.646 0.838 12 6 "[ * * * *- + . 2]"
1 31 GLY 3.495 0.155 9 0 "[ . 1 . 2]"
1 32 THR 3.229 0.132 5 0 "[ . 1 . 2]"
1 33 PRO 0.654 0.053 4 0 "[ . 1 . 2]"
1 34 GLU 0.439 0.033 9 0 "[ . 1 . 2]"
1 35 GLN 2.987 0.089 4 0 "[ . 1 . 2]"
1 36 PRO 1.005 0.103 20 0 "[ . 1 . 2]"
1 37 GLN 11.519 0.838 12 6 "[ * * * *- + . 2]"
1 38 CYS 2.858 0.130 8 0 "[ . 1 . 2]"
1 39 GLY 0.423 0.053 13 0 "[ . 1 . 2]"
1 40 PHE 4.655 0.128 14 0 "[ . 1 . 2]"
1 41 SER 4.549 0.130 8 0 "[ . 1 . 2]"
1 42 ASN 4.407 0.159 17 0 "[ . 1 . 2]"
1 43 ALA 3.886 0.114 6 0 "[ . 1 . 2]"
1 44 VAL 7.802 0.140 10 0 "[ . 1 . 2]"
1 45 VAL 12.410 0.746 4 5 "[ +. * 1** -. 2]"
1 46 GLN 9.869 0.746 4 5 "[ +. * 1** -. 2]"
1 47 ILE 2.695 0.049 19 0 "[ . 1 . 2]"
1 48 LEU 1.044 0.038 15 0 "[ . 1 . 2]"
1 49 ARG 4.479 0.163 2 0 "[ . 1 . 2]"
1 50 LEU 3.048 0.056 5 0 "[ . 1 . 2]"
1 51 HIS 4.620 0.108 5 0 "[ . 1 . 2]"
1 52 GLY 0.740 0.074 14 0 "[ . 1 . 2]"
1 53 VAL 0.787 0.035 9 0 "[ . 1 . 2]"
1 54 ARG 6.746 0.118 19 0 "[ . 1 . 2]"
1 55 ASP 1.756 0.114 13 0 "[ . 1 . 2]"
1 56 TYR 18.944 0.229 9 0 "[ . 1 . 2]"
1 57 ALA 1.706 0.087 9 0 "[ . 1 . 2]"
1 58 ALA 7.253 0.229 9 0 "[ . 1 . 2]"
1 59 TYR 5.601 0.156 15 0 "[ . 1 . 2]"
1 60 ASN 1.302 0.061 3 0 "[ . 1 . 2]"
1 61 VAL 2.550 0.347 14 0 "[ . 1 . 2]"
1 62 LEU 2.798 0.424 9 0 "[ . 1 . 2]"
1 63 ASP 3.405 0.106 17 0 "[ . 1 . 2]"
1 64 ASP 2.633 0.110 15 0 "[ . 1 . 2]"
1 65 PRO 1.244 0.084 8 0 "[ . 1 . 2]"
1 66 GLU 6.237 0.162 8 0 "[ . 1 . 2]"
1 67 LEU 3.449 0.228 17 0 "[ . 1 . 2]"
1 68 ARG 2.987 0.424 9 0 "[ . 1 . 2]"
1 69 GLN 2.938 0.110 11 0 "[ . 1 . 2]"
1 70 GLY 1.692 0.081 13 0 "[ . 1 . 2]"
1 71 ILE 6.451 0.159 5 0 "[ . 1 . 2]"
1 72 LYS 0.526 0.046 6 0 "[ . 1 . 2]"
1 73 ASP 0.403 0.046 6 0 "[ . 1 . 2]"
1 74 TYR 2.342 0.093 3 0 "[ . 1 . 2]"
1 75 SER 0.105 0.025 16 0 "[ . 1 . 2]"
1 76 ASN 2.618 0.093 3 0 "[ . 1 . 2]"
1 77 TRP 3.003 0.114 20 0 "[ . 1 . 2]"
1 78 PRO 0.642 0.061 5 0 "[ . 1 . 2]"
1 79 THR 2.513 0.134 20 0 "[ . 1 . 2]"
1 80 ILE 5.295 1.397 20 2 "[ . 1 - . +]"
1 81 PRO 7.755 0.213 10 0 "[ . 1 . 2]"
1 82 GLN 4.227 1.397 20 2 "[ . 1 - . +]"
1 83 VAL 4.759 0.145 18 0 "[ . 1 . 2]"
1 84 TYR 4.879 0.286 2 0 "[ . 1 . 2]"
1 85 LEU 4.551 0.102 20 0 "[ . 1 . 2]"
1 86 ASN 6.791 0.134 20 0 "[ . 1 . 2]"
1 87 GLY 5.330 0.135 6 0 "[ . 1 . 2]"
1 88 GLU 5.534 0.124 19 0 "[ . 1 . 2]"
1 89 PHE 6.943 0.140 17 0 "[ . 1 . 2]"
1 90 VAL 8.631 0.286 2 0 "[ . 1 . 2]"
1 91 GLY 3.038 0.108 2 0 "[ . 1 . 2]"
1 92 GLY 0.333 0.042 7 0 "[ . 1 . 2]"
1 93 CYS 6.178 0.134 9 0 "[ . 1 . 2]"
1 94 ASP 1.039 0.095 10 0 "[ . 1 . 2]"
1 95 ILE 4.674 0.104 6 0 "[ . 1 . 2]"
1 96 LEU 1.182 0.057 10 0 "[ . 1 . 2]"
1 97 LEU 2.483 0.054 19 0 "[ . 1 . 2]"
1 98 GLN 3.738 0.090 6 0 "[ . 1 . 2]"
1 99 MET 3.760 0.067 5 0 "[ . 1 . 2]"
1 100 HIS 14.769 0.181 9 0 "[ . 1 . 2]"
1 101 GLN 9.752 0.181 9 0 "[ . 1 . 2]"
1 102 ASN 3.941 0.109 14 0 "[ . 1 . 2]"
1 103 GLY 2.047 0.070 16 0 "[ . 1 . 2]"
1 104 ASP 2.364 0.144 11 0 "[ . 1 . 2]"
1 105 LEU 5.322 0.144 11 0 "[ . 1 . 2]"
1 106 VAL 9.145 0.415 15 0 "[ . 1 . 2]"
1 107 GLU 4.129 0.498 15 0 "[ . 1 . 2]"
1 108 GLU 1.776 0.151 15 0 "[ . 1 . 2]"
1 109 LEU 1.016 0.063 5 0 "[ . 1 . 2]"
1 110 LYS 4.533 0.498 15 0 "[ . 1 . 2]"
1 111 LYS 1.554 0.194 14 0 "[ . 1 . 2]"
1 112 LEU 3.809 0.103 7 0 "[ . 1 . 2]"
1 113 GLY 0.141 0.017 4 0 "[ . 1 . 2]"
1 114 ILE 2.964 0.100 6 0 "[ . 1 . 2]"
1 115 HIS 3.940 1.000 20 1 "[ . 1 . +]"
1 116 SER 5.888 0.593 20 2 "[ . 1 . -+]"
1 117 ALA 3.124 0.192 4 0 "[ . 1 . 2]"
1 118 LEU 4.956 0.160 18 0 "[ . 1 . 2]"
1 119 LEU 12.725 1.000 20 2 "[ . 1 . -+]"
1 120 ASP 1.833 0.088 11 0 "[ . 1 . 2]"
1 121 GLU 2.781 0.107 12 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 117 ALA H 1 119 LEU HB2 . . 5.100 5.241 5.154 5.292 0.192 4 0 "[ . 1 . 2]" 1
2 1 116 SER HB3 1 117 ALA H . . 5.360 4.458 4.264 4.584 . 0 0 "[ . 1 . 2]" 1
3 1 51 HIS HB2 1 117 ALA H . . 5.190 5.080 4.843 5.206 0.016 2 0 "[ . 1 . 2]" 1
4 1 77 TRP HE1 1 79 THR H . . 5.240 5.061 4.656 5.268 0.028 2 0 "[ . 1 . 2]" 1
5 1 84 TYR H 1 84 TYR QE . . 4.680 4.709 4.597 4.768 0.088 12 0 "[ . 1 . 2]" 1
6 1 28 PHE H 1 84 TYR H . . 5.320 5.287 5.068 5.345 0.025 11 0 "[ . 1 . 2]" 1
7 1 114 ILE HB 1 115 HIS H . . 4.980 4.028 3.873 4.119 . 0 0 "[ . 1 . 2]" 1
8 1 114 ILE HG13 1 115 HIS H . . 4.930 4.933 4.844 4.965 0.035 11 0 "[ . 1 . 2]" 1
9 1 114 ILE MG 1 115 HIS H . . 4.190 2.295 2.147 2.418 . 0 0 "[ . 1 . 2]" 1
10 1 26 VAL H 1 84 TYR HB3 . . 5.280 4.850 4.449 5.125 . 0 0 "[ . 1 . 2]" 1
11 1 26 VAL H 1 26 VAL HB . . 3.730 3.149 2.864 3.720 . 0 0 "[ . 1 . 2]" 1
12 1 26 VAL H 1 83 VAL MG2 . . 3.780 3.151 2.886 3.501 . 0 0 "[ . 1 . 2]" 1
13 1 89 PHE HB3 1 90 VAL H . . 4.970 3.775 3.388 3.933 . 0 0 "[ . 1 . 2]" 1
14 1 90 VAL H 1 90 VAL MG1 . . 3.730 3.330 3.110 3.461 . 0 0 "[ . 1 . 2]" 1
15 1 54 ARG H 1 54 ARG HB3 . . 3.540 3.367 3.100 3.654 0.114 8 0 "[ . 1 . 2]" 1
16 1 54 ARG H 1 56 TYR QD . . 5.390 4.603 4.365 4.775 . 0 0 "[ . 1 . 2]" 1
17 1 54 ARG H 1 55 ASP HA . . 5.440 4.361 4.049 4.618 . 0 0 "[ . 1 . 2]" 1
18 1 54 ARG H 1 55 ASP HB2 . . 4.490 3.950 3.296 4.604 0.114 13 0 "[ . 1 . 2]" 1
19 1 53 VAL MG1 1 54 ARG H . . 3.780 2.855 2.535 3.094 . 0 0 "[ . 1 . 2]" 1
20 1 119 LEU HA 1 121 GLU H . . 4.230 3.999 3.306 4.294 0.064 17 0 "[ . 1 . 2]" 1
21 1 121 GLU H 1 121 GLU HB2 . . 4.010 2.702 2.129 4.015 0.005 16 0 "[ . 1 . 2]" 1
22 1 120 ASP H 1 121 GLU H . . 3.220 2.718 2.365 3.060 . 0 0 "[ . 1 . 2]" 1
23 1 121 GLU H 1 121 GLU QG . . 3.840 3.471 2.384 3.947 0.107 12 0 "[ . 1 . 2]" 1
24 1 121 GLU H 1 121 GLU HB3 . . 3.460 2.857 2.311 3.565 0.105 10 0 "[ . 1 . 2]" 1
25 1 86 ASN H 1 112 LEU MD1 . . 4.080 3.345 2.710 4.091 0.011 17 0 "[ . 1 . 2]" 1
26 1 85 LEU H 1 86 ASN H . . 5.050 4.375 4.274 4.467 . 0 0 "[ . 1 . 2]" 1
27 1 13 ALA H 1 15 GLN H . . 5.270 4.294 4.110 4.409 . 0 0 "[ . 1 . 2]" 1
28 1 57 ALA H 1 58 ALA H . . 4.510 4.235 4.128 4.354 . 0 0 "[ . 1 . 2]" 1
29 1 26 VAL HA 1 57 ALA H . . 3.860 2.654 2.317 2.888 . 0 0 "[ . 1 . 2]" 1
30 1 56 TYR HB2 1 57 ALA H . . 3.880 2.331 2.209 2.407 . 0 0 "[ . 1 . 2]" 1
31 1 25 VAL HB 1 57 ALA H . . 3.990 3.660 3.566 3.747 . 0 0 "[ . 1 . 2]" 1
32 1 26 VAL QG 1 57 ALA H . . 4.550 3.331 3.022 3.591 . 0 0 "[ . 1 . 2]" 1
33 1 13 ALA H 1 14 GLU QG . . 5.370 4.326 3.789 4.962 . 0 0 "[ . 1 . 2]" 1
34 1 13 ALA H 1 14 GLU H . . 3.510 2.939 2.822 3.087 . 0 0 "[ . 1 . 2]" 1
35 1 13 ALA H 1 15 GLN QB . . 5.130 5.121 4.939 5.193 0.063 9 0 "[ . 1 . 2]" 1
36 1 13 ALA H 1 16 LEU MD2 . . 5.500 4.730 4.587 4.833 . 0 0 "[ . 1 . 2]" 1
37 1 58 ALA H 1 59 TYR H . . 4.550 4.280 4.143 4.402 . 0 0 "[ . 1 . 2]" 1
38 1 69 GLN HA 1 72 LYS H . . 5.370 3.456 3.264 3.738 . 0 0 "[ . 1 . 2]" 1
39 1 89 PHE H 1 90 VAL H . . 4.570 4.438 4.368 4.477 . 0 0 "[ . 1 . 2]" 1
40 1 88 GLU HB2 1 89 PHE H . . 3.800 3.886 3.855 3.924 0.124 19 0 "[ . 1 . 2]" 1
41 1 57 ALA MB 1 58 ALA H . . 3.710 3.401 3.239 3.511 . 0 0 "[ . 1 . 2]" 1
42 1 64 ASP H 1 67 LEU H . . 5.500 4.528 4.099 5.076 . 0 0 "[ . 1 . 2]" 1
43 1 6 GLY QA 1 7 ALA H . . 3.250 2.316 2.069 2.973 . 0 0 "[ . 1 . 2]" 1
44 1 7 ALA H 1 7 ALA MB . . 3.660 2.461 2.165 2.815 . 0 0 "[ . 1 . 2]" 1
45 1 66 GLU HB2 1 67 LEU H . . 3.840 2.488 2.237 2.693 . 0 0 "[ . 1 . 2]" 1
46 1 67 LEU H 1 67 LEU QD . . 4.440 3.425 3.294 3.738 . 0 0 "[ . 1 . 2]" 1
47 1 49 ARG QD 1 50 LEU H . . 5.020 4.406 4.214 4.578 . 0 0 "[ . 1 . 2]" 1
48 1 102 ASN HB2 1 104 ASP H . . 4.930 4.832 4.544 4.961 0.031 8 0 "[ . 1 . 2]" 1
49 1 4 THR HB 1 5 MET H . . 4.220 2.583 2.018 4.114 . 0 0 "[ . 1 . 2]" 1
50 1 4 THR MG 1 5 MET H . . 5.360 3.689 3.385 4.293 . 0 0 "[ . 1 . 2]" 1
51 1 79 THR HB 1 80 ILE H . . 4.290 4.242 3.835 4.367 0.077 13 0 "[ . 1 . 2]" 1
52 1 80 ILE H 1 80 ILE HG12 . . 4.580 3.693 2.420 4.449 . 0 0 "[ . 1 . 2]" 1
53 1 79 THR MG 1 80 ILE H . . 4.120 3.593 2.480 4.187 0.067 12 0 "[ . 1 . 2]" 1
54 1 49 ARG H 1 50 LEU H . . 3.430 3.007 2.904 3.101 . 0 0 "[ . 1 . 2]" 1
55 1 50 LEU H 1 50 LEU HB2 . . 2.960 2.265 2.237 2.305 . 0 0 "[ . 1 . 2]" 1
56 1 49 ARG HG2 1 50 LEU H . . 3.250 2.653 2.427 2.952 . 0 0 "[ . 1 . 2]" 1
57 1 49 ARG HG3 1 50 LEU H . . 4.330 2.935 2.675 3.147 . 0 0 "[ . 1 . 2]" 1
58 1 50 LEU H 1 50 LEU HB3 . . 3.460 3.505 3.494 3.516 0.056 5 0 "[ . 1 . 2]" 1
59 1 50 LEU H 1 50 LEU MD2 . . 3.770 3.741 3.641 3.780 0.010 1 0 "[ . 1 . 2]" 1
60 1 104 ASP H 1 104 ASP HB2 . . 3.060 2.166 2.004 2.298 . 0 0 "[ . 1 . 2]" 1
61 1 99 MET HB3 1 104 ASP H . . 5.080 3.723 3.593 3.846 . 0 0 "[ . 1 . 2]" 1
62 1 99 MET ME 1 104 ASP H . . 5.170 4.116 4.036 4.210 . 0 0 "[ . 1 . 2]" 1
63 1 104 ASP H 1 105 LEU HG . . 5.280 4.071 3.885 4.252 . 0 0 "[ . 1 . 2]" 1
64 1 5 MET H 1 5 MET HG2 . . 4.440 3.256 1.872 4.462 0.022 10 0 "[ . 1 . 2]" 1
65 1 27 VAL HB 1 28 PHE H . . 3.990 3.891 3.749 4.022 0.032 13 0 "[ . 1 . 2]" 1
66 1 28 PHE H 1 29 LEU QD . . 3.980 3.623 3.354 3.721 . 0 0 "[ . 1 . 2]" 1
67 1 28 PHE H 1 83 VAL HA . . 4.720 3.599 3.451 3.737 . 0 0 "[ . 1 . 2]" 1
68 1 60 ASN H 1 61 VAL MG1 . . 5.280 4.699 4.469 4.947 . 0 0 "[ . 1 . 2]" 1
69 1 59 TYR H 1 60 ASN H . . 5.290 4.434 4.366 4.534 . 0 0 "[ . 1 . 2]" 1
70 1 59 TYR QD 1 60 ASN H . . 4.470 4.344 3.860 4.523 0.053 6 0 "[ . 1 . 2]" 1
71 1 60 ASN H 1 60 ASN HB2 . . 3.530 2.345 2.236 2.475 . 0 0 "[ . 1 . 2]" 1
72 1 60 ASN H 1 60 ASN HB3 . . 3.690 2.506 2.217 3.590 . 0 0 "[ . 1 . 2]" 1
73 1 59 TYR HB3 1 60 ASN H . . 4.950 3.649 3.171 3.884 . 0 0 "[ . 1 . 2]" 1
74 1 99 MET HG2 1 100 HIS H . . 5.080 5.029 4.978 5.079 . 0 0 "[ . 1 . 2]" 1
75 1 98 GLN H 1 100 HIS H . . 4.650 4.018 3.892 4.264 . 0 0 "[ . 1 . 2]" 1
76 1 100 HIS H 1 105 LEU HG . . 4.800 3.458 3.364 3.535 . 0 0 "[ . 1 . 2]" 1
77 1 96 LEU H 1 99 MET H . . 5.180 4.871 4.802 4.992 . 0 0 "[ . 1 . 2]" 1
78 1 94 ASP HA 1 96 LEU H . . 5.170 4.691 4.531 4.814 . 0 0 "[ . 1 . 2]" 1
79 1 94 ASP QB 1 96 LEU H . . 5.160 4.932 4.789 5.007 . 0 0 "[ . 1 . 2]" 1
80 1 120 ASP H 1 120 ASP HB3 . . 3.320 2.709 2.511 3.257 . 0 0 "[ . 1 . 2]" 1
81 1 119 LEU HB2 1 120 ASP H . . 3.460 3.176 2.751 3.509 0.049 11 0 "[ . 1 . 2]" 1
82 1 96 LEU H 1 96 LEU HB3 . . 3.340 2.851 2.654 3.214 . 0 0 "[ . 1 . 2]" 1
83 1 95 ILE MG 1 96 LEU H . . 3.640 3.335 3.184 3.455 . 0 0 "[ . 1 . 2]" 1
84 1 115 HIS HB3 1 116 SER H . . 4.860 4.424 4.334 4.553 . 0 0 "[ . 1 . 2]" 1
85 1 114 ILE MG 1 116 SER H . . 3.990 3.862 3.538 3.999 0.009 5 0 "[ . 1 . 2]" 1
86 1 16 LEU H 1 16 LEU MD2 . . 3.490 2.064 1.967 2.241 . 0 0 "[ . 1 . 2]" 1
87 1 15 GLN QB 1 16 LEU H . . 3.190 2.378 2.255 2.550 . 0 0 "[ . 1 . 2]" 1
88 1 114 ILE H 1 114 ILE HG13 . . 4.080 2.389 2.278 2.455 . 0 0 "[ . 1 . 2]" 1
89 1 112 LEU H 1 114 ILE H . . 4.410 3.468 3.229 3.769 . 0 0 "[ . 1 . 2]" 1
90 1 114 ILE H 1 114 ILE MD . . 3.750 3.690 3.598 3.755 0.005 11 0 "[ . 1 . 2]" 1
91 1 109 LEU MD2 1 114 ILE H . . 5.230 4.380 4.142 4.562 . 0 0 "[ . 1 . 2]" 1
92 1 28 PHE QD 1 59 TYR H . . 5.500 4.699 4.577 4.820 . 0 0 "[ . 1 . 2]" 1
93 1 27 VAL H 1 59 TYR H . . 4.000 3.476 3.241 3.645 . 0 0 "[ . 1 . 2]" 1
94 1 116 SER H 1 116 SER HB2 . . 4.010 2.840 2.685 2.954 . 0 0 "[ . 1 . 2]" 1
95 1 115 HIS HB2 1 116 SER H . . 4.540 4.578 4.566 4.604 0.064 16 0 "[ . 1 . 2]" 1
96 1 82 GLN HB3 1 83 VAL H . . 4.500 2.890 2.359 3.782 . 0 0 "[ . 1 . 2]" 1
97 1 83 VAL H 1 83 VAL MG1 . . 3.730 2.464 2.328 2.559 . 0 0 "[ . 1 . 2]" 1
98 1 83 VAL H 1 91 GLY H . . 4.110 3.261 2.996 3.933 . 0 0 "[ . 1 . 2]" 1
99 1 83 VAL H 1 90 VAL HB . . 4.820 4.909 4.874 4.965 0.145 18 0 "[ . 1 . 2]" 1
100 1 59 TYR H 1 59 TYR HB3 . . 3.890 3.555 3.529 3.587 . 0 0 "[ . 1 . 2]" 1
101 1 29 LEU HG 1 59 TYR H . . 4.820 4.722 4.482 4.845 0.025 3 0 "[ . 1 . 2]" 1
102 1 110 LYS H 1 110 LYS HE3 . . 4.580 4.235 3.737 4.608 0.028 11 0 "[ . 1 . 2]" 1
103 1 110 LYS H 1 111 LYS H . . 3.320 2.866 2.688 3.046 . 0 0 "[ . 1 . 2]" 1
104 1 107 GLU HA 1 110 LYS H . . 3.790 3.334 3.134 3.797 0.007 15 0 "[ . 1 . 2]" 1
105 1 110 LYS H 1 110 LYS QB . . 2.830 2.329 1.890 2.481 . 0 0 "[ . 1 . 2]" 1
106 1 110 LYS H 1 110 LYS QD . . 4.650 3.625 2.546 4.427 . 0 0 "[ . 1 . 2]" 1
107 1 29 LEU H 1 59 TYR HB3 . . 5.140 4.537 4.245 4.670 . 0 0 "[ . 1 . 2]" 1
108 1 29 LEU H 1 29 LEU QD . . 4.110 2.466 2.275 2.775 . 0 0 "[ . 1 . 2]" 1
109 1 75 SER HB3 1 77 TRP H . . 4.500 4.054 3.124 4.525 0.025 16 0 "[ . 1 . 2]" 1
110 1 94 ASP QB 1 95 ILE H . . 4.160 2.845 2.629 3.053 . 0 0 "[ . 1 . 2]" 1
111 1 28 PHE QD 1 29 LEU H . . 4.930 4.393 4.256 4.510 . 0 0 "[ . 1 . 2]" 1
112 1 29 LEU H 1 29 LEU HB3 . . 3.870 3.750 3.623 3.882 0.012 19 0 "[ . 1 . 2]" 1
113 1 73 ASP HB2 1 74 TYR H . . 4.270 3.811 3.636 3.958 . 0 0 "[ . 1 . 2]" 1
114 1 51 HIS HB3 1 53 VAL H . . 4.640 4.078 3.825 4.483 . 0 0 "[ . 1 . 2]" 1
115 1 53 VAL H 1 53 VAL MG2 . . 3.230 2.465 2.291 2.684 . 0 0 "[ . 1 . 2]" 1
116 1 77 TRP H 1 79 THR H . . 5.500 5.528 5.400 5.585 0.085 13 0 "[ . 1 . 2]" 1
117 1 119 LEU H 1 120 ASP HB2 . . 5.050 4.949 4.336 5.104 0.054 10 0 "[ . 1 . 2]" 1
118 1 16 LEU MD1 1 74 TYR H . . 4.640 4.260 3.994 4.525 . 0 0 "[ . 1 . 2]" 1
119 1 40 PHE HA 1 43 ALA H . . 4.740 3.274 2.477 3.813 . 0 0 "[ . 1 . 2]" 1
120 1 43 ALA H 1 43 ALA MB . . 3.300 2.236 2.195 2.266 . 0 0 "[ . 1 . 2]" 1
121 1 95 ILE HA 1 98 GLN H . . 3.720 3.361 3.245 3.521 . 0 0 "[ . 1 . 2]" 1
122 1 98 GLN H 1 99 MET HA . . 5.500 5.126 5.030 5.439 . 0 0 "[ . 1 . 2]" 1
123 1 98 GLN H 1 98 GLN HG2 . . 4.070 2.165 2.055 2.247 . 0 0 "[ . 1 . 2]" 1
124 1 118 LEU H 1 119 LEU H . . 3.280 2.566 2.366 2.758 . 0 0 "[ . 1 . 2]" 1
125 1 119 LEU H 1 121 GLU H . . 4.650 4.519 4.293 4.694 0.044 5 0 "[ . 1 . 2]" 1
126 1 116 SER HB3 1 119 LEU H . . 4.630 3.816 3.248 4.091 . 0 0 "[ . 1 . 2]" 1
127 1 119 LEU H 1 119 LEU MD1 . . 4.320 3.019 2.313 4.261 . 0 0 "[ . 1 . 2]" 1
128 1 37 GLN H 1 41 SER HB3 . . 4.110 3.742 2.365 4.162 0.052 9 0 "[ . 1 . 2]" 1
129 1 37 GLN H 1 37 GLN QG . . 4.100 2.562 1.797 3.685 . 0 0 "[ . 1 . 2]" 1
130 1 24 LYS H 1 24 LYS QE . . 4.890 3.165 2.250 4.064 . 0 0 "[ . 1 . 2]" 1
131 1 42 ASN HB2 1 43 ALA H . . 3.720 3.789 3.744 3.834 0.114 6 0 "[ . 1 . 2]" 1
132 1 98 GLN H 1 99 MET H . . 3.520 2.497 2.399 2.835 . 0 0 "[ . 1 . 2]" 1
133 1 97 LEU QB 1 98 GLN H . . 3.610 2.973 2.520 3.157 . 0 0 "[ . 1 . 2]" 1
134 1 111 LYS H 1 112 LEU H . . 3.450 2.780 2.701 2.859 . 0 0 "[ . 1 . 2]" 1
135 1 111 LYS H 1 111 LYS HE2 . . 4.800 4.756 4.124 4.860 0.060 7 0 "[ . 1 . 2]" 1
136 1 109 LEU H 1 111 LYS H . . 4.420 4.295 4.101 4.427 0.007 12 0 "[ . 1 . 2]" 1
137 1 111 LYS H 1 111 LYS QB . . 2.670 2.443 2.274 2.622 . 0 0 "[ . 1 . 2]" 1
138 1 111 LYS H 1 111 LYS HG3 . . 3.650 2.316 1.961 3.220 . 0 0 "[ . 1 . 2]" 1
139 1 24 LYS H 1 112 LEU MD1 . . 5.500 5.249 4.882 5.518 0.018 4 0 "[ . 1 . 2]" 1
140 1 106 VAL H 1 108 GLU H . . 4.300 3.800 3.500 4.004 . 0 0 "[ . 1 . 2]" 1
141 1 106 VAL HA 1 108 GLU H . . 4.890 4.431 4.072 4.648 . 0 0 "[ . 1 . 2]" 1
142 1 108 GLU H 1 108 GLU HB3 . . 3.670 2.979 2.698 3.590 . 0 0 "[ . 1 . 2]" 1
143 1 104 ASP HA 1 108 GLU H . . 4.860 4.332 3.961 4.685 . 0 0 "[ . 1 . 2]" 1
144 1 15 GLN H 1 15 GLN QB . . 2.810 2.193 2.121 2.287 . 0 0 "[ . 1 . 2]" 1
145 1 15 GLN H 1 16 LEU MD2 . . 4.750 3.713 3.580 3.871 . 0 0 "[ . 1 . 2]" 1
146 1 61 VAL H 1 62 LEU H . . 3.670 2.816 2.567 2.938 . 0 0 "[ . 1 . 2]" 1
147 1 60 ASN HA 1 62 LEU H . . 4.090 3.512 3.240 3.639 . 0 0 "[ . 1 . 2]" 1
148 1 88 GLU H 1 90 VAL MG1 . . 5.500 5.344 4.628 5.546 0.046 2 0 "[ . 1 . 2]" 1
149 1 22 LYS H 1 23 ASP HA . . 5.350 5.289 5.203 5.380 0.030 13 0 "[ . 1 . 2]" 1
150 1 22 LYS H 1 22 LYS QE . . 4.830 4.444 4.167 4.633 . 0 0 "[ . 1 . 2]" 1
151 1 22 LYS H 1 23 ASP HB2 . . 5.080 5.092 4.889 5.178 0.098 8 0 "[ . 1 . 2]" 1
152 1 22 LYS H 1 22 LYS HB2 . . 3.160 2.179 2.016 2.324 . 0 0 "[ . 1 . 2]" 1
153 1 22 LYS H 1 22 LYS QD . . 3.630 2.976 2.355 3.696 0.066 1 0 "[ . 1 . 2]" 1
154 1 20 VAL H 1 22 LYS H . . 4.460 4.328 4.109 4.464 0.004 17 0 "[ . 1 . 2]" 1
155 1 46 GLN H 1 47 ILE H . . 3.650 2.843 2.771 2.919 . 0 0 "[ . 1 . 2]" 1
156 1 45 VAL H 1 46 GLN H . . 3.430 2.596 2.497 2.724 . 0 0 "[ . 1 . 2]" 1
157 1 45 VAL MG1 1 46 GLN H . . 3.820 3.479 3.179 3.677 . 0 0 "[ . 1 . 2]" 1
158 1 30 LYS HA 1 62 LEU H . . 4.060 3.071 2.877 3.444 . 0 0 "[ . 1 . 2]" 1
159 1 60 ASN HB2 1 62 LEU H . . 5.500 4.781 4.242 5.527 0.027 9 0 "[ . 1 . 2]" 1
160 1 62 LEU H 1 63 ASP HB2 . . 5.500 4.289 3.847 4.852 . 0 0 "[ . 1 . 2]" 1
161 1 62 LEU H 1 62 LEU HB2 . . 3.500 2.479 2.308 3.474 . 0 0 "[ . 1 . 2]" 1
162 1 62 LEU H 1 62 LEU HG . . 3.260 2.599 2.362 3.141 . 0 0 "[ . 1 . 2]" 1
163 1 61 VAL MG1 1 62 LEU H . . 4.890 4.266 3.857 4.350 . 0 0 "[ . 1 . 2]" 1
164 1 61 VAL MG2 1 62 LEU H . . 3.510 3.314 2.432 3.542 0.032 13 0 "[ . 1 . 2]" 1
165 1 31 GLY H 1 62 LEU H . . 4.170 3.871 3.587 4.008 . 0 0 "[ . 1 . 2]" 1
166 1 48 LEU H 1 49 ARG H . . 3.350 3.147 3.073 3.225 . 0 0 "[ . 1 . 2]" 1
167 1 45 VAL HA 1 49 ARG H . . 4.240 3.748 3.529 3.929 . 0 0 "[ . 1 . 2]" 1
168 1 49 ARG H 1 49 ARG QD . . 4.570 3.969 3.484 4.559 . 0 0 "[ . 1 . 2]" 1
169 1 104 ASP HB2 1 105 LEU H . . 3.730 3.704 3.482 3.874 0.144 11 0 "[ . 1 . 2]" 1
170 1 48 LEU HB3 1 49 ARG H . . 4.120 3.200 3.095 3.337 . 0 0 "[ . 1 . 2]" 1
171 1 105 LEU H 1 105 LEU MD2 . . 4.420 3.376 3.293 3.435 . 0 0 "[ . 1 . 2]" 1
172 1 73 ASP H 1 74 TYR H . . 3.740 2.784 2.625 2.913 . 0 0 "[ . 1 . 2]" 1
173 1 72 LYS H 1 73 ASP H . . 3.490 2.796 2.703 2.919 . 0 0 "[ . 1 . 2]" 1
174 1 73 ASP H 1 73 ASP HB2 . . 3.060 2.517 2.356 2.682 . 0 0 "[ . 1 . 2]" 1
175 1 72 LYS HB2 1 73 ASP H . . 3.560 2.797 2.595 2.938 . 0 0 "[ . 1 . 2]" 1
176 1 84 TYR HA 1 88 GLU H . . 4.580 4.421 4.016 4.619 0.039 20 0 "[ . 1 . 2]" 1
177 1 86 ASN HA 1 88 GLU H . . 4.910 4.524 4.354 4.683 . 0 0 "[ . 1 . 2]" 1
178 1 85 LEU H 1 88 GLU H . . 3.720 3.123 2.953 3.350 . 0 0 "[ . 1 . 2]" 1
179 1 106 VAL MG2 1 107 GLU H . . 4.130 3.640 3.549 3.760 . 0 0 "[ . 1 . 2]" 1
180 1 95 ILE H 1 97 LEU H . . 5.500 3.870 3.686 4.123 . 0 0 "[ . 1 . 2]" 1
181 1 41 SER H 1 42 ASN H . . 4.170 2.750 2.475 3.076 . 0 0 "[ . 1 . 2]" 1
182 1 64 ASP HA 1 66 GLU H . . 4.330 3.648 3.329 4.003 . 0 0 "[ . 1 . 2]" 1
183 1 66 GLU H 1 67 LEU H . . 3.160 2.714 2.564 2.799 . 0 0 "[ . 1 . 2]" 1
184 1 65 PRO HG2 1 66 GLU H . . 3.060 2.506 2.309 2.637 . 0 0 "[ . 1 . 2]" 1
185 1 55 ASP H 1 56 TYR HA . . 5.370 5.137 4.860 5.384 0.014 11 0 "[ . 1 . 2]" 1
186 1 53 VAL HA 1 55 ASP H . . 4.160 3.280 2.935 3.529 . 0 0 "[ . 1 . 2]" 1
187 1 54 ARG QD 1 55 ASP H . . 5.500 3.668 2.326 5.020 . 0 0 "[ . 1 . 2]" 1
188 1 55 ASP H 1 55 ASP HB2 . . 3.340 2.680 2.314 3.413 0.073 19 0 "[ . 1 . 2]" 1
189 1 48 LEU MD1 1 49 ARG H . . 4.870 4.436 4.339 4.512 . 0 0 "[ . 1 . 2]" 1
190 1 107 GLU H 1 108 GLU H . . 3.300 2.539 2.424 2.690 . 0 0 "[ . 1 . 2]" 1
191 1 105 LEU H 1 107 GLU H . . 5.250 4.077 3.813 4.301 . 0 0 "[ . 1 . 2]" 1
192 1 107 GLU H 1 107 GLU QG . . 3.240 2.144 1.873 3.284 0.044 15 0 "[ . 1 . 2]" 1
193 1 106 VAL HB 1 107 GLU H . . 2.780 2.637 2.459 2.785 0.005 16 0 "[ . 1 . 2]" 1
194 1 96 LEU H 1 97 LEU H . . 3.290 2.822 2.768 2.914 . 0 0 "[ . 1 . 2]" 1
195 1 97 LEU H 1 97 LEU QB . . 2.930 2.095 2.047 2.170 . 0 0 "[ . 1 . 2]" 1
196 1 97 LEU H 1 97 LEU MD1 . . 4.770 4.358 4.278 4.409 . 0 0 "[ . 1 . 2]" 1
197 1 95 ILE MG 1 97 LEU H . . 4.810 4.836 4.823 4.850 0.040 18 0 "[ . 1 . 2]" 1
198 1 64 ASP HB2 1 68 ARG H . . 4.370 4.295 4.129 4.406 0.036 19 0 "[ . 1 . 2]" 1
199 1 15 GLN QB 1 17 ASP H . . 4.610 4.646 4.616 4.671 0.061 7 0 "[ . 1 . 2]" 1
200 1 17 ASP H 1 20 VAL MG2 . . 5.310 4.231 4.080 4.437 . 0 0 "[ . 1 . 2]" 1
201 1 16 LEU HB3 1 17 ASP H . . 3.670 3.488 3.361 3.621 . 0 0 "[ . 1 . 2]" 1
202 1 45 VAL H 1 45 VAL MG2 . . 3.320 2.388 2.272 2.552 . 0 0 "[ . 1 . 2]" 1
203 1 59 TYR HA 1 61 VAL H . . 5.330 5.318 4.965 5.371 0.041 2 0 "[ . 1 . 2]" 1
204 1 60 ASN HB3 1 61 VAL H . . 4.700 4.422 4.058 4.605 . 0 0 "[ . 1 . 2]" 1
205 1 84 TYR HB3 1 85 LEU H . . 4.130 3.174 2.918 3.449 . 0 0 "[ . 1 . 2]" 1
206 1 85 LEU H 1 90 VAL MG1 . . 3.590 2.854 2.669 3.073 . 0 0 "[ . 1 . 2]" 1
207 1 85 LEU H 1 85 LEU MD1 . . 4.790 3.250 3.103 3.432 . 0 0 "[ . 1 . 2]" 1
208 1 30 LYS H 1 31 GLY HA3 . . 4.880 4.547 4.071 4.824 . 0 0 "[ . 1 . 2]" 1
209 1 23 ASP HA 1 25 VAL H . . 4.230 4.159 4.031 4.249 0.019 4 0 "[ . 1 . 2]" 1
210 1 24 LYS HB3 1 25 VAL H . . 4.350 4.372 4.132 4.460 0.110 18 0 "[ . 1 . 2]" 1
211 1 67 LEU QB 1 68 ARG H . . 4.140 2.519 2.387 2.601 . 0 0 "[ . 1 . 2]" 1
212 1 68 ARG H 1 70 GLY H . . 4.120 4.141 4.065 4.161 0.041 19 0 "[ . 1 . 2]" 1
213 1 67 LEU H 1 68 ARG H . . 3.300 2.491 2.403 2.569 . 0 0 "[ . 1 . 2]" 1
214 1 68 ARG H 1 68 ARG HB3 . . 3.260 2.734 2.546 2.911 . 0 0 "[ . 1 . 2]" 1
215 1 67 LEU QD 1 68 ARG H . . 5.060 4.087 3.735 4.164 . 0 0 "[ . 1 . 2]" 1
216 1 17 ASP H 1 19 LEU H . . 5.120 3.938 3.834 4.026 . 0 0 "[ . 1 . 2]" 1
217 1 16 LEU HB2 1 17 ASP H . . 3.840 2.811 2.684 2.923 . 0 0 "[ . 1 . 2]" 1
218 1 75 SER H 1 76 ASN H . . 3.480 2.490 2.357 2.623 . 0 0 "[ . 1 . 2]" 1
219 1 76 ASN H 1 76 ASN HB2 . . 3.950 2.876 2.768 2.979 . 0 0 "[ . 1 . 2]" 1
220 1 76 ASN H 1 76 ASN HB3 . . 3.800 3.745 3.632 3.872 0.072 19 0 "[ . 1 . 2]" 1
221 1 46 GLN H 1 48 LEU H . . 4.850 4.286 4.230 4.372 . 0 0 "[ . 1 . 2]" 1
222 1 48 LEU H 1 48 LEU MD1 . . 3.980 3.426 3.339 3.524 . 0 0 "[ . 1 . 2]" 1
223 1 32 THR HA 1 35 GLN H . . 5.010 4.855 4.451 5.057 0.047 5 0 "[ . 1 . 2]" 1
224 1 34 GLU H 1 35 GLN H . . 3.180 2.558 2.382 2.785 . 0 0 "[ . 1 . 2]" 1
225 1 35 GLN H 1 35 GLN QG . . 3.920 3.282 2.921 3.901 . 0 0 "[ . 1 . 2]" 1
226 1 35 GLN H 1 35 GLN HB2 . . 3.100 2.532 2.380 2.646 . 0 0 "[ . 1 . 2]" 1
227 1 32 THR MG 1 35 GLN H . . 4.640 4.428 3.919 4.690 0.050 19 0 "[ . 1 . 2]" 1
228 1 19 LEU H 1 20 VAL H . . 3.350 2.805 2.671 2.918 . 0 0 "[ . 1 . 2]" 1
229 1 18 ALA H 1 19 LEU H . . 3.370 2.296 2.163 2.532 . 0 0 "[ . 1 . 2]" 1
230 1 42 ASN HA 1 45 VAL H . . 4.550 3.224 3.113 3.360 . 0 0 "[ . 1 . 2]" 1
231 1 18 ALA MB 1 19 LEU H . . 3.330 2.756 2.616 2.907 . 0 0 "[ . 1 . 2]" 1
232 1 96 LEU HA 1 99 MET H . . 4.720 3.428 3.275 3.596 . 0 0 "[ . 1 . 2]" 1
233 1 98 GLN QB 1 99 MET H . . 3.450 2.188 2.104 2.316 . 0 0 "[ . 1 . 2]" 1
234 1 95 ILE MG 1 99 MET H . . 4.630 3.690 3.591 3.861 . 0 0 "[ . 1 . 2]" 1
235 1 116 SER HB3 1 118 LEU H . . 5.010 4.060 3.830 4.330 . 0 0 "[ . 1 . 2]" 1
236 1 29 LEU H 1 30 LYS H . . 4.990 4.453 4.411 4.493 . 0 0 "[ . 1 . 2]" 1
237 1 24 LYS QE 1 25 VAL H . . 5.430 4.533 4.126 5.199 . 0 0 "[ . 1 . 2]" 1
238 1 23 ASP HB2 1 25 VAL H . . 3.980 3.965 3.801 4.031 0.051 11 0 "[ . 1 . 2]" 1
239 1 99 MET H 1 105 LEU HG . . 5.270 4.877 4.739 4.978 . 0 0 "[ . 1 . 2]" 1
240 1 108 GLU HB2 1 109 LEU H . . 3.880 3.537 2.559 3.872 . 0 0 "[ . 1 . 2]" 1
241 1 3 PHE HB2 1 4 THR H . . 4.520 4.027 3.606 4.368 . 0 0 "[ . 1 . 2]" 1
242 1 3 PHE QD 1 4 THR H . . 5.410 3.990 3.044 4.961 . 0 0 "[ . 1 . 2]" 1
243 1 14 GLU H 1 17 ASP HB2 . . 5.350 5.184 4.593 5.390 0.040 10 0 "[ . 1 . 2]" 1
244 1 14 GLU H 1 14 GLU QG . . 3.390 2.284 1.918 2.754 . 0 0 "[ . 1 . 2]" 1
245 1 14 GLU H 1 14 GLU QB . . 2.790 2.574 2.383 2.750 . 0 0 "[ . 1 . 2]" 1
246 1 13 ALA MB 1 14 GLU H . . 3.510 2.681 2.530 2.913 . 0 0 "[ . 1 . 2]" 1
247 1 98 GLN HA 1 101 GLN H . . 4.410 4.060 3.720 4.284 . 0 0 "[ . 1 . 2]" 1
248 1 100 HIS HB2 1 101 GLN H . . 3.970 3.479 3.406 3.568 . 0 0 "[ . 1 . 2]" 1
249 1 104 ASP H 1 106 VAL H . . 4.870 4.140 3.969 4.288 . 0 0 "[ . 1 . 2]" 1
250 1 105 LEU H 1 106 VAL H . . 3.710 2.177 2.079 2.253 . 0 0 "[ . 1 . 2]" 1
251 1 106 VAL H 1 107 GLU H . . 3.430 2.473 2.395 2.596 . 0 0 "[ . 1 . 2]" 1
252 1 104 ASP HA 1 106 VAL H . . 4.080 3.704 3.525 3.887 . 0 0 "[ . 1 . 2]" 1
253 1 106 VAL H 1 106 VAL MG2 . . 3.780 1.906 1.720 2.000 . 0 0 "[ . 1 . 2]" 1
254 1 105 LEU MD2 1 106 VAL H . . 4.700 4.593 4.509 4.650 . 0 0 "[ . 1 . 2]" 1
255 1 105 LEU MD1 1 106 VAL H . . 4.860 4.797 4.608 4.868 0.008 4 0 "[ . 1 . 2]" 1
256 1 38 CYS H 1 41 SER HB3 . . 4.450 3.670 3.220 4.288 . 0 0 "[ . 1 . 2]" 1
257 1 112 LEU H 1 112 LEU HB2 . . 3.080 2.154 2.104 2.221 . 0 0 "[ . 1 . 2]" 1
258 1 112 LEU H 1 112 LEU HB3 . . 3.360 3.402 2.966 3.463 0.103 7 0 "[ . 1 . 2]" 1
259 1 112 LEU H 1 112 LEU MD2 . . 3.620 2.829 2.243 3.678 0.058 15 0 "[ . 1 . 2]" 1
260 1 109 LEU H 1 112 LEU H . . 5.410 5.185 4.663 5.441 0.031 1 0 "[ . 1 . 2]" 1
261 1 25 VAL HB 1 56 TYR H . . 4.540 3.905 3.758 4.181 . 0 0 "[ . 1 . 2]" 1
262 1 25 VAL MG1 1 56 TYR H . . 5.060 4.435 4.306 4.602 . 0 0 "[ . 1 . 2]" 1
263 1 54 ARG H 1 56 TYR H . . 4.130 4.198 4.163 4.245 0.115 5 0 "[ . 1 . 2]" 1
264 1 56 TYR H 1 56 TYR QD . . 3.250 2.638 2.426 2.793 . 0 0 "[ . 1 . 2]" 1
265 1 54 ARG HA 1 56 TYR H . . 4.410 3.554 3.222 3.949 . 0 0 "[ . 1 . 2]" 1
266 1 56 TYR H 1 56 TYR HB2 . . 3.430 3.542 3.494 3.587 0.157 5 0 "[ . 1 . 2]" 1
267 1 53 VAL MG1 1 56 TYR H . . 4.340 3.311 2.875 3.584 . 0 0 "[ . 1 . 2]" 1
268 1 17 ASP H 1 18 ALA H . . 3.450 2.708 2.583 2.855 . 0 0 "[ . 1 . 2]" 1
269 1 17 ASP HB2 1 18 ALA H . . 3.870 3.845 3.003 3.913 0.043 6 0 "[ . 1 . 2]" 1
270 1 17 ASP HB3 1 18 ALA H . . 3.470 2.686 2.484 3.266 . 0 0 "[ . 1 . 2]" 1
271 1 12 SER H 1 13 ALA H . . 4.600 4.540 4.370 4.664 0.064 20 0 "[ . 1 . 2]" 1
272 1 11 GLY H 1 12 SER H . . 4.390 3.705 1.835 4.468 0.078 18 0 "[ . 1 . 2]" 1
273 1 11 GLY HA2 1 12 SER H . . 3.130 2.798 2.399 3.192 0.062 1 0 "[ . 1 . 2]" 1
274 1 12 SER H 1 15 GLN QB . . 3.900 3.376 2.326 3.915 0.015 8 0 "[ . 1 . 2]" 1
275 1 12 SER H 1 16 LEU MD2 . . 5.500 3.573 3.082 3.941 . 0 0 "[ . 1 . 2]" 1
276 1 43 ALA H 1 44 VAL H . . 4.290 2.935 2.863 3.013 . 0 0 "[ . 1 . 2]" 1
277 1 62 LEU H 1 63 ASP H . . 3.490 2.395 2.132 2.895 . 0 0 "[ . 1 . 2]" 1
278 1 63 ASP H 1 63 ASP HB2 . . 3.660 2.225 2.099 2.445 . 0 0 "[ . 1 . 2]" 1
279 1 63 ASP H 1 63 ASP HB3 . . 3.370 2.776 2.515 3.336 . 0 0 "[ . 1 . 2]" 1
280 1 62 LEU HB2 1 63 ASP H . . 4.230 2.923 2.575 4.024 . 0 0 "[ . 1 . 2]" 1
281 1 62 LEU HB3 1 63 ASP H . . 4.790 3.813 3.426 4.444 . 0 0 "[ . 1 . 2]" 1
282 1 61 VAL MG1 1 63 ASP H . . 5.500 5.298 5.080 5.530 0.030 18 0 "[ . 1 . 2]" 1
283 1 19 LEU H 1 21 LYS H . . 4.550 3.848 3.621 4.016 . 0 0 "[ . 1 . 2]" 1
284 1 20 VAL HA 1 21 LYS H . . 3.530 3.541 3.505 3.566 0.036 5 0 "[ . 1 . 2]" 1
285 1 20 VAL H 1 21 LYS H . . 3.480 2.728 2.625 2.816 . 0 0 "[ . 1 . 2]" 1
286 1 21 LYS H 1 22 LYS QE . . 5.500 5.483 5.004 5.558 0.058 5 0 "[ . 1 . 2]" 1
287 1 63 ASP H 1 64 ASP H . . 3.390 2.680 2.350 2.833 . 0 0 "[ . 1 . 2]" 1
288 1 64 ASP H 1 67 LEU QD . . 4.940 3.271 2.745 4.310 . 0 0 "[ . 1 . 2]" 1
289 1 63 ASP HB2 1 64 ASP H . . 3.580 3.629 3.551 3.665 0.085 9 0 "[ . 1 . 2]" 1
290 1 28 PHE HB2 1 82 GLN H . . 4.010 2.599 2.533 2.682 . 0 0 "[ . 1 . 2]" 1
291 1 81 PRO HB2 1 82 GLN H . . 3.780 3.315 2.683 3.823 0.043 3 0 "[ . 1 . 2]" 1
292 1 81 PRO HB3 1 82 GLN H . . 4.160 3.618 3.072 4.089 . 0 0 "[ . 1 . 2]" 1
293 1 31 GLY H 1 37 GLN QG . . 5.020 4.673 3.829 4.978 . 0 0 "[ . 1 . 2]" 1
294 1 31 GLY H 1 62 LEU HG . . 3.950 3.676 3.036 4.025 0.075 9 0 "[ . 1 . 2]" 1
295 1 31 GLY H 1 62 LEU HB2 . . 4.800 4.750 4.391 4.955 0.155 9 0 "[ . 1 . 2]" 1
296 1 69 GLN H 1 69 GLN QG . . 4.090 3.866 2.476 4.001 . 0 0 "[ . 1 . 2]" 1
297 1 69 GLN H 1 69 GLN HB2 . . 3.400 2.378 2.116 3.480 0.080 9 0 "[ . 1 . 2]" 1
298 1 69 GLN H 1 69 GLN HB3 . . 3.490 2.617 2.271 3.194 . 0 0 "[ . 1 . 2]" 1
299 1 68 ARG HG2 1 69 GLN H . . 5.500 3.859 3.487 4.123 . 0 0 "[ . 1 . 2]" 1
300 1 98 GLN HA 1 102 ASN H . . 4.630 4.406 4.154 4.646 0.016 15 0 "[ . 1 . 2]" 1
301 1 101 GLN HB3 1 102 ASN H . . 4.160 4.060 3.848 4.219 0.059 2 0 "[ . 1 . 2]" 1
302 1 100 HIS H 1 102 ASN H . . 5.190 4.203 4.013 4.365 . 0 0 "[ . 1 . 2]" 1
303 1 99 MET HA 1 102 ASN H . . 3.710 3.494 3.359 3.626 . 0 0 "[ . 1 . 2]" 1
304 1 42 ASN HD21 1 46 GLN H . . 5.320 5.159 4.771 5.335 0.015 9 0 "[ . 1 . 2]" 1
305 1 42 ASN HD22 1 46 GLN QG . . 4.730 3.483 2.537 4.757 0.027 8 0 "[ . 1 . 2]" 1
306 1 42 ASN HD21 1 46 GLN QG . . 5.500 3.220 2.541 4.835 . 0 0 "[ . 1 . 2]" 1
307 1 22 LYS H 1 23 ASP H . . 3.200 2.666 2.552 2.775 . 0 0 "[ . 1 . 2]" 1
308 1 22 LYS HB2 1 23 ASP H . . 4.050 3.106 2.475 3.435 . 0 0 "[ . 1 . 2]" 1
309 1 22 LYS HB3 1 23 ASP H . . 4.000 3.413 2.930 3.957 . 0 0 "[ . 1 . 2]" 1
310 1 21 LYS HA 1 23 ASP H . . 4.520 3.582 3.176 4.090 . 0 0 "[ . 1 . 2]" 1
311 1 50 LEU HG 1 51 HIS H . . 4.840 4.602 4.536 4.650 . 0 0 "[ . 1 . 2]" 1
312 1 16 LEU HA 1 20 VAL H . . 4.410 3.998 3.780 4.141 . 0 0 "[ . 1 . 2]" 1
313 1 20 VAL H 1 20 VAL HB . . 3.810 3.719 3.694 3.749 . 0 0 "[ . 1 . 2]" 1
314 1 19 LEU HB2 1 20 VAL H . . 3.630 3.132 2.777 3.434 . 0 0 "[ . 1 . 2]" 1
315 1 32 THR HA 1 34 GLU H . . 4.430 4.295 4.058 4.463 0.033 9 0 "[ . 1 . 2]" 1
316 1 48 LEU HA 1 51 HIS H . . 3.790 3.602 3.569 3.657 . 0 0 "[ . 1 . 2]" 1
317 1 51 HIS H 1 118 LEU MD2 . . 4.520 4.514 4.312 4.548 0.028 7 0 "[ . 1 . 2]" 1
318 1 51 HIS H 1 51 HIS HB2 . . 3.570 2.213 2.189 2.242 . 0 0 "[ . 1 . 2]" 1
319 1 50 LEU HB2 1 51 HIS H . . 3.640 2.643 2.529 2.741 . 0 0 "[ . 1 . 2]" 1
320 1 45 VAL MG1 1 46 GLN HE21 . . 5.160 4.727 3.750 5.216 0.056 10 0 "[ . 1 . 2]" 1
321 1 52 GLY H 1 53 VAL HB . . 5.040 4.957 4.806 5.049 0.009 18 0 "[ . 1 . 2]" 1
322 1 52 GLY H 1 117 ALA MB . . 4.320 3.195 3.013 3.550 . 0 0 "[ . 1 . 2]" 1
323 1 52 GLY H 1 53 VAL MG2 . . 4.540 4.069 3.942 4.209 . 0 0 "[ . 1 . 2]" 1
324 1 51 HIS HB3 1 52 GLY H . . 4.330 4.231 4.145 4.292 . 0 0 "[ . 1 . 2]" 1
325 1 20 VAL H 1 74 TYR QE . . 5.500 5.427 5.007 5.553 0.053 7 0 "[ . 1 . 2]" 1
326 1 32 THR HB 1 34 GLU H . . 3.560 2.896 2.483 3.178 . 0 0 "[ . 1 . 2]" 1
327 1 34 GLU H 1 34 GLU QB . . 3.000 2.617 2.277 2.828 . 0 0 "[ . 1 . 2]" 1
328 1 33 PRO HB2 1 34 GLU H . . 3.670 3.579 2.801 3.701 0.031 15 0 "[ . 1 . 2]" 1
329 1 60 ASN QD 1 62 LEU HB2 . . 4.840 3.287 2.613 4.589 . 0 0 "[ . 1 . 2]" 1
330 1 35 GLN HA 1 35 GLN HE21 . . 5.500 4.709 2.343 5.322 . 0 0 "[ . 1 . 2]" 1
331 1 35 GLN HB2 1 35 GLN HE21 . . 4.590 3.289 2.155 4.517 . 0 0 "[ . 1 . 2]" 1
332 1 46 GLN HA 1 46 GLN HE21 . . 5.370 3.458 2.338 4.185 . 0 0 "[ . 1 . 2]" 1
333 1 32 THR H 1 60 ASN QD . . 4.670 3.868 3.545 4.190 . 0 0 "[ . 1 . 2]" 1
334 1 35 GLN HB2 1 35 GLN HE22 . . 5.000 4.102 3.602 5.089 0.089 4 0 "[ . 1 . 2]" 1
335 1 76 ASN HB2 1 76 ASN HD22 . . 3.980 4.026 3.974 4.051 0.071 3 0 "[ . 1 . 2]" 1
336 1 52 GLY H 1 53 VAL H . . 3.240 2.533 2.419 2.628 . 0 0 "[ . 1 . 2]" 1
337 1 51 HIS HA 1 52 GLY H . . 3.520 3.308 3.280 3.365 . 0 0 "[ . 1 . 2]" 1
338 1 60 ASN QD 1 62 LEU MD1 . . 5.260 2.846 2.161 3.773 . 0 0 "[ . 1 . 2]" 1
339 1 32 THR MG 1 60 ASN QD . . 4.400 2.065 1.721 2.323 . 0 0 "[ . 1 . 2]" 1
340 1 60 ASN QD 1 62 LEU HG . . 5.130 4.087 2.617 4.675 . 0 0 "[ . 1 . 2]" 1
341 1 46 GLN HE22 1 50 LEU MD2 . . 5.500 5.357 5.033 5.526 0.026 5 0 "[ . 1 . 2]" 1
342 1 15 GLN HE21 1 19 LEU MD2 . . 5.170 4.532 3.254 5.002 . 0 0 "[ . 1 . 2]" 1
343 1 97 LEU MD2 1 98 GLN HE22 . . 5.500 5.512 5.428 5.539 0.039 9 0 "[ . 1 . 2]" 1
344 1 15 GLN HE22 1 19 LEU MD2 . . 5.500 4.806 3.417 5.538 0.038 13 0 "[ . 1 . 2]" 1
345 1 74 TYR HB3 1 75 SER H . . 4.130 2.696 2.463 2.878 . 0 0 "[ . 1 . 2]" 1
346 1 74 TYR H 1 75 SER H . . 3.800 2.908 2.811 3.032 . 0 0 "[ . 1 . 2]" 1
347 1 75 SER H 1 76 ASN HA . . 5.140 4.549 4.388 4.735 . 0 0 "[ . 1 . 2]" 1
348 1 5 MET HA 1 6 GLY H . . 3.440 2.698 2.023 3.491 0.051 14 0 "[ . 1 . 2]" 1
349 1 5 MET HB3 1 6 GLY H . . 4.330 3.451 2.122 4.406 0.076 20 0 "[ . 1 . 2]" 1
350 1 86 ASN HD21 1 112 LEU MD2 . . 4.760 2.597 2.299 2.866 . 0 0 "[ . 1 . 2]" 1
351 1 86 ASN HD22 1 112 LEU MD2 . . 4.820 3.484 2.710 4.083 . 0 0 "[ . 1 . 2]" 1
352 1 86 ASN HD22 1 112 LEU HG . . 5.500 5.360 4.592 5.550 0.050 3 0 "[ . 1 . 2]" 1
353 1 9 GLY QA 1 10 GLY H . . 2.820 2.256 2.139 2.847 0.027 9 0 "[ . 1 . 2]" 1
354 1 7 ALA MB 1 8 GLY H . . 4.770 2.806 2.172 3.732 . 0 0 "[ . 1 . 2]" 1
355 1 8 GLY QA 1 9 GLY H . . 2.870 2.419 2.110 2.915 0.045 16 0 "[ . 1 . 2]" 1
356 1 70 GLY H 1 72 LYS H . . 4.840 4.392 4.327 4.540 . 0 0 "[ . 1 . 2]" 1
357 1 32 THR H 1 37 GLN H . . 4.070 3.728 3.329 4.124 0.054 5 0 "[ . 1 . 2]" 1
358 1 31 GLY HA2 1 32 THR H . . 3.440 2.676 2.512 2.933 . 0 0 "[ . 1 . 2]" 1
359 1 32 THR H 1 37 GLN HB2 . . 5.050 4.997 4.281 5.138 0.088 11 0 "[ . 1 . 2]" 1
360 1 32 THR H 1 35 GLN HB2 . . 4.200 3.884 2.253 4.272 0.072 13 0 "[ . 1 . 2]" 1
361 1 29 LEU QD 1 32 THR H . . 5.190 3.658 3.316 4.015 . 0 0 "[ . 1 . 2]" 1
362 1 11 GLY H 1 11 GLY HA2 . . 2.930 2.457 2.243 2.965 0.035 10 0 "[ . 1 . 2]" 1
363 1 11 GLY H 1 15 GLN QB . . 3.970 2.862 1.918 4.000 0.030 7 0 "[ . 1 . 2]" 1
364 1 70 GLY H 1 71 ILE HB . . 5.410 5.121 4.923 5.295 . 0 0 "[ . 1 . 2]" 1
365 1 69 GLN QG 1 70 GLY H . . 5.050 3.865 1.980 4.645 . 0 0 "[ . 1 . 2]" 1
366 1 70 GLY H 1 71 ILE H . . 3.780 2.947 2.856 3.089 . 0 0 "[ . 1 . 2]" 1
367 1 69 GLN HB3 1 70 GLY H . . 3.640 2.584 2.312 3.669 0.029 9 0 "[ . 1 . 2]" 1
368 1 70 GLY H 1 71 ILE MG . . 4.810 4.661 4.536 4.820 0.010 6 0 "[ . 1 . 2]" 1
369 1 112 LEU H 1 113 GLY H . . 3.210 2.522 2.295 2.801 . 0 0 "[ . 1 . 2]" 1
370 1 110 LYS HA 1 113 GLY H . . 3.670 3.190 2.875 3.683 0.013 9 0 "[ . 1 . 2]" 1
371 1 112 LEU HB2 1 113 GLY H . . 3.630 3.583 3.367 3.647 0.017 4 0 "[ . 1 . 2]" 1
372 1 112 LEU HB3 1 113 GLY H . . 4.230 3.993 3.213 4.209 . 0 0 "[ . 1 . 2]" 1
373 1 112 LEU MD2 1 113 GLY H . . 5.040 4.527 4.256 4.882 . 0 0 "[ . 1 . 2]" 1
374 1 103 GLY H 1 104 ASP HB2 . . 4.200 4.080 3.699 4.228 0.028 9 0 "[ . 1 . 2]" 1
375 1 102 ASN H 1 102 ASN HD22 . . 5.500 5.455 5.171 5.578 0.078 16 0 "[ . 1 . 2]" 1
376 1 99 MET HA 1 102 ASN HD22 . . 5.100 4.864 4.545 5.125 0.025 16 0 "[ . 1 . 2]" 1
377 1 80 ILE MD 1 82 GLN HE21 . . 5.500 4.589 2.449 5.528 0.028 8 0 "[ . 1 . 2]" 1
378 1 103 GLY H 1 105 LEU H . . 4.640 3.657 3.560 3.725 . 0 0 "[ . 1 . 2]" 1
379 1 103 GLY H 1 105 LEU QB . . 5.060 5.035 4.967 5.069 0.009 8 0 "[ . 1 . 2]" 1
380 1 100 HIS H 1 103 GLY H . . 5.200 4.547 4.466 4.679 . 0 0 "[ . 1 . 2]" 1
381 1 99 MET ME 1 103 GLY H . . 5.500 5.531 5.506 5.563 0.063 13 0 "[ . 1 . 2]" 1
382 1 103 GLY H 1 105 LEU MD2 . . 5.500 5.546 5.532 5.570 0.070 16 0 "[ . 1 . 2]" 1
383 1 21 LYS QG 1 87 GLY H . . 5.480 5.017 4.739 5.213 . 0 0 "[ . 1 . 2]" 1
384 1 21 LYS HD2 1 87 GLY H . . 5.430 3.496 3.293 3.655 . 0 0 "[ . 1 . 2]" 1
385 1 90 VAL H 1 91 GLY H . . 3.490 2.061 1.853 2.271 . 0 0 "[ . 1 . 2]" 1
386 1 84 TYR HA 1 91 GLY H . . 4.680 4.280 3.963 4.691 0.011 20 0 "[ . 1 . 2]" 1
387 1 90 VAL MG1 1 91 GLY H . . 3.950 2.890 2.364 3.997 0.047 17 0 "[ . 1 . 2]" 1
388 1 32 THR HB 1 35 GLN H . . 4.300 3.778 3.323 4.320 0.020 4 0 "[ . 1 . 2]" 1
389 1 32 THR HB 1 33 PRO HD3 . . 3.450 3.357 2.617 3.473 0.023 3 0 "[ . 1 . 2]" 1
390 1 32 THR HB 1 34 GLU QB . . 4.830 4.614 3.882 4.851 0.021 10 0 "[ . 1 . 2]" 1
391 1 29 LEU QD 1 32 THR HB . . 5.020 4.736 4.354 4.936 . 0 0 "[ . 1 . 2]" 1
392 1 106 VAL HA 1 109 LEU H . . 3.730 3.374 3.175 3.463 . 0 0 "[ . 1 . 2]" 1
393 1 106 VAL HA 1 107 GLU QG . . 5.500 5.232 5.040 5.638 0.138 15 0 "[ . 1 . 2]" 1
394 1 106 VAL HA 1 109 LEU HB3 . . 4.140 4.143 4.038 4.178 0.038 14 0 "[ . 1 . 2]" 1
395 1 106 VAL HA 1 109 LEU MD1 . . 3.770 2.443 2.338 2.601 . 0 0 "[ . 1 . 2]" 1
396 1 106 VAL HA 1 110 LYS H . . 4.420 4.148 3.897 4.371 . 0 0 "[ . 1 . 2]" 1
397 1 44 VAL HA 1 47 ILE H . . 4.400 3.523 3.341 3.678 . 0 0 "[ . 1 . 2]" 1
398 1 45 VAL HA 1 48 LEU H . . 3.940 3.349 3.122 3.503 . 0 0 "[ . 1 . 2]" 1
399 1 43 ALA HA 1 44 VAL HA . . 4.620 4.694 4.685 4.710 0.090 9 0 "[ . 1 . 2]" 1
400 1 45 VAL HA 1 45 VAL MG2 . . 2.910 2.262 2.226 2.299 . 0 0 "[ . 1 . 2]" 1
401 1 44 VAL HA 1 44 VAL MG2 . . 3.200 3.244 3.237 3.249 0.049 4 0 "[ . 1 . 2]" 1
402 1 33 PRO HA 1 45 VAL MG2 . . 2.980 2.340 2.026 2.816 . 0 0 "[ . 1 . 2]" 1
403 1 29 LEU QD 1 33 PRO HA . . 4.050 3.500 3.023 3.792 . 0 0 "[ . 1 . 2]" 1
404 1 65 PRO HA 1 68 ARG H . . 3.880 3.107 2.838 3.364 . 0 0 "[ . 1 . 2]" 1
405 1 20 VAL HA 1 23 ASP H . . 4.300 4.329 4.293 4.351 0.051 8 0 "[ . 1 . 2]" 1
406 1 20 VAL HA 1 26 VAL QG . . 3.370 2.120 1.845 2.359 . 0 0 "[ . 1 . 2]" 1
407 1 20 VAL HA 1 20 VAL MG2 . . 3.750 3.250 3.234 3.267 . 0 0 "[ . 1 . 2]" 1
408 1 20 VAL HA 1 20 VAL MG1 . . 3.360 2.405 2.350 2.468 . 0 0 "[ . 1 . 2]" 1
409 1 47 ILE HA 1 50 LEU MD1 . . 3.560 2.310 2.229 2.416 . 0 0 "[ . 1 . 2]" 1
410 1 47 ILE HA 1 47 ILE MG . . 3.390 2.581 2.478 2.637 . 0 0 "[ . 1 . 2]" 1
411 1 46 GLN HA 1 47 ILE HA . . 5.100 4.752 4.700 4.816 . 0 0 "[ . 1 . 2]" 1
412 1 47 ILE HA 1 50 LEU HB3 . . 4.150 4.121 3.977 4.170 0.020 10 0 "[ . 1 . 2]" 1
413 1 65 PRO HA 1 68 ARG QD . . 4.220 3.190 2.945 3.474 . 0 0 "[ . 1 . 2]" 1
414 1 65 PRO HA 1 68 ARG HG2 . . 5.250 4.595 4.356 4.894 . 0 0 "[ . 1 . 2]" 1
415 1 64 ASP HA 1 65 PRO HA . . 4.760 4.572 4.507 4.625 . 0 0 "[ . 1 . 2]" 1
416 1 72 LYS HB3 1 78 PRO HA . . 3.710 3.522 2.878 3.738 0.028 14 0 "[ . 1 . 2]" 1
417 1 37 GLN HE22 1 41 SER HA . . 4.430 4.030 3.267 4.499 0.069 5 0 "[ . 1 . 2]" 1
418 1 29 LEU QD 1 41 SER HA . . 3.860 2.402 2.023 3.082 . 0 0 "[ . 1 . 2]" 1
419 1 41 SER HA 1 44 VAL H . . 4.010 3.926 3.623 4.055 0.045 6 0 "[ . 1 . 2]" 1
420 1 20 VAL HA 1 26 VAL H . . 5.450 5.349 5.060 5.562 0.112 5 0 "[ . 1 . 2]" 1
421 1 20 VAL HA 1 22 LYS H . . 3.830 3.667 3.463 3.845 0.015 10 0 "[ . 1 . 2]" 1
422 1 36 PRO HA 1 37 GLN H . . 2.990 2.257 2.108 2.600 . 0 0 "[ . 1 . 2]" 1
423 1 36 PRO HA 1 41 SER HB3 . . 3.980 3.852 2.805 4.083 0.103 20 0 "[ . 1 . 2]" 1
424 1 12 SER HB2 1 13 ALA H . . 4.270 3.780 3.598 4.119 . 0 0 "[ . 1 . 2]" 1
425 1 12 SER HB3 1 13 ALA H . . 3.990 3.080 2.607 3.401 . 0 0 "[ . 1 . 2]" 1
426 1 12 SER HB3 1 15 GLN QB . . 4.280 4.131 3.636 4.316 0.036 2 0 "[ . 1 . 2]" 1
427 1 2 SER QB 1 3 PHE H . . 4.930 3.405 2.430 4.035 . 0 0 "[ . 1 . 2]" 1
428 1 116 SER HB2 1 119 LEU H . . 5.150 4.958 4.438 5.156 0.006 11 0 "[ . 1 . 2]" 1
429 1 53 VAL HA 1 53 VAL MG1 . . 3.010 2.338 2.274 2.400 . 0 0 "[ . 1 . 2]" 1
430 1 106 VAL HA 1 116 SER HB3 . . 3.790 3.812 3.645 3.890 0.100 15 0 "[ . 1 . 2]" 1
431 1 116 SER HB3 1 119 LEU MD2 . . 5.070 3.832 2.114 4.679 . 0 0 "[ . 1 . 2]" 1
432 1 29 LEU HA 1 81 PRO HA . . 4.120 2.985 2.682 3.391 . 0 0 "[ . 1 . 2]" 1
433 1 29 LEU HG 1 81 PRO HA . . 5.500 4.978 4.354 5.511 0.011 20 0 "[ . 1 . 2]" 1
434 1 41 SER HB2 1 42 ASN H . . 4.670 3.982 3.469 4.239 . 0 0 "[ . 1 . 2]" 1
435 1 61 VAL HA 1 63 ASP H . . 4.060 3.700 3.462 4.000 . 0 0 "[ . 1 . 2]" 1
436 1 61 VAL HA 1 67 LEU QD . . 3.520 2.770 2.303 3.423 . 0 0 "[ . 1 . 2]" 1
437 1 59 TYR HB3 1 61 VAL HA . . 4.790 4.642 3.778 4.843 0.053 18 0 "[ . 1 . 2]" 1
438 1 90 VAL HA 1 90 VAL MG1 . . 2.990 2.763 2.213 2.993 0.003 3 0 "[ . 1 . 2]" 1
439 1 90 VAL HA 1 90 VAL MG2 . . 3.130 2.392 2.094 3.191 0.061 12 0 "[ . 1 . 2]" 1
440 1 93 CYS HA 1 96 LEU H . . 3.800 3.341 3.152 3.470 . 0 0 "[ . 1 . 2]" 1
441 1 93 CYS HA 1 97 LEU H . . 4.290 4.190 4.063 4.329 0.039 19 0 "[ . 1 . 2]" 1
442 1 93 CYS HA 1 96 LEU HB3 . . 3.720 2.753 2.420 3.302 . 0 0 "[ . 1 . 2]" 1
443 1 44 VAL MG1 1 93 CYS HA . . 3.400 2.686 2.288 3.249 . 0 0 "[ . 1 . 2]" 1
444 1 93 CYS HA 1 95 ILE H . . 4.110 4.109 4.001 4.153 0.043 16 0 "[ . 1 . 2]" 1
445 1 83 VAL HA 1 83 VAL MG2 . . 3.340 2.268 2.210 2.361 . 0 0 "[ . 1 . 2]" 1
446 1 25 VAL HA 1 83 VAL MG2 . . 3.470 3.289 3.020 3.479 0.009 11 0 "[ . 1 . 2]" 1
447 1 25 VAL HA 1 25 VAL MG1 . . 3.440 2.216 2.171 2.264 . 0 0 "[ . 1 . 2]" 1
448 1 25 VAL HA 1 85 LEU HA . . 3.610 3.044 2.833 3.329 . 0 0 "[ . 1 . 2]" 1
449 1 4 THR HA 1 4 THR HB . . 2.640 2.445 2.280 2.558 . 0 0 "[ . 1 . 2]" 1
450 1 4 THR HA 1 4 THR MG . . 3.170 2.384 2.270 2.554 . 0 0 "[ . 1 . 2]" 1
451 1 26 VAL HA 1 27 VAL H . . 2.930 2.050 1.993 2.102 . 0 0 "[ . 1 . 2]" 1
452 1 26 VAL HA 1 57 ALA MB . . 3.470 3.001 2.766 3.154 . 0 0 "[ . 1 . 2]" 1
453 1 25 VAL HA 1 85 LEU MD1 . . 3.620 2.653 2.407 3.050 . 0 0 "[ . 1 . 2]" 1
454 1 79 THR HA 1 80 ILE H . . 3.160 2.335 2.037 3.294 0.134 20 0 "[ . 1 . 2]" 1
455 1 79 THR HA 1 79 THR MG . . 3.400 2.675 2.222 3.294 . 0 0 "[ . 1 . 2]" 1
456 1 71 ILE HA 1 74 TYR HB2 . . 3.630 3.480 3.120 3.657 0.027 8 0 "[ . 1 . 2]" 1
457 1 71 ILE HA 1 74 TYR HB3 . . 3.690 2.468 2.282 2.655 . 0 0 "[ . 1 . 2]" 1
458 1 114 ILE HA 1 115 HIS H . . 3.120 2.081 2.019 2.165 . 0 0 "[ . 1 . 2]" 1
459 1 24 LYS HA 1 85 LEU HA . . 4.460 4.226 3.914 4.498 0.038 11 0 "[ . 1 . 2]" 1
460 1 114 ILE HA 1 114 ILE HG13 . . 3.580 3.027 2.928 3.077 . 0 0 "[ . 1 . 2]" 1
461 1 71 ILE HA 1 74 TYR H . . 4.130 3.214 3.039 3.449 . 0 0 "[ . 1 . 2]" 1
462 1 110 LYS HA 1 110 LYS HG3 . . 3.480 2.853 2.623 3.505 0.025 17 0 "[ . 1 . 2]" 1
463 1 68 ARG HA 1 68 ARG QD . . 4.140 3.967 3.791 4.172 0.032 20 0 "[ . 1 . 2]" 1
464 1 61 VAL HB 1 68 ARG HA . . 3.510 2.408 2.176 2.653 . 0 0 "[ . 1 . 2]" 1
465 1 68 ARG HA 1 68 ARG HG2 . . 3.900 3.017 2.774 3.217 . 0 0 "[ . 1 . 2]" 1
466 1 61 VAL MG1 1 68 ARG HA . . 3.860 3.504 2.812 3.878 0.018 9 0 "[ . 1 . 2]" 1
467 1 61 VAL MG2 1 68 ARG HA . . 4.250 3.146 2.851 3.369 . 0 0 "[ . 1 . 2]" 1
468 1 100 HIS HA 1 105 LEU H . . 4.050 4.075 4.048 4.128 0.078 14 0 "[ . 1 . 2]" 1
469 1 100 HIS HA 1 105 LEU HG . . 3.390 2.851 2.747 2.940 . 0 0 "[ . 1 . 2]" 1
470 1 47 ILE MG 1 100 HIS HA . . 4.170 3.566 3.422 3.752 . 0 0 "[ . 1 . 2]" 1
471 1 100 HIS HA 1 105 LEU MD1 . . 3.600 2.196 2.149 2.261 . 0 0 "[ . 1 . 2]" 1
472 1 110 LYS HA 1 110 LYS QB . . 2.740 2.418 2.071 2.533 . 0 0 "[ . 1 . 2]" 1
473 1 110 LYS HA 1 110 LYS HG2 . . 3.510 2.764 2.394 3.628 0.118 12 0 "[ . 1 . 2]" 1
474 1 110 LYS HA 1 112 LEU H . . 4.230 4.096 3.785 4.284 0.054 12 0 "[ . 1 . 2]" 1
475 1 12 SER HA 1 13 ALA H . . 2.910 2.427 2.217 2.656 . 0 0 "[ . 1 . 2]" 1
476 1 12 SER HA 1 12 SER HB2 . . 2.950 2.661 2.474 3.004 0.054 1 0 "[ . 1 . 2]" 1
477 1 12 SER HA 1 13 ALA MB . . 4.210 4.096 3.996 4.238 0.028 2 0 "[ . 1 . 2]" 1
478 1 49 ARG HA 1 49 ARG HB3 . . 2.900 2.573 2.499 2.705 . 0 0 "[ . 1 . 2]" 1
479 1 66 GLU HA 1 67 LEU H . . 3.530 3.569 3.541 3.580 0.050 16 0 "[ . 1 . 2]" 1
480 1 14 GLU HA 1 17 ASP HB3 . . 3.460 2.714 2.360 3.501 0.041 2 0 "[ . 1 . 2]" 1
481 1 111 LYS HA 1 111 LYS QB . . 2.400 2.367 2.070 2.419 0.019 11 0 "[ . 1 . 2]" 1
482 1 111 LYS HA 1 111 LYS HG2 . . 3.320 2.669 2.497 3.455 0.135 14 0 "[ . 1 . 2]" 1
483 1 111 LYS HA 1 111 LYS HG3 . . 3.240 2.970 2.714 3.434 0.194 14 0 "[ . 1 . 2]" 1
484 1 27 VAL HA 1 28 PHE H . . 2.830 2.196 2.133 2.271 . 0 0 "[ . 1 . 2]" 1
485 1 27 VAL HA 1 82 GLN H . . 5.000 4.863 4.680 5.020 0.020 18 0 "[ . 1 . 2]" 1
486 1 26 VAL HA 1 27 VAL HA . . 4.410 4.398 4.360 4.422 0.012 16 0 "[ . 1 . 2]" 1
487 1 27 VAL HA 1 83 VAL HA . . 3.500 2.411 2.246 2.511 . 0 0 "[ . 1 . 2]" 1
488 1 27 VAL HA 1 28 PHE HB2 . . 4.590 3.517 3.432 3.585 . 0 0 "[ . 1 . 2]" 1
489 1 27 VAL HA 1 29 LEU HG . . 5.180 4.739 4.562 4.850 . 0 0 "[ . 1 . 2]" 1
490 1 27 VAL HA 1 27 VAL MG2 . . 3.060 2.299 2.249 2.349 . 0 0 "[ . 1 . 2]" 1
491 1 27 VAL HA 1 83 VAL MG2 . . 3.930 2.739 2.622 2.962 . 0 0 "[ . 1 . 2]" 1
492 1 116 SER HA 1 117 ALA MB . . 3.940 3.948 3.918 3.968 0.028 8 0 "[ . 1 . 2]" 1
493 1 114 ILE MG 1 116 SER HA . . 4.230 3.817 3.623 4.132 . 0 0 "[ . 1 . 2]" 1
494 1 116 SER HA 1 117 ALA H . . 2.680 2.144 2.099 2.178 . 0 0 "[ . 1 . 2]" 1
495 1 99 MET HA 1 99 MET HG3 . . 3.260 3.117 3.011 3.191 . 0 0 "[ . 1 . 2]" 1
496 1 98 GLN QB 1 99 MET HA . . 3.910 3.652 3.548 3.858 . 0 0 "[ . 1 . 2]" 1
497 1 51 HIS HA 1 116 SER HA . . 3.870 3.414 3.090 3.629 . 0 0 "[ . 1 . 2]" 1
498 1 51 HIS HA 1 53 VAL MG2 . . 4.560 4.511 4.357 4.588 0.028 19 0 "[ . 1 . 2]" 1
499 1 51 HIS HA 1 118 LEU MD2 . . 4.510 3.494 3.318 3.754 . 0 0 "[ . 1 . 2]" 1
500 1 107 GLU HA 1 107 GLU QG . . 3.230 3.100 2.884 3.239 0.009 12 0 "[ . 1 . 2]" 1
501 1 107 GLU HA 1 107 GLU QB . . 2.610 2.350 2.233 2.470 . 0 0 "[ . 1 . 2]" 1
502 1 107 GLU HA 1 110 LYS HG3 . . 3.880 3.739 3.505 3.988 0.108 12 0 "[ . 1 . 2]" 1
503 1 97 LEU HA 1 100 HIS HB3 . . 3.460 3.431 3.137 3.484 0.024 20 0 "[ . 1 . 2]" 1
504 1 97 LEU HA 1 97 LEU MD2 . . 3.460 2.165 2.104 2.231 . 0 0 "[ . 1 . 2]" 1
505 1 46 GLN HA 1 49 ARG H . . 4.070 3.784 3.430 4.033 . 0 0 "[ . 1 . 2]" 1
506 1 45 VAL MG1 1 46 GLN HA . . 4.180 3.823 3.475 4.018 . 0 0 "[ . 1 . 2]" 1
507 1 101 GLN HA 1 101 GLN HB3 . . 3.000 2.381 2.362 2.408 . 0 0 "[ . 1 . 2]" 1
508 1 47 ILE HA 1 48 LEU HA . . 4.810 4.796 4.776 4.810 0.000 14 0 "[ . 1 . 2]" 1
509 1 48 LEU HA 1 51 HIS HB2 . . 4.150 2.821 2.768 2.912 . 0 0 "[ . 1 . 2]" 1
510 1 48 LEU HA 1 53 VAL MG2 . . 4.530 3.742 3.328 4.040 . 0 0 "[ . 1 . 2]" 1
511 1 48 LEU HA 1 48 LEU MD2 . . 3.050 2.095 2.063 2.118 . 0 0 "[ . 1 . 2]" 1
512 1 48 LEU HA 1 48 LEU MD1 . . 4.020 3.847 3.837 3.858 . 0 0 "[ . 1 . 2]" 1
513 1 48 LEU HA 1 51 HIS HB3 . . 4.480 4.279 4.182 4.376 . 0 0 "[ . 1 . 2]" 1
514 1 85 LEU H 1 89 PHE HA . . 4.530 4.017 3.673 4.150 . 0 0 "[ . 1 . 2]" 1
515 1 32 THR HA 1 32 THR MG . . 3.220 2.454 2.318 2.587 . 0 0 "[ . 1 . 2]" 1
516 1 3 PHE HA 1 3 PHE QD . . 3.420 2.700 2.161 3.086 . 0 0 "[ . 1 . 2]" 1
517 1 59 TYR HA 1 60 ASN HA . . 4.340 4.382 4.322 4.401 0.061 3 0 "[ . 1 . 2]" 1
518 1 94 ASP HA 1 97 LEU QB . . 3.200 2.931 2.469 3.214 0.014 10 0 "[ . 1 . 2]" 1
519 1 15 GLN HA 1 18 ALA MB . . 3.500 2.736 2.580 2.907 . 0 0 "[ . 1 . 2]" 1
520 1 50 LEU HA 1 50 LEU MD2 . . 2.840 2.182 2.128 2.226 . 0 0 "[ . 1 . 2]" 1
521 1 109 LEU HA 1 109 LEU MD2 . . 3.120 2.148 2.118 2.195 . 0 0 "[ . 1 . 2]" 1
522 1 19 LEU HA 1 22 LYS QD . . 2.980 2.289 2.050 3.006 0.026 12 0 "[ . 1 . 2]" 1
523 1 19 LEU HA 1 19 LEU HB3 . . 2.940 2.863 2.783 2.962 0.022 13 0 "[ . 1 . 2]" 1
524 1 19 LEU HA 1 19 LEU MD2 . . 3.090 2.449 2.065 3.107 0.017 13 0 "[ . 1 . 2]" 1
525 1 19 LEU HA 1 22 LYS H . . 4.620 3.658 3.100 4.151 . 0 0 "[ . 1 . 2]" 1
526 1 19 LEU HA 1 22 LYS QE . . 4.010 2.584 2.042 3.248 . 0 0 "[ . 1 . 2]" 1
527 1 96 LEU HA 1 96 LEU QD . . 2.930 2.143 2.099 2.178 . 0 0 "[ . 1 . 2]" 1
528 1 96 LEU HA 1 100 HIS H . . 4.660 3.708 3.388 4.041 . 0 0 "[ . 1 . 2]" 1
529 1 105 LEU HA 1 108 GLU H . . 3.940 3.487 3.256 3.628 . 0 0 "[ . 1 . 2]" 1
530 1 99 MET ME 1 105 LEU HA . . 3.290 3.240 2.757 3.325 0.035 8 0 "[ . 1 . 2]" 1
531 1 105 LEU HA 1 105 LEU MD2 . . 3.100 2.135 2.109 2.189 . 0 0 "[ . 1 . 2]" 1
532 1 89 PHE HA 1 90 VAL H . . 3.050 1.952 1.857 2.050 . 0 0 "[ . 1 . 2]" 1
533 1 84 TYR HA 1 89 PHE HA . . 3.600 2.919 2.712 3.085 . 0 0 "[ . 1 . 2]" 1
534 1 89 PHE HA 1 90 VAL HA . . 5.130 4.224 4.163 4.281 . 0 0 "[ . 1 . 2]" 1
535 1 89 PHE HA 1 90 VAL HB . . 4.710 3.229 2.608 4.850 0.140 17 0 "[ . 1 . 2]" 1
536 1 89 PHE HA 1 90 VAL MG1 . . 4.100 4.028 3.426 4.206 0.106 3 0 "[ . 1 . 2]" 1
537 1 28 PHE HA 1 29 LEU H . . 2.910 2.279 2.224 2.342 . 0 0 "[ . 1 . 2]" 1
538 1 28 PHE HA 1 59 TYR H . . 3.630 3.245 3.081 3.353 . 0 0 "[ . 1 . 2]" 1
539 1 27 VAL HA 1 28 PHE HA . . 4.390 4.404 4.394 4.413 0.023 6 0 "[ . 1 . 2]" 1
540 1 28 PHE HA 1 59 TYR HB3 . . 4.040 3.713 3.455 3.849 . 0 0 "[ . 1 . 2]" 1
541 1 28 PHE HA 1 61 VAL MG1 . . 4.410 3.365 3.000 3.757 . 0 0 "[ . 1 . 2]" 1
542 1 84 TYR HA 1 85 LEU H . . 2.860 2.177 2.128 2.237 . 0 0 "[ . 1 . 2]" 1
543 1 84 TYR HA 1 90 VAL H . . 3.700 3.688 3.334 3.758 0.058 20 0 "[ . 1 . 2]" 1
544 1 59 TYR HA 1 60 ASN H . . 2.800 2.116 1.973 2.240 . 0 0 "[ . 1 . 2]" 1
545 1 59 TYR HA 1 59 TYR QD . . 3.370 2.993 2.684 3.142 . 0 0 "[ . 1 . 2]" 1
546 1 58 ALA MB 1 59 TYR HA . . 4.600 4.493 4.427 4.605 0.005 3 0 "[ . 1 . 2]" 1
547 1 104 ASP HA 1 104 ASP QB . . 2.700 2.505 2.428 2.579 . 0 0 "[ . 1 . 2]" 1
548 1 104 ASP HA 1 107 GLU QB . . 3.600 3.220 2.173 3.389 . 0 0 "[ . 1 . 2]" 1
549 1 17 ASP HA 1 20 VAL MG2 . . 3.250 2.081 1.992 2.318 . 0 0 "[ . 1 . 2]" 1
550 1 69 GLN HA 1 71 ILE H . . 4.230 4.313 4.292 4.340 0.110 11 0 "[ . 1 . 2]" 1
551 1 69 GLN HA 1 69 GLN QG . . 3.660 2.519 2.281 3.419 . 0 0 "[ . 1 . 2]" 1
552 1 16 LEU HA 1 19 LEU HB2 . . 3.600 2.067 1.987 2.242 . 0 0 "[ . 1 . 2]" 1
553 1 16 LEU HA 1 19 LEU HB3 . . 3.140 3.010 2.431 3.222 0.082 5 0 "[ . 1 . 2]" 1
554 1 16 LEU HA 1 67 LEU QD . . 5.400 4.799 4.238 5.126 . 0 0 "[ . 1 . 2]" 1
555 1 16 LEU HA 1 16 LEU MD2 . . 2.850 2.368 2.195 2.552 . 0 0 "[ . 1 . 2]" 1
556 1 28 PHE HA 1 59 TYR QD . . 4.450 4.231 3.488 4.475 0.025 6 0 "[ . 1 . 2]" 1
557 1 30 LYS HA 1 30 LYS HE3 . . 5.080 5.115 5.083 5.140 0.060 14 0 "[ . 1 . 2]" 1
558 1 72 LYS HB3 1 73 ASP HA . . 4.440 4.449 4.361 4.486 0.046 6 0 "[ . 1 . 2]" 1
559 1 73 ASP HA 1 73 ASP HB2 . . 2.650 2.499 2.383 2.617 . 0 0 "[ . 1 . 2]" 1
560 1 80 ILE HA 1 80 ILE HG12 . . 3.870 3.200 2.437 3.987 0.117 14 0 "[ . 1 . 2]" 1
561 1 42 ASN HA 1 46 GLN H . . 4.680 3.706 3.564 3.963 . 0 0 "[ . 1 . 2]" 1
562 1 21 LYS HA 1 87 GLY HA3 . . 3.850 3.685 3.292 3.876 0.026 15 0 "[ . 1 . 2]" 1
563 1 42 ASN HA 1 45 VAL HA . . 5.210 5.264 5.238 5.295 0.085 19 0 "[ . 1 . 2]" 1
564 1 21 LYS HA 1 21 LYS HB2 . . 3.010 2.920 2.699 3.028 0.018 10 0 "[ . 1 . 2]" 1
565 1 21 LYS HA 1 21 LYS HD2 . . 4.040 2.124 2.026 2.276 . 0 0 "[ . 1 . 2]" 1
566 1 21 LYS HA 1 21 LYS QG . . 3.390 2.501 2.142 2.846 . 0 0 "[ . 1 . 2]" 1
567 1 42 ASN HA 1 45 VAL MG2 . . 3.500 3.503 3.242 3.577 0.077 18 0 "[ . 1 . 2]" 1
568 1 21 LYS HA 1 87 GLY H . . 4.230 4.165 3.921 4.259 0.029 17 0 "[ . 1 . 2]" 1
569 1 21 LYS HA 1 21 LYS QE . . 4.490 3.166 2.356 4.077 . 0 0 "[ . 1 . 2]" 1
570 1 15 GLN QB 1 16 LEU HA . . 4.420 4.359 4.247 4.454 0.034 12 0 "[ . 1 . 2]" 1
571 1 82 GLN HA 1 83 VAL H . . 2.910 2.435 2.328 2.586 . 0 0 "[ . 1 . 2]" 1
572 1 82 GLN HA 1 83 VAL MG1 . . 4.230 4.010 3.727 4.199 . 0 0 "[ . 1 . 2]" 1
573 1 54 ARG HA 1 56 TYR QD . . 3.450 3.307 3.050 3.473 0.023 16 0 "[ . 1 . 2]" 1
574 1 54 ARG HA 1 54 ARG HB2 . . 2.970 2.452 2.263 3.016 0.046 8 0 "[ . 1 . 2]" 1
575 1 5 MET HA 1 5 MET HB3 . . 2.930 2.395 2.238 2.527 . 0 0 "[ . 1 . 2]" 1
576 1 43 ALA HA 1 46 GLN QG . . 4.290 3.388 2.846 3.932 . 0 0 "[ . 1 . 2]" 1
577 1 56 TYR HA 1 57 ALA H . . 2.870 2.306 2.211 2.401 . 0 0 "[ . 1 . 2]" 1
578 1 37 GLN HA 1 37 GLN QG . . 3.520 3.378 3.281 3.532 0.012 4 0 "[ . 1 . 2]" 1
579 1 37 GLN HA 1 62 LEU MD1 . . 4.570 4.543 4.185 4.626 0.056 19 0 "[ . 1 . 2]" 1
580 1 119 LEU HA 1 119 LEU MD1 . . 2.770 2.687 2.242 2.864 0.094 3 0 "[ . 1 . 2]" 1
581 1 118 LEU HA 1 119 LEU H . . 3.520 3.423 3.337 3.533 0.013 19 0 "[ . 1 . 2]" 1
582 1 118 LEU HA 1 118 LEU MD2 . . 3.030 2.199 2.091 2.300 . 0 0 "[ . 1 . 2]" 1
583 1 13 ALA HA 1 16 LEU H . . 3.740 3.424 3.262 3.661 . 0 0 "[ . 1 . 2]" 1
584 1 13 ALA HA 1 74 TYR QD . . 3.590 2.450 2.094 2.806 . 0 0 "[ . 1 . 2]" 1
585 1 13 ALA HA 1 16 LEU MD2 . . 4.950 3.706 3.547 3.788 . 0 0 "[ . 1 . 2]" 1
586 1 88 GLU HA 1 89 PHE H . . 2.980 2.149 2.101 2.222 . 0 0 "[ . 1 . 2]" 1
587 1 63 ASP HA 1 63 ASP HB3 . . 2.870 2.952 2.814 2.976 0.106 17 0 "[ . 1 . 2]" 1
588 1 63 ASP HA 1 63 ASP HB2 . . 2.900 2.617 2.492 2.923 0.023 5 0 "[ . 1 . 2]" 1
589 1 120 ASP HA 1 121 GLU H . . 2.890 2.924 2.833 2.978 0.088 11 0 "[ . 1 . 2]" 1
590 1 120 ASP HA 1 120 ASP HB3 . . 3.010 3.010 2.873 3.033 0.023 20 0 "[ . 1 . 2]" 1
591 1 115 HIS HA 1 116 SER H . . 2.940 2.248 2.162 2.308 . 0 0 "[ . 1 . 2]" 1
592 1 18 ALA HA 1 21 LYS H . . 3.750 3.248 3.119 3.433 . 0 0 "[ . 1 . 2]" 1
593 1 17 ASP HB3 1 18 ALA HA . . 4.570 4.375 4.090 4.499 . 0 0 "[ . 1 . 2]" 1
594 1 18 ALA HA 1 21 LYS HB3 . . 3.440 3.348 2.918 3.521 0.081 1 0 "[ . 1 . 2]" 1
595 1 18 ALA HA 1 20 VAL MG2 . . 5.070 4.480 4.375 4.619 . 0 0 "[ . 1 . 2]" 1
596 1 76 ASN HD21 1 77 TRP HA . . 4.570 4.411 4.085 4.625 0.055 10 0 "[ . 1 . 2]" 1
597 1 77 TRP HA 1 78 PRO HD2 . . 3.210 2.319 2.098 2.711 . 0 0 "[ . 1 . 2]" 1
598 1 77 TRP HA 1 78 PRO HD3 . . 3.340 2.391 1.988 2.580 . 0 0 "[ . 1 . 2]" 1
599 1 111 LYS H 1 112 LEU HA . . 5.410 5.429 5.409 5.453 0.043 7 0 "[ . 1 . 2]" 1
600 1 112 LEU HA 1 112 LEU HB2 . . 2.980 3.001 2.832 3.024 0.044 15 0 "[ . 1 . 2]" 1
601 1 112 LEU HA 1 112 LEU HB3 . . 2.990 2.659 2.557 2.978 . 0 0 "[ . 1 . 2]" 1
602 1 112 LEU HA 1 112 LEU MD2 . . 2.820 2.547 2.046 2.860 0.040 9 0 "[ . 1 . 2]" 1
603 1 76 ASN H 1 76 ASN HA . . 2.930 2.231 2.199 2.263 . 0 0 "[ . 1 . 2]" 1
604 1 55 ASP HA 1 56 TYR H . . 2.990 3.010 2.939 3.091 0.101 5 0 "[ . 1 . 2]" 1
605 1 55 ASP HA 1 55 ASP QB . . 2.690 2.338 2.152 2.459 . 0 0 "[ . 1 . 2]" 1
606 1 86 ASN H 1 86 ASN HA . . 2.870 2.298 2.254 2.334 . 0 0 "[ . 1 . 2]" 1
607 1 86 ASN HA 1 87 GLY H . . 3.520 2.813 2.644 2.926 . 0 0 "[ . 1 . 2]" 1
608 1 86 ASN HA 1 86 ASN HD22 . . 4.310 4.362 4.324 4.403 0.093 16 0 "[ . 1 . 2]" 1
609 1 24 LYS HA 1 86 ASN HA . . 3.400 2.650 2.386 2.973 . 0 0 "[ . 1 . 2]" 1
610 1 86 ASN HA 1 112 LEU MD1 . . 4.510 3.279 2.691 4.118 . 0 0 "[ . 1 . 2]" 1
611 1 85 LEU HA 1 86 ASN H . . 2.980 2.088 1.983 2.206 . 0 0 "[ . 1 . 2]" 1
612 1 85 LEU HA 1 85 LEU HG . . 3.820 2.300 2.204 2.364 . 0 0 "[ . 1 . 2]" 1
613 1 85 LEU HA 1 85 LEU MD2 . . 3.690 3.682 3.644 3.704 0.014 5 0 "[ . 1 . 2]" 1
614 1 26 VAL H 1 85 LEU HA . . 4.420 3.743 3.514 4.111 . 0 0 "[ . 1 . 2]" 1
615 1 85 LEU HA 1 86 ASN HB2 . . 4.690 4.368 4.197 4.489 . 0 0 "[ . 1 . 2]" 1
616 1 23 ASP HA 1 24 LYS H . . 2.660 2.518 2.422 2.618 . 0 0 "[ . 1 . 2]" 1
617 1 102 ASN HA 1 102 ASN HD22 . . 4.520 4.586 4.562 4.629 0.109 14 0 "[ . 1 . 2]" 1
618 1 102 ASN HA 1 102 ASN HB2 . . 2.960 2.331 2.186 2.486 . 0 0 "[ . 1 . 2]" 1
619 1 102 ASN HA 1 102 ASN HB3 . . 2.880 2.912 2.783 2.976 0.096 16 0 "[ . 1 . 2]" 1
620 1 35 GLN HA 1 36 PRO QD . . 2.570 2.066 1.985 2.140 . 0 0 "[ . 1 . 2]" 1
621 1 35 GLN HA 1 35 GLN HB2 . . 2.920 2.981 2.951 2.991 0.071 20 0 "[ . 1 . 2]" 1
622 1 35 GLN HA 1 35 GLN QG . . 3.210 2.394 2.209 2.919 . 0 0 "[ . 1 . 2]" 1
623 1 80 ILE MG 1 81 PRO HD2 . . 5.500 2.730 2.207 3.771 . 0 0 "[ . 1 . 2]" 1
624 1 60 ASN HA 1 61 VAL H . . 2.850 2.213 2.148 2.308 . 0 0 "[ . 1 . 2]" 1
625 1 29 LEU H 1 60 ASN HA . . 3.900 3.628 3.462 3.906 0.006 9 0 "[ . 1 . 2]" 1
626 1 31 GLY H 1 60 ASN HA . . 4.070 2.692 2.408 3.290 . 0 0 "[ . 1 . 2]" 1
627 1 57 ALA HA 1 58 ALA H . . 2.470 2.184 2.163 2.201 . 0 0 "[ . 1 . 2]" 1
628 1 57 ALA HA 1 58 ALA MB . . 4.410 4.059 3.990 4.129 . 0 0 "[ . 1 . 2]" 1
629 1 80 ILE MG 1 81 PRO HD3 . . 4.700 3.609 3.111 4.058 . 0 0 "[ . 1 . 2]" 1
630 1 64 ASP HA 1 65 PRO HD2 . . 2.900 2.117 2.053 2.248 . 0 0 "[ . 1 . 2]" 1
631 1 64 ASP HA 1 65 PRO HD3 . . 3.000 2.676 2.447 2.875 . 0 0 "[ . 1 . 2]" 1
632 1 64 ASP HB3 1 65 PRO HD2 . . 5.150 3.572 3.043 4.011 . 0 0 "[ . 1 . 2]" 1
633 1 65 PRO HD3 1 66 GLU H . . 4.530 3.904 3.800 4.089 . 0 0 "[ . 1 . 2]" 1
634 1 64 ASP H 1 65 PRO HD3 . . 4.930 4.622 4.163 4.901 . 0 0 "[ . 1 . 2]" 1
635 1 64 ASP HB3 1 65 PRO HD3 . . 5.240 4.687 4.301 5.007 . 0 0 "[ . 1 . 2]" 1
636 1 33 PRO HD3 1 34 GLU H . . 4.940 3.986 3.710 4.195 . 0 0 "[ . 1 . 2]" 1
637 1 35 GLN H 1 36 PRO QD . . 4.400 3.983 3.132 4.406 0.006 17 0 "[ . 1 . 2]" 1
638 1 27 VAL HA 1 58 ALA HA . . 4.510 4.494 4.355 4.551 0.041 7 0 "[ . 1 . 2]" 1
639 1 27 VAL H 1 58 ALA HA . . 3.490 2.957 2.713 3.139 . 0 0 "[ . 1 . 2]" 1
640 1 57 ALA H 1 58 ALA HA . . 5.060 4.629 4.496 4.708 . 0 0 "[ . 1 . 2]" 1
641 1 58 ALA HA 1 59 TYR H . . 2.740 2.321 2.247 2.365 . 0 0 "[ . 1 . 2]" 1
642 1 57 ALA HA 1 58 ALA HA . . 4.380 4.407 4.398 4.417 0.037 2 0 "[ . 1 . 2]" 1
643 1 27 VAL HB 1 58 ALA HA . . 4.040 2.055 1.976 2.165 . 0 0 "[ . 1 . 2]" 1
644 1 29 LEU HG 1 58 ALA HA . . 4.690 4.652 4.535 4.721 0.031 14 0 "[ . 1 . 2]" 1
645 1 27 VAL MG1 1 58 ALA HA . . 3.260 3.311 3.295 3.337 0.077 9 0 "[ . 1 . 2]" 1
646 1 29 LEU QD 1 33 PRO HD2 . . 5.330 4.266 3.749 4.577 . 0 0 "[ . 1 . 2]" 1
647 1 69 GLN HE21 1 70 GLY HA2 . . 4.950 4.569 3.263 4.988 0.038 11 0 "[ . 1 . 2]" 1
648 1 39 GLY QA 1 40 PHE HA . . 4.170 3.916 1.988 4.093 . 0 0 "[ . 1 . 2]" 1
649 1 16 LEU MD1 1 70 GLY HA3 . . 4.570 2.489 2.221 2.965 . 0 0 "[ . 1 . 2]" 1
650 1 52 GLY HA2 1 53 VAL MG2 . . 5.500 4.543 4.342 4.722 . 0 0 "[ . 1 . 2]" 1
651 1 52 GLY HA2 1 117 ALA MB . . 3.890 3.003 2.806 3.385 . 0 0 "[ . 1 . 2]" 1
652 1 39 GLY QA 1 40 PHE QE . . 4.450 4.298 3.544 4.503 0.053 13 0 "[ . 1 . 2]" 1
653 1 52 GLY HA3 1 117 ALA MB . . 4.030 2.421 2.269 2.789 . 0 0 "[ . 1 . 2]" 1
654 1 23 ASP HB3 1 25 VAL H . . 4.890 2.292 2.123 2.454 . 0 0 "[ . 1 . 2]" 1
655 1 103 GLY HA2 1 106 VAL HB . . 5.450 4.085 3.893 4.279 . 0 0 "[ . 1 . 2]" 1
656 1 20 VAL MG2 1 87 GLY HA2 . . 5.340 2.380 2.201 2.646 . 0 0 "[ . 1 . 2]" 1
657 1 20 VAL MG1 1 87 GLY HA2 . . 5.460 3.657 3.549 3.773 . 0 0 "[ . 1 . 2]" 1
658 1 21 LYS QG 1 87 GLY HA2 . . 4.790 4.196 3.286 4.883 0.093 2 0 "[ . 1 . 2]" 1
659 1 103 GLY HA3 1 106 VAL MG1 . . 4.700 4.716 4.698 4.736 0.036 15 0 "[ . 1 . 2]" 1
660 1 20 VAL HB 1 87 GLY HA3 . . 4.480 3.568 3.455 3.667 . 0 0 "[ . 1 . 2]" 1
661 1 21 LYS HD2 1 87 GLY HA3 . . 4.520 2.102 1.963 2.261 . 0 0 "[ . 1 . 2]" 1
662 1 21 LYS QG 1 87 GLY HA3 . . 4.650 3.452 2.458 4.292 . 0 0 "[ . 1 . 2]" 1
663 1 29 LEU HB2 1 41 SER HB2 . . 4.940 3.354 2.339 4.346 . 0 0 "[ . 1 . 2]" 1
664 1 29 LEU HB2 1 41 SER HB3 . . 4.700 3.790 2.741 4.375 . 0 0 "[ . 1 . 2]" 1
665 1 29 LEU HB2 1 81 PRO HG2 . . 5.000 5.156 5.101 5.213 0.213 10 0 "[ . 1 . 2]" 1
666 1 29 LEU HB3 1 41 SER HB3 . . 4.550 4.460 3.717 4.671 0.121 19 0 "[ . 1 . 2]" 1
667 1 29 LEU HB3 1 30 LYS H . . 4.100 3.413 2.999 3.597 . 0 0 "[ . 1 . 2]" 1
668 1 29 LEU HB3 1 30 LYS QG . . 4.790 4.685 4.205 4.826 0.036 11 0 "[ . 1 . 2]" 1
669 1 11 GLY HA2 1 16 LEU MD2 . . 4.330 3.002 2.057 3.535 . 0 0 "[ . 1 . 2]" 1
670 1 7 ALA MB 1 8 GLY QA . . 4.290 3.846 3.522 4.295 0.005 14 0 "[ . 1 . 2]" 1
671 1 11 GLY HA3 1 16 LEU MD2 . . 4.830 4.255 3.288 4.871 0.041 17 0 "[ . 1 . 2]" 1
672 1 91 GLY HA2 1 95 ILE MG . . 4.050 3.388 2.961 3.627 . 0 0 "[ . 1 . 2]" 1
673 1 91 GLY HA3 1 95 ILE MG . . 4.390 2.702 2.359 4.170 . 0 0 "[ . 1 . 2]" 1
674 1 90 VAL MG2 1 91 GLY HA3 . . 5.500 5.225 4.277 5.559 0.059 4 0 "[ . 1 . 2]" 1
675 1 31 GLY HA2 1 37 GLN QG . . 4.180 3.820 3.375 4.214 0.034 3 0 "[ . 1 . 2]" 1
676 1 31 GLY HA2 1 32 THR MG . . 4.760 3.500 3.177 3.983 . 0 0 "[ . 1 . 2]" 1
677 1 31 GLY HA2 1 37 GLN HA . . 4.180 4.255 4.201 4.321 0.141 7 0 "[ . 1 . 2]" 1
678 1 31 GLY HA3 1 37 GLN H . . 4.220 3.582 2.763 4.032 . 0 0 "[ . 1 . 2]" 1
679 1 31 GLY HA3 1 60 ASN QD . . 4.300 3.934 3.579 4.099 . 0 0 "[ . 1 . 2]" 1
680 1 31 GLY HA3 1 37 GLN HB3 . . 4.510 2.138 2.002 2.545 . 0 0 "[ . 1 . 2]" 1
681 1 91 GLY HA3 1 95 ILE HB . . 4.220 2.748 2.239 4.234 0.014 19 0 "[ . 1 . 2]" 1
682 1 82 GLN HA 1 92 GLY HA2 . . 4.710 2.226 2.019 2.494 . 0 0 "[ . 1 . 2]" 1
683 1 49 ARG HB2 1 49 ARG QD . . 3.700 2.771 2.282 3.108 . 0 0 "[ . 1 . 2]" 1
684 1 68 ARG H 1 68 ARG QD . . 4.830 4.337 3.986 4.705 . 0 0 "[ . 1 . 2]" 1
685 1 68 ARG QD 1 69 GLN H . . 5.340 4.648 4.262 4.926 . 0 0 "[ . 1 . 2]" 1
686 1 85 LEU HB3 1 85 LEU MD2 . . 3.660 2.259 2.231 2.281 . 0 0 "[ . 1 . 2]" 1
687 1 54 ARG H 1 54 ARG QD . . 4.470 3.125 2.174 4.315 . 0 0 "[ . 1 . 2]" 1
688 1 54 ARG HA 1 54 ARG QD . . 3.910 3.867 3.710 4.023 0.113 12 0 "[ . 1 . 2]" 1
689 1 54 ARG HB2 1 54 ARG QD . . 3.130 2.642 2.155 3.199 0.069 15 0 "[ . 1 . 2]" 1
690 1 46 GLN HA 1 49 ARG QD . . 4.490 2.764 2.191 3.745 . 0 0 "[ . 1 . 2]" 1
691 1 24 LYS QE 1 24 LYS HG2 . . 3.200 2.794 2.422 3.261 0.061 10 0 "[ . 1 . 2]" 1
692 1 24 LYS QE 1 24 LYS HG3 . . 3.780 2.447 2.108 3.037 . 0 0 "[ . 1 . 2]" 1
693 1 24 LYS QE 1 114 ILE MD . . 4.510 4.073 3.536 4.519 0.009 17 0 "[ . 1 . 2]" 1
694 1 64 ASP HB2 1 67 LEU QD . . 3.710 2.279 2.126 2.623 . 0 0 "[ . 1 . 2]" 1
695 1 64 ASP HB2 1 67 LEU H . . 4.330 3.062 2.614 3.602 . 0 0 "[ . 1 . 2]" 1
696 1 64 ASP HB3 1 67 LEU QD . . 4.940 3.386 2.624 3.882 . 0 0 "[ . 1 . 2]" 1
697 1 47 ILE QG 1 50 LEU HB2 . . 4.930 4.388 4.286 4.490 . 0 0 "[ . 1 . 2]" 1
698 1 112 LEU HB3 1 112 LEU MD1 . . 3.440 2.401 2.281 2.625 . 0 0 "[ . 1 . 2]" 1
699 1 19 LEU HB2 1 19 LEU MD1 . . 3.430 2.249 2.173 2.603 . 0 0 "[ . 1 . 2]" 1
700 1 119 LEU HB2 1 119 LEU MD2 . . 3.010 2.800 2.617 2.930 . 0 0 "[ . 1 . 2]" 1
701 1 116 SER HB3 1 119 LEU HB2 . . 4.650 4.128 2.760 4.397 . 0 0 "[ . 1 . 2]" 1
702 1 19 LEU H 1 19 LEU HB3 . . 3.660 3.165 2.913 3.288 . 0 0 "[ . 1 . 2]" 1
703 1 18 ALA H 1 19 LEU HB3 . . 5.180 5.266 5.212 5.293 0.113 5 0 "[ . 1 . 2]" 1
704 1 19 LEU HB3 1 59 TYR QE . . 4.790 4.685 3.340 4.885 0.095 19 0 "[ . 1 . 2]" 1
705 1 19 LEU HB3 1 19 LEU MD2 . . 3.490 2.336 2.119 2.979 . 0 0 "[ . 1 . 2]" 1
706 1 20 VAL MG2 1 84 TYR HB2 . . 5.500 4.217 3.972 4.525 . 0 0 "[ . 1 . 2]" 1
707 1 84 TYR HB2 1 85 LEU H . . 5.450 4.172 4.042 4.315 . 0 0 "[ . 1 . 2]" 1
708 1 19 LEU MD2 1 22 LYS QE . . 4.020 3.199 2.132 4.034 0.014 10 0 "[ . 1 . 2]" 1
709 1 106 VAL HA 1 110 LYS HE3 . . 5.500 4.188 3.842 4.533 . 0 0 "[ . 1 . 2]" 1
710 1 50 LEU HB2 1 50 LEU MD1 . . 3.480 2.227 2.193 2.248 . 0 0 "[ . 1 . 2]" 1
711 1 64 ASP HB2 1 67 LEU QB . . 4.170 2.517 2.235 2.784 . 0 0 "[ . 1 . 2]" 1
712 1 67 LEU QB 1 68 ARG QB . . 4.980 3.824 3.627 4.034 . 0 0 "[ . 1 . 2]" 1
713 1 27 VAL MG2 1 28 PHE HB2 . . 5.050 5.193 5.184 5.206 0.156 11 0 "[ . 1 . 2]" 1
714 1 59 TYR HB2 1 67 LEU QD . . 5.350 3.875 3.638 4.065 . 0 0 "[ . 1 . 2]" 1
715 1 99 MET HB3 1 104 ASP QB . . 3.580 2.807 2.298 3.143 . 0 0 "[ . 1 . 2]" 1
716 1 120 ASP HB2 1 121 GLU H . . 4.460 4.443 4.253 4.510 0.050 15 0 "[ . 1 . 2]" 1
717 1 30 LYS HA 1 62 LEU HB2 . . 4.890 4.370 4.244 4.630 . 0 0 "[ . 1 . 2]" 1
718 1 47 ILE MD 1 96 LEU HB2 . . 4.350 4.300 4.046 4.370 0.020 6 0 "[ . 1 . 2]" 1
719 1 62 LEU H 1 62 LEU HB3 . . 4.000 3.574 2.655 3.677 . 0 0 "[ . 1 . 2]" 1
720 1 62 LEU HB3 1 62 LEU MD2 . . 3.590 2.356 2.297 2.531 . 0 0 "[ . 1 . 2]" 1
721 1 96 LEU HB3 1 97 LEU H . . 4.330 2.822 2.595 3.183 . 0 0 "[ . 1 . 2]" 1
722 1 96 LEU HB3 1 97 LEU MD2 . . 5.420 4.050 3.209 4.524 . 0 0 "[ . 1 . 2]" 1
723 1 59 TYR HB2 1 61 VAL MG1 . . 5.500 3.691 3.063 4.047 . 0 0 "[ . 1 . 2]" 1
724 1 28 PHE HA 1 59 TYR HB2 . . 4.190 2.488 2.198 2.673 . 0 0 "[ . 1 . 2]" 1
725 1 29 LEU H 1 59 TYR HB2 . . 4.740 3.958 3.555 4.183 . 0 0 "[ . 1 . 2]" 1
726 1 104 ASP QB 1 105 LEU HA . . 4.430 4.191 4.030 4.400 . 0 0 "[ . 1 . 2]" 1
727 1 28 PHE QE 1 59 TYR HB3 . . 5.440 4.024 3.629 4.188 . 0 0 "[ . 1 . 2]" 1
728 1 59 TYR HB3 1 67 LEU QD . . 3.730 2.610 2.330 2.964 . 0 0 "[ . 1 . 2]" 1
729 1 80 ILE H 1 80 ILE HB . . 3.560 2.996 2.245 3.704 0.144 12 0 "[ . 1 . 2]" 1
730 1 80 ILE HB 1 81 PRO HA . . 5.500 4.828 3.058 5.512 0.012 5 0 "[ . 1 . 2]" 1
731 1 30 LYS HA 1 62 LEU HB3 . . 5.250 5.144 3.029 5.339 0.089 17 0 "[ . 1 . 2]" 1
732 1 100 HIS HA 1 105 LEU QB . . 4.300 3.298 3.219 3.421 . 0 0 "[ . 1 . 2]" 1
733 1 100 HIS H 1 105 LEU QB . . 5.210 5.071 4.987 5.184 . 0 0 "[ . 1 . 2]" 1
734 1 99 MET HB3 1 105 LEU QB . . 5.030 4.295 4.127 4.390 . 0 0 "[ . 1 . 2]" 1
735 1 94 ASP QB 1 95 ILE HB . . 4.810 4.787 4.482 4.844 0.034 13 0 "[ . 1 . 2]" 1
736 1 56 TYR HB3 1 58 ALA HA . . 5.130 5.320 5.286 5.359 0.229 9 0 "[ . 1 . 2]" 1
737 1 48 LEU H 1 48 LEU HB2 . . 4.010 2.336 2.314 2.368 . 0 0 "[ . 1 . 2]" 1
738 1 109 LEU HB3 1 110 LYS H . . 4.710 3.523 3.438 3.642 . 0 0 "[ . 1 . 2]" 1
739 1 13 ALA HA 1 16 LEU HB2 . . 4.180 2.397 2.185 2.945 . 0 0 "[ . 1 . 2]" 1
740 1 16 LEU HB2 1 74 TYR HB2 . . 4.640 3.863 3.399 4.550 . 0 0 "[ . 1 . 2]" 1
741 1 48 LEU HB3 1 56 TYR QD . . 4.770 3.009 2.850 3.217 . 0 0 "[ . 1 . 2]" 1
742 1 86 ASN HB2 1 87 GLY H . . 4.970 4.573 4.470 4.634 . 0 0 "[ . 1 . 2]" 1
743 1 25 VAL MG1 1 56 TYR HB3 . . 4.280 2.665 2.619 2.742 . 0 0 "[ . 1 . 2]" 1
744 1 86 ASN HB3 1 87 GLY H . . 4.630 4.310 4.200 4.376 . 0 0 "[ . 1 . 2]" 1
745 1 85 LEU HA 1 86 ASN HB3 . . 5.040 5.060 4.914 5.142 0.102 20 0 "[ . 1 . 2]" 1
746 1 109 LEU MD2 1 114 ILE HB . . 4.440 2.370 2.234 2.467 . 0 0 "[ . 1 . 2]" 1
747 1 114 ILE H 1 114 ILE HB . . 3.320 2.588 2.447 2.678 . 0 0 "[ . 1 . 2]" 1
748 1 109 LEU HA 1 114 ILE HB . . 4.000 3.098 2.839 3.602 . 0 0 "[ . 1 . 2]" 1
749 1 40 PHE HB3 1 41 SER H . . 4.930 4.062 3.083 4.767 . 0 0 "[ . 1 . 2]" 1
750 1 60 ASN HB2 1 67 LEU QD . . 5.500 5.369 4.853 5.438 . 0 0 "[ . 1 . 2]" 1
751 1 89 PHE HB2 1 90 VAL H . . 4.640 3.880 3.659 4.128 . 0 0 "[ . 1 . 2]" 1
752 1 84 TYR QD 1 89 PHE HB2 . . 4.210 2.993 2.365 3.868 . 0 0 "[ . 1 . 2]" 1
753 1 102 ASN HB3 1 102 ASN HD22 . . 4.060 3.673 3.408 4.075 0.015 8 0 "[ . 1 . 2]" 1
754 1 84 TYR QD 1 89 PHE HB3 . . 5.420 4.398 3.883 5.072 . 0 0 "[ . 1 . 2]" 1
755 1 76 ASN HB2 1 77 TRP HE3 . . 4.570 4.577 4.413 4.609 0.039 3 0 "[ . 1 . 2]" 1
756 1 40 PHE QD 1 81 PRO HB2 . . 5.500 4.733 3.568 5.484 . 0 0 "[ . 1 . 2]" 1
757 1 41 SER HA 1 81 PRO HB2 . . 4.560 4.122 3.681 4.572 0.012 7 0 "[ . 1 . 2]" 1
758 1 44 VAL MG1 1 81 PRO HB2 . . 3.980 3.034 2.151 3.987 0.007 8 0 "[ . 1 . 2]" 1
759 1 29 LEU HA 1 81 PRO HB3 . . 5.030 2.767 2.026 3.840 . 0 0 "[ . 1 . 2]" 1
760 1 29 LEU QD 1 81 PRO HB3 . . 4.380 3.079 2.123 3.714 . 0 0 "[ . 1 . 2]" 1
761 1 41 SER HA 1 81 PRO HB3 . . 4.730 4.204 3.145 4.762 0.032 18 0 "[ . 1 . 2]" 1
762 1 47 ILE HB 1 96 LEU QD . . 3.980 2.537 2.314 2.725 . 0 0 "[ . 1 . 2]" 1
763 1 67 LEU HA 1 71 ILE HB . . 5.030 4.380 4.095 4.797 . 0 0 "[ . 1 . 2]" 1
764 1 71 ILE HB 1 74 TYR HB3 . . 5.500 4.797 4.563 5.013 . 0 0 "[ . 1 . 2]" 1
765 1 16 LEU MD1 1 71 ILE HB . . 4.840 3.189 2.733 3.854 . 0 0 "[ . 1 . 2]" 1
766 1 47 ILE HB 1 48 LEU H . . 3.830 2.773 2.721 2.839 . 0 0 "[ . 1 . 2]" 1
767 1 46 GLN H 1 47 ILE HB . . 4.980 4.921 4.782 4.995 0.015 9 0 "[ . 1 . 2]" 1
768 1 44 VAL HA 1 47 ILE HB . . 3.420 2.856 2.607 3.045 . 0 0 "[ . 1 . 2]" 1
769 1 44 VAL MG1 1 47 ILE HB . . 4.620 4.480 4.200 4.640 0.020 19 0 "[ . 1 . 2]" 1
770 1 92 GLY H 1 95 ILE HB . . 3.960 2.598 2.024 3.038 . 0 0 "[ . 1 . 2]" 1
771 1 91 GLY HA2 1 95 ILE HB . . 3.630 3.604 3.018 3.676 0.046 12 0 "[ . 1 . 2]" 1
772 1 66 GLU HA 1 66 GLU HG2 . . 3.570 3.071 2.533 3.615 0.045 3 0 "[ . 1 . 2]" 1
773 1 12 SER HB3 1 14 GLU QG . . 4.470 2.666 2.121 3.449 . 0 0 "[ . 1 . 2]" 1
774 1 66 GLU H 1 66 GLU HG3 . . 3.700 2.905 1.787 3.516 . 0 0 "[ . 1 . 2]" 1
775 1 106 VAL MG1 1 107 GLU QG . . 5.500 4.480 4.192 5.915 0.415 15 0 "[ . 1 . 2]" 1
776 1 88 GLU H 1 88 GLU HG3 . . 4.560 4.576 4.507 4.608 0.048 5 0 "[ . 1 . 2]" 1
777 1 108 GLU H 1 108 GLU HG2 . . 5.220 4.311 2.524 4.696 . 0 0 "[ . 1 . 2]" 1
778 1 26 VAL HB 1 84 TYR HB2 . . 3.800 3.080 2.548 3.848 0.048 16 0 "[ . 1 . 2]" 1
779 1 27 VAL HB 1 58 ALA H . . 4.690 4.509 4.401 4.656 . 0 0 "[ . 1 . 2]" 1
780 1 27 VAL H 1 27 VAL HB . . 3.230 2.581 2.495 2.654 . 0 0 "[ . 1 . 2]" 1
781 1 27 VAL HB 1 29 LEU HG . . 4.260 4.302 4.259 4.334 0.074 9 0 "[ . 1 . 2]" 1
782 1 27 VAL HB 1 48 LEU MD1 . . 5.400 4.164 4.082 4.379 . 0 0 "[ . 1 . 2]" 1
783 1 107 GLU QG 1 108 GLU H . . 3.820 3.770 1.987 3.893 0.073 2 0 "[ . 1 . 2]" 1
784 1 82 GLN HB2 1 82 GLN HE21 . . 4.630 4.213 3.298 4.576 . 0 0 "[ . 1 . 2]" 1
785 1 100 HIS HD2 1 101 GLN HG2 . . 4.460 1.929 1.908 1.952 . 0 0 "[ . 1 . 2]" 1
786 1 97 LEU MD2 1 101 GLN HG2 . . 5.130 5.132 4.969 5.164 0.034 12 0 "[ . 1 . 2]" 1
787 1 98 GLN HA 1 98 GLN HG2 . . 3.870 3.532 3.293 3.611 . 0 0 "[ . 1 . 2]" 1
788 1 97 LEU QB 1 98 GLN HG2 . . 4.520 3.800 3.248 4.029 . 0 0 "[ . 1 . 2]" 1
789 1 97 LEU MD1 1 101 GLN HG3 . . 4.500 3.048 2.403 3.488 . 0 0 "[ . 1 . 2]" 1
790 1 101 GLN H 1 101 GLN HG3 . . 4.020 2.314 2.161 2.448 . 0 0 "[ . 1 . 2]" 1
791 1 95 ILE HA 1 98 GLN HG3 . . 4.430 3.318 3.078 3.731 . 0 0 "[ . 1 . 2]" 1
792 1 15 GLN HG2 1 16 LEU MD2 . . 4.990 3.308 3.013 4.380 . 0 0 "[ . 1 . 2]" 1
793 1 15 GLN HG2 1 16 LEU H . . 4.130 4.176 4.147 4.219 0.089 13 0 "[ . 1 . 2]" 1
794 1 15 GLN HA 1 15 GLN HG3 . . 3.610 3.360 3.276 3.479 . 0 0 "[ . 1 . 2]" 1
795 1 15 GLN HG3 1 16 LEU MD2 . . 4.820 2.539 2.173 4.368 . 0 0 "[ . 1 . 2]" 1
796 1 96 LEU HA 1 99 MET HB2 . . 4.850 2.541 2.378 2.739 . 0 0 "[ . 1 . 2]" 1
797 1 96 LEU HA 1 99 MET HB3 . . 4.600 4.219 4.062 4.386 . 0 0 "[ . 1 . 2]" 1
798 1 99 MET HB3 1 105 LEU HG . . 3.850 2.440 2.345 2.550 . 0 0 "[ . 1 . 2]" 1
799 1 30 LYS HD3 1 38 CYS HB2 . . 4.680 3.843 2.842 4.393 . 0 0 "[ . 1 . 2]" 1
800 1 37 GLN HE22 1 38 CYS HB3 . . 5.120 4.023 2.899 5.006 . 0 0 "[ . 1 . 2]" 1
801 1 30 LYS HD2 1 38 CYS HB3 . . 3.750 3.473 2.928 3.782 0.032 11 0 "[ . 1 . 2]" 1
802 1 37 GLN QG 1 38 CYS H . . 3.870 2.015 1.603 2.683 . 0 0 "[ . 1 . 2]" 1
803 1 31 GLY HA3 1 37 GLN QG . . 3.760 2.758 2.158 3.810 0.050 14 0 "[ . 1 . 2]" 1
804 1 30 LYS QG 1 37 GLN QG . . 3.640 3.453 2.017 4.478 0.838 12 6 "[ * * * *- + . 2]" 1
805 1 35 GLN HB2 1 35 GLN QG . . 2.690 2.396 2.161 2.469 . 0 0 "[ . 1 . 2]" 1
806 1 83 VAL HB 1 84 TYR H . . 4.430 4.105 4.014 4.212 . 0 0 "[ . 1 . 2]" 1
807 1 30 LYS HD2 1 38 CYS HB2 . . 3.930 3.750 3.164 4.015 0.085 11 0 "[ . 1 . 2]" 1
808 1 30 LYS HD3 1 38 CYS HB3 . . 4.420 4.213 3.417 4.505 0.085 11 0 "[ . 1 . 2]" 1
809 1 46 GLN H 1 46 GLN QG . . 3.320 2.516 2.392 2.714 . 0 0 "[ . 1 . 2]" 1
810 1 46 GLN HA 1 46 GLN QG . . 3.460 2.827 2.578 3.222 . 0 0 "[ . 1 . 2]" 1
811 1 24 LYS HB2 1 112 LEU MD1 . . 3.740 2.556 2.015 3.329 . 0 0 "[ . 1 . 2]" 1
812 1 24 LYS HB2 1 86 ASN HB2 . . 4.910 4.707 4.106 4.922 0.012 10 0 "[ . 1 . 2]" 1
813 1 22 LYS HA 1 22 LYS HB2 . . 2.980 2.988 2.847 3.024 0.044 12 0 "[ . 1 . 2]" 1
814 1 22 LYS HB2 1 22 LYS QE . . 4.290 3.809 2.962 4.157 . 0 0 "[ . 1 . 2]" 1
815 1 19 LEU MD2 1 22 LYS HB2 . . 5.030 3.950 2.683 4.953 . 0 0 "[ . 1 . 2]" 1
816 1 21 LYS HB2 1 21 LYS QE . . 4.380 3.855 3.382 4.195 . 0 0 "[ . 1 . 2]" 1
817 1 24 LYS H 1 24 LYS HB3 . . 3.880 3.268 2.685 3.571 . 0 0 "[ . 1 . 2]" 1
818 1 24 LYS HB3 1 25 VAL MG2 . . 4.260 4.297 4.173 4.342 0.082 16 0 "[ . 1 . 2]" 1
819 1 22 LYS HB3 1 22 LYS QE . . 4.450 4.339 4.089 4.476 0.026 2 0 "[ . 1 . 2]" 1
820 1 90 VAL H 1 90 VAL HB . . 3.450 2.581 2.205 3.459 0.009 18 0 "[ . 1 . 2]" 1
821 1 90 VAL HB 1 91 GLY H . . 3.500 2.835 2.535 3.207 . 0 0 "[ . 1 . 2]" 1
822 1 84 TYR HA 1 90 VAL HB . . 4.660 2.963 2.237 4.709 0.049 17 0 "[ . 1 . 2]" 1
823 1 50 LEU H 1 51 HIS HB2 . . 4.940 4.619 4.546 4.673 . 0 0 "[ . 1 . 2]" 1
824 1 51 HIS HB2 1 116 SER HA . . 4.900 4.733 4.531 4.914 0.014 15 0 "[ . 1 . 2]" 1
825 1 51 HIS HB3 1 117 ALA H . . 5.040 3.902 3.670 4.022 . 0 0 "[ . 1 . 2]" 1
826 1 51 HIS HB3 1 53 VAL MG2 . . 4.240 2.802 2.584 3.005 . 0 0 "[ . 1 . 2]" 1
827 1 5 MET HB2 1 5 MET HG2 . . 2.400 2.452 2.410 2.514 0.114 8 0 "[ . 1 . 2]" 1
828 1 30 LYS HB2 1 62 LEU MD2 . . 3.810 2.363 2.187 3.849 0.039 9 0 "[ . 1 . 2]" 1
829 1 65 PRO HB3 1 66 GLU H . . 4.220 4.268 4.224 4.304 0.084 8 0 "[ . 1 . 2]" 1
830 1 4 THR HB 1 5 MET HG3 . . 3.330 3.345 3.257 3.396 0.066 4 0 "[ . 1 . 2]" 1
831 1 88 GLU HB3 1 89 PHE H . . 4.430 3.922 3.703 4.107 . 0 0 "[ . 1 . 2]" 1
832 1 72 LYS HB3 1 73 ASP H . . 4.520 3.575 3.398 3.698 . 0 0 "[ . 1 . 2]" 1
833 1 100 HIS HB2 1 101 GLN HB2 . . 5.200 5.329 5.297 5.358 0.158 20 0 "[ . 1 . 2]" 1
834 1 97 LEU MD1 1 100 HIS HB2 . . 5.170 4.693 4.397 4.911 . 0 0 "[ . 1 . 2]" 1
835 1 96 LEU HG 1 100 HIS HB3 . . 5.250 5.164 4.645 5.285 0.035 20 0 "[ . 1 . 2]" 1
836 1 99 MET HA 1 99 MET HG2 . . 4.180 2.431 2.343 2.466 . 0 0 "[ . 1 . 2]" 1
837 1 96 LEU HA 1 99 MET HG2 . . 5.160 5.127 4.966 5.184 0.024 1 0 "[ . 1 . 2]" 1
838 1 98 GLN H 1 99 MET HG3 . . 5.240 4.081 3.967 4.411 . 0 0 "[ . 1 . 2]" 1
839 1 33 PRO HB3 1 45 VAL MG2 . . 3.950 2.361 2.096 2.853 . 0 0 "[ . 1 . 2]" 1
840 1 45 VAL H 1 45 VAL HB . . 3.150 2.357 2.225 2.447 . 0 0 "[ . 1 . 2]" 1
841 1 42 ASN HA 1 45 VAL HB . . 3.300 2.480 2.351 2.557 . 0 0 "[ . 1 . 2]" 1
842 1 106 VAL HB 1 108 GLU H . . 5.500 4.975 4.613 5.192 . 0 0 "[ . 1 . 2]" 1
843 1 106 VAL H 1 106 VAL HB . . 3.020 2.585 2.489 2.722 . 0 0 "[ . 1 . 2]" 1
844 1 44 VAL H 1 44 VAL HB . . 3.340 3.470 3.454 3.480 0.140 10 0 "[ . 1 . 2]" 1
845 1 121 GLU HB2 1 121 GLU QG . . 2.600 2.342 2.124 2.476 . 0 0 "[ . 1 . 2]" 1
846 1 72 LYS HB2 1 73 ASP HB2 . . 4.560 4.429 4.228 4.596 0.036 20 0 "[ . 1 . 2]" 1
847 1 33 PRO HB2 1 45 VAL MG2 . . 4.230 3.145 2.312 3.776 . 0 0 "[ . 1 . 2]" 1
848 1 54 ARG HB3 1 54 ARG QD . . 3.860 2.776 2.119 3.588 . 0 0 "[ . 1 . 2]" 1
849 1 30 LYS HB3 1 31 GLY H . . 5.270 4.610 4.527 4.767 . 0 0 "[ . 1 . 2]" 1
850 1 30 LYS HB3 1 61 VAL MG2 . . 4.250 2.494 2.130 3.089 . 0 0 "[ . 1 . 2]" 1
851 1 61 VAL HB 1 68 ARG H . . 4.940 3.461 3.146 3.791 . 0 0 "[ . 1 . 2]" 1
852 1 61 VAL HB 1 68 ARG QD . . 4.820 4.612 3.797 4.851 0.031 3 0 "[ . 1 . 2]" 1
853 1 61 VAL HB 1 67 LEU H . . 5.500 5.329 4.973 5.516 0.016 15 0 "[ . 1 . 2]" 1
854 1 61 VAL HB 1 68 ARG HG3 . . 4.670 3.492 2.627 4.045 . 0 0 "[ . 1 . 2]" 1
855 1 65 PRO HB2 1 68 ARG QB . . 4.810 4.021 3.715 4.405 . 0 0 "[ . 1 . 2]" 1
856 1 48 LEU HB3 1 53 VAL HB . . 3.700 2.592 2.347 2.971 . 0 0 "[ . 1 . 2]" 1
857 1 69 GLN HA 1 72 LYS HD3 . . 4.530 3.285 2.475 4.533 0.003 13 0 "[ . 1 . 2]" 1
858 1 37 GLN H 1 37 GLN HB2 . . 4.140 3.528 3.432 3.635 . 0 0 "[ . 1 . 2]" 1
859 1 49 ARG HB3 1 50 LEU H . . 4.110 4.000 3.750 4.124 0.014 2 0 "[ . 1 . 2]" 1
860 1 24 LYS HA 1 24 LYS HD2 . . 4.260 4.112 3.910 4.301 0.041 3 0 "[ . 1 . 2]" 1
861 1 24 LYS HD2 1 114 ILE MD . . 4.400 4.197 3.708 4.434 0.034 4 0 "[ . 1 . 2]" 1
862 1 24 LYS HD2 1 25 VAL MG1 . . 4.950 4.820 4.551 4.983 0.033 5 0 "[ . 1 . 2]" 1
863 1 30 LYS HA 1 30 LYS HD3 . . 4.970 4.779 4.541 4.974 0.004 20 0 "[ . 1 . 2]" 1
864 1 24 LYS H 1 24 LYS HD3 . . 4.450 3.771 3.602 3.915 . 0 0 "[ . 1 . 2]" 1
865 1 111 LYS H 1 111 LYS QD . . 3.850 3.649 3.280 3.915 0.065 14 0 "[ . 1 . 2]" 1
866 1 110 LYS QD 1 110 LYS HG2 . . 2.670 2.329 2.265 2.540 . 0 0 "[ . 1 . 2]" 1
867 1 19 LEU MD2 1 22 LYS QD . . 4.790 3.393 2.295 4.407 . 0 0 "[ . 1 . 2]" 1
868 1 47 ILE H 1 47 ILE QG . . 3.840 2.366 2.295 2.460 . 0 0 "[ . 1 . 2]" 1
869 1 31 GLY HA2 1 37 GLN HB3 . . 4.430 2.508 2.161 2.947 . 0 0 "[ . 1 . 2]" 1
870 1 30 LYS QG 1 37 GLN HB3 . . 5.180 4.314 3.839 5.178 . 0 0 "[ . 1 . 2]" 1
871 1 114 ILE HA 1 115 HIS HB2 . . 4.720 4.097 3.789 4.324 . 0 0 "[ . 1 . 2]" 1
872 1 115 HIS H 1 115 HIS HB3 . . 3.860 2.477 2.282 2.730 . 0 0 "[ . 1 . 2]" 1
873 1 114 ILE HA 1 115 HIS HB3 . . 4.650 4.506 4.302 4.666 0.016 13 0 "[ . 1 . 2]" 1
874 1 114 ILE MG 1 115 HIS HB3 . . 4.650 3.777 3.491 4.214 . 0 0 "[ . 1 . 2]" 1
875 1 66 GLU H 1 66 GLU HB2 . . 3.420 2.410 2.245 2.698 . 0 0 "[ . 1 . 2]" 1
876 1 107 GLU QB 1 108 GLU H . . 3.400 2.536 2.228 2.922 . 0 0 "[ . 1 . 2]" 1
877 1 107 GLU H 1 107 GLU QB . . 3.180 2.446 1.814 2.592 . 0 0 "[ . 1 . 2]" 1
878 1 14 GLU QG 1 15 GLN QB . . 2.900 3.419 3.102 3.730 0.830 17 11 "[* * * *1* ***+ -*]" 1
879 1 108 GLU H 1 108 GLU HB2 . . 3.480 2.239 2.125 2.371 . 0 0 "[ . 1 . 2]" 1
880 1 107 GLU H 1 108 GLU HB2 . . 4.530 4.550 4.537 4.571 0.041 16 0 "[ . 1 . 2]" 1
881 1 108 GLU HA 1 108 GLU HB2 . . 2.960 2.722 2.593 2.999 0.039 5 0 "[ . 1 . 2]" 1
882 1 105 LEU MD2 1 108 GLU HB2 . . 4.160 4.068 3.702 4.191 0.031 16 0 "[ . 1 . 2]" 1
883 1 105 LEU HA 1 108 GLU HB3 . . 4.040 3.059 2.589 4.078 0.038 11 0 "[ . 1 . 2]" 1
884 1 85 LEU MD2 1 108 GLU HB3 . . 4.180 2.742 2.096 3.329 . 0 0 "[ . 1 . 2]" 1
885 1 21 LYS HD3 1 87 GLY H . . 4.740 4.743 4.616 4.796 0.056 18 0 "[ . 1 . 2]" 1
886 1 95 ILE HA 1 95 ILE HG12 . . 4.050 2.975 2.136 3.333 . 0 0 "[ . 1 . 2]" 1
887 1 95 ILE H 1 95 ILE HG13 . . 4.380 3.491 2.294 3.948 . 0 0 "[ . 1 . 2]" 1
888 1 95 ILE HG13 1 96 LEU H . . 4.830 4.750 4.170 4.883 0.053 8 0 "[ . 1 . 2]" 1
889 1 95 ILE MG 1 98 GLN QB . . 4.480 3.436 3.296 3.573 . 0 0 "[ . 1 . 2]" 1
890 1 95 ILE HA 1 98 GLN QB . . 3.280 3.306 3.241 3.325 0.045 8 0 "[ . 1 . 2]" 1
891 1 69 GLN HB2 1 70 GLY H . . 3.640 3.678 3.376 3.721 0.081 13 0 "[ . 1 . 2]" 1
892 1 15 GLN QB 1 16 LEU MD2 . . 4.350 2.633 2.404 2.888 . 0 0 "[ . 1 . 2]" 1
893 1 35 GLN HA 1 36 PRO HG2 . . 4.560 4.399 4.086 4.588 0.028 3 0 "[ . 1 . 2]" 1
894 1 46 GLN QB 1 47 ILE H . . 3.920 2.561 2.368 2.777 . 0 0 "[ . 1 . 2]" 1
895 1 62 LEU HA 1 62 LEU HG . . 4.160 3.094 2.909 3.934 . 0 0 "[ . 1 . 2]" 1
896 1 49 ARG HA 1 49 ARG HG3 . . 4.030 3.694 3.549 3.801 . 0 0 "[ . 1 . 2]" 1
897 1 93 CYS H 1 93 CYS HB2 . . 3.980 2.281 2.137 2.507 . 0 0 "[ . 1 . 2]" 1
898 1 92 GLY HA2 1 93 CYS HB2 . . 4.930 4.486 4.282 4.776 . 0 0 "[ . 1 . 2]" 1
899 1 81 PRO HG2 1 93 CYS HB2 . . 4.870 2.740 2.368 3.300 . 0 0 "[ . 1 . 2]" 1
900 1 81 PRO HD2 1 93 CYS HB2 . . 4.480 2.640 2.060 3.591 . 0 0 "[ . 1 . 2]" 1
901 1 40 PHE HA 1 93 CYS HB3 . . 5.370 5.096 4.306 5.446 0.076 7 0 "[ . 1 . 2]" 1
902 1 92 GLY HA3 1 93 CYS HB3 . . 5.420 5.094 4.789 5.462 0.042 7 0 "[ . 1 . 2]" 1
903 1 81 PRO HG3 1 93 CYS HB3 . . 4.770 4.839 4.779 4.904 0.134 9 0 "[ . 1 . 2]" 1
904 1 46 GLN HA 1 50 LEU HG . . 3.580 3.564 3.302 3.615 0.035 16 0 "[ . 1 . 2]" 1
905 1 47 ILE HA 1 50 LEU HG . . 4.020 4.036 3.951 4.061 0.041 13 0 "[ . 1 . 2]" 1
906 1 49 ARG HG3 1 50 LEU HG . . 3.170 3.200 3.177 3.225 0.055 18 0 "[ . 1 . 2]" 1
907 1 96 LEU HG 1 100 HIS H . . 4.770 4.234 3.988 4.513 . 0 0 "[ . 1 . 2]" 1
908 1 96 LEU HA 1 96 LEU HG . . 4.220 2.723 2.415 3.006 . 0 0 "[ . 1 . 2]" 1
909 1 93 CYS HA 1 96 LEU HG . . 5.400 5.109 4.717 5.426 0.026 16 0 "[ . 1 . 2]" 1
910 1 44 VAL HA 1 96 LEU HG . . 4.820 4.653 4.447 4.829 0.009 4 0 "[ . 1 . 2]" 1
911 1 62 LEU HG 1 63 ASP H . . 4.440 4.405 3.173 4.497 0.057 20 0 "[ . 1 . 2]" 1
912 1 53 VAL HA 1 54 ARG QG . . 4.210 3.801 3.264 4.244 0.034 15 0 "[ . 1 . 2]" 1
913 1 68 ARG HG2 1 72 LYS QE . . 4.800 4.001 2.168 4.804 0.004 3 0 "[ . 1 . 2]" 1
914 1 115 HIS HA 1 119 LEU HG . . 5.500 5.227 4.021 5.559 0.059 3 0 "[ . 1 . 2]" 1
915 1 67 LEU HG 1 68 ARG H . . 5.020 4.592 4.413 5.055 0.035 5 0 "[ . 1 . 2]" 1
916 1 119 LEU H 1 119 LEU HG . . 3.570 3.660 3.618 3.724 0.154 10 0 "[ . 1 . 2]" 1
917 1 116 SER HB3 1 119 LEU HG . . 3.950 3.815 2.768 4.104 0.154 8 0 "[ . 1 . 2]" 1
918 1 67 LEU HA 1 67 LEU HG . . 4.090 3.053 2.517 3.231 . 0 0 "[ . 1 . 2]" 1
919 1 64 ASP HB2 1 67 LEU HG . . 5.500 2.713 2.279 4.645 . 0 0 "[ . 1 . 2]" 1
920 1 85 LEU HG 1 86 ASN H . . 4.870 3.484 3.339 3.658 . 0 0 "[ . 1 . 2]" 1
921 1 68 ARG H 1 68 ARG HG3 . . 4.540 4.276 4.085 4.442 . 0 0 "[ . 1 . 2]" 1
922 1 16 LEU H 1 16 LEU HG . . 3.460 3.520 3.492 3.537 0.077 18 0 "[ . 1 . 2]" 1
923 1 13 ALA HA 1 16 LEU HG . . 4.050 3.571 3.233 3.862 . 0 0 "[ . 1 . 2]" 1
924 1 68 ARG HA 1 68 ARG HG3 . . 3.660 2.464 2.284 2.604 . 0 0 "[ . 1 . 2]" 1
925 1 118 LEU H 1 118 LEU HG . . 3.630 2.232 2.018 2.486 . 0 0 "[ . 1 . 2]" 1
926 1 118 LEU HA 1 118 LEU HG . . 3.500 3.462 3.356 3.508 0.008 12 0 "[ . 1 . 2]" 1
927 1 30 LYS QG 1 37 GLN HE22 . . 5.500 2.752 2.205 3.836 . 0 0 "[ . 1 . 2]" 1
928 1 50 LEU H 1 50 LEU HG . . 3.330 2.525 2.400 2.614 . 0 0 "[ . 1 . 2]" 1
929 1 109 LEU HA 1 109 LEU HG . . 3.400 2.868 2.761 2.956 . 0 0 "[ . 1 . 2]" 1
930 1 48 LEU H 1 48 LEU HG . . 3.350 2.491 2.436 2.531 . 0 0 "[ . 1 . 2]" 1
931 1 48 LEU HA 1 48 LEU HG . . 4.080 2.762 2.674 2.827 . 0 0 "[ . 1 . 2]" 1
932 1 29 LEU HA 1 29 LEU HG . . 4.240 3.531 3.442 3.578 . 0 0 "[ . 1 . 2]" 1
933 1 80 ILE H 1 80 ILE HG13 . . 4.720 3.981 2.380 4.777 0.057 15 0 "[ . 1 . 2]" 1
934 1 105 LEU H 1 105 LEU HG . . 4.220 2.514 2.442 2.558 . 0 0 "[ . 1 . 2]" 1
935 1 24 LYS HA 1 24 LYS HG2 . . 3.850 3.870 3.689 3.963 0.113 7 0 "[ . 1 . 2]" 1
936 1 111 LYS H 1 111 LYS HG2 . . 3.740 3.476 1.866 3.781 0.041 5 0 "[ . 1 . 2]" 1
937 1 24 LYS HG3 1 25 VAL H . . 4.540 4.218 3.933 4.655 0.115 12 0 "[ . 1 . 2]" 1
938 1 30 LYS HA 1 62 LEU MD1 . . 3.910 3.603 3.211 3.866 . 0 0 "[ . 1 . 2]" 1
939 1 62 LEU HA 1 62 LEU MD1 . . 4.100 3.901 3.801 4.104 0.004 9 0 "[ . 1 . 2]" 1
940 1 30 LYS HB2 1 62 LEU MD1 . . 3.890 3.094 2.354 3.911 0.021 20 0 "[ . 1 . 2]" 1
941 1 29 LEU QD 1 41 SER HB3 . . 3.750 3.379 2.743 3.642 . 0 0 "[ . 1 . 2]" 1
942 1 109 LEU MD1 1 116 SER HB3 . . 5.110 3.663 3.305 3.976 . 0 0 "[ . 1 . 2]" 1
943 1 106 VAL MG2 1 109 LEU MD1 . . 4.400 3.270 3.138 3.456 . 0 0 "[ . 1 . 2]" 1
944 1 29 LEU QD 1 56 TYR QD . . 4.890 4.983 4.770 5.115 0.225 16 0 "[ . 1 . 2]" 1
945 1 96 LEU HA 1 105 LEU MD1 . . 3.640 3.274 3.083 3.424 . 0 0 "[ . 1 . 2]" 1
946 1 99 MET ME 1 105 LEU MD1 . . 4.360 4.366 4.342 4.383 0.023 4 0 "[ . 1 . 2]" 1
947 1 41 SER HA 1 81 PRO HG2 . . 4.240 3.599 2.258 4.233 . 0 0 "[ . 1 . 2]" 1
948 1 40 PHE HB3 1 81 PRO HG2 . . 5.480 3.393 2.099 5.397 . 0 0 "[ . 1 . 2]" 1
949 1 44 VAL MG1 1 81 PRO HG2 . . 4.400 3.231 2.647 3.782 . 0 0 "[ . 1 . 2]" 1
950 1 110 LYS H 1 110 LYS HG2 . . 4.510 3.731 2.864 4.050 . 0 0 "[ . 1 . 2]" 1
951 1 110 LYS H 1 110 LYS HG3 . . 5.040 2.701 2.287 4.276 . 0 0 "[ . 1 . 2]" 1
952 1 85 LEU HB3 1 85 LEU MD1 . . 3.280 3.227 3.200 3.246 . 0 0 "[ . 1 . 2]" 1
953 1 29 LEU QD 1 30 LYS H . . 4.820 4.114 3.999 4.280 . 0 0 "[ . 1 . 2]" 1
954 1 16 LEU MD1 1 70 GLY HA2 . . 3.840 3.543 3.138 3.848 0.008 1 0 "[ . 1 . 2]" 1
955 1 16 LEU MD1 1 71 ILE MD . . 4.010 2.378 2.098 2.625 . 0 0 "[ . 1 . 2]" 1
956 1 16 LEU MD1 1 74 TYR QE . . 4.830 4.426 4.128 4.758 . 0 0 "[ . 1 . 2]" 1
957 1 16 LEU MD1 1 28 PHE HZ . . 4.550 4.204 3.784 4.509 . 0 0 "[ . 1 . 2]" 1
958 1 16 LEU HA 1 16 LEU MD1 . . 4.570 2.285 2.171 2.425 . 0 0 "[ . 1 . 2]" 1
959 1 72 LYS H 1 72 LYS HG3 . . 4.510 2.494 2.403 2.578 . 0 0 "[ . 1 . 2]" 1
960 1 97 LEU MD1 1 101 GLN HE21 . . 4.440 2.366 2.035 2.746 . 0 0 "[ . 1 . 2]" 1
961 1 97 LEU HA 1 97 LEU MD1 . . 3.830 2.405 2.234 2.690 . 0 0 "[ . 1 . 2]" 1
962 1 85 LEU MD2 1 86 ASN HB2 . . 4.740 4.759 4.746 4.779 0.039 18 0 "[ . 1 . 2]" 1
963 1 85 LEU HB2 1 85 LEU MD2 . . 3.480 2.440 2.372 2.564 . 0 0 "[ . 1 . 2]" 1
964 1 51 HIS HD2 1 118 LEU MD1 . . 4.600 3.882 3.637 4.145 . 0 0 "[ . 1 . 2]" 1
965 1 19 LEU MD1 1 28 PHE QE . . 4.970 3.782 3.316 4.187 . 0 0 "[ . 1 . 2]" 1
966 1 19 LEU H 1 19 LEU MD1 . . 4.820 3.701 3.516 4.232 . 0 0 "[ . 1 . 2]" 1
967 1 16 LEU HA 1 19 LEU MD1 . . 4.230 2.573 2.344 3.044 . 0 0 "[ . 1 . 2]" 1
968 1 19 LEU MD1 1 22 LYS QE . . 4.910 4.249 3.587 4.912 0.002 4 0 "[ . 1 . 2]" 1
969 1 15 GLN HG2 1 19 LEU MD1 . . 5.000 3.691 3.431 4.769 . 0 0 "[ . 1 . 2]" 1
970 1 19 LEU MD1 1 67 LEU QD . . 4.280 2.114 2.014 2.284 . 0 0 "[ . 1 . 2]" 1
971 1 27 VAL MG1 1 48 LEU MD1 . . 3.520 2.847 2.676 3.156 . 0 0 "[ . 1 . 2]" 1
972 1 22 LYS HA 1 22 LYS HG2 . . 3.930 3.296 2.430 3.686 . 0 0 "[ . 1 . 2]" 1
973 1 22 LYS H 1 22 LYS HG3 . . 4.570 3.864 2.566 4.572 0.002 15 0 "[ . 1 . 2]" 1
974 1 22 LYS HA 1 22 LYS HG3 . . 3.990 2.625 2.474 3.552 . 0 0 "[ . 1 . 2]" 1
975 1 112 LEU H 1 112 LEU MD1 . . 4.390 3.955 3.490 4.319 . 0 0 "[ . 1 . 2]" 1
976 1 86 ASN HD21 1 112 LEU MD1 . . 4.060 3.045 2.410 4.095 0.035 11 0 "[ . 1 . 2]" 1
977 1 96 LEU H 1 96 LEU QD . . 4.330 3.477 3.059 3.617 . 0 0 "[ . 1 . 2]" 1
978 1 26 VAL QG 1 84 TYR HB2 . . 4.430 3.090 1.958 3.710 . 0 0 "[ . 1 . 2]" 1
979 1 26 VAL QG 1 57 ALA MB . . 3.990 2.244 2.026 2.529 . 0 0 "[ . 1 . 2]" 1
980 1 23 ASP H 1 26 VAL QG . . 3.670 2.287 2.045 2.800 . 0 0 "[ . 1 . 2]" 1
981 1 22 LYS HB3 1 26 VAL QG . . 4.300 3.613 3.064 3.957 . 0 0 "[ . 1 . 2]" 1
982 1 45 VAL HA 1 45 VAL MG1 . . 3.280 2.513 2.453 2.617 . 0 0 "[ . 1 . 2]" 1
983 1 45 VAL MG1 1 46 GLN QG . . 4.970 4.110 3.653 4.755 . 0 0 "[ . 1 . 2]" 1
984 1 45 VAL MG1 1 48 LEU MD1 . . 4.470 4.004 3.745 4.303 . 0 0 "[ . 1 . 2]" 1
985 1 44 VAL H 1 44 VAL MG1 . . 3.500 2.282 2.182 2.355 . 0 0 "[ . 1 . 2]" 1
986 1 106 VAL MG1 1 119 LEU MD2 . . 4.600 3.519 2.056 4.485 . 0 0 "[ . 1 . 2]" 1
987 1 50 LEU H 1 118 LEU MD2 . . 5.500 5.432 5.071 5.522 0.022 12 0 "[ . 1 . 2]" 1
988 1 118 LEU MD2 1 119 LEU H . . 4.480 4.532 4.516 4.546 0.066 4 0 "[ . 1 . 2]" 1
989 1 11 GLY H 1 16 LEU MD2 . . 4.810 4.373 3.147 4.850 0.040 8 0 "[ . 1 . 2]" 1
990 1 19 LEU H 1 19 LEU MD2 . . 4.400 4.224 3.720 4.359 . 0 0 "[ . 1 . 2]" 1
991 1 16 LEU MD2 1 71 ILE MD . . 5.020 4.679 4.334 4.927 . 0 0 "[ . 1 . 2]" 1
992 1 106 VAL H 1 106 VAL MG1 . . 4.000 3.652 3.611 3.682 . 0 0 "[ . 1 . 2]" 1
993 1 105 LEU H 1 106 VAL MG1 . . 5.170 5.272 5.244 5.298 0.128 11 0 "[ . 1 . 2]" 1
994 1 106 VAL MG1 1 107 GLU H . . 4.110 3.805 3.669 3.974 . 0 0 "[ . 1 . 2]" 1
995 1 106 VAL MG1 1 116 SER HB2 . . 4.620 2.535 2.274 2.694 . 0 0 "[ . 1 . 2]" 1
996 1 106 VAL MG1 1 116 SER HB3 . . 4.150 2.150 2.065 2.261 . 0 0 "[ . 1 . 2]" 1
997 1 42 ASN HA 1 45 VAL MG1 . . 3.970 3.868 3.522 4.000 0.030 6 0 "[ . 1 . 2]" 1
998 1 43 ALA H 1 44 VAL MG1 . . 4.480 4.516 4.501 4.537 0.057 3 0 "[ . 1 . 2]" 1
999 1 44 VAL MG1 1 93 CYS HB3 . . 4.210 3.749 3.542 3.979 . 0 0 "[ . 1 . 2]" 1
1000 1 44 VAL MG1 1 48 LEU MD1 . . 5.490 4.504 4.330 4.725 . 0 0 "[ . 1 . 2]" 1
1001 1 44 VAL MG1 1 93 CYS H . . 4.580 3.798 3.461 4.168 . 0 0 "[ . 1 . 2]" 1
1002 1 29 LEU HA 1 29 LEU QD . . 3.840 3.442 3.414 3.473 . 0 0 "[ . 1 . 2]" 1
1003 1 27 VAL MG1 1 56 TYR HB3 . . 4.450 4.531 4.513 4.556 0.106 1 0 "[ . 1 . 2]" 1
1004 1 29 LEU QD 1 44 VAL HB . . 3.720 3.744 3.727 3.758 0.038 5 0 "[ . 1 . 2]" 1
1005 1 27 VAL MG1 1 83 VAL MG2 . . 3.300 3.365 3.348 3.385 0.085 17 0 "[ . 1 . 2]" 1
1006 1 29 LEU QD 1 45 VAL H . . 4.500 4.194 4.001 4.440 . 0 0 "[ . 1 . 2]" 1
1007 1 26 VAL QG 1 27 VAL H . . 4.120 2.990 2.698 3.472 . 0 0 "[ . 1 . 2]" 1
1008 1 26 VAL QG 1 28 PHE QE . . 3.990 2.593 2.339 2.769 . 0 0 "[ . 1 . 2]" 1
1009 1 26 VAL QG 1 59 TYR QE . . 3.460 2.032 1.934 2.129 . 0 0 "[ . 1 . 2]" 1
1010 1 26 VAL QG 1 59 TYR QD . . 3.770 2.656 2.153 3.588 . 0 0 "[ . 1 . 2]" 1
1011 1 32 THR MG 1 33 PRO HD3 . . 4.290 4.032 3.465 4.297 0.007 4 0 "[ . 1 . 2]" 1
1012 1 61 VAL MG1 1 71 ILE MG . . 3.950 2.157 2.040 2.371 . 0 0 "[ . 1 . 2]" 1
1013 1 106 VAL MG2 1 109 LEU HB2 . . 4.560 4.453 4.322 4.574 0.014 19 0 "[ . 1 . 2]" 1
1014 1 48 LEU MD1 1 53 VAL MG1 . . 4.430 3.574 3.261 3.840 . 0 0 "[ . 1 . 2]" 1
1015 1 53 VAL MG1 1 55 ASP H . . 4.220 2.789 2.079 3.372 . 0 0 "[ . 1 . 2]" 1
1016 1 99 MET HB3 1 105 LEU MD2 . . 3.790 2.300 2.197 2.384 . 0 0 "[ . 1 . 2]" 1
1017 1 100 HIS H 1 105 LEU MD2 . . 4.490 3.931 3.828 4.000 . 0 0 "[ . 1 . 2]" 1
1018 1 99 MET HG2 1 105 LEU MD2 . . 4.200 4.078 3.962 4.205 0.005 8 0 "[ . 1 . 2]" 1
1019 1 56 TYR HA 1 57 ALA MB . . 4.140 4.111 4.019 4.159 0.019 16 0 "[ . 1 . 2]" 1
1020 1 28 PHE HB3 1 61 VAL MG1 . . 4.050 3.590 3.187 4.050 . 0 0 "[ . 1 . 2]" 1
1021 1 3 PHE HB3 1 4 THR MG . . 4.820 4.548 2.805 4.866 0.046 18 0 "[ . 1 . 2]" 1
1022 1 45 VAL MG2 1 46 GLN H . . 4.200 4.091 4.045 4.158 . 0 0 "[ . 1 . 2]" 1
1023 1 53 VAL MG2 1 109 LEU MD1 . . 3.800 2.842 2.415 3.261 . 0 0 "[ . 1 . 2]" 1
1024 1 44 VAL H 1 44 VAL MG2 . . 3.950 1.797 1.742 1.875 . 0 0 "[ . 1 . 2]" 1
1025 1 85 LEU HB3 1 90 VAL MG1 . . 4.170 3.893 3.534 4.148 . 0 0 "[ . 1 . 2]" 1
1026 1 109 LEU MD2 1 114 ILE MD . . 3.020 2.191 2.061 2.335 . 0 0 "[ . 1 . 2]" 1
1027 1 90 VAL MG2 1 91 GLY HA2 . . 5.450 5.156 4.044 5.517 0.067 5 0 "[ . 1 . 2]" 1
1028 1 27 VAL H 1 57 ALA MB . . 4.520 3.797 3.514 3.957 . 0 0 "[ . 1 . 2]" 1
1029 1 44 VAL MG2 1 45 VAL MG2 . . 3.710 2.078 2.032 2.146 . 0 0 "[ . 1 . 2]" 1
1030 1 44 VAL HB 1 45 VAL MG2 . . 3.730 3.764 3.735 3.791 0.061 13 0 "[ . 1 . 2]" 1
1031 1 27 VAL MG2 1 28 PHE H . . 3.840 3.732 3.684 3.816 . 0 0 "[ . 1 . 2]" 1
1032 1 27 VAL MG2 1 44 VAL HB . . 4.640 4.297 3.810 4.640 0.000 2 0 "[ . 1 . 2]" 1
1033 1 27 VAL MG2 1 45 VAL MG2 . . 3.870 3.896 3.876 3.919 0.049 18 0 "[ . 1 . 2]" 1
1034 1 27 VAL MG2 1 48 LEU MD1 . . 3.810 2.067 1.973 2.258 . 0 0 "[ . 1 . 2]" 1
1035 1 83 VAL MG1 1 84 TYR H . . 4.460 3.871 3.710 4.047 . 0 0 "[ . 1 . 2]" 1
1036 1 44 VAL MG2 1 45 VAL H . . 4.220 2.221 1.938 2.330 . 0 0 "[ . 1 . 2]" 1
1037 1 25 VAL MG1 1 56 TYR HA . . 4.230 3.656 3.573 3.783 . 0 0 "[ . 1 . 2]" 1
1038 1 25 VAL MG1 1 26 VAL H . . 3.990 3.441 2.954 3.807 . 0 0 "[ . 1 . 2]" 1
1039 1 25 VAL MG1 1 56 TYR QD . . 4.200 3.537 3.362 3.766 . 0 0 "[ . 1 . 2]" 1
1040 1 48 LEU MD2 1 56 TYR QD . . 5.020 3.169 2.732 3.650 . 0 0 "[ . 1 . 2]" 1
1041 1 48 LEU MD2 1 56 TYR HB2 . . 5.440 5.130 4.846 5.439 . 0 0 "[ . 1 . 2]" 1
1042 1 48 LEU MD2 1 53 VAL MG2 . . 3.810 3.071 2.726 3.353 . 0 0 "[ . 1 . 2]" 1
1043 1 47 ILE MG 1 48 LEU MD2 . . 3.970 3.755 3.536 3.977 0.007 15 0 "[ . 1 . 2]" 1
1044 1 20 VAL MG1 1 88 GLU HA . . 5.470 5.153 4.476 5.415 . 0 0 "[ . 1 . 2]" 1
1045 1 20 VAL MG1 1 26 VAL HB . . 5.040 3.311 3.048 3.675 . 0 0 "[ . 1 . 2]" 1
1046 1 83 VAL MG2 1 85 LEU H . . 5.430 4.420 4.274 4.579 . 0 0 "[ . 1 . 2]" 1
1047 1 83 VAL MG2 1 84 TYR HA . . 4.650 3.930 3.679 4.060 . 0 0 "[ . 1 . 2]" 1
1048 1 83 VAL MG2 1 85 LEU HG . . 4.160 4.223 4.208 4.238 0.078 13 0 "[ . 1 . 2]" 1
1049 1 6 GLY QA 1 7 ALA MB . . 5.120 3.748 3.459 4.276 . 0 0 "[ . 1 . 2]" 1
1050 1 24 LYS H 1 25 VAL MG2 . . 5.500 3.616 3.348 3.792 . 0 0 "[ . 1 . 2]" 1
1051 1 71 ILE MG 1 73 ASP H . . 4.890 4.626 4.493 4.782 . 0 0 "[ . 1 . 2]" 1
1052 1 71 ILE H 1 71 ILE MG . . 3.490 2.443 2.291 2.623 . 0 0 "[ . 1 . 2]" 1
1053 1 71 ILE MG 1 72 LYS H . . 4.070 2.413 2.292 2.526 . 0 0 "[ . 1 . 2]" 1
1054 1 28 PHE QE 1 71 ILE MG . . 4.980 4.863 4.467 4.994 0.014 8 0 "[ . 1 . 2]" 1
1055 1 31 GLY H 1 61 VAL MG2 . . 5.190 3.854 3.588 4.048 . 0 0 "[ . 1 . 2]" 1
1056 1 60 ASN HA 1 61 VAL MG2 . . 4.150 4.103 4.025 4.166 0.016 9 0 "[ . 1 . 2]" 1
1057 1 61 VAL MG2 1 68 ARG QD . . 4.030 3.945 3.310 4.377 0.347 14 0 "[ . 1 . 2]" 1
1058 1 30 LYS HE2 1 61 VAL MG2 . . 5.020 4.318 3.382 5.027 0.007 2 0 "[ . 1 . 2]" 1
1059 1 43 ALA MB 1 47 ILE H . . 5.500 4.789 4.525 5.047 . 0 0 "[ . 1 . 2]" 1
1060 1 43 ALA MB 1 93 CYS HB3 . . 4.900 4.787 4.460 4.923 0.023 2 0 "[ . 1 . 2]" 1
1061 1 42 ASN H 1 43 ALA MB . . 5.000 4.129 3.863 4.356 . 0 0 "[ . 1 . 2]" 1
1062 1 40 PHE QD 1 43 ALA MB . . 5.000 4.255 3.949 4.849 . 0 0 "[ . 1 . 2]" 1
1063 1 43 ALA MB 1 44 VAL H . . 3.750 2.641 2.513 2.843 . 0 0 "[ . 1 . 2]" 1
1064 1 40 PHE HA 1 43 ALA MB . . 3.780 2.608 2.198 3.587 . 0 0 "[ . 1 . 2]" 1
1065 1 42 ASN HA 1 43 ALA MB . . 5.380 5.024 4.984 5.048 . 0 0 "[ . 1 . 2]" 1
1066 1 43 ALA MB 1 44 VAL HA . . 4.700 3.998 3.914 4.108 . 0 0 "[ . 1 . 2]" 1
1067 1 42 ASN HB2 1 43 ALA MB . . 5.290 5.181 4.876 5.296 0.006 5 0 "[ . 1 . 2]" 1
1068 1 43 ALA MB 1 46 GLN QG . . 5.490 4.596 4.088 5.062 . 0 0 "[ . 1 . 2]" 1
1069 1 43 ALA MB 1 46 GLN QB . . 5.140 4.165 3.790 4.519 . 0 0 "[ . 1 . 2]" 1
1070 1 43 ALA MB 1 44 VAL MG1 . . 4.550 3.195 2.951 3.469 . 0 0 "[ . 1 . 2]" 1
1071 1 13 ALA MB 1 16 LEU MD2 . . 4.820 4.819 4.716 4.841 0.021 18 0 "[ . 1 . 2]" 1
1072 1 13 ALA MB 1 16 LEU H . . 5.080 4.757 4.614 4.960 . 0 0 "[ . 1 . 2]" 1
1073 1 12 SER HB3 1 13 ALA MB . . 4.440 4.378 4.006 4.485 0.045 9 0 "[ . 1 . 2]" 1
1074 1 17 ASP HB3 1 18 ALA MB . . 4.390 3.825 3.568 4.067 . 0 0 "[ . 1 . 2]" 1
1075 1 15 GLN QB 1 18 ALA MB . . 4.600 4.387 4.237 4.556 . 0 0 "[ . 1 . 2]" 1
1076 1 18 ALA MB 1 19 LEU MD2 . . 5.460 5.191 4.297 5.502 0.042 13 0 "[ . 1 . 2]" 1
1077 1 51 HIS H 1 117 ALA MB . . 4.840 4.664 4.495 4.847 0.007 2 0 "[ . 1 . 2]" 1
1078 1 117 ALA MB 1 118 LEU MD2 . . 4.540 3.085 2.772 3.433 . 0 0 "[ . 1 . 2]" 1
1079 1 47 ILE MG 1 51 HIS H . . 4.830 4.372 4.304 4.474 . 0 0 "[ . 1 . 2]" 1
1080 1 47 ILE MG 1 96 LEU HG . . 3.850 2.411 2.281 2.637 . 0 0 "[ . 1 . 2]" 1
1081 1 47 ILE MG 1 96 LEU QD . . 3.360 2.430 2.298 2.517 . 0 0 "[ . 1 . 2]" 1
1082 1 47 ILE MG 1 105 LEU MD1 . . 3.860 2.204 2.005 2.430 . 0 0 "[ . 1 . 2]" 1
1083 1 18 ALA H 1 18 ALA MB . . 3.090 2.268 2.205 2.304 . 0 0 "[ . 1 . 2]" 1
1084 1 80 ILE MG 1 82 GLN QG . . 4.710 3.539 2.304 6.107 1.397 20 2 "[ . 1 - . +]" 1
1085 1 114 ILE HG13 1 114 ILE MG . . 3.520 3.253 3.246 3.262 . 0 0 "[ . 1 . 2]" 1
1086 1 109 LEU MD2 1 114 ILE MG . . 4.100 2.314 2.143 2.555 . 0 0 "[ . 1 . 2]" 1
1087 1 95 ILE H 1 95 ILE MG . . 4.370 3.776 3.732 3.799 . 0 0 "[ . 1 . 2]" 1
1088 1 92 GLY H 1 95 ILE MG . . 5.150 3.673 3.222 4.116 . 0 0 "[ . 1 . 2]" 1
1089 1 95 ILE HA 1 95 ILE MG . . 3.640 2.392 2.323 2.454 . 0 0 "[ . 1 . 2]" 1
1090 1 95 ILE MG 1 99 MET HG2 . . 4.180 3.575 3.406 3.717 . 0 0 "[ . 1 . 2]" 1
1091 1 5 MET HA 1 5 MET ME . . 5.280 4.714 3.914 5.288 0.008 16 0 "[ . 1 . 2]" 1
1092 1 4 THR HA 1 5 MET ME . . 5.180 4.986 4.237 5.197 0.017 15 0 "[ . 1 . 2]" 1
1093 1 99 MET HA 1 99 MET ME . . 3.970 3.627 3.571 3.722 . 0 0 "[ . 1 . 2]" 1
1094 1 99 MET HB3 1 99 MET ME . . 3.350 2.004 1.980 2.028 . 0 0 "[ . 1 . 2]" 1
1095 1 95 ILE MG 1 99 MET ME . . 3.810 3.815 3.765 3.831 0.021 18 0 "[ . 1 . 2]" 1
1096 1 16 LEU HA 1 71 ILE MD . . 5.500 5.089 4.703 5.413 . 0 0 "[ . 1 . 2]" 1
1097 1 109 LEU HA 1 114 ILE MD . . 4.970 3.300 2.891 3.663 . 0 0 "[ . 1 . 2]" 1
1098 1 25 VAL MG1 1 114 ILE MD . . 3.950 3.984 3.968 4.004 0.054 9 0 "[ . 1 . 2]" 1
1099 1 47 ILE MD 1 100 HIS HA . . 5.500 4.513 4.324 4.827 . 0 0 "[ . 1 . 2]" 1
1100 1 47 ILE MD 1 100 HIS HB2 . . 4.860 2.400 2.242 2.712 . 0 0 "[ . 1 . 2]" 1
1101 1 47 ILE HA 1 47 ILE MD . . 3.860 3.807 3.757 3.856 . 0 0 "[ . 1 . 2]" 1
1102 1 47 ILE MD 1 97 LEU MD2 . . 4.270 2.135 2.012 2.276 . 0 0 "[ . 1 . 2]" 1
1103 1 47 ILE MD 1 105 LEU MD1 . . 4.860 3.375 3.149 3.608 . 0 0 "[ . 1 . 2]" 1
1104 1 92 GLY H 1 95 ILE MD . . 4.560 4.220 2.785 4.598 0.038 5 0 "[ . 1 . 2]" 1
1105 1 80 ILE HA 1 80 ILE MD . . 3.770 2.837 2.120 3.910 0.140 12 0 "[ . 1 . 2]" 1
1106 1 86 ASN H 1 87 GLY H . . 3.830 2.830 2.730 2.904 . 0 0 "[ . 1 . 2]" 1
1107 1 26 VAL H 1 86 ASN H . . 5.500 4.724 4.438 5.058 . 0 0 "[ . 1 . 2]" 1
1108 1 86 ASN H 1 88 GLU H . . 4.970 4.284 4.124 4.403 . 0 0 "[ . 1 . 2]" 1
1109 1 24 LYS HA 1 86 ASN H . . 3.710 2.589 2.289 2.935 . 0 0 "[ . 1 . 2]" 1
1110 1 24 LYS HG2 1 86 ASN H . . 5.500 5.423 4.704 5.634 0.134 20 0 "[ . 1 . 2]" 1
1111 1 85 LEU MD1 1 86 ASN H . . 4.100 4.147 4.115 4.172 0.072 10 0 "[ . 1 . 2]" 1
1112 1 25 VAL H 1 86 ASN H . . 5.500 4.714 4.501 4.845 . 0 0 "[ . 1 . 2]" 1
1113 1 40 PHE H 1 41 SER H . . 4.400 3.219 2.180 3.817 . 0 0 "[ . 1 . 2]" 1
1114 1 37 GLN HE22 1 41 SER H . . 4.810 3.815 2.169 4.834 0.024 7 0 "[ . 1 . 2]" 1
1115 1 85 LEU H 1 87 GLY H . . 5.330 4.435 4.124 4.654 . 0 0 "[ . 1 . 2]" 1
1116 1 87 GLY H 1 88 GLU H . . 3.630 3.009 2.864 3.206 . 0 0 "[ . 1 . 2]" 1
1117 1 20 VAL MG1 1 87 GLY H . . 5.380 5.101 4.909 5.299 . 0 0 "[ . 1 . 2]" 1
1118 1 26 VAL H 1 84 TYR H . . 4.280 3.229 2.975 3.469 . 0 0 "[ . 1 . 2]" 1
1119 1 84 TYR H 1 85 LEU H . . 5.080 4.439 4.351 4.524 . 0 0 "[ . 1 . 2]" 1
1120 1 27 VAL QG 1 84 TYR H . . 4.030 3.970 3.744 4.081 0.051 14 0 "[ . 1 . 2]" 1
1121 1 83 VAL MG2 1 84 TYR H . . 3.710 2.467 2.332 2.698 . 0 0 "[ . 1 . 2]" 1
1122 1 20 VAL MG1 1 84 TYR H . . 5.500 4.479 4.279 4.673 . 0 0 "[ . 1 . 2]" 1
1123 1 29 LEU H 1 61 VAL H . . 4.760 3.424 3.275 3.518 . 0 0 "[ . 1 . 2]" 1
1124 1 60 ASN H 1 61 VAL H . . 4.990 4.259 4.148 4.363 . 0 0 "[ . 1 . 2]" 1
1125 1 31 GLY H 1 61 VAL H . . 4.630 3.251 3.054 3.772 . 0 0 "[ . 1 . 2]" 1
1126 1 28 PHE QD 1 61 VAL H . . 5.500 5.441 5.227 5.520 0.020 11 0 "[ . 1 . 2]" 1
1127 1 61 VAL H 1 61 VAL MG1 . . 3.700 2.239 2.086 2.332 . 0 0 "[ . 1 . 2]" 1
1128 1 61 VAL H 1 61 VAL MG2 . . 3.560 2.279 2.237 2.330 . 0 0 "[ . 1 . 2]" 1
1129 1 61 VAL H 1 63 ASP H . . 5.060 4.560 4.276 4.857 . 0 0 "[ . 1 . 2]" 1
1130 1 102 ASN H 1 104 ASP H . . 4.190 4.162 3.929 4.231 0.041 19 0 "[ . 1 . 2]" 1
1131 1 103 GLY H 1 104 ASP H . . 3.250 2.205 2.050 2.314 . 0 0 "[ . 1 . 2]" 1
1132 1 104 ASP H 1 107 GLU H . . 5.480 5.301 4.963 5.483 0.003 1 0 "[ . 1 . 2]" 1
1133 1 29 LEU H 1 58 ALA MB . . 5.340 4.934 4.755 5.124 . 0 0 "[ . 1 . 2]" 1
1134 1 27 VAL H 1 84 TYR H . . 4.970 5.001 4.974 5.033 0.063 13 0 "[ . 1 . 2]" 1
1135 1 28 PHE H 1 82 GLN H . . 4.030 3.085 2.852 3.283 . 0 0 "[ . 1 . 2]" 1
1136 1 40 PHE H 1 40 PHE QD . . 3.920 2.606 1.992 3.294 . 0 0 "[ . 1 . 2]" 1
1137 1 37 GLN H 1 38 CYS H . . 3.350 3.056 2.609 3.447 0.097 19 0 "[ . 1 . 2]" 1
1138 1 28 PHE H 1 28 PHE QD . . 3.550 3.157 3.038 3.242 . 0 0 "[ . 1 . 2]" 1
1139 1 28 PHE H 1 81 PRO HA . . 5.310 4.884 4.597 5.220 . 0 0 "[ . 1 . 2]" 1
1140 1 36 PRO QB 1 37 GLN H . . 4.580 3.776 3.290 4.024 . 0 0 "[ . 1 . 2]" 1
1141 1 27 VAL H 1 58 ALA MB . . 4.760 4.424 4.204 4.615 . 0 0 "[ . 1 . 2]" 1
1142 1 27 VAL QG 1 28 PHE H . . 3.160 2.305 2.214 2.429 . 0 0 "[ . 1 . 2]" 1
1143 1 115 HIS H 1 116 SER H . . 4.770 4.385 4.246 4.465 . 0 0 "[ . 1 . 2]" 1
1144 1 27 VAL H 1 59 TYR QD . . 4.000 3.338 3.172 3.586 . 0 0 "[ . 1 . 2]" 1
1145 1 84 TYR HA 1 89 PHE H . . 5.050 4.994 4.692 5.109 0.059 18 0 "[ . 1 . 2]" 1
1146 1 88 GLU H 1 89 PHE H . . 4.500 4.494 4.434 4.524 0.024 17 0 "[ . 1 . 2]" 1
1147 1 84 TYR QD 1 89 PHE H . . 3.830 3.295 3.082 3.533 . 0 0 "[ . 1 . 2]" 1
1148 1 88 GLU HG2 1 89 PHE H . . 5.040 2.678 2.141 2.945 . 0 0 "[ . 1 . 2]" 1
1149 1 60 ASN H 1 67 LEU QD . . 5.210 4.028 3.781 4.282 . 0 0 "[ . 1 . 2]" 1
1150 1 99 MET ME 1 100 HIS H . . 5.220 5.249 5.232 5.276 0.056 18 0 "[ . 1 . 2]" 1
1151 1 97 LEU MD1 1 100 HIS H . . 5.500 5.195 4.794 5.447 . 0 0 "[ . 1 . 2]" 1
1152 1 96 LEU QD 1 100 HIS H . . 4.650 4.355 4.066 4.509 . 0 0 "[ . 1 . 2]" 1
1153 1 100 HIS H 1 101 GLN HA . . 5.500 5.265 5.197 5.343 . 0 0 "[ . 1 . 2]" 1
1154 1 71 ILE H 1 73 ASP H . . 4.870 4.049 3.797 4.296 . 0 0 "[ . 1 . 2]" 1
1155 1 97 LEU H 1 99 MET H . . 4.260 4.285 4.269 4.303 0.043 5 0 "[ . 1 . 2]" 1
1156 1 69 GLN H 1 71 ILE H . . 5.200 4.297 4.171 4.399 . 0 0 "[ . 1 . 2]" 1
1157 1 71 ILE H 1 71 ILE HG12 . . 4.440 4.521 4.507 4.539 0.099 11 0 "[ . 1 . 2]" 1
1158 1 97 LEU H 1 97 LEU MD2 . . 4.790 3.517 2.974 3.801 . 0 0 "[ . 1 . 2]" 1
1159 1 16 LEU MD1 1 71 ILE H . . 4.500 3.363 2.998 3.886 . 0 0 "[ . 1 . 2]" 1
1160 1 97 LEU H 1 98 GLN H . . 3.290 2.652 2.578 2.807 . 0 0 "[ . 1 . 2]" 1
1161 1 96 LEU QD 1 97 LEU H . . 4.620 4.183 4.010 4.351 . 0 0 "[ . 1 . 2]" 1
1162 1 94 ASP HA 1 97 LEU H . . 4.180 3.711 3.477 3.945 . 0 0 "[ . 1 . 2]" 1
1163 1 93 CYS HB2 1 94 ASP H . . 4.080 4.104 4.007 4.175 0.095 10 0 "[ . 1 . 2]" 1
1164 1 94 ASP H 1 95 ILE MD . . 5.280 5.087 4.631 5.316 0.036 10 0 "[ . 1 . 2]" 1
1165 1 93 CYS H 1 94 ASP H . . 4.460 3.075 2.900 3.250 . 0 0 "[ . 1 . 2]" 1
1166 1 46 GLN H 1 46 GLN HE21 . . 5.230 4.650 3.794 5.231 0.001 2 0 "[ . 1 . 2]" 1
1167 1 24 LYS H 1 24 LYS HD2 . . 3.810 2.281 1.980 2.517 . 0 0 "[ . 1 . 2]" 1
1168 1 24 LYS H 1 25 VAL H . . 3.670 2.296 2.220 2.383 . 0 0 "[ . 1 . 2]" 1
1169 1 23 ASP H 1 24 LYS H . . 4.400 4.398 4.346 4.437 0.037 5 0 "[ . 1 . 2]" 1
1170 1 94 ASP H 1 94 ASP QB . . 3.920 2.283 2.142 2.490 . 0 0 "[ . 1 . 2]" 1
1171 1 23 ASP HB3 1 24 LYS H . . 3.510 2.789 2.557 3.048 . 0 0 "[ . 1 . 2]" 1
1172 1 28 PHE QD 1 82 GLN H . . 4.450 4.500 4.471 4.538 0.088 16 0 "[ . 1 . 2]" 1
1173 1 81 PRO HA 1 82 GLN H . . 3.250 2.318 2.264 2.416 . 0 0 "[ . 1 . 2]" 1
1174 1 99 MET H 1 100 HIS H . . 3.640 2.794 2.696 2.846 . 0 0 "[ . 1 . 2]" 1
1175 1 98 GLN HG3 1 99 MET H . . 4.920 4.585 4.484 4.756 . 0 0 "[ . 1 . 2]" 1
1176 1 99 MET H 1 99 MET ME . . 4.530 4.580 4.561 4.597 0.067 5 0 "[ . 1 . 2]" 1
1177 1 56 TYR QD 1 57 ALA H . . 3.510 3.559 3.519 3.597 0.087 9 0 "[ . 1 . 2]" 1
1178 1 83 VAL H 1 84 TYR H . . 5.170 4.267 4.131 4.397 . 0 0 "[ . 1 . 2]" 1
1179 1 27 VAL H 1 57 ALA H . . 4.270 3.357 3.186 3.515 . 0 0 "[ . 1 . 2]" 1
1180 1 56 TYR H 1 57 ALA H . . 4.610 4.539 4.465 4.619 0.009 3 0 "[ . 1 . 2]" 1
1181 1 83 VAL H 1 83 VAL HB . . 3.260 3.277 3.205 3.301 0.041 4 0 "[ . 1 . 2]" 1
1182 1 54 ARG H 1 55 ASP H . . 3.390 1.687 1.559 1.821 . 0 0 "[ . 1 . 2]" 1
1183 1 54 ARG H 1 54 ARG HB2 . . 3.700 3.719 2.580 3.818 0.118 19 0 "[ . 1 . 2]" 1
1184 1 106 VAL MG2 1 109 LEU H . . 4.960 4.986 4.941 5.019 0.059 20 0 "[ . 1 . 2]" 1
1185 1 118 LEU H 1 118 LEU MD1 . . 4.470 3.726 3.610 3.875 . 0 0 "[ . 1 . 2]" 1
1186 1 108 GLU HB3 1 109 LEU H . . 3.230 2.791 2.483 3.293 0.063 5 0 "[ . 1 . 2]" 1
1187 1 109 LEU H 1 110 LYS H . . 3.460 2.775 2.621 2.874 . 0 0 "[ . 1 . 2]" 1
1188 1 80 ILE H 1 80 ILE MG . . 4.360 3.778 2.420 4.053 . 0 0 "[ . 1 . 2]" 1
1189 1 29 LEU H 1 59 TYR H . . 4.300 4.200 4.002 4.324 0.024 10 0 "[ . 1 . 2]" 1
1190 1 59 TYR H 1 59 TYR QD . . 3.690 2.414 2.257 2.596 . 0 0 "[ . 1 . 2]" 1
1191 1 58 ALA MB 1 59 TYR H . . 3.920 3.512 3.338 3.588 . 0 0 "[ . 1 . 2]" 1
1192 1 59 TYR H 1 59 TYR HB2 . . 4.160 2.316 2.266 2.364 . 0 0 "[ . 1 . 2]" 1
1193 1 50 LEU H 1 51 HIS H . . 3.520 2.662 2.624 2.707 . 0 0 "[ . 1 . 2]" 1
1194 1 51 HIS HA 1 117 ALA H . . 3.180 2.825 2.554 3.040 . 0 0 "[ . 1 . 2]" 1
1195 1 117 ALA H 1 118 LEU MD2 . . 4.610 4.509 4.219 4.620 0.010 13 0 "[ . 1 . 2]" 1
1196 1 30 LYS H 1 37 GLN HE22 . . 4.050 3.170 2.342 4.117 0.067 4 0 "[ . 1 . 2]" 1
1197 1 30 LYS H 1 30 LYS HE2 . . 5.050 4.972 4.166 5.106 0.056 4 0 "[ . 1 . 2]" 1
1198 1 66 GLU H 1 66 GLU HB3 . . 3.290 3.426 3.393 3.452 0.162 8 0 "[ . 1 . 2]" 1
1199 1 14 GLU H 1 15 GLN H . . 3.200 2.797 2.650 2.906 . 0 0 "[ . 1 . 2]" 1
1200 1 102 ASN H 1 103 GLY H . . 3.240 2.527 2.390 2.707 . 0 0 "[ . 1 . 2]" 1
1201 1 101 GLN HB2 1 102 ASN H . . 3.500 2.974 2.672 3.348 . 0 0 "[ . 1 . 2]" 1
1202 1 16 LEU MD1 1 70 GLY H . . 4.910 4.368 4.156 4.913 0.003 3 0 "[ . 1 . 2]" 1
1203 1 60 ASN QD 1 62 LEU H . . 4.800 3.895 3.132 4.354 . 0 0 "[ . 1 . 2]" 1
1204 1 52 GLY H 1 116 SER HA . . 5.480 5.377 5.214 5.497 0.017 15 0 "[ . 1 . 2]" 1
1205 1 51 HIS H 1 52 GLY H . . 3.230 2.771 2.697 2.840 . 0 0 "[ . 1 . 2]" 1
1206 1 100 HIS HD2 1 101 GLN H . . 4.450 4.166 3.993 4.285 . 0 0 "[ . 1 . 2]" 1
1207 1 100 HIS H 1 101 GLN H . . 3.530 2.625 2.528 2.716 . 0 0 "[ . 1 . 2]" 1
1208 1 55 ASP H 1 56 TYR QD . . 4.740 4.214 3.549 4.628 . 0 0 "[ . 1 . 2]" 1
1209 1 54 ARG HB3 1 55 ASP H . . 4.460 4.313 3.834 4.468 0.008 17 0 "[ . 1 . 2]" 1
1210 1 55 ASP H 1 56 TYR H . . 3.930 2.969 2.484 3.232 . 0 0 "[ . 1 . 2]" 1
1211 1 25 VAL H 1 26 VAL H . . 5.090 3.648 3.231 4.139 . 0 0 "[ . 1 . 2]" 1
1212 1 25 VAL H 1 25 VAL HB . . 4.050 3.285 3.201 3.323 . 0 0 "[ . 1 . 2]" 1
1213 1 25 VAL H 1 26 VAL QG . . 4.850 3.191 2.959 3.662 . 0 0 "[ . 1 . 2]" 1
1214 1 25 VAL H 1 57 ALA H . . 5.500 4.280 3.959 4.609 . 0 0 "[ . 1 . 2]" 1
1215 1 25 VAL H 1 56 TYR HB3 . . 5.180 5.236 5.205 5.302 0.122 3 0 "[ . 1 . 2]" 1
1216 1 24 LYS HD2 1 25 VAL H . . 4.140 2.706 2.347 3.208 . 0 0 "[ . 1 . 2]" 1
1217 1 25 VAL H 1 25 VAL MG2 . . 3.490 2.528 2.234 2.728 . 0 0 "[ . 1 . 2]" 1
1218 1 89 PHE QD 1 90 VAL H . . 3.670 1.893 1.649 2.404 . 0 0 "[ . 1 . 2]" 1
1219 1 90 VAL H 1 90 VAL MG2 . . 4.440 3.014 1.864 3.468 . 0 0 "[ . 1 . 2]" 1
1220 1 89 PHE QE 1 90 VAL H . . 5.030 3.780 3.665 4.007 . 0 0 "[ . 1 . 2]" 1
1221 1 76 ASN H 1 77 TRP H . . 3.120 3.087 2.909 3.182 0.062 3 0 "[ . 1 . 2]" 1
1222 1 51 HIS H 1 53 VAL H . . 3.760 3.745 3.675 3.785 0.025 3 0 "[ . 1 . 2]" 1
1223 1 49 ARG HA 1 53 VAL H . . 3.700 2.798 2.427 3.103 . 0 0 "[ . 1 . 2]" 1
1224 1 17 ASP H 1 17 ASP HB3 . . 3.150 2.523 2.282 3.263 0.113 2 0 "[ . 1 . 2]" 1
1225 1 17 ASP H 1 18 ALA MB . . 4.430 4.399 4.274 4.438 0.008 13 0 "[ . 1 . 2]" 1
1226 1 20 VAL H 1 28 PHE HZ . . 5.300 3.938 3.763 4.224 . 0 0 "[ . 1 . 2]" 1
1227 1 20 VAL H 1 20 VAL MG2 . . 3.440 2.099 1.975 2.180 . 0 0 "[ . 1 . 2]" 1
1228 1 104 ASP H 1 105 LEU H . . 3.450 2.605 2.412 2.749 . 0 0 "[ . 1 . 2]" 1
1229 1 100 HIS H 1 105 LEU H . . 5.350 5.311 5.200 5.361 0.011 19 0 "[ . 1 . 2]" 1
1230 1 49 ARG H 1 56 TYR QD . . 5.500 5.535 5.508 5.557 0.057 4 0 "[ . 1 . 2]" 1
1231 1 99 MET ME 1 105 LEU H . . 4.120 3.797 3.452 3.941 . 0 0 "[ . 1 . 2]" 1
1232 1 15 GLN H 1 16 LEU H . . 2.740 2.476 2.325 2.602 . 0 0 "[ . 1 . 2]" 1
1233 1 29 LEU HB3 1 31 GLY H . . 4.990 5.044 4.945 5.088 0.098 15 0 "[ . 1 . 2]" 1
1234 1 31 GLY H 1 60 ASN QD . . 4.480 3.276 2.353 3.790 . 0 0 "[ . 1 . 2]" 1
1235 1 31 GLY H 1 32 THR H . . 4.430 4.327 3.919 4.449 0.019 13 0 "[ . 1 . 2]" 1
1236 1 31 GLY H 1 62 LEU MD1 . . 3.740 3.678 2.808 3.780 0.040 15 0 "[ . 1 . 2]" 1
1237 1 44 VAL H 1 47 ILE H . . 4.980 4.817 4.723 4.896 . 0 0 "[ . 1 . 2]" 1
1238 1 37 GLN HE21 1 38 CYS H . . 4.050 3.145 2.175 4.099 0.049 17 0 "[ . 1 . 2]" 1
1239 1 16 LEU H 1 74 TYR QE . . 4.740 4.651 4.408 4.771 0.031 12 0 "[ . 1 . 2]" 1
1240 1 94 ASP H 1 95 ILE H . . 3.850 2.492 2.296 2.671 . 0 0 "[ . 1 . 2]" 1
1241 1 95 ILE H 1 95 ILE MD . . 4.290 3.500 3.058 3.904 . 0 0 "[ . 1 . 2]" 1
1242 1 47 ILE H 1 47 ILE MG . . 3.960 3.787 3.762 3.822 . 0 0 "[ . 1 . 2]" 1
1243 1 47 ILE H 1 47 ILE MD . . 4.170 3.498 3.412 3.589 . 0 0 "[ . 1 . 2]" 1
1244 1 95 ILE H 1 95 ILE HB . . 3.160 2.436 2.336 2.525 . 0 0 "[ . 1 . 2]" 1
1245 1 44 VAL MG2 1 47 ILE H . . 5.180 5.207 5.187 5.219 0.039 16 0 "[ . 1 . 2]" 1
1246 1 51 HIS HE1 1 118 LEU MD2 . . 5.050 5.043 4.807 5.087 0.037 10 0 "[ . 1 . 2]" 1
1247 1 34 GLU H 1 34 GLU HG2 . . 3.560 2.901 1.831 3.584 0.024 9 0 "[ . 1 . 2]" 1
1248 1 42 ASN H 1 43 ALA H . . 3.570 2.438 2.158 2.668 . 0 0 "[ . 1 . 2]" 1
1249 1 86 ASN HB2 1 86 ASN HD21 . . 3.370 2.448 2.308 2.574 . 0 0 "[ . 1 . 2]" 1
1250 1 47 ILE MD 1 48 LEU H . . 4.690 4.712 4.699 4.728 0.038 15 0 "[ . 1 . 2]" 1
1251 1 95 ILE H 1 96 LEU H . . 3.660 2.432 2.261 2.620 . 0 0 "[ . 1 . 2]" 1
1252 1 47 ILE MG 1 48 LEU H . . 4.160 3.230 3.075 3.439 . 0 0 "[ . 1 . 2]" 1
1253 1 48 LEU H 1 48 LEU MD2 . . 4.050 3.768 3.702 3.831 . 0 0 "[ . 1 . 2]" 1
1254 1 44 VAL MG2 1 48 LEU H . . 5.500 5.363 5.251 5.441 . 0 0 "[ . 1 . 2]" 1
1255 1 110 LYS HG3 1 111 LYS H . . 5.090 4.702 3.720 4.945 . 0 0 "[ . 1 . 2]" 1
1256 1 110 LYS QB 1 111 LYS H . . 3.700 2.923 2.555 3.714 0.014 17 0 "[ . 1 . 2]" 1
1257 1 69 GLN H 1 70 GLY H . . 3.180 2.659 2.579 2.789 . 0 0 "[ . 1 . 2]" 1
1258 1 68 ARG HB3 1 69 GLN H . . 3.740 2.299 2.126 2.441 . 0 0 "[ . 1 . 2]" 1
1259 1 119 LEU H 1 120 ASP H . . 3.180 2.816 2.555 3.064 . 0 0 "[ . 1 . 2]" 1
1260 1 16 LEU HB2 1 19 LEU H . . 5.350 5.395 5.371 5.411 0.061 8 0 "[ . 1 . 2]" 1
1261 1 19 LEU H 1 20 VAL MG1 . . 5.260 4.671 4.544 4.791 . 0 0 "[ . 1 . 2]" 1
1262 1 117 ALA H 1 119 LEU H . . 4.810 4.402 4.242 4.516 . 0 0 "[ . 1 . 2]" 1
1263 1 50 LEU H 1 51 HIS HD2 . . 5.170 5.138 5.033 5.185 0.015 1 0 "[ . 1 . 2]" 1
1264 1 40 PHE QE 1 93 CYS HB2 . . 4.050 4.127 4.093 4.156 0.106 20 0 "[ . 1 . 2]" 1
1265 1 77 TRP HD1 1 80 ILE MG . . 4.700 3.912 2.248 4.753 0.053 16 0 "[ . 1 . 2]" 1
1266 1 50 LEU MD1 1 51 HIS HD2 . . 4.790 4.817 4.810 4.830 0.040 15 0 "[ . 1 . 2]" 1
1267 1 37 GLN HE22 1 38 CYS H . . 4.520 4.222 3.848 4.532 0.012 15 0 "[ . 1 . 2]" 1
1268 1 51 HIS H 1 109 LEU MD1 . . 5.460 5.241 5.050 5.381 . 0 0 "[ . 1 . 2]" 1
1269 1 15 GLN HE21 1 18 ALA H . . 5.240 3.889 3.601 5.054 . 0 0 "[ . 1 . 2]" 1
1270 1 15 GLN HE21 1 18 ALA MB . . 5.140 2.655 2.267 3.892 . 0 0 "[ . 1 . 2]" 1
1271 1 60 ASN H 1 60 ASN QD . . 5.420 4.235 3.956 4.398 . 0 0 "[ . 1 . 2]" 1
1272 1 21 LYS H 1 21 LYS HB2 . . 3.720 2.162 2.073 2.389 . 0 0 "[ . 1 . 2]" 1
1273 1 21 LYS H 1 21 LYS HD2 . . 3.900 3.914 3.811 3.979 0.079 7 0 "[ . 1 . 2]" 1
1274 1 20 VAL MG2 1 21 LYS H . . 3.690 2.561 2.409 2.694 . 0 0 "[ . 1 . 2]" 1
1275 1 92 GLY H 1 93 CYS H . . 5.500 4.600 4.514 4.648 . 0 0 "[ . 1 . 2]" 1
1276 1 19 LEU QD 1 21 LYS H . . 5.030 5.312 5.134 5.532 0.502 5 1 "[ + 1 . 2]" 1
1277 1 28 PHE QD 1 84 TYR QE . . 5.350 3.256 2.774 3.881 . 0 0 "[ . 1 . 2]" 1
1278 1 15 GLN HA 1 18 ALA H . . 4.070 3.375 3.237 3.531 . 0 0 "[ . 1 . 2]" 1
1279 1 15 GLN QB 1 18 ALA H . . 5.050 4.904 4.813 5.056 0.006 13 0 "[ . 1 . 2]" 1
1280 1 18 ALA H 1 19 LEU HB2 . . 5.500 3.925 3.799 4.204 . 0 0 "[ . 1 . 2]" 1
1281 1 32 THR H 1 35 GLN H . . 4.440 3.870 3.241 4.102 . 0 0 "[ . 1 . 2]" 1
1282 1 28 PHE QD 1 84 TYR QD . . 4.240 2.335 2.194 2.583 . 0 0 "[ . 1 . 2]" 1
1283 1 84 TYR QD 1 89 PHE HA . . 4.110 2.844 2.246 3.550 . 0 0 "[ . 1 . 2]" 1
1284 1 84 TYR H 1 84 TYR QD . . 4.190 2.519 2.423 2.719 . 0 0 "[ . 1 . 2]" 1
1285 1 100 HIS H 1 100 HIS HD2 . . 5.070 5.074 4.983 5.112 0.042 19 0 "[ . 1 . 2]" 1
1286 1 74 TYR H 1 74 TYR QD . . 4.040 4.056 3.954 4.096 0.056 14 0 "[ . 1 . 2]" 1
1287 1 74 TYR QD 1 75 SER H . . 4.270 3.700 3.134 4.082 . 0 0 "[ . 1 . 2]" 1
1288 1 74 TYR QD 1 76 ASN H . . 5.230 5.270 5.185 5.323 0.093 3 0 "[ . 1 . 2]" 1
1289 1 74 TYR QD 1 75 SER HA . . 4.390 3.747 3.264 4.207 . 0 0 "[ . 1 . 2]" 1
1290 1 47 ILE MD 1 100 HIS HD2 . . 4.800 3.772 3.438 4.189 . 0 0 "[ . 1 . 2]" 1
1291 1 16 LEU HB3 1 74 TYR QD . . 4.390 2.900 2.552 3.214 . 0 0 "[ . 1 . 2]" 1
1292 1 97 LEU MD1 1 100 HIS HD2 . . 4.080 4.064 3.635 4.109 0.029 9 0 "[ . 1 . 2]" 1
1293 1 71 ILE H 1 72 LYS H . . 3.910 2.514 2.425 2.602 . 0 0 "[ . 1 . 2]" 1
1294 1 71 ILE HB 1 72 LYS H . . 5.010 3.923 3.753 4.003 . 0 0 "[ . 1 . 2]" 1
1295 1 71 ILE MD 1 72 LYS H . . 5.500 4.827 4.682 4.928 . 0 0 "[ . 1 . 2]" 1
1296 1 46 GLN HE22 1 49 ARG QD . . 4.920 2.800 1.984 3.755 . 0 0 "[ . 1 . 2]" 1
1297 1 17 ASP H 1 74 TYR QE . . 4.290 3.094 2.872 3.534 . 0 0 "[ . 1 . 2]" 1
1298 1 20 VAL HA 1 28 PHE QE . . 4.610 3.371 3.072 3.908 . 0 0 "[ . 1 . 2]" 1
1299 1 63 ASP HB3 1 64 ASP H . . 3.720 2.643 2.289 3.558 . 0 0 "[ . 1 . 2]" 1
1300 1 62 LEU H 1 64 ASP H . . 4.420 4.345 4.007 4.447 0.027 15 0 "[ . 1 . 2]" 1
1301 1 19 LEU HB2 1 28 PHE QE . . 5.360 5.178 4.869 5.365 0.005 9 0 "[ . 1 . 2]" 1
1302 1 28 PHE H 1 28 PHE QE . . 5.320 5.314 5.184 5.358 0.038 9 0 "[ . 1 . 2]" 1
1303 1 27 VAL HA 1 28 PHE QE . . 5.480 4.659 4.419 4.850 . 0 0 "[ . 1 . 2]" 1
1304 1 61 VAL HA 1 64 ASP H . . 4.200 3.491 3.037 3.824 . 0 0 "[ . 1 . 2]" 1
1305 1 89 PHE H 1 89 PHE QD . . 4.120 4.194 4.169 4.233 0.113 19 0 "[ . 1 . 2]" 1
1306 1 56 TYR QE 1 58 ALA H . . 5.290 3.776 3.516 4.004 . 0 0 "[ . 1 . 2]" 1
1307 1 102 ASN HD22 1 104 ASP H . . 5.230 4.059 3.098 5.032 . 0 0 "[ . 1 . 2]" 1
1308 1 23 ASP H 1 23 ASP HB3 . . 3.270 3.201 3.065 3.299 0.029 4 0 "[ . 1 . 2]" 1
1309 1 59 TYR QE 1 67 LEU QD . . 3.350 3.080 2.579 3.234 . 0 0 "[ . 1 . 2]" 1
1310 1 27 VAL H 1 56 TYR QD . . 4.220 4.278 4.247 4.308 0.088 15 0 "[ . 1 . 2]" 1
1311 1 59 TYR H 1 59 TYR QE . . 4.700 4.662 4.506 4.731 0.031 19 0 "[ . 1 . 2]" 1
1312 1 102 ASN HD22 1 104 ASP QB . . 3.560 3.480 3.195 3.594 0.034 3 0 "[ . 1 . 2]" 1
1313 1 25 VAL HB 1 56 TYR QD . . 4.080 4.036 3.940 4.122 0.042 7 0 "[ . 1 . 2]" 1
1314 1 56 TYR QD 1 58 ALA H . . 3.680 2.689 2.476 2.925 . 0 0 "[ . 1 . 2]" 1
1315 1 77 TRP HD1 1 79 THR H . . 3.650 2.771 2.197 3.068 . 0 0 "[ . 1 . 2]" 1
1316 1 28 PHE QD 1 59 TYR QD . . 4.370 4.182 3.485 4.526 0.156 15 0 "[ . 1 . 2]" 1
1317 1 82 GLN HB2 1 82 GLN HE22 . . 5.230 4.614 3.792 5.306 0.076 6 0 "[ . 1 . 2]" 1
1318 1 89 PHE HA 1 91 GLY H . . 4.200 3.737 3.609 3.964 . 0 0 "[ . 1 . 2]" 1
1319 1 90 VAL MG2 1 91 GLY H . . 4.430 3.551 1.698 4.288 . 0 0 "[ . 1 . 2]" 1
1320 1 89 PHE QD 1 91 GLY H . . 4.010 2.734 2.336 3.430 . 0 0 "[ . 1 . 2]" 1
1321 1 27 VAL HA 1 84 TYR QD . . 5.200 4.470 4.031 4.850 . 0 0 "[ . 1 . 2]" 1
1322 1 27 VAL HA 1 84 TYR H . . 4.170 3.693 3.533 3.792 . 0 0 "[ . 1 . 2]" 1
1323 1 27 VAL HA 1 28 PHE QD . . 3.990 2.883 2.735 3.039 . 0 0 "[ . 1 . 2]" 1
1324 1 27 VAL HA 1 58 ALA MB . . 5.500 5.393 5.223 5.514 0.014 5 0 "[ . 1 . 2]" 1
1325 1 85 LEU HA 1 87 GLY H . . 4.530 3.732 3.406 3.913 . 0 0 "[ . 1 . 2]" 1
1326 1 25 VAL H 1 85 LEU HA . . 5.500 4.990 4.797 5.256 . 0 0 "[ . 1 . 2]" 1
1327 1 29 LEU HB2 1 81 PRO HA . . 5.370 4.955 4.259 5.420 0.050 8 0 "[ . 1 . 2]" 1
1328 1 28 PHE HA 1 82 GLN H . . 5.150 4.638 4.547 4.892 . 0 0 "[ . 1 . 2]" 1
1329 1 28 PHE HA 1 28 PHE QD . . 3.500 2.845 2.723 2.991 . 0 0 "[ . 1 . 2]" 1
1330 1 28 PHE HA 1 28 PHE QE . . 5.050 4.557 4.426 4.624 . 0 0 "[ . 1 . 2]" 1
1331 1 56 TYR QD 1 58 ALA HA . . 4.030 3.219 3.035 3.434 . 0 0 "[ . 1 . 2]" 1
1332 1 58 ALA HA 1 59 TYR QD . . 4.090 3.914 3.500 4.150 0.060 17 0 "[ . 1 . 2]" 1
1333 1 27 VAL QG 1 58 ALA HA . . 3.380 3.099 3.070 3.137 . 0 0 "[ . 1 . 2]" 1
1334 1 57 ALA MB 1 58 ALA HA . . 5.490 4.436 4.371 4.527 . 0 0 "[ . 1 . 2]" 1
1335 1 77 TRP HA 1 77 TRP HD1 . . 4.090 3.868 3.445 4.039 . 0 0 "[ . 1 . 2]" 1
1336 1 77 TRP HA 1 79 THR H . . 5.370 4.203 3.943 4.442 . 0 0 "[ . 1 . 2]" 1
1337 1 77 TRP HA 1 77 TRP HE3 . . 3.740 3.181 2.920 3.413 . 0 0 "[ . 1 . 2]" 1
1338 1 77 TRP HA 1 78 PRO HG2 . . 4.460 4.452 4.349 4.501 0.041 2 0 "[ . 1 . 2]" 1
1339 1 77 TRP HA 1 77 TRP HZ3 . . 5.500 5.220 4.922 5.519 0.019 5 0 "[ . 1 . 2]" 1
1340 1 63 ASP H 1 64 ASP HA . . 5.460 5.362 5.130 5.469 0.009 12 0 "[ . 1 . 2]" 1
1341 1 64 ASP HA 1 65 PRO HG2 . . 4.470 4.316 4.205 4.460 . 0 0 "[ . 1 . 2]" 1
1342 1 84 TYR HA 1 84 TYR QD . . 4.460 3.164 3.020 3.229 . 0 0 "[ . 1 . 2]" 1
1343 1 84 TYR HA 1 90 VAL MG2 . . 5.110 3.100 1.941 3.765 . 0 0 "[ . 1 . 2]" 1
1344 1 84 TYR HA 1 89 PHE QD . . 4.200 3.988 3.091 4.228 0.028 9 0 "[ . 1 . 2]" 1
1345 1 20 VAL MG1 1 84 TYR HA . . 5.500 4.727 4.584 4.884 . 0 0 "[ . 1 . 2]" 1
1346 1 26 VAL HA 1 59 TYR QD . . 5.010 3.925 3.681 4.127 . 0 0 "[ . 1 . 2]" 1
1347 1 82 GLN HA 1 83 VAL HB . . 4.690 4.524 4.235 4.695 0.005 9 0 "[ . 1 . 2]" 1
1348 1 25 VAL HB 1 26 VAL HA . . 4.540 4.490 4.259 4.598 0.058 18 0 "[ . 1 . 2]" 1
1349 1 26 VAL HA 1 27 VAL QG . . 4.770 3.422 3.265 3.562 . 0 0 "[ . 1 . 2]" 1
1350 1 84 TYR HA 1 90 VAL MG1 . . 3.400 3.250 2.980 3.462 0.062 20 0 "[ . 1 . 2]" 1
1351 1 82 GLN HA 1 92 GLY H . . 5.460 4.742 4.536 5.067 . 0 0 "[ . 1 . 2]" 1
1352 1 83 VAL HA 1 84 TYR H . . 3.110 2.154 2.060 2.323 . 0 0 "[ . 1 . 2]" 1
1353 1 26 VAL H 1 83 VAL HA . . 5.220 4.760 4.524 4.953 . 0 0 "[ . 1 . 2]" 1
1354 1 83 VAL HA 1 83 VAL MG1 . . 3.540 3.269 3.252 3.287 . 0 0 "[ . 1 . 2]" 1
1355 1 48 LEU MD1 1 83 VAL HA . . 5.500 5.097 4.817 5.445 . 0 0 "[ . 1 . 2]" 1
1356 1 25 VAL HB 1 56 TYR HA . . 3.380 2.035 1.968 2.213 . 0 0 "[ . 1 . 2]" 1
1357 1 48 LEU MD1 1 56 TYR HA . . 5.500 5.229 4.825 5.509 0.009 13 0 "[ . 1 . 2]" 1
1358 1 25 VAL H 1 56 TYR HA . . 4.320 3.698 3.528 4.074 . 0 0 "[ . 1 . 2]" 1
1359 1 53 VAL MG1 1 56 TYR HA . . 4.780 4.272 4.074 4.433 . 0 0 "[ . 1 . 2]" 1
1360 1 32 THR HA 1 33 PRO HD3 . . 3.510 2.437 2.116 2.621 . 0 0 "[ . 1 . 2]" 1
1361 1 29 LEU QD 1 32 THR HA . . 4.060 2.865 2.453 3.112 . 0 0 "[ . 1 . 2]" 1
1362 1 32 THR HA 1 33 PRO HG3 . . 4.640 4.626 4.052 4.693 0.053 4 0 "[ . 1 . 2]" 1
1363 1 40 PHE HA 1 40 PHE QD . . 3.460 3.113 2.671 3.588 0.128 14 0 "[ . 1 . 2]" 1
1364 1 37 GLN HA 1 38 CYS HA . . 4.860 4.844 4.767 4.915 0.055 7 0 "[ . 1 . 2]" 1
1365 1 32 THR HA 1 33 PRO HA . . 4.390 4.341 4.215 4.414 0.024 2 0 "[ . 1 . 2]" 1
1366 1 29 LEU HA 1 30 LYS HA . . 5.080 4.473 4.390 4.608 . 0 0 "[ . 1 . 2]" 1
1367 1 28 PHE HB2 1 29 LEU HA . . 4.950 5.033 5.005 5.060 0.110 17 0 "[ . 1 . 2]" 1
1368 1 40 PHE HA 1 81 PRO HG2 . . 4.730 4.700 4.175 4.817 0.087 9 0 "[ . 1 . 2]" 1
1369 1 25 VAL HA 1 86 ASN H . . 4.630 4.061 3.767 4.401 . 0 0 "[ . 1 . 2]" 1
1370 1 25 VAL HA 1 84 TYR H . . 5.480 4.635 4.419 5.029 . 0 0 "[ . 1 . 2]" 1
1371 1 102 ASN HA 1 104 ASP H . . 4.940 4.874 4.742 4.962 0.022 7 0 "[ . 1 . 2]" 1
1372 1 25 VAL HA 1 26 VAL H . . 2.990 2.138 2.032 2.260 . 0 0 "[ . 1 . 2]" 1
1373 1 25 VAL HA 1 25 VAL MG2 . . 3.520 2.834 2.758 2.953 . 0 0 "[ . 1 . 2]" 1
1374 1 3 PHE HA 1 4 THR H . . 3.010 2.464 2.154 3.044 0.034 16 0 "[ . 1 . 2]" 1
1375 1 102 ASN HA 1 102 ASN HD21 . . 4.440 4.079 3.335 4.463 0.023 20 0 "[ . 1 . 2]" 1
1376 1 3 PHE HA 1 4 THR MG . . 4.720 3.867 3.266 4.729 0.009 15 0 "[ . 1 . 2]" 1
1377 1 86 ASN HA 1 86 ASN HD21 . . 4.790 4.293 4.246 4.379 . 0 0 "[ . 1 . 2]" 1
1378 1 86 ASN HA 1 112 LEU MD2 . . 4.140 3.886 3.116 4.208 0.068 17 0 "[ . 1 . 2]" 1
1379 1 29 LEU QD 1 59 TYR HA . . 5.500 4.813 4.623 5.030 . 0 0 "[ . 1 . 2]" 1
1380 1 59 TYR HA 1 59 TYR QE . . 4.610 4.618 4.462 4.653 0.043 3 0 "[ . 1 . 2]" 1
1381 1 53 VAL MG2 1 116 SER HA . . 4.790 4.043 3.790 4.342 . 0 0 "[ . 1 . 2]" 1
1382 1 109 LEU MD1 1 116 SER HA . . 5.070 2.943 2.667 3.303 . 0 0 "[ . 1 . 2]" 1
1383 1 32 THR HB 1 33 PRO HD2 . . 3.190 2.007 1.938 2.217 . 0 0 "[ . 1 . 2]" 1
1384 1 32 THR HB 1 58 ALA MB . . 5.240 4.607 4.336 4.915 . 0 0 "[ . 1 . 2]" 1
1385 1 37 GLN HE22 1 41 SER HB2 . . 3.910 3.484 2.570 3.977 0.067 15 0 "[ . 1 . 2]" 1
1386 1 38 CYS H 1 41 SER HB2 . . 4.470 4.432 3.387 4.600 0.130 8 0 "[ . 1 . 2]" 1
1387 1 104 ASP HA 1 107 GLU H . . 3.480 3.325 2.951 3.505 0.025 16 0 "[ . 1 . 2]" 1
1388 1 104 ASP HA 1 107 GLU QG . . 3.500 2.855 2.260 3.507 0.007 15 0 "[ . 1 . 2]" 1
1389 1 54 ARG HA 1 55 ASP H . . 3.330 3.254 2.889 3.385 0.055 8 0 "[ . 1 . 2]" 1
1390 1 31 GLY HA2 1 60 ASN QD . . 4.360 2.856 2.510 4.195 . 0 0 "[ . 1 . 2]" 1
1391 1 104 ASP HA 1 107 GLU HB2 . . 3.400 3.337 2.915 3.488 0.088 15 0 "[ . 1 . 2]" 1
1392 1 54 ARG HA 1 54 ARG QG . . 3.330 3.352 2.544 3.440 0.110 10 0 "[ . 1 . 2]" 1
1393 1 114 ILE HA 1 115 HIS HA . . 4.430 4.433 4.387 4.456 0.026 8 0 "[ . 1 . 2]" 1
1394 1 53 VAL HA 1 54 ARG HA . . 4.410 4.430 4.411 4.445 0.035 9 0 "[ . 1 . 2]" 1
1395 1 103 GLY HA2 1 106 VAL MG1 . . 5.010 4.623 4.460 4.815 . 0 0 "[ . 1 . 2]" 1
1396 1 30 LYS HA 1 61 VAL H . . 4.580 2.933 2.709 3.761 . 0 0 "[ . 1 . 2]" 1
1397 1 104 ASP HA 1 105 LEU H . . 3.550 3.392 3.330 3.459 . 0 0 "[ . 1 . 2]" 1
1398 1 30 LYS HA 1 31 GLY H . . 3.020 2.499 2.376 2.690 . 0 0 "[ . 1 . 2]" 1
1399 1 100 HIS HA 1 100 HIS HD2 . . 4.520 4.619 4.590 4.649 0.129 14 0 "[ . 1 . 2]" 1
1400 1 115 HIS HA 1 116 SER HB3 . . 4.380 4.274 4.165 4.396 0.016 20 0 "[ . 1 . 2]" 1
1401 1 30 LYS HA 1 61 VAL MG2 . . 3.460 2.269 2.110 2.413 . 0 0 "[ . 1 . 2]" 1
1402 1 114 ILE MG 1 115 HIS HA . . 3.920 3.834 3.706 3.936 0.016 16 0 "[ . 1 . 2]" 1
1403 1 99 MET HA 1 102 ASN HB3 . . 5.120 2.943 2.307 3.718 . 0 0 "[ . 1 . 2]" 1
1404 1 30 LYS HA 1 62 LEU MD2 . . 4.190 3.469 2.000 3.749 . 0 0 "[ . 1 . 2]" 1
1405 1 100 HIS HA 1 105 LEU MD2 . . 4.360 4.231 4.103 4.327 . 0 0 "[ . 1 . 2]" 1
1406 1 65 PRO HA 1 67 LEU H . . 4.570 4.204 4.063 4.392 . 0 0 "[ . 1 . 2]" 1
1407 1 80 ILE HA 1 81 PRO HD3 . . 3.920 2.440 2.029 3.475 . 0 0 "[ . 1 . 2]" 1
1408 1 7 ALA HA 1 8 GLY H . . 3.440 2.683 2.148 3.510 0.070 4 0 "[ . 1 . 2]" 1
1409 1 56 TYR QD 1 57 ALA HA . . 4.470 3.324 3.047 3.630 . 0 0 "[ . 1 . 2]" 1
1410 1 115 HIS HD2 1 117 ALA HA . . 4.710 3.114 2.454 4.028 . 0 0 "[ . 1 . 2]" 1
1411 1 119 LEU HA 1 119 LEU HB2 . . 2.930 2.943 2.869 2.980 0.050 8 0 "[ . 1 . 2]" 1
1412 1 4 THR HA 1 5 MET H . . 3.060 2.454 2.152 3.285 0.225 14 0 "[ . 1 . 2]" 1
1413 1 42 ASN HA 1 42 ASN HD22 . . 4.920 4.449 3.405 5.079 0.159 17 0 "[ . 1 . 2]" 1
1414 1 51 HIS HA 1 51 HIS HD2 . . 4.580 4.231 4.120 4.373 . 0 0 "[ . 1 . 2]" 1
1415 1 49 ARG HA 1 49 ARG HG2 . . 3.840 3.830 3.736 3.892 0.052 8 0 "[ . 1 . 2]" 1
1416 1 48 LEU MD2 1 49 ARG HA . . 5.500 5.514 5.505 5.528 0.028 7 0 "[ . 1 . 2]" 1
1417 1 61 VAL MG2 1 62 LEU HA . . 4.170 3.941 3.381 4.130 . 0 0 "[ . 1 . 2]" 1
1418 1 118 LEU HA 1 118 LEU MD1 . . 3.800 3.792 3.746 3.810 0.010 4 0 "[ . 1 . 2]" 1
1419 1 74 TYR HA 1 74 TYR QD . . 3.180 3.056 2.653 3.190 0.010 6 0 "[ . 1 . 2]" 1
1420 1 17 ASP HA 1 74 TYR QE . . 3.550 3.495 2.894 3.605 0.055 19 0 "[ . 1 . 2]" 1
1421 1 107 GLU HA 1 110 LYS QB . . 3.080 2.496 1.951 3.177 0.097 17 0 "[ . 1 . 2]" 1
1422 1 71 ILE HA 1 71 ILE HG12 . . 3.280 3.421 3.407 3.439 0.159 5 0 "[ . 1 . 2]" 1
1423 1 97 LEU HA 1 100 HIS H . . 3.900 3.889 3.709 3.935 0.035 14 0 "[ . 1 . 2]" 1
1424 1 13 ALA HA 1 74 TYR QE . . 4.030 3.166 2.626 3.853 . 0 0 "[ . 1 . 2]" 1
1425 1 65 PRO HD2 1 66 GLU H . . 3.130 2.730 2.563 3.052 . 0 0 "[ . 1 . 2]" 1
1426 1 14 GLU HA 1 17 ASP HB2 . . 4.060 3.164 2.283 3.611 . 0 0 "[ . 1 . 2]" 1
1427 1 67 LEU HA 1 71 ILE H . . 4.340 3.961 3.839 4.105 . 0 0 "[ . 1 . 2]" 1
1428 1 20 VAL HA 1 28 PHE HZ . . 5.040 3.357 3.118 3.595 . 0 0 "[ . 1 . 2]" 1
1429 1 67 LEU HA 1 67 LEU QD . . 3.150 2.212 2.142 2.604 . 0 0 "[ . 1 . 2]" 1
1430 1 109 LEU HA 1 109 LEU MD1 . . 4.510 3.881 3.866 3.900 . 0 0 "[ . 1 . 2]" 1
1431 1 15 GLN HE22 1 19 LEU HA . . 4.920 4.785 4.353 4.961 0.041 6 0 "[ . 1 . 2]" 1
1432 1 53 VAL HA 1 54 ARG H . . 2.660 2.100 2.036 2.205 . 0 0 "[ . 1 . 2]" 1
1433 1 53 VAL HA 1 53 VAL MG2 . . 3.580 2.445 2.402 2.500 . 0 0 "[ . 1 . 2]" 1
1434 1 12 SER H 1 12 SER HB3 . . 3.640 3.557 2.630 3.721 0.081 5 0 "[ . 1 . 2]" 1
1435 1 104 ASP H 1 105 LEU HA . . 5.150 5.180 5.114 5.221 0.071 8 0 "[ . 1 . 2]" 1
1436 1 52 GLY HA3 1 116 SER HA . . 4.460 4.490 4.419 4.534 0.074 14 0 "[ . 1 . 2]" 1
1437 1 51 HIS HB2 1 52 GLY HA3 . . 5.500 5.478 5.404 5.513 0.013 11 0 "[ . 1 . 2]" 1
1438 1 101 GLN H 1 101 GLN HA . . 2.930 2.886 2.865 2.910 . 0 0 "[ . 1 . 2]" 1
1439 1 101 GLN HA 1 103 GLY H . . 4.610 4.292 4.155 4.481 . 0 0 "[ . 1 . 2]" 1
1440 1 100 HIS HD2 1 101 GLN HA . . 3.910 3.937 3.849 3.974 0.064 9 0 "[ . 1 . 2]" 1
1441 1 101 GLN HA 1 101 GLN HG2 . . 3.660 2.401 2.264 2.532 . 0 0 "[ . 1 . 2]" 1
1442 1 48 LEU HA 1 51 HIS HD2 . . 4.450 4.011 3.729 4.154 . 0 0 "[ . 1 . 2]" 1
1443 1 31 GLY HA3 1 32 THR H . . 3.330 2.354 1.945 2.618 . 0 0 "[ . 1 . 2]" 1
1444 1 41 SER HB3 1 42 ASN H . . 4.210 3.707 2.749 4.264 0.054 14 0 "[ . 1 . 2]" 1
1445 1 37 GLN HE22 1 41 SER HB3 . . 4.040 2.944 1.902 4.043 0.003 19 0 "[ . 1 . 2]" 1
1446 1 89 PHE QD 1 90 VAL HA . . 4.980 4.656 4.397 4.893 . 0 0 "[ . 1 . 2]" 1
1447 1 33 PRO HD2 1 34 GLU H . . 4.070 2.883 2.347 3.297 . 0 0 "[ . 1 . 2]" 1
1448 1 32 THR MG 1 33 PRO HD2 . . 4.370 3.329 2.970 3.787 . 0 0 "[ . 1 . 2]" 1
1449 1 33 PRO HD2 1 58 ALA MB . . 4.130 3.243 3.012 3.539 . 0 0 "[ . 1 . 2]" 1
1450 1 75 SER H 1 75 SER HB2 . . 3.900 2.941 2.435 3.754 . 0 0 "[ . 1 . 2]" 1
1451 1 16 LEU HA 1 28 PHE HZ . . 5.360 5.216 4.919 5.373 0.013 6 0 "[ . 1 . 2]" 1
1452 1 116 SER H 1 116 SER HB3 . . 3.470 2.158 2.094 2.316 . 0 0 "[ . 1 . 2]" 1
1453 1 16 LEU HA 1 19 LEU H . . 3.540 3.222 3.151 3.286 . 0 0 "[ . 1 . 2]" 1
1454 1 106 VAL MG2 1 116 SER HB3 . . 4.230 3.658 3.588 3.773 . 0 0 "[ . 1 . 2]" 1
1455 1 16 LEU HA 1 18 ALA H . . 5.340 4.196 4.051 4.601 . 0 0 "[ . 1 . 2]" 1
1456 1 100 HIS HB2 1 101 GLN HG2 . . 3.700 3.831 3.800 3.881 0.181 9 0 "[ . 1 . 2]" 1
1457 1 99 MET H 1 100 HIS HB2 . . 5.500 5.013 4.829 5.138 . 0 0 "[ . 1 . 2]" 1
1458 1 100 HIS HB2 1 100 HIS HD2 . . 3.530 3.342 3.283 3.395 . 0 0 "[ . 1 . 2]" 1
1459 1 100 HIS H 1 100 HIS HB2 . . 3.350 2.407 2.323 2.511 . 0 0 "[ . 1 . 2]" 1
1460 1 86 ASN H 1 87 GLY HA3 . . 5.430 5.489 5.468 5.519 0.089 13 0 "[ . 1 . 2]" 1
1461 1 33 PRO HD3 1 58 ALA MB . . 3.940 2.110 1.972 2.332 . 0 0 "[ . 1 . 2]" 1
1462 1 29 LEU QD 1 33 PRO HD3 . . 4.290 3.115 2.675 3.347 . 0 0 "[ . 1 . 2]" 1
1463 1 100 HIS HB2 1 105 LEU MD1 . . 5.190 2.801 2.685 2.906 . 0 0 "[ . 1 . 2]" 1
1464 1 20 VAL MG1 1 87 GLY HA3 . . 4.640 4.726 4.707 4.755 0.115 4 0 "[ . 1 . 2]" 1
1465 1 51 HIS HE1 1 106 VAL HA . . 4.180 4.235 4.198 4.256 0.076 2 0 "[ . 1 . 2]" 1
1466 1 86 ASN HB2 1 86 ASN HD22 . . 3.700 3.492 3.392 3.574 . 0 0 "[ . 1 . 2]" 1
1467 1 86 ASN HB2 1 112 LEU MD2 . . 3.840 2.088 1.962 2.273 . 0 0 "[ . 1 . 2]" 1
1468 1 40 PHE H 1 40 PHE HB2 . . 3.950 3.369 2.305 3.992 0.042 1 0 "[ . 1 . 2]" 1
1469 1 35 GLN HB3 1 36 PRO QD . . 3.960 3.385 2.783 3.998 0.038 3 0 "[ . 1 . 2]" 1
1470 1 40 PHE HB2 1 81 PRO HG2 . . 3.950 3.502 2.569 3.970 0.020 18 0 "[ . 1 . 2]" 1
1471 1 106 VAL HA 1 109 LEU HB2 . . 3.520 2.558 2.445 2.620 . 0 0 "[ . 1 . 2]" 1
1472 1 40 PHE HB2 1 41 SER HA . . 4.790 4.632 4.109 4.814 0.024 13 0 "[ . 1 . 2]" 1
1473 1 40 PHE HB2 1 81 PRO HD2 . . 3.980 4.011 3.789 4.105 0.125 5 0 "[ . 1 . 2]" 1
1474 1 77 TRP HE3 1 78 PRO HD2 . . 5.010 4.943 4.643 5.071 0.061 5 0 "[ . 1 . 2]" 1
1475 1 44 VAL HA 1 96 LEU QD . . 3.250 2.205 2.076 2.342 . 0 0 "[ . 1 . 2]" 1
1476 1 44 VAL HA 1 47 ILE MD . . 3.550 3.011 2.736 3.370 . 0 0 "[ . 1 . 2]" 1
1477 1 45 VAL HA 1 48 LEU MD2 . . 4.940 4.881 4.679 4.952 0.012 16 0 "[ . 1 . 2]" 1
1478 1 47 ILE HA 1 50 LEU H . . 4.020 3.679 3.555 3.756 . 0 0 "[ . 1 . 2]" 1
1479 1 47 ILE HA 1 51 HIS H . . 4.450 4.154 4.051 4.274 . 0 0 "[ . 1 . 2]" 1
1480 1 78 PRO HD2 1 79 THR H . . 4.560 2.946 2.664 3.238 . 0 0 "[ . 1 . 2]" 1
1481 1 75 SER H 1 75 SER HB3 . . 4.140 3.237 2.491 3.733 . 0 0 "[ . 1 . 2]" 1
1482 1 89 PHE HA 1 89 PHE QD . . 3.160 2.252 2.031 2.481 . 0 0 "[ . 1 . 2]" 1
1483 1 75 SER HB3 1 76 ASN H . . 4.700 4.275 3.607 4.480 . 0 0 "[ . 1 . 2]" 1
1484 1 83 VAL MG2 1 84 TYR HB2 . . 4.640 4.461 4.357 4.572 . 0 0 "[ . 1 . 2]" 1
1485 1 20 VAL MG1 1 84 TYR HB2 . . 4.920 2.657 2.446 2.867 . 0 0 "[ . 1 . 2]" 1
1486 1 84 TYR H 1 84 TYR HB2 . . 3.900 2.589 2.361 2.676 . 0 0 "[ . 1 . 2]" 1
1487 1 26 VAL H 1 84 TYR HB2 . . 4.320 3.741 3.508 3.916 . 0 0 "[ . 1 . 2]" 1
1488 1 51 HIS HB2 1 53 VAL MG2 . . 4.040 3.221 2.903 3.386 . 0 0 "[ . 1 . 2]" 1
1489 1 114 ILE MG 1 115 HIS HB2 . . 4.150 4.220 4.193 4.250 0.100 6 0 "[ . 1 . 2]" 1
1490 1 51 HIS HB2 1 109 LEU MD1 . . 4.310 3.443 3.219 3.618 . 0 0 "[ . 1 . 2]" 1
1491 1 115 HIS H 1 115 HIS HB2 . . 3.360 2.379 2.264 2.506 . 0 0 "[ . 1 . 2]" 1
1492 1 51 HIS HB2 1 117 ALA MB . . 5.500 5.284 5.129 5.414 . 0 0 "[ . 1 . 2]" 1
1493 1 45 VAL QG 1 49 ARG QD . . 4.620 3.177 2.394 4.341 . 0 0 "[ . 1 . 2]" 1
1494 1 51 HIS HB2 1 52 GLY H . . 4.050 3.845 3.732 3.917 . 0 0 "[ . 1 . 2]" 1
1495 1 102 ASN H 1 102 ASN HB2 . . 3.700 2.877 2.283 3.534 . 0 0 "[ . 1 . 2]" 1
1496 1 102 ASN HB2 1 103 GLY H . . 4.610 4.205 3.918 4.476 . 0 0 "[ . 1 . 2]" 1
1497 1 60 ASN HB2 1 61 VAL H . . 4.850 4.566 4.487 4.709 . 0 0 "[ . 1 . 2]" 1
1498 1 65 PRO HB2 1 68 ARG QD . . 4.930 4.938 4.878 4.971 0.041 19 0 "[ . 1 . 2]" 1
1499 1 13 ALA MB 1 74 TYR HB2 . . 5.060 4.645 4.055 5.070 0.010 6 0 "[ . 1 . 2]" 1
1500 1 73 ASP H 1 74 TYR HB2 . . 5.400 4.867 4.682 5.055 . 0 0 "[ . 1 . 2]" 1
1501 1 62 LEU MD2 1 68 ARG QD . . 4.780 3.721 2.461 5.204 0.424 9 0 "[ . 1 . 2]" 1
1502 1 16 LEU MD2 1 74 TYR HB2 . . 5.260 4.281 3.845 5.032 . 0 0 "[ . 1 . 2]" 1
1503 1 74 TYR H 1 74 TYR HB2 . . 3.460 2.234 2.097 2.338 . 0 0 "[ . 1 . 2]" 1
1504 1 74 TYR HB2 1 75 SER H . . 4.010 3.875 3.640 4.025 0.015 2 0 "[ . 1 . 2]" 1
1505 1 77 TRP H 1 77 TRP HB2 . . 3.600 2.598 2.333 2.763 . 0 0 "[ . 1 . 2]" 1
1506 1 47 ILE MG 1 100 HIS HB3 . . 4.030 4.055 3.997 4.079 0.049 19 0 "[ . 1 . 2]" 1
1507 1 100 HIS HB3 1 105 LEU MD1 . . 4.010 3.961 3.867 4.018 0.008 20 0 "[ . 1 . 2]" 1
1508 1 100 HIS H 1 100 HIS HB3 . . 3.360 2.626 2.577 2.684 . 0 0 "[ . 1 . 2]" 1
1509 1 100 HIS HB3 1 101 GLN H . . 3.950 2.281 2.150 2.408 . 0 0 "[ . 1 . 2]" 1
1510 1 47 ILE MD 1 100 HIS HB3 . . 4.410 3.419 3.189 3.745 . 0 0 "[ . 1 . 2]" 1
1511 1 19 LEU QD 1 22 LYS QE . . 4.100 3.062 2.129 3.776 . 0 0 "[ . 1 . 2]" 1
1512 1 89 PHE H 1 89 PHE HB2 . . 3.190 2.490 2.302 2.890 . 0 0 "[ . 1 . 2]" 1
1513 1 28 PHE HB2 1 29 LEU H . . 5.080 4.553 4.512 4.588 . 0 0 "[ . 1 . 2]" 1
1514 1 28 PHE HB2 1 81 PRO HA . . 4.820 4.457 4.218 4.611 . 0 0 "[ . 1 . 2]" 1
1515 1 40 PHE QD 1 93 CYS HB2 . . 3.950 2.876 2.488 3.715 . 0 0 "[ . 1 . 2]" 1
1516 1 38 CYS H 1 38 CYS HB3 . . 3.740 3.089 2.872 3.766 0.026 7 0 "[ . 1 . 2]" 1
1517 1 110 LYS QB 1 110 LYS HE2 . . 4.060 4.003 2.295 4.151 0.091 12 0 "[ . 1 . 2]" 1
1518 1 17 ASP H 1 17 ASP HB2 . . 3.200 2.421 1.982 2.612 . 0 0 "[ . 1 . 2]" 1
1519 1 64 ASP H 1 64 ASP HB2 . . 3.070 2.378 2.273 2.493 . 0 0 "[ . 1 . 2]" 1
1520 1 64 ASP HB2 1 65 PRO HD2 . . 4.870 4.661 4.378 4.879 0.009 5 0 "[ . 1 . 2]" 1
1521 1 99 MET H 1 99 MET HG2 . . 3.560 3.233 3.167 3.311 . 0 0 "[ . 1 . 2]" 1
1522 1 28 PHE HB3 1 29 LEU H . . 4.210 3.970 3.863 4.094 . 0 0 "[ . 1 . 2]" 1
1523 1 42 ASN H 1 42 ASN HB2 . . 3.470 2.710 2.233 3.521 0.051 11 0 "[ . 1 . 2]" 1
1524 1 111 LYS H 1 111 LYS QE . . 4.540 4.152 3.167 4.548 0.008 3 0 "[ . 1 . 2]" 1
1525 1 42 ASN HB2 1 42 ASN HD22 . . 4.080 3.731 3.379 4.016 . 0 0 "[ . 1 . 2]" 1
1526 1 106 VAL MG2 1 110 LYS HE3 . . 4.520 4.557 4.422 4.612 0.092 17 0 "[ . 1 . 2]" 1
1527 1 99 MET HG2 1 105 LEU HG . . 5.460 4.950 4.866 5.023 . 0 0 "[ . 1 . 2]" 1
1528 1 74 TYR H 1 74 TYR HB3 . . 3.400 2.572 2.339 2.796 . 0 0 "[ . 1 . 2]" 1
1529 1 73 ASP H 1 74 TYR HB3 . . 5.250 4.970 4.690 5.206 . 0 0 "[ . 1 . 2]" 1
1530 1 16 LEU MD1 1 74 TYR HB3 . . 4.300 3.100 2.604 3.673 . 0 0 "[ . 1 . 2]" 1
1531 1 71 ILE MD 1 74 TYR HB3 . . 4.250 2.415 2.254 2.542 . 0 0 "[ . 1 . 2]" 1
1532 1 120 ASP HB3 1 121 GLU H . . 4.140 4.060 3.916 4.207 0.067 9 0 "[ . 1 . 2]" 1
1533 1 59 TYR HB2 1 60 ASN H . . 4.650 4.493 4.249 4.613 . 0 0 "[ . 1 . 2]" 1
1534 1 28 PHE QD 1 59 TYR HB2 . . 3.670 3.187 2.813 3.384 . 0 0 "[ . 1 . 2]" 1
1535 1 28 PHE QE 1 59 TYR HB2 . . 5.090 3.815 3.522 4.005 . 0 0 "[ . 1 . 2]" 1
1536 1 51 HIS HB3 1 118 LEU MD1 . . 5.320 5.038 4.922 5.225 . 0 0 "[ . 1 . 2]" 1
1537 1 102 ASN HB3 1 104 ASP H . . 4.580 3.571 2.813 4.583 0.003 10 0 "[ . 1 . 2]" 1
1538 1 102 ASN H 1 102 ASN HB3 . . 3.640 2.239 2.184 2.325 . 0 0 "[ . 1 . 2]" 1
1539 1 51 HIS HB3 1 117 ALA MB . . 5.340 4.799 4.661 4.968 . 0 0 "[ . 1 . 2]" 1
1540 1 51 HIS HB3 1 51 HIS HD2 . . 3.970 3.778 3.709 3.814 . 0 0 "[ . 1 . 2]" 1
1541 1 51 HIS H 1 51 HIS HB3 . . 3.570 3.503 3.486 3.526 . 0 0 "[ . 1 . 2]" 1
1542 1 72 LYS QE 1 78 PRO HA . . 4.090 2.627 1.836 4.112 0.022 13 0 "[ . 1 . 2]" 1
1543 1 51 HIS HB3 1 109 LEU MD1 . . 4.530 2.485 2.226 2.694 . 0 0 "[ . 1 . 2]" 1
1544 1 48 LEU MD2 1 51 HIS HB3 . . 5.060 4.666 4.556 4.767 . 0 0 "[ . 1 . 2]" 1
1545 1 69 GLN HA 1 72 LYS QE . . 5.400 4.352 3.618 4.841 . 0 0 "[ . 1 . 2]" 1
1546 1 25 VAL MG1 1 56 TYR HB2 . . 3.770 3.814 3.776 3.844 0.074 3 0 "[ . 1 . 2]" 1
1547 1 48 LEU MD1 1 56 TYR HB2 . . 5.500 4.023 3.791 4.301 . 0 0 "[ . 1 . 2]" 1
1548 1 42 ASN H 1 42 ASN HB3 . . 3.270 2.648 2.454 2.914 . 0 0 "[ . 1 . 2]" 1
1549 1 42 ASN HB3 1 43 ALA H . . 3.930 3.204 2.628 3.996 0.066 8 0 "[ . 1 . 2]" 1
1550 1 82 GLN HB3 1 82 GLN HE21 . . 4.630 3.964 2.287 4.663 0.033 3 0 "[ . 1 . 2]" 1
1551 1 40 PHE QD 1 93 CYS HB3 . . 5.110 2.088 2.000 2.232 . 0 0 "[ . 1 . 2]" 1
1552 1 84 TYR H 1 84 TYR HB3 . . 4.170 3.749 3.593 3.811 . 0 0 "[ . 1 . 2]" 1
1553 1 104 ASP H 1 104 ASP QB . . 3.060 2.136 1.973 2.272 . 0 0 "[ . 1 . 2]" 1
1554 1 104 ASP QB 1 105 LEU H . . 3.860 3.330 3.025 3.484 . 0 0 "[ . 1 . 2]" 1
1555 1 99 MET ME 1 104 ASP QB . . 3.150 2.047 1.941 2.147 . 0 0 "[ . 1 . 2]" 1
1556 1 53 VAL MG1 1 56 TYR HB3 . . 3.830 3.728 3.512 3.859 0.029 9 0 "[ . 1 . 2]" 1
1557 1 20 VAL MG1 1 84 TYR HB3 . . 4.720 3.090 2.811 3.279 . 0 0 "[ . 1 . 2]" 1
1558 1 89 PHE H 1 89 PHE HB3 . . 3.090 2.488 2.322 2.843 . 0 0 "[ . 1 . 2]" 1
1559 1 73 ASP HB3 1 74 TYR H . . 3.690 2.465 2.316 2.744 . 0 0 "[ . 1 . 2]" 1
1560 1 101 GLN H 1 101 GLN HG2 . . 3.490 2.831 2.718 2.936 . 0 0 "[ . 1 . 2]" 1
1561 1 25 VAL MG2 1 56 TYR HB3 . . 4.530 3.759 3.663 3.845 . 0 0 "[ . 1 . 2]" 1
1562 1 56 TYR HB3 1 57 ALA H . . 3.670 3.449 3.305 3.538 . 0 0 "[ . 1 . 2]" 1
1563 1 56 TYR HB3 1 57 ALA MB . . 5.500 5.308 5.190 5.396 . 0 0 "[ . 1 . 2]" 1
1564 1 27 VAL QG 1 56 TYR HB3 . . 4.150 2.320 2.247 2.425 . 0 0 "[ . 1 . 2]" 1
1565 1 25 VAL HB 1 56 TYR HB3 . . 3.490 2.273 2.189 2.327 . 0 0 "[ . 1 . 2]" 1
1566 1 120 ASP H 1 120 ASP HB2 . . 2.930 2.602 2.357 2.943 0.013 3 0 "[ . 1 . 2]" 1
1567 1 77 TRP HB3 1 79 THR HA . . 4.530 4.415 3.546 4.644 0.114 20 0 "[ . 1 . 2]" 1
1568 1 64 ASP H 1 64 ASP HB3 . . 3.510 3.573 3.533 3.620 0.110 15 0 "[ . 1 . 2]" 1
1569 1 23 ASP HB2 1 24 LYS H . . 3.710 3.796 3.754 3.830 0.120 16 0 "[ . 1 . 2]" 1
1570 1 23 ASP H 1 23 ASP HB2 . . 3.720 2.906 2.495 3.107 . 0 0 "[ . 1 . 2]" 1
1571 1 37 GLN HB2 1 38 CYS H . . 4.200 3.290 2.752 4.126 . 0 0 "[ . 1 . 2]" 1
1572 1 99 MET HG3 1 100 HIS H . . 5.500 4.453 4.390 4.513 . 0 0 "[ . 1 . 2]" 1
1573 1 99 MET H 1 99 MET HG3 . . 3.750 2.127 2.097 2.181 . 0 0 "[ . 1 . 2]" 1
1574 1 37 GLN HB2 1 38 CYS HA . . 5.260 4.913 4.497 5.346 0.086 17 0 "[ . 1 . 2]" 1
1575 1 30 LYS QG 1 37 GLN HB2 . . 4.190 3.633 2.785 4.248 0.058 18 0 "[ . 1 . 2]" 1
1576 1 5 MET HB2 1 6 GLY H . . 4.160 3.010 2.159 4.215 0.055 4 0 "[ . 1 . 2]" 1
1577 1 95 ILE MG 1 99 MET HG3 . . 4.090 2.455 2.276 2.623 . 0 0 "[ . 1 . 2]" 1
1578 1 89 PHE QD 1 91 GLY HA3 . . 4.690 4.760 4.726 4.798 0.108 2 0 "[ . 1 . 2]" 1
1579 1 99 MET HB2 1 99 MET HG3 . . 2.400 2.416 2.408 2.426 0.026 14 0 "[ . 1 . 2]" 1
1580 1 101 GLN HA 1 101 GLN HG3 . . 3.380 3.431 3.393 3.456 0.076 16 0 "[ . 1 . 2]" 1
1581 1 100 HIS HD2 1 101 GLN HG3 . . 4.160 2.962 2.652 3.155 . 0 0 "[ . 1 . 2]" 1
1582 1 45 VAL H 1 46 GLN QG . . 5.270 4.567 4.362 4.813 . 0 0 "[ . 1 . 2]" 1
1583 1 29 LEU QD 1 33 PRO HB3 . . 4.610 3.782 3.491 4.149 . 0 0 "[ . 1 . 2]" 1
1584 1 65 PRO HB2 1 66 GLU H . . 4.140 3.657 3.460 3.784 . 0 0 "[ . 1 . 2]" 1
1585 1 33 PRO HB3 1 58 ALA MB . . 3.850 3.126 2.578 3.857 0.007 12 0 "[ . 1 . 2]" 1
1586 1 28 PHE QD 1 59 TYR HB3 . . 3.720 3.660 3.178 3.745 0.025 14 0 "[ . 1 . 2]" 1
1587 1 86 ASN HB3 1 112 LEU MD2 . . 3.570 3.384 2.886 3.594 0.024 16 0 "[ . 1 . 2]" 1
1588 1 86 ASN H 1 86 ASN HB3 . . 4.060 3.800 3.669 3.867 . 0 0 "[ . 1 . 2]" 1
1589 1 108 GLU HB3 1 108 GLU HG3 . . 2.960 2.511 2.427 2.567 . 0 0 "[ . 1 . 2]" 1
1590 1 85 LEU MD2 1 108 GLU HG3 . . 5.040 2.847 2.326 4.120 . 0 0 "[ . 1 . 2]" 1
1591 1 12 SER H 1 15 GLN HG2 . . 5.330 4.516 3.408 5.342 0.012 6 0 "[ . 1 . 2]" 1
1592 1 98 GLN H 1 98 GLN HG3 . . 3.590 3.641 3.570 3.664 0.074 11 0 "[ . 1 . 2]" 1
1593 1 34 GLU HG2 1 35 GLN HE21 . . 5.500 4.539 2.781 5.527 0.027 4 0 "[ . 1 . 2]" 1
1594 1 45 VAL HB 1 46 GLN H . . 3.440 2.923 2.774 3.025 . 0 0 "[ . 1 . 2]" 1
1595 1 88 GLU HA 1 88 GLU HG2 . . 3.160 3.181 2.912 3.240 0.080 8 0 "[ . 1 . 2]" 1
1596 1 13 ALA MB 1 14 GLU QG . . 4.950 4.411 4.036 4.892 . 0 0 "[ . 1 . 2]" 1
1597 1 97 LEU H 1 98 GLN QB . . 5.350 4.815 4.695 4.908 . 0 0 "[ . 1 . 2]" 1
1598 1 98 GLN QB 1 100 HIS H . . 4.480 4.557 4.540 4.570 0.090 6 0 "[ . 1 . 2]" 1
1599 1 98 GLN QB 1 98 GLN HE22 . . 4.490 4.493 4.420 4.527 0.037 5 0 "[ . 1 . 2]" 1
1600 1 66 GLU HA 1 66 GLU HG3 . . 3.640 3.366 2.372 3.737 0.097 19 0 "[ . 1 . 2]" 1
1601 1 98 GLN H 1 98 GLN QB . . 2.900 2.533 2.380 2.659 . 0 0 "[ . 1 . 2]" 1
1602 1 98 GLN HA 1 98 GLN QB . . 2.710 2.297 2.268 2.347 . 0 0 "[ . 1 . 2]" 1
1603 1 101 GLN H 1 101 GLN HB2 . . 3.400 2.354 2.317 2.390 . 0 0 "[ . 1 . 2]" 1
1604 1 88 GLU HG3 1 89 PHE H . . 5.070 2.423 2.102 2.822 . 0 0 "[ . 1 . 2]" 1
1605 1 88 GLU HA 1 88 GLU HG3 . . 3.110 2.412 2.262 2.554 . 0 0 "[ . 1 . 2]" 1
1606 1 66 GLU HB2 1 67 LEU HA . . 4.310 4.358 4.330 4.387 0.077 3 0 "[ . 1 . 2]" 1
1607 1 68 ARG H 1 68 ARG HB2 . . 3.550 2.247 2.066 2.436 . 0 0 "[ . 1 . 2]" 1
1608 1 65 PRO HA 1 68 ARG HB2 . . 3.560 2.584 2.383 3.042 . 0 0 "[ . 1 . 2]" 1
1609 1 44 VAL HB 1 45 VAL H . . 3.630 3.618 3.500 3.650 0.020 18 0 "[ . 1 . 2]" 1
1610 1 107 GLU H 1 107 GLU HB2 . . 2.930 2.549 2.341 2.939 0.009 15 0 "[ . 1 . 2]" 1
1611 1 107 GLU HB2 1 108 GLU H . . 3.560 2.629 2.269 3.711 0.151 15 0 "[ . 1 . 2]" 1
1612 1 69 GLN HB2 1 69 GLN HE22 . . 5.460 4.665 3.972 5.397 . 0 0 "[ . 1 . 2]" 1
1613 1 35 GLN HB3 1 35 GLN QG . . 2.640 2.330 2.156 2.411 . 0 0 "[ . 1 . 2]" 1
1614 1 23 ASP HB3 1 26 VAL QG . . 3.640 2.126 2.037 2.414 . 0 0 "[ . 1 . 2]" 1
1615 1 23 ASP HB3 1 26 VAL HA . . 4.050 3.722 3.364 4.109 0.059 5 0 "[ . 1 . 2]" 1
1616 1 101 GLN H 1 101 GLN HB3 . . 3.560 3.519 3.490 3.553 . 0 0 "[ . 1 . 2]" 1
1617 1 53 VAL H 1 53 VAL HB . . 3.100 2.607 2.510 2.675 . 0 0 "[ . 1 . 2]" 1
1618 1 48 LEU MD2 1 53 VAL HB . . 3.780 2.526 2.359 2.667 . 0 0 "[ . 1 . 2]" 1
1619 1 99 MET HB2 1 100 HIS H . . 4.140 2.810 2.738 2.934 . 0 0 "[ . 1 . 2]" 1
1620 1 46 GLN H 1 46 GLN QB . . 2.920 2.348 2.227 2.521 . 0 0 "[ . 1 . 2]" 1
1621 1 99 MET H 1 99 MET HB2 . . 3.460 2.359 2.325 2.412 . 0 0 "[ . 1 . 2]" 1
1622 1 101 GLN HB3 1 101 GLN HE22 . . 5.500 3.970 3.686 4.388 . 0 0 "[ . 1 . 2]" 1
1623 1 64 ASP HA 1 65 PRO HG3 . . 4.890 4.603 4.554 4.666 . 0 0 "[ . 1 . 2]" 1
1624 1 25 VAL HB 1 56 TYR HB2 . . 3.210 3.226 3.211 3.239 0.029 15 0 "[ . 1 . 2]" 1
1625 1 48 LEU MD1 1 53 VAL HB . . 4.640 4.235 4.034 4.451 . 0 0 "[ . 1 . 2]" 1
1626 1 80 ILE HB 1 82 GLN HE21 . . 4.820 3.500 2.630 4.829 0.009 20 0 "[ . 1 . 2]" 1
1627 1 100 HIS HD2 1 101 GLN HB3 . . 4.390 4.510 4.494 4.526 0.136 14 0 "[ . 1 . 2]" 1
1628 1 51 HIS HB2 1 53 VAL HB . . 4.540 3.990 3.804 4.123 . 0 0 "[ . 1 . 2]" 1
1629 1 30 LYS HB2 1 30 LYS HE2 . . 3.790 2.400 1.997 2.920 . 0 0 "[ . 1 . 2]" 1
1630 1 46 GLN QB 1 47 ILE MD . . 5.060 4.449 4.194 4.837 . 0 0 "[ . 1 . 2]" 1
1631 1 26 VAL HB 1 84 TYR H . . 4.430 3.813 3.474 4.346 . 0 0 "[ . 1 . 2]" 1
1632 1 26 VAL HB 1 84 TYR QD . . 5.030 3.984 3.480 4.971 . 0 0 "[ . 1 . 2]" 1
1633 1 5 MET ME 1 5 MET HG2 . . 3.370 2.568 2.401 3.248 . 0 0 "[ . 1 . 2]" 1
1634 1 27 VAL HB 1 56 TYR QD . . 3.510 3.397 3.076 3.529 0.019 13 0 "[ . 1 . 2]" 1
1635 1 27 VAL HB 1 58 ALA MB . . 3.500 2.899 2.700 3.050 . 0 0 "[ . 1 . 2]" 1
1636 1 5 MET H 1 5 MET HG3 . . 3.370 2.693 1.866 3.491 0.121 7 0 "[ . 1 . 2]" 1
1637 1 49 ARG H 1 49 ARG HB2 . . 3.260 3.393 3.350 3.423 0.163 2 0 "[ . 1 . 2]" 1
1638 1 77 TRP HA 1 78 PRO QB . . 5.080 4.663 4.574 4.742 . 0 0 "[ . 1 . 2]" 1
1639 1 81 PRO HG2 1 93 CYS HB3 . . 3.560 3.607 3.538 3.680 0.120 20 0 "[ . 1 . 2]" 1
1640 1 50 LEU HB2 1 118 LEU MD1 . . 4.390 3.969 3.604 4.359 . 0 0 "[ . 1 . 2]" 1
1641 1 50 LEU HB2 1 51 HIS HD2 . . 4.420 3.932 3.850 4.030 . 0 0 "[ . 1 . 2]" 1
1642 1 47 ILE HA 1 50 LEU HB2 . . 3.170 2.635 2.541 2.705 . 0 0 "[ . 1 . 2]" 1
1643 1 62 LEU HB2 1 62 LEU MD1 . . 3.480 2.297 2.166 2.393 . 0 0 "[ . 1 . 2]" 1
1644 1 88 GLU H 1 88 GLU HB3 . . 2.870 2.580 2.434 2.755 . 0 0 "[ . 1 . 2]" 1
1645 1 88 GLU HB3 1 88 GLU HG3 . . 2.860 2.962 2.954 2.972 0.112 6 0 "[ . 1 . 2]" 1
1646 1 72 LYS H 1 72 LYS HB2 . . 3.860 2.380 2.340 2.436 . 0 0 "[ . 1 . 2]" 1
1647 1 20 VAL HB 1 87 GLY H . . 5.090 3.787 3.530 4.043 . 0 0 "[ . 1 . 2]" 1
1648 1 49 ARG H 1 49 ARG HB3 . . 3.540 2.140 2.083 2.217 . 0 0 "[ . 1 . 2]" 1
1649 1 20 VAL HB 1 84 TYR QD . . 4.620 3.730 3.295 3.967 . 0 0 "[ . 1 . 2]" 1
1650 1 20 VAL HB 1 28 PHE QE . . 4.630 4.055 3.867 4.188 . 0 0 "[ . 1 . 2]" 1
1651 1 20 VAL HB 1 28 PHE HZ . . 5.500 4.752 4.602 4.955 . 0 0 "[ . 1 . 2]" 1
1652 1 20 VAL HA 1 20 VAL HB . . 2.910 2.439 2.413 2.470 . 0 0 "[ . 1 . 2]" 1
1653 1 49 ARG HB3 1 49 ARG QD . . 3.260 2.630 2.356 3.128 . 0 0 "[ . 1 . 2]" 1
1654 1 24 LYS HB3 1 86 ASN H . . 4.970 3.929 3.411 5.031 0.061 10 0 "[ . 1 . 2]" 1
1655 1 109 LEU H 1 109 LEU HB2 . . 3.560 2.289 2.215 2.383 . 0 0 "[ . 1 . 2]" 1
1656 1 54 ARG HB2 1 55 ASP H . . 4.180 4.061 2.702 4.245 0.065 15 0 "[ . 1 . 2]" 1
1657 1 47 ILE H 1 47 ILE HB . . 3.130 2.364 2.319 2.449 . 0 0 "[ . 1 . 2]" 1
1658 1 47 ILE HB 1 51 HIS HD2 . . 5.500 4.833 4.651 5.000 . 0 0 "[ . 1 . 2]" 1
1659 1 36 PRO QB 1 38 CYS H . . 4.170 3.929 3.515 4.206 0.036 19 0 "[ . 1 . 2]" 1
1660 1 24 LYS HB3 1 112 LEU MD1 . . 3.330 2.742 2.084 3.389 0.059 11 0 "[ . 1 . 2]" 1
1661 1 24 LYS HD2 1 25 VAL MG2 . . 3.990 2.188 2.018 2.476 . 0 0 "[ . 1 . 2]" 1
1662 1 47 ILE HB 1 47 ILE MD . . 3.480 2.364 2.312 2.408 . 0 0 "[ . 1 . 2]" 1
1663 1 47 ILE HB 1 48 LEU MD1 . . 5.500 4.855 4.657 5.073 . 0 0 "[ . 1 . 2]" 1
1664 1 22 LYS H 1 22 LYS HB3 . . 3.430 3.453 3.121 3.534 0.104 12 0 "[ . 1 . 2]" 1
1665 1 72 LYS H 1 72 LYS HB3 . . 4.070 3.599 3.573 3.629 . 0 0 "[ . 1 . 2]" 1
1666 1 99 MET ME 1 105 LEU HG . . 3.680 3.511 3.441 3.548 . 0 0 "[ . 1 . 2]" 1
1667 1 29 LEU H 1 29 LEU HB2 . . 3.670 3.723 3.631 3.774 0.104 11 0 "[ . 1 . 2]" 1
1668 1 29 LEU HB2 1 30 LYS H . . 4.020 2.915 2.710 3.098 . 0 0 "[ . 1 . 2]" 1
1669 1 93 CYS HA 1 96 LEU HB2 . . 2.830 2.802 2.649 2.858 0.028 11 0 "[ . 1 . 2]" 1
1670 1 35 GLN H 1 35 GLN HB3 . . 3.640 3.685 3.553 3.729 0.089 20 0 "[ . 1 . 2]" 1
1671 1 29 LEU HB2 1 29 LEU QD . . 3.080 2.197 2.142 2.256 . 0 0 "[ . 1 . 2]" 1
1672 1 96 LEU H 1 96 LEU HB2 . . 3.030 2.205 2.082 2.291 . 0 0 "[ . 1 . 2]" 1
1673 1 97 LEU QB 1 101 GLN HE22 . . 5.410 5.215 4.451 5.464 0.054 19 0 "[ . 1 . 2]" 1
1674 1 24 LYS HD3 1 24 LYS QE . . 2.800 2.261 2.167 2.384 . 0 0 "[ . 1 . 2]" 1
1675 1 24 LYS H 1 24 LYS HG2 . . 3.520 3.582 3.550 3.611 0.091 14 0 "[ . 1 . 2]" 1
1676 1 48 LEU HB2 1 49 ARG H . . 3.390 2.560 2.459 2.649 . 0 0 "[ . 1 . 2]" 1
1677 1 48 LEU HB2 1 56 TYR QD . . 4.500 3.983 3.859 4.180 . 0 0 "[ . 1 . 2]" 1
1678 1 81 PRO HG3 1 93 CYS H . . 5.500 5.493 5.297 5.570 0.070 19 0 "[ . 1 . 2]" 1
1679 1 45 VAL HA 1 48 LEU HB2 . . 3.740 2.425 2.215 2.565 . 0 0 "[ . 1 . 2]" 1
1680 1 48 LEU HB2 1 48 LEU MD1 . . 3.610 2.289 2.279 2.305 . 0 0 "[ . 1 . 2]" 1
1681 1 107 GLU HA 1 110 LYS QD . . 3.390 2.530 2.119 3.468 0.078 12 0 "[ . 1 . 2]" 1
1682 1 19 LEU HB2 1 28 PHE HZ . . 4.690 4.687 4.417 4.781 0.091 13 0 "[ . 1 . 2]" 1
1683 1 107 GLU QG 1 110 LYS QD . . 5.200 4.486 4.010 5.698 0.498 15 0 "[ . 1 . 2]" 1
1684 1 19 LEU H 1 19 LEU HB2 . . 3.290 1.968 1.916 2.025 . 0 0 "[ . 1 . 2]" 1
1685 1 19 LEU HB2 1 20 VAL MG1 . . 5.080 4.354 3.897 4.675 . 0 0 "[ . 1 . 2]" 1
1686 1 21 LYS H 1 21 LYS HB3 . . 3.290 3.273 2.942 3.405 0.115 16 0 "[ . 1 . 2]" 1
1687 1 61 VAL H 1 62 LEU HG . . 4.950 4.350 4.040 4.952 0.002 9 0 "[ . 1 . 2]" 1
1688 1 62 LEU HA 1 62 LEU HB3 . . 2.940 2.504 2.350 2.584 . 0 0 "[ . 1 . 2]" 1
1689 1 84 TYR HA 1 85 LEU HB2 . . 4.350 4.351 4.264 4.373 0.023 11 0 "[ . 1 . 2]" 1
1690 1 85 LEU HB2 1 86 ASN H . . 4.400 4.408 4.359 4.440 0.040 20 0 "[ . 1 . 2]" 1
1691 1 24 LYS H 1 24 LYS HG3 . . 3.870 2.593 2.087 3.962 0.092 16 0 "[ . 1 . 2]" 1
1692 1 21 LYS HD2 1 87 GLY HA2 . . 3.010 3.057 2.946 3.145 0.135 6 0 "[ . 1 . 2]" 1
1693 1 54 ARG H 1 54 ARG QG . . 3.590 2.390 2.079 2.575 . 0 0 "[ . 1 . 2]" 1
1694 1 85 LEU H 1 85 LEU HB2 . . 3.740 2.564 2.480 2.621 . 0 0 "[ . 1 . 2]" 1
1695 1 72 LYS H 1 72 LYS HG2 . . 4.020 3.747 3.563 3.860 . 0 0 "[ . 1 . 2]" 1
1696 1 54 ARG QG 1 55 ASP H . . 3.670 3.186 2.436 3.715 0.045 8 0 "[ . 1 . 2]" 1
1697 1 115 HIS HD2 1 119 LEU HB2 . . 4.730 4.055 3.484 4.740 0.010 18 0 "[ . 1 . 2]" 1
1698 1 119 LEU H 1 119 LEU HB2 . . 2.840 2.061 1.917 2.131 . 0 0 "[ . 1 . 2]" 1
1699 1 49 ARG H 1 49 ARG HG3 . . 4.220 3.820 3.474 4.184 . 0 0 "[ . 1 . 2]" 1
1700 1 79 THR H 1 80 ILE HG12 . . 5.110 4.213 3.259 5.145 0.035 14 0 "[ . 1 . 2]" 1
1701 1 45 VAL HA 1 48 LEU HG . . 4.380 4.027 3.855 4.152 . 0 0 "[ . 1 . 2]" 1
1702 1 67 LEU H 1 67 LEU QB . . 3.350 2.379 2.099 2.481 . 0 0 "[ . 1 . 2]" 1
1703 1 110 LYS HE2 1 110 LYS HG2 . . 3.810 2.857 2.511 3.725 . 0 0 "[ . 1 . 2]" 1
1704 1 19 LEU HG 1 59 TYR QE . . 4.230 4.190 3.107 4.330 0.100 3 0 "[ . 1 . 2]" 1
1705 1 22 LYS QE 1 22 LYS HG2 . . 3.680 2.497 2.281 3.077 . 0 0 "[ . 1 . 2]" 1
1706 1 28 PHE H 1 29 LEU HG . . 5.470 3.111 3.038 3.174 . 0 0 "[ . 1 . 2]" 1
1707 1 118 LEU H 1 118 LEU HB2 . . 3.690 2.388 2.250 2.506 . 0 0 "[ . 1 . 2]" 1
1708 1 51 HIS HE1 1 118 LEU HB2 . . 4.800 3.470 3.040 3.863 . 0 0 "[ . 1 . 2]" 1
1709 1 22 LYS H 1 22 LYS HG2 . . 4.100 4.060 3.132 4.196 0.096 11 0 "[ . 1 . 2]" 1
1710 1 118 LEU HA 1 118 LEU HB2 . . 3.010 3.026 3.015 3.033 0.023 17 0 "[ . 1 . 2]" 1
1711 1 29 LEU H 1 29 LEU HG . . 3.870 2.717 2.659 2.805 . 0 0 "[ . 1 . 2]" 1
1712 1 95 ILE HB 1 96 LEU H . . 3.640 2.577 2.504 2.880 . 0 0 "[ . 1 . 2]" 1
1713 1 28 PHE HA 1 29 LEU HG . . 4.410 3.612 3.397 3.783 . 0 0 "[ . 1 . 2]" 1
1714 1 94 ASP QB 1 95 ILE HG12 . . 3.700 3.429 3.253 3.706 0.006 20 0 "[ . 1 . 2]" 1
1715 1 13 ALA H 1 13 ALA MB . . 3.170 2.170 2.093 2.241 . 0 0 "[ . 1 . 2]" 1
1716 1 119 LEU H 1 119 LEU HB3 . . 3.400 3.375 3.231 3.435 0.035 3 0 "[ . 1 . 2]" 1
1717 1 13 ALA MB 1 74 TYR QD . . 3.630 3.074 2.712 3.553 . 0 0 "[ . 1 . 2]" 1
1718 1 13 ALA MB 1 74 TYR QE . . 4.260 3.139 2.198 3.693 . 0 0 "[ . 1 . 2]" 1
1719 1 47 ILE HA 1 47 ILE QG . . 3.320 2.291 2.250 2.369 . 0 0 "[ . 1 . 2]" 1
1720 1 89 PHE QD 1 90 VAL HB . . 4.980 3.998 3.395 5.041 0.061 12 0 "[ . 1 . 2]" 1
1721 1 78 PRO HG3 1 79 THR H . . 4.950 4.200 3.908 4.732 . 0 0 "[ . 1 . 2]" 1
1722 1 77 TRP HA 1 78 PRO HG3 . . 4.800 4.499 4.152 4.618 . 0 0 "[ . 1 . 2]" 1
1723 1 119 LEU HA 1 119 LEU HG . . 3.500 2.512 1.983 3.614 0.114 13 0 "[ . 1 . 2]" 1
1724 1 110 LYS HE2 1 119 LEU HG . . 3.720 3.749 3.576 3.790 0.070 17 0 "[ . 1 . 2]" 1
1725 1 111 LYS QE 1 111 LYS HG3 . . 3.800 2.767 2.132 3.375 . 0 0 "[ . 1 . 2]" 1
1726 1 21 LYS QG 1 22 LYS H . . 4.510 4.606 4.555 4.673 0.163 19 0 "[ . 1 . 2]" 1
1727 1 115 HIS HD2 1 117 ALA MB . . 5.400 4.189 3.255 5.064 . 0 0 "[ . 1 . 2]" 1
1728 1 114 ILE HA 1 114 ILE HG12 . . 3.500 2.649 2.567 2.750 . 0 0 "[ . 1 . 2]" 1
1729 1 114 ILE H 1 114 ILE HG12 . . 3.660 3.671 3.569 3.696 0.036 5 0 "[ . 1 . 2]" 1
1730 1 117 ALA H 1 117 ALA MB . . 3.160 2.194 2.164 2.233 . 0 0 "[ . 1 . 2]" 1
1731 1 51 HIS HA 1 117 ALA MB . . 3.540 3.054 2.900 3.240 . 0 0 "[ . 1 . 2]" 1
1732 1 118 LEU H 1 118 LEU HB3 . . 3.310 3.439 3.397 3.470 0.160 18 0 "[ . 1 . 2]" 1
1733 1 51 HIS HE1 1 118 LEU HB3 . . 4.720 4.651 4.307 4.778 0.058 1 0 "[ . 1 . 2]" 1
1734 1 50 LEU HB3 1 51 HIS H . . 3.800 3.484 3.345 3.628 . 0 0 "[ . 1 . 2]" 1
1735 1 110 LYS HE2 1 110 LYS HG3 . . 4.070 3.021 2.696 4.107 0.037 9 0 "[ . 1 . 2]" 1
1736 1 61 VAL MG2 1 68 ARG HG3 . . 4.030 2.938 2.403 3.386 . 0 0 "[ . 1 . 2]" 1
1737 1 19 LEU HB3 1 20 VAL H . . 3.870 2.839 2.659 3.108 . 0 0 "[ . 1 . 2]" 1
1738 1 16 LEU HG 1 74 TYR QE . . 5.240 4.626 4.105 5.154 . 0 0 "[ . 1 . 2]" 1
1739 1 19 LEU HB3 1 20 VAL MG1 . . 5.300 3.580 3.339 3.803 . 0 0 "[ . 1 . 2]" 1
1740 1 57 ALA MB 1 59 TYR QD . . 4.300 3.491 3.000 4.166 . 0 0 "[ . 1 . 2]" 1
1741 1 57 ALA H 1 57 ALA MB . . 3.480 2.428 2.376 2.475 . 0 0 "[ . 1 . 2]" 1
1742 1 57 ALA MB 1 59 TYR QE . . 3.390 2.649 2.092 3.410 0.020 13 0 "[ . 1 . 2]" 1
1743 1 23 ASP HB3 1 57 ALA MB . . 3.640 3.307 3.008 3.654 0.014 13 0 "[ . 1 . 2]" 1
1744 1 23 ASP HB2 1 57 ALA MB . . 3.640 2.719 2.384 3.290 . 0 0 "[ . 1 . 2]" 1
1745 1 85 LEU HB3 1 86 ASN H . . 4.310 3.374 3.294 3.430 . 0 0 "[ . 1 . 2]" 1
1746 1 85 LEU H 1 85 LEU HB3 . . 4.090 3.596 3.559 3.621 . 0 0 "[ . 1 . 2]" 1
1747 1 100 HIS HE1 1 118 LEU HG . . 5.500 4.526 4.136 4.760 . 0 0 "[ . 1 . 2]" 1
1748 1 95 ILE HA 1 95 ILE HG13 . . 3.600 3.571 3.068 3.683 0.083 5 0 "[ . 1 . 2]" 1
1749 1 51 HIS HE1 1 106 VAL MG1 . . 3.150 3.226 3.194 3.258 0.108 5 0 "[ . 1 . 2]" 1
1750 1 72 LYS HA 1 72 LYS HG3 . . 3.520 2.843 2.682 2.995 . 0 0 "[ . 1 . 2]" 1
1751 1 106 VAL HA 1 106 VAL MG1 . . 3.220 2.293 2.197 2.376 . 0 0 "[ . 1 . 2]" 1
1752 1 16 LEU H 1 16 LEU HB2 . . 3.320 2.201 2.102 2.264 . 0 0 "[ . 1 . 2]" 1
1753 1 16 LEU HB2 1 74 TYR QD . . 4.740 2.623 2.248 3.148 . 0 0 "[ . 1 . 2]" 1
1754 1 61 VAL HA 1 61 VAL MG1 . . 3.310 2.349 2.306 2.401 . 0 0 "[ . 1 . 2]" 1
1755 1 29 LEU H 1 61 VAL MG1 . . 4.400 3.067 2.782 3.310 . 0 0 "[ . 1 . 2]" 1
1756 1 37 GLN H 1 37 GLN HB3 . . 3.650 2.518 2.137 2.750 . 0 0 "[ . 1 . 2]" 1
1757 1 37 GLN HB3 1 38 CYS H . . 4.220 3.756 3.529 4.030 . 0 0 "[ . 1 . 2]" 1
1758 1 28 PHE QD 1 61 VAL MG1 . . 3.700 2.691 2.296 3.171 . 0 0 "[ . 1 . 2]" 1
1759 1 32 THR H 1 32 THR MG . . 3.640 2.995 2.727 3.427 . 0 0 "[ . 1 . 2]" 1
1760 1 28 PHE QE 1 61 VAL MG1 . . 4.670 3.983 3.641 4.428 . 0 0 "[ . 1 . 2]" 1
1761 1 60 ASN HA 1 61 VAL MG1 . . 3.880 3.837 3.751 3.901 0.021 5 0 "[ . 1 . 2]" 1
1762 1 32 THR MG 1 60 ASN HB3 . . 4.050 3.963 3.549 4.071 0.021 19 0 "[ . 1 . 2]" 1
1763 1 45 VAL HA 1 48 LEU HB3 . . 4.230 4.033 3.843 4.159 . 0 0 "[ . 1 . 2]" 1
1764 1 48 LEU HB3 1 48 LEU MD1 . . 3.670 2.514 2.468 2.574 . 0 0 "[ . 1 . 2]" 1
1765 1 71 ILE H 1 71 ILE HB . . 3.510 2.412 2.287 2.496 . 0 0 "[ . 1 . 2]" 1
1766 1 23 ASP HB2 1 26 VAL QG . . 3.560 2.532 2.337 2.844 . 0 0 "[ . 1 . 2]" 1
1767 1 26 VAL H 1 26 VAL QG . . 3.860 2.346 1.955 2.687 . 0 0 "[ . 1 . 2]" 1
1768 1 22 LYS H 1 26 VAL QG . . 5.500 3.154 2.949 3.394 . 0 0 "[ . 1 . 2]" 1
1769 1 56 TYR QD 1 58 ALA MB . . 3.030 2.445 2.266 2.732 . 0 0 "[ . 1 . 2]" 1
1770 1 58 ALA H 1 58 ALA MB . . 3.400 2.271 2.215 2.369 . 0 0 "[ . 1 . 2]" 1
1771 1 32 THR HA 1 58 ALA MB . . 3.370 3.432 3.399 3.502 0.132 5 0 "[ . 1 . 2]" 1
1772 1 45 VAL H 1 45 VAL QG . . 3.330 2.362 2.255 2.509 . 0 0 "[ . 1 . 2]" 1
1773 1 42 ASN HA 1 45 VAL QG . . 3.810 3.249 3.105 3.333 . 0 0 "[ . 1 . 2]" 1
1774 1 33 PRO HA 1 45 VAL QG . . 3.200 2.285 2.010 2.783 . 0 0 "[ . 1 . 2]" 1
1775 1 45 VAL HA 1 45 VAL QG . . 3.070 2.105 2.087 2.127 . 0 0 "[ . 1 . 2]" 1
1776 1 45 VAL QG 1 48 LEU MD1 . . 4.880 2.965 2.731 3.131 . 0 0 "[ . 1 . 2]" 1
1777 1 45 VAL QG 1 46 GLN H . . 3.990 3.294 3.073 3.422 . 0 0 "[ . 1 . 2]" 1
1778 1 45 VAL QG 1 46 GLN QG . . 3.820 3.980 3.583 4.509 0.689 11 1 "[ . 1+ . 2]" 1
1779 1 106 VAL MG2 1 116 SER H . . 5.150 5.214 5.189 5.236 0.086 7 0 "[ . 1 . 2]" 1
1780 1 45 VAL QG 1 46 GLN HE21 . . 5.010 4.640 3.714 5.130 0.120 10 0 "[ . 1 . 2]" 1
1781 1 45 VAL QG 1 46 GLN HE22 . . 5.120 5.198 4.407 5.866 0.746 4 4 "[ +. * 1 * -. 2]" 1
1782 1 106 VAL MG2 1 116 SER HB2 . . 4.450 3.196 3.030 3.389 . 0 0 "[ . 1 . 2]" 1
1783 1 45 VAL QG 1 46 GLN HA . . 4.350 3.767 3.442 3.945 . 0 0 "[ . 1 . 2]" 1
1784 1 106 VAL HA 1 106 VAL MG2 . . 3.290 2.326 2.271 2.421 . 0 0 "[ . 1 . 2]" 1
1785 1 105 LEU H 1 105 LEU QB . . 3.280 2.488 2.462 2.533 . 0 0 "[ . 1 . 2]" 1
1786 1 105 LEU QB 1 106 VAL H . . 3.710 2.842 2.623 2.918 . 0 0 "[ . 1 . 2]" 1
1787 1 44 VAL HA 1 44 VAL MG1 . . 3.230 2.266 2.219 2.302 . 0 0 "[ . 1 . 2]" 1
1788 1 97 LEU MD1 1 101 GLN HE22 . . 4.690 2.552 2.405 2.732 . 0 0 "[ . 1 . 2]" 1
1789 1 29 LEU H 1 61 VAL MG2 . . 4.940 3.856 3.446 4.108 . 0 0 "[ . 1 . 2]" 1
1790 1 44 VAL MG1 1 93 CYS HB2 . . 4.140 2.581 2.251 2.967 . 0 0 "[ . 1 . 2]" 1
1791 1 30 LYS H 1 30 LYS QG . . 4.700 2.049 1.773 2.155 . 0 0 "[ . 1 . 2]" 1
1792 1 29 LEU HA 1 30 LYS QG . . 4.070 3.980 3.771 4.108 0.038 11 0 "[ . 1 . 2]" 1
1793 1 53 VAL MG1 1 56 TYR QD . . 3.250 2.595 2.275 2.923 . 0 0 "[ . 1 . 2]" 1
1794 1 62 LEU H 1 62 LEU MD2 . . 4.110 3.590 1.545 3.916 . 0 0 "[ . 1 . 2]" 1
1795 1 28 PHE QD 1 67 LEU QD . . 3.900 3.907 3.068 4.128 0.228 17 0 "[ . 1 . 2]" 1
1796 1 62 LEU HA 1 62 LEU MD2 . . 3.890 2.235 2.050 3.453 . 0 0 "[ . 1 . 2]" 1
1797 1 97 LEU MD2 1 100 HIS HD2 . . 5.150 4.453 4.296 4.654 . 0 0 "[ . 1 . 2]" 1
1798 1 97 LEU MD2 1 101 GLN HE22 . . 4.800 4.617 4.188 4.808 0.008 16 0 "[ . 1 . 2]" 1
1799 1 59 TYR QD 1 67 LEU QD . . 3.320 2.191 2.012 2.465 . 0 0 "[ . 1 . 2]" 1
1800 1 77 TRP HB2 1 80 ILE MG . . 4.970 4.605 3.598 5.000 0.030 19 0 "[ . 1 . 2]" 1
1801 1 80 ILE HA 1 80 ILE MG . . 3.660 2.477 2.084 2.903 . 0 0 "[ . 1 . 2]" 1
1802 1 25 VAL H 1 85 LEU MD1 . . 5.500 5.156 4.911 5.485 . 0 0 "[ . 1 . 2]" 1
1803 1 85 LEU HA 1 85 LEU MD1 . . 3.140 2.382 2.306 2.473 . 0 0 "[ . 1 . 2]" 1
1804 1 26 VAL H 1 85 LEU MD1 . . 4.950 3.538 3.249 3.791 . 0 0 "[ . 1 . 2]" 1
1805 1 27 VAL QG 1 82 GLN H . . 4.740 4.149 3.870 4.442 . 0 0 "[ . 1 . 2]" 1
1806 1 27 VAL QG 1 59 TYR H . . 4.110 3.991 3.918 4.094 . 0 0 "[ . 1 . 2]" 1
1807 1 27 VAL QG 1 28 PHE QD . . 4.750 4.026 3.918 4.120 . 0 0 "[ . 1 . 2]" 1
1808 1 29 LEU QD 1 81 PRO HB2 . . 3.880 3.070 2.381 3.659 . 0 0 "[ . 1 . 2]" 1
1809 1 27 VAL QG 1 83 VAL MG2 . . 3.340 1.913 1.887 1.967 . 0 0 "[ . 1 . 2]" 1
1810 1 27 VAL QG 1 56 TYR QD . . 3.050 3.071 2.881 3.231 0.181 6 0 "[ . 1 . 2]" 1
1811 1 27 VAL HA 1 27 VAL QG . . 3.290 2.080 2.057 2.100 . 0 0 "[ . 1 . 2]" 1
1812 1 20 VAL MG2 1 22 LYS H . . 4.670 4.655 4.522 4.696 0.026 7 0 "[ . 1 . 2]" 1
1813 1 119 LEU HA 1 119 LEU QD . . 3.140 2.498 1.966 2.738 . 0 0 "[ . 1 . 2]" 1
1814 1 114 ILE HA 1 114 ILE MG . . 3.060 2.277 2.185 2.370 . 0 0 "[ . 1 . 2]" 1
1815 1 116 SER H 1 119 LEU QD . . 3.760 2.650 2.050 4.353 0.593 20 2 "[ . 1 . -+]" 1
1816 1 119 LEU H 1 119 LEU QD . . 3.580 2.485 2.262 2.769 . 0 0 "[ . 1 . 2]" 1
1817 1 20 VAL MG2 1 84 TYR QD . . 3.850 3.513 2.832 3.849 . 0 0 "[ . 1 . 2]" 1
1818 1 29 LEU QD 1 37 GLN HE22 . . 4.450 4.085 3.444 4.306 . 0 0 "[ . 1 . 2]" 1
1819 1 20 VAL MG2 1 28 PHE HZ . . 4.630 4.650 4.635 4.672 0.042 13 0 "[ . 1 . 2]" 1
1820 1 116 SER HB3 1 119 LEU QD . . 4.820 2.058 1.867 2.846 . 0 0 "[ . 1 . 2]" 1
1821 1 115 HIS HE1 1 119 LEU QD . . 4.310 3.028 2.360 5.310 1.000 20 1 "[ . 1 . +]" 1
1822 1 116 SER HB2 1 119 LEU QD . . 5.130 3.446 3.233 3.964 . 0 0 "[ . 1 . 2]" 1
1823 1 110 LYS HE2 1 119 LEU QD . . 4.450 2.600 2.040 3.613 . 0 0 "[ . 1 . 2]" 1
1824 1 50 LEU MD1 1 100 HIS HE1 . . 3.550 3.203 2.910 3.549 . 0 0 "[ . 1 . 2]" 1
1825 1 83 VAL MG1 1 91 GLY H . . 4.780 3.405 3.215 3.818 . 0 0 "[ . 1 . 2]" 1
1826 1 93 CYS HA 1 96 LEU QD . . 3.580 3.269 2.899 3.637 0.057 10 0 "[ . 1 . 2]" 1
1827 1 46 GLN QG 1 50 LEU MD1 . . 4.840 4.442 4.130 4.748 . 0 0 "[ . 1 . 2]" 1
1828 1 96 LEU QD 1 105 LEU MD1 . . 3.770 2.256 2.035 2.686 . 0 0 "[ . 1 . 2]" 1
1829 1 95 ILE HA 1 95 ILE MD . . 3.410 2.417 2.112 3.514 0.104 6 0 "[ . 1 . 2]" 1
1830 1 95 ILE MG 1 98 GLN HG2 . . 5.500 3.910 3.661 4.591 . 0 0 "[ . 1 . 2]" 1
1831 1 25 VAL MG2 1 26 VAL H . . 4.350 4.424 4.395 4.451 0.101 5 0 "[ . 1 . 2]" 1
1832 1 28 PHE QE 1 67 LEU QD . . 3.290 3.085 2.338 3.261 . 0 0 "[ . 1 . 2]" 1
1833 1 85 LEU HA 1 90 VAL MG1 . . 4.230 4.268 4.242 4.302 0.072 20 0 "[ . 1 . 2]" 1
1834 1 25 VAL MG2 1 56 TYR HB2 . . 4.600 4.634 4.614 4.667 0.067 1 0 "[ . 1 . 2]" 1
1835 1 84 TYR QD 1 90 VAL MG1 . . 5.060 5.130 4.979 5.346 0.286 2 0 "[ . 1 . 2]" 1
1836 1 89 PHE QD 1 90 VAL MG1 . . 5.500 4.473 4.197 4.717 . 0 0 "[ . 1 . 2]" 1
1837 1 83 VAL H 1 83 VAL MG2 . . 4.270 4.020 3.986 4.057 . 0 0 "[ . 1 . 2]" 1
1838 1 71 ILE HG12 1 71 ILE MG . . 3.000 2.265 2.171 2.344 . 0 0 "[ . 1 . 2]" 1
1839 1 85 LEU MD2 1 86 ASN H . . 5.490 4.555 4.434 4.721 . 0 0 "[ . 1 . 2]" 1
1840 1 85 LEU MD2 1 112 LEU HG . . 4.550 3.619 2.921 4.099 . 0 0 "[ . 1 . 2]" 1
1841 1 99 MET ME 1 105 LEU MD2 . . 3.300 2.075 2.036 2.104 . 0 0 "[ . 1 . 2]" 1
1842 1 118 LEU H 1 118 LEU MD2 . . 3.660 2.880 2.645 3.087 . 0 0 "[ . 1 . 2]" 1
1843 1 47 ILE MG 1 100 HIS HD2 . . 5.360 4.446 4.366 4.566 . 0 0 "[ . 1 . 2]" 1
1844 1 25 VAL H 1 25 VAL MG1 . . 4.290 4.007 3.875 4.076 . 0 0 "[ . 1 . 2]" 1
1845 1 47 ILE MG 1 51 HIS HD2 . . 3.270 2.249 2.140 2.399 . 0 0 "[ . 1 . 2]" 1
1846 1 106 VAL HA 1 109 LEU MD2 . . 5.500 4.862 4.752 4.990 . 0 0 "[ . 1 . 2]" 1
1847 1 25 VAL MG1 1 48 LEU MD1 . . 4.050 3.067 2.655 3.282 . 0 0 "[ . 1 . 2]" 1
1848 1 109 LEU MD1 1 116 SER HB2 . . 4.230 2.387 2.088 2.672 . 0 0 "[ . 1 . 2]" 1
1849 1 109 LEU H 1 109 LEU MD1 . . 4.150 3.504 3.442 3.564 . 0 0 "[ . 1 . 2]" 1
1850 1 109 LEU MD1 1 116 SER H . . 4.360 3.638 3.465 3.937 . 0 0 "[ . 1 . 2]" 1
1851 1 51 HIS HE1 1 109 LEU MD1 . . 5.500 4.132 3.887 4.443 . 0 0 "[ . 1 . 2]" 1
1852 1 89 PHE QD 1 90 VAL MG2 . . 5.500 4.194 2.663 4.795 . 0 0 "[ . 1 . 2]" 1
1853 1 47 ILE MD 1 96 LEU HA . . 5.410 4.313 4.094 4.550 . 0 0 "[ . 1 . 2]" 1
1854 1 27 VAL HB 1 29 LEU QD . . 3.920 3.620 3.478 3.694 . 0 0 "[ . 1 . 2]" 1
1855 1 106 VAL MG1 1 109 LEU MD1 . . 3.760 3.497 3.228 3.745 . 0 0 "[ . 1 . 2]" 1
1856 1 47 ILE MD 1 100 HIS HE1 . . 5.120 5.143 5.132 5.155 0.035 15 0 "[ . 1 . 2]" 1
1857 1 43 ALA MB 1 47 ILE MD . . 3.850 3.510 3.093 3.856 0.006 17 0 "[ . 1 . 2]" 1
1858 1 29 LEU QD 1 58 ALA MB . . 3.150 2.280 2.161 2.467 . 0 0 "[ . 1 . 2]" 1
1859 1 109 LEU HB2 1 109 LEU MD1 . . 3.460 2.283 2.269 2.303 . 0 0 "[ . 1 . 2]" 1
1860 1 47 ILE MD 1 96 LEU QD . . 3.110 2.240 2.131 2.463 . 0 0 "[ . 1 . 2]" 1
1861 1 47 ILE MD 1 100 HIS H . . 5.140 4.060 3.837 4.370 . 0 0 "[ . 1 . 2]" 1
1862 1 47 ILE MD 1 97 LEU H . . 5.130 4.039 3.849 4.392 . 0 0 "[ . 1 . 2]" 1
1863 1 29 LEU QD 1 31 GLY H . . 5.500 3.255 2.976 3.805 . 0 0 "[ . 1 . 2]" 1
1864 1 47 ILE MD 1 97 LEU HA . . 3.540 2.794 2.543 3.300 . 0 0 "[ . 1 . 2]" 1
1865 1 47 ILE MD 1 47 ILE MG . . 3.040 2.076 2.060 2.098 . 0 0 "[ . 1 . 2]" 1
1866 1 117 ALA H 1 118 LEU MD1 . . 5.500 5.417 5.137 5.514 0.014 15 0 "[ . 1 . 2]" 1
1867 1 51 HIS HE1 1 118 LEU MD1 . . 3.740 2.596 2.361 2.749 . 0 0 "[ . 1 . 2]" 1
1868 1 100 HIS HE1 1 118 LEU MD1 . . 3.240 2.333 2.122 2.593 . 0 0 "[ . 1 . 2]" 1
1869 1 51 HIS HA 1 118 LEU MD1 . . 4.290 3.633 3.444 3.821 . 0 0 "[ . 1 . 2]" 1
1870 1 19 LEU H 1 19 LEU QD . . 3.880 3.460 3.353 3.611 . 0 0 "[ . 1 . 2]" 1
1871 1 16 LEU HB3 1 74 TYR QE . . 3.250 3.117 2.542 3.277 0.027 18 0 "[ . 1 . 2]" 1
1872 1 19 LEU HA 1 19 LEU QD . . 3.280 2.402 2.055 2.890 . 0 0 "[ . 1 . 2]" 1
1873 1 19 LEU QD 1 22 LYS HB2 . . 5.500 3.898 2.675 4.813 . 0 0 "[ . 1 . 2]" 1
1874 1 15 GLN HE21 1 19 LEU QD . . 5.500 2.846 2.502 3.232 . 0 0 "[ . 1 . 2]" 1
1875 1 19 LEU QD 1 59 TYR QE . . 3.750 2.101 1.887 2.512 . 0 0 "[ . 1 . 2]" 1
1876 1 16 LEU MD1 1 74 TYR QD . . 4.030 3.560 3.120 3.873 . 0 0 "[ . 1 . 2]" 1
1877 1 16 LEU MD1 1 71 ILE HA . . 3.590 2.912 2.466 3.384 . 0 0 "[ . 1 . 2]" 1
1878 1 16 LEU MD1 1 74 TYR HB2 . . 4.310 3.167 2.894 3.405 . 0 0 "[ . 1 . 2]" 1
1879 1 100 HIS H 1 105 LEU MD1 . . 4.580 2.984 2.921 3.142 . 0 0 "[ . 1 . 2]" 1
1880 1 105 LEU H 1 105 LEU MD1 . . 4.370 3.864 3.830 3.894 . 0 0 "[ . 1 . 2]" 1
1881 1 51 HIS HE1 1 105 LEU MD1 . . 5.020 4.689 4.403 4.954 . 0 0 "[ . 1 . 2]" 1
1882 1 51 HIS HD2 1 105 LEU MD1 . . 3.840 3.329 3.084 3.567 . 0 0 "[ . 1 . 2]" 1
1883 1 48 LEU MD2 1 51 HIS H . . 5.130 5.139 5.080 5.159 0.029 2 0 "[ . 1 . 2]" 1
1884 1 48 LEU MD2 1 51 HIS HB2 . . 5.430 3.892 3.783 3.979 . 0 0 "[ . 1 . 2]" 1
1885 1 20 VAL H 1 20 VAL MG1 . . 3.580 2.402 2.333 2.487 . 0 0 "[ . 1 . 2]" 1
1886 1 20 VAL MG1 1 21 LYS H . . 4.760 4.203 4.124 4.268 . 0 0 "[ . 1 . 2]" 1
1887 1 20 VAL MG1 1 28 PHE QD . . 4.840 4.064 3.914 4.240 . 0 0 "[ . 1 . 2]" 1
1888 1 20 VAL MG1 1 84 TYR QD . . 4.110 2.662 2.536 2.762 . 0 0 "[ . 1 . 2]" 1
1889 1 20 VAL MG1 1 28 PHE QE . . 3.460 2.215 2.095 2.358 . 0 0 "[ . 1 . 2]" 1
1890 1 20 VAL MG1 1 28 PHE HZ . . 3.750 2.491 2.256 2.710 . 0 0 "[ . 1 . 2]" 1
1891 1 17 ASP HA 1 20 VAL MG1 . . 4.760 3.776 3.633 4.016 . 0 0 "[ . 1 . 2]" 1
1892 1 71 ILE MD 1 74 TYR HA . . 5.390 5.015 4.828 5.229 . 0 0 "[ . 1 . 2]" 1
1893 1 71 ILE H 1 71 ILE MD . . 4.270 4.024 3.770 4.162 . 0 0 "[ . 1 . 2]" 1
1894 1 71 ILE MD 1 74 TYR H . . 4.920 4.222 4.034 4.420 . 0 0 "[ . 1 . 2]" 1
1895 1 71 ILE MD 1 75 SER H . . 5.180 3.351 2.859 3.928 . 0 0 "[ . 1 . 2]" 1
1896 1 28 PHE QD 1 71 ILE MD . . 4.420 3.235 2.851 3.752 . 0 0 "[ . 1 . 2]" 1
1897 1 71 ILE MD 1 74 TYR QD . . 3.620 2.943 2.155 3.692 0.072 20 0 "[ . 1 . 2]" 1
1898 1 28 PHE QE 1 71 ILE MD . . 4.000 3.068 2.655 3.585 . 0 0 "[ . 1 . 2]" 1
1899 1 28 PHE HZ 1 71 ILE MD . . 4.350 3.912 3.547 4.281 . 0 0 "[ . 1 . 2]" 1
1900 1 71 ILE HA 1 71 ILE MD . . 3.380 2.026 2.013 2.046 . 0 0 "[ . 1 . 2]" 1
1901 1 71 ILE MD 1 74 TYR HB2 . . 4.640 3.764 3.508 3.970 . 0 0 "[ . 1 . 2]" 1
1902 1 28 PHE HB2 1 71 ILE MD . . 5.270 4.364 3.917 4.837 . 0 0 "[ . 1 . 2]" 1
1903 1 16 LEU HG 1 71 ILE MD . . 4.880 4.381 3.897 4.701 . 0 0 "[ . 1 . 2]" 1
1904 1 16 LEU HB3 1 71 ILE MD . . 4.320 4.044 3.653 4.326 0.006 7 0 "[ . 1 . 2]" 1
1905 1 45 VAL H 1 48 LEU MD1 . . 5.500 4.335 4.123 4.431 . 0 0 "[ . 1 . 2]" 1
1906 1 48 LEU MD1 1 56 TYR H . . 5.500 4.692 4.339 4.910 . 0 0 "[ . 1 . 2]" 1
1907 1 48 LEU MD1 1 56 TYR QD . . 3.600 2.400 2.280 2.652 . 0 0 "[ . 1 . 2]" 1
1908 1 45 VAL HA 1 48 LEU MD1 . . 3.670 2.573 2.398 2.740 . 0 0 "[ . 1 . 2]" 1
1909 1 27 VAL QG 1 48 LEU MD1 . . 3.420 2.020 1.929 2.211 . 0 0 "[ . 1 . 2]" 1
1910 1 44 VAL MG2 1 48 LEU MD1 . . 3.820 3.745 3.587 3.830 0.010 6 0 "[ . 1 . 2]" 1
1911 1 71 ILE H 1 71 ILE HG13 . . 4.890 4.627 4.526 4.673 . 0 0 "[ . 1 . 2]" 1
1912 1 28 PHE QD 1 71 ILE HG13 . . 4.880 4.332 4.120 4.503 . 0 0 "[ . 1 . 2]" 1
1913 1 28 PHE QE 1 71 ILE HG13 . . 5.390 5.328 5.086 5.403 0.013 10 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 38
_Distance_constraint_stats_list.Viol_count 338
_Distance_constraint_stats_list.Viol_total 159.787
_Distance_constraint_stats_list.Viol_max 0.130
_Distance_constraint_stats_list.Viol_rms 0.0182
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0105
_Distance_constraint_stats_list.Viol_average_violations_only 0.0236
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
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 12 SER 0.268 0.039 12 0 "[ . 1 . 2]"
1 13 ALA 0.206 0.044 5 0 "[ . 1 . 2]"
1 15 GLN 0.417 0.039 12 0 "[ . 1 . 2]"
1 16 LEU 0.097 0.040 17 0 "[ . 1 . 2]"
1 17 ASP 2.072 0.130 20 0 "[ . 1 . 2]"
1 19 LEU 0.149 0.023 4 0 "[ . 1 . 2]"
1 20 VAL 0.097 0.040 17 0 "[ . 1 . 2]"
1 21 LYS 1.866 0.130 20 0 "[ . 1 . 2]"
1 25 VAL 0.450 0.049 5 0 "[ . 1 . 2]"
1 27 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 LEU 1.359 0.088 9 0 "[ . 1 . 2]"
1 57 ALA 0.450 0.049 5 0 "[ . 1 . 2]"
1 59 TYR 0.775 0.035 19 0 "[ . 1 . 2]"
1 61 VAL 0.585 0.088 9 0 "[ . 1 . 2]"
1 64 ASP 0.897 0.042 15 0 "[ . 1 . 2]"
1 65 PRO 0.039 0.014 4 0 "[ . 1 . 2]"
1 66 GLU 0.459 0.058 19 0 "[ . 1 . 2]"
1 67 LEU 0.007 0.007 3 0 "[ . 1 . 2]"
1 68 ARG 1.532 0.042 15 0 "[ . 1 . 2]"
1 69 GLN 0.604 0.053 19 0 "[ . 1 . 2]"
1 70 GLY 0.591 0.058 19 0 "[ . 1 . 2]"
1 71 ILE 0.107 0.033 14 0 "[ . 1 . 2]"
1 72 LYS 0.635 0.035 1 0 "[ . 1 . 2]"
1 73 ASP 1.325 0.066 5 0 "[ . 1 . 2]"
1 74 TYR 0.132 0.021 7 0 "[ . 1 . 2]"
1 75 SER 0.100 0.033 14 0 "[ . 1 . 2]"
1 76 ASN 0.759 0.066 5 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 64 ASP O 1 68 ARG H . . 2.000 2.024 1.996 2.041 0.041 18 0 "[ . 1 . 2]" 2
2 1 64 ASP O 1 68 ARG N . . 3.000 3.020 2.985 3.042 0.042 15 0 "[ . 1 . 2]" 2
3 1 65 PRO O 1 69 GLN H . . 2.000 1.902 1.812 2.008 0.008 4 0 "[ . 1 . 2]" 2
4 1 65 PRO O 1 69 GLN N . . 3.000 2.910 2.819 3.014 0.014 4 0 "[ . 1 . 2]" 2
5 1 66 GLU O 1 70 GLY H . . 2.000 2.012 1.911 2.058 0.058 19 0 "[ . 1 . 2]" 2
6 1 66 GLU O 1 70 GLY N . . 3.000 2.910 2.862 2.988 . 0 0 "[ . 1 . 2]" 2
7 1 67 LEU O 1 71 ILE H . . 2.000 1.952 1.888 2.007 0.007 3 0 "[ . 1 . 2]" 2
8 1 67 LEU O 1 71 ILE N . . 3.000 2.878 2.815 2.951 . 0 0 "[ . 1 . 2]" 2
9 1 68 ARG O 1 72 LYS H . . 2.000 2.017 1.968 2.034 0.034 6 0 "[ . 1 . 2]" 2
10 1 68 ARG O 1 72 LYS N . . 3.000 3.008 2.965 3.035 0.035 1 0 "[ . 1 . 2]" 2
11 1 69 GLN O 1 73 ASP H . . 2.000 2.018 1.994 2.053 0.053 19 0 "[ . 1 . 2]" 2
12 1 69 GLN O 1 73 ASP N . . 3.000 2.993 2.896 3.047 0.047 18 0 "[ . 1 . 2]" 2
13 1 70 GLY O 1 74 TYR H . . 2.000 1.981 1.895 2.021 0.021 7 0 "[ . 1 . 2]" 2
14 1 70 GLY O 1 74 TYR N . . 3.000 2.974 2.890 3.010 0.010 13 0 "[ . 1 . 2]" 2
15 1 71 ILE O 1 75 SER H . . 2.000 1.959 1.901 2.033 0.033 14 0 "[ . 1 . 2]" 2
16 1 71 ILE O 1 75 SER N . . 3.000 2.925 2.867 3.021 0.021 6 0 "[ . 1 . 2]" 2
17 1 73 ASP O 1 76 ASN H . . 2.000 2.038 2.007 2.066 0.066 5 0 "[ . 1 . 2]" 2
18 1 73 ASP O 1 76 ASN N . . 3.000 2.945 2.895 3.007 0.007 15 0 "[ . 1 . 2]" 2
19 1 12 SER O 1 15 GLN H . . 2.000 2.013 2.002 2.039 0.039 12 0 "[ . 1 . 2]" 2
20 1 12 SER O 1 15 GLN N . . 3.000 2.915 2.878 2.954 . 0 0 "[ . 1 . 2]" 2
21 1 13 ALA O 1 17 ASP H . . 2.000 1.964 1.830 2.044 0.044 5 0 "[ . 1 . 2]" 2
22 1 13 ALA O 1 17 ASP N . . 3.000 2.900 2.789 3.013 0.013 5 0 "[ . 1 . 2]" 2
23 1 15 GLN O 1 19 LEU H . . 2.000 1.990 1.890 2.023 0.023 4 0 "[ . 1 . 2]" 2
24 1 15 GLN O 1 19 LEU N . . 3.000 2.876 2.804 2.935 . 0 0 "[ . 1 . 2]" 2
25 1 16 LEU O 1 20 VAL H . . 2.000 1.946 1.802 2.040 0.040 17 0 "[ . 1 . 2]" 2
26 1 16 LEU O 1 20 VAL N . . 3.000 2.927 2.800 3.005 0.005 17 0 "[ . 1 . 2]" 2
27 1 17 ASP O 1 21 LYS H . . 2.000 2.081 2.033 2.130 0.130 20 0 "[ . 1 . 2]" 2
28 1 17 ASP O 1 21 LYS N . . 3.000 3.006 2.957 3.040 0.040 5 0 "[ . 1 . 2]" 2
29 1 27 VAL H 1 57 ALA O . . 2.000 1.882 1.814 1.975 . 0 0 "[ . 1 . 2]" 2
30 1 27 VAL N 1 57 ALA O . . 3.000 2.877 2.825 2.987 . 0 0 "[ . 1 . 2]" 2
31 1 29 LEU H 1 59 TYR O . . 2.000 2.021 2.001 2.034 0.034 11 0 "[ . 1 . 2]" 2
32 1 29 LEU N 1 59 TYR O . . 3.000 3.018 2.991 3.035 0.035 19 0 "[ . 1 . 2]" 2
33 1 25 VAL O 1 57 ALA H . . 2.000 2.017 1.943 2.049 0.049 5 0 "[ . 1 . 2]" 2
34 1 25 VAL O 1 57 ALA N . . 3.000 2.968 2.899 3.018 0.018 1 0 "[ . 1 . 2]" 2
35 1 27 VAL O 1 59 TYR H . . 2.000 1.731 1.705 1.774 . 0 0 "[ . 1 . 2]" 2
36 1 27 VAL O 1 59 TYR N . . 3.000 2.712 2.668 2.742 . 0 0 "[ . 1 . 2]" 2
37 1 29 LEU O 1 61 VAL H . . 2.000 2.015 1.960 2.088 0.088 9 0 "[ . 1 . 2]" 2
38 1 29 LEU O 1 61 VAL N . . 3.000 2.999 2.952 3.074 0.074 9 0 "[ . 1 . 2]" 2
stop_
save_