NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
416291 |
2diz   |
11107 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2diz
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 2915
_Distance_constraint_stats_list.Viol_count 680
_Distance_constraint_stats_list.Viol_total 202.094
_Distance_constraint_stats_list.Viol_max 0.181
_Distance_constraint_stats_list.Viol_rms 0.0033
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0002
_Distance_constraint_stats_list.Viol_average_violations_only 0.0149
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 6 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 GLY 0.026 0.005 8 0 "[ . 1 . 2]"
1 8 THR 0.079 0.035 15 0 "[ . 1 . 2]"
1 9 VAL 2.582 0.181 10 0 "[ . 1 . 2]"
1 10 LEU 2.928 0.181 10 0 "[ . 1 . 2]"
1 11 ALA 0.128 0.030 12 0 "[ . 1 . 2]"
1 12 LEU 0.173 0.043 19 0 "[ . 1 . 2]"
1 13 THR 0.166 0.043 20 0 "[ . 1 . 2]"
1 14 GLU 0.056 0.040 7 0 "[ . 1 . 2]"
1 15 ASN 0.065 0.020 3 0 "[ . 1 . 2]"
1 16 ASN 0.085 0.043 20 0 "[ . 1 . 2]"
1 17 PHE 0.075 0.017 20 0 "[ . 1 . 2]"
1 18 ASP 0.000 0.000 11 0 "[ . 1 . 2]"
1 19 ASP 0.009 0.007 12 0 "[ . 1 . 2]"
1 20 THR 0.070 0.027 12 0 "[ . 1 . 2]"
1 21 ILE 0.004 0.002 19 0 "[ . 1 . 2]"
1 22 ALA 0.010 0.007 19 0 "[ . 1 . 2]"
1 23 GLU 0.065 0.031 11 0 "[ . 1 . 2]"
1 24 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 ILE 0.028 0.010 12 0 "[ . 1 . 2]"
1 26 THR 0.009 0.003 11 0 "[ . 1 . 2]"
1 27 PHE 0.056 0.018 19 0 "[ . 1 . 2]"
1 28 ILE 0.069 0.020 19 0 "[ . 1 . 2]"
1 29 LYS 0.604 0.063 18 0 "[ . 1 . 2]"
1 30 PHE 0.434 0.063 18 0 "[ . 1 . 2]"
1 31 TYR 0.315 0.033 18 0 "[ . 1 . 2]"
1 32 ALA 0.026 0.010 18 0 "[ . 1 . 2]"
1 33 PRO 0.162 0.033 18 0 "[ . 1 . 2]"
1 34 TRP 0.010 0.005 17 0 "[ . 1 . 2]"
1 35 CYS 0.024 0.010 19 0 "[ . 1 . 2]"
1 36 GLY 0.042 0.012 8 0 "[ . 1 . 2]"
1 37 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 CYS 0.030 0.010 19 0 "[ . 1 . 2]"
1 39 LYS 0.102 0.022 11 0 "[ . 1 . 2]"
1 40 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 LEU 0.004 0.003 13 0 "[ . 1 . 2]"
1 42 ALA 0.125 0.038 18 0 "[ . 1 . 2]"
1 43 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 THR 0.034 0.015 19 0 "[ . 1 . 2]"
1 45 TRP 0.281 0.038 18 0 "[ . 1 . 2]"
1 46 GLU 0.145 0.035 15 0 "[ . 1 . 2]"
1 47 GLU 0.018 0.009 20 0 "[ . 1 . 2]"
1 48 LEU 0.035 0.010 8 0 "[ . 1 . 2]"
1 49 SER 0.067 0.019 15 0 "[ . 1 . 2]"
1 50 LYS 0.042 0.009 20 0 "[ . 1 . 2]"
1 51 LYS 1.262 0.091 12 0 "[ . 1 . 2]"
1 52 GLU 1.298 0.091 12 0 "[ . 1 . 2]"
1 53 PHE 0.024 0.018 3 0 "[ . 1 . 2]"
1 54 PRO 0.037 0.018 3 0 "[ . 1 . 2]"
1 55 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 LEU 0.041 0.009 20 0 "[ . 1 . 2]"
1 57 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 VAL 0.031 0.010 12 0 "[ . 1 . 2]"
1 60 LYS 0.014 0.004 18 0 "[ . 1 . 2]"
1 61 ILE 0.099 0.058 12 0 "[ . 1 . 2]"
1 62 ALA 0.138 0.043 8 0 "[ . 1 . 2]"
1 63 GLU 0.784 0.138 7 0 "[ . 1 . 2]"
1 64 VAL 0.312 0.060 18 0 "[ . 1 . 2]"
1 65 ASP 0.309 0.060 18 0 "[ . 1 . 2]"
1 66 CYS 0.136 0.018 7 0 "[ . 1 . 2]"
1 67 THR 0.131 0.031 13 0 "[ . 1 . 2]"
1 68 ALA 0.080 0.016 10 0 "[ . 1 . 2]"
1 69 GLU 0.408 0.099 10 0 "[ . 1 . 2]"
1 70 ARG 0.681 0.131 3 0 "[ . 1 . 2]"
1 71 ASN 0.385 0.095 6 0 "[ . 1 . 2]"
1 72 ILE 0.165 0.095 6 0 "[ . 1 . 2]"
1 73 CYS 0.035 0.012 8 0 "[ . 1 . 2]"
1 74 SER 0.041 0.017 20 0 "[ . 1 . 2]"
1 75 LYS 0.148 0.025 20 0 "[ . 1 . 2]"
1 76 TYR 0.171 0.021 20 0 "[ . 1 . 2]"
1 77 SER 0.001 0.001 15 0 "[ . 1 . 2]"
1 78 VAL 0.023 0.012 8 0 "[ . 1 . 2]"
1 79 ARG 0.013 0.013 12 0 "[ . 1 . 2]"
1 80 GLY 0.101 0.028 7 0 "[ . 1 . 2]"
1 81 TYR 0.153 0.028 7 0 "[ . 1 . 2]"
1 82 PRO 0.045 0.010 13 0 "[ . 1 . 2]"
1 83 THR 0.139 0.021 19 0 "[ . 1 . 2]"
1 84 LEU 0.068 0.025 17 0 "[ . 1 . 2]"
1 85 LEU 0.041 0.008 17 0 "[ . 1 . 2]"
1 86 LEU 0.075 0.025 19 0 "[ . 1 . 2]"
1 87 PHE 0.041 0.020 19 0 "[ . 1 . 2]"
1 88 ARG 0.037 0.025 19 0 "[ . 1 . 2]"
1 89 GLY 0.022 0.022 19 0 "[ . 1 . 2]"
1 90 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 91 LYS 0.224 0.071 19 0 "[ . 1 . 2]"
1 92 LYS 0.335 0.111 11 0 "[ . 1 . 2]"
1 93 VAL 0.011 0.004 15 0 "[ . 1 . 2]"
1 94 SER 0.009 0.003 1 0 "[ . 1 . 2]"
1 95 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 HIS 0.006 0.003 6 0 "[ . 1 . 2]"
1 97 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 98 GLY 0.001 0.001 17 0 "[ . 1 . 2]"
1 99 GLY 0.094 0.064 15 0 "[ . 1 . 2]"
1 100 ARG 0.239 0.092 6 0 "[ . 1 . 2]"
1 101 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 LEU 0.016 0.006 19 0 "[ . 1 . 2]"
1 103 ASP 0.003 0.002 18 0 "[ . 1 . 2]"
1 104 SER 0.006 0.002 18 0 "[ . 1 . 2]"
1 105 LEU 0.047 0.015 19 0 "[ . 1 . 2]"
1 106 HIS 0.011 0.010 8 0 "[ . 1 . 2]"
1 107 ARG 0.083 0.047 13 0 "[ . 1 . 2]"
1 108 PHE 0.002 0.001 2 0 "[ . 1 . 2]"
1 109 VAL 0.023 0.005 17 0 "[ . 1 . 2]"
1 110 LEU 0.026 0.014 8 0 "[ . 1 . 2]"
1 111 SER 0.049 0.033 3 0 "[ . 1 . 2]"
1 112 GLN 0.004 0.004 15 0 "[ . 1 . 2]"
1 113 ALA 0.161 0.045 17 0 "[ . 1 . 2]"
1 114 LYS 0.373 0.136 14 0 "[ . 1 . 2]"
1 115 ASP 0.160 0.136 14 0 "[ . 1 . 2]"
1 116 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 117 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 12 LEU H 1 13 THR H . . 5.080 4.578 4.511 4.622 . 0 0 "[ . 1 . 2]" 1
2 1 13 THR H 1 14 GLU H . . 5.420 4.452 4.386 4.479 . 0 0 "[ . 1 . 2]" 1
3 1 13 THR H 1 17 PHE QD . . 5.430 4.751 4.455 5.158 . 0 0 "[ . 1 . 2]" 1
4 1 12 LEU HA 1 13 THR H . . 2.810 2.294 2.220 2.329 . 0 0 "[ . 1 . 2]" 1
5 1 13 THR H 1 16 ASN HB2 . . 5.150 4.365 3.730 5.099 . 0 0 "[ . 1 . 2]" 1
6 1 13 THR H 1 17 PHE QB . . 5.330 3.335 2.980 3.797 . 0 0 "[ . 1 . 2]" 1
7 1 12 LEU HB2 1 13 THR H . . 4.360 3.772 3.630 3.953 . 0 0 "[ . 1 . 2]" 1
8 1 12 LEU HB3 1 13 THR H . . 3.640 2.697 2.585 2.929 . 0 0 "[ . 1 . 2]" 1
9 1 12 LEU MD2 1 13 THR H . . 3.890 3.440 3.158 3.685 . 0 0 "[ . 1 . 2]" 1
10 1 49 SER H 1 49 SER HG . . 3.390 3.122 2.966 3.323 . 0 0 "[ . 1 . 2]" 1
11 1 49 SER H 1 49 SER HB3 . . 3.200 2.289 2.235 2.332 . 0 0 "[ . 1 . 2]" 1
12 1 49 SER H 1 50 LYS HB2 . . 5.500 5.015 4.828 5.163 . 0 0 "[ . 1 . 2]" 1
13 1 49 SER H 1 61 ILE HG12 . . 5.500 4.782 4.415 5.211 . 0 0 "[ . 1 . 2]" 1
14 1 48 LEU HG 1 49 SER H . . 4.510 3.940 3.757 4.132 . 0 0 "[ . 1 . 2]" 1
15 1 48 LEU HB2 1 49 SER H . . 4.210 3.679 3.564 3.847 . 0 0 "[ . 1 . 2]" 1
16 1 9 VAL MG2 1 49 SER H . . 4.370 4.333 4.165 4.376 0.006 8 0 "[ . 1 . 2]" 1
17 1 48 LEU MD2 1 49 SER H . . 4.990 4.224 3.999 4.450 . 0 0 "[ . 1 . 2]" 1
18 1 27 PHE H 1 60 LYS H . . 4.730 3.536 3.176 4.099 . 0 0 "[ . 1 . 2]" 1
19 1 25 ILE H 1 60 LYS H . . 5.140 4.629 4.303 5.029 . 0 0 "[ . 1 . 2]" 1
20 1 60 LYS H 1 60 LYS HB2 . . 3.430 2.464 2.301 2.699 . 0 0 "[ . 1 . 2]" 1
21 1 25 ILE HB 1 60 LYS H . . 4.440 3.949 3.684 4.154 . 0 0 "[ . 1 . 2]" 1
22 1 60 LYS H 1 60 LYS HB3 . . 4.030 3.663 3.566 3.813 . 0 0 "[ . 1 . 2]" 1
23 1 60 LYS H 1 60 LYS HG3 . . 4.750 2.957 2.514 3.332 . 0 0 "[ . 1 . 2]" 1
24 1 25 ILE MG 1 60 LYS H . . 4.370 3.875 3.435 4.291 . 0 0 "[ . 1 . 2]" 1
25 1 26 THR MG 1 60 LYS H . . 4.810 4.044 3.833 4.295 . 0 0 "[ . 1 . 2]" 1
26 1 60 LYS H 1 61 ILE MD . . 5.120 4.191 3.716 4.436 . 0 0 "[ . 1 . 2]" 1
27 1 59 VAL MG1 1 60 LYS H . . 3.660 2.543 1.857 3.115 . 0 0 "[ . 1 . 2]" 1
28 1 54 PRO HB2 1 55 GLY H . . 4.590 3.363 2.965 3.859 . 0 0 "[ . 1 . 2]" 1
29 1 54 PRO HB3 1 55 GLY H . . 4.590 3.897 3.647 4.233 . 0 0 "[ . 1 . 2]" 1
30 1 10 LEU HG 1 11 ALA H . . 5.000 4.232 3.636 4.992 . 0 0 "[ . 1 . 2]" 1
31 1 10 LEU HB3 1 11 ALA H . . 4.470 3.499 2.748 4.117 . 0 0 "[ . 1 . 2]" 1
32 1 117 LEU H 1 117 LEU QB . . 3.580 2.458 2.120 3.221 . 0 0 "[ . 1 . 2]" 1
33 1 116 GLU HB2 1 117 LEU H . . 5.190 4.237 2.665 4.629 . 0 0 "[ . 1 . 2]" 1
34 1 9 VAL MG1 1 11 ALA H . . 5.070 3.945 2.856 4.804 . 0 0 "[ . 1 . 2]" 1
35 1 93 VAL H 1 94 SER H . . 3.200 2.379 2.098 2.702 . 0 0 "[ . 1 . 2]" 1
36 1 86 LEU H 1 94 SER H . . 3.880 3.005 2.738 3.308 . 0 0 "[ . 1 . 2]" 1
37 1 93 VAL HB 1 94 SER H . . 3.420 2.149 1.951 2.399 . 0 0 "[ . 1 . 2]" 1
38 1 86 LEU HB2 1 94 SER H . . 4.710 4.046 3.654 4.504 . 0 0 "[ . 1 . 2]" 1
39 1 92 LYS HB2 1 94 SER H . . 5.420 4.409 4.014 5.375 . 0 0 "[ . 1 . 2]" 1
40 1 93 VAL MG2 1 94 SER H . . 3.690 3.625 3.488 3.683 . 0 0 "[ . 1 . 2]" 1
41 1 28 ILE HA 1 62 ALA H . . 3.800 3.042 2.749 3.288 . 0 0 "[ . 1 . 2]" 1
42 1 28 ILE HG13 1 62 ALA H . . 5.060 4.457 3.746 4.823 . 0 0 "[ . 1 . 2]" 1
43 1 61 ILE HB 1 62 ALA H . . 5.340 4.339 4.252 4.412 . 0 0 "[ . 1 . 2]" 1
44 1 62 ALA H 1 62 ALA MB . . 3.430 2.394 2.302 2.518 . 0 0 "[ . 1 . 2]" 1
45 1 61 ILE MD 1 62 ALA H . . 4.120 3.709 3.516 3.906 . 0 0 "[ . 1 . 2]" 1
46 1 10 LEU HB3 1 62 ALA H . . 5.500 5.184 4.929 5.501 0.001 10 0 "[ . 1 . 2]" 1
47 1 12 LEU HG 1 62 ALA H . . 5.500 5.174 4.949 5.436 . 0 0 "[ . 1 . 2]" 1
48 1 61 ILE HG12 1 62 ALA H . . 5.500 5.188 5.101 5.264 . 0 0 "[ . 1 . 2]" 1
49 1 29 LYS H 1 62 ALA H . . 4.960 4.659 4.354 4.899 . 0 0 "[ . 1 . 2]" 1
50 1 29 LYS H 1 45 TRP HE1 . . 4.120 3.955 3.749 4.141 0.021 18 0 "[ . 1 . 2]" 1
51 1 29 LYS H 1 63 GLU HA . . 3.320 2.394 1.929 2.751 . 0 0 "[ . 1 . 2]" 1
52 1 28 ILE HA 1 29 LYS H . . 2.930 2.282 2.218 2.333 . 0 0 "[ . 1 . 2]" 1
53 1 29 LYS H 1 29 LYS HB2 . . 3.720 3.185 3.017 3.503 . 0 0 "[ . 1 . 2]" 1
54 1 28 ILE HG12 1 29 LYS H . . 4.860 4.262 4.038 4.462 . 0 0 "[ . 1 . 2]" 1
55 1 29 LYS H 1 29 LYS HB3 . . 3.720 2.682 2.501 2.769 . 0 0 "[ . 1 . 2]" 1
56 1 28 ILE H 1 29 LYS H . . 5.120 4.549 4.532 4.565 . 0 0 "[ . 1 . 2]" 1
57 1 28 ILE MD 1 29 LYS H . . 5.270 4.827 4.699 4.988 . 0 0 "[ . 1 . 2]" 1
58 1 18 ASP H 1 21 ILE H . . 5.500 5.170 4.907 5.403 . 0 0 "[ . 1 . 2]" 1
59 1 19 ASP H 1 21 ILE H . . 5.500 4.783 4.302 5.048 . 0 0 "[ . 1 . 2]" 1
60 1 20 THR HG1 1 21 ILE H . . 4.680 3.996 3.797 4.146 . 0 0 "[ . 1 . 2]" 1
61 1 18 ASP HA 1 21 ILE H . . 4.110 3.820 3.494 4.110 0.000 11 0 "[ . 1 . 2]" 1
62 1 20 THR HB 1 21 ILE H . . 3.460 2.123 1.944 2.482 . 0 0 "[ . 1 . 2]" 1
63 1 17 PHE HA 1 21 ILE H . . 5.200 4.536 4.156 4.855 . 0 0 "[ . 1 . 2]" 1
64 1 21 ILE H 1 26 THR HB . . 5.500 4.181 3.888 4.530 . 0 0 "[ . 1 . 2]" 1
65 1 21 ILE H 1 21 ILE QG . . 3.110 2.148 1.947 2.314 . 0 0 "[ . 1 . 2]" 1
66 1 12 LEU MD1 1 21 ILE H . . 4.650 3.621 3.241 4.074 . 0 0 "[ . 1 . 2]" 1
67 1 34 TRP H 1 34 TRP HE1 . . 5.110 4.306 4.157 4.471 . 0 0 "[ . 1 . 2]" 1
68 1 34 TRP H 1 34 TRP HD1 . . 3.640 3.055 2.665 3.278 . 0 0 "[ . 1 . 2]" 1
69 1 34 TRP H 1 34 TRP HB2 . . 4.070 3.694 3.590 3.747 . 0 0 "[ . 1 . 2]" 1
70 1 33 PRO HD2 1 34 TRP H . . 3.890 2.996 2.664 3.066 . 0 0 "[ . 1 . 2]" 1
71 1 34 TRP H 1 34 TRP HB3 . . 3.660 3.127 2.821 3.302 . 0 0 "[ . 1 . 2]" 1
72 1 34 TRP H 1 67 THR MG . . 4.790 3.750 3.311 4.206 . 0 0 "[ . 1 . 2]" 1
73 1 32 ALA MB 1 34 TRP H . . 3.690 2.362 2.226 2.591 . 0 0 "[ . 1 . 2]" 1
74 1 87 PHE H 1 87 PHE QD . . 3.690 2.861 2.407 3.267 . 0 0 "[ . 1 . 2]" 1
75 1 26 THR HB 1 87 PHE H . . 4.880 4.699 4.378 4.871 . 0 0 "[ . 1 . 2]" 1
76 1 87 PHE H 1 87 PHE HB2 . . 3.530 2.760 2.676 2.858 . 0 0 "[ . 1 . 2]" 1
77 1 86 LEU HG 1 87 PHE H . . 3.790 2.307 2.144 2.667 . 0 0 "[ . 1 . 2]" 1
78 1 25 ILE MG 1 87 PHE H . . 4.460 3.254 3.006 3.564 . 0 0 "[ . 1 . 2]" 1
79 1 86 LEU HB3 1 87 PHE H . . 5.010 3.866 3.776 4.041 . 0 0 "[ . 1 . 2]" 1
80 1 28 ILE HA 1 45 TRP HE1 . . 4.870 4.451 4.018 4.741 . 0 0 "[ . 1 . 2]" 1
81 1 45 TRP HE1 1 63 GLU HB3 . . 5.340 3.075 2.221 3.917 . 0 0 "[ . 1 . 2]" 1
82 1 45 TRP HE1 1 63 GLU HB2 . . 4.880 3.070 2.153 3.890 . 0 0 "[ . 1 . 2]" 1
83 1 45 TRP HE1 1 62 ALA HA . . 4.980 3.815 3.534 3.997 . 0 0 "[ . 1 . 2]" 1
84 1 45 TRP HE1 1 63 GLU HA . . 4.830 3.078 2.651 3.677 . 0 0 "[ . 1 . 2]" 1
85 1 29 LYS QG 1 45 TRP HE1 . . 5.490 4.976 4.694 5.153 . 0 0 "[ . 1 . 2]" 1
86 1 29 LYS HB3 1 45 TRP HE1 . . 4.660 3.242 3.008 3.383 . 0 0 "[ . 1 . 2]" 1
87 1 58 GLY H 1 59 VAL H . . 4.340 4.206 4.061 4.330 . 0 0 "[ . 1 . 2]" 1
88 1 57 ALA HA 1 58 GLY H . . 3.140 2.326 2.258 2.374 . 0 0 "[ . 1 . 2]" 1
89 1 57 ALA MB 1 58 GLY H . . 3.850 2.615 2.473 2.761 . 0 0 "[ . 1 . 2]" 1
90 1 92 LYS HB3 1 93 VAL H . . 4.770 4.092 3.798 4.412 . 0 0 "[ . 1 . 2]" 1
91 1 92 LYS HB2 1 93 VAL H . . 4.650 2.891 2.431 3.670 . 0 0 "[ . 1 . 2]" 1
92 1 37 HIS H 1 37 HIS HD2 . . 4.830 3.386 1.981 4.725 . 0 0 "[ . 1 . 2]" 1
93 1 27 PHE HD1 1 28 ILE H . . 3.570 3.361 2.063 3.566 . 0 0 "[ . 1 . 2]" 1
94 1 27 PHE HB3 1 28 ILE H . . 5.030 4.174 4.131 4.236 . 0 0 "[ . 1 . 2]" 1
95 1 28 ILE H 1 28 ILE HG13 . . 3.690 2.477 2.237 2.647 . 0 0 "[ . 1 . 2]" 1
96 1 28 ILE H 1 28 ILE HG12 . . 4.200 3.815 3.561 4.011 . 0 0 "[ . 1 . 2]" 1
97 1 35 CYS H 1 38 CYS H . . 5.500 5.301 4.933 5.508 0.008 11 0 "[ . 1 . 2]" 1
98 1 34 TRP HE3 1 35 CYS H . . 4.430 3.853 3.225 4.394 . 0 0 "[ . 1 . 2]" 1
99 1 34 TRP H 1 35 CYS H . . 3.230 2.119 1.901 2.407 . 0 0 "[ . 1 . 2]" 1
100 1 33 PRO HA 1 35 CYS H . . 4.450 3.891 3.610 4.285 . 0 0 "[ . 1 . 2]" 1
101 1 34 TRP HB3 1 35 CYS H . . 4.940 4.409 4.157 4.604 . 0 0 "[ . 1 . 2]" 1
102 1 35 CYS H 1 35 CYS HB2 . . 3.220 2.597 2.332 2.986 . 0 0 "[ . 1 . 2]" 1
103 1 35 CYS H 1 35 CYS HB3 . . 3.220 2.707 2.420 2.857 . 0 0 "[ . 1 . 2]" 1
104 1 32 ALA MB 1 35 CYS H . . 3.760 2.719 2.152 3.256 . 0 0 "[ . 1 . 2]" 1
105 1 96 HIS HE1 1 99 GLY H . . 5.040 3.744 3.015 5.015 . 0 0 "[ . 1 . 2]" 1
106 1 27 PHE HB2 1 28 ILE H . . 5.000 4.529 4.497 4.542 . 0 0 "[ . 1 . 2]" 1
107 1 65 ASP H 1 69 GLU H . . 5.500 4.293 3.919 4.577 . 0 0 "[ . 1 . 2]" 1
108 1 65 ASP H 1 65 ASP HB2 . . 3.840 2.723 2.207 3.606 . 0 0 "[ . 1 . 2]" 1
109 1 64 VAL MG1 1 65 ASP H . . 3.670 2.569 2.315 2.786 . 0 0 "[ . 1 . 2]" 1
110 1 31 TYR QE 1 65 ASP H . . 4.890 4.818 4.649 4.903 0.013 18 0 "[ . 1 . 2]" 1
111 1 64 VAL HB 1 65 ASP H . . 5.070 4.200 4.056 4.322 . 0 0 "[ . 1 . 2]" 1
112 1 85 LEU HB2 1 86 LEU H . . 4.620 4.163 3.913 4.411 . 0 0 "[ . 1 . 2]" 1
113 1 13 THR H 1 17 PHE H . . 4.230 3.808 2.863 4.247 0.017 20 0 "[ . 1 . 2]" 1
114 1 17 PHE H 1 17 PHE QD . . 4.380 4.001 3.841 4.183 . 0 0 "[ . 1 . 2]" 1
115 1 13 THR HA 1 17 PHE H . . 5.500 5.360 4.834 5.506 0.006 19 0 "[ . 1 . 2]" 1
116 1 15 ASN HA 1 17 PHE H . . 5.500 4.377 4.138 4.801 . 0 0 "[ . 1 . 2]" 1
117 1 14 GLU HA 1 17 PHE H . . 4.270 3.882 3.610 4.128 . 0 0 "[ . 1 . 2]" 1
118 1 17 PHE H 1 17 PHE QB . . 2.860 2.260 2.233 2.288 . 0 0 "[ . 1 . 2]" 1
119 1 12 LEU HB3 1 17 PHE H . . 4.960 4.314 3.425 4.659 . 0 0 "[ . 1 . 2]" 1
120 1 12 LEU MD2 1 17 PHE H . . 5.400 4.880 4.171 5.379 . 0 0 "[ . 1 . 2]" 1
121 1 17 PHE H 1 72 ILE MD . . 4.790 4.651 4.416 4.791 0.001 2 0 "[ . 1 . 2]" 1
122 1 86 LEU H 1 87 PHE H . . 4.690 4.557 4.515 4.583 . 0 0 "[ . 1 . 2]" 1
123 1 27 PHE QE 1 86 LEU H . . 4.890 3.219 2.964 3.635 . 0 0 "[ . 1 . 2]" 1
124 1 86 LEU H 1 108 PHE QE . . 5.030 4.173 3.565 4.617 . 0 0 "[ . 1 . 2]" 1
125 1 86 LEU H 1 108 PHE HZ . . 5.270 4.242 3.449 4.871 . 0 0 "[ . 1 . 2]" 1
126 1 85 LEU HA 1 86 LEU H . . 3.000 2.184 2.139 2.291 . 0 0 "[ . 1 . 2]" 1
127 1 86 LEU H 1 95 GLU HA . . 4.310 3.665 3.475 3.952 . 0 0 "[ . 1 . 2]" 1
128 1 86 LEU H 1 86 LEU HB3 . . 3.500 2.509 2.364 2.608 . 0 0 "[ . 1 . 2]" 1
129 1 86 LEU H 1 86 LEU HB2 . . 3.600 2.769 2.662 2.948 . 0 0 "[ . 1 . 2]" 1
130 1 85 LEU MD2 1 86 LEU H . . 4.130 3.381 3.162 3.571 . 0 0 "[ . 1 . 2]" 1
131 1 79 ARG H 1 80 GLY H . . 3.050 1.982 1.798 2.549 . 0 0 "[ . 1 . 2]" 1
132 1 80 GLY H 1 81 TYR H . . 4.760 4.186 3.462 4.504 . 0 0 "[ . 1 . 2]" 1
133 1 80 GLY H 1 83 THR HG1 . . 3.850 3.662 3.384 3.871 0.021 19 0 "[ . 1 . 2]" 1
134 1 78 VAL HA 1 80 GLY H . . 4.050 3.623 3.307 3.840 . 0 0 "[ . 1 . 2]" 1
135 1 79 ARG HB2 1 80 GLY H . . 4.470 3.365 2.586 4.090 . 0 0 "[ . 1 . 2]" 1
136 1 79 ARG HB3 1 80 GLY H . . 4.470 3.842 3.346 4.406 . 0 0 "[ . 1 . 2]" 1
137 1 78 VAL MG1 1 80 GLY H . . 3.590 3.416 2.474 3.596 0.006 8 0 "[ . 1 . 2]" 1
138 1 80 GLY H 1 81 TYR QD . . 5.410 4.674 3.793 5.074 . 0 0 "[ . 1 . 2]" 1
139 1 80 GLY H 1 81 TYR QE . . 5.500 4.673 3.887 5.112 . 0 0 "[ . 1 . 2]" 1
140 1 87 PHE QE 1 92 LYS H . . 4.950 3.420 2.879 4.105 . 0 0 "[ . 1 . 2]" 1
141 1 87 PHE QD 1 92 LYS H . . 4.920 2.938 2.442 3.511 . 0 0 "[ . 1 . 2]" 1
142 1 91 LYS H 1 92 LYS H . . 4.740 4.360 4.153 4.514 . 0 0 "[ . 1 . 2]" 1
143 1 92 LYS H 1 92 LYS HB3 . . 3.360 2.333 2.142 2.471 . 0 0 "[ . 1 . 2]" 1
144 1 92 LYS H 1 92 LYS HB2 . . 3.700 3.540 3.110 3.594 . 0 0 "[ . 1 . 2]" 1
145 1 60 LYS HA 1 61 ILE H . . 2.830 2.243 2.163 2.335 . 0 0 "[ . 1 . 2]" 1
146 1 49 SER HA 1 61 ILE H . . 5.100 4.312 3.878 4.748 . 0 0 "[ . 1 . 2]" 1
147 1 49 SER HB2 1 61 ILE H . . 5.300 4.468 4.133 4.717 . 0 0 "[ . 1 . 2]" 1
148 1 61 ILE H 1 61 ILE HB . . 3.230 2.644 2.493 2.794 . 0 0 "[ . 1 . 2]" 1
149 1 61 ILE H 1 61 ILE HG12 . . 3.550 2.812 2.421 3.024 . 0 0 "[ . 1 . 2]" 1
150 1 60 LYS HB3 1 61 ILE H . . 4.040 2.898 2.598 3.218 . 0 0 "[ . 1 . 2]" 1
151 1 61 ILE H 1 62 ALA MB . . 5.500 4.665 4.442 4.932 . 0 0 "[ . 1 . 2]" 1
152 1 10 LEU MD2 1 61 ILE H . . 4.500 4.181 3.921 4.558 0.058 12 0 "[ . 1 . 2]" 1
153 1 61 ILE H 1 61 ILE MG . . 4.500 3.849 3.782 3.917 . 0 0 "[ . 1 . 2]" 1
154 1 59 VAL MG1 1 61 ILE H . . 5.070 4.509 4.155 4.825 . 0 0 "[ . 1 . 2]" 1
155 1 68 ALA H 1 70 ARG H . . 5.100 4.055 3.489 4.926 . 0 0 "[ . 1 . 2]" 1
156 1 67 THR H 1 68 ALA H . . 2.910 2.068 1.787 2.618 . 0 0 "[ . 1 . 2]" 1
157 1 68 ALA H 1 69 GLU H . . 2.880 2.116 1.815 2.453 . 0 0 "[ . 1 . 2]" 1
158 1 67 THR HB 1 68 ALA H . . 4.330 3.781 3.415 4.211 . 0 0 "[ . 1 . 2]" 1
159 1 65 ASP HB2 1 68 ALA H . . 4.440 3.093 2.531 4.436 . 0 0 "[ . 1 . 2]" 1
160 1 65 ASP HB3 1 68 ALA H . . 4.440 3.351 2.658 4.443 0.003 11 0 "[ . 1 . 2]" 1
161 1 68 ALA H 1 69 GLU HB2 . . 4.860 4.412 4.174 4.871 0.011 18 0 "[ . 1 . 2]" 1
162 1 68 ALA H 1 68 ALA MB . . 3.020 2.270 2.085 2.448 . 0 0 "[ . 1 . 2]" 1
163 1 95 GLU HA 1 96 HIS H . . 2.930 2.179 2.139 2.302 . 0 0 "[ . 1 . 2]" 1
164 1 75 LYS H 1 76 TYR QD . . 5.110 4.569 4.076 4.899 . 0 0 "[ . 1 . 2]" 1
165 1 75 LYS H 1 76 TYR H . . 3.370 2.713 2.593 2.826 . 0 0 "[ . 1 . 2]" 1
166 1 71 ASN HA 1 75 LYS H . . 4.810 4.349 3.942 4.712 . 0 0 "[ . 1 . 2]" 1
167 1 74 SER QB 1 75 LYS H . . 3.450 2.542 2.289 2.755 . 0 0 "[ . 1 . 2]" 1
168 1 72 ILE HA 1 75 LYS H . . 4.110 3.646 3.447 3.942 . 0 0 "[ . 1 . 2]" 1
169 1 75 LYS H 1 75 LYS HB2 . . 3.090 2.552 2.380 2.695 . 0 0 "[ . 1 . 2]" 1
170 1 75 LYS H 1 75 LYS HB3 . . 3.140 2.497 2.370 2.684 . 0 0 "[ . 1 . 2]" 1
171 1 75 LYS H 1 75 LYS HG2 . . 5.010 4.424 4.342 4.492 . 0 0 "[ . 1 . 2]" 1
172 1 72 ILE MG 1 75 LYS H . . 4.930 4.597 4.345 4.862 . 0 0 "[ . 1 . 2]" 1
173 1 96 HIS H 1 108 PHE QE . . 4.960 4.085 3.419 4.782 . 0 0 "[ . 1 . 2]" 1
174 1 96 HIS H 1 108 PHE HZ . . 5.240 3.786 2.974 4.530 . 0 0 "[ . 1 . 2]" 1
175 1 84 LEU HB2 1 96 HIS H . . 3.630 3.103 2.686 3.525 . 0 0 "[ . 1 . 2]" 1
176 1 95 GLU HG2 1 96 HIS H . . 3.890 3.082 1.955 3.856 . 0 0 "[ . 1 . 2]" 1
177 1 96 HIS H 1 96 HIS HB3 . . 3.530 2.693 2.404 2.836 . 0 0 "[ . 1 . 2]" 1
178 1 85 LEU MD2 1 96 HIS H . . 3.930 3.690 3.278 3.931 0.001 16 0 "[ . 1 . 2]" 1
179 1 85 LEU HA 1 96 HIS H . . 4.140 3.501 3.123 4.050 . 0 0 "[ . 1 . 2]" 1
180 1 24 GLY H 1 25 ILE H . . 4.930 4.608 4.493 4.648 . 0 0 "[ . 1 . 2]" 1
181 1 25 ILE H 1 26 THR H . . 5.260 4.539 4.515 4.557 . 0 0 "[ . 1 . 2]" 1
182 1 25 ILE H 1 26 THR HA . . 5.500 5.335 5.202 5.366 . 0 0 "[ . 1 . 2]" 1
183 1 25 ILE H 1 88 ARG HA . . 5.500 5.020 4.719 5.478 . 0 0 "[ . 1 . 2]" 1
184 1 24 GLY HA3 1 25 ILE H . . 2.920 2.456 2.277 2.685 . 0 0 "[ . 1 . 2]" 1
185 1 24 GLY HA2 1 25 ILE H . . 3.320 2.683 2.448 2.899 . 0 0 "[ . 1 . 2]" 1
186 1 25 ILE H 1 25 ILE HB . . 3.160 2.515 2.447 2.604 . 0 0 "[ . 1 . 2]" 1
187 1 25 ILE H 1 25 ILE HG12 . . 4.340 3.675 3.404 3.839 . 0 0 "[ . 1 . 2]" 1
188 1 25 ILE H 1 25 ILE MG . . 4.320 3.780 3.760 3.806 . 0 0 "[ . 1 . 2]" 1
189 1 25 ILE H 1 59 VAL MG2 . . 4.760 4.013 3.474 4.401 . 0 0 "[ . 1 . 2]" 1
190 1 44 THR HB 1 45 TRP H . . 3.290 2.376 2.139 2.827 . 0 0 "[ . 1 . 2]" 1
191 1 45 TRP H 1 45 TRP HB2 . . 3.020 2.336 2.211 2.509 . 0 0 "[ . 1 . 2]" 1
192 1 96 HIS H 1 96 HIS HB2 . . 3.530 2.501 2.264 3.118 . 0 0 "[ . 1 . 2]" 1
193 1 41 LEU MD1 1 45 TRP H . . 4.130 3.313 2.762 3.828 . 0 0 "[ . 1 . 2]" 1
194 1 56 LEU HA 1 57 ALA H . . 2.990 2.342 2.275 2.497 . 0 0 "[ . 1 . 2]" 1
195 1 57 ALA H 1 57 ALA MB . . 3.110 2.158 2.024 2.238 . 0 0 "[ . 1 . 2]" 1
196 1 56 LEU MD2 1 57 ALA H . . 4.190 3.151 2.441 3.742 . 0 0 "[ . 1 . 2]" 1
197 1 57 ALA H 1 59 VAL MG2 . . 4.900 3.995 3.688 4.179 . 0 0 "[ . 1 . 2]" 1
198 1 12 LEU HA 1 16 ASN HD21 . . 4.290 2.711 2.021 4.262 . 0 0 "[ . 1 . 2]" 1
199 1 32 ALA H 1 66 CYS H . . 5.370 5.023 4.770 5.288 . 0 0 "[ . 1 . 2]" 1
200 1 66 CYS H 1 68 ALA H . . 5.500 4.383 3.620 4.683 . 0 0 "[ . 1 . 2]" 1
201 1 31 TYR QD 1 66 CYS H . . 5.390 4.972 4.804 5.194 . 0 0 "[ . 1 . 2]" 1
202 1 33 PRO HD2 1 66 CYS H . . 4.140 3.965 3.689 4.148 0.008 11 0 "[ . 1 . 2]" 1
203 1 65 ASP HA 1 66 CYS H . . 2.840 2.202 2.150 2.284 . 0 0 "[ . 1 . 2]" 1
204 1 66 CYS H 1 66 CYS HB2 . . 3.170 2.307 2.237 2.361 . 0 0 "[ . 1 . 2]" 1
205 1 66 CYS H 1 67 THR MG . . 4.650 3.703 3.330 4.011 . 0 0 "[ . 1 . 2]" 1
206 1 43 PRO QG 1 45 TRP H . . 5.390 4.840 4.543 5.072 . 0 0 "[ . 1 . 2]" 1
207 1 45 TRP H 1 46 GLU HB2 . . 5.500 4.869 4.577 5.047 . 0 0 "[ . 1 . 2]" 1
208 1 45 TRP H 1 45 TRP HB3 . . 3.290 2.766 2.568 2.924 . 0 0 "[ . 1 . 2]" 1
209 1 96 HIS HE1 1 98 GLY H . . 4.370 3.352 2.643 4.040 . 0 0 "[ . 1 . 2]" 1
210 1 96 HIS HA 1 98 GLY H . . 4.690 4.234 3.581 4.691 0.001 17 0 "[ . 1 . 2]" 1
211 1 26 THR H 1 87 PHE H . . 3.920 3.336 3.202 3.445 . 0 0 "[ . 1 . 2]" 1
212 1 26 THR H 1 26 THR HG1 . . 3.750 3.155 2.793 3.752 0.002 5 0 "[ . 1 . 2]" 1
213 1 26 THR H 1 27 PHE H . . 5.160 4.128 4.012 4.279 . 0 0 "[ . 1 . 2]" 1
214 1 26 THR H 1 87 PHE HB3 . . 4.810 4.651 4.315 4.785 . 0 0 "[ . 1 . 2]" 1
215 1 25 ILE HB 1 26 THR H . . 4.600 4.098 4.010 4.180 . 0 0 "[ . 1 . 2]" 1
216 1 25 ILE HG12 1 26 THR H . . 4.730 4.387 4.270 4.521 . 0 0 "[ . 1 . 2]" 1
217 1 25 ILE MG 1 26 THR H . . 3.460 2.319 2.114 2.545 . 0 0 "[ . 1 . 2]" 1
218 1 26 THR H 1 86 LEU MD1 . . 4.630 3.677 3.401 3.835 . 0 0 "[ . 1 . 2]" 1
219 1 97 SER H 1 98 GLY H . . 4.590 2.788 1.829 3.697 . 0 0 "[ . 1 . 2]" 1
220 1 39 LYS H 1 42 ALA H . . 5.500 4.714 4.558 5.038 . 0 0 "[ . 1 . 2]" 1
221 1 42 ALA H 1 45 TRP H . . 5.500 4.843 4.714 4.904 . 0 0 "[ . 1 . 2]" 1
222 1 12 LEU H 1 12 LEU HB2 . . 3.490 2.516 2.398 2.660 . 0 0 "[ . 1 . 2]" 1
223 1 12 LEU H 1 12 LEU HG . . 3.340 2.495 2.319 2.794 . 0 0 "[ . 1 . 2]" 1
224 1 38 CYS H 1 39 LYS H . . 3.560 2.787 2.562 3.064 . 0 0 "[ . 1 . 2]" 1
225 1 37 HIS H 1 39 LYS H . . 4.770 4.392 3.997 4.668 . 0 0 "[ . 1 . 2]" 1
226 1 36 GLY HA2 1 39 LYS H . . 3.940 3.535 3.317 3.761 . 0 0 "[ . 1 . 2]" 1
227 1 39 LYS H 1 39 LYS QB . . 2.990 2.352 2.158 2.609 . 0 0 "[ . 1 . 2]" 1
228 1 12 LEU H 1 64 VAL HA . . 4.780 4.580 4.160 4.788 0.008 20 0 "[ . 1 . 2]" 1
229 1 12 LEU H 1 63 GLU HB3 . . 5.500 5.282 4.702 5.543 0.043 19 0 "[ . 1 . 2]" 1
230 1 11 ALA MB 1 12 LEU H . . 3.760 3.461 3.237 3.603 . 0 0 "[ . 1 . 2]" 1
231 1 12 LEU H 1 12 LEU MD1 . . 4.460 3.773 3.541 4.099 . 0 0 "[ . 1 . 2]" 1
232 1 18 ASP HA 1 22 ALA H . . 4.570 4.188 3.979 4.562 . 0 0 "[ . 1 . 2]" 1
233 1 21 ILE QG 1 22 ALA H . . 3.540 2.225 1.921 2.587 . 0 0 "[ . 1 . 2]" 1
234 1 21 ILE MD 1 22 ALA H . . 4.830 3.933 3.666 4.276 . 0 0 "[ . 1 . 2]" 1
235 1 21 ILE MG 1 22 ALA H . . 4.940 3.968 3.841 4.067 . 0 0 "[ . 1 . 2]" 1
236 1 53 PHE H 1 53 PHE QD . . 4.240 2.122 1.928 2.547 . 0 0 "[ . 1 . 2]" 1
237 1 7 GLY QA 1 9 VAL H . . 5.180 4.707 4.508 5.056 . 0 0 "[ . 1 . 2]" 1
238 1 9 VAL H 1 10 LEU H . . 4.970 4.184 3.887 4.289 . 0 0 "[ . 1 . 2]" 1
239 1 9 VAL H 1 46 GLU HA . . 5.500 5.326 5.097 5.520 0.020 15 0 "[ . 1 . 2]" 1
240 1 9 VAL H 1 49 SER HB2 . . 5.500 4.742 4.431 5.053 . 0 0 "[ . 1 . 2]" 1
241 1 9 VAL H 1 49 SER HB3 . . 5.190 4.938 4.763 5.133 . 0 0 "[ . 1 . 2]" 1
242 1 9 VAL H 1 9 VAL HB . . 2.980 2.952 2.893 3.004 0.024 19 0 "[ . 1 . 2]" 1
243 1 9 VAL H 1 9 VAL MG2 . . 3.360 3.247 3.117 3.358 . 0 0 "[ . 1 . 2]" 1
244 1 47 GLU H 1 48 LEU H . . 3.320 2.899 2.760 3.009 . 0 0 "[ . 1 . 2]" 1
245 1 48 LEU H 1 49 SER H . . 3.400 2.850 2.707 2.975 . 0 0 "[ . 1 . 2]" 1
246 1 47 GLU HB2 1 48 LEU H . . 3.580 2.580 2.442 2.780 . 0 0 "[ . 1 . 2]" 1
247 1 48 LEU H 1 48 LEU HB3 . . 3.120 2.701 2.590 2.875 . 0 0 "[ . 1 . 2]" 1
248 1 44 THR MG 1 48 LEU H . . 4.310 4.070 3.721 4.290 . 0 0 "[ . 1 . 2]" 1
249 1 48 LEU H 1 48 LEU HB2 . . 3.090 2.330 2.215 2.419 . 0 0 "[ . 1 . 2]" 1
250 1 48 LEU H 1 102 LEU MD1 . . 3.500 2.955 2.646 3.280 . 0 0 "[ . 1 . 2]" 1
251 1 48 LEU H 1 48 LEU MD2 . . 4.450 4.210 4.172 4.254 . 0 0 "[ . 1 . 2]" 1
252 1 46 GLU H 1 48 LEU H . . 4.960 4.245 4.053 4.390 . 0 0 "[ . 1 . 2]" 1
253 1 9 VAL H 1 49 SER HG . . 5.110 4.522 4.380 4.839 . 0 0 "[ . 1 . 2]" 1
254 1 95 GLU H 1 108 PHE QE . . 5.500 4.719 4.236 5.072 . 0 0 "[ . 1 . 2]" 1
255 1 95 GLU H 1 108 PHE HZ . . 5.500 4.255 3.906 4.616 . 0 0 "[ . 1 . 2]" 1
256 1 94 SER HA 1 95 GLU H . . 3.410 2.360 2.212 2.502 . 0 0 "[ . 1 . 2]" 1
257 1 105 LEU H 1 106 HIS H . . 3.310 2.415 2.176 2.609 . 0 0 "[ . 1 . 2]" 1
258 1 103 ASP HA 1 105 LEU H . . 4.530 3.809 3.588 4.154 . 0 0 "[ . 1 . 2]" 1
259 1 105 LEU H 1 105 LEU HB3 . . 3.830 3.584 3.523 3.622 . 0 0 "[ . 1 . 2]" 1
260 1 105 LEU H 1 106 HIS HB2 . . 4.930 4.586 4.368 4.857 . 0 0 "[ . 1 . 2]" 1
261 1 105 LEU H 1 105 LEU HB2 . . 3.240 2.359 2.228 2.499 . 0 0 "[ . 1 . 2]" 1
262 1 105 LEU H 1 105 LEU HG . . 3.000 2.706 2.290 2.996 . 0 0 "[ . 1 . 2]" 1
263 1 105 LEU H 1 105 LEU MD1 . . 3.930 3.535 3.261 3.794 . 0 0 "[ . 1 . 2]" 1
264 1 101 ASP HA 1 102 LEU H . . 3.040 2.318 2.203 2.496 . 0 0 "[ . 1 . 2]" 1
265 1 101 ASP HB3 1 102 LEU H . . 3.440 2.699 2.228 3.019 . 0 0 "[ . 1 . 2]" 1
266 1 102 LEU H 1 102 LEU HB3 . . 3.220 2.414 2.301 2.495 . 0 0 "[ . 1 . 2]" 1
267 1 102 LEU H 1 102 LEU HB2 . . 3.140 2.647 2.564 2.722 . 0 0 "[ . 1 . 2]" 1
268 1 102 LEU H 1 102 LEU MD1 . . 4.580 4.144 4.017 4.213 . 0 0 "[ . 1 . 2]" 1
269 1 59 VAL H 1 60 LYS H . . 4.720 4.489 4.316 4.629 . 0 0 "[ . 1 . 2]" 1
270 1 53 PHE HB2 1 59 VAL H . . 5.180 3.827 3.396 4.151 . 0 0 "[ . 1 . 2]" 1
271 1 59 VAL H 1 59 VAL MG1 . . 4.140 3.764 3.701 3.801 . 0 0 "[ . 1 . 2]" 1
272 1 47 GLU H 1 49 SER H . . 4.610 4.482 4.236 4.612 0.002 18 0 "[ . 1 . 2]" 1
273 1 43 PRO HA 1 47 GLU H . . 4.690 4.477 4.348 4.661 . 0 0 "[ . 1 . 2]" 1
274 1 44 THR HA 1 47 GLU H . . 3.850 3.545 3.292 3.756 . 0 0 "[ . 1 . 2]" 1
275 1 47 GLU H 1 47 GLU HB2 . . 3.180 2.537 2.266 2.731 . 0 0 "[ . 1 . 2]" 1
276 1 47 GLU H 1 47 GLU HG3 . . 3.680 3.093 1.982 3.630 . 0 0 "[ . 1 . 2]" 1
277 1 44 THR MG 1 47 GLU H . . 5.020 4.637 4.327 4.887 . 0 0 "[ . 1 . 2]" 1
278 1 47 GLU H 1 48 LEU HB2 . . 5.180 5.069 4.969 5.171 . 0 0 "[ . 1 . 2]" 1
279 1 47 GLU H 1 102 LEU MD1 . . 4.530 4.322 4.063 4.527 . 0 0 "[ . 1 . 2]" 1
280 1 31 TYR H 1 64 VAL H . . 4.310 3.722 3.401 3.961 . 0 0 "[ . 1 . 2]" 1
281 1 30 PHE QD 1 31 TYR H . . 5.140 4.793 4.632 4.931 . 0 0 "[ . 1 . 2]" 1
282 1 31 TYR H 1 32 ALA H . . 4.980 4.437 4.381 4.477 . 0 0 "[ . 1 . 2]" 1
283 1 31 TYR H 1 31 TYR QD . . 3.280 2.496 2.099 2.745 . 0 0 "[ . 1 . 2]" 1
284 1 30 PHE HA 1 31 TYR H . . 2.860 2.177 2.139 2.213 . 0 0 "[ . 1 . 2]" 1
285 1 30 PHE HB2 1 31 TYR H . . 4.930 4.343 4.214 4.417 . 0 0 "[ . 1 . 2]" 1
286 1 30 PHE HB3 1 31 TYR H . . 4.200 3.813 3.575 3.949 . 0 0 "[ . 1 . 2]" 1
287 1 31 TYR H 1 64 VAL HB . . 4.780 4.635 4.412 4.785 0.005 18 0 "[ . 1 . 2]" 1
288 1 31 TYR H 1 64 VAL MG1 . . 4.870 4.669 4.404 4.872 0.002 13 0 "[ . 1 . 2]" 1
289 1 29 LYS QG 1 31 TYR H . . 5.250 4.354 3.106 5.024 . 0 0 "[ . 1 . 2]" 1
290 1 30 PHE H 1 85 LEU H . . 4.910 4.665 4.362 4.853 . 0 0 "[ . 1 . 2]" 1
291 1 84 LEU HB3 1 85 LEU H . . 4.100 3.096 2.861 3.414 . 0 0 "[ . 1 . 2]" 1
292 1 28 ILE H 1 85 LEU H . . 4.040 3.788 3.590 3.932 . 0 0 "[ . 1 . 2]" 1
293 1 30 PHE QE 1 85 LEU H . . 4.030 3.515 2.661 3.994 . 0 0 "[ . 1 . 2]" 1
294 1 84 LEU HA 1 85 LEU H . . 2.870 2.198 2.147 2.277 . 0 0 "[ . 1 . 2]" 1
295 1 29 LYS HA 1 85 LEU H . . 4.790 3.677 3.412 3.998 . 0 0 "[ . 1 . 2]" 1
296 1 85 LEU H 1 85 LEU HB2 . . 3.710 2.774 2.647 2.865 . 0 0 "[ . 1 . 2]" 1
297 1 28 ILE HB 1 85 LEU H . . 4.330 4.150 4.010 4.333 0.003 20 0 "[ . 1 . 2]" 1
298 1 85 LEU H 1 85 LEU HG . . 3.890 3.418 3.136 3.643 . 0 0 "[ . 1 . 2]" 1
299 1 28 ILE MG 1 85 LEU H . . 5.250 4.742 4.394 4.948 . 0 0 "[ . 1 . 2]" 1
300 1 58 GLY QA 1 59 VAL H . . 3.310 2.218 2.158 2.304 . 0 0 "[ . 1 . 2]" 1
301 1 59 VAL H 1 59 VAL HB . . 2.960 2.481 2.330 2.616 . 0 0 "[ . 1 . 2]" 1
302 1 59 VAL H 1 59 VAL MG2 . . 3.080 2.423 2.144 2.709 . 0 0 "[ . 1 . 2]" 1
303 1 85 LEU H 1 85 LEU MD1 . . 4.620 4.229 3.997 4.441 . 0 0 "[ . 1 . 2]" 1
304 1 115 ASP HA 1 116 GLU H . . 3.230 2.313 2.147 2.830 . 0 0 "[ . 1 . 2]" 1
305 1 115 ASP HB2 1 116 GLU H . . 4.760 4.192 3.196 4.638 . 0 0 "[ . 1 . 2]" 1
306 1 115 ASP HB3 1 116 GLU H . . 4.760 4.035 2.814 4.553 . 0 0 "[ . 1 . 2]" 1
307 1 116 GLU H 1 116 GLU HG2 . . 4.950 3.673 1.893 4.830 . 0 0 "[ . 1 . 2]" 1
308 1 114 LYS HB2 1 115 ASP H . . 4.730 4.431 3.611 4.632 . 0 0 "[ . 1 . 2]" 1
309 1 57 ALA MB 1 59 VAL H . . 5.500 4.628 4.233 4.802 . 0 0 "[ . 1 . 2]" 1
310 1 114 LYS HG2 1 115 ASP H . . 5.500 4.457 2.620 5.459 . 0 0 "[ . 1 . 2]" 1
311 1 114 LYS HG3 1 115 ASP H . . 5.500 4.355 2.643 5.487 . 0 0 "[ . 1 . 2]" 1
312 1 114 LYS H 1 115 ASP H . . 4.410 4.017 2.195 4.546 0.136 14 0 "[ . 1 . 2]" 1
313 1 56 LEU H 1 57 ALA H . . 4.660 4.522 4.454 4.618 . 0 0 "[ . 1 . 2]" 1
314 1 53 PHE HB3 1 56 LEU H . . 4.680 4.173 3.601 4.611 . 0 0 "[ . 1 . 2]" 1
315 1 56 LEU H 1 56 LEU HB2 . . 3.860 2.524 2.412 2.725 . 0 0 "[ . 1 . 2]" 1
316 1 56 LEU H 1 56 LEU HG . . 3.630 2.968 2.208 3.628 . 0 0 "[ . 1 . 2]" 1
317 1 56 LEU H 1 56 LEU HB3 . . 3.860 3.652 3.581 3.756 . 0 0 "[ . 1 . 2]" 1
318 1 56 LEU H 1 59 VAL MG2 . . 5.460 5.210 4.781 5.459 . 0 0 "[ . 1 . 2]" 1
319 1 71 ASN H 1 72 ILE H . . 3.420 3.050 2.731 3.266 . 0 0 "[ . 1 . 2]" 1
320 1 71 ASN HB2 1 72 ILE H . . 3.640 2.723 2.454 3.261 . 0 0 "[ . 1 . 2]" 1
321 1 69 GLU HB3 1 72 ILE H . . 4.230 3.353 3.070 3.573 . 0 0 "[ . 1 . 2]" 1
322 1 72 ILE H 1 72 ILE HB . . 3.030 2.535 2.445 2.639 . 0 0 "[ . 1 . 2]" 1
323 1 72 ILE H 1 72 ILE HG13 . . 3.150 2.162 1.900 2.345 . 0 0 "[ . 1 . 2]" 1
324 1 72 ILE H 1 72 ILE HG12 . . 3.780 3.443 3.145 3.629 . 0 0 "[ . 1 . 2]" 1
325 1 72 ILE H 1 72 ILE MG . . 4.220 3.768 3.750 3.778 . 0 0 "[ . 1 . 2]" 1
326 1 105 LEU HA 1 108 PHE H . . 4.110 3.586 3.267 3.921 . 0 0 "[ . 1 . 2]" 1
327 1 108 PHE H 1 108 PHE HB2 . . 3.200 2.630 2.528 2.771 . 0 0 "[ . 1 . 2]" 1
328 1 108 PHE H 1 108 PHE HB3 . . 3.200 2.450 2.316 2.544 . 0 0 "[ . 1 . 2]" 1
329 1 108 PHE H 1 108 PHE QD . . 4.410 4.166 4.079 4.195 . 0 0 "[ . 1 . 2]" 1
330 1 110 LEU HA 1 113 ALA H . . 4.450 4.225 3.842 4.449 . 0 0 "[ . 1 . 2]" 1
331 1 112 GLN HB2 1 113 ALA H . . 4.470 2.413 2.158 2.861 . 0 0 "[ . 1 . 2]" 1
332 1 56 LEU MD1 1 113 ALA H . . 4.590 3.801 3.156 4.553 . 0 0 "[ . 1 . 2]" 1
333 1 86 LEU MD2 1 113 ALA H . . 4.880 3.629 3.052 4.207 . 0 0 "[ . 1 . 2]" 1
334 1 99 GLY HA2 1 100 ARG H . . 3.490 2.548 2.138 3.506 0.016 14 0 "[ . 1 . 2]" 1
335 1 99 GLY HA3 1 100 ARG H . . 3.490 3.049 2.292 3.554 0.064 15 0 "[ . 1 . 2]" 1
336 1 100 ARG H 1 100 ARG HG2 . . 4.310 3.639 2.777 4.312 0.002 16 0 "[ . 1 . 2]" 1
337 1 100 ARG H 1 100 ARG HG3 . . 4.310 3.102 1.878 4.324 0.014 17 0 "[ . 1 . 2]" 1
338 1 108 PHE H 1 109 VAL H . . 3.420 2.956 2.638 3.232 . 0 0 "[ . 1 . 2]" 1
339 1 49 SER HB3 1 50 LYS H . . 4.930 3.763 3.649 3.894 . 0 0 "[ . 1 . 2]" 1
340 1 50 LYS H 1 50 LYS HB3 . . 3.710 3.595 3.578 3.623 . 0 0 "[ . 1 . 2]" 1
341 1 42 ALA H 1 43 PRO HD2 . . 3.550 2.309 2.048 2.471 . 0 0 "[ . 1 . 2]" 1
342 1 42 ALA H 1 43 PRO HD3 . . 3.710 3.330 3.117 3.472 . 0 0 "[ . 1 . 2]" 1
343 1 42 ALA H 1 42 ALA MB . . 2.910 2.081 2.025 2.186 . 0 0 "[ . 1 . 2]" 1
344 1 48 LEU H 1 50 LYS H . . 5.060 4.223 3.997 4.412 . 0 0 "[ . 1 . 2]" 1
345 1 49 SER HG 1 50 LYS H . . 3.730 3.220 3.004 3.544 . 0 0 "[ . 1 . 2]" 1
346 1 50 LYS H 1 50 LYS HG3 . . 3.450 2.331 2.211 2.556 . 0 0 "[ . 1 . 2]" 1
347 1 22 ALA HA 1 90 GLY H . . 4.200 3.685 2.811 4.197 . 0 0 "[ . 1 . 2]" 1
348 1 21 ILE HB 1 90 GLY H . . 4.780 4.252 3.473 4.696 . 0 0 "[ . 1 . 2]" 1
349 1 21 ILE QG 1 90 GLY H . . 5.140 4.521 3.974 4.892 . 0 0 "[ . 1 . 2]" 1
350 1 13 THR HA 1 14 GLU H . . 3.260 2.460 2.354 2.652 . 0 0 "[ . 1 . 2]" 1
351 1 13 THR HB 1 14 GLU H . . 3.370 2.317 1.930 2.515 . 0 0 "[ . 1 . 2]" 1
352 1 14 GLU H 1 14 GLU HG2 . . 4.540 4.091 2.826 4.580 0.040 7 0 "[ . 1 . 2]" 1
353 1 14 GLU H 1 14 GLU HB2 . . 3.650 2.278 2.193 2.466 . 0 0 "[ . 1 . 2]" 1
354 1 67 THR H 1 69 GLU H . . 4.200 3.314 2.903 4.194 . 0 0 "[ . 1 . 2]" 1
355 1 66 CYS HA 1 69 GLU H . . 4.140 3.835 3.258 4.067 . 0 0 "[ . 1 . 2]" 1
356 1 69 GLU H 1 69 GLU HB2 . . 3.360 2.499 2.350 2.660 . 0 0 "[ . 1 . 2]" 1
357 1 51 LYS H 1 51 LYS HG3 . . 3.920 3.473 3.342 3.857 . 0 0 "[ . 1 . 2]" 1
358 1 51 LYS H 1 51 LYS HG2 . . 3.920 2.087 1.942 2.678 . 0 0 "[ . 1 . 2]" 1
359 1 51 LYS H 1 51 LYS HB3 . . 3.750 3.605 3.585 3.681 . 0 0 "[ . 1 . 2]" 1
360 1 106 HIS H 1 106 HIS HB3 . . 3.160 2.714 2.572 2.865 . 0 0 "[ . 1 . 2]" 1
361 1 106 HIS H 1 106 HIS HB2 . . 3.100 2.380 2.243 2.526 . 0 0 "[ . 1 . 2]" 1
362 1 105 LEU HG 1 106 HIS H . . 4.890 4.496 4.237 4.718 . 0 0 "[ . 1 . 2]" 1
363 1 105 LEU HB3 1 106 HIS H . . 3.920 3.519 3.300 3.845 . 0 0 "[ . 1 . 2]" 1
364 1 48 LEU MD1 1 106 HIS H . . 3.870 3.148 2.874 3.522 . 0 0 "[ . 1 . 2]" 1
365 1 31 TYR QD 1 64 VAL H . . 3.670 3.436 3.114 3.676 0.006 20 0 "[ . 1 . 2]" 1
366 1 64 VAL H 1 65 ASP HA . . 5.220 4.616 4.476 4.714 . 0 0 "[ . 1 . 2]" 1
367 1 63 GLU HB2 1 64 VAL H . . 3.860 3.147 2.515 3.792 . 0 0 "[ . 1 . 2]" 1
368 1 64 VAL H 1 64 VAL MG2 . . 3.690 3.157 2.999 3.300 . 0 0 "[ . 1 . 2]" 1
369 1 29 LYS QG 1 64 VAL H . . 5.500 4.999 3.167 5.508 0.008 12 0 "[ . 1 . 2]" 1
370 1 70 ARG H 1 73 CYS HB2 . . 5.060 4.748 4.534 5.062 0.002 3 0 "[ . 1 . 2]" 1
371 1 108 PHE HB2 1 109 VAL H . . 4.100 3.762 3.618 3.926 . 0 0 "[ . 1 . 2]" 1
372 1 108 PHE HB3 1 109 VAL H . . 4.100 2.315 2.108 2.572 . 0 0 "[ . 1 . 2]" 1
373 1 109 VAL H 1 109 VAL MG1 . . 4.230 3.762 3.748 3.768 . 0 0 "[ . 1 . 2]" 1
374 1 41 LEU H 1 41 LEU HB3 . . 3.540 2.554 2.409 2.659 . 0 0 "[ . 1 . 2]" 1
375 1 38 CYS HA 1 41 LEU H . . 4.030 3.221 2.993 3.584 . 0 0 "[ . 1 . 2]" 1
376 1 40 THR MG 1 41 LEU H . . 4.310 3.222 2.039 4.021 . 0 0 "[ . 1 . 2]" 1
377 1 64 VAL H 1 65 ASP H . . 4.290 4.198 4.020 4.317 0.027 16 0 "[ . 1 . 2]" 1
378 1 63 GLU H 1 64 VAL H . . 4.840 4.410 4.343 4.479 . 0 0 "[ . 1 . 2]" 1
379 1 29 LYS H 1 64 VAL H . . 4.360 3.523 3.247 3.903 . 0 0 "[ . 1 . 2]" 1
380 1 63 GLU HA 1 64 VAL H . . 2.850 2.326 2.222 2.498 . 0 0 "[ . 1 . 2]" 1
381 1 64 VAL H 1 64 VAL HB . . 3.430 2.845 2.753 2.975 . 0 0 "[ . 1 . 2]" 1
382 1 28 ILE MG 1 64 VAL H . . 3.870 3.453 3.087 3.821 . 0 0 "[ . 1 . 2]" 1
383 1 106 HIS HA 1 109 VAL H . . 4.290 3.871 3.539 4.258 . 0 0 "[ . 1 . 2]" 1
384 1 109 VAL H 1 109 VAL HB . . 3.120 2.537 2.432 2.643 . 0 0 "[ . 1 . 2]" 1
385 1 39 LYS H 1 41 LEU H . . 4.880 4.156 3.808 4.392 . 0 0 "[ . 1 . 2]" 1
386 1 40 THR H 1 41 LEU H . . 3.320 2.516 2.434 2.603 . 0 0 "[ . 1 . 2]" 1
387 1 40 THR HB 1 41 LEU H . . 4.020 3.166 2.613 4.018 . 0 0 "[ . 1 . 2]" 1
388 1 41 LEU H 1 41 LEU MD2 . . 4.510 4.267 4.178 4.346 . 0 0 "[ . 1 . 2]" 1
389 1 10 LEU H 1 63 GLU H . . 4.630 4.060 3.680 4.661 0.031 12 0 "[ . 1 . 2]" 1
390 1 12 LEU H 1 63 GLU H . . 4.020 3.037 2.702 3.505 . 0 0 "[ . 1 . 2]" 1
391 1 63 GLU H 1 63 GLU HB3 . . 3.450 2.801 2.506 3.137 . 0 0 "[ . 1 . 2]" 1
392 1 12 LEU HG 1 63 GLU H . . 3.690 3.513 3.246 3.694 0.004 13 0 "[ . 1 . 2]" 1
393 1 10 LEU HB2 1 63 GLU H . . 5.070 4.257 3.912 4.497 . 0 0 "[ . 1 . 2]" 1
394 1 9 VAL MG1 1 63 GLU H . . 3.850 2.982 2.569 3.236 . 0 0 "[ . 1 . 2]" 1
395 1 63 GLU H 1 64 VAL MG2 . . 4.820 3.770 3.622 3.961 . 0 0 "[ . 1 . 2]" 1
396 1 12 LEU MD1 1 63 GLU H . . 4.700 4.203 3.886 4.584 . 0 0 "[ . 1 . 2]" 1
397 1 28 ILE MG 1 63 GLU H . . 4.620 4.079 3.326 4.559 . 0 0 "[ . 1 . 2]" 1
398 1 17 PHE QD 1 18 ASP H . . 3.820 2.833 2.598 3.110 . 0 0 "[ . 1 . 2]" 1
399 1 17 PHE QB 1 18 ASP H . . 3.120 2.720 2.408 2.999 . 0 0 "[ . 1 . 2]" 1
400 1 18 ASP H 1 18 ASP QB . . 3.150 2.473 2.192 2.845 . 0 0 "[ . 1 . 2]" 1
401 1 18 ASP H 1 21 ILE MD . . 5.090 4.661 4.333 5.064 . 0 0 "[ . 1 . 2]" 1
402 1 68 ALA HA 1 70 ARG H . . 4.820 4.067 3.774 4.701 . 0 0 "[ . 1 . 2]" 1
403 1 70 ARG H 1 70 ARG HG3 . . 3.790 2.593 1.904 3.542 . 0 0 "[ . 1 . 2]" 1
404 1 31 TYR HA 1 32 ALA H . . 3.140 2.584 2.509 2.652 . 0 0 "[ . 1 . 2]" 1
405 1 32 ALA H 1 38 CYS HB2 . . 4.870 3.310 2.869 4.008 . 0 0 "[ . 1 . 2]" 1
406 1 31 TYR HB2 1 32 ALA H . . 3.080 2.274 2.115 2.411 . 0 0 "[ . 1 . 2]" 1
407 1 31 TYR HB3 1 32 ALA H . . 3.820 3.726 3.625 3.825 0.005 3 0 "[ . 1 . 2]" 1
408 1 32 ALA H 1 32 ALA MB . . 3.400 2.529 2.486 2.597 . 0 0 "[ . 1 . 2]" 1
409 1 76 TYR H 1 78 VAL H . . 4.650 3.561 3.298 3.756 . 0 0 "[ . 1 . 2]" 1
410 1 70 ARG H 1 71 ASN H . . 3.520 2.954 2.730 3.187 . 0 0 "[ . 1 . 2]" 1
411 1 69 GLU H 1 70 ARG H . . 4.010 2.938 2.209 3.567 . 0 0 "[ . 1 . 2]" 1
412 1 70 ARG H 1 70 ARG QB . . 2.960 2.553 2.365 2.813 . 0 0 "[ . 1 . 2]" 1
413 1 78 VAL H 1 79 ARG H . . 4.780 4.271 3.970 4.426 . 0 0 "[ . 1 . 2]" 1
414 1 73 CYS HA 1 78 VAL H . . 4.300 4.133 3.871 4.312 0.012 8 0 "[ . 1 . 2]" 1
415 1 74 SER HA 1 78 VAL H . . 4.530 3.483 3.219 3.677 . 0 0 "[ . 1 . 2]" 1
416 1 77 SER HA 1 78 VAL H . . 3.260 2.805 2.684 2.975 . 0 0 "[ . 1 . 2]" 1
417 1 76 TYR HB3 1 78 VAL H . . 5.050 4.142 3.797 4.406 . 0 0 "[ . 1 . 2]" 1
418 1 73 CYS HB3 1 78 VAL H . . 4.450 4.115 3.868 4.309 . 0 0 "[ . 1 . 2]" 1
419 1 78 VAL H 1 78 VAL HB . . 3.030 2.566 2.408 2.684 . 0 0 "[ . 1 . 2]" 1
420 1 78 VAL H 1 78 VAL MG2 . . 3.120 2.148 1.904 2.504 . 0 0 "[ . 1 . 2]" 1
421 1 21 ILE MD 1 91 LYS H . . 4.940 4.342 3.820 4.793 . 0 0 "[ . 1 . 2]" 1
422 1 88 ARG H 1 91 LYS H . . 3.890 3.263 2.736 3.744 . 0 0 "[ . 1 . 2]" 1
423 1 89 GLY H 1 91 LYS H . . 4.850 4.368 4.148 4.731 . 0 0 "[ . 1 . 2]" 1
424 1 87 PHE QD 1 91 LYS H . . 4.850 3.896 3.206 4.471 . 0 0 "[ . 1 . 2]" 1
425 1 89 GLY HA3 1 91 LYS H . . 5.060 4.117 3.681 4.609 . 0 0 "[ . 1 . 2]" 1
426 1 87 PHE HB2 1 91 LYS H . . 5.500 5.089 4.306 5.500 . 0 0 "[ . 1 . 2]" 1
427 1 87 PHE HB3 1 91 LYS H . . 4.940 3.439 2.621 3.891 . 0 0 "[ . 1 . 2]" 1
428 1 91 LYS H 1 91 LYS QG . . 3.670 2.976 2.046 3.666 . 0 0 "[ . 1 . 2]" 1
429 1 88 ARG H 1 90 GLY H . . 4.230 3.780 3.320 4.223 . 0 0 "[ . 1 . 2]" 1
430 1 87 PHE QD 1 88 ARG H . . 4.840 4.326 4.012 4.592 . 0 0 "[ . 1 . 2]" 1
431 1 87 PHE HA 1 88 ARG H . . 3.030 2.151 2.139 2.194 . 0 0 "[ . 1 . 2]" 1
432 1 87 PHE HB2 1 88 ARG H . . 4.340 4.229 4.053 4.344 0.004 9 0 "[ . 1 . 2]" 1
433 1 87 PHE HB3 1 88 ARG H . . 3.860 3.348 3.051 3.551 . 0 0 "[ . 1 . 2]" 1
434 1 88 ARG H 1 88 ARG HB2 . . 3.960 3.108 2.980 3.341 . 0 0 "[ . 1 . 2]" 1
435 1 88 ARG H 1 88 ARG HB3 . . 3.960 2.717 2.586 2.926 . 0 0 "[ . 1 . 2]" 1
436 1 87 PHE H 1 88 ARG H . . 5.180 4.217 4.094 4.344 . 0 0 "[ . 1 . 2]" 1
437 1 89 GLY HA2 1 91 LYS H . . 5.060 4.891 4.539 5.082 0.022 19 0 "[ . 1 . 2]" 1
438 1 87 PHE HA 1 91 LYS H . . 5.070 4.158 3.691 4.751 . 0 0 "[ . 1 . 2]" 1
439 1 111 SER QB 1 112 GLN H . . 3.630 2.652 2.386 3.166 . 0 0 "[ . 1 . 2]" 1
440 1 112 GLN H 1 112 GLN HG2 . . 3.410 2.620 2.095 2.941 . 0 0 "[ . 1 . 2]" 1
441 1 112 GLN H 1 112 GLN HB2 . . 3.870 2.344 2.198 2.556 . 0 0 "[ . 1 . 2]" 1
442 1 56 LEU MD1 1 112 GLN H . . 5.500 5.150 4.554 5.463 . 0 0 "[ . 1 . 2]" 1
443 1 109 VAL MG2 1 112 GLN H . . 5.500 5.074 4.903 5.286 . 0 0 "[ . 1 . 2]" 1
444 1 86 LEU MD2 1 112 GLN H . . 5.130 4.520 4.180 4.738 . 0 0 "[ . 1 . 2]" 1
445 1 19 ASP H 1 20 THR HB . . 5.210 5.028 4.820 5.168 . 0 0 "[ . 1 . 2]" 1
446 1 18 ASP QB 1 19 ASP H . . 3.650 2.978 2.356 3.459 . 0 0 "[ . 1 . 2]" 1
447 1 19 ASP H 1 19 ASP HB2 . . 3.950 2.403 2.189 2.718 . 0 0 "[ . 1 . 2]" 1
448 1 19 ASP H 1 19 ASP HB3 . . 3.950 3.141 2.420 3.591 . 0 0 "[ . 1 . 2]" 1
449 1 30 PHE QD 1 83 THR H . . 5.110 4.664 4.311 4.994 . 0 0 "[ . 1 . 2]" 1
450 1 30 PHE H 1 83 THR H . . 3.930 3.574 3.165 3.898 . 0 0 "[ . 1 . 2]" 1
451 1 81 TYR QD 1 83 THR H . . 4.550 4.058 3.643 4.435 . 0 0 "[ . 1 . 2]" 1
452 1 83 THR H 1 83 THR HG1 . . 4.450 4.021 3.336 4.432 . 0 0 "[ . 1 . 2]" 1
453 1 82 PRO HA 1 83 THR H . . 2.990 2.325 2.252 2.442 . 0 0 "[ . 1 . 2]" 1
454 1 83 THR H 1 83 THR HB . . 3.450 2.810 2.643 2.963 . 0 0 "[ . 1 . 2]" 1
455 1 30 PHE HB2 1 83 THR H . . 4.050 3.831 3.692 3.954 . 0 0 "[ . 1 . 2]" 1
456 1 82 PRO HB3 1 83 THR H . . 4.250 3.564 3.400 3.685 . 0 0 "[ . 1 . 2]" 1
457 1 82 PRO HB2 1 83 THR H . . 3.980 2.818 2.508 3.034 . 0 0 "[ . 1 . 2]" 1
458 1 83 THR H 1 83 THR MG . . 4.580 3.920 3.829 3.979 . 0 0 "[ . 1 . 2]" 1
459 1 78 VAL MG1 1 83 THR H . . 4.550 4.152 3.994 4.367 . 0 0 "[ . 1 . 2]" 1
460 1 83 THR H 1 84 LEU MD2 . . 4.720 3.554 3.066 3.871 . 0 0 "[ . 1 . 2]" 1
461 1 44 THR H 1 45 TRP H . . 3.110 2.856 2.658 3.018 . 0 0 "[ . 1 . 2]" 1
462 1 44 THR H 1 44 THR HB . . 2.930 2.593 2.475 2.685 . 0 0 "[ . 1 . 2]" 1
463 1 43 PRO HB3 1 44 THR H . . 4.480 4.045 3.904 4.198 . 0 0 "[ . 1 . 2]" 1
464 1 43 PRO QG 1 44 THR H . . 3.500 2.174 1.931 2.474 . 0 0 "[ . 1 . 2]" 1
465 1 43 PRO HB2 1 44 THR H . . 3.670 3.170 2.924 3.434 . 0 0 "[ . 1 . 2]" 1
466 1 42 ALA MB 1 44 THR H . . 4.940 4.315 4.154 4.455 . 0 0 "[ . 1 . 2]" 1
467 1 44 THR H 1 44 THR MG . . 4.050 3.766 3.755 3.771 . 0 0 "[ . 1 . 2]" 1
468 1 41 LEU MD1 1 44 THR H . . 4.560 4.183 4.061 4.358 . 0 0 "[ . 1 . 2]" 1
469 1 114 LYS H 1 114 LYS HB3 . . 3.830 3.095 2.331 3.743 . 0 0 "[ . 1 . 2]" 1
470 1 113 ALA MB 1 114 LYS H . . 3.670 2.851 2.168 3.715 0.045 17 0 "[ . 1 . 2]" 1
471 1 52 GLU H 1 52 GLU HB2 . . 3.330 2.766 2.299 3.034 . 0 0 "[ . 1 . 2]" 1
472 1 51 LYS HB2 1 52 GLU H . . 4.170 3.719 3.292 4.103 . 0 0 "[ . 1 . 2]" 1
473 1 51 LYS HB3 1 52 GLU H . . 4.170 2.563 2.121 3.105 . 0 0 "[ . 1 . 2]" 1
474 1 81 TYR H 1 81 TYR QD . . 3.750 2.444 1.891 3.081 . 0 0 "[ . 1 . 2]" 1
475 1 80 GLY HA2 1 81 TYR H . . 3.500 2.204 2.138 2.538 . 0 0 "[ . 1 . 2]" 1
476 1 80 GLY HA3 1 81 TYR H . . 3.500 3.357 2.588 3.497 . 0 0 "[ . 1 . 2]" 1
477 1 102 LEU H 1 104 SER H . . 4.810 4.364 4.101 4.810 0.000 1 0 "[ . 1 . 2]" 1
478 1 104 SER H 1 106 HIS H . . 5.120 4.380 4.142 4.755 . 0 0 "[ . 1 . 2]" 1
479 1 104 SER H 1 107 ARG H . . 5.500 5.089 4.916 5.222 . 0 0 "[ . 1 . 2]" 1
480 1 101 ASP HB3 1 104 SER H . . 4.950 3.514 3.178 3.852 . 0 0 "[ . 1 . 2]" 1
481 1 101 ASP HB2 1 104 SER H . . 3.610 2.460 2.116 2.807 . 0 0 "[ . 1 . 2]" 1
482 1 71 ASN H 1 71 ASN HB2 . . 3.430 2.338 2.166 2.394 . 0 0 "[ . 1 . 2]" 1
483 1 70 ARG QB 1 71 ASN H . . 3.790 2.480 2.179 3.541 . 0 0 "[ . 1 . 2]" 1
484 1 102 LEU HB3 1 103 ASP H . . 3.270 2.372 2.194 2.762 . 0 0 "[ . 1 . 2]" 1
485 1 102 LEU HB2 1 103 ASP H . . 4.050 3.800 3.673 4.046 . 0 0 "[ . 1 . 2]" 1
486 1 44 THR MG 1 101 ASP H . . 5.360 4.750 4.192 5.144 . 0 0 "[ . 1 . 2]" 1
487 1 44 THR MG 1 103 ASP H . . 5.500 4.687 4.415 4.887 . 0 0 "[ . 1 . 2]" 1
488 1 102 LEU H 1 103 ASP H . . 3.600 3.086 2.899 3.283 . 0 0 "[ . 1 . 2]" 1
489 1 101 ASP H 1 104 SER HB3 . . 4.520 3.083 1.980 3.557 . 0 0 "[ . 1 . 2]" 1
490 1 101 ASP H 1 101 ASP HB2 . . 3.100 2.577 2.366 2.770 . 0 0 "[ . 1 . 2]" 1
491 1 102 LEU MD1 1 103 ASP H . . 4.740 4.022 3.820 4.246 . 0 0 "[ . 1 . 2]" 1
492 1 100 ARG H 1 101 ASP H . . 3.290 2.869 2.348 3.287 . 0 0 "[ . 1 . 2]" 1
493 1 101 ASP H 1 104 SER HB2 . . 4.520 2.216 1.900 3.838 . 0 0 "[ . 1 . 2]" 1
494 1 101 ASP H 1 101 ASP HB3 . . 4.040 3.656 3.575 3.840 . 0 0 "[ . 1 . 2]" 1
495 1 101 ASP HB3 1 103 ASP H . . 4.230 3.419 2.926 3.857 . 0 0 "[ . 1 . 2]" 1
496 1 89 GLY H 1 90 GLY H . . 4.020 2.633 2.383 2.939 . 0 0 "[ . 1 . 2]" 1
497 1 88 ARG HA 1 89 GLY H . . 3.090 2.163 2.143 2.273 . 0 0 "[ . 1 . 2]" 1
498 1 88 ARG HG2 1 89 GLY H . . 4.480 3.722 2.496 4.455 . 0 0 "[ . 1 . 2]" 1
499 1 88 ARG HB2 1 89 GLY H . . 5.140 4.353 3.851 4.522 . 0 0 "[ . 1 . 2]" 1
500 1 105 LEU H 1 107 ARG H . . 4.990 4.109 3.901 4.478 . 0 0 "[ . 1 . 2]" 1
501 1 107 ARG H 1 108 PHE H . . 3.450 2.722 2.497 2.890 . 0 0 "[ . 1 . 2]" 1
502 1 103 ASP HA 1 107 ARG H . . 4.550 4.008 3.715 4.313 . 0 0 "[ . 1 . 2]" 1
503 1 104 SER HA 1 107 ARG H . . 4.230 3.946 3.680 4.148 . 0 0 "[ . 1 . 2]" 1
504 1 106 HIS HB3 1 107 ARG H . . 3.260 2.400 2.128 2.631 . 0 0 "[ . 1 . 2]" 1
505 1 106 HIS HB2 1 107 ARG H . . 3.840 3.657 3.476 3.841 0.001 12 0 "[ . 1 . 2]" 1
506 1 107 ARG H 1 107 ARG HB2 . . 3.650 3.585 3.567 3.603 . 0 0 "[ . 1 . 2]" 1
507 1 109 VAL HB 1 110 LEU H . . 3.340 2.605 2.407 2.855 . 0 0 "[ . 1 . 2]" 1
508 1 110 LEU H 1 110 LEU HB2 . . 3.260 2.405 2.330 2.499 . 0 0 "[ . 1 . 2]" 1
509 1 110 LEU H 1 110 LEU HB3 . . 3.770 3.575 3.559 3.596 . 0 0 "[ . 1 . 2]" 1
510 1 16 ASN HA 1 20 THR H . . 4.990 4.033 3.699 4.392 . 0 0 "[ . 1 . 2]" 1
511 1 45 TRP H 1 46 GLU H . . 3.390 2.874 2.652 3.042 . 0 0 "[ . 1 . 2]" 1
512 1 44 THR H 1 46 GLU H . . 4.620 4.278 4.034 4.620 . 8 0 "[ . 1 . 2]" 1
513 1 43 PRO HA 1 46 GLU H . . 3.960 3.658 3.397 3.838 . 0 0 "[ . 1 . 2]" 1
514 1 45 TRP HB3 1 46 GLU H . . 3.510 2.529 2.196 2.755 . 0 0 "[ . 1 . 2]" 1
515 1 45 TRP HB2 1 46 GLU H . . 4.100 3.734 3.547 3.881 . 0 0 "[ . 1 . 2]" 1
516 1 46 GLU H 1 46 GLU HG2 . . 4.040 3.762 2.453 3.985 . 0 0 "[ . 1 . 2]" 1
517 1 46 GLU H 1 46 GLU HB2 . . 3.120 2.335 2.208 2.484 . 0 0 "[ . 1 . 2]" 1
518 1 53 PHE QE 1 110 LEU H . . 5.020 4.187 3.853 4.789 . 0 0 "[ . 1 . 2]" 1
519 1 56 LEU MD1 1 110 LEU H . . 4.520 3.855 3.365 4.126 . 0 0 "[ . 1 . 2]" 1
520 1 110 LEU H 1 110 LEU MD1 . . 4.250 3.405 3.288 3.510 . 0 0 "[ . 1 . 2]" 1
521 1 109 VAL MG1 1 110 LEU H . . 4.270 3.412 3.067 3.674 . 0 0 "[ . 1 . 2]" 1
522 1 19 ASP H 1 20 THR H . . 3.340 2.831 2.692 3.053 . 0 0 "[ . 1 . 2]" 1
523 1 20 THR H 1 22 ALA H . . 4.710 3.893 3.594 4.148 . 0 0 "[ . 1 . 2]" 1
524 1 20 THR H 1 20 THR HG1 . . 2.980 2.091 1.924 2.325 . 0 0 "[ . 1 . 2]" 1
525 1 20 THR H 1 20 THR HB . . 3.100 2.578 2.445 2.806 . 0 0 "[ . 1 . 2]" 1
526 1 16 ASN HB2 1 20 THR H . . 4.770 4.094 3.357 4.639 . 0 0 "[ . 1 . 2]" 1
527 1 19 ASP HB2 1 20 THR H . . 4.050 3.157 2.108 4.043 . 0 0 "[ . 1 . 2]" 1
528 1 19 ASP HB3 1 20 THR H . . 4.050 2.991 2.233 3.618 . 0 0 "[ . 1 . 2]" 1
529 1 20 THR H 1 20 THR MG . . 4.110 3.765 3.749 3.779 . 0 0 "[ . 1 . 2]" 1
530 1 12 LEU MD2 1 20 THR H . . 4.620 4.063 3.756 4.460 . 0 0 "[ . 1 . 2]" 1
531 1 20 THR H 1 21 ILE MG . . 4.900 4.549 4.381 4.735 . 0 0 "[ . 1 . 2]" 1
532 1 38 CYS H 1 40 THR H . . 5.030 4.258 4.073 4.438 . 0 0 "[ . 1 . 2]" 1
533 1 39 LYS H 1 40 THR H . . 3.450 2.758 2.535 2.903 . 0 0 "[ . 1 . 2]" 1
534 1 37 HIS HA 1 40 THR H . . 4.070 3.527 3.299 3.747 . 0 0 "[ . 1 . 2]" 1
535 1 40 THR H 1 40 THR HB . . 3.110 2.523 2.343 2.662 . 0 0 "[ . 1 . 2]" 1
536 1 38 CYS HA 1 40 THR H . . 4.470 3.972 3.671 4.370 . 0 0 "[ . 1 . 2]" 1
537 1 39 LYS QB 1 40 THR H . . 3.280 2.765 2.625 2.966 . 0 0 "[ . 1 . 2]" 1
538 1 39 LYS QD 1 40 THR H . . 5.370 4.573 4.139 5.117 . 0 0 "[ . 1 . 2]" 1
539 1 40 THR H 1 42 ALA MB . . 5.500 4.422 4.172 4.587 . 0 0 "[ . 1 . 2]" 1
540 1 40 THR H 1 40 THR MG . . 3.850 3.394 2.449 3.784 . 0 0 "[ . 1 . 2]" 1
541 1 16 ASN H 1 18 ASP H . . 5.480 4.719 4.033 5.028 . 0 0 "[ . 1 . 2]" 1
542 1 107 ARG H 1 110 LEU H . . 5.500 4.844 4.669 5.072 . 0 0 "[ . 1 . 2]" 1
543 1 14 GLU HA 1 16 ASN H . . 4.810 4.382 4.132 4.559 . 0 0 "[ . 1 . 2]" 1
544 1 16 ASN H 1 16 ASN HB3 . . 3.620 3.288 2.803 3.441 . 0 0 "[ . 1 . 2]" 1
545 1 13 THR H 1 16 ASN H . . 3.770 3.043 2.877 3.348 . 0 0 "[ . 1 . 2]" 1
546 1 16 ASN H 1 17 PHE H . . 2.800 2.528 1.967 2.753 . 0 0 "[ . 1 . 2]" 1
547 1 16 ASN H 1 16 ASN HB2 . . 4.000 3.748 3.614 3.831 . 0 0 "[ . 1 . 2]" 1
548 1 16 ASN H 1 17 PHE QB . . 4.380 3.797 3.712 3.873 . 0 0 "[ . 1 . 2]" 1
549 1 13 THR MG 1 16 ASN H . . 4.630 4.207 4.048 4.633 0.003 18 0 "[ . 1 . 2]" 1
550 1 71 ASN HB2 1 71 ASN HD22 . . 3.970 3.612 3.434 3.947 . 0 0 "[ . 1 . 2]" 1
551 1 74 SER H 1 76 TYR H . . 4.990 4.195 4.123 4.338 . 0 0 "[ . 1 . 2]" 1
552 1 74 SER H 1 74 SER QB . . 3.030 2.268 2.170 2.577 . 0 0 "[ . 1 . 2]" 1
553 1 73 CYS HB2 1 74 SER H . . 3.600 2.493 2.376 2.626 . 0 0 "[ . 1 . 2]" 1
554 1 73 CYS HB3 1 74 SER H . . 4.210 2.926 2.792 3.066 . 0 0 "[ . 1 . 2]" 1
555 1 72 ILE HB 1 74 SER H . . 5.500 5.089 4.917 5.289 . 0 0 "[ . 1 . 2]" 1
556 1 74 SER H 1 75 LYS HB2 . . 5.500 5.304 5.069 5.511 0.011 19 0 "[ . 1 . 2]" 1
557 1 74 SER H 1 75 LYS HB3 . . 5.210 5.015 4.813 5.206 . 0 0 "[ . 1 . 2]" 1
558 1 64 VAL MG1 1 73 CYS H . . 4.520 3.683 3.165 4.140 . 0 0 "[ . 1 . 2]" 1
559 1 71 ASN H 1 73 CYS H . . 4.900 4.680 4.141 4.911 0.011 20 0 "[ . 1 . 2]" 1
560 1 73 CYS H 1 74 SER H . . 3.260 3.025 2.896 3.152 . 0 0 "[ . 1 . 2]" 1
561 1 70 ARG HA 1 73 CYS H . . 3.900 3.421 2.981 3.871 . 0 0 "[ . 1 . 2]" 1
562 1 73 CYS H 1 73 CYS HB2 . . 3.190 2.275 2.216 2.339 . 0 0 "[ . 1 . 2]" 1
563 1 73 CYS H 1 73 CYS HB3 . . 3.820 3.544 3.513 3.578 . 0 0 "[ . 1 . 2]" 1
564 1 69 GLU HB3 1 73 CYS H . . 4.980 4.094 3.764 4.569 . 0 0 "[ . 1 . 2]" 1
565 1 72 ILE HB 1 73 CYS H . . 3.240 2.237 2.012 2.518 . 0 0 "[ . 1 . 2]" 1
566 1 72 ILE HG13 1 73 CYS H . . 4.420 4.107 3.930 4.247 . 0 0 "[ . 1 . 2]" 1
567 1 72 ILE MG 1 73 CYS H . . 3.950 3.144 2.852 3.465 . 0 0 "[ . 1 . 2]" 1
568 1 13 THR HG1 1 15 ASN H . . 4.370 2.621 1.895 3.552 . 0 0 "[ . 1 . 2]" 1
569 1 15 ASN H 1 15 ASN HB3 . . 3.910 2.889 2.402 3.506 . 0 0 "[ . 1 . 2]" 1
570 1 14 GLU HB3 1 15 ASN H . . 4.720 3.675 3.314 4.154 . 0 0 "[ . 1 . 2]" 1
571 1 76 TYR H 1 77 SER H . . 3.220 2.765 2.669 2.817 . 0 0 "[ . 1 . 2]" 1
572 1 73 CYS HA 1 76 TYR H . . 3.990 3.457 3.322 3.592 . 0 0 "[ . 1 . 2]" 1
573 1 76 TYR H 1 76 TYR HB3 . . 3.800 3.623 3.586 3.647 . 0 0 "[ . 1 . 2]" 1
574 1 76 TYR H 1 76 TYR HB2 . . 3.220 2.394 2.326 2.433 . 0 0 "[ . 1 . 2]" 1
575 1 75 LYS HB2 1 76 TYR H . . 4.110 4.013 3.854 4.111 0.001 9 0 "[ . 1 . 2]" 1
576 1 75 LYS HB3 1 76 TYR H . . 3.530 2.803 2.613 2.910 . 0 0 "[ . 1 . 2]" 1
577 1 72 ILE MG 1 76 TYR H . . 4.440 4.238 4.026 4.436 . 0 0 "[ . 1 . 2]" 1
578 1 75 LYS HG2 1 76 TYR H . . 5.020 3.976 3.689 4.427 . 0 0 "[ . 1 . 2]" 1
579 1 29 LYS HA 1 30 PHE H . . 2.940 2.159 2.142 2.174 . 0 0 "[ . 1 . 2]" 1
580 1 30 PHE H 1 30 PHE HB2 . . 3.390 2.648 2.553 2.785 . 0 0 "[ . 1 . 2]" 1
581 1 30 PHE H 1 30 PHE HB3 . . 3.970 3.678 3.631 3.766 . 0 0 "[ . 1 . 2]" 1
582 1 29 LYS HB2 1 30 PHE H . . 5.220 4.311 3.829 4.492 . 0 0 "[ . 1 . 2]" 1
583 1 30 PHE H 1 85 LEU MD1 . . 5.500 5.041 4.636 5.427 . 0 0 "[ . 1 . 2]" 1
584 1 29 LYS QG 1 30 PHE H . . 4.190 3.017 2.535 3.325 . 0 0 "[ . 1 . 2]" 1
585 1 29 LYS HB3 1 30 PHE H . . 5.220 4.332 4.220 4.391 . 0 0 "[ . 1 . 2]" 1
586 1 27 PHE H 1 28 ILE H . . 4.940 4.330 4.265 4.347 . 0 0 "[ . 1 . 2]" 1
587 1 27 PHE H 1 62 ALA H . . 4.510 3.989 3.683 4.232 . 0 0 "[ . 1 . 2]" 1
588 1 27 PHE H 1 27 PHE HB3 . . 3.590 2.799 2.701 2.845 . 0 0 "[ . 1 . 2]" 1
589 1 27 PHE H 1 27 PHE HB2 . . 3.680 2.479 2.435 2.585 . 0 0 "[ . 1 . 2]" 1
590 1 27 PHE H 1 60 LYS HB2 . . 4.600 4.011 3.717 4.153 . 0 0 "[ . 1 . 2]" 1
591 1 27 PHE H 1 61 ILE MD . . 3.960 2.857 2.623 3.277 . 0 0 "[ . 1 . 2]" 1
592 1 110 LEU HB2 1 111 SER H . . 3.660 2.738 2.294 3.288 . 0 0 "[ . 1 . 2]" 1
593 1 110 LEU HB3 1 111 SER H . . 4.130 3.607 3.123 4.080 . 0 0 "[ . 1 . 2]" 1
594 1 111 SER H 1 112 GLN HG2 . . 4.950 4.521 4.030 4.944 . 0 0 "[ . 1 . 2]" 1
595 1 110 LEU MD1 1 111 SER H . . 5.120 4.492 4.131 4.948 . 0 0 "[ . 1 . 2]" 1
596 1 10 LEU H 1 10 LEU HB3 . . 3.650 3.515 3.473 3.609 . 0 0 "[ . 1 . 2]" 1
597 1 10 LEU H 1 10 LEU HB2 . . 3.920 2.248 2.175 2.544 . 0 0 "[ . 1 . 2]" 1
598 1 9 VAL MG1 1 10 LEU H . . 3.540 2.403 2.176 3.012 . 0 0 "[ . 1 . 2]" 1
599 1 10 LEU H 1 61 ILE H . . 5.120 4.581 4.220 4.809 . 0 0 "[ . 1 . 2]" 1
600 1 10 LEU H 1 62 ALA H . . 5.370 4.347 4.229 4.546 . 0 0 "[ . 1 . 2]" 1
601 1 21 ILE HA 1 23 GLU H . . 4.320 3.983 3.624 4.264 . 0 0 "[ . 1 . 2]" 1
602 1 20 THR HA 1 23 GLU H . . 4.770 3.760 3.538 4.144 . 0 0 "[ . 1 . 2]" 1
603 1 23 GLU H 1 23 GLU HB2 . . 3.720 2.649 2.272 3.743 0.023 7 0 "[ . 1 . 2]" 1
604 1 23 GLU H 1 23 GLU HB3 . . 3.720 3.583 3.201 3.751 0.031 11 0 "[ . 1 . 2]" 1
605 1 20 THR MG 1 23 GLU H . . 5.350 4.439 4.202 4.724 . 0 0 "[ . 1 . 2]" 1
606 1 34 TRP HE1 1 81 TYR QE . . 4.970 4.506 3.563 4.970 0.000 5 0 "[ . 1 . 2]" 1
607 1 84 LEU H 1 85 LEU H . . 4.950 4.381 4.254 4.474 . 0 0 "[ . 1 . 2]" 1
608 1 84 LEU H 1 96 HIS H . . 5.060 4.376 3.720 4.847 . 0 0 "[ . 1 . 2]" 1
609 1 83 THR HA 1 84 LEU H . . 2.920 2.189 2.147 2.223 . 0 0 "[ . 1 . 2]" 1
610 1 84 LEU H 1 84 LEU HB2 . . 3.470 2.889 2.731 3.003 . 0 0 "[ . 1 . 2]" 1
611 1 84 LEU H 1 95 GLU HG3 . . 5.330 3.827 3.280 4.842 . 0 0 "[ . 1 . 2]" 1
612 1 84 LEU H 1 84 LEU HG . . 3.560 2.591 2.388 2.790 . 0 0 "[ . 1 . 2]" 1
613 1 84 LEU H 1 84 LEU HB3 . . 4.190 3.838 3.761 3.878 . 0 0 "[ . 1 . 2]" 1
614 1 84 LEU H 1 84 LEU MD1 . . 4.370 3.888 3.674 4.157 . 0 0 "[ . 1 . 2]" 1
615 1 34 TRP HE1 1 67 THR HA . . 5.340 4.430 3.918 4.902 . 0 0 "[ . 1 . 2]" 1
616 1 34 TRP HE1 1 67 THR HB . . 5.500 5.026 4.305 5.498 . 0 0 "[ . 1 . 2]" 1
617 1 33 PRO HD2 1 34 TRP HE1 . . 5.290 3.584 3.080 4.036 . 0 0 "[ . 1 . 2]" 1
618 1 34 TRP HE1 1 66 CYS HB3 . . 5.500 4.524 3.805 5.027 . 0 0 "[ . 1 . 2]" 1
619 1 34 TRP HE1 1 67 THR MG . . 3.500 2.326 1.807 2.725 . 0 0 "[ . 1 . 2]" 1
620 1 32 ALA MB 1 34 TRP HE1 . . 3.770 2.447 2.225 2.651 . 0 0 "[ . 1 . 2]" 1
621 1 33 PRO HD3 1 67 THR H . . 4.610 4.065 3.303 4.578 . 0 0 "[ . 1 . 2]" 1
622 1 66 CYS HB3 1 67 THR H . . 4.990 4.187 3.526 4.399 . 0 0 "[ . 1 . 2]" 1
623 1 65 ASP HA 1 67 THR H . . 4.470 3.825 3.599 4.128 . 0 0 "[ . 1 . 2]" 1
624 1 66 CYS HB2 1 67 THR H . . 5.090 3.764 2.742 4.189 . 0 0 "[ . 1 . 2]" 1
625 1 74 SER HA 1 77 SER H . . 3.910 3.816 3.652 3.911 0.001 15 0 "[ . 1 . 2]" 1
626 1 77 SER H 1 77 SER HA . . 2.720 2.308 2.290 2.318 . 0 0 "[ . 1 . 2]" 1
627 1 76 TYR HB3 1 77 SER H . . 4.990 4.398 4.358 4.422 . 0 0 "[ . 1 . 2]" 1
628 1 76 TYR HB2 1 77 SER H . . 4.760 4.041 3.990 4.089 . 0 0 "[ . 1 . 2]" 1
629 1 77 SER H 1 78 VAL MG2 . . 4.550 3.953 3.692 4.177 . 0 0 "[ . 1 . 2]" 1
630 1 8 THR H 1 8 THR HB . . 3.980 3.708 3.597 3.794 . 0 0 "[ . 1 . 2]" 1
631 1 8 THR H 1 49 SER HB3 . . 5.500 5.372 5.138 5.512 0.012 19 0 "[ . 1 . 2]" 1
632 1 8 THR H 1 49 SER HG . . 4.600 4.442 4.207 4.592 . 0 0 "[ . 1 . 2]" 1
633 1 7 GLY QA 1 8 THR H . . 3.030 2.856 2.732 2.916 . 0 0 "[ . 1 . 2]" 1
634 1 8 THR H 1 49 SER HB2 . . 4.940 4.616 4.372 4.797 . 0 0 "[ . 1 . 2]" 1
635 1 8 THR H 1 8 THR MG . . 3.620 3.088 2.660 3.484 . 0 0 "[ . 1 . 2]" 1
636 1 8 THR H 1 9 VAL MG2 . . 4.980 4.646 4.460 4.921 . 0 0 "[ . 1 . 2]" 1
637 1 112 GLN H 1 113 ALA H . . 3.240 2.873 2.404 3.160 . 0 0 "[ . 1 . 2]" 1
638 1 111 SER H 1 112 GLN H . . 3.450 2.429 2.036 2.685 . 0 0 "[ . 1 . 2]" 1
639 1 35 CYS HB3 1 38 CYS H . . 5.160 2.995 2.593 3.386 . 0 0 "[ . 1 . 2]" 1
640 1 32 ALA MB 1 66 CYS H . . 5.330 3.804 3.458 4.040 . 0 0 "[ . 1 . 2]" 1
641 1 31 TYR H 1 66 CYS H . . 4.170 4.067 3.797 4.178 0.008 18 0 "[ . 1 . 2]" 1
642 1 72 ILE H 1 73 CYS H . . 3.210 2.751 2.503 3.123 . 0 0 "[ . 1 . 2]" 1
643 1 37 HIS H 1 38 CYS H . . 3.650 2.838 2.600 3.082 . 0 0 "[ . 1 . 2]" 1
644 1 95 GLU HG3 1 96 HIS H . . 3.890 3.275 2.512 3.836 . 0 0 "[ . 1 . 2]" 1
645 1 95 GLU HB2 1 96 HIS H . . 5.070 4.236 3.852 4.499 . 0 0 "[ . 1 . 2]" 1
646 1 95 GLU HB3 1 96 HIS H . . 5.070 4.158 3.771 4.366 . 0 0 "[ . 1 . 2]" 1
647 1 30 PHE H 1 31 TYR H . . 5.080 4.205 3.984 4.396 . 0 0 "[ . 1 . 2]" 1
648 1 78 VAL MG1 1 81 TYR H . . 5.330 4.640 4.300 5.126 . 0 0 "[ . 1 . 2]" 1
649 1 21 ILE H 1 22 ALA H . . 3.350 2.746 2.534 2.911 . 0 0 "[ . 1 . 2]" 1
650 1 31 TYR QD 1 32 ALA H . . 3.840 2.238 1.929 2.495 . 0 0 "[ . 1 . 2]" 1
651 1 41 LEU H 1 42 ALA H . . 3.160 2.284 2.037 2.450 . 0 0 "[ . 1 . 2]" 1
652 1 45 TRP HE1 1 62 ALA H . . 4.260 3.952 3.551 4.254 . 0 0 "[ . 1 . 2]" 1
653 1 68 ALA H 1 70 ARG QD . . 5.500 5.002 3.845 5.516 0.016 10 0 "[ . 1 . 2]" 1
654 1 18 ASP H 1 20 THR H . . 4.780 4.083 3.655 4.617 . 0 0 "[ . 1 . 2]" 1
655 1 17 PHE H 1 18 ASP H . . 3.670 2.364 2.176 3.008 . 0 0 "[ . 1 . 2]" 1
656 1 27 PHE H 1 60 LYS HB3 . . 5.180 4.770 4.431 4.993 . 0 0 "[ . 1 . 2]" 1
657 1 30 PHE H 1 78 VAL MG1 . . 5.500 4.419 4.035 4.871 . 0 0 "[ . 1 . 2]" 1
658 1 28 ILE H 1 86 LEU HA . . 4.250 3.613 3.269 3.844 . 0 0 "[ . 1 . 2]" 1
659 1 8 THR H 1 9 VAL H . . 3.470 2.230 2.025 2.596 . 0 0 "[ . 1 . 2]" 1
660 1 12 LEU MD1 1 20 THR H . . 5.260 4.534 3.980 4.922 . 0 0 "[ . 1 . 2]" 1
661 1 26 THR H 1 87 PHE HB2 . . 4.120 3.397 3.022 3.591 . 0 0 "[ . 1 . 2]" 1
662 1 63 GLU HG2 1 64 VAL H . . 4.520 3.379 2.203 4.500 . 0 0 "[ . 1 . 2]" 1
663 1 77 SER H 1 78 VAL H . . 3.510 2.984 2.829 3.078 . 0 0 "[ . 1 . 2]" 1
664 1 108 PHE QD 1 109 VAL H . . 4.130 2.614 2.186 3.036 . 0 0 "[ . 1 . 2]" 1
665 1 109 VAL H 1 110 LEU H . . 3.330 2.733 2.564 2.920 . 0 0 "[ . 1 . 2]" 1
666 1 14 GLU H 1 15 ASN H . . 3.840 2.751 2.679 3.086 . 0 0 "[ . 1 . 2]" 1
667 1 46 GLU H 1 47 GLU H . . 3.370 2.832 2.605 3.050 . 0 0 "[ . 1 . 2]" 1
668 1 42 ALA MB 1 46 GLU H . . 5.500 5.395 5.245 5.503 0.003 10 0 "[ . 1 . 2]" 1
669 1 67 THR HA 1 69 GLU H . . 5.190 4.805 4.272 5.002 . 0 0 "[ . 1 . 2]" 1
670 1 50 LYS H 1 50 LYS HB2 . . 3.370 2.447 2.386 2.509 . 0 0 "[ . 1 . 2]" 1
671 1 51 LYS H 1 51 LYS HB2 . . 3.750 2.581 2.423 2.671 . 0 0 "[ . 1 . 2]" 1
672 1 48 LEU HA 1 51 LYS H . . 4.270 3.267 2.948 4.069 . 0 0 "[ . 1 . 2]" 1
673 1 75 LYS H 1 76 TYR HB2 . . 5.170 4.907 4.710 5.047 . 0 0 "[ . 1 . 2]" 1
674 1 92 LYS H 1 92 LYS HG2 . . 5.250 2.635 2.231 3.912 . 0 0 "[ . 1 . 2]" 1
675 1 92 LYS H 1 92 LYS HG3 . . 5.250 3.873 3.545 4.441 . 0 0 "[ . 1 . 2]" 1
676 1 48 LEU H 1 61 ILE MG . . 5.330 4.703 4.578 4.819 . 0 0 "[ . 1 . 2]" 1
677 1 117 LEU H 1 117 LEU MD1 . . 5.500 3.167 1.821 4.585 . 0 0 "[ . 1 . 2]" 1
678 1 116 GLU HB3 1 117 LEU H . . 5.190 3.895 2.212 4.618 . 0 0 "[ . 1 . 2]" 1
679 1 7 GLY H 1 8 THR H . . 3.770 2.521 1.853 3.035 . 0 0 "[ . 1 . 2]" 1
680 1 72 ILE MG 1 74 SER H . . 5.500 5.093 4.908 5.273 . 0 0 "[ . 1 . 2]" 1
681 1 74 SER H 1 78 VAL MG2 . . 5.500 4.786 4.495 5.101 . 0 0 "[ . 1 . 2]" 1
682 1 74 SER H 1 75 LYS H . . 3.250 2.879 2.758 3.073 . 0 0 "[ . 1 . 2]" 1
683 1 94 SER H 1 108 PHE QE . . 5.500 4.847 4.503 5.106 . 0 0 "[ . 1 . 2]" 1
684 1 94 SER H 1 108 PHE HZ . . 5.500 4.197 3.602 4.603 . 0 0 "[ . 1 . 2]" 1
685 1 103 ASP H 1 104 SER H . . 3.230 2.732 2.612 2.922 . 0 0 "[ . 1 . 2]" 1
686 1 109 VAL MG1 1 111 SER H . . 5.270 4.833 4.588 5.263 . 0 0 "[ . 1 . 2]" 1
687 1 110 LEU H 1 111 SER H . . 3.430 2.733 2.473 2.960 . 0 0 "[ . 1 . 2]" 1
688 1 63 GLU HG3 1 64 VAL H . . 4.520 3.064 2.049 4.059 . 0 0 "[ . 1 . 2]" 1
689 1 25 ILE MG 1 27 PHE H . . 4.760 3.794 3.547 4.049 . 0 0 "[ . 1 . 2]" 1
690 1 25 ILE MG 1 87 PHE QD . . 5.500 5.253 5.009 5.498 . 0 0 "[ . 1 . 2]" 1
691 1 25 ILE MG 1 26 THR HA . . 4.450 3.516 3.353 3.744 . 0 0 "[ . 1 . 2]" 1
692 1 25 ILE MG 1 88 ARG HA . . 4.850 3.695 3.386 4.039 . 0 0 "[ . 1 . 2]" 1
693 1 25 ILE MG 1 27 PHE HB2 . . 4.330 3.772 3.505 4.008 . 0 0 "[ . 1 . 2]" 1
694 1 25 ILE MG 1 86 LEU HB3 . . 5.080 4.969 4.688 5.070 . 0 0 "[ . 1 . 2]" 1
695 1 25 ILE MG 1 86 LEU HG . . 3.560 2.947 2.621 3.128 . 0 0 "[ . 1 . 2]" 1
696 1 25 ILE MG 1 59 VAL MG1 . . 3.490 2.455 2.067 2.892 . 0 0 "[ . 1 . 2]" 1
697 1 30 PHE QE 1 72 ILE MG . . 3.100 1.934 1.806 2.162 . 0 0 "[ . 1 . 2]" 1
698 1 17 PHE QE 1 72 ILE MG . . 3.560 2.447 2.159 2.711 . 0 0 "[ . 1 . 2]" 1
699 1 17 PHE HZ 1 72 ILE MG . . 4.360 2.841 2.667 3.388 . 0 0 "[ . 1 . 2]" 1
700 1 72 ILE MG 1 73 CYS HA . . 4.110 3.347 3.067 3.584 . 0 0 "[ . 1 . 2]" 1
701 1 69 GLU HB3 1 72 ILE MG . . 4.850 4.172 3.700 4.599 . 0 0 "[ . 1 . 2]" 1
702 1 72 ILE MG 1 76 TYR HB2 . . 5.090 4.120 3.921 4.419 . 0 0 "[ . 1 . 2]" 1
703 1 72 ILE MG 1 75 LYS HB3 . . 4.240 3.629 3.256 4.022 . 0 0 "[ . 1 . 2]" 1
704 1 72 ILE MD 1 72 ILE MG . . 2.940 2.108 1.930 2.327 . 0 0 "[ . 1 . 2]" 1
705 1 28 ILE H 1 28 ILE MG . . 4.470 3.819 3.775 3.842 . 0 0 "[ . 1 . 2]" 1
706 1 28 ILE MG 1 30 PHE H . . 4.940 3.820 3.362 4.360 . 0 0 "[ . 1 . 2]" 1
707 1 28 ILE MG 1 45 TRP HE1 . . 5.500 4.977 4.719 5.288 . 0 0 "[ . 1 . 2]" 1
708 1 28 ILE MG 1 29 LYS H . . 3.530 1.976 1.854 2.117 . 0 0 "[ . 1 . 2]" 1
709 1 28 ILE MG 1 30 PHE QE . . 3.780 3.040 2.701 3.291 . 0 0 "[ . 1 . 2]" 1
710 1 17 PHE QE 1 28 ILE MG . . 3.800 2.464 2.163 2.752 . 0 0 "[ . 1 . 2]" 1
711 1 28 ILE MG 1 30 PHE HZ . . 4.120 3.114 2.722 3.461 . 0 0 "[ . 1 . 2]" 1
712 1 28 ILE MG 1 63 GLU HA . . 3.430 3.042 2.228 3.432 0.002 17 0 "[ . 1 . 2]" 1
713 1 28 ILE HA 1 28 ILE MG . . 3.310 2.331 2.184 2.412 . 0 0 "[ . 1 . 2]" 1
714 1 28 ILE MG 1 85 LEU HB2 . . 5.020 4.696 4.227 5.027 0.007 18 0 "[ . 1 . 2]" 1
715 1 28 ILE MG 1 64 VAL HB . . 3.870 2.791 2.479 3.168 . 0 0 "[ . 1 . 2]" 1
716 1 28 ILE MG 1 64 VAL MG2 . . 2.950 1.972 1.768 2.276 . 0 0 "[ . 1 . 2]" 1
717 1 28 ILE HG12 1 28 ILE MG . . 3.350 2.288 2.138 2.360 . 0 0 "[ . 1 . 2]" 1
718 1 31 TYR QD 1 32 ALA HA . . 4.770 3.493 3.318 3.900 . 0 0 "[ . 1 . 2]" 1
719 1 88 ARG HG3 1 89 GLY HA2 . . 5.500 4.705 3.684 5.173 . 0 0 "[ . 1 . 2]" 1
720 1 88 ARG HG3 1 89 GLY HA3 . . 5.500 4.581 2.909 5.195 . 0 0 "[ . 1 . 2]" 1
721 1 25 ILE MG 1 88 ARG HD2 . . 5.500 4.038 3.245 4.912 . 0 0 "[ . 1 . 2]" 1
722 1 25 ILE MG 1 88 ARG HD3 . . 5.500 4.752 3.691 5.437 . 0 0 "[ . 1 . 2]" 1
723 1 25 ILE MG 1 113 ALA MB . . 3.890 3.573 3.296 3.874 . 0 0 "[ . 1 . 2]" 1
724 1 17 PHE QB 1 72 ILE MG . . 4.670 4.027 3.864 4.302 . 0 0 "[ . 1 . 2]" 1
725 1 32 ALA HA 1 66 CYS H . . 4.290 2.995 2.715 3.224 . 0 0 "[ . 1 . 2]" 1
726 1 32 ALA HA 1 33 PRO HD3 . . 2.980 2.262 2.253 2.297 . 0 0 "[ . 1 . 2]" 1
727 1 32 ALA HA 1 33 PRO HG3 . . 4.650 4.336 4.318 4.349 . 0 0 "[ . 1 . 2]" 1
728 1 32 ALA HA 1 66 CYS HB2 . . 5.030 3.383 3.044 3.648 . 0 0 "[ . 1 . 2]" 1
729 1 36 GLY HA3 1 39 LYS H . . 5.120 4.634 4.449 4.812 . 0 0 "[ . 1 . 2]" 1
730 1 36 GLY HA3 1 39 LYS QB . . 4.640 4.497 4.224 4.601 . 0 0 "[ . 1 . 2]" 1
731 1 61 ILE MG 1 62 ALA H . . 3.580 2.887 2.692 3.109 . 0 0 "[ . 1 . 2]" 1
732 1 45 TRP HE1 1 61 ILE MG . . 3.440 2.724 2.361 3.086 . 0 0 "[ . 1 . 2]" 1
733 1 49 SER H 1 61 ILE MG . . 3.910 3.071 2.664 3.457 . 0 0 "[ . 1 . 2]" 1
734 1 45 TRP HE3 1 61 ILE MG . . 4.970 4.353 4.103 4.605 . 0 0 "[ . 1 . 2]" 1
735 1 49 SER HG 1 61 ILE MG . . 5.010 4.373 4.064 4.722 . 0 0 "[ . 1 . 2]" 1
736 1 28 ILE HA 1 61 ILE MG . . 5.080 4.531 4.260 4.737 . 0 0 "[ . 1 . 2]" 1
737 1 9 VAL HA 1 61 ILE MG . . 4.150 3.222 2.868 3.618 . 0 0 "[ . 1 . 2]" 1
738 1 49 SER HA 1 61 ILE MG . . 3.700 3.255 2.979 3.611 . 0 0 "[ . 1 . 2]" 1
739 1 46 GLU HA 1 61 ILE MG . . 4.630 4.111 3.764 4.354 . 0 0 "[ . 1 . 2]" 1
740 1 27 PHE HB3 1 61 ILE MG . . 3.990 3.389 2.863 3.754 . 0 0 "[ . 1 . 2]" 1
741 1 61 ILE MG 1 63 GLU HB3 . . 5.500 4.961 4.349 5.493 . 0 0 "[ . 1 . 2]" 1
742 1 48 LEU HB3 1 61 ILE MG . . 3.950 2.735 2.371 2.936 . 0 0 "[ . 1 . 2]" 1
743 1 61 ILE HG12 1 61 ILE MG . . 3.670 3.187 3.167 3.202 . 0 0 "[ . 1 . 2]" 1
744 1 48 LEU HG 1 61 ILE MG . . 4.020 3.620 3.206 3.943 . 0 0 "[ . 1 . 2]" 1
745 1 48 LEU HB2 1 61 ILE MG . . 4.690 4.194 3.906 4.401 . 0 0 "[ . 1 . 2]" 1
746 1 9 VAL MG2 1 61 ILE MG . . 3.280 2.967 2.626 3.281 0.001 12 0 "[ . 1 . 2]" 1
747 1 61 ILE HG13 1 61 ILE MG . . 3.080 2.285 2.148 2.399 . 0 0 "[ . 1 . 2]" 1
748 1 21 ILE H 1 21 ILE MG . . 3.340 2.145 1.879 2.430 . 0 0 "[ . 1 . 2]" 1
749 1 21 ILE MG 1 87 PHE QE . . 4.810 4.107 3.696 4.450 . 0 0 "[ . 1 . 2]" 1
750 1 17 PHE QE 1 21 ILE MG . . 4.110 3.723 3.473 4.057 . 0 0 "[ . 1 . 2]" 1
751 1 21 ILE MG 1 87 PHE QD . . 4.260 3.190 2.850 3.534 . 0 0 "[ . 1 . 2]" 1
752 1 17 PHE HZ 1 21 ILE MG . . 4.380 4.089 3.739 4.380 . 0 0 "[ . 1 . 2]" 1
753 1 21 ILE MG 1 26 THR HG1 . . 4.220 3.656 3.177 4.000 . 0 0 "[ . 1 . 2]" 1
754 1 18 ASP HA 1 21 ILE MG . . 4.530 3.675 3.438 4.001 . 0 0 "[ . 1 . 2]" 1
755 1 21 ILE MG 1 26 THR HB . . 3.440 2.109 1.914 2.471 . 0 0 "[ . 1 . 2]" 1
756 1 21 ILE MG 1 87 PHE HB2 . . 4.060 2.713 2.080 3.235 . 0 0 "[ . 1 . 2]" 1
757 1 21 ILE MG 1 87 PHE HB3 . . 4.350 3.482 3.108 3.943 . 0 0 "[ . 1 . 2]" 1
758 1 21 ILE MG 1 28 ILE HG13 . . 4.850 3.041 2.858 3.305 . 0 0 "[ . 1 . 2]" 1
759 1 21 ILE QG 1 21 ILE MG . . 3.180 2.280 2.162 2.385 . 0 0 "[ . 1 . 2]" 1
760 1 12 LEU MD2 1 21 ILE MG . . 4.760 4.220 3.640 4.592 . 0 0 "[ . 1 . 2]" 1
761 1 21 ILE MD 1 21 ILE MG . . 3.080 2.044 1.900 2.281 . 0 0 "[ . 1 . 2]" 1
762 1 21 ILE MG 1 28 ILE MD . . 3.100 1.872 1.736 2.070 . 0 0 "[ . 1 . 2]" 1
763 1 57 ALA HA 1 58 GLY QA . . 4.360 3.920 3.911 3.936 . 0 0 "[ . 1 . 2]" 1
764 1 85 LEU HB2 1 87 PHE QD . . 4.870 4.394 4.172 4.695 . 0 0 "[ . 1 . 2]" 1
765 1 85 LEU HB3 1 86 LEU H . . 4.270 3.138 2.704 3.504 . 0 0 "[ . 1 . 2]" 1
766 1 85 LEU HB3 1 87 PHE QE . . 4.070 2.964 2.355 3.317 . 0 0 "[ . 1 . 2]" 1
767 1 85 LEU HB3 1 87 PHE QD . . 5.030 4.304 4.017 4.589 . 0 0 "[ . 1 . 2]" 1
768 1 85 LEU HB3 1 85 LEU MD2 . . 3.650 2.252 2.130 2.348 . 0 0 "[ . 1 . 2]" 1
769 1 21 ILE MD 1 90 GLY H . . 5.100 4.563 4.040 5.064 . 0 0 "[ . 1 . 2]" 1
770 1 21 ILE H 1 21 ILE MD . . 4.440 3.709 3.582 3.850 . 0 0 "[ . 1 . 2]" 1
771 1 17 PHE QE 1 21 ILE MD . . 2.940 2.642 2.338 2.920 . 0 0 "[ . 1 . 2]" 1
772 1 21 ILE MD 1 22 ALA HA . . 4.560 4.468 4.201 4.560 . 0 0 "[ . 1 . 2]" 1
773 1 21 ILE MD 1 87 PHE HB2 . . 4.540 3.703 2.964 4.181 . 0 0 "[ . 1 . 2]" 1
774 1 18 ASP QB 1 21 ILE MD . . 4.500 3.364 2.885 3.970 . 0 0 "[ . 1 . 2]" 1
775 1 21 ILE HB 1 21 ILE MD . . 3.230 2.362 2.220 2.476 . 0 0 "[ . 1 . 2]" 1
776 1 42 ALA MB 1 45 TRP HB2 . . 5.500 5.424 5.102 5.514 0.014 20 0 "[ . 1 . 2]" 1
777 1 42 ALA MB 1 43 PRO HB3 . . 4.650 3.999 3.966 4.088 . 0 0 "[ . 1 . 2]" 1
778 1 42 ALA MB 1 43 PRO QG . . 3.920 3.581 3.558 3.653 . 0 0 "[ . 1 . 2]" 1
779 1 39 LYS QB 1 42 ALA MB . . 4.590 3.824 3.463 4.066 . 0 0 "[ . 1 . 2]" 1
780 1 39 LYS H 1 42 ALA MB . . 4.740 4.576 4.309 4.735 . 0 0 "[ . 1 . 2]" 1
781 1 41 LEU H 1 42 ALA MB . . 4.310 3.893 3.683 4.017 . 0 0 "[ . 1 . 2]" 1
782 1 42 ALA MB 1 43 PRO HA . . 4.230 3.726 3.710 3.772 . 0 0 "[ . 1 . 2]" 1
783 1 39 LYS HA 1 42 ALA MB . . 3.100 2.427 2.286 2.660 . 0 0 "[ . 1 . 2]" 1
784 1 42 ALA MB 1 43 PRO HD3 . . 2.840 1.922 1.903 1.960 . 0 0 "[ . 1 . 2]" 1
785 1 28 ILE MD 1 30 PHE QE . . 3.970 3.702 3.390 3.939 . 0 0 "[ . 1 . 2]" 1
786 1 28 ILE MD 1 87 PHE QE . . 3.600 2.843 2.380 3.196 . 0 0 "[ . 1 . 2]" 1
787 1 17 PHE QE 1 28 ILE MD . . 3.040 2.320 1.957 2.617 . 0 0 "[ . 1 . 2]" 1
788 1 17 PHE HZ 1 28 ILE MD . . 3.740 2.670 2.300 3.227 . 0 0 "[ . 1 . 2]" 1
789 1 17 PHE HA 1 28 ILE MD . . 4.540 4.392 3.910 4.533 . 0 0 "[ . 1 . 2]" 1
790 1 28 ILE HB 1 28 ILE MD . . 3.360 2.314 2.154 2.433 . 0 0 "[ . 1 . 2]" 1
791 1 21 ILE HB 1 28 ILE MD . . 4.380 3.993 3.736 4.169 . 0 0 "[ . 1 . 2]" 1
792 1 28 ILE MD 1 62 ALA MB . . 4.110 3.791 3.289 4.117 0.007 12 0 "[ . 1 . 2]" 1
793 1 28 ILE MD 1 64 VAL MG2 . . 3.680 3.318 2.964 3.643 . 0 0 "[ . 1 . 2]" 1
794 1 12 LEU MD1 1 28 ILE MD . . 3.040 2.359 1.993 2.942 . 0 0 "[ . 1 . 2]" 1
795 1 28 ILE MD 1 28 ILE MG . . 2.940 2.117 1.944 2.332 . 0 0 "[ . 1 . 2]" 1
796 1 7 GLY QA 1 8 THR HA . . 4.140 4.011 3.991 4.027 . 0 0 "[ . 1 . 2]" 1
797 1 7 GLY QA 1 50 LYS HG2 . . 5.210 4.876 4.357 5.205 . 0 0 "[ . 1 . 2]" 1
798 1 28 ILE H 1 28 ILE MD . . 4.420 3.610 3.363 3.777 . 0 0 "[ . 1 . 2]" 1
799 1 17 PHE QB 1 28 ILE MD . . 5.250 4.592 4.361 4.766 . 0 0 "[ . 1 . 2]" 1
800 1 28 ILE MD 1 87 PHE HB3 . . 5.230 4.738 4.298 5.077 . 0 0 "[ . 1 . 2]" 1
801 1 28 ILE MD 1 85 LEU HB2 . . 5.200 4.683 4.410 4.955 . 0 0 "[ . 1 . 2]" 1
802 1 24 GLY HA2 1 25 ILE HG13 . . 4.860 3.677 3.542 3.811 . 0 0 "[ . 1 . 2]" 1
803 1 27 PHE QE 1 86 LEU HB3 . . 5.220 3.814 3.549 4.658 . 0 0 "[ . 1 . 2]" 1
804 1 27 PHE HD1 1 86 LEU HB3 . . 5.500 4.277 3.995 5.494 . 0 0 "[ . 1 . 2]" 1
805 1 86 LEU HB3 1 93 VAL MG2 . . 4.580 3.382 3.056 3.938 . 0 0 "[ . 1 . 2]" 1
806 1 86 LEU HB3 1 94 SER H . . 4.130 2.513 2.186 2.865 . 0 0 "[ . 1 . 2]" 1
807 1 86 LEU HB3 1 108 PHE QE . . 3.970 3.397 2.761 3.961 . 0 0 "[ . 1 . 2]" 1
808 1 86 LEU HB3 1 108 PHE HZ . . 4.570 3.911 2.991 4.531 . 0 0 "[ . 1 . 2]" 1
809 1 86 LEU HB3 1 94 SER HB3 . . 4.960 4.032 3.822 4.290 . 0 0 "[ . 1 . 2]" 1
810 1 86 LEU HB2 1 87 PHE H . . 4.820 4.012 3.916 4.101 . 0 0 "[ . 1 . 2]" 1
811 1 21 ILE QG 1 90 GLY HA2 . . 4.410 2.634 2.012 3.210 . 0 0 "[ . 1 . 2]" 1
812 1 22 ALA MB 1 90 GLY HA2 . . 4.800 3.738 3.162 4.417 . 0 0 "[ . 1 . 2]" 1
813 1 22 ALA MB 1 90 GLY HA3 . . 4.800 3.691 3.214 4.310 . 0 0 "[ . 1 . 2]" 1
814 1 21 ILE QG 1 90 GLY HA3 . . 4.410 3.987 3.476 4.406 . 0 0 "[ . 1 . 2]" 1
815 1 25 ILE MD 1 26 THR H . . 5.190 5.097 5.064 5.160 . 0 0 "[ . 1 . 2]" 1
816 1 25 ILE MD 1 57 ALA H . . 4.840 3.016 2.372 3.475 . 0 0 "[ . 1 . 2]" 1
817 1 25 ILE H 1 25 ILE MD . . 4.340 3.512 3.305 3.692 . 0 0 "[ . 1 . 2]" 1
818 1 25 ILE MD 1 88 ARG HA . . 4.790 4.607 4.241 4.779 . 0 0 "[ . 1 . 2]" 1
819 1 25 ILE MD 1 56 LEU HA . . 4.920 4.465 3.853 4.906 . 0 0 "[ . 1 . 2]" 1
820 1 25 ILE MD 1 59 VAL HA . . 4.560 4.067 3.802 4.256 . 0 0 "[ . 1 . 2]" 1
821 1 24 GLY HA2 1 25 ILE MD . . 5.360 4.954 4.742 5.108 . 0 0 "[ . 1 . 2]" 1
822 1 25 ILE MD 1 113 ALA MB . . 3.470 2.047 1.788 2.451 . 0 0 "[ . 1 . 2]" 1
823 1 25 ILE MD 1 59 VAL MG1 . . 4.780 3.913 3.685 4.365 . 0 0 "[ . 1 . 2]" 1
824 1 100 ARG H 1 100 ARG HD2 . . 5.490 4.768 3.447 5.398 . 0 0 "[ . 1 . 2]" 1
825 1 100 ARG HA 1 100 ARG HD2 . . 4.790 4.301 3.468 4.748 . 0 0 "[ . 1 . 2]" 1
826 1 100 ARG HB2 1 100 ARG HD2 . . 3.920 2.780 2.226 3.679 . 0 0 "[ . 1 . 2]" 1
827 1 100 ARG HB3 1 100 ARG HD2 . . 3.920 2.659 2.208 3.769 . 0 0 "[ . 1 . 2]" 1
828 1 41 LEU MD1 1 100 ARG HD2 . . 4.210 3.416 2.053 4.153 . 0 0 "[ . 1 . 2]" 1
829 1 84 LEU MD1 1 100 ARG HD2 . . 4.520 3.820 2.433 4.518 . 0 0 "[ . 1 . 2]" 1
830 1 41 LEU MD2 1 100 ARG HD2 . . 4.320 3.421 2.323 4.211 . 0 0 "[ . 1 . 2]" 1
831 1 100 ARG HA 1 100 ARG HD3 . . 4.790 4.031 2.101 4.673 . 0 0 "[ . 1 . 2]" 1
832 1 100 ARG H 1 100 ARG HD3 . . 5.490 5.074 3.835 5.485 . 0 0 "[ . 1 . 2]" 1
833 1 100 ARG HB2 1 100 ARG HD3 . . 3.920 3.438 2.319 3.832 . 0 0 "[ . 1 . 2]" 1
834 1 100 ARG HB3 1 100 ARG HD3 . . 3.920 2.888 2.121 3.632 . 0 0 "[ . 1 . 2]" 1
835 1 41 LEU MD1 1 100 ARG HD3 . . 4.210 3.518 1.957 4.213 0.003 13 0 "[ . 1 . 2]" 1
836 1 84 LEU MD1 1 100 ARG HD3 . . 4.520 2.870 1.893 4.017 . 0 0 "[ . 1 . 2]" 1
837 1 41 LEU MD2 1 100 ARG HD3 . . 4.320 3.199 2.480 3.992 . 0 0 "[ . 1 . 2]" 1
838 1 25 ILE HG12 1 88 ARG HD2 . . 4.180 2.660 2.094 3.588 . 0 0 "[ . 1 . 2]" 1
839 1 88 ARG HA 1 88 ARG HD3 . . 5.140 4.397 3.606 4.706 . 0 0 "[ . 1 . 2]" 1
840 1 25 ILE HG12 1 88 ARG HD3 . . 4.180 3.688 2.483 4.181 0.001 10 0 "[ . 1 . 2]" 1
841 1 56 LEU HB2 1 59 VAL MG2 . . 3.810 3.299 2.641 3.808 . 0 0 "[ . 1 . 2]" 1
842 1 56 LEU HB3 1 56 LEU MD1 . . 3.460 2.279 2.075 2.575 . 0 0 "[ . 1 . 2]" 1
843 1 80 GLY HA2 1 81 TYR QD . . 5.130 3.839 2.834 4.462 . 0 0 "[ . 1 . 2]" 1
844 1 80 GLY HA3 1 81 TYR QD . . 5.130 4.912 4.111 5.158 0.028 7 0 "[ . 1 . 2]" 1
845 1 104 SER HA 1 107 ARG HD2 . . 4.940 2.619 2.034 3.470 . 0 0 "[ . 1 . 2]" 1
846 1 104 SER HA 1 107 ARG HD3 . . 4.940 3.007 1.995 4.574 . 0 0 "[ . 1 . 2]" 1
847 1 66 CYS HA 1 73 CYS HB2 . . 5.120 2.851 2.695 3.165 . 0 0 "[ . 1 . 2]" 1
848 1 72 ILE MG 1 73 CYS HB2 . . 5.420 4.853 4.645 5.146 . 0 0 "[ . 1 . 2]" 1
849 1 73 CYS HB2 1 78 VAL MG2 . . 5.500 4.444 4.027 4.751 . 0 0 "[ . 1 . 2]" 1
850 1 70 ARG H 1 70 ARG QD . . 4.750 3.296 1.830 4.193 . 0 0 "[ . 1 . 2]" 1
851 1 31 TYR HB2 1 38 CYS HA . . 4.930 4.064 3.546 4.677 . 0 0 "[ . 1 . 2]" 1
852 1 29 LYS HD2 1 31 TYR HB3 . . 4.550 2.317 2.060 2.761 . 0 0 "[ . 1 . 2]" 1
853 1 29 LYS HD3 1 31 TYR HB3 . . 4.550 2.749 1.999 4.383 . 0 0 "[ . 1 . 2]" 1
854 1 105 LEU HB2 1 106 HIS H . . 3.720 2.623 2.216 2.984 . 0 0 "[ . 1 . 2]" 1
855 1 27 PHE QE 1 105 LEU HB2 . . 5.500 5.153 4.819 5.497 . 0 0 "[ . 1 . 2]" 1
856 1 48 LEU MD2 1 105 LEU HB2 . . 3.960 3.351 2.995 3.920 . 0 0 "[ . 1 . 2]" 1
857 1 45 TRP HZ3 1 105 LEU HB3 . . 5.500 4.328 3.906 4.613 . 0 0 "[ . 1 . 2]" 1
858 1 96 HIS HD2 1 105 LEU HB3 . . 5.500 4.308 3.856 4.914 . 0 0 "[ . 1 . 2]" 1
859 1 27 PHE QE 1 105 LEU HB3 . . 4.000 3.537 3.121 3.889 . 0 0 "[ . 1 . 2]" 1
860 1 70 ARG HA 1 73 CYS HB2 . . 3.850 2.316 2.004 2.709 . 0 0 "[ . 1 . 2]" 1
861 1 73 CYS HB2 1 78 VAL HB . . 4.380 4.265 4.010 4.385 0.005 11 0 "[ . 1 . 2]" 1
862 1 73 CYS HB2 1 78 VAL MG1 . . 5.240 4.911 4.680 5.089 . 0 0 "[ . 1 . 2]" 1
863 1 67 THR HA 1 70 ARG QD . . 4.900 3.259 2.378 4.907 0.007 10 0 "[ . 1 . 2]" 1
864 1 70 ARG QB 1 70 ARG QD . . 3.390 2.230 2.041 2.611 . 0 0 "[ . 1 . 2]" 1
865 1 73 CYS HB3 1 78 VAL HB . . 3.330 2.581 2.347 2.756 . 0 0 "[ . 1 . 2]" 1
866 1 79 ARG QD 1 80 GLY H . . 5.200 4.351 2.666 5.184 . 0 0 "[ . 1 . 2]" 1
867 1 21 ILE HB 1 87 PHE HB2 . . 4.350 2.626 2.240 2.999 . 0 0 "[ . 1 . 2]" 1
868 1 79 ARG H 1 79 ARG QD . . 5.010 3.932 1.888 4.587 . 0 0 "[ . 1 . 2]" 1
869 1 26 THR HG1 1 87 PHE HB2 . . 5.070 4.932 4.604 5.065 . 0 0 "[ . 1 . 2]" 1
870 1 25 ILE MG 1 87 PHE HB2 . . 5.150 4.659 4.376 4.944 . 0 0 "[ . 1 . 2]" 1
871 1 28 ILE MD 1 87 PHE HB2 . . 4.940 3.883 3.406 4.154 . 0 0 "[ . 1 . 2]" 1
872 1 87 PHE H 1 87 PHE HB3 . . 4.130 3.847 3.795 3.901 . 0 0 "[ . 1 . 2]" 1
873 1 26 THR HB 1 87 PHE HB3 . . 4.850 4.677 4.564 4.810 . 0 0 "[ . 1 . 2]" 1
874 1 21 ILE MD 1 87 PHE HB3 . . 4.620 3.067 2.492 3.601 . 0 0 "[ . 1 . 2]" 1
875 1 87 PHE HB3 1 90 GLY H . . 5.310 3.740 3.444 4.405 . 0 0 "[ . 1 . 2]" 1
876 1 12 LEU HB2 1 17 PHE QD . . 3.850 2.939 2.680 3.300 . 0 0 "[ . 1 . 2]" 1
877 1 12 LEU HB2 1 17 PHE QB . . 4.670 3.646 3.067 3.958 . 0 0 "[ . 1 . 2]" 1
878 1 12 LEU HB2 1 28 ILE MG . . 5.180 4.015 3.654 4.501 . 0 0 "[ . 1 . 2]" 1
879 1 41 LEU H 1 41 LEU HB2 . . 3.540 2.644 2.480 2.844 . 0 0 "[ . 1 . 2]" 1
880 1 41 LEU HB2 1 41 LEU MD2 . . 3.600 2.500 2.363 2.647 . 0 0 "[ . 1 . 2]" 1
881 1 13 THR HB 1 15 ASN H . . 4.890 2.919 2.672 3.882 . 0 0 "[ . 1 . 2]" 1
882 1 14 GLU H 1 72 ILE MD . . 3.850 3.341 2.887 3.697 . 0 0 "[ . 1 . 2]" 1
883 1 72 ILE H 1 72 ILE MD . . 4.240 3.558 3.143 3.766 . 0 0 "[ . 1 . 2]" 1
884 1 72 ILE MD 1 73 CYS H . . 5.070 4.234 3.984 4.487 . 0 0 "[ . 1 . 2]" 1
885 1 30 PHE QE 1 72 ILE MD . . 4.930 3.984 3.569 4.410 . 0 0 "[ . 1 . 2]" 1
886 1 17 PHE QD 1 72 ILE MD . . 3.490 2.451 2.288 2.708 . 0 0 "[ . 1 . 2]" 1
887 1 72 ILE MD 1 76 TYR QE . . 4.990 4.396 3.924 4.744 . 0 0 "[ . 1 . 2]" 1
888 1 69 GLU HA 1 72 ILE MD . . 4.940 4.242 3.890 4.677 . 0 0 "[ . 1 . 2]" 1
889 1 13 THR HA 1 72 ILE MD . . 4.160 3.659 3.330 3.839 . 0 0 "[ . 1 . 2]" 1
890 1 17 PHE HA 1 72 ILE MD . . 4.760 4.552 4.414 4.740 . 0 0 "[ . 1 . 2]" 1
891 1 72 ILE HA 1 72 ILE MD . . 4.050 3.840 3.717 3.908 . 0 0 "[ . 1 . 2]" 1
892 1 17 PHE QB 1 72 ILE MD . . 3.220 2.469 2.312 2.541 . 0 0 "[ . 1 . 2]" 1
893 1 71 ASN HB2 1 72 ILE MD . . 5.090 4.718 4.464 5.074 . 0 0 "[ . 1 . 2]" 1
894 1 14 GLU HG2 1 72 ILE MD . . 4.120 3.254 2.006 4.117 . 0 0 "[ . 1 . 2]" 1
895 1 69 GLU HG2 1 72 ILE MD . . 4.890 3.561 2.688 4.626 . 0 0 "[ . 1 . 2]" 1
896 1 14 GLU HG3 1 72 ILE MD . . 4.120 3.275 2.084 4.072 . 0 0 "[ . 1 . 2]" 1
897 1 14 GLU HB2 1 72 ILE MD . . 4.700 3.428 2.503 4.322 . 0 0 "[ . 1 . 2]" 1
898 1 69 GLU HB3 1 72 ILE MD . . 3.370 2.324 2.009 2.792 . 0 0 "[ . 1 . 2]" 1
899 1 72 ILE HB 1 72 ILE MD . . 3.150 2.361 2.262 2.497 . 0 0 "[ . 1 . 2]" 1
900 1 12 LEU HB3 1 72 ILE MD . . 5.500 4.679 4.321 5.047 . 0 0 "[ . 1 . 2]" 1
901 1 64 VAL HB 1 72 ILE MD . . 5.500 4.679 4.341 5.105 . 0 0 "[ . 1 . 2]" 1
902 1 13 THR MG 1 72 ILE MD . . 5.230 5.081 4.928 5.225 . 0 0 "[ . 1 . 2]" 1
903 1 50 LYS H 1 50 LYS QE . . 4.550 4.119 3.763 4.533 . 0 0 "[ . 1 . 2]" 1
904 1 49 SER HG 1 50 LYS QE . . 4.530 3.829 3.360 4.228 . 0 0 "[ . 1 . 2]" 1
905 1 8 THR HA 1 50 LYS QE . . 4.890 3.460 3.149 3.997 . 0 0 "[ . 1 . 2]" 1
906 1 7 GLY QA 1 50 LYS QE . . 5.300 5.236 4.926 5.305 0.005 8 0 "[ . 1 . 2]" 1
907 1 47 GLU HA 1 50 LYS QE . . 3.770 3.269 2.744 3.671 . 0 0 "[ . 1 . 2]" 1
908 1 46 GLU HB2 1 50 LYS QE . . 4.780 4.505 4.040 4.772 . 0 0 "[ . 1 . 2]" 1
909 1 46 GLU HB3 1 50 LYS QE . . 3.970 3.233 2.830 3.513 . 0 0 "[ . 1 . 2]" 1
910 1 50 LYS QE 1 50 LYS HG2 . . 3.550 2.593 2.321 3.036 . 0 0 "[ . 1 . 2]" 1
911 1 8 THR MG 1 50 LYS QE . . 4.410 2.814 2.319 3.369 . 0 0 "[ . 1 . 2]" 1
912 1 10 LEU HB3 1 12 LEU MD2 . . 3.940 2.769 2.346 3.092 . 0 0 "[ . 1 . 2]" 1
913 1 10 LEU HB3 1 62 ALA MB . . 3.380 2.291 1.985 2.942 . 0 0 "[ . 1 . 2]" 1
914 1 10 LEU HB3 1 63 GLU H . . 5.140 4.523 4.171 4.946 . 0 0 "[ . 1 . 2]" 1
915 1 10 LEU HB2 1 11 ALA H . . 4.580 4.385 3.778 4.581 0.001 13 0 "[ . 1 . 2]" 1
916 1 10 LEU HB2 1 62 ALA MB . . 3.860 2.215 1.993 2.462 . 0 0 "[ . 1 . 2]" 1
917 1 10 LEU HB2 1 12 LEU MD2 . . 4.120 3.946 3.346 4.128 0.008 6 0 "[ . 1 . 2]" 1
918 1 91 LYS H 1 91 LYS QE . . 5.460 5.135 4.466 5.467 0.007 17 0 "[ . 1 . 2]" 1
919 1 91 LYS QE 1 91 LYS QG . . 3.370 2.313 2.056 2.721 . 0 0 "[ . 1 . 2]" 1
920 1 39 LYS QE 1 39 LYS HG3 . . 3.880 2.565 2.090 3.367 . 0 0 "[ . 1 . 2]" 1
921 1 101 ASP HA 1 102 LEU HB3 . . 5.220 4.678 4.518 4.824 . 0 0 "[ . 1 . 2]" 1
922 1 101 ASP HB2 1 102 LEU HB3 . . 5.500 5.133 4.594 5.441 . 0 0 "[ . 1 . 2]" 1
923 1 36 GLY HA3 1 39 LYS QE . . 5.350 4.441 3.315 5.269 . 0 0 "[ . 1 . 2]" 1
924 1 39 LYS HA 1 39 LYS QE . . 5.500 4.505 4.020 4.824 . 0 0 "[ . 1 . 2]" 1
925 1 36 GLY HA2 1 39 LYS QE . . 4.850 2.949 1.986 3.866 . 0 0 "[ . 1 . 2]" 1
926 1 39 LYS QB 1 39 LYS QE . . 4.230 3.555 3.096 3.811 . 0 0 "[ . 1 . 2]" 1
927 1 75 LYS HA 1 75 LYS QE . . 5.180 4.698 4.263 5.043 . 0 0 "[ . 1 . 2]" 1
928 1 75 LYS QE 1 75 LYS HG3 . . 3.470 2.604 2.161 3.121 . 0 0 "[ . 1 . 2]" 1
929 1 75 LYS QE 1 75 LYS HG2 . . 3.470 2.749 2.177 3.472 0.002 8 0 "[ . 1 . 2]" 1
930 1 29 LYS HB2 1 29 LYS HE2 . . 4.550 3.222 3.113 3.401 . 0 0 "[ . 1 . 2]" 1
931 1 29 LYS HE2 1 29 LYS QG . . 3.820 2.665 2.307 3.204 . 0 0 "[ . 1 . 2]" 1
932 1 29 LYS HB3 1 29 LYS HE2 . . 4.550 2.146 1.990 2.998 . 0 0 "[ . 1 . 2]" 1
933 1 29 LYS HE2 1 63 GLU HA . . 5.140 4.170 3.034 4.829 . 0 0 "[ . 1 . 2]" 1
934 1 29 LYS HE3 1 45 TRP HD1 . . 4.500 4.182 3.581 4.483 . 0 0 "[ . 1 . 2]" 1
935 1 29 LYS HE3 1 63 GLU HA . . 5.140 4.149 3.102 5.120 . 0 0 "[ . 1 . 2]" 1
936 1 29 LYS HB2 1 29 LYS HE3 . . 4.550 4.182 3.705 4.581 0.031 1 0 "[ . 1 . 2]" 1
937 1 29 LYS HE3 1 29 LYS QG . . 3.820 3.074 2.075 3.470 . 0 0 "[ . 1 . 2]" 1
938 1 29 LYS HB3 1 29 LYS HE3 . . 4.550 2.770 2.096 3.254 . 0 0 "[ . 1 . 2]" 1
939 1 101 ASP HB3 1 102 LEU HB3 . . 4.660 4.113 3.849 4.352 . 0 0 "[ . 1 . 2]" 1
940 1 75 LYS QE 1 76 TYR QD . . 5.500 4.694 2.711 5.305 . 0 0 "[ . 1 . 2]" 1
941 1 76 TYR QD 1 92 LYS QE . . 5.500 4.175 2.810 5.430 . 0 0 "[ . 1 . 2]" 1
942 1 101 ASP HB2 1 102 LEU H . . 4.070 3.722 3.273 4.048 . 0 0 "[ . 1 . 2]" 1
943 1 27 PHE QE 1 84 LEU HB2 . . 4.120 3.834 3.413 4.088 . 0 0 "[ . 1 . 2]" 1
944 1 45 TRP HZ3 1 84 LEU HB2 . . 5.500 5.125 4.428 5.511 0.011 19 0 "[ . 1 . 2]" 1
945 1 84 LEU HB3 1 96 HIS H . . 4.990 4.473 4.022 4.980 . 0 0 "[ . 1 . 2]" 1
946 1 27 PHE QE 1 84 LEU HB3 . . 3.680 3.005 2.321 3.292 . 0 0 "[ . 1 . 2]" 1
947 1 92 LYS QE 1 92 LYS HG2 . . 3.700 2.847 2.131 3.456 . 0 0 "[ . 1 . 2]" 1
948 1 92 LYS QE 1 92 LYS HG3 . . 3.700 2.624 2.080 3.464 . 0 0 "[ . 1 . 2]" 1
949 1 78 VAL HA 1 83 THR HB . . 5.200 4.827 4.673 5.199 . 0 0 "[ . 1 . 2]" 1
950 1 83 THR HB 1 85 LEU HG . . 5.010 4.872 4.468 5.011 0.001 13 0 "[ . 1 . 2]" 1
951 1 30 PHE H 1 83 THR HB . . 4.320 3.125 2.610 3.487 . 0 0 "[ . 1 . 2]" 1
952 1 81 TYR QD 1 83 THR HB . . 5.130 3.895 3.292 4.551 . 0 0 "[ . 1 . 2]" 1
953 1 82 PRO HA 1 83 THR HB . . 5.110 4.683 4.494 4.881 . 0 0 "[ . 1 . 2]" 1
954 1 30 PHE HB2 1 83 THR HB . . 3.210 1.999 1.986 2.013 . 0 0 "[ . 1 . 2]" 1
955 1 30 PHE HB3 1 83 THR HB . . 3.800 3.692 3.603 3.757 . 0 0 "[ . 1 . 2]" 1
956 1 60 LYS H 1 60 LYS HE2 . . 4.860 3.488 2.813 4.363 . 0 0 "[ . 1 . 2]" 1
957 1 26 THR HG1 1 60 LYS HE2 . . 4.550 3.130 2.430 3.860 . 0 0 "[ . 1 . 2]" 1
958 1 26 THR HA 1 60 LYS HE2 . . 5.040 3.974 3.072 4.802 . 0 0 "[ . 1 . 2]" 1
959 1 60 LYS HB2 1 60 LYS HE2 . . 3.620 2.556 2.007 3.214 . 0 0 "[ . 1 . 2]" 1
960 1 20 THR MG 1 60 LYS HE2 . . 4.130 3.877 3.582 4.119 . 0 0 "[ . 1 . 2]" 1
961 1 60 LYS H 1 60 LYS HE3 . . 4.860 4.526 3.860 4.861 0.001 2 0 "[ . 1 . 2]" 1
962 1 26 THR HG1 1 60 LYS HE3 . . 4.550 2.714 2.419 3.256 . 0 0 "[ . 1 . 2]" 1
963 1 60 LYS HB2 1 60 LYS HE3 . . 3.620 2.921 2.325 3.510 . 0 0 "[ . 1 . 2]" 1
964 1 60 LYS HB3 1 60 LYS HE3 . . 4.610 3.965 3.365 4.586 . 0 0 "[ . 1 . 2]" 1
965 1 32 ALA H 1 81 TYR HB2 . . 4.750 4.003 3.579 4.459 . 0 0 "[ . 1 . 2]" 1
966 1 32 ALA H 1 81 TYR HB3 . . 4.750 3.557 3.169 3.993 . 0 0 "[ . 1 . 2]" 1
967 1 81 TYR HB3 1 82 PRO HA . . 3.800 2.026 1.978 2.304 . 0 0 "[ . 1 . 2]" 1
968 1 103 ASP H 1 103 ASP HB2 . . 3.920 2.617 2.205 3.594 . 0 0 "[ . 1 . 2]" 1
969 1 103 ASP HB2 1 104 SER H . . 3.750 3.200 2.316 3.752 0.002 18 0 "[ . 1 . 2]" 1
970 1 103 ASP H 1 103 ASP HB3 . . 3.920 2.997 2.388 3.598 . 0 0 "[ . 1 . 2]" 1
971 1 103 ASP HB3 1 104 SER H . . 3.750 3.053 2.145 3.748 . 0 0 "[ . 1 . 2]" 1
972 1 51 LYS HE2 1 106 HIS HB2 . . 4.700 2.484 2.004 3.979 . 0 0 "[ . 1 . 2]" 1
973 1 51 LYS HA 1 51 LYS HE2 . . 5.040 4.442 3.947 4.824 . 0 0 "[ . 1 . 2]" 1
974 1 51 LYS HE3 1 106 HIS HD2 . . 5.270 3.672 2.699 4.979 . 0 0 "[ . 1 . 2]" 1
975 1 51 LYS HA 1 51 LYS HE3 . . 5.040 3.730 3.188 4.359 . 0 0 "[ . 1 . 2]" 1
976 1 51 LYS HE3 1 106 HIS HB2 . . 4.700 3.369 2.594 3.881 . 0 0 "[ . 1 . 2]" 1
977 1 26 THR HA 1 60 LYS HE3 . . 5.040 4.369 3.830 4.966 . 0 0 "[ . 1 . 2]" 1
978 1 45 TRP HA 1 48 LEU HB3 . . 3.770 3.462 3.250 3.720 . 0 0 "[ . 1 . 2]" 1
979 1 48 LEU HB3 1 49 SER H . . 3.290 2.408 2.211 2.653 . 0 0 "[ . 1 . 2]" 1
980 1 28 ILE HB 1 30 PHE HZ . . 4.420 3.416 3.016 3.754 . 0 0 "[ . 1 . 2]" 1
981 1 45 TRP HE3 1 48 LEU HB3 . . 5.090 4.419 4.143 4.727 . 0 0 "[ . 1 . 2]" 1
982 1 28 ILE HB 1 85 LEU HB2 . . 4.220 3.839 3.520 4.212 . 0 0 "[ . 1 . 2]" 1
983 1 48 LEU HB3 1 102 LEU MD1 . . 4.550 4.364 4.010 4.553 0.003 17 0 "[ . 1 . 2]" 1
984 1 28 ILE H 1 28 ILE HB . . 3.550 2.581 2.474 2.687 . 0 0 "[ . 1 . 2]" 1
985 1 28 ILE HB 1 30 PHE QD . . 4.740 4.619 4.399 4.742 0.002 6 0 "[ . 1 . 2]" 1
986 1 25 ILE HB 1 25 ILE MD . . 3.410 2.315 2.149 2.419 . 0 0 "[ . 1 . 2]" 1
987 1 25 ILE HB 1 59 VAL MG1 . . 4.270 3.227 2.776 3.640 . 0 0 "[ . 1 . 2]" 1
988 1 48 LEU HB2 1 102 LEU MD1 . . 3.730 3.152 2.797 3.344 . 0 0 "[ . 1 . 2]" 1
989 1 19 ASP HB2 1 20 THR HG1 . . 5.190 4.338 3.263 5.180 . 0 0 "[ . 1 . 2]" 1
990 1 16 ASN HA 1 19 ASP HB2 . . 4.470 3.134 2.488 3.837 . 0 0 "[ . 1 . 2]" 1
991 1 19 ASP HB3 1 20 THR HG1 . . 5.190 4.025 3.237 4.977 . 0 0 "[ . 1 . 2]" 1
992 1 61 ILE H 1 61 ILE MD . . 4.220 3.553 3.326 3.782 . 0 0 "[ . 1 . 2]" 1
993 1 27 PHE HD2 1 61 ILE MD . . 3.630 2.690 2.434 3.052 . 0 0 "[ . 1 . 2]" 1
994 1 53 PHE HZ 1 61 ILE MD . . 3.640 2.679 2.333 2.952 . 0 0 "[ . 1 . 2]" 1
995 1 60 LYS HA 1 61 ILE MD . . 5.110 4.115 3.901 4.387 . 0 0 "[ . 1 . 2]" 1
996 1 49 SER HA 1 61 ILE MD . . 4.040 3.727 3.623 4.002 . 0 0 "[ . 1 . 2]" 1
997 1 48 LEU HA 1 61 ILE MD . . 5.500 5.035 4.736 5.217 . 0 0 "[ . 1 . 2]" 1
998 1 49 SER HB2 1 61 ILE MD . . 5.500 5.166 4.930 5.414 . 0 0 "[ . 1 . 2]" 1
999 1 27 PHE HB3 1 61 ILE MD . . 3.170 1.959 1.847 2.072 . 0 0 "[ . 1 . 2]" 1
1000 1 48 LEU HB3 1 61 ILE MD . . 4.730 3.590 3.218 3.827 . 0 0 "[ . 1 . 2]" 1
1001 1 48 LEU HG 1 61 ILE MD . . 3.480 2.495 2.185 2.856 . 0 0 "[ . 1 . 2]" 1
1002 1 48 LEU MD2 1 61 ILE MD . . 3.210 2.060 1.831 2.396 . 0 0 "[ . 1 . 2]" 1
1003 1 61 ILE MD 1 61 ILE MG . . 3.010 2.030 1.927 2.209 . 0 0 "[ . 1 . 2]" 1
1004 1 59 VAL MG1 1 61 ILE MD . . 3.240 2.411 2.066 2.760 . 0 0 "[ . 1 . 2]" 1
1005 1 27 PHE HA 1 61 ILE MD . . 5.000 4.286 4.152 4.431 . 0 0 "[ . 1 . 2]" 1
1006 1 27 PHE HB3 1 109 VAL MG2 . . 4.350 4.263 3.981 4.355 0.005 17 0 "[ . 1 . 2]" 1
1007 1 27 PHE HB3 1 48 LEU MD2 . . 4.790 3.344 3.104 3.877 . 0 0 "[ . 1 . 2]" 1
1008 1 27 PHE HB2 1 61 ILE MD . . 3.560 2.628 2.387 2.964 . 0 0 "[ . 1 . 2]" 1
1009 1 12 LEU HB3 1 17 PHE QB . . 4.320 2.873 2.396 3.240 . 0 0 "[ . 1 . 2]" 1
1010 1 53 PHE H 1 53 PHE HB2 . . 4.080 2.688 2.612 2.833 . 0 0 "[ . 1 . 2]" 1
1011 1 53 PHE HB2 1 56 LEU MD1 . . 4.220 3.290 3.042 3.756 . 0 0 "[ . 1 . 2]" 1
1012 1 53 PHE HB2 1 56 LEU H . . 5.000 4.109 3.746 4.392 . 0 0 "[ . 1 . 2]" 1
1013 1 53 PHE HB3 1 56 LEU MD1 . . 3.610 2.096 1.799 2.468 . 0 0 "[ . 1 . 2]" 1
1014 1 8 THR HB 1 9 VAL H . . 3.460 3.233 2.882 3.430 . 0 0 "[ . 1 . 2]" 1
1015 1 8 THR HB 1 49 SER HG . . 5.070 3.862 3.611 4.139 . 0 0 "[ . 1 . 2]" 1
1016 1 8 THR HB 1 46 GLU HA . . 4.310 3.923 3.452 4.345 0.035 15 0 "[ . 1 . 2]" 1
1017 1 17 PHE QB 1 64 VAL MG2 . . 5.500 3.954 3.604 4.331 . 0 0 "[ . 1 . 2]" 1
1018 1 16 ASN HB2 1 20 THR HG1 . . 4.040 2.972 2.626 3.275 . 0 0 "[ . 1 . 2]" 1
1019 1 31 TYR QE 1 65 ASP HB2 . . 5.500 5.053 3.698 5.492 . 0 0 "[ . 1 . 2]" 1
1020 1 15 ASN H 1 15 ASN HB2 . . 3.910 2.709 2.232 3.387 . 0 0 "[ . 1 . 2]" 1
1021 1 13 THR MG 1 15 ASN HB2 . . 5.500 4.944 4.209 5.515 0.015 12 0 "[ . 1 . 2]" 1
1022 1 13 THR MG 1 16 ASN HB3 . . 5.500 5.444 5.075 5.543 0.043 20 0 "[ . 1 . 2]" 1
1023 1 16 ASN HB3 1 17 PHE H . . 5.150 4.569 3.988 4.668 . 0 0 "[ . 1 . 2]" 1
1024 1 16 ASN HB3 1 20 THR HG1 . . 4.740 4.618 4.282 4.752 0.012 12 0 "[ . 1 . 2]" 1
1025 1 13 THR MG 1 15 ASN HB3 . . 5.500 4.791 4.230 5.520 0.020 3 0 "[ . 1 . 2]" 1
1026 1 65 ASP H 1 65 ASP HB3 . . 3.840 3.356 2.606 3.665 . 0 0 "[ . 1 . 2]" 1
1027 1 31 TYR QE 1 65 ASP HB3 . . 5.500 4.617 3.541 5.427 . 0 0 "[ . 1 . 2]" 1
1028 1 66 CYS HB3 1 67 THR HA . . 5.120 4.544 4.250 4.677 . 0 0 "[ . 1 . 2]" 1
1029 1 30 PHE HB3 1 83 THR H . . 5.140 5.134 5.085 5.158 0.018 20 0 "[ . 1 . 2]" 1
1030 1 30 PHE HB3 1 78 VAL MG2 . . 4.200 3.136 2.780 3.331 . 0 0 "[ . 1 . 2]" 1
1031 1 30 PHE HB3 1 81 TYR QE . . 5.480 4.466 4.064 4.900 . 0 0 "[ . 1 . 2]" 1
1032 1 30 PHE HB3 1 76 TYR HB2 . . 5.500 5.503 5.489 5.514 0.014 20 0 "[ . 1 . 2]" 1
1033 1 66 CYS HB2 1 78 VAL MG1 . . 5.170 4.431 3.965 5.162 . 0 0 "[ . 1 . 2]" 1
1034 1 21 ILE HB 1 91 LYS H . . 5.500 4.898 4.385 5.415 . 0 0 "[ . 1 . 2]" 1
1035 1 21 ILE HB 1 87 PHE QD . . 4.410 3.866 3.464 4.132 . 0 0 "[ . 1 . 2]" 1
1036 1 21 ILE HB 1 26 THR HG1 . . 4.990 4.390 4.218 4.670 . 0 0 "[ . 1 . 2]" 1
1037 1 21 ILE HB 1 87 PHE HB3 . . 4.070 2.628 2.085 3.055 . 0 0 "[ . 1 . 2]" 1
1038 1 30 PHE HB2 1 83 THR HG1 . . 5.040 4.243 3.310 4.724 . 0 0 "[ . 1 . 2]" 1
1039 1 66 CYS H 1 66 CYS HB3 . . 3.810 3.572 3.529 3.607 . 0 0 "[ . 1 . 2]" 1
1040 1 66 CYS HB3 1 73 CYS HB2 . . 4.280 3.734 3.501 4.023 . 0 0 "[ . 1 . 2]" 1
1041 1 66 CYS HB3 1 73 CYS HB3 . . 4.300 3.481 3.265 3.671 . 0 0 "[ . 1 . 2]" 1
1042 1 66 CYS HB3 1 67 THR MG . . 5.190 4.095 3.767 4.270 . 0 0 "[ . 1 . 2]" 1
1043 1 66 CYS HB2 1 81 TYR QE . . 3.700 3.312 2.772 3.718 0.018 7 0 "[ . 1 . 2]" 1
1044 1 66 CYS HB2 1 73 CYS HB2 . . 5.360 4.961 4.814 5.202 . 0 0 "[ . 1 . 2]" 1
1045 1 66 CYS HB2 1 73 CYS HB3 . . 4.920 4.714 4.510 4.853 . 0 0 "[ . 1 . 2]" 1
1046 1 26 THR HB 1 87 PHE QD . . 4.570 4.337 3.850 4.564 . 0 0 "[ . 1 . 2]" 1
1047 1 21 ILE HB 1 26 THR HB . . 4.640 3.300 3.026 3.529 . 0 0 "[ . 1 . 2]" 1
1048 1 20 THR MG 1 26 THR HB . . 5.090 3.615 3.073 4.157 . 0 0 "[ . 1 . 2]" 1
1049 1 21 ILE MD 1 26 THR HB . . 5.500 4.826 4.585 4.976 . 0 0 "[ . 1 . 2]" 1
1050 1 26 THR HB 1 28 ILE HG12 . . 5.500 4.914 4.495 5.309 . 0 0 "[ . 1 . 2]" 1
1051 1 26 THR HB 1 28 ILE MD . . 4.090 3.899 3.681 4.068 . 0 0 "[ . 1 . 2]" 1
1052 1 26 THR HB 1 27 PHE H . . 4.970 4.314 4.160 4.376 . 0 0 "[ . 1 . 2]" 1
1053 1 26 THR H 1 26 THR HB . . 3.670 2.765 2.722 2.821 . 0 0 "[ . 1 . 2]" 1
1054 1 26 THR HB 1 87 PHE HB2 . . 3.360 3.280 3.088 3.362 0.002 2 0 "[ . 1 . 2]" 1
1055 1 26 THR HB 1 28 ILE HG13 . . 4.680 3.930 3.783 4.056 . 0 0 "[ . 1 . 2]" 1
1056 1 37 HIS HA 1 40 THR HB . . 3.910 3.698 3.389 3.908 . 0 0 "[ . 1 . 2]" 1
1057 1 44 THR HB 1 45 TRP HB2 . . 5.200 4.171 4.052 4.368 . 0 0 "[ . 1 . 2]" 1
1058 1 41 LEU HG 1 44 THR HB . . 4.790 3.014 2.646 3.467 . 0 0 "[ . 1 . 2]" 1
1059 1 67 THR H 1 67 THR HB . . 4.150 3.719 3.614 3.817 . 0 0 "[ . 1 . 2]" 1
1060 1 33 PRO HD2 1 67 THR HB . . 4.820 4.343 4.053 4.758 . 0 0 "[ . 1 . 2]" 1
1061 1 64 VAL MG1 1 72 ILE HB . . 3.760 2.789 2.480 3.183 . 0 0 "[ . 1 . 2]" 1
1062 1 69 GLU HB3 1 72 ILE HB . . 3.660 2.899 2.432 3.300 . 0 0 "[ . 1 . 2]" 1
1063 1 71 ASN HB2 1 72 ILE HG13 . . 5.040 3.485 3.241 4.296 . 0 0 "[ . 1 . 2]" 1
1064 1 71 ASN H 1 71 ASN HB3 . . 3.780 3.553 2.976 3.602 . 0 0 "[ . 1 . 2]" 1
1065 1 71 ASN HB3 1 72 ILE H . . 3.950 3.116 2.092 3.422 . 0 0 "[ . 1 . 2]" 1
1066 1 71 ASN HB3 1 72 ILE HB . . 5.500 5.366 4.624 5.501 0.001 1 0 "[ . 1 . 2]" 1
1067 1 71 ASN HB3 1 75 LYS HB2 . . 5.500 5.227 4.433 5.504 0.004 13 0 "[ . 1 . 2]" 1
1068 1 71 ASN HB3 1 72 ILE HG13 . . 5.170 3.658 2.758 4.092 . 0 0 "[ . 1 . 2]" 1
1069 1 12 LEU MD1 1 20 THR HB . . 3.980 2.511 1.982 3.034 . 0 0 "[ . 1 . 2]" 1
1070 1 17 PHE HA 1 20 THR HB . . 4.010 3.503 3.017 3.730 . 0 0 "[ . 1 . 2]" 1
1071 1 16 ASN HB2 1 20 THR HB . . 5.500 5.130 4.683 5.461 . 0 0 "[ . 1 . 2]" 1
1072 1 17 PHE QB 1 20 THR HB . . 5.500 5.329 4.914 5.514 0.014 12 0 "[ . 1 . 2]" 1
1073 1 20 THR HB 1 21 ILE MG . . 4.280 3.092 2.804 3.414 . 0 0 "[ . 1 . 2]" 1
1074 1 73 CYS HA 1 76 TYR HB3 . . 5.190 4.689 4.546 4.857 . 0 0 "[ . 1 . 2]" 1
1075 1 71 ASN HB3 1 72 ILE HA . . 5.190 4.039 3.831 4.171 . 0 0 "[ . 1 . 2]" 1
1076 1 73 CYS HA 1 76 TYR HB2 . . 4.880 3.007 2.860 3.180 . 0 0 "[ . 1 . 2]" 1
1077 1 14 GLU HG2 1 72 ILE HG12 . . 4.980 3.693 2.362 4.531 . 0 0 "[ . 1 . 2]" 1
1078 1 14 GLU HG2 1 72 ILE HG13 . . 4.840 3.336 2.239 4.372 . 0 0 "[ . 1 . 2]" 1
1079 1 14 GLU H 1 14 GLU HG3 . . 4.540 3.983 2.247 4.548 0.008 18 0 "[ . 1 . 2]" 1
1080 1 14 GLU HG3 1 72 ILE HG12 . . 4.980 3.884 2.486 4.650 . 0 0 "[ . 1 . 2]" 1
1081 1 30 PHE QE 1 64 VAL HB . . 4.510 3.641 3.219 4.103 . 0 0 "[ . 1 . 2]" 1
1082 1 17 PHE QE 1 64 VAL HB . . 5.500 4.068 3.717 4.272 . 0 0 "[ . 1 . 2]" 1
1083 1 30 PHE HZ 1 64 VAL HB . . 5.500 5.092 4.772 5.491 . 0 0 "[ . 1 . 2]" 1
1084 1 64 VAL HB 1 72 ILE MG . . 4.940 4.187 3.809 4.584 . 0 0 "[ . 1 . 2]" 1
1085 1 109 VAL HA 1 111 SER H . . 4.950 4.211 3.729 4.807 . 0 0 "[ . 1 . 2]" 1
1086 1 109 VAL HA 1 112 GLN H . . 4.450 3.337 3.094 3.661 . 0 0 "[ . 1 . 2]" 1
1087 1 47 GLU H 1 47 GLU HG2 . . 3.680 2.466 1.994 3.578 . 0 0 "[ . 1 . 2]" 1
1088 1 47 GLU HA 1 47 GLU HG2 . . 3.920 2.722 2.340 3.073 . 0 0 "[ . 1 . 2]" 1
1089 1 14 GLU HG3 1 72 ILE HG13 . . 4.840 3.194 2.218 4.763 . 0 0 "[ . 1 . 2]" 1
1090 1 46 GLU HG2 1 49 SER HG . . 5.460 4.284 3.740 5.457 . 0 0 "[ . 1 . 2]" 1
1091 1 45 TRP HB3 1 46 GLU HG2 . . 5.270 4.959 3.462 5.270 . 0 0 "[ . 1 . 2]" 1
1092 1 52 GLU HA 1 52 GLU HG2 . . 4.090 2.786 2.151 3.866 . 0 0 "[ . 1 . 2]" 1
1093 1 52 GLU H 1 52 GLU HG2 . . 4.120 3.352 2.379 4.138 0.018 17 0 "[ . 1 . 2]" 1
1094 1 44 THR HA 1 47 GLU HG3 . . 4.290 3.078 2.509 3.498 . 0 0 "[ . 1 . 2]" 1
1095 1 46 GLU HG3 1 49 SER HG . . 5.460 5.126 4.172 5.479 0.019 15 0 "[ . 1 . 2]" 1
1096 1 45 TRP HB3 1 46 GLU HG3 . . 5.270 3.675 3.258 5.154 . 0 0 "[ . 1 . 2]" 1
1097 1 52 GLU H 1 52 GLU HG3 . . 4.120 3.444 2.372 4.132 0.012 20 0 "[ . 1 . 2]" 1
1098 1 46 GLU H 1 46 GLU HG3 . . 4.040 2.657 2.189 3.667 . 0 0 "[ . 1 . 2]" 1
1099 1 20 THR HA 1 22 ALA H . . 4.870 4.140 3.805 4.468 . 0 0 "[ . 1 . 2]" 1
1100 1 20 THR HA 1 20 THR HG1 . . 3.870 2.907 2.630 3.265 . 0 0 "[ . 1 . 2]" 1
1101 1 20 THR HA 1 60 LYS HD2 . . 5.150 4.822 4.315 5.154 0.004 18 0 "[ . 1 . 2]" 1
1102 1 109 VAL HA 1 113 ALA H . . 4.710 3.536 3.188 3.738 . 0 0 "[ . 1 . 2]" 1
1103 1 108 PHE QD 1 109 VAL HA . . 4.420 2.897 2.612 3.384 . 0 0 "[ . 1 . 2]" 1
1104 1 109 VAL HA 1 110 LEU HA . . 5.170 4.824 4.720 4.884 . 0 0 "[ . 1 . 2]" 1
1105 1 86 LEU MD1 1 109 VAL HA . . 3.820 3.581 3.287 3.808 . 0 0 "[ . 1 . 2]" 1
1106 1 116 GLU H 1 116 GLU HG3 . . 4.950 3.697 2.054 4.642 . 0 0 "[ . 1 . 2]" 1
1107 1 22 ALA MB 1 23 GLU HG3 . . 4.020 3.580 2.904 4.027 0.007 19 0 "[ . 1 . 2]" 1
1108 1 49 SER H 1 61 ILE HB . . 5.150 4.057 3.880 4.408 . 0 0 "[ . 1 . 2]" 1
1109 1 60 LYS HA 1 61 ILE HB . . 4.810 4.598 4.503 4.719 . 0 0 "[ . 1 . 2]" 1
1110 1 84 LEU H 1 95 GLU HG2 . . 5.330 4.309 3.427 4.864 . 0 0 "[ . 1 . 2]" 1
1111 1 95 GLU HA 1 95 GLU HG2 . . 4.170 3.061 2.512 3.452 . 0 0 "[ . 1 . 2]" 1
1112 1 85 LEU MD2 1 95 GLU HG2 . . 4.130 3.422 2.759 3.852 . 0 0 "[ . 1 . 2]" 1
1113 1 95 GLU HA 1 95 GLU HG3 . . 4.170 2.634 2.345 3.610 . 0 0 "[ . 1 . 2]" 1
1114 1 85 LEU MD2 1 95 GLU HG3 . . 4.130 2.153 1.813 2.982 . 0 0 "[ . 1 . 2]" 1
1115 1 91 LYS HB2 1 92 LYS H . . 4.200 3.427 2.266 4.200 0.000 17 0 "[ . 1 . 2]" 1
1116 1 91 LYS HB3 1 92 LYS H . . 4.200 3.300 1.972 4.271 0.071 19 0 "[ . 1 . 2]" 1
1117 1 44 THR HA 1 46 GLU H . . 5.050 4.370 4.065 4.795 . 0 0 "[ . 1 . 2]" 1
1118 1 44 THR HA 1 47 GLU HB2 . . 3.340 2.989 2.740 3.172 . 0 0 "[ . 1 . 2]" 1
1119 1 43 PRO HB2 1 44 THR HA . . 4.390 4.013 3.925 4.115 . 0 0 "[ . 1 . 2]" 1
1120 1 43 PRO HA 1 46 GLU HB2 . . 3.340 2.988 2.771 3.270 . 0 0 "[ . 1 . 2]" 1
1121 1 44 THR HA 1 48 LEU H . . 4.570 4.488 4.251 4.576 0.006 8 0 "[ . 1 . 2]" 1
1122 1 44 THR HA 1 47 GLU HG2 . . 4.290 3.794 3.062 4.294 0.004 15 0 "[ . 1 . 2]" 1
1123 1 40 THR HA 1 41 LEU HA . . 5.070 4.644 4.570 4.688 . 0 0 "[ . 1 . 2]" 1
1124 1 40 THR HA 1 43 PRO QG . . 4.830 3.803 3.454 4.132 . 0 0 "[ . 1 . 2]" 1
1125 1 39 LYS QB 1 40 THR HA . . 4.560 3.906 3.828 3.970 . 0 0 "[ . 1 . 2]" 1
1126 1 40 THR HA 1 42 ALA H . . 4.910 4.082 3.752 4.417 . 0 0 "[ . 1 . 2]" 1
1127 1 40 THR HA 1 42 ALA MB . . 5.170 4.413 4.257 4.563 . 0 0 "[ . 1 . 2]" 1
1128 1 13 THR MG 1 69 GLU HG2 . . 5.110 4.778 4.433 5.115 0.005 18 0 "[ . 1 . 2]" 1
1129 1 69 GLU HG3 1 72 ILE MD . . 4.890 3.668 2.507 4.883 . 0 0 "[ . 1 . 2]" 1
1130 1 60 LYS HB2 1 60 LYS HD2 . . 3.810 2.646 2.420 2.845 . 0 0 "[ . 1 . 2]" 1
1131 1 60 LYS HB2 1 61 ILE H . . 4.940 4.037 3.801 4.252 . 0 0 "[ . 1 . 2]" 1
1132 1 26 THR HA 1 60 LYS HB3 . . 4.160 3.906 3.605 4.122 . 0 0 "[ . 1 . 2]" 1
1133 1 60 LYS HB3 1 60 LYS HE2 . . 4.610 3.833 3.474 4.175 . 0 0 "[ . 1 . 2]" 1
1134 1 94 SER HB2 1 95 GLU H . . 4.340 3.980 3.802 4.196 . 0 0 "[ . 1 . 2]" 1
1135 1 94 SER HB2 1 108 PHE HZ . . 4.250 4.128 3.752 4.251 0.001 6 0 "[ . 1 . 2]" 1
1136 1 86 LEU HB3 1 94 SER HB2 . . 4.960 4.795 4.507 4.944 . 0 0 "[ . 1 . 2]" 1
1137 1 93 VAL HB 1 94 SER HB2 . . 4.940 4.030 3.747 4.247 . 0 0 "[ . 1 . 2]" 1
1138 1 93 VAL MG2 1 94 SER HB2 . . 5.500 5.092 5.044 5.197 . 0 0 "[ . 1 . 2]" 1
1139 1 86 LEU MD2 1 94 SER HB2 . . 4.710 4.454 4.084 4.710 . 0 0 "[ . 1 . 2]" 1
1140 1 94 SER HB3 1 95 GLU H . . 4.340 3.479 3.132 3.826 . 0 0 "[ . 1 . 2]" 1
1141 1 94 SER HB3 1 108 PHE HZ . . 4.250 2.388 2.023 2.575 . 0 0 "[ . 1 . 2]" 1
1142 1 93 VAL HB 1 94 SER HB3 . . 4.940 4.151 3.971 4.322 . 0 0 "[ . 1 . 2]" 1
1143 1 93 VAL MG2 1 94 SER HB3 . . 5.500 5.453 5.356 5.501 0.001 6 0 "[ . 1 . 2]" 1
1144 1 86 LEU MD2 1 94 SER HB3 . . 4.710 3.951 3.564 4.270 . 0 0 "[ . 1 . 2]" 1
1145 1 38 CYS HA 1 82 PRO HB3 . . 4.360 3.034 2.628 3.444 . 0 0 "[ . 1 . 2]" 1
1146 1 38 CYS HA 1 41 LEU MD2 . . 4.230 3.763 3.268 4.201 . 0 0 "[ . 1 . 2]" 1
1147 1 72 ILE HA 1 73 CYS HA . . 5.100 4.849 4.809 4.895 . 0 0 "[ . 1 . 2]" 1
1148 1 72 ILE HA 1 76 TYR QD . . 4.390 4.022 3.552 4.386 . 0 0 "[ . 1 . 2]" 1
1149 1 72 ILE HA 1 76 TYR H . . 4.830 4.684 4.510 4.831 0.001 15 0 "[ . 1 . 2]" 1
1150 1 71 ASN HB2 1 72 ILE HA . . 5.310 4.764 4.673 5.405 0.095 6 0 "[ . 1 . 2]" 1
1151 1 72 ILE HA 1 75 LYS HB2 . . 4.060 3.491 3.095 3.768 . 0 0 "[ . 1 . 2]" 1
1152 1 72 ILE HA 1 72 ILE HG13 . . 3.500 2.991 2.812 3.205 . 0 0 "[ . 1 . 2]" 1
1153 1 72 ILE HA 1 75 LYS HB3 . . 3.730 2.873 2.648 3.241 . 0 0 "[ . 1 . 2]" 1
1154 1 72 ILE HA 1 75 LYS HD2 . . 4.970 3.796 3.170 4.428 . 0 0 "[ . 1 . 2]" 1
1155 1 72 ILE HA 1 72 ILE HG12 . . 3.320 2.570 2.410 2.793 . 0 0 "[ . 1 . 2]" 1
1156 1 72 ILE HA 1 72 ILE MG . . 3.180 2.417 2.293 2.466 . 0 0 "[ . 1 . 2]" 1
1157 1 25 ILE HG12 1 88 ARG HB2 . . 4.520 2.798 2.395 3.121 . 0 0 "[ . 1 . 2]" 1
1158 1 88 ARG HB3 1 89 GLY H . . 5.140 4.281 3.877 4.414 . 0 0 "[ . 1 . 2]" 1
1159 1 31 TYR QD 1 33 PRO HA . . 3.810 3.623 3.537 3.686 . 0 0 "[ . 1 . 2]" 1
1160 1 81 TYR HA 1 82 PRO HB3 . . 4.980 4.464 4.354 4.489 . 0 0 "[ . 1 . 2]" 1
1161 1 29 LYS QG 1 82 PRO HB3 . . 4.680 4.246 3.995 4.561 . 0 0 "[ . 1 . 2]" 1
1162 1 82 PRO HB3 1 84 LEU MD2 . . 4.520 4.281 3.949 4.486 . 0 0 "[ . 1 . 2]" 1
1163 1 11 ALA MB 1 63 GLU HB3 . . 5.150 4.889 4.126 5.180 0.030 12 0 "[ . 1 . 2]" 1
1164 1 31 TYR QE 1 63 GLU HB2 . . 4.570 3.550 2.572 4.574 0.004 11 0 "[ . 1 . 2]" 1
1165 1 41 LEU MD2 1 82 PRO HB2 . . 3.910 2.335 2.019 2.585 . 0 0 "[ . 1 . 2]" 1
1166 1 29 LYS QG 1 82 PRO HB2 . . 4.390 3.517 3.236 4.295 . 0 0 "[ . 1 . 2]" 1
1167 1 29 LYS HD3 1 82 PRO HB2 . . 4.990 3.839 3.136 5.000 0.010 13 0 "[ . 1 . 2]" 1
1168 1 82 PRO HB2 1 84 LEU MD2 . . 3.720 2.954 2.461 3.239 . 0 0 "[ . 1 . 2]" 1
1169 1 29 LYS HD2 1 82 PRO HB2 . . 4.990 4.553 3.582 4.995 0.005 16 0 "[ . 1 . 2]" 1
1170 1 82 PRO HB2 1 84 LEU MD1 . . 5.360 4.415 4.187 4.608 . 0 0 "[ . 1 . 2]" 1
1171 1 109 VAL HA 1 112 GLN HG3 . . 4.960 3.750 3.271 4.431 . 0 0 "[ . 1 . 2]" 1
1172 1 13 THR H 1 17 PHE HA . . 4.810 3.534 3.184 4.009 . 0 0 "[ . 1 . 2]" 1
1173 1 17 PHE HA 1 20 THR H . . 4.370 4.081 3.921 4.313 . 0 0 "[ . 1 . 2]" 1
1174 1 17 PHE HA 1 17 PHE QD . . 3.630 3.219 3.105 3.316 . 0 0 "[ . 1 . 2]" 1
1175 1 17 PHE HA 1 20 THR HG1 . . 4.240 3.765 2.739 4.173 . 0 0 "[ . 1 . 2]" 1
1176 1 12 LEU HB3 1 17 PHE HA . . 3.580 2.109 1.994 2.416 . 0 0 "[ . 1 . 2]" 1
1177 1 12 LEU MD1 1 17 PHE HA . . 3.490 2.729 2.300 3.058 . 0 0 "[ . 1 . 2]" 1
1178 1 17 PHE HA 1 18 ASP HA . . 5.030 4.685 4.640 4.773 . 0 0 "[ . 1 . 2]" 1
1179 1 12 LEU HB2 1 17 PHE HA . . 4.380 3.583 3.304 3.848 . 0 0 "[ . 1 . 2]" 1
1180 1 17 PHE HA 1 21 ILE MG . . 4.870 4.296 3.834 4.825 . 0 0 "[ . 1 . 2]" 1
1181 1 63 GLU HB3 1 64 VAL H . . 5.190 4.064 3.881 4.236 . 0 0 "[ . 1 . 2]" 1
1182 1 31 TYR QE 1 63 GLU HB3 . . 4.740 4.393 3.959 4.739 . 0 0 "[ . 1 . 2]" 1
1183 1 31 TYR QD 1 63 GLU HB2 . . 4.610 3.727 2.851 4.611 0.001 11 0 "[ . 1 . 2]" 1
1184 1 109 VAL HA 1 112 GLN HG2 . . 4.480 3.454 2.341 4.078 . 0 0 "[ . 1 . 2]" 1
1185 1 86 LEU MD2 1 112 GLN HG2 . . 4.480 3.659 2.978 4.107 . 0 0 "[ . 1 . 2]" 1
1186 1 93 VAL H 1 93 VAL HB . . 3.650 2.645 2.498 2.755 . 0 0 "[ . 1 . 2]" 1
1187 1 86 LEU MD2 1 93 VAL HB . . 3.910 2.390 1.981 2.772 . 0 0 "[ . 1 . 2]" 1
1188 1 112 GLN H 1 112 GLN HG3 . . 4.310 3.923 3.394 4.146 . 0 0 "[ . 1 . 2]" 1
1189 1 108 PHE QE 1 112 GLN HG3 . . 4.820 2.738 2.380 3.311 . 0 0 "[ . 1 . 2]" 1
1190 1 108 PHE HZ 1 112 GLN HG3 . . 5.330 2.888 2.576 3.509 . 0 0 "[ . 1 . 2]" 1
1191 1 86 LEU MD2 1 112 GLN HG3 . . 4.140 2.479 2.097 2.896 . 0 0 "[ . 1 . 2]" 1
1192 1 17 PHE HA 1 20 THR MG . . 5.250 4.632 4.106 4.887 . 0 0 "[ . 1 . 2]" 1
1193 1 9 VAL MG2 1 63 GLU HB2 . . 5.250 4.269 3.508 4.939 . 0 0 "[ . 1 . 2]" 1
1194 1 54 PRO HA 1 55 GLY H . . 2.930 2.202 2.158 2.278 . 0 0 "[ . 1 . 2]" 1
1195 1 54 PRO HA 1 56 LEU H . . 4.220 3.556 3.289 4.018 . 0 0 "[ . 1 . 2]" 1
1196 1 97 SER HB2 1 98 GLY H . . 5.070 3.937 2.050 4.670 . 0 0 "[ . 1 . 2]" 1
1197 1 97 SER HB3 1 98 GLY H . . 5.070 3.934 2.595 4.654 . 0 0 "[ . 1 . 2]" 1
1198 1 78 VAL HA 1 79 ARG H . . 2.940 2.192 2.141 2.344 . 0 0 "[ . 1 . 2]" 1
1199 1 78 VAL HA 1 79 ARG HA . . 4.520 4.405 4.390 4.508 . 0 0 "[ . 1 . 2]" 1
1200 1 78 VAL HA 1 79 ARG QG . . 4.710 4.198 3.860 4.669 . 0 0 "[ . 1 . 2]" 1
1201 1 78 VAL HA 1 83 THR MG . . 4.060 3.235 3.001 3.517 . 0 0 "[ . 1 . 2]" 1
1202 1 78 VAL HA 1 78 VAL MG1 . . 3.220 2.347 2.260 2.440 . 0 0 "[ . 1 . 2]" 1
1203 1 78 VAL HA 1 78 VAL MG2 . . 3.180 2.433 2.243 2.569 . 0 0 "[ . 1 . 2]" 1
1204 1 50 LYS HB3 1 51 LYS H . . 4.420 3.698 3.501 4.427 0.007 14 0 "[ . 1 . 2]" 1
1205 1 47 GLU HA 1 50 LYS HB3 . . 4.910 4.738 4.502 4.919 0.009 20 0 "[ . 1 . 2]" 1
1206 1 50 LYS HB3 1 50 LYS QE . . 4.850 4.125 4.004 4.286 . 0 0 "[ . 1 . 2]" 1
1207 1 114 LYS H 1 114 LYS HB2 . . 3.830 2.590 2.174 3.585 . 0 0 "[ . 1 . 2]" 1
1208 1 114 LYS HB3 1 115 ASP H . . 4.730 4.009 3.162 4.505 . 0 0 "[ . 1 . 2]" 1
1209 1 50 LYS HB2 1 50 LYS QE . . 4.710 3.838 3.659 4.012 . 0 0 "[ . 1 . 2]" 1
1210 1 50 LYS HB2 1 51 LYS H . . 3.990 2.723 2.455 3.988 . 0 0 "[ . 1 . 2]" 1
1211 1 47 GLU HA 1 50 LYS HB2 . . 4.200 3.176 2.918 3.428 . 0 0 "[ . 1 . 2]" 1
1212 1 83 THR HA 1 84 LEU HB2 . . 5.470 4.828 4.718 4.925 . 0 0 "[ . 1 . 2]" 1
1213 1 82 PRO HB2 1 83 THR HA . . 5.390 4.226 4.117 4.328 . 0 0 "[ . 1 . 2]" 1
1214 1 33 PRO HD2 1 67 THR HA . . 5.410 4.923 4.683 5.368 . 0 0 "[ . 1 . 2]" 1
1215 1 59 VAL HA 1 60 LYS H . . 2.770 2.181 2.139 2.344 . 0 0 "[ . 1 . 2]" 1
1216 1 59 VAL HA 1 60 LYS HA . . 4.990 4.407 4.387 4.451 . 0 0 "[ . 1 . 2]" 1
1217 1 59 VAL HA 1 60 LYS HB2 . . 4.620 4.449 4.328 4.553 . 0 0 "[ . 1 . 2]" 1
1218 1 25 ILE HB 1 59 VAL HA . . 3.160 2.505 2.480 2.535 . 0 0 "[ . 1 . 2]" 1
1219 1 25 ILE MG 1 59 VAL HA . . 3.840 3.364 3.020 3.583 . 0 0 "[ . 1 . 2]" 1
1220 1 59 VAL HA 1 59 VAL MG1 . . 3.330 2.408 2.241 2.514 . 0 0 "[ . 1 . 2]" 1
1221 1 93 VAL HA 1 93 VAL MG2 . . 3.320 2.418 2.289 2.532 . 0 0 "[ . 1 . 2]" 1
1222 1 49 SER H 1 49 SER HB2 . . 3.970 3.552 3.527 3.570 . 0 0 "[ . 1 . 2]" 1
1223 1 49 SER HB2 1 50 LYS H . . 4.400 3.937 3.766 4.143 . 0 0 "[ . 1 . 2]" 1
1224 1 49 SER HB2 1 61 ILE HB . . 3.790 2.781 2.443 3.059 . 0 0 "[ . 1 . 2]" 1
1225 1 9 VAL MG2 1 49 SER HB2 . . 4.420 4.218 4.059 4.347 . 0 0 "[ . 1 . 2]" 1
1226 1 49 SER HB2 1 61 ILE MG . . 4.080 3.652 3.366 4.018 . 0 0 "[ . 1 . 2]" 1
1227 1 49 SER HB2 1 61 ILE HG12 . . 4.800 4.242 3.866 4.607 . 0 0 "[ . 1 . 2]" 1
1228 1 49 SER HB2 1 61 ILE HG13 . . 4.430 4.017 3.781 4.246 . 0 0 "[ . 1 . 2]" 1
1229 1 49 SER HB3 1 61 ILE HG13 . . 4.290 3.611 3.433 3.855 . 0 0 "[ . 1 . 2]" 1
1230 1 49 SER HB3 1 61 ILE HB . . 3.770 2.774 2.536 3.008 . 0 0 "[ . 1 . 2]" 1
1231 1 49 SER HB3 1 61 ILE HG12 . . 4.750 4.483 4.120 4.756 0.006 12 0 "[ . 1 . 2]" 1
1232 1 49 SER HB3 1 61 ILE MG . . 3.690 2.653 2.333 3.021 . 0 0 "[ . 1 . 2]" 1
1233 1 102 LEU MD1 1 106 HIS HB3 . . 5.270 4.923 4.507 5.195 . 0 0 "[ . 1 . 2]" 1
1234 1 111 SER H 1 111 SER QB . . 3.090 2.315 2.212 2.874 . 0 0 "[ . 1 . 2]" 1
1235 1 110 LEU HB2 1 111 SER QB . . 4.560 4.100 3.855 4.489 . 0 0 "[ . 1 . 2]" 1
1236 1 110 LEU HB3 1 111 SER QB . . 5.500 4.779 4.420 5.395 . 0 0 "[ . 1 . 2]" 1
1237 1 111 SER QB 1 112 GLN HG3 . . 5.500 5.358 5.113 5.497 . 0 0 "[ . 1 . 2]" 1
1238 1 105 LEU HB3 1 106 HIS HB2 . . 5.500 5.115 4.833 5.357 . 0 0 "[ . 1 . 2]" 1
1239 1 85 LEU MD2 1 95 GLU HB2 . . 3.790 2.189 1.902 2.551 . 0 0 "[ . 1 . 2]" 1
1240 1 95 GLU H 1 95 GLU HB3 . . 4.190 2.555 2.401 2.736 . 0 0 "[ . 1 . 2]" 1
1241 1 85 LEU MD2 1 95 GLU HB3 . . 3.790 3.513 3.277 3.783 . 0 0 "[ . 1 . 2]" 1
1242 1 104 SER HB2 1 105 LEU HG . . 4.840 3.848 3.435 4.842 0.002 19 0 "[ . 1 . 2]" 1
1243 1 111 SER QB 1 112 GLN HG2 . . 5.060 3.834 3.652 4.106 . 0 0 "[ . 1 . 2]" 1
1244 1 74 SER QB 1 76 TYR H . . 5.130 4.583 4.430 4.705 . 0 0 "[ . 1 . 2]" 1
1245 1 104 SER HB3 1 105 LEU HG . . 4.840 4.397 3.214 4.808 . 0 0 "[ . 1 . 2]" 1
1246 1 31 TYR QE 1 33 PRO HB2 . . 4.720 4.589 4.398 4.734 0.014 13 0 "[ . 1 . 2]" 1
1247 1 33 PRO HB2 1 34 TRP H . . 4.100 3.928 3.474 3.991 . 0 0 "[ . 1 . 2]" 1
1248 1 36 GLY HA2 1 39 LYS QB . . 3.530 3.474 3.149 3.542 0.012 8 0 "[ . 1 . 2]" 1
1249 1 39 LYS QB 1 39 LYS QD . . 3.390 2.133 2.016 2.261 . 0 0 "[ . 1 . 2]" 1
1250 1 101 ASP H 1 104 SER HA . . 5.500 4.961 4.826 5.218 . 0 0 "[ . 1 . 2]" 1
1251 1 103 ASP H 1 104 SER HA . . 5.500 5.310 5.171 5.448 . 0 0 "[ . 1 . 2]" 1
1252 1 101 ASP HB2 1 104 SER HA . . 5.500 4.472 4.176 4.941 . 0 0 "[ . 1 . 2]" 1
1253 1 21 ILE HA 1 26 THR HG1 . . 3.360 2.246 2.000 2.570 . 0 0 "[ . 1 . 2]" 1
1254 1 21 ILE HA 1 26 THR HB . . 4.070 2.132 1.998 2.471 . 0 0 "[ . 1 . 2]" 1
1255 1 21 ILE HA 1 87 PHE HB2 . . 4.990 3.965 3.532 4.371 . 0 0 "[ . 1 . 2]" 1
1256 1 21 ILE HA 1 87 PHE HB3 . . 5.190 4.659 4.080 5.143 . 0 0 "[ . 1 . 2]" 1
1257 1 20 THR MG 1 21 ILE HA . . 4.290 3.328 3.053 3.530 . 0 0 "[ . 1 . 2]" 1
1258 1 21 ILE HA 1 26 THR MG . . 4.400 3.204 2.764 3.614 . 0 0 "[ . 1 . 2]" 1
1259 1 21 ILE HA 1 21 ILE MD . . 4.390 4.168 4.129 4.181 . 0 0 "[ . 1 . 2]" 1
1260 1 21 ILE HA 1 21 ILE MG . . 3.090 2.328 2.179 2.466 . 0 0 "[ . 1 . 2]" 1
1261 1 9 VAL HB 1 10 LEU H . . 4.930 4.138 4.022 4.371 . 0 0 "[ . 1 . 2]" 1
1262 1 9 VAL HB 1 45 TRP HD1 . . 5.090 4.440 4.008 4.978 . 0 0 "[ . 1 . 2]" 1
1263 1 8 THR HA 1 9 VAL HB . . 5.500 5.364 5.215 5.491 . 0 0 "[ . 1 . 2]" 1
1264 1 9 VAL HB 1 46 GLU HA . . 5.420 4.940 4.688 5.169 . 0 0 "[ . 1 . 2]" 1
1265 1 87 PHE QE 1 92 LYS HB3 . . 4.810 2.651 2.198 4.101 . 0 0 "[ . 1 . 2]" 1
1266 1 76 TYR QE 1 92 LYS HB3 . . 4.130 3.259 2.540 3.862 . 0 0 "[ . 1 . 2]" 1
1267 1 74 SER QB 1 75 LYS HB2 . . 5.100 4.237 4.068 4.370 . 0 0 "[ . 1 . 2]" 1
1268 1 75 LYS HB2 1 75 LYS QE . . 4.800 3.723 2.295 4.467 . 0 0 "[ . 1 . 2]" 1
1269 1 92 LYS HB3 1 92 LYS QE . . 4.940 3.056 2.019 4.127 . 0 0 "[ . 1 . 2]" 1
1270 1 53 PHE HB2 1 59 VAL HB . . 4.530 3.627 3.272 3.967 . 0 0 "[ . 1 . 2]" 1
1271 1 53 PHE HB3 1 59 VAL HB . . 5.000 4.652 4.187 4.901 . 0 0 "[ . 1 . 2]" 1
1272 1 87 PHE QE 1 92 LYS HB2 . . 4.360 3.633 3.140 4.051 . 0 0 "[ . 1 . 2]" 1
1273 1 76 TYR QE 1 92 LYS HB2 . . 4.860 4.297 3.042 4.787 . 0 0 "[ . 1 . 2]" 1
1274 1 27 PHE QE 1 96 HIS HB2 . . 4.720 3.704 3.409 4.387 . 0 0 "[ . 1 . 2]" 1
1275 1 27 PHE HZ 1 96 HIS HB2 . . 4.000 2.593 2.256 3.423 . 0 0 "[ . 1 . 2]" 1
1276 1 84 LEU HB2 1 96 HIS HB2 . . 4.240 3.040 2.441 4.225 . 0 0 "[ . 1 . 2]" 1
1277 1 53 PHE QE 1 109 VAL HB . . 3.540 2.183 2.003 2.456 . 0 0 "[ . 1 . 2]" 1
1278 1 53 PHE QD 1 109 VAL HB . . 4.090 3.106 2.562 3.506 . 0 0 "[ . 1 . 2]" 1
1279 1 109 VAL HB 1 110 LEU MD1 . . 4.940 4.725 4.489 4.928 . 0 0 "[ . 1 . 2]" 1
1280 1 84 LEU HB2 1 96 HIS HB3 . . 4.240 2.213 2.022 2.615 . 0 0 "[ . 1 . 2]" 1
1281 1 84 LEU MD1 1 96 HIS HB3 . . 4.570 2.230 1.977 2.674 . 0 0 "[ . 1 . 2]" 1
1282 1 27 PHE QE 1 96 HIS HB3 . . 4.720 4.431 3.744 4.720 . 19 0 "[ . 1 . 2]" 1
1283 1 28 ILE HA 1 63 GLU HA . . 4.400 3.821 3.476 4.077 . 0 0 "[ . 1 . 2]" 1
1284 1 28 ILE HA 1 28 ILE HG13 . . 4.100 2.915 2.756 3.110 . 0 0 "[ . 1 . 2]" 1
1285 1 28 ILE HA 1 28 ILE HG12 . . 3.710 2.694 2.604 2.839 . 0 0 "[ . 1 . 2]" 1
1286 1 28 ILE HA 1 28 ILE MD . . 4.550 3.889 3.850 3.922 . 0 0 "[ . 1 . 2]" 1
1287 1 28 ILE HA 1 29 LYS HB2 . . 5.210 4.422 4.298 4.833 . 0 0 "[ . 1 . 2]" 1
1288 1 28 ILE HA 1 29 LYS HB3 . . 5.210 4.485 4.129 4.623 . 0 0 "[ . 1 . 2]" 1
1289 1 30 PHE QE 1 73 CYS HA . . 4.380 3.707 3.413 4.138 . 0 0 "[ . 1 . 2]" 1
1290 1 73 CYS HA 1 76 TYR QD . . 4.620 3.064 2.716 3.520 . 0 0 "[ . 1 . 2]" 1
1291 1 73 CYS HA 1 78 VAL HB . . 3.870 3.311 2.854 3.679 . 0 0 "[ . 1 . 2]" 1
1292 1 72 ILE HB 1 73 CYS HA . . 4.950 4.152 3.998 4.241 . 0 0 "[ . 1 . 2]" 1
1293 1 73 CYS HA 1 78 VAL MG1 . . 4.660 4.120 3.852 4.392 . 0 0 "[ . 1 . 2]" 1
1294 1 73 CYS HA 1 78 VAL MG2 . . 3.350 2.313 2.043 2.774 . 0 0 "[ . 1 . 2]" 1
1295 1 9 VAL HA 1 10 LEU H . . 2.790 2.185 2.147 2.238 . 0 0 "[ . 1 . 2]" 1
1296 1 9 VAL HA 1 62 ALA HA . . 4.060 3.851 3.718 4.023 . 0 0 "[ . 1 . 2]" 1
1297 1 9 VAL HA 1 49 SER HB2 . . 4.120 3.678 3.411 3.867 . 0 0 "[ . 1 . 2]" 1
1298 1 9 VAL HA 1 49 SER HB3 . . 4.430 3.348 3.196 3.549 . 0 0 "[ . 1 . 2]" 1
1299 1 9 VAL HA 1 61 ILE HB . . 3.960 3.733 3.542 3.903 . 0 0 "[ . 1 . 2]" 1
1300 1 9 VAL HA 1 10 LEU HB3 . . 5.500 5.618 5.595 5.681 0.181 10 0 "[ . 1 . 2]" 1
1301 1 9 VAL HA 1 10 LEU HB2 . . 5.100 4.310 4.259 4.678 . 0 0 "[ . 1 . 2]" 1
1302 1 9 VAL HA 1 9 VAL MG2 . . 3.170 2.268 2.186 2.364 . 0 0 "[ . 1 . 2]" 1
1303 1 9 VAL HA 1 9 VAL MG1 . . 3.170 2.458 2.335 2.516 . 0 0 "[ . 1 . 2]" 1
1304 1 9 VAL HA 1 62 ALA MB . . 5.480 5.218 5.091 5.366 . 0 0 "[ . 1 . 2]" 1
1305 1 52 GLU HB3 1 53 PHE H . . 4.400 3.276 2.944 4.267 . 0 0 "[ . 1 . 2]" 1
1306 1 52 GLU H 1 52 GLU HB3 . . 4.040 3.770 3.511 3.939 . 0 0 "[ . 1 . 2]" 1
1307 1 51 LYS HA 1 52 GLU HB3 . . 5.500 5.562 5.507 5.591 0.091 12 0 "[ . 1 . 2]" 1
1308 1 52 GLU HB2 1 54 PRO HD3 . . 4.790 3.802 2.968 4.690 . 0 0 "[ . 1 . 2]" 1
1309 1 52 GLU HB2 1 53 PHE H . . 4.640 4.036 3.663 4.446 . 0 0 "[ . 1 . 2]" 1
1310 1 78 VAL HB 1 83 THR HB . . 5.500 5.037 4.773 5.350 . 0 0 "[ . 1 . 2]" 1
1311 1 108 PHE HA 1 108 PHE QD . . 3.390 2.955 2.704 3.188 . 0 0 "[ . 1 . 2]" 1
1312 1 63 GLU HA 1 64 VAL HA . . 4.830 4.484 4.432 4.567 . 0 0 "[ . 1 . 2]" 1
1313 1 106 HIS HA 1 108 PHE H . . 5.230 4.416 3.666 4.693 . 0 0 "[ . 1 . 2]" 1
1314 1 106 HIS HA 1 110 LEU H . . 5.010 4.285 4.088 4.519 . 0 0 "[ . 1 . 2]" 1
1315 1 53 PHE QD 1 106 HIS HA . . 5.120 4.428 3.882 4.802 . 0 0 "[ . 1 . 2]" 1
1316 1 105 LEU HB2 1 106 HIS HA . . 5.500 4.380 4.150 4.588 . 0 0 "[ . 1 . 2]" 1
1317 1 48 LEU MD1 1 106 HIS HA . . 3.200 2.718 2.412 2.874 . 0 0 "[ . 1 . 2]" 1
1318 1 106 HIS HA 1 110 LEU MD1 . . 5.170 3.919 3.637 4.320 . 0 0 "[ . 1 . 2]" 1
1319 1 105 LEU HB3 1 106 HIS HA . . 5.180 4.284 4.105 4.537 . 0 0 "[ . 1 . 2]" 1
1320 1 106 HIS HA 1 110 LEU HG . . 5.500 4.113 3.837 4.479 . 0 0 "[ . 1 . 2]" 1
1321 1 64 VAL HA 1 65 ASP H . . 2.860 2.161 2.140 2.193 . 0 0 "[ . 1 . 2]" 1
1322 1 31 TYR QE 1 64 VAL HA . . 5.250 4.970 4.649 5.261 0.011 20 0 "[ . 1 . 2]" 1
1323 1 64 VAL HA 1 64 VAL MG1 . . 3.210 2.440 2.369 2.524 . 0 0 "[ . 1 . 2]" 1
1324 1 64 VAL HA 1 64 VAL MG2 . . 3.390 2.284 2.157 2.385 . 0 0 "[ . 1 . 2]" 1
1325 1 53 PHE QE 1 106 HIS HA . . 3.640 2.885 2.360 3.260 . 0 0 "[ . 1 . 2]" 1
1326 1 106 HIS HA 1 106 HIS HD2 . . 3.680 2.573 2.357 2.765 . 0 0 "[ . 1 . 2]" 1
1327 1 48 LEU MD2 1 106 HIS HA . . 4.820 4.454 4.194 4.711 . 0 0 "[ . 1 . 2]" 1
1328 1 106 HIS HA 1 109 VAL MG1 . . 5.460 4.798 4.447 5.197 . 0 0 "[ . 1 . 2]" 1
1329 1 49 SER HA 1 49 SER HB2 . . 3.010 2.359 2.331 2.389 . 0 0 "[ . 1 . 2]" 1
1330 1 49 SER HA 1 61 ILE HB . . 3.480 2.570 2.193 2.989 . 0 0 "[ . 1 . 2]" 1
1331 1 49 SER HA 1 61 ILE HG12 . . 3.460 2.628 2.282 2.997 . 0 0 "[ . 1 . 2]" 1
1332 1 49 SER HA 1 61 ILE HG13 . . 3.060 2.092 1.993 2.421 . 0 0 "[ . 1 . 2]" 1
1333 1 77 SER H 1 77 SER HB2 . . 4.110 3.208 2.791 3.941 . 0 0 "[ . 1 . 2]" 1
1334 1 77 SER H 1 77 SER HB3 . . 4.110 3.636 2.865 4.031 . 0 0 "[ . 1 . 2]" 1
1335 1 107 ARG H 1 107 ARG HB3 . . 3.650 2.468 2.351 2.718 . 0 0 "[ . 1 . 2]" 1
1336 1 8 THR HA 1 49 SER HB2 . . 5.350 3.792 3.561 4.052 . 0 0 "[ . 1 . 2]" 1
1337 1 8 THR HA 1 46 GLU HB3 . . 4.960 3.838 3.349 4.242 . 0 0 "[ . 1 . 2]" 1
1338 1 70 ARG QB 1 74 SER H . . 5.310 3.875 3.543 4.155 . 0 0 "[ . 1 . 2]" 1
1339 1 69 GLU HA 1 70 ARG QB . . 5.060 4.699 4.437 5.159 0.099 10 0 "[ . 1 . 2]" 1
1340 1 8 THR HA 1 49 SER HG . . 5.000 2.062 1.996 2.237 . 0 0 "[ . 1 . 2]" 1
1341 1 111 SER HA 1 113 ALA H . . 5.120 4.836 4.341 5.109 . 0 0 "[ . 1 . 2]" 1
1342 1 110 LEU HB2 1 111 SER HA . . 5.190 4.501 4.377 4.652 . 0 0 "[ . 1 . 2]" 1
1343 1 111 SER HA 1 114 LYS HG2 . . 5.500 4.562 1.988 5.498 . 0 0 "[ . 1 . 2]" 1
1344 1 111 SER HA 1 114 LYS HG3 . . 5.500 4.715 2.655 5.491 . 0 0 "[ . 1 . 2]" 1
1345 1 72 ILE HA 1 75 LYS HD3 . . 4.970 4.395 3.588 4.995 0.025 20 0 "[ . 1 . 2]" 1
1346 1 34 TRP HE3 1 35 CYS HA . . 3.400 2.804 2.184 3.352 . 0 0 "[ . 1 . 2]" 1
1347 1 32 ALA MB 1 35 CYS HA . . 5.120 4.172 3.792 4.458 . 0 0 "[ . 1 . 2]" 1
1348 1 39 LYS HA 1 39 LYS HG3 . . 3.700 2.637 2.163 3.392 . 0 0 "[ . 1 . 2]" 1
1349 1 35 CYS HB2 1 38 CYS H . . 5.160 4.526 4.244 4.784 . 0 0 "[ . 1 . 2]" 1
1350 1 14 GLU HB2 1 15 ASN H . . 4.720 3.870 3.331 4.506 . 0 0 "[ . 1 . 2]" 1
1351 1 14 GLU H 1 14 GLU HB3 . . 3.650 3.087 2.756 3.587 . 0 0 "[ . 1 . 2]" 1
1352 1 14 GLU HB3 1 72 ILE MD . . 4.700 4.261 3.872 4.517 . 0 0 "[ . 1 . 2]" 1
1353 1 32 ALA MB 1 35 CYS HB3 . . 4.100 3.244 2.563 3.633 . 0 0 "[ . 1 . 2]" 1
1354 1 84 LEU MD1 1 100 ARG HG3 . . 4.310 3.840 3.015 4.335 0.025 17 0 "[ . 1 . 2]" 1
1355 1 35 CYS HA 1 36 GLY HA3 . . 4.640 4.401 4.377 4.437 . 0 0 "[ . 1 . 2]" 1
1356 1 45 TRP HA 1 48 LEU H . . 3.830 3.701 3.462 3.821 . 0 0 "[ . 1 . 2]" 1
1357 1 45 TRP HA 1 47 GLU H . . 5.030 4.742 4.379 4.967 . 0 0 "[ . 1 . 2]" 1
1358 1 45 TRP HA 1 45 TRP HE3 . . 3.300 2.211 1.998 2.367 . 0 0 "[ . 1 . 2]" 1
1359 1 45 TRP HA 1 45 TRP HZ3 . . 5.080 4.427 4.244 4.544 . 0 0 "[ . 1 . 2]" 1
1360 1 45 TRP HA 1 48 LEU HB2 . . 3.720 3.351 3.060 3.573 . 0 0 "[ . 1 . 2]" 1
1361 1 45 TRP HA 1 105 LEU MD1 . . 4.100 3.398 3.087 3.670 . 0 0 "[ . 1 . 2]" 1
1362 1 45 TRP HA 1 48 LEU MD2 . . 3.960 3.527 3.286 3.836 . 0 0 "[ . 1 . 2]" 1
1363 1 44 THR HB 1 45 TRP HA . . 4.930 4.156 4.011 4.322 . 0 0 "[ . 1 . 2]" 1
1364 1 39 LYS HA 1 39 LYS HG2 . . 3.700 2.997 2.378 3.612 . 0 0 "[ . 1 . 2]" 1
1365 1 41 LEU HG 1 45 TRP HB3 . . 4.600 4.105 3.777 4.501 . 0 0 "[ . 1 . 2]" 1
1366 1 9 VAL MG2 1 45 TRP HB3 . . 4.710 3.342 2.787 3.690 . 0 0 "[ . 1 . 2]" 1
1367 1 42 ALA HA 1 45 TRP HB3 . . 4.030 3.967 3.648 4.068 0.038 18 0 "[ . 1 . 2]" 1
1368 1 34 TRP HB2 1 34 TRP HE3 . . 3.730 2.701 2.600 2.808 . 0 0 "[ . 1 . 2]" 1
1369 1 29 LYS QG 1 45 TRP HB2 . . 5.270 4.014 3.376 5.276 0.006 18 0 "[ . 1 . 2]" 1
1370 1 44 THR H 1 45 TRP HB2 . . 5.190 5.013 4.766 5.170 . 0 0 "[ . 1 . 2]" 1
1371 1 41 LEU HA 1 45 TRP HB2 . . 5.500 4.871 4.659 5.076 . 0 0 "[ . 1 . 2]" 1
1372 1 41 LEU HG 1 45 TRP HB2 . . 3.850 2.528 2.266 2.831 . 0 0 "[ . 1 . 2]" 1
1373 1 9 VAL MG2 1 45 TRP HB2 . . 5.270 4.678 4.157 5.026 . 0 0 "[ . 1 . 2]" 1
1374 1 46 GLU HB2 1 47 GLU H . . 3.900 2.470 2.305 2.667 . 0 0 "[ . 1 . 2]" 1
1375 1 46 GLU HB3 1 47 GLU H . . 3.870 3.197 2.982 3.492 . 0 0 "[ . 1 . 2]" 1
1376 1 47 GLU H 1 47 GLU HB3 . . 4.200 3.594 3.538 3.608 . 0 0 "[ . 1 . 2]" 1
1377 1 46 GLU HB3 1 49 SER H . . 5.500 5.210 5.004 5.450 . 0 0 "[ . 1 . 2]" 1
1378 1 47 GLU HB3 1 50 LYS H . . 5.500 5.146 4.926 5.421 . 0 0 "[ . 1 . 2]" 1
1379 1 47 GLU HB3 1 48 LEU H . . 3.940 3.542 3.292 3.769 . 0 0 "[ . 1 . 2]" 1
1380 1 44 THR HA 1 47 GLU HB3 . . 4.650 4.517 4.239 4.652 0.002 17 0 "[ . 1 . 2]" 1
1381 1 47 GLU HB3 1 102 LEU HG . . 5.500 4.582 4.127 5.036 . 0 0 "[ . 1 . 2]" 1
1382 1 44 THR MG 1 47 GLU HB3 . . 5.060 4.784 4.506 5.014 . 0 0 "[ . 1 . 2]" 1
1383 1 84 LEU MD1 1 100 ARG HG2 . . 4.310 2.584 1.890 3.876 . 0 0 "[ . 1 . 2]" 1
1384 1 100 ARG HA 1 100 ARG HG2 . . 4.100 2.571 2.337 4.192 0.092 6 0 "[ . 1 . 2]" 1
1385 1 41 LEU MD1 1 100 ARG HG2 . . 5.170 4.063 3.032 4.897 . 0 0 "[ . 1 . 2]" 1
1386 1 39 LYS H 1 39 LYS QD . . 5.120 2.997 1.939 4.158 . 0 0 "[ . 1 . 2]" 1
1387 1 36 GLY HA3 1 39 LYS QD . . 4.860 3.763 2.911 4.826 . 0 0 "[ . 1 . 2]" 1
1388 1 39 LYS HA 1 39 LYS QD . . 5.050 3.566 2.748 4.202 . 0 0 "[ . 1 . 2]" 1
1389 1 50 LYS HB3 1 50 LYS HD2 . . 3.880 3.106 2.894 3.322 . 0 0 "[ . 1 . 2]" 1
1390 1 50 LYS HB3 1 50 LYS HD3 . . 3.880 2.758 2.585 2.927 . 0 0 "[ . 1 . 2]" 1
1391 1 41 LEU MD1 1 100 ARG HG3 . . 5.170 4.626 3.837 5.044 . 0 0 "[ . 1 . 2]" 1
1392 1 29 LYS HB2 1 45 TRP HE1 . . 4.660 3.988 3.418 4.263 . 0 0 "[ . 1 . 2]" 1
1393 1 13 THR HA 1 14 GLU HA . . 4.700 4.304 4.296 4.337 . 0 0 "[ . 1 . 2]" 1
1394 1 14 GLU HA 1 15 ASN HA . . 5.130 4.590 4.409 4.633 . 0 0 "[ . 1 . 2]" 1
1395 1 14 GLU HA 1 17 PHE QB . . 3.830 2.686 2.512 2.927 . 0 0 "[ . 1 . 2]" 1
1396 1 14 GLU HA 1 14 GLU HG2 . . 4.020 2.639 2.187 3.683 . 0 0 "[ . 1 . 2]" 1
1397 1 14 GLU HA 1 14 GLU HG3 . . 4.020 3.035 2.179 3.637 . 0 0 "[ . 1 . 2]" 1
1398 1 14 GLU HA 1 72 ILE HG12 . . 4.330 3.818 3.343 4.139 . 0 0 "[ . 1 . 2]" 1
1399 1 14 GLU HA 1 72 ILE MD . . 3.190 2.413 2.000 2.736 . 0 0 "[ . 1 . 2]" 1
1400 1 14 GLU HA 1 72 ILE HG13 . . 4.180 3.990 3.588 4.163 . 0 0 "[ . 1 . 2]" 1
1401 1 47 GLU HA 1 50 LYS H . . 3.820 3.535 3.315 3.733 . 0 0 "[ . 1 . 2]" 1
1402 1 47 GLU HA 1 49 SER HG . . 5.220 4.792 4.532 5.153 . 0 0 "[ . 1 . 2]" 1
1403 1 47 GLU HA 1 47 GLU HG3 . . 3.920 3.577 2.768 3.798 . 0 0 "[ . 1 . 2]" 1
1404 1 47 GLU HA 1 50 LYS HG2 . . 5.180 4.840 4.637 5.134 . 0 0 "[ . 1 . 2]" 1
1405 1 47 GLU HA 1 102 LEU MD1 . . 4.540 4.025 3.694 4.363 . 0 0 "[ . 1 . 2]" 1
1406 1 47 GLU HA 1 102 LEU MD2 . . 5.070 4.524 4.149 4.890 . 0 0 "[ . 1 . 2]" 1
1407 1 9 VAL MG2 1 46 GLU HB2 . . 4.430 4.121 3.935 4.453 0.023 15 0 "[ . 1 . 2]" 1
1408 1 46 GLU H 1 46 GLU HB3 . . 3.680 3.560 3.507 3.595 . 0 0 "[ . 1 . 2]" 1
1409 1 43 PRO HA 1 46 GLU HB3 . . 5.500 4.558 4.353 4.812 . 0 0 "[ . 1 . 2]" 1
1410 1 91 LYS H 1 91 LYS QD . . 5.130 4.425 3.552 5.128 . 0 0 "[ . 1 . 2]" 1
1411 1 111 SER HA 1 114 LYS QD . . 4.750 3.863 1.985 4.752 0.002 17 0 "[ . 1 . 2]" 1
1412 1 114 LYS HA 1 114 LYS QD . . 4.900 3.377 1.994 4.452 . 0 0 "[ . 1 . 2]" 1
1413 1 70 ARG HA 1 74 SER H . . 4.300 3.313 2.911 3.696 . 0 0 "[ . 1 . 2]" 1
1414 1 70 ARG HA 1 72 ILE H . . 4.840 4.255 3.879 4.843 0.003 6 0 "[ . 1 . 2]" 1
1415 1 66 CYS HA 1 70 ARG HA . . 4.460 3.155 2.465 3.531 . 0 0 "[ . 1 . 2]" 1
1416 1 70 ARG HA 1 70 ARG QD . . 4.310 3.533 2.210 4.166 . 0 0 "[ . 1 . 2]" 1
1417 1 66 CYS HB3 1 70 ARG HA . . 5.030 4.255 3.674 4.637 . 0 0 "[ . 1 . 2]" 1
1418 1 70 ARG HA 1 73 CYS HB3 . . 4.510 3.799 3.599 4.142 . 0 0 "[ . 1 . 2]" 1
1419 1 107 ARG HA 1 111 SER H . . 4.740 4.148 3.783 4.575 . 0 0 "[ . 1 . 2]" 1
1420 1 107 ARG HA 1 109 VAL H . . 5.040 4.758 4.350 5.040 . 0 0 "[ . 1 . 2]" 1
1421 1 106 HIS HB3 1 107 ARG HA . . 4.830 4.062 3.873 4.228 . 0 0 "[ . 1 . 2]" 1
1422 1 107 ARG HA 1 110 LEU HB2 . . 2.910 2.392 2.137 2.618 . 0 0 "[ . 1 . 2]" 1
1423 1 107 ARG HA 1 110 LEU HB3 . . 4.190 3.928 3.681 4.179 . 0 0 "[ . 1 . 2]" 1
1424 1 8 THR HA 1 46 GLU HA . . 4.850 3.898 3.394 4.210 . 0 0 "[ . 1 . 2]" 1
1425 1 75 LYS HA 1 76 TYR HA . . 5.440 4.617 4.592 4.650 . 0 0 "[ . 1 . 2]" 1
1426 1 46 GLU HA 1 48 LEU H . . 4.680 4.328 4.060 4.496 . 0 0 "[ . 1 . 2]" 1
1427 1 46 GLU HA 1 49 SER H . . 3.860 3.496 3.318 3.647 . 0 0 "[ . 1 . 2]" 1
1428 1 46 GLU HA 1 49 SER HG . . 3.260 2.777 2.303 3.178 . 0 0 "[ . 1 . 2]" 1
1429 1 46 GLU HA 1 49 SER HB3 . . 3.940 3.233 3.048 3.375 . 0 0 "[ . 1 . 2]" 1
1430 1 46 GLU HA 1 46 GLU HG2 . . 3.930 2.672 2.310 3.668 . 0 0 "[ . 1 . 2]" 1
1431 1 46 GLU HA 1 46 GLU HG3 . . 3.930 2.754 2.459 3.696 . 0 0 "[ . 1 . 2]" 1
1432 1 102 LEU HA 1 105 LEU HB2 . . 3.590 3.082 2.580 3.502 . 0 0 "[ . 1 . 2]" 1
1433 1 32 ALA H 1 38 CYS HB3 . . 4.870 3.497 2.688 4.163 . 0 0 "[ . 1 . 2]" 1
1434 1 25 ILE HG12 1 59 VAL HA . . 5.500 5.494 5.465 5.510 0.010 12 0 "[ . 1 . 2]" 1
1435 1 29 LYS HD2 1 45 TRP HB2 . . 5.500 5.023 3.688 5.507 0.007 14 0 "[ . 1 . 2]" 1
1436 1 29 LYS HD3 1 45 TRP HB2 . . 5.500 4.246 2.645 4.968 . 0 0 "[ . 1 . 2]" 1
1437 1 102 LEU HA 1 102 LEU MD1 . . 3.200 2.291 1.984 2.464 . 0 0 "[ . 1 . 2]" 1
1438 1 25 ILE HG13 1 88 ARG HA . . 5.090 4.026 3.544 4.438 . 0 0 "[ . 1 . 2]" 1
1439 1 25 ILE HG13 1 26 THR H . . 5.500 4.923 4.823 5.077 . 0 0 "[ . 1 . 2]" 1
1440 1 25 ILE HG13 1 89 GLY H . . 5.500 4.927 4.017 5.399 . 0 0 "[ . 1 . 2]" 1
1441 1 25 ILE H 1 25 ILE HG13 . . 4.080 2.317 2.107 2.498 . 0 0 "[ . 1 . 2]" 1
1442 1 25 ILE HA 1 25 ILE HG13 . . 3.990 2.897 2.779 3.082 . 0 0 "[ . 1 . 2]" 1
1443 1 112 GLN H 1 112 GLN HB3 . . 3.870 3.559 3.500 3.591 . 0 0 "[ . 1 . 2]" 1
1444 1 109 VAL MG2 1 112 GLN HB3 . . 5.380 5.160 4.754 5.377 . 0 0 "[ . 1 . 2]" 1
1445 1 26 THR MG 1 60 LYS HD2 . . 4.500 3.678 3.202 4.018 . 0 0 "[ . 1 . 2]" 1
1446 1 60 LYS HB3 1 60 LYS HD2 . . 3.520 2.522 2.324 2.722 . 0 0 "[ . 1 . 2]" 1
1447 1 25 ILE HA 1 25 ILE HG12 . . 3.960 2.654 2.523 2.772 . 0 0 "[ . 1 . 2]" 1
1448 1 25 ILE HG12 1 88 ARG HB3 . . 4.520 4.299 3.887 4.521 0.001 6 0 "[ . 1 . 2]" 1
1449 1 25 ILE HG12 1 113 ALA MB . . 4.790 4.006 3.567 4.457 . 0 0 "[ . 1 . 2]" 1
1450 1 25 ILE HG12 1 25 ILE MG . . 3.060 2.238 2.089 2.359 . 0 0 "[ . 1 . 2]" 1
1451 1 12 LEU HG 1 28 ILE HG12 . . 4.960 4.207 3.714 4.666 . 0 0 "[ . 1 . 2]" 1
1452 1 102 LEU HA 1 105 LEU H . . 4.410 3.830 3.641 4.156 . 0 0 "[ . 1 . 2]" 1
1453 1 101 ASP HA 1 102 LEU HA . . 5.140 4.297 4.291 4.312 . 0 0 "[ . 1 . 2]" 1
1454 1 93 VAL MG1 1 112 GLN HB2 . . 4.950 4.373 3.792 4.950 . 0 0 "[ . 1 . 2]" 1
1455 1 28 ILE HG13 1 87 PHE QD . . 4.240 3.363 2.566 4.120 . 0 0 "[ . 1 . 2]" 1
1456 1 41 LEU HG 1 45 TRP HA . . 5.360 3.950 3.728 4.331 . 0 0 "[ . 1 . 2]" 1
1457 1 69 GLU HB3 1 72 ILE HG13 . . 4.370 3.048 2.544 3.397 . 0 0 "[ . 1 . 2]" 1
1458 1 112 GLN HB3 1 113 ALA H . . 4.470 3.093 2.753 3.624 . 0 0 "[ . 1 . 2]" 1
1459 1 60 LYS HA 1 60 LYS HD2 . . 4.730 4.449 4.327 4.574 . 0 0 "[ . 1 . 2]" 1
1460 1 60 LYS H 1 60 LYS HD2 . . 5.250 4.810 4.455 5.230 . 0 0 "[ . 1 . 2]" 1
1461 1 17 PHE QD 1 72 ILE HG12 . . 5.450 4.216 3.901 4.510 . 0 0 "[ . 1 . 2]" 1
1462 1 17 PHE QE 1 72 ILE HG12 . . 5.500 4.540 4.237 4.949 . 0 0 "[ . 1 . 2]" 1
1463 1 69 GLU HB3 1 72 ILE HG12 . . 5.050 4.448 4.075 4.839 . 0 0 "[ . 1 . 2]" 1
1464 1 72 ILE HG12 1 72 ILE MG . . 3.590 2.291 2.098 2.458 . 0 0 "[ . 1 . 2]" 1
1465 1 41 LEU HA 1 41 LEU MD2 . . 4.620 3.900 3.868 3.956 . 0 0 "[ . 1 . 2]" 1
1466 1 41 LEU MD2 1 44 THR HB . . 5.140 4.345 4.080 4.659 . 0 0 "[ . 1 . 2]" 1
1467 1 41 LEU MD2 1 45 TRP HB2 . . 4.550 3.286 2.704 3.867 . 0 0 "[ . 1 . 2]" 1
1468 1 41 LEU MD2 1 82 PRO HB3 . . 3.950 2.566 2.263 3.049 . 0 0 "[ . 1 . 2]" 1
1469 1 41 LEU HB3 1 41 LEU MD2 . . 3.600 2.176 1.995 2.328 . 0 0 "[ . 1 . 2]" 1
1470 1 41 LEU MD2 1 84 LEU MD1 . . 4.200 3.127 2.677 3.661 . 0 0 "[ . 1 . 2]" 1
1471 1 17 PHE QE 1 28 ILE HG12 . . 5.050 4.253 3.514 4.713 . 0 0 "[ . 1 . 2]" 1
1472 1 28 ILE HG12 1 62 ALA MB . . 3.540 2.657 2.045 3.022 . 0 0 "[ . 1 . 2]" 1
1473 1 76 TYR HA 1 78 VAL MG2 . . 5.500 3.900 3.670 4.123 . 0 0 "[ . 1 . 2]" 1
1474 1 17 PHE QB 1 72 ILE HG12 . . 5.110 4.027 3.732 4.276 . 0 0 "[ . 1 . 2]" 1
1475 1 54 PRO HG2 1 110 LEU MD1 . . 5.150 4.500 4.214 4.789 . 0 0 "[ . 1 . 2]" 1
1476 1 31 TYR QE 1 33 PRO HG2 . . 5.410 5.310 5.133 5.400 . 0 0 "[ . 1 . 2]" 1
1477 1 33 PRO HG2 1 34 TRP H . . 4.300 3.286 2.551 3.400 . 0 0 "[ . 1 . 2]" 1
1478 1 32 ALA MB 1 33 PRO HG2 . . 5.080 4.243 4.065 4.459 . 0 0 "[ . 1 . 2]" 1
1479 1 31 TYR QE 1 33 PRO HG3 . . 4.650 4.637 4.461 4.683 0.033 18 0 "[ . 1 . 2]" 1
1480 1 33 PRO HG3 1 34 TRP H . . 4.920 4.571 4.016 4.658 . 0 0 "[ . 1 . 2]" 1
1481 1 33 PRO HG3 1 67 THR MG . . 4.720 2.800 2.423 3.333 . 0 0 "[ . 1 . 2]" 1
1482 1 54 PRO HG3 1 110 LEU MD1 . . 5.150 4.918 4.718 5.128 . 0 0 "[ . 1 . 2]" 1
1483 1 41 LEU HG 1 45 TRP H . . 4.910 2.830 2.295 3.394 . 0 0 "[ . 1 . 2]" 1
1484 1 41 LEU H 1 41 LEU HG . . 5.120 4.494 4.387 4.543 . 0 0 "[ . 1 . 2]" 1
1485 1 41 LEU HG 1 44 THR H . . 5.500 4.578 4.061 5.005 . 0 0 "[ . 1 . 2]" 1
1486 1 51 LYS HA 1 51 LYS HD2 . . 3.720 2.095 2.000 2.264 . 0 0 "[ . 1 . 2]" 1
1487 1 48 LEU HA 1 51 LYS HD2 . . 5.220 4.807 4.446 5.137 . 0 0 "[ . 1 . 2]" 1
1488 1 51 LYS HD2 1 102 LEU MD1 . . 4.360 3.886 3.432 4.355 . 0 0 "[ . 1 . 2]" 1
1489 1 51 LYS HA 1 51 LYS HD3 . . 3.720 3.586 3.474 3.705 . 0 0 "[ . 1 . 2]" 1
1490 1 48 LEU HA 1 51 LYS HD3 . . 5.220 4.222 3.482 4.699 . 0 0 "[ . 1 . 2]" 1
1491 1 51 LYS HD3 1 102 LEU MD1 . . 4.360 2.532 2.063 3.074 . 0 0 "[ . 1 . 2]" 1
1492 1 103 ASP HA 1 106 HIS H . . 3.980 3.205 3.027 3.420 . 0 0 "[ . 1 . 2]" 1
1493 1 102 LEU HA 1 103 ASP HA . . 4.930 4.748 4.663 4.792 . 0 0 "[ . 1 . 2]" 1
1494 1 103 ASP HA 1 106 HIS HB3 . . 3.530 3.033 2.706 3.292 . 0 0 "[ . 1 . 2]" 1
1495 1 103 ASP HA 1 106 HIS HB2 . . 4.000 3.207 2.877 3.578 . 0 0 "[ . 1 . 2]" 1
1496 1 102 LEU HB3 1 103 ASP HA . . 4.880 4.510 4.402 4.591 . 0 0 "[ . 1 . 2]" 1
1497 1 102 LEU HG 1 103 ASP HA . . 4.430 3.189 3.018 3.562 . 0 0 "[ . 1 . 2]" 1
1498 1 102 LEU MD2 1 103 ASP HA . . 5.230 4.562 4.379 4.961 . 0 0 "[ . 1 . 2]" 1
1499 1 105 LEU HA 1 109 VAL MG2 . . 4.950 4.318 3.955 4.759 . 0 0 "[ . 1 . 2]" 1
1500 1 76 TYR H 1 77 SER HA . . 5.150 4.677 4.609 4.748 . 0 0 "[ . 1 . 2]" 1
1501 1 77 SER HA 1 78 VAL MG2 . . 5.070 4.440 4.225 4.629 . 0 0 "[ . 1 . 2]" 1
1502 1 74 SER HA 1 77 SER HA . . 4.140 3.641 3.475 3.779 . 0 0 "[ . 1 . 2]" 1
1503 1 77 SER HA 1 78 VAL HB . . 5.500 5.182 5.026 5.367 . 0 0 "[ . 1 . 2]" 1
1504 1 86 LEU H 1 86 LEU HG . . 4.990 4.460 4.346 4.526 . 0 0 "[ . 1 . 2]" 1
1505 1 86 LEU HG 1 87 PHE QD . . 5.500 4.855 4.395 5.231 . 0 0 "[ . 1 . 2]" 1
1506 1 86 LEU HG 1 108 PHE QE . . 5.500 4.878 4.448 5.223 . 0 0 "[ . 1 . 2]" 1
1507 1 86 LEU HA 1 86 LEU HG . . 3.770 2.962 2.831 3.061 . 0 0 "[ . 1 . 2]" 1
1508 1 27 PHE HD2 1 48 LEU MD2 . . 3.520 2.225 1.959 2.920 . 0 0 "[ . 1 . 2]" 1
1509 1 48 LEU HB3 1 48 LEU MD2 . . 3.430 2.282 2.112 2.399 . 0 0 "[ . 1 . 2]" 1
1510 1 48 LEU MD2 1 105 LEU HB3 . . 3.470 2.366 2.048 2.745 . 0 0 "[ . 1 . 2]" 1
1511 1 48 LEU HB2 1 48 LEU MD2 . . 3.480 2.383 2.271 2.548 . 0 0 "[ . 1 . 2]" 1
1512 1 48 LEU MD2 1 109 VAL MG2 . . 4.070 3.304 2.984 3.512 . 0 0 "[ . 1 . 2]" 1
1513 1 18 ASP HA 1 20 THR H . . 4.910 4.406 3.797 4.857 . 0 0 "[ . 1 . 2]" 1
1514 1 17 PHE QD 1 18 ASP HA . . 3.600 2.724 2.426 2.958 . 0 0 "[ . 1 . 2]" 1
1515 1 17 PHE QB 1 18 ASP HA . . 4.870 4.403 4.283 4.524 . 0 0 "[ . 1 . 2]" 1
1516 1 18 ASP HA 1 22 ALA MB . . 4.950 4.483 4.284 4.721 . 0 0 "[ . 1 . 2]" 1
1517 1 18 ASP HA 1 21 ILE QG . . 2.980 2.116 1.968 2.454 . 0 0 "[ . 1 . 2]" 1
1518 1 18 ASP HA 1 21 ILE MD . . 3.780 2.300 1.992 2.694 . 0 0 "[ . 1 . 2]" 1
1519 1 27 PHE QE 1 105 LEU HA . . 4.820 4.490 4.023 4.806 . 0 0 "[ . 1 . 2]" 1
1520 1 96 HIS HD2 1 105 LEU HA . . 4.870 2.913 2.331 3.523 . 0 0 "[ . 1 . 2]" 1
1521 1 105 LEU HA 1 108 PHE HB2 . . 4.160 3.428 3.143 3.656 . 0 0 "[ . 1 . 2]" 1
1522 1 105 LEU HA 1 108 PHE HB3 . . 4.160 2.779 2.285 3.148 . 0 0 "[ . 1 . 2]" 1
1523 1 105 LEU HA 1 105 LEU HG . . 3.780 2.857 2.669 3.019 . 0 0 "[ . 1 . 2]" 1
1524 1 105 LEU HA 1 105 LEU MD2 . . 2.950 2.248 2.018 2.446 . 0 0 "[ . 1 . 2]" 1
1525 1 48 LEU MD2 1 105 LEU HA . . 4.800 4.464 4.192 4.765 . 0 0 "[ . 1 . 2]" 1
1526 1 47 GLU HB2 1 48 LEU HA . . 5.120 4.295 4.121 4.600 . 0 0 "[ . 1 . 2]" 1
1527 1 70 ARG H 1 70 ARG HG2 . . 3.790 3.026 1.986 3.921 0.131 3 0 "[ . 1 . 2]" 1
1528 1 67 THR HA 1 70 ARG HG2 . . 5.170 3.599 2.761 4.750 . 0 0 "[ . 1 . 2]" 1
1529 1 67 THR HA 1 70 ARG HG3 . . 5.170 3.567 2.622 5.201 0.031 13 0 "[ . 1 . 2]" 1
1530 1 117 LEU H 1 117 LEU HG . . 4.550 3.578 2.429 4.527 . 0 0 "[ . 1 . 2]" 1
1531 1 83 THR HA 1 84 LEU HG . . 4.620 3.396 3.184 3.640 . 0 0 "[ . 1 . 2]" 1
1532 1 88 ARG HA 1 88 ARG HG3 . . 4.060 2.509 2.261 3.045 . 0 0 "[ . 1 . 2]" 1
1533 1 25 ILE HA 1 86 LEU HG . . 5.500 5.074 4.837 5.329 . 0 0 "[ . 1 . 2]" 1
1534 1 42 ALA HA 1 46 GLU H . . 5.220 5.018 4.829 5.212 . 0 0 "[ . 1 . 2]" 1
1535 1 110 LEU HA 1 112 GLN H . . 4.900 4.658 4.061 4.900 . 0 0 "[ . 1 . 2]" 1
1536 1 53 PHE HB3 1 110 LEU HA . . 5.120 4.409 3.916 4.881 . 0 0 "[ . 1 . 2]" 1
1537 1 48 LEU HA 1 48 LEU HG . . 3.540 2.996 2.875 3.091 . 0 0 "[ . 1 . 2]" 1
1538 1 56 LEU MD1 1 110 LEU HA . . 3.280 1.913 1.788 2.188 . 0 0 "[ . 1 . 2]" 1
1539 1 48 LEU HA 1 48 LEU MD2 . . 4.280 3.861 3.804 3.892 . 0 0 "[ . 1 . 2]" 1
1540 1 53 PHE QD 1 110 LEU HA . . 4.880 3.826 3.500 4.211 . 0 0 "[ . 1 . 2]" 1
1541 1 47 GLU HB3 1 48 LEU HA . . 4.790 4.340 4.071 4.504 . 0 0 "[ . 1 . 2]" 1
1542 1 109 VAL HB 1 110 LEU HA . . 5.120 4.246 4.148 4.390 . 0 0 "[ . 1 . 2]" 1
1543 1 48 LEU HA 1 51 LYS HG2 . . 3.370 2.442 2.089 2.852 . 0 0 "[ . 1 . 2]" 1
1544 1 110 LEU HA 1 110 LEU HG . . 3.800 2.834 2.750 2.934 . 0 0 "[ . 1 . 2]" 1
1545 1 14 GLU H 1 69 GLU HB3 . . 5.500 4.934 4.569 5.336 . 0 0 "[ . 1 . 2]" 1
1546 1 69 GLU HB3 1 71 ASN H . . 5.500 4.832 3.977 5.231 . 0 0 "[ . 1 . 2]" 1
1547 1 13 THR HA 1 69 GLU HB3 . . 5.500 5.077 4.823 5.447 . 0 0 "[ . 1 . 2]" 1
1548 1 66 CYS HA 1 69 GLU HB3 . . 5.500 5.390 5.081 5.514 0.014 19 0 "[ . 1 . 2]" 1
1549 1 64 VAL MG1 1 69 GLU HB3 . . 3.810 2.863 2.525 3.408 . 0 0 "[ . 1 . 2]" 1
1550 1 10 LEU HG 1 61 ILE H . . 5.500 5.098 3.305 5.507 0.007 19 0 "[ . 1 . 2]" 1
1551 1 85 LEU HG 1 86 LEU H . . 5.500 4.930 4.708 5.075 . 0 0 "[ . 1 . 2]" 1
1552 1 10 LEU H 1 10 LEU HG . . 3.880 3.664 2.194 3.915 0.035 20 0 "[ . 1 . 2]" 1
1553 1 10 LEU HG 1 62 ALA HA . . 4.940 4.694 3.607 4.944 0.004 3 0 "[ . 1 . 2]" 1
1554 1 66 CYS HA 1 69 GLU HB2 . . 4.620 4.262 3.913 4.598 . 0 0 "[ . 1 . 2]" 1
1555 1 10 LEU HA 1 10 LEU HG . . 3.990 2.352 2.234 3.107 . 0 0 "[ . 1 . 2]" 1
1556 1 9 VAL HA 1 10 LEU HG . . 5.370 5.080 3.739 5.391 0.021 18 0 "[ . 1 . 2]" 1
1557 1 69 GLU HB2 1 72 ILE MD . . 4.280 3.456 2.976 3.975 . 0 0 "[ . 1 . 2]" 1
1558 1 30 PHE QE 1 85 LEU HG . . 3.980 3.291 2.651 3.894 . 0 0 "[ . 1 . 2]" 1
1559 1 48 LEU MD2 1 61 ILE HG12 . . 4.790 4.233 3.925 4.695 . 0 0 "[ . 1 . 2]" 1
1560 1 27 PHE HB3 1 61 ILE HG12 . . 5.330 4.569 4.341 4.780 . 0 0 "[ . 1 . 2]" 1
1561 1 59 VAL MG1 1 61 ILE HG12 . . 4.320 3.353 2.873 3.731 . 0 0 "[ . 1 . 2]" 1
1562 1 53 PHE QE 1 110 LEU HG . . 5.500 3.933 3.632 4.281 . 0 0 "[ . 1 . 2]" 1
1563 1 110 LEU H 1 110 LEU HG . . 3.320 2.410 2.213 2.543 . 0 0 "[ . 1 . 2]" 1
1564 1 53 PHE QD 1 110 LEU HG . . 4.170 2.806 2.352 3.158 . 0 0 "[ . 1 . 2]" 1
1565 1 107 ARG HA 1 110 LEU HG . . 4.170 3.653 3.286 4.029 . 0 0 "[ . 1 . 2]" 1
1566 1 109 VAL HB 1 110 LEU HG . . 4.470 3.578 3.314 3.785 . 0 0 "[ . 1 . 2]" 1
1567 1 109 VAL MG1 1 110 LEU HG . . 4.750 4.030 3.636 4.346 . 0 0 "[ . 1 . 2]" 1
1568 1 79 ARG H 1 79 ARG QG . . 3.830 2.690 1.993 3.384 . 0 0 "[ . 1 . 2]" 1
1569 1 79 ARG QG 1 80 GLY H . . 4.960 3.335 1.972 4.635 . 0 0 "[ . 1 . 2]" 1
1570 1 88 ARG HG2 1 89 GLY HA2 . . 5.500 4.613 3.923 5.493 . 0 0 "[ . 1 . 2]" 1
1571 1 88 ARG HG2 1 89 GLY HA3 . . 5.500 3.983 3.213 4.890 . 0 0 "[ . 1 . 2]" 1
1572 1 88 ARG HG3 1 89 GLY H . . 4.480 3.263 2.297 3.749 . 0 0 "[ . 1 . 2]" 1
1573 1 48 LEU HG 1 61 ILE HG13 . . 3.680 2.688 2.458 3.032 . 0 0 "[ . 1 . 2]" 1
1574 1 61 ILE H 1 61 ILE HG13 . . 4.580 4.172 3.871 4.305 . 0 0 "[ . 1 . 2]" 1
1575 1 49 SER H 1 61 ILE HG13 . . 4.910 3.292 3.022 3.690 . 0 0 "[ . 1 . 2]" 1
1576 1 48 LEU HA 1 61 ILE HG13 . . 5.340 4.701 4.477 5.071 . 0 0 "[ . 1 . 2]" 1
1577 1 42 ALA HA 1 45 TRP H . . 4.480 4.244 4.044 4.443 . 0 0 "[ . 1 . 2]" 1
1578 1 41 LEU H 1 42 ALA HA . . 5.220 4.745 4.520 4.854 . 0 0 "[ . 1 . 2]" 1
1579 1 42 ALA HA 1 44 THR H . . 5.500 4.704 4.383 5.009 . 0 0 "[ . 1 . 2]" 1
1580 1 41 LEU HA 1 42 ALA HA . . 5.480 4.948 4.816 5.025 . 0 0 "[ . 1 . 2]" 1
1581 1 42 ALA HA 1 45 TRP HB2 . . 4.300 4.135 3.717 4.255 . 0 0 "[ . 1 . 2]" 1
1582 1 41 LEU MD2 1 42 ALA HA . . 5.200 4.916 4.583 5.199 . 0 0 "[ . 1 . 2]" 1
1583 1 92 LYS HA 1 93 VAL H . . 3.030 2.281 2.144 2.444 . 0 0 "[ . 1 . 2]" 1
1584 1 88 ARG H 1 92 LYS HA . . 4.710 4.091 3.843 4.464 . 0 0 "[ . 1 . 2]" 1
1585 1 92 LYS HA 1 94 SER H . . 4.670 4.557 4.342 4.671 0.001 16 0 "[ . 1 . 2]" 1
1586 1 87 PHE QE 1 92 LYS HA . . 4.900 3.326 2.893 3.753 . 0 0 "[ . 1 . 2]" 1
1587 1 87 PHE QD 1 92 LYS HA . . 4.250 2.585 2.155 2.986 . 0 0 "[ . 1 . 2]" 1
1588 1 92 LYS HA 1 93 VAL HB . . 5.190 4.649 4.554 4.785 . 0 0 "[ . 1 . 2]" 1
1589 1 92 LYS HA 1 92 LYS HG2 . . 4.040 3.693 3.555 3.809 . 0 0 "[ . 1 . 2]" 1
1590 1 102 LEU H 1 102 LEU HG . . 4.770 4.421 4.327 4.485 . 0 0 "[ . 1 . 2]" 1
1591 1 102 LEU HG 1 103 ASP H . . 4.760 2.946 2.617 3.590 . 0 0 "[ . 1 . 2]" 1
1592 1 102 LEU HG 1 106 HIS HB2 . . 5.090 4.359 3.958 4.809 . 0 0 "[ . 1 . 2]" 1
1593 1 79 ARG HA 1 79 ARG QG . . 3.460 2.924 2.267 3.430 . 0 0 "[ . 1 . 2]" 1
1594 1 48 LEU H 1 48 LEU HG . . 5.240 4.549 4.513 4.598 . 0 0 "[ . 1 . 2]" 1
1595 1 27 PHE HD2 1 48 LEU HG . . 5.140 4.442 4.216 4.756 . 0 0 "[ . 1 . 2]" 1
1596 1 48 LEU HG 1 53 PHE QE . . 5.380 4.046 3.789 4.224 . 0 0 "[ . 1 . 2]" 1
1597 1 48 LEU HG 1 106 HIS HA . . 5.500 5.057 4.596 5.304 . 0 0 "[ . 1 . 2]" 1
1598 1 53 PHE HB3 1 56 LEU HG . . 4.990 3.388 2.391 3.880 . 0 0 "[ . 1 . 2]" 1
1599 1 105 LEU MD1 1 106 HIS H . . 5.120 4.378 4.004 4.678 . 0 0 "[ . 1 . 2]" 1
1600 1 27 PHE QE 1 105 LEU MD1 . . 4.670 3.883 3.156 4.666 . 0 0 "[ . 1 . 2]" 1
1601 1 45 TRP HZ3 1 105 LEU MD1 . . 3.640 3.196 2.226 3.649 0.009 17 0 "[ . 1 . 2]" 1
1602 1 44 THR HB 1 105 LEU MD1 . . 4.360 3.875 3.488 4.089 . 0 0 "[ . 1 . 2]" 1
1603 1 100 ARG HA 1 105 LEU MD1 . . 4.610 3.707 2.980 4.107 . 0 0 "[ . 1 . 2]" 1
1604 1 102 LEU HA 1 105 LEU MD1 . . 3.520 2.365 1.974 2.914 . 0 0 "[ . 1 . 2]" 1
1605 1 105 LEU HB2 1 105 LEU MD1 . . 3.260 2.175 2.010 2.304 . 0 0 "[ . 1 . 2]" 1
1606 1 105 LEU HB3 1 105 LEU MD1 . . 3.280 2.523 2.385 2.677 . 0 0 "[ . 1 . 2]" 1
1607 1 41 LEU MD2 1 105 LEU MD1 . . 4.490 3.813 3.318 4.350 . 0 0 "[ . 1 . 2]" 1
1608 1 48 LEU MD2 1 105 LEU MD1 . . 3.410 2.552 2.125 3.070 . 0 0 "[ . 1 . 2]" 1
1609 1 48 LEU MD2 1 61 ILE HG13 . . 4.800 3.152 2.694 3.576 . 0 0 "[ . 1 . 2]" 1
1610 1 12 LEU MD1 1 17 PHE QD . . 3.470 3.154 2.662 3.468 . 0 0 "[ . 1 . 2]" 1
1611 1 12 LEU HB2 1 12 LEU MD1 . . 3.420 2.306 2.137 2.484 . 0 0 "[ . 1 . 2]" 1
1612 1 12 LEU MD1 1 28 ILE MG . . 3.930 3.065 2.432 3.495 . 0 0 "[ . 1 . 2]" 1
1613 1 92 LYS HA 1 93 VAL HA . . 4.970 4.405 4.374 4.461 . 0 0 "[ . 1 . 2]" 1
1614 1 102 LEU MD2 1 103 ASP H . . 4.820 3.800 3.455 4.440 . 0 0 "[ . 1 . 2]" 1
1615 1 102 LEU HA 1 102 LEU MD2 . . 4.060 3.924 3.834 3.978 . 0 0 "[ . 1 . 2]" 1
1616 1 56 LEU H 1 56 LEU MD1 . . 4.630 4.036 3.562 4.416 . 0 0 "[ . 1 . 2]" 1
1617 1 56 LEU HA 1 56 LEU MD1 . . 4.380 3.821 3.603 3.973 . 0 0 "[ . 1 . 2]" 1
1618 1 12 LEU MD1 1 17 PHE QB . . 4.850 3.793 3.211 4.064 . 0 0 "[ . 1 . 2]" 1
1619 1 12 LEU HB3 1 12 LEU MD1 . . 3.410 2.355 2.138 2.524 . 0 0 "[ . 1 . 2]" 1
1620 1 12 LEU MD1 1 26 THR MG . . 3.650 2.444 2.258 2.564 . 0 0 "[ . 1 . 2]" 1
1621 1 12 LEU MD1 1 21 ILE MG . . 4.000 2.824 2.515 3.172 . 0 0 "[ . 1 . 2]" 1
1622 1 102 LEU H 1 102 LEU MD2 . . 4.570 4.225 4.184 4.274 . 0 0 "[ . 1 . 2]" 1
1623 1 47 GLU HB2 1 102 LEU MD2 . . 3.500 3.072 2.434 3.476 . 0 0 "[ . 1 . 2]" 1
1624 1 47 GLU HB3 1 102 LEU MD2 . . 3.460 2.378 1.962 2.784 . 0 0 "[ . 1 . 2]" 1
1625 1 102 LEU HB3 1 102 LEU MD2 . . 3.180 2.315 2.177 2.464 . 0 0 "[ . 1 . 2]" 1
1626 1 44 THR HA 1 102 LEU MD2 . . 4.740 4.470 3.794 4.738 . 0 0 "[ . 1 . 2]" 1
1627 1 56 LEU HB2 1 56 LEU MD1 . . 3.460 2.384 2.063 2.646 . 0 0 "[ . 1 . 2]" 1
1628 1 56 LEU MD1 1 59 VAL MG1 . . 4.870 4.560 4.173 4.867 . 0 0 "[ . 1 . 2]" 1
1629 1 19 ASP HA 1 21 ILE H . . 5.500 5.059 4.580 5.291 . 0 0 "[ . 1 . 2]" 1
1630 1 19 ASP HA 1 22 ALA H . . 4.310 3.629 3.234 3.867 . 0 0 "[ . 1 . 2]" 1
1631 1 18 ASP QB 1 21 ILE QG . . 5.090 3.659 3.408 4.106 . 0 0 "[ . 1 . 2]" 1
1632 1 21 ILE QG 1 91 LYS H . . 5.500 5.146 4.714 5.500 . 20 0 "[ . 1 . 2]" 1
1633 1 27 PHE QE 1 84 LEU MD1 . . 4.340 2.965 2.277 3.978 . 0 0 "[ . 1 . 2]" 1
1634 1 45 TRP HE3 1 84 LEU MD1 . . 4.590 4.164 3.725 4.589 . 0 0 "[ . 1 . 2]" 1
1635 1 84 LEU MD1 1 96 HIS HD2 . . 4.110 3.221 1.958 3.945 . 0 0 "[ . 1 . 2]" 1
1636 1 84 LEU MD1 1 96 HIS HB2 . . 4.570 3.233 2.704 3.969 . 0 0 "[ . 1 . 2]" 1
1637 1 84 LEU HB2 1 84 LEU MD1 . . 3.350 2.234 2.043 2.358 . 0 0 "[ . 1 . 2]" 1
1638 1 84 LEU HB3 1 84 LEU MD1 . . 3.360 2.445 2.327 2.607 . 0 0 "[ . 1 . 2]" 1
1639 1 86 LEU H 1 86 LEU MD2 . . 4.790 4.264 4.088 4.360 . 0 0 "[ . 1 . 2]" 1
1640 1 86 LEU MD2 1 94 SER H . . 4.640 3.645 3.341 4.098 . 0 0 "[ . 1 . 2]" 1
1641 1 27 PHE QE 1 86 LEU MD2 . . 4.940 4.221 3.869 4.916 . 0 0 "[ . 1 . 2]" 1
1642 1 86 LEU MD2 1 108 PHE QE . . 3.700 2.923 2.331 3.478 . 0 0 "[ . 1 . 2]" 1
1643 1 27 PHE HA 1 86 LEU MD2 . . 5.500 5.429 5.220 5.518 0.018 19 0 "[ . 1 . 2]" 1
1644 1 86 LEU MD2 1 87 PHE HA . . 5.270 4.755 4.514 5.014 . 0 0 "[ . 1 . 2]" 1
1645 1 86 LEU MD2 1 88 ARG HD2 . . 5.500 4.555 3.814 5.525 0.025 19 0 "[ . 1 . 2]" 1
1646 1 86 LEU MD2 1 88 ARG HD3 . . 5.500 4.491 3.774 5.089 . 0 0 "[ . 1 . 2]" 1
1647 1 86 LEU HB3 1 86 LEU MD2 . . 3.230 2.159 1.991 2.333 . 0 0 "[ . 1 . 2]" 1
1648 1 86 LEU MD2 1 112 GLN HB3 . . 3.930 2.180 1.863 2.453 . 0 0 "[ . 1 . 2]" 1
1649 1 96 HIS HA 1 108 PHE QE . . 4.040 2.670 2.208 3.208 . 0 0 "[ . 1 . 2]" 1
1650 1 84 LEU HB2 1 96 HIS HA . . 5.250 4.819 4.512 5.237 . 0 0 "[ . 1 . 2]" 1
1651 1 116 GLU HA 1 117 LEU H . . 3.340 2.383 2.141 3.338 . 0 0 "[ . 1 . 2]" 1
1652 1 114 LYS HA 1 115 ASP H . . 3.230 2.299 2.141 3.238 0.008 10 0 "[ . 1 . 2]" 1
1653 1 114 LYS HA 1 114 LYS HG2 . . 4.230 3.012 2.241 3.722 . 0 0 "[ . 1 . 2]" 1
1654 1 114 LYS HA 1 114 LYS HG3 . . 4.230 2.839 2.185 3.789 . 0 0 "[ . 1 . 2]" 1
1655 1 56 LEU MD2 1 114 LYS HA . . 3.880 3.455 2.656 3.846 . 0 0 "[ . 1 . 2]" 1
1656 1 27 PHE H 1 62 ALA MB . . 5.080 4.897 4.592 5.080 0.000 2 0 "[ . 1 . 2]" 1
1657 1 62 ALA MB 1 63 GLU H . . 2.940 2.230 1.991 2.624 . 0 0 "[ . 1 . 2]" 1
1658 1 10 LEU H 1 62 ALA MB . . 3.890 3.512 3.300 3.730 . 0 0 "[ . 1 . 2]" 1
1659 1 12 LEU H 1 62 ALA MB . . 4.550 3.035 2.666 3.501 . 0 0 "[ . 1 . 2]" 1
1660 1 29 LYS H 1 62 ALA MB . . 4.800 4.283 4.030 4.580 . 0 0 "[ . 1 . 2]" 1
1661 1 17 PHE QD 1 62 ALA MB . . 5.500 5.132 4.713 5.440 . 0 0 "[ . 1 . 2]" 1
1662 1 12 LEU HA 1 62 ALA MB . . 5.080 4.354 4.127 4.632 . 0 0 "[ . 1 . 2]" 1
1663 1 28 ILE HA 1 62 ALA MB . . 3.740 3.229 2.924 3.579 . 0 0 "[ . 1 . 2]" 1
1664 1 10 LEU HA 1 62 ALA MB . . 4.760 4.079 3.778 4.317 . 0 0 "[ . 1 . 2]" 1
1665 1 17 PHE HA 1 62 ALA MB . . 5.500 5.329 5.127 5.512 0.012 12 0 "[ . 1 . 2]" 1
1666 1 26 THR HB 1 62 ALA MB . . 5.500 5.143 4.932 5.410 . 0 0 "[ . 1 . 2]" 1
1667 1 62 ALA MB 1 63 GLU HB3 . . 4.850 4.499 4.420 4.717 . 0 0 "[ . 1 . 2]" 1
1668 1 12 LEU HB2 1 62 ALA MB . . 4.250 3.312 3.036 3.613 . 0 0 "[ . 1 . 2]" 1
1669 1 28 ILE HG13 1 62 ALA MB . . 4.000 3.698 2.903 4.020 0.020 19 0 "[ . 1 . 2]" 1
1670 1 12 LEU HG 1 62 ALA MB . . 2.830 1.829 1.771 1.916 . 0 0 "[ . 1 . 2]" 1
1671 1 12 LEU MD2 1 62 ALA MB . . 3.430 2.658 2.267 2.924 . 0 0 "[ . 1 . 2]" 1
1672 1 12 LEU MD1 1 62 ALA MB . . 2.950 1.957 1.795 2.266 . 0 0 "[ . 1 . 2]" 1
1673 1 61 ILE MG 1 62 ALA MB . . 4.830 4.279 4.151 4.370 . 0 0 "[ . 1 . 2]" 1
1674 1 28 ILE MG 1 62 ALA MB . . 3.530 3.162 2.777 3.499 . 0 0 "[ . 1 . 2]" 1
1675 1 21 ILE MG 1 62 ALA MB . . 5.200 4.396 4.064 4.638 . 0 0 "[ . 1 . 2]" 1
1676 1 86 LEU MD2 1 87 PHE H . . 4.300 3.973 3.853 4.240 . 0 0 "[ . 1 . 2]" 1
1677 1 86 LEU HA 1 86 LEU MD2 . . 4.020 3.920 3.886 3.977 . 0 0 "[ . 1 . 2]" 1
1678 1 86 LEU MD2 1 109 VAL HA . . 3.830 3.119 2.559 3.585 . 0 0 "[ . 1 . 2]" 1
1679 1 71 ASN HA 1 74 SER H . . 4.640 4.330 3.912 4.542 . 0 0 "[ . 1 . 2]" 1
1680 1 71 ASN HA 1 74 SER QB . . 3.560 3.223 2.955 3.399 . 0 0 "[ . 1 . 2]" 1
1681 1 71 ASN HA 1 73 CYS H . . 5.440 5.129 4.659 5.443 0.003 5 0 "[ . 1 . 2]" 1
1682 1 39 LYS QE 1 39 LYS HG2 . . 3.880 2.584 2.198 3.143 . 0 0 "[ . 1 . 2]" 1
1683 1 49 SER HG 1 50 LYS HG3 . . 4.240 3.206 3.084 3.331 . 0 0 "[ . 1 . 2]" 1
1684 1 7 GLY QA 1 50 LYS HG3 . . 5.500 5.146 4.640 5.466 . 0 0 "[ . 1 . 2]" 1
1685 1 49 SER HA 1 50 LYS HG3 . . 5.500 5.308 5.138 5.434 . 0 0 "[ . 1 . 2]" 1
1686 1 50 LYS HA 1 50 LYS HG3 . . 3.870 2.870 2.741 2.975 . 0 0 "[ . 1 . 2]" 1
1687 1 47 GLU HA 1 50 LYS HG3 . . 4.480 3.584 3.329 3.840 . 0 0 "[ . 1 . 2]" 1
1688 1 50 LYS HB2 1 50 LYS HG3 . . 2.980 2.551 2.480 2.610 . 0 0 "[ . 1 . 2]" 1
1689 1 50 LYS H 1 50 LYS HG2 . . 4.030 3.695 3.585 3.814 . 0 0 "[ . 1 . 2]" 1
1690 1 49 SER HG 1 50 LYS HG2 . . 5.040 4.720 4.517 4.883 . 0 0 "[ . 1 . 2]" 1
1691 1 8 THR MG 1 50 LYS HG2 . . 4.810 4.459 4.072 4.774 . 0 0 "[ . 1 . 2]" 1
1692 1 10 LEU MD1 1 61 ILE H . . 4.500 2.396 1.902 2.556 . 0 0 "[ . 1 . 2]" 1
1693 1 10 LEU H 1 10 LEU MD1 . . 4.490 2.734 2.418 3.774 . 0 0 "[ . 1 . 2]" 1
1694 1 10 LEU MD1 1 11 ALA H . . 5.200 4.892 4.685 5.172 . 0 0 "[ . 1 . 2]" 1
1695 1 10 LEU HA 1 10 LEU MD1 . . 4.110 3.253 3.067 3.933 . 0 0 "[ . 1 . 2]" 1
1696 1 10 LEU HB2 1 10 LEU MD1 . . 3.390 2.149 2.004 2.221 . 0 0 "[ . 1 . 2]" 1
1697 1 107 ARG H 1 110 LEU MD1 . . 5.100 3.569 3.189 3.915 . 0 0 "[ . 1 . 2]" 1
1698 1 108 PHE H 1 110 LEU MD1 . . 5.500 4.793 4.490 5.101 . 0 0 "[ . 1 . 2]" 1
1699 1 53 PHE QE 1 110 LEU MD1 . . 5.170 4.760 4.431 5.135 . 0 0 "[ . 1 . 2]" 1
1700 1 53 PHE QD 1 110 LEU MD1 . . 4.430 4.070 3.695 4.364 . 0 0 "[ . 1 . 2]" 1
1701 1 106 HIS HD2 1 110 LEU MD1 . . 4.860 4.069 3.540 4.679 . 0 0 "[ . 1 . 2]" 1
1702 1 107 ARG HA 1 110 LEU MD1 . . 3.400 2.192 1.922 2.504 . 0 0 "[ . 1 . 2]" 1
1703 1 53 PHE HB3 1 110 LEU MD1 . . 5.340 5.057 4.619 5.340 . 0 0 "[ . 1 . 2]" 1
1704 1 110 LEU HB2 1 110 LEU MD1 . . 3.260 2.203 2.077 2.297 . 0 0 "[ . 1 . 2]" 1
1705 1 110 LEU HB3 1 110 LEU MD1 . . 3.260 2.477 2.410 2.550 . 0 0 "[ . 1 . 2]" 1
1706 1 100 ARG HA 1 105 LEU HG . . 3.800 3.161 2.808 3.606 . 0 0 "[ . 1 . 2]" 1
1707 1 100 ARG HA 1 100 ARG HG3 . . 4.100 3.190 2.584 3.722 . 0 0 "[ . 1 . 2]" 1
1708 1 84 LEU MD1 1 100 ARG HA . . 3.990 3.327 2.839 3.746 . 0 0 "[ . 1 . 2]" 1
1709 1 50 LYS HA 1 50 LYS HG2 . . 3.400 2.700 2.575 2.833 . 0 0 "[ . 1 . 2]" 1
1710 1 52 GLU HA 1 53 PHE H . . 3.180 2.201 2.141 2.392 . 0 0 "[ . 1 . 2]" 1
1711 1 52 GLU HA 1 53 PHE QD . . 4.210 3.266 2.970 3.618 . 0 0 "[ . 1 . 2]" 1
1712 1 52 GLU HA 1 53 PHE HB2 . . 4.970 4.757 4.668 4.803 . 0 0 "[ . 1 . 2]" 1
1713 1 52 GLU HA 1 52 GLU HG3 . . 4.090 3.532 2.818 3.951 . 0 0 "[ . 1 . 2]" 1
1714 1 79 ARG HA 1 79 ARG QD . . 4.320 3.421 2.072 4.333 0.013 12 0 "[ . 1 . 2]" 1
1715 1 112 GLN HA 1 112 GLN HE22 . . 4.990 3.340 2.785 3.846 . 0 0 "[ . 1 . 2]" 1
1716 1 111 SER HA 1 112 GLN HA . . 5.110 4.813 4.673 4.911 . 0 0 "[ . 1 . 2]" 1
1717 1 85 LEU MD1 1 86 LEU H . . 5.140 5.006 4.742 5.144 0.004 14 0 "[ . 1 . 2]" 1
1718 1 30 PHE QD 1 85 LEU MD1 . . 4.190 3.202 2.759 3.507 . 0 0 "[ . 1 . 2]" 1
1719 1 76 TYR QD 1 85 LEU MD1 . . 3.730 2.604 2.148 2.947 . 0 0 "[ . 1 . 2]" 1
1720 1 85 LEU MD1 1 87 PHE QE . . 3.640 3.383 3.151 3.601 . 0 0 "[ . 1 . 2]" 1
1721 1 30 PHE HZ 1 85 LEU MD1 . . 3.980 3.324 2.945 3.965 . 0 0 "[ . 1 . 2]" 1
1722 1 85 LEU MD1 1 87 PHE HZ . . 3.760 2.624 2.326 2.966 . 0 0 "[ . 1 . 2]" 1
1723 1 85 LEU HA 1 85 LEU MD1 . . 4.440 3.883 3.837 3.919 . 0 0 "[ . 1 . 2]" 1
1724 1 76 TYR HA 1 85 LEU MD1 . . 5.010 4.061 3.813 4.351 . 0 0 "[ . 1 . 2]" 1
1725 1 76 TYR HB3 1 85 LEU MD1 . . 3.410 2.356 2.096 2.655 . 0 0 "[ . 1 . 2]" 1
1726 1 85 LEU HB2 1 85 LEU MD1 . . 3.260 2.238 2.096 2.340 . 0 0 "[ . 1 . 2]" 1
1727 1 85 LEU HB3 1 85 LEU MD1 . . 3.210 2.436 2.321 2.566 . 0 0 "[ . 1 . 2]" 1
1728 1 83 THR MG 1 85 LEU MD1 . . 3.460 2.804 2.617 3.100 . 0 0 "[ . 1 . 2]" 1
1729 1 78 VAL MG2 1 85 LEU MD1 . . 3.450 2.927 2.588 3.189 . 0 0 "[ . 1 . 2]" 1
1730 1 86 LEU MD1 1 87 PHE H . . 3.700 2.487 2.222 2.766 . 0 0 "[ . 1 . 2]" 1
1731 1 27 PHE H 1 86 LEU MD1 . . 4.850 3.956 3.682 4.096 . 0 0 "[ . 1 . 2]" 1
1732 1 86 LEU H 1 86 LEU MD1 . . 4.920 4.251 4.156 4.381 . 0 0 "[ . 1 . 2]" 1
1733 1 86 LEU MD1 1 108 PHE QE . . 3.730 3.241 2.965 3.524 . 0 0 "[ . 1 . 2]" 1
1734 1 27 PHE HA 1 86 LEU MD1 . . 3.700 2.850 2.595 3.072 . 0 0 "[ . 1 . 2]" 1
1735 1 26 THR HA 1 86 LEU MD1 . . 5.100 4.608 4.368 4.777 . 0 0 "[ . 1 . 2]" 1
1736 1 27 PHE HB3 1 86 LEU MD1 . . 4.450 4.207 3.936 4.450 0.000 19 0 "[ . 1 . 2]" 1
1737 1 86 LEU MD1 1 87 PHE HB2 . . 5.230 4.742 4.396 4.978 . 0 0 "[ . 1 . 2]" 1
1738 1 86 LEU HB3 1 86 LEU MD1 . . 3.640 3.166 3.126 3.192 . 0 0 "[ . 1 . 2]" 1
1739 1 25 ILE MG 1 86 LEU MD1 . . 2.990 1.933 1.836 2.149 . 0 0 "[ . 1 . 2]" 1
1740 1 86 LEU MD1 1 109 VAL MG2 . . 3.370 2.550 2.232 3.026 . 0 0 "[ . 1 . 2]" 1
1741 1 59 VAL MG1 1 86 LEU MD1 . . 5.130 3.442 2.976 3.917 . 0 0 "[ . 1 . 2]" 1
1742 1 27 PHE HD1 1 86 LEU MD1 . . 4.090 2.131 1.844 4.022 . 0 0 "[ . 1 . 2]" 1
1743 1 86 LEU HA 1 86 LEU MD1 . . 3.380 2.322 2.074 2.556 . 0 0 "[ . 1 . 2]" 1
1744 1 27 PHE HB2 1 86 LEU MD1 . . 3.400 2.925 2.601 3.218 . 0 0 "[ . 1 . 2]" 1
1745 1 86 LEU HB2 1 86 LEU MD1 . . 3.240 2.185 2.039 2.305 . 0 0 "[ . 1 . 2]" 1
1746 1 86 LEU MD1 1 109 VAL MG1 . . 3.380 2.646 2.228 3.030 . 0 0 "[ . 1 . 2]" 1
1747 1 59 VAL MG1 1 60 LYS HA . . 4.850 3.728 3.415 4.188 . 0 0 "[ . 1 . 2]" 1
1748 1 112 GLN HA 1 112 GLN HE21 . . 4.990 3.094 2.324 3.822 . 0 0 "[ . 1 . 2]" 1
1749 1 112 GLN HA 1 112 GLN HG2 . . 3.820 3.067 2.771 3.390 . 0 0 "[ . 1 . 2]" 1
1750 1 86 LEU MD2 1 112 GLN HA . . 5.150 4.257 3.867 4.549 . 0 0 "[ . 1 . 2]" 1
1751 1 38 CYS HA 1 82 PRO HG2 . . 5.250 4.893 4.344 5.251 0.001 5 0 "[ . 1 . 2]" 1
1752 1 82 PRO HG3 1 84 LEU MD1 . . 5.500 5.412 5.110 5.506 0.006 16 0 "[ . 1 . 2]" 1
1753 1 114 LYS H 1 114 LYS HG2 . . 5.280 4.178 1.929 5.101 . 0 0 "[ . 1 . 2]" 1
1754 1 114 LYS H 1 114 LYS HG3 . . 5.280 3.868 2.591 4.682 . 0 0 "[ . 1 . 2]" 1
1755 1 48 LEU HA 1 51 LYS HG3 . . 3.370 2.305 2.061 2.488 . 0 0 "[ . 1 . 2]" 1
1756 1 92 LYS HG2 1 93 VAL H . . 4.600 4.383 3.547 4.590 . 0 0 "[ . 1 . 2]" 1
1757 1 92 LYS HG3 1 93 VAL H . . 4.600 3.662 2.409 4.286 . 0 0 "[ . 1 . 2]" 1
1758 1 92 LYS HA 1 92 LYS HG3 . . 4.040 3.740 2.916 4.151 0.111 11 0 "[ . 1 . 2]" 1
1759 1 75 LYS HG3 1 76 TYR H . . 5.020 4.981 4.889 5.041 0.021 20 0 "[ . 1 . 2]" 1
1760 1 75 LYS H 1 75 LYS HG3 . . 5.010 4.513 4.365 4.623 . 0 0 "[ . 1 . 2]" 1
1761 1 10 LEU HA 1 11 ALA H . . 2.700 2.199 2.141 2.319 . 0 0 "[ . 1 . 2]" 1
1762 1 22 ALA HA 1 90 GLY HA2 . . 3.660 2.475 2.009 3.184 . 0 0 "[ . 1 . 2]" 1
1763 1 22 ALA HA 1 90 GLY HA3 . . 3.660 2.797 2.356 3.208 . 0 0 "[ . 1 . 2]" 1
1764 1 21 ILE QG 1 22 ALA HA . . 4.210 3.160 2.939 3.340 . 0 0 "[ . 1 . 2]" 1
1765 1 82 PRO HG2 1 84 LEU MD1 . . 5.500 4.589 4.280 4.803 . 0 0 "[ . 1 . 2]" 1
1766 1 82 PRO HG2 1 84 LEU MD2 . . 5.200 4.330 3.722 4.623 . 0 0 "[ . 1 . 2]" 1
1767 1 41 LEU MD2 1 82 PRO HG2 . . 4.000 3.152 2.833 3.494 . 0 0 "[ . 1 . 2]" 1
1768 1 38 CYS HA 1 82 PRO HG3 . . 5.250 3.276 2.751 3.679 . 0 0 "[ . 1 . 2]" 1
1769 1 41 LEU MD2 1 82 PRO HG3 . . 4.000 2.673 2.160 3.041 . 0 0 "[ . 1 . 2]" 1
1770 1 91 LYS QG 1 92 LYS H . . 4.810 3.823 3.298 4.520 . 0 0 "[ . 1 . 2]" 1
1771 1 30 PHE H 1 84 LEU MD2 . . 3.990 3.690 3.232 3.973 . 0 0 "[ . 1 . 2]" 1
1772 1 84 LEU H 1 84 LEU MD2 . . 4.240 3.566 3.344 3.799 . 0 0 "[ . 1 . 2]" 1
1773 1 84 LEU MD2 1 85 LEU H . . 4.310 3.935 3.724 4.167 . 0 0 "[ . 1 . 2]" 1
1774 1 29 LYS H 1 84 LEU MD2 . . 5.000 4.778 4.547 5.004 0.004 16 0 "[ . 1 . 2]" 1
1775 1 27 PHE QE 1 84 LEU MD2 . . 4.710 3.553 3.093 3.939 . 0 0 "[ . 1 . 2]" 1
1776 1 27 PHE HZ 1 84 LEU MD2 . . 4.600 4.229 3.658 4.591 . 0 0 "[ . 1 . 2]" 1
1777 1 45 TRP HZ3 1 84 LEU MD2 . . 3.810 2.608 1.978 3.480 . 0 0 "[ . 1 . 2]" 1
1778 1 84 LEU HA 1 84 LEU MD2 . . 3.190 2.297 2.050 2.559 . 0 0 "[ . 1 . 2]" 1
1779 1 82 PRO HA 1 84 LEU MD2 . . 5.120 4.862 4.473 5.091 . 0 0 "[ . 1 . 2]" 1
1780 1 83 THR HA 1 84 LEU MD2 . . 4.990 4.013 3.605 4.307 . 0 0 "[ . 1 . 2]" 1
1781 1 29 LYS HA 1 84 LEU MD2 . . 3.060 2.603 2.257 2.998 . 0 0 "[ . 1 . 2]" 1
1782 1 82 PRO HG3 1 84 LEU MD2 . . 5.200 4.833 4.380 5.079 . 0 0 "[ . 1 . 2]" 1
1783 1 84 LEU HB3 1 84 LEU MD2 . . 3.520 2.271 2.113 2.398 . 0 0 "[ . 1 . 2]" 1
1784 1 10 LEU HA 1 62 ALA HA . . 5.080 3.903 3.729 3.985 . 0 0 "[ . 1 . 2]" 1
1785 1 60 LYS H 1 60 LYS HG2 . . 4.750 4.134 3.770 4.437 . 0 0 "[ . 1 . 2]" 1
1786 1 60 LYS HA 1 60 LYS HG2 . . 3.730 2.635 2.479 2.849 . 0 0 "[ . 1 . 2]" 1
1787 1 60 LYS HG3 1 61 ILE H . . 5.290 4.771 4.540 5.034 . 0 0 "[ . 1 . 2]" 1
1788 1 41 LEU MD1 1 45 TRP HZ3 . . 4.920 4.635 3.819 4.916 . 0 0 "[ . 1 . 2]" 1
1789 1 109 VAL H 1 109 VAL MG2 . . 3.030 2.178 1.907 2.390 . 0 0 "[ . 1 . 2]" 1
1790 1 53 PHE QE 1 109 VAL MG2 . . 3.110 2.731 2.233 3.058 . 0 0 "[ . 1 . 2]" 1
1791 1 53 PHE HZ 1 109 VAL MG2 . . 3.950 3.485 3.032 3.907 . 0 0 "[ . 1 . 2]" 1
1792 1 108 PHE QD 1 109 VAL MG2 . . 3.660 2.105 1.951 2.283 . 0 0 "[ . 1 . 2]" 1
1793 1 109 VAL HA 1 109 VAL MG2 . . 3.040 2.324 2.186 2.419 . 0 0 "[ . 1 . 2]" 1
1794 1 59 VAL MG1 1 109 VAL MG2 . . 4.190 3.147 2.766 3.437 . 0 0 "[ . 1 . 2]" 1
1795 1 109 VAL MG2 1 110 LEU H . . 4.460 3.846 3.735 3.969 . 0 0 "[ . 1 . 2]" 1
1796 1 56 LEU MD2 1 113 ALA H . . 4.860 4.076 3.705 4.351 . 0 0 "[ . 1 . 2]" 1
1797 1 27 PHE HA 1 109 VAL MG2 . . 5.200 4.958 4.749 5.160 . 0 0 "[ . 1 . 2]" 1
1798 1 106 HIS HA 1 109 VAL MG2 . . 4.100 3.611 3.345 4.048 . 0 0 "[ . 1 . 2]" 1
1799 1 56 LEU H 1 56 LEU MD2 . . 4.480 3.655 2.789 4.272 . 0 0 "[ . 1 . 2]" 1
1800 1 56 LEU MD2 1 114 LYS H . . 5.080 3.447 2.477 4.741 . 0 0 "[ . 1 . 2]" 1
1801 1 56 LEU MD2 1 110 LEU HA . . 4.130 3.418 2.607 3.838 . 0 0 "[ . 1 . 2]" 1
1802 1 109 VAL MG2 1 112 GLN HB2 . . 5.380 4.104 3.846 4.248 . 0 0 "[ . 1 . 2]" 1
1803 1 51 LYS HA 1 52 GLU H . . 2.870 2.363 2.183 2.563 . 0 0 "[ . 1 . 2]" 1
1804 1 51 LYS HA 1 52 GLU HB2 . . 5.030 4.670 4.201 5.006 . 0 0 "[ . 1 . 2]" 1
1805 1 51 LYS HA 1 51 LYS HG2 . . 4.130 2.910 2.785 3.052 . 0 0 "[ . 1 . 2]" 1
1806 1 51 LYS HA 1 51 LYS HG3 . . 4.130 3.774 3.716 3.812 . 0 0 "[ . 1 . 2]" 1
1807 1 41 LEU H 1 41 LEU MD1 . . 4.750 4.135 3.981 4.329 . 0 0 "[ . 1 . 2]" 1
1808 1 41 LEU MD1 1 45 TRP HE3 . . 3.540 3.340 2.828 3.541 0.001 14 0 "[ . 1 . 2]" 1
1809 1 41 LEU HA 1 41 LEU MD1 . . 3.130 2.173 1.974 2.569 . 0 0 "[ . 1 . 2]" 1
1810 1 41 LEU MD1 1 44 THR HB . . 3.320 2.072 1.936 2.272 . 0 0 "[ . 1 . 2]" 1
1811 1 41 LEU MD1 1 44 THR HA . . 5.060 4.571 4.325 4.789 . 0 0 "[ . 1 . 2]" 1
1812 1 41 LEU MD1 1 45 TRP HA . . 5.240 3.827 3.429 4.194 . 0 0 "[ . 1 . 2]" 1
1813 1 41 LEU MD1 1 45 TRP HB3 . . 5.500 5.038 4.686 5.413 . 0 0 "[ . 1 . 2]" 1
1814 1 41 LEU MD1 1 45 TRP HB2 . . 4.100 3.719 3.388 4.087 . 0 0 "[ . 1 . 2]" 1
1815 1 41 LEU MD1 1 105 LEU MD1 . . 3.060 2.412 2.041 2.665 . 0 0 "[ . 1 . 2]" 1
1816 1 105 LEU H 1 105 LEU MD2 . . 4.250 3.875 3.569 4.031 . 0 0 "[ . 1 . 2]" 1
1817 1 27 PHE QE 1 105 LEU MD2 . . 3.520 2.335 1.941 3.164 . 0 0 "[ . 1 . 2]" 1
1818 1 45 TRP HE3 1 105 LEU MD2 . . 4.270 3.640 2.995 4.248 . 0 0 "[ . 1 . 2]" 1
1819 1 27 PHE HZ 1 105 LEU MD2 . . 3.530 3.320 2.993 3.536 0.006 13 0 "[ . 1 . 2]" 1
1820 1 45 TRP HZ3 1 105 LEU MD2 . . 3.260 2.726 2.232 3.263 0.003 12 0 "[ . 1 . 2]" 1
1821 1 100 ARG HA 1 105 LEU MD2 . . 3.500 2.790 2.153 3.299 . 0 0 "[ . 1 . 2]" 1
1822 1 47 GLU HB3 1 102 LEU MD1 . . 3.340 2.266 1.851 2.742 . 0 0 "[ . 1 . 2]" 1
1823 1 48 LEU MD2 1 105 LEU MD2 . . 3.930 3.066 2.591 3.391 . 0 0 "[ . 1 . 2]" 1
1824 1 84 LEU MD2 1 105 LEU MD2 . . 4.230 3.092 2.621 3.580 . 0 0 "[ . 1 . 2]" 1
1825 1 56 LEU MD2 1 115 ASP H . . 5.500 4.991 3.821 5.504 0.004 6 0 "[ . 1 . 2]" 1
1826 1 56 LEU HA 1 56 LEU MD2 . . 3.170 2.056 1.921 2.253 . 0 0 "[ . 1 . 2]" 1
1827 1 29 LYS HA 1 30 PHE HA . . 5.110 4.405 4.384 4.427 . 0 0 "[ . 1 . 2]" 1
1828 1 29 LYS HA 1 63 GLU HA . . 5.500 4.847 4.481 5.229 . 0 0 "[ . 1 . 2]" 1
1829 1 29 LYS HA 1 84 LEU HB3 . . 5.100 4.121 3.778 4.529 . 0 0 "[ . 1 . 2]" 1
1830 1 29 LYS HA 1 84 LEU MD1 . . 5.500 5.165 4.875 5.458 . 0 0 "[ . 1 . 2]" 1
1831 1 29 LYS HA 1 29 LYS QG . . 3.670 2.448 2.320 2.775 . 0 0 "[ . 1 . 2]" 1
1832 1 84 LEU H 1 85 LEU MD2 . . 4.760 4.421 3.866 4.707 . 0 0 "[ . 1 . 2]" 1
1833 1 85 LEU H 1 85 LEU MD2 . . 4.360 4.174 3.978 4.349 . 0 0 "[ . 1 . 2]" 1
1834 1 102 LEU MD1 1 105 LEU HB2 . . 4.110 3.667 3.285 4.025 . 0 0 "[ . 1 . 2]" 1
1835 1 29 LYS HA 1 30 PHE HB2 . . 4.950 4.758 4.655 4.834 . 0 0 "[ . 1 . 2]" 1
1836 1 28 ILE MG 1 29 LYS HA . . 5.000 3.543 3.387 3.847 . 0 0 "[ . 1 . 2]" 1
1837 1 67 THR H 1 67 THR MG . . 3.280 2.812 1.954 3.178 . 0 0 "[ . 1 . 2]" 1
1838 1 34 TRP HZ2 1 67 THR MG . . 5.020 4.567 3.919 5.000 . 0 0 "[ . 1 . 2]" 1
1839 1 67 THR MG 1 68 ALA H . . 4.460 4.023 3.768 4.247 . 0 0 "[ . 1 . 2]" 1
1840 1 67 THR HA 1 67 THR MG . . 3.000 2.338 2.188 2.474 . 0 0 "[ . 1 . 2]" 1
1841 1 32 ALA HA 1 67 THR MG . . 3.420 3.261 3.013 3.430 0.010 18 0 "[ . 1 . 2]" 1
1842 1 33 PRO HD2 1 67 THR MG . . 3.150 1.906 1.809 2.014 . 0 0 "[ . 1 . 2]" 1
1843 1 66 CYS HB2 1 67 THR MG . . 4.880 3.613 3.243 3.923 . 0 0 "[ . 1 . 2]" 1
1844 1 33 PRO HG2 1 67 THR MG . . 4.440 2.130 1.978 2.805 . 0 0 "[ . 1 . 2]" 1
1845 1 85 LEU HA 1 85 LEU MD2 . . 3.060 2.175 1.975 2.380 . 0 0 "[ . 1 . 2]" 1
1846 1 85 LEU MD2 1 95 GLU HA . . 3.300 2.219 1.978 2.535 . 0 0 "[ . 1 . 2]" 1
1847 1 85 LEU MD2 1 92 LYS QE . . 4.600 4.105 2.558 4.603 0.003 14 0 "[ . 1 . 2]" 1
1848 1 47 GLU HB2 1 102 LEU MD1 . . 3.450 2.251 1.979 2.763 . 0 0 "[ . 1 . 2]" 1
1849 1 102 LEU MD1 1 106 HIS H . . 4.470 4.107 3.818 4.468 . 0 0 "[ . 1 . 2]" 1
1850 1 44 THR HA 1 102 LEU MD1 . . 4.270 4.044 3.411 4.270 . 0 0 "[ . 1 . 2]" 1
1851 1 48 LEU HA 1 102 LEU MD1 . . 3.100 2.631 2.231 2.846 . 0 0 "[ . 1 . 2]" 1
1852 1 102 LEU MD1 1 106 HIS HB2 . . 4.310 3.604 3.238 3.902 . 0 0 "[ . 1 . 2]" 1
1853 1 117 LEU H 1 117 LEU MD2 . . 5.500 3.641 1.968 4.588 . 0 0 "[ . 1 . 2]" 1
1854 1 110 LEU H 1 110 LEU MD2 . . 3.770 3.709 3.531 3.771 0.001 1 0 "[ . 1 . 2]" 1
1855 1 53 PHE QE 1 110 LEU MD2 . . 4.750 4.455 4.007 4.750 . 0 0 "[ . 1 . 2]" 1
1856 1 53 PHE HB2 1 110 LEU MD2 . . 4.410 4.210 3.878 4.412 0.002 15 0 "[ . 1 . 2]" 1
1857 1 54 PRO HG3 1 110 LEU MD2 . . 4.120 4.045 3.794 4.134 0.014 8 0 "[ . 1 . 2]" 1
1858 1 53 PHE H 1 110 LEU MD2 . . 5.500 5.099 4.843 5.346 . 0 0 "[ . 1 . 2]" 1
1859 1 53 PHE QD 1 110 LEU MD2 . . 3.320 2.607 2.122 2.957 . 0 0 "[ . 1 . 2]" 1
1860 1 110 LEU HA 1 110 LEU MD2 . . 2.880 2.276 2.139 2.390 . 0 0 "[ . 1 . 2]" 1
1861 1 54 PRO HD2 1 110 LEU MD2 . . 3.410 2.346 2.113 2.496 . 0 0 "[ . 1 . 2]" 1
1862 1 53 PHE HB3 1 110 LEU MD2 . . 3.570 2.730 2.406 2.957 . 0 0 "[ . 1 . 2]" 1
1863 1 54 PRO HG2 1 110 LEU MD2 . . 4.120 3.145 3.004 3.343 . 0 0 "[ . 1 . 2]" 1
1864 1 34 TRP HA 1 34 TRP HE3 . . 5.500 4.227 4.040 4.403 . 0 0 "[ . 1 . 2]" 1
1865 1 34 TRP HA 1 39 LYS QE . . 4.910 4.689 4.099 4.915 0.005 17 0 "[ . 1 . 2]" 1
1866 1 10 LEU H 1 10 LEU MD2 . . 4.490 4.266 3.444 4.393 . 0 0 "[ . 1 . 2]" 1
1867 1 10 LEU MD2 1 11 ALA H . . 5.200 4.372 3.161 5.180 . 0 0 "[ . 1 . 2]" 1
1868 1 10 LEU HA 1 10 LEU MD2 . . 4.110 3.287 2.139 3.547 . 0 0 "[ . 1 . 2]" 1
1869 1 12 LEU H 1 12 LEU MD2 . . 3.950 3.439 3.040 3.619 . 0 0 "[ . 1 . 2]" 1
1870 1 12 LEU MD2 1 17 PHE HA . . 3.650 3.072 2.771 3.473 . 0 0 "[ . 1 . 2]" 1
1871 1 12 LEU MD2 1 16 ASN HB2 . . 4.830 3.841 3.382 4.396 . 0 0 "[ . 1 . 2]" 1
1872 1 12 LEU MD2 1 17 PHE QB . . 5.500 4.416 4.135 4.786 . 0 0 "[ . 1 . 2]" 1
1873 1 12 LEU MD2 1 16 ASN HD21 . . 4.230 2.632 2.039 4.232 0.002 18 0 "[ . 1 . 2]" 1
1874 1 12 LEU MD2 1 16 ASN HD22 . . 4.230 3.287 1.921 4.093 . 0 0 "[ . 1 . 2]" 1
1875 1 12 LEU MD2 1 20 THR HG1 . . 3.670 2.641 2.180 3.210 . 0 0 "[ . 1 . 2]" 1
1876 1 12 LEU HA 1 12 LEU MD2 . . 2.920 2.046 1.958 2.170 . 0 0 "[ . 1 . 2]" 1
1877 1 12 LEU MD2 1 20 THR HB . . 3.590 2.525 1.976 2.977 . 0 0 "[ . 1 . 2]" 1
1878 1 29 LYS H 1 29 LYS QG . . 5.140 4.155 3.695 4.254 . 0 0 "[ . 1 . 2]" 1
1879 1 29 LYS QG 1 31 TYR HB3 . . 3.910 3.495 2.704 3.895 . 0 0 "[ . 1 . 2]" 1
1880 1 29 LYS QG 1 31 TYR QD . . 4.870 4.110 2.383 4.820 . 0 0 "[ . 1 . 2]" 1
1881 1 29 LYS QG 1 82 PRO HA . . 5.500 4.733 4.318 5.227 . 0 0 "[ . 1 . 2]" 1
1882 1 29 LYS QG 1 31 TYR HB2 . . 5.330 4.858 4.224 5.188 . 0 0 "[ . 1 . 2]" 1
1883 1 29 LYS QG 1 84 LEU MD2 . . 3.740 1.864 1.651 2.860 . 0 0 "[ . 1 . 2]" 1
1884 1 48 LEU H 1 48 LEU MD1 . . 4.480 3.813 3.596 4.005 . 0 0 "[ . 1 . 2]" 1
1885 1 48 LEU MD1 1 53 PHE QE . . 3.500 3.336 3.028 3.504 0.004 17 0 "[ . 1 . 2]" 1
1886 1 48 LEU MD1 1 53 PHE HZ . . 3.340 2.951 2.690 3.268 . 0 0 "[ . 1 . 2]" 1
1887 1 48 LEU MD1 1 106 HIS HD2 . . 3.590 3.036 2.307 3.427 . 0 0 "[ . 1 . 2]" 1
1888 1 48 LEU HA 1 48 LEU MD1 . . 2.960 2.065 1.954 2.308 . 0 0 "[ . 1 . 2]" 1
1889 1 48 LEU MD1 1 106 HIS HB3 . . 4.490 4.347 4.060 4.500 0.010 8 0 "[ . 1 . 2]" 1
1890 1 48 LEU MD1 1 106 HIS HB2 . . 3.530 3.074 2.802 3.231 . 0 0 "[ . 1 . 2]" 1
1891 1 48 LEU MD1 1 105 LEU HB2 . . 3.650 2.445 2.126 2.933 . 0 0 "[ . 1 . 2]" 1
1892 1 48 LEU HB2 1 48 LEU MD1 . . 3.010 2.303 2.164 2.384 . 0 0 "[ . 1 . 2]" 1
1893 1 48 LEU MD1 1 102 LEU MD1 . . 2.870 2.550 2.238 2.849 . 0 0 "[ . 1 . 2]" 1
1894 1 48 LEU MD1 1 109 VAL MG2 . . 3.740 3.537 3.168 3.745 0.005 13 0 "[ . 1 . 2]" 1
1895 1 48 LEU MD1 1 61 ILE MD . . 3.970 3.589 3.484 3.762 . 0 0 "[ . 1 . 2]" 1
1896 1 48 LEU MD1 1 61 ILE MG . . 4.950 4.580 4.319 4.701 . 0 0 "[ . 1 . 2]" 1
1897 1 44 THR MG 1 102 LEU H . . 3.420 2.426 2.137 2.745 . 0 0 "[ . 1 . 2]" 1
1898 1 44 THR MG 1 45 TRP H . . 4.290 3.288 2.956 3.586 . 0 0 "[ . 1 . 2]" 1
1899 1 44 THR MG 1 101 ASP HA . . 3.790 2.884 2.382 3.430 . 0 0 "[ . 1 . 2]" 1
1900 1 44 THR HA 1 44 THR MG . . 3.050 2.360 2.242 2.454 . 0 0 "[ . 1 . 2]" 1
1901 1 44 THR MG 1 102 LEU HA . . 3.160 2.401 2.100 2.637 . 0 0 "[ . 1 . 2]" 1
1902 1 44 THR MG 1 45 TRP HB2 . . 5.150 4.548 4.248 4.875 . 0 0 "[ . 1 . 2]" 1
1903 1 44 THR MG 1 101 ASP HB3 . . 5.490 4.458 3.956 5.038 . 0 0 "[ . 1 . 2]" 1
1904 1 44 THR MG 1 48 LEU MD2 . . 5.110 4.489 4.163 4.878 . 0 0 "[ . 1 . 2]" 1
1905 1 12 LEU H 1 64 VAL MG2 . . 4.010 3.346 2.906 3.664 . 0 0 "[ . 1 . 2]" 1
1906 1 12 LEU HB2 1 64 VAL MG2 . . 3.040 2.616 2.313 2.991 . 0 0 "[ . 1 . 2]" 1
1907 1 59 VAL MG2 1 60 LYS H . . 4.340 3.982 3.705 4.206 . 0 0 "[ . 1 . 2]" 1
1908 1 53 PHE QE 1 59 VAL MG2 . . 5.030 3.584 3.337 3.978 . 0 0 "[ . 1 . 2]" 1
1909 1 56 LEU HA 1 59 VAL MG2 . . 5.050 4.927 4.600 5.054 0.004 6 0 "[ . 1 . 2]" 1
1910 1 59 VAL HA 1 59 VAL MG2 . . 3.180 2.295 2.121 2.386 . 0 0 "[ . 1 . 2]" 1
1911 1 58 GLY QA 1 59 VAL MG2 . . 4.690 3.882 3.738 4.143 . 0 0 "[ . 1 . 2]" 1
1912 1 53 PHE HB2 1 59 VAL MG2 . . 3.640 2.576 2.278 2.845 . 0 0 "[ . 1 . 2]" 1
1913 1 53 PHE HB3 1 59 VAL MG2 . . 3.650 3.165 2.829 3.310 . 0 0 "[ . 1 . 2]" 1
1914 1 59 VAL MG2 1 109 VAL HB . . 5.210 4.450 3.964 4.740 . 0 0 "[ . 1 . 2]" 1
1915 1 25 ILE HB 1 59 VAL MG2 . . 3.070 2.271 1.926 2.706 . 0 0 "[ . 1 . 2]" 1
1916 1 17 PHE QD 1 64 VAL MG2 . . 3.230 2.391 2.162 2.691 . 0 0 "[ . 1 . 2]" 1
1917 1 17 PHE QE 1 64 VAL MG2 . . 3.560 2.415 1.974 2.789 . 0 0 "[ . 1 . 2]" 1
1918 1 40 THR MG 1 41 LEU HA . . 4.440 3.573 3.233 4.028 . 0 0 "[ . 1 . 2]" 1
1919 1 39 LYS QB 1 40 THR MG . . 5.170 4.904 4.360 5.166 . 0 0 "[ . 1 . 2]" 1
1920 1 30 PHE QE 1 64 VAL MG1 . . 3.820 3.028 2.456 3.635 . 0 0 "[ . 1 . 2]" 1
1921 1 30 PHE QE 1 64 VAL MG2 . . 4.380 3.459 2.839 4.046 . 0 0 "[ . 1 . 2]" 1
1922 1 88 ARG HD2 1 113 ALA HA . . 5.500 3.800 2.844 5.500 0.000 19 0 "[ . 1 . 2]" 1
1923 1 88 ARG HD3 1 113 ALA HA . . 5.500 3.832 2.669 4.594 . 0 0 "[ . 1 . 2]" 1
1924 1 25 ILE MD 1 113 ALA HA . . 4.000 3.428 2.619 3.819 . 0 0 "[ . 1 . 2]" 1
1925 1 56 LEU MD2 1 113 ALA HA . . 4.290 4.112 3.857 4.296 0.006 14 0 "[ . 1 . 2]" 1
1926 1 86 LEU MD2 1 113 ALA HA . . 4.710 4.050 3.430 4.704 . 0 0 "[ . 1 . 2]" 1
1927 1 37 HIS HA 1 40 THR MG . . 4.900 4.195 2.465 4.881 . 0 0 "[ . 1 . 2]" 1
1928 1 40 THR HA 1 40 THR MG . . 3.180 2.609 2.204 3.179 . 0 0 "[ . 1 . 2]" 1
1929 1 78 VAL MG1 1 79 ARG H . . 3.920 3.050 2.657 3.494 . 0 0 "[ . 1 . 2]" 1
1930 1 78 VAL H 1 78 VAL MG1 . . 4.150 3.773 3.746 3.800 . 0 0 "[ . 1 . 2]" 1
1931 1 78 VAL MG1 1 81 TYR QD . . 3.650 2.400 2.088 2.766 . 0 0 "[ . 1 . 2]" 1
1932 1 78 VAL MG1 1 83 THR HG1 . . 3.360 2.354 1.804 3.073 . 0 0 "[ . 1 . 2]" 1
1933 1 78 VAL MG1 1 83 THR HB . . 3.180 2.223 1.963 2.586 . 0 0 "[ . 1 . 2]" 1
1934 1 30 PHE HB2 1 78 VAL MG1 . . 3.540 2.259 1.917 2.773 . 0 0 "[ . 1 . 2]" 1
1935 1 30 PHE HB3 1 78 VAL MG1 . . 3.420 2.734 2.135 3.204 . 0 0 "[ . 1 . 2]" 1
1936 1 73 CYS HB3 1 78 VAL MG1 . . 3.980 3.619 3.328 3.870 . 0 0 "[ . 1 . 2]" 1
1937 1 64 VAL MG1 1 66 CYS H . . 4.650 4.421 4.230 4.637 . 0 0 "[ . 1 . 2]" 1
1938 1 64 VAL MG1 1 66 CYS HA . . 3.960 3.831 3.705 3.969 0.009 18 0 "[ . 1 . 2]" 1
1939 1 64 VAL MG1 1 69 GLU HG2 . . 3.890 3.607 2.482 3.893 0.003 20 0 "[ . 1 . 2]" 1
1940 1 64 VAL MG1 1 69 GLU HG3 . . 3.890 3.489 2.354 3.896 0.006 13 0 "[ . 1 . 2]" 1
1941 1 64 VAL MG1 1 69 GLU HB2 . . 3.060 2.245 1.979 2.560 . 0 0 "[ . 1 . 2]" 1
1942 1 30 PHE HB3 1 64 VAL MG1 . . 5.040 3.994 3.610 4.289 . 0 0 "[ . 1 . 2]" 1
1943 1 109 VAL MG1 1 113 ALA H . . 4.730 3.458 3.073 3.811 . 0 0 "[ . 1 . 2]" 1
1944 1 53 PHE QE 1 109 VAL MG1 . . 3.690 2.719 2.331 3.196 . 0 0 "[ . 1 . 2]" 1
1945 1 53 PHE QD 1 109 VAL MG1 . . 3.610 2.719 2.377 3.159 . 0 0 "[ . 1 . 2]" 1
1946 1 109 VAL MG1 1 113 ALA HA . . 5.500 4.960 4.333 5.326 . 0 0 "[ . 1 . 2]" 1
1947 1 59 VAL HA 1 109 VAL MG1 . . 5.170 4.899 4.651 5.094 . 0 0 "[ . 1 . 2]" 1
1948 1 109 VAL MG1 1 110 LEU HA . . 4.140 3.452 3.136 3.731 . 0 0 "[ . 1 . 2]" 1
1949 1 53 PHE HB2 1 109 VAL MG1 . . 4.850 4.501 3.942 4.831 . 0 0 "[ . 1 . 2]" 1
1950 1 109 VAL HA 1 109 VAL MG1 . . 3.100 2.398 2.257 2.493 . 0 0 "[ . 1 . 2]" 1
1951 1 59 VAL HB 1 109 VAL MG1 . . 4.620 4.022 3.417 4.380 . 0 0 "[ . 1 . 2]" 1
1952 1 56 LEU HG 1 109 VAL MG1 . . 5.500 5.112 4.100 5.504 0.004 20 0 "[ . 1 . 2]" 1
1953 1 86 LEU HG 1 109 VAL MG1 . . 5.500 4.968 4.510 5.503 0.003 20 0 "[ . 1 . 2]" 1
1954 1 59 VAL MG1 1 109 VAL MG1 . . 3.230 2.437 2.006 2.932 . 0 0 "[ . 1 . 2]" 1
1955 1 9 VAL MG2 1 62 ALA HA . . 5.210 4.708 4.481 4.904 . 0 0 "[ . 1 . 2]" 1
1956 1 9 VAL MG2 1 49 SER HG . . 3.730 3.428 3.214 3.618 . 0 0 "[ . 1 . 2]" 1
1957 1 8 THR HA 1 9 VAL MG2 . . 4.480 3.730 3.561 3.822 . 0 0 "[ . 1 . 2]" 1
1958 1 9 VAL MG2 1 46 GLU HA . . 2.900 2.319 2.136 2.590 . 0 0 "[ . 1 . 2]" 1
1959 1 9 VAL MG2 1 49 SER HB3 . . 3.210 3.147 2.969 3.213 0.003 12 0 "[ . 1 . 2]" 1
1960 1 9 VAL MG2 1 46 GLU HG3 . . 3.960 2.502 1.967 3.836 . 0 0 "[ . 1 . 2]" 1
1961 1 67 THR H 1 68 ALA MB . . 4.510 3.885 3.675 4.288 . 0 0 "[ . 1 . 2]" 1
1962 1 65 ASP HA 1 68 ALA MB . . 5.500 5.286 4.530 5.504 0.004 7 0 "[ . 1 . 2]" 1
1963 1 68 ALA MB 1 69 GLU HB3 . . 5.090 5.035 4.861 5.103 0.013 15 0 "[ . 1 . 2]" 1
1964 1 65 ASP H 1 68 ALA MB . . 4.830 4.438 3.789 4.824 . 0 0 "[ . 1 . 2]" 1
1965 1 68 ALA MB 1 69 GLU H . . 3.370 2.772 2.538 3.003 . 0 0 "[ . 1 . 2]" 1
1966 1 68 ALA MB 1 69 GLU HA . . 4.730 3.957 3.848 4.175 . 0 0 "[ . 1 . 2]" 1
1967 1 67 THR HB 1 68 ALA MB . . 4.770 4.375 4.223 4.759 . 0 0 "[ . 1 . 2]" 1
1968 1 8 THR MG 1 9 VAL H . . 4.150 3.901 3.724 4.093 . 0 0 "[ . 1 . 2]" 1
1969 1 8 THR HA 1 8 THR MG . . 3.200 2.169 1.988 2.336 . 0 0 "[ . 1 . 2]" 1
1970 1 7 GLY QA 1 8 THR MG . . 4.310 3.694 3.352 4.095 . 0 0 "[ . 1 . 2]" 1
1971 1 8 THR MG 1 46 GLU HA . . 4.920 4.666 4.014 4.936 0.016 15 0 "[ . 1 . 2]" 1
1972 1 8 THR MG 1 46 GLU HB3 . . 5.170 3.495 2.667 4.204 . 0 0 "[ . 1 . 2]" 1
1973 1 9 VAL MG2 1 46 GLU H . . 4.330 3.673 3.473 3.890 . 0 0 "[ . 1 . 2]" 1
1974 1 93 VAL MG1 1 94 SER H . . 4.150 3.145 2.950 3.442 . 0 0 "[ . 1 . 2]" 1
1975 1 88 ARG HB2 1 93 VAL MG1 . . 4.280 3.875 3.619 4.282 0.002 14 0 "[ . 1 . 2]" 1
1976 1 88 ARG HB3 1 93 VAL MG1 . . 4.280 3.732 3.264 4.117 . 0 0 "[ . 1 . 2]" 1
1977 1 93 VAL MG1 1 112 GLN HG3 . . 4.450 3.688 2.989 4.203 . 0 0 "[ . 1 . 2]" 1
1978 1 93 VAL MG1 1 112 GLN HB3 . . 4.950 2.892 2.313 3.513 . 0 0 "[ . 1 . 2]" 1
1979 1 93 VAL H 1 93 VAL MG1 . . 4.160 3.851 3.783 3.903 . 0 0 "[ . 1 . 2]" 1
1980 1 88 ARG H 1 93 VAL MG1 . . 4.850 4.561 4.238 4.849 . 0 0 "[ . 1 . 2]" 1
1981 1 87 PHE HA 1 93 VAL MG1 . . 5.290 4.929 4.776 5.203 . 0 0 "[ . 1 . 2]" 1
1982 1 93 VAL HA 1 93 VAL MG1 . . 3.290 2.320 2.264 2.416 . 0 0 "[ . 1 . 2]" 1
1983 1 9 VAL MG1 1 49 SER HB3 . . 4.910 4.780 4.545 4.912 0.002 1 0 "[ . 1 . 2]" 1
1984 1 87 PHE HB3 1 93 VAL MG2 . . 5.240 4.248 4.036 4.542 . 0 0 "[ . 1 . 2]" 1
1985 1 9 VAL MG1 1 45 TRP HE1 . . 3.360 2.572 2.012 3.363 0.003 16 0 "[ . 1 . 2]" 1
1986 1 9 VAL H 1 9 VAL MG1 . . 4.350 3.915 3.863 3.955 . 0 0 "[ . 1 . 2]" 1
1987 1 87 PHE HA 1 93 VAL MG2 . . 3.760 2.197 1.983 2.520 . 0 0 "[ . 1 . 2]" 1
1988 1 92 LYS HA 1 93 VAL MG2 . . 4.340 3.381 3.230 3.619 . 0 0 "[ . 1 . 2]" 1
1989 1 9 VAL MG1 1 63 GLU HB3 . . 3.290 1.927 1.843 2.046 . 0 0 "[ . 1 . 2]" 1
1990 1 9 VAL MG1 1 63 GLU HB2 . . 3.360 2.827 2.039 3.345 . 0 0 "[ . 1 . 2]" 1
1991 1 26 THR MG 1 28 ILE H . . 4.710 3.996 3.777 4.179 . 0 0 "[ . 1 . 2]" 1
1992 1 26 THR MG 1 27 PHE H . . 3.480 2.787 2.486 2.984 . 0 0 "[ . 1 . 2]" 1
1993 1 26 THR MG 1 62 ALA H . . 4.250 3.314 3.135 3.703 . 0 0 "[ . 1 . 2]" 1
1994 1 26 THR H 1 26 THR MG . . 4.300 3.901 3.870 3.936 . 0 0 "[ . 1 . 2]" 1
1995 1 26 THR MG 1 27 PHE HA . . 4.910 4.026 3.867 4.178 . 0 0 "[ . 1 . 2]" 1
1996 1 26 THR HA 1 26 THR MG . . 3.090 2.323 2.231 2.455 . 0 0 "[ . 1 . 2]" 1
1997 1 26 THR MG 1 28 ILE HA . . 4.410 4.004 3.855 4.140 . 0 0 "[ . 1 . 2]" 1
1998 1 26 THR MG 1 60 LYS HE2 . . 4.720 4.163 3.424 4.671 . 0 0 "[ . 1 . 2]" 1
1999 1 26 THR MG 1 87 PHE HB2 . . 4.490 4.350 4.199 4.491 0.001 5 0 "[ . 1 . 2]" 1
2000 1 26 THR MG 1 60 LYS HE3 . . 4.720 3.711 3.050 4.439 . 0 0 "[ . 1 . 2]" 1
2001 1 26 THR MG 1 28 ILE HG13 . . 3.250 2.436 2.185 2.689 . 0 0 "[ . 1 . 2]" 1
2002 1 26 THR MG 1 60 LYS HB2 . . 3.630 2.684 2.318 3.049 . 0 0 "[ . 1 . 2]" 1
2003 1 12 LEU HG 1 26 THR MG . . 4.490 4.298 3.982 4.493 0.003 11 0 "[ . 1 . 2]" 1
2004 1 26 THR MG 1 60 LYS HB3 . . 3.450 3.121 2.787 3.402 . 0 0 "[ . 1 . 2]" 1
2005 1 26 THR MG 1 62 ALA MB . . 2.970 2.671 2.502 2.892 . 0 0 "[ . 1 . 2]" 1
2006 1 26 THR MG 1 28 ILE HG12 . . 3.110 2.833 2.540 3.107 . 0 0 "[ . 1 . 2]" 1
2007 1 26 THR MG 1 28 ILE MD . . 3.240 2.951 2.453 3.165 . 0 0 "[ . 1 . 2]" 1
2008 1 26 THR MG 1 28 ILE MG . . 4.600 4.332 4.128 4.528 . 0 0 "[ . 1 . 2]" 1
2009 1 21 ILE MG 1 26 THR MG . . 3.310 2.288 1.954 2.665 . 0 0 "[ . 1 . 2]" 1
2010 1 26 THR MG 1 87 PHE QD . . 4.540 4.350 3.991 4.540 0.000 17 0 "[ . 1 . 2]" 1
2011 1 11 ALA MB 1 13 THR MG . . 4.130 3.685 3.527 3.909 . 0 0 "[ . 1 . 2]" 1
2012 1 93 VAL H 1 93 VAL MG2 . . 3.360 2.595 2.179 2.953 . 0 0 "[ . 1 . 2]" 1
2013 1 88 ARG H 1 93 VAL MG2 . . 3.660 2.044 1.857 2.327 . 0 0 "[ . 1 . 2]" 1
2014 1 9 VAL MG1 1 46 GLU HA . . 5.290 4.726 4.421 5.096 . 0 0 "[ . 1 . 2]" 1
2015 1 88 ARG HD2 1 93 VAL MG2 . . 4.950 4.225 3.705 4.729 . 0 0 "[ . 1 . 2]" 1
2016 1 88 ARG HD3 1 93 VAL MG2 . . 4.950 3.658 3.087 4.604 . 0 0 "[ . 1 . 2]" 1
2017 1 32 ALA MB 1 33 PRO HD3 . . 4.030 3.678 3.592 3.823 . 0 0 "[ . 1 . 2]" 1
2018 1 13 THR H 1 13 THR MG . . 3.520 2.859 2.535 3.030 . 0 0 "[ . 1 . 2]" 1
2019 1 13 THR MG 1 14 GLU H . . 4.050 3.738 3.548 3.826 . 0 0 "[ . 1 . 2]" 1
2020 1 13 THR MG 1 15 ASN H . . 4.760 4.105 4.034 4.414 . 0 0 "[ . 1 . 2]" 1
2021 1 13 THR MG 1 16 ASN HD21 . . 4.950 4.086 3.497 4.932 . 0 0 "[ . 1 . 2]" 1
2022 1 13 THR MG 1 16 ASN HD22 . . 4.950 2.747 2.058 3.639 . 0 0 "[ . 1 . 2]" 1
2023 1 12 LEU HA 1 13 THR MG . . 4.070 3.470 3.124 3.658 . 0 0 "[ . 1 . 2]" 1
2024 1 13 THR HA 1 13 THR MG . . 3.160 2.366 2.268 2.539 . 0 0 "[ . 1 . 2]" 1
2025 1 13 THR MG 1 69 GLU HG3 . . 5.110 4.774 4.311 5.087 . 0 0 "[ . 1 . 2]" 1
2026 1 12 LEU HB3 1 13 THR MG . . 5.180 4.753 4.527 4.882 . 0 0 "[ . 1 . 2]" 1
2027 1 20 THR MG 1 21 ILE H . . 4.160 3.010 2.745 3.330 . 0 0 "[ . 1 . 2]" 1
2028 1 20 THR MG 1 22 ALA H . . 5.260 4.614 4.305 4.824 . 0 0 "[ . 1 . 2]" 1
2029 1 20 THR MG 1 26 THR HG1 . . 5.160 3.202 2.070 3.936 . 0 0 "[ . 1 . 2]" 1
2030 1 20 THR HA 1 20 THR MG . . 3.070 2.385 2.244 2.475 . 0 0 "[ . 1 . 2]" 1
2031 1 20 THR MG 1 60 LYS HE3 . . 4.130 2.796 2.352 3.668 . 0 0 "[ . 1 . 2]" 1
2032 1 20 THR MG 1 21 ILE MG . . 3.940 3.170 2.481 3.438 . 0 0 "[ . 1 . 2]" 1
2033 1 78 VAL MG2 1 79 ARG H . . 4.700 4.239 3.978 4.354 . 0 0 "[ . 1 . 2]" 1
2034 1 30 PHE QD 1 78 VAL MG2 . . 3.820 3.078 2.897 3.314 . 0 0 "[ . 1 . 2]" 1
2035 1 30 PHE QE 1 78 VAL MG2 . . 4.570 3.794 3.482 4.227 . 0 0 "[ . 1 . 2]" 1
2036 1 76 TYR QD 1 78 VAL MG2 . . 4.840 3.383 3.121 3.755 . 0 0 "[ . 1 . 2]" 1
2037 1 76 TYR H 1 78 VAL MG2 . . 4.590 3.325 3.145 3.564 . 0 0 "[ . 1 . 2]" 1
2038 1 78 VAL MG2 1 83 THR HG1 . . 4.890 3.855 3.170 4.680 . 0 0 "[ . 1 . 2]" 1
2039 1 78 VAL MG2 1 83 THR HB . . 3.940 3.238 2.889 3.574 . 0 0 "[ . 1 . 2]" 1
2040 1 30 PHE HB2 1 78 VAL MG2 . . 4.090 2.877 2.658 3.167 . 0 0 "[ . 1 . 2]" 1
2041 1 76 TYR HB3 1 78 VAL MG2 . . 3.660 2.450 2.190 2.710 . 0 0 "[ . 1 . 2]" 1
2042 1 73 CYS HB3 1 78 VAL MG2 . . 3.970 3.389 2.853 3.811 . 0 0 "[ . 1 . 2]" 1
2043 1 76 TYR HB2 1 78 VAL MG2 . . 3.660 1.948 1.830 2.088 . 0 0 "[ . 1 . 2]" 1
2044 1 78 VAL MG2 1 85 LEU HG . . 4.850 4.452 4.048 4.650 . 0 0 "[ . 1 . 2]" 1
2045 1 78 VAL MG2 1 83 THR MG . . 3.350 2.400 2.005 2.722 . 0 0 "[ . 1 . 2]" 1
2046 1 31 TYR QD 1 33 PRO HD3 . . 5.000 4.019 3.731 4.160 . 0 0 "[ . 1 . 2]" 1
2047 1 33 PRO HD3 1 34 TRP H . . 4.770 4.026 3.849 4.064 . 0 0 "[ . 1 . 2]" 1
2048 1 33 PRO HD3 1 66 CYS H . . 4.980 3.647 3.414 3.965 . 0 0 "[ . 1 . 2]" 1
2049 1 33 PRO HD3 1 67 THR MG . . 3.620 3.053 2.912 3.265 . 0 0 "[ . 1 . 2]" 1
2050 1 33 PRO HD2 1 67 THR H . . 5.410 4.038 3.148 4.627 . 0 0 "[ . 1 . 2]" 1
2051 1 31 TYR QE 1 33 PRO HD2 . . 4.980 4.791 4.612 4.883 . 0 0 "[ . 1 . 2]" 1
2052 1 32 ALA HA 1 33 PRO HD2 . . 3.190 2.106 2.014 2.151 . 0 0 "[ . 1 . 2]" 1
2053 1 33 PRO HD2 1 66 CYS HB2 . . 5.360 4.417 4.144 4.685 . 0 0 "[ . 1 . 2]" 1
2054 1 31 TYR H 1 65 ASP HA . . 4.170 3.339 2.977 3.670 . 0 0 "[ . 1 . 2]" 1
2055 1 65 ASP HA 1 68 ALA H . . 5.210 4.814 4.541 4.987 . 0 0 "[ . 1 . 2]" 1
2056 1 31 TYR QD 1 65 ASP HA . . 4.520 3.993 3.754 4.224 . 0 0 "[ . 1 . 2]" 1
2057 1 65 ASP HA 1 66 CYS HA . . 5.000 4.355 4.339 4.372 . 0 0 "[ . 1 . 2]" 1
2058 1 64 VAL HA 1 65 ASP HA . . 4.430 4.373 4.362 4.384 . 0 0 "[ . 1 . 2]" 1
2059 1 64 VAL MG1 1 65 ASP HA . . 4.830 3.822 3.713 3.989 . 0 0 "[ . 1 . 2]" 1
2060 1 83 THR MG 1 84 LEU H . . 3.460 2.310 2.035 2.512 . 0 0 "[ . 1 . 2]" 1
2061 1 79 ARG H 1 83 THR MG . . 5.240 4.413 4.066 4.815 . 0 0 "[ . 1 . 2]" 1
2062 1 83 THR MG 1 85 LEU H . . 5.500 4.511 4.079 5.027 . 0 0 "[ . 1 . 2]" 1
2063 1 30 PHE QD 1 83 THR MG . . 3.990 2.769 2.341 3.168 . 0 0 "[ . 1 . 2]" 1
2064 1 30 PHE QE 1 83 THR MG . . 4.760 3.986 3.596 4.354 . 0 0 "[ . 1 . 2]" 1
2065 1 80 GLY H 1 83 THR MG . . 5.160 4.484 4.037 4.957 . 0 0 "[ . 1 . 2]" 1
2066 1 83 THR HA 1 83 THR MG . . 3.340 2.279 2.135 2.489 . 0 0 "[ . 1 . 2]" 1
2067 1 30 PHE HB2 1 83 THR MG . . 4.230 3.221 2.869 3.392 . 0 0 "[ . 1 . 2]" 1
2068 1 30 PHE HB3 1 83 THR MG . . 5.140 4.571 4.207 4.722 . 0 0 "[ . 1 . 2]" 1
2069 1 76 TYR HB3 1 83 THR MG . . 5.500 4.290 3.883 4.603 . 0 0 "[ . 1 . 2]" 1
2070 1 83 THR MG 1 85 LEU HG . . 3.050 2.672 2.452 3.003 . 0 0 "[ . 1 . 2]" 1
2071 1 82 PRO HA 1 83 THR MG . . 5.500 5.413 5.345 5.451 . 0 0 "[ . 1 . 2]" 1
2072 1 83 THR MG 1 95 GLU HA . . 5.500 5.223 4.989 5.473 . 0 0 "[ . 1 . 2]" 1
2073 1 83 THR MG 1 84 LEU HG . . 4.690 4.421 4.162 4.609 . 0 0 "[ . 1 . 2]" 1
2074 1 53 PHE HB2 1 59 VAL MG1 . . 4.880 4.642 4.315 4.880 . 0 0 "[ . 1 . 2]" 1
2075 1 27 PHE HB2 1 59 VAL MG1 . . 4.520 3.029 2.596 3.420 . 0 0 "[ . 1 . 2]" 1
2076 1 27 PHE H 1 59 VAL MG1 . . 4.940 3.168 2.782 3.716 . 0 0 "[ . 1 . 2]" 1
2077 1 53 PHE QE 1 59 VAL MG1 . . 4.130 2.644 2.270 3.080 . 0 0 "[ . 1 . 2]" 1
2078 1 53 PHE HZ 1 59 VAL MG1 . . 4.140 2.785 2.348 3.532 . 0 0 "[ . 1 . 2]" 1
2079 1 27 PHE HB3 1 59 VAL MG1 . . 5.050 3.896 3.497 4.223 . 0 0 "[ . 1 . 2]" 1
2080 1 53 PHE HB2 1 54 PRO HD3 . . 5.150 5.079 5.047 5.096 . 0 0 "[ . 1 . 2]" 1
2081 1 53 PHE H 1 54 PRO HD3 . . 4.920 4.119 3.804 4.550 . 0 0 "[ . 1 . 2]" 1
2082 1 54 PRO HD3 1 106 HIS HE1 . . 4.750 3.834 3.281 4.471 . 0 0 "[ . 1 . 2]" 1
2083 1 54 PRO HD3 1 110 LEU MD2 . . 3.970 3.789 3.628 3.956 . 0 0 "[ . 1 . 2]" 1
2084 1 54 PRO HD3 1 110 LEU MD1 . . 4.890 4.835 4.639 4.892 0.002 13 0 "[ . 1 . 2]" 1
2085 1 53 PHE HB3 1 54 PRO HD3 . . 4.880 4.719 4.431 4.898 0.018 3 0 "[ . 1 . 2]" 1
2086 1 53 PHE QD 1 54 PRO HD2 . . 4.980 4.359 3.950 4.612 . 0 0 "[ . 1 . 2]" 1
2087 1 53 PHE HB3 1 54 PRO HD2 . . 4.710 3.659 3.225 3.962 . 0 0 "[ . 1 . 2]" 1
2088 1 54 PRO HD2 1 110 LEU MD1 . . 3.950 3.713 3.376 3.950 . 14 0 "[ . 1 . 2]" 1
2089 1 25 ILE H 1 57 ALA MB . . 4.900 2.994 2.405 3.381 . 0 0 "[ . 1 . 2]" 1
2090 1 56 LEU HA 1 57 ALA MB . . 4.380 4.066 4.007 4.112 . 0 0 "[ . 1 . 2]" 1
2091 1 57 ALA MB 1 58 GLY QA . . 4.130 3.823 3.734 3.910 . 0 0 "[ . 1 . 2]" 1
2092 1 25 ILE MD 1 57 ALA MB . . 4.500 2.490 1.911 2.833 . 0 0 "[ . 1 . 2]" 1
2093 1 24 GLY HA3 1 57 ALA MB . . 5.090 3.777 3.187 4.266 . 0 0 "[ . 1 . 2]" 1
2094 1 53 PHE HB2 1 54 PRO HD2 . . 4.970 4.583 4.354 4.732 . 0 0 "[ . 1 . 2]" 1
2095 1 32 ALA MB 1 67 THR HA . . 5.500 5.339 5.055 5.497 . 0 0 "[ . 1 . 2]" 1
2096 1 32 ALA MB 1 33 PRO HD2 . . 3.740 2.675 2.465 2.919 . 0 0 "[ . 1 . 2]" 1
2097 1 32 ALA MB 1 35 CYS HB2 . . 4.100 2.368 1.958 2.752 . 0 0 "[ . 1 . 2]" 1
2098 1 32 ALA MB 1 66 CYS HB2 . . 4.670 2.876 2.321 3.240 . 0 0 "[ . 1 . 2]" 1
2099 1 32 ALA MB 1 67 THR MG . . 3.230 2.964 2.645 3.224 . 0 0 "[ . 1 . 2]" 1
2100 1 22 ALA MB 1 90 GLY H . . 5.500 5.077 4.396 5.470 . 0 0 "[ . 1 . 2]" 1
2101 1 20 THR H 1 22 ALA MB . . 5.070 4.345 3.976 4.514 . 0 0 "[ . 1 . 2]" 1
2102 1 21 ILE H 1 22 ALA MB . . 4.630 4.335 4.155 4.496 . 0 0 "[ . 1 . 2]" 1
2103 1 22 ALA MB 1 23 GLU H . . 3.360 2.719 2.520 2.984 . 0 0 "[ . 1 . 2]" 1
2104 1 22 ALA H 1 22 ALA MB . . 2.800 2.106 2.027 2.184 . 0 0 "[ . 1 . 2]" 1
2105 1 19 ASP HA 1 22 ALA MB . . 3.300 2.376 1.969 2.748 . 0 0 "[ . 1 . 2]" 1
2106 1 18 ASP QB 1 22 ALA MB . . 4.750 4.167 3.684 4.731 . 0 0 "[ . 1 . 2]" 1
2107 1 22 ALA MB 1 23 GLU HG2 . . 4.020 3.369 2.560 4.022 0.002 7 0 "[ . 1 . 2]" 1
2108 1 21 ILE QG 1 22 ALA MB . . 4.400 3.180 3.035 3.492 . 0 0 "[ . 1 . 2]" 1
2109 1 43 PRO HD2 1 45 TRP H . . 5.140 4.617 4.374 4.784 . 0 0 "[ . 1 . 2]" 1
2110 1 43 PRO HD2 1 44 THR H . . 3.570 2.674 2.647 2.744 . 0 0 "[ . 1 . 2]" 1
2111 1 41 LEU HA 1 43 PRO HD2 . . 4.260 3.520 3.362 3.711 . 0 0 "[ . 1 . 2]" 1
2112 1 42 ALA MB 1 43 PRO HD2 . . 3.460 2.507 2.393 2.689 . 0 0 "[ . 1 . 2]" 1
2113 1 43 PRO HD3 1 44 THR H . . 4.220 3.844 3.834 3.868 . 0 0 "[ . 1 . 2]" 1
2114 1 113 ALA H 1 113 ALA MB . . 2.930 2.180 2.028 2.322 . 0 0 "[ . 1 . 2]" 1
2115 1 113 ALA MB 1 114 LYS HA . . 4.480 3.907 3.601 4.331 . 0 0 "[ . 1 . 2]" 1
2116 1 110 LEU HA 1 113 ALA MB . . 3.980 3.597 3.288 3.984 0.004 14 0 "[ . 1 . 2]" 1
2117 1 88 ARG HD2 1 113 ALA MB . . 5.500 3.671 2.933 4.824 . 0 0 "[ . 1 . 2]" 1
2118 1 88 ARG HD3 1 113 ALA MB . . 5.500 4.245 3.449 5.031 . 0 0 "[ . 1 . 2]" 1
2119 1 109 VAL HA 1 113 ALA MB . . 4.650 4.238 3.855 4.557 . 0 0 "[ . 1 . 2]" 1
2120 1 109 VAL HB 1 113 ALA MB . . 5.370 5.116 4.616 5.361 . 0 0 "[ . 1 . 2]" 1
2121 1 113 ALA MB 1 114 LYS HB2 . . 5.500 4.294 3.727 5.097 . 0 0 "[ . 1 . 2]" 1
2122 1 113 ALA MB 1 114 LYS HB3 . . 5.500 5.075 3.931 5.520 0.020 10 0 "[ . 1 . 2]" 1
2123 1 25 ILE HG13 1 113 ALA MB . . 4.980 4.476 4.098 4.906 . 0 0 "[ . 1 . 2]" 1
2124 1 113 ALA MB 1 114 LYS QD . . 5.500 5.035 4.306 5.494 . 0 0 "[ . 1 . 2]" 1
2125 1 56 LEU MD2 1 113 ALA MB . . 3.150 1.858 1.715 2.239 . 0 0 "[ . 1 . 2]" 1
2126 1 86 LEU MD1 1 113 ALA MB . . 4.770 4.250 3.819 4.550 . 0 0 "[ . 1 . 2]" 1
2127 1 86 LEU MD2 1 113 ALA MB . . 3.940 3.590 3.011 3.867 . 0 0 "[ . 1 . 2]" 1
2128 1 109 VAL MG1 1 113 ALA MB . . 3.830 2.861 2.340 3.174 . 0 0 "[ . 1 . 2]" 1
2129 1 112 GLN HA 1 113 ALA MB . . 5.250 5.020 4.956 5.048 . 0 0 "[ . 1 . 2]" 1
2130 1 41 LEU MD2 1 82 PRO HD2 . . 5.150 4.833 4.523 5.122 . 0 0 "[ . 1 . 2]" 1
2131 1 41 LEU MD2 1 82 PRO HD3 . . 5.150 4.464 4.034 4.872 . 0 0 "[ . 1 . 2]" 1
2132 1 11 ALA MB 1 63 GLU H . . 4.800 4.446 4.211 4.660 . 0 0 "[ . 1 . 2]" 1
2133 1 11 ALA H 1 11 ALA MB . . 2.820 2.206 2.072 2.426 . 0 0 "[ . 1 . 2]" 1
2134 1 11 ALA MB 1 12 LEU HA . . 4.970 4.300 4.160 4.413 . 0 0 "[ . 1 . 2]" 1
2135 1 9 VAL HB 1 11 ALA MB . . 5.500 5.155 4.644 5.515 0.015 19 0 "[ . 1 . 2]" 1
2136 1 9 VAL MG1 1 11 ALA MB . . 4.700 3.828 3.313 4.343 . 0 0 "[ . 1 . 2]" 1
2137 1 11 ALA MB 1 12 LEU MD2 . . 5.300 4.727 4.092 5.240 . 0 0 "[ . 1 . 2]" 1
2138 1 11 ALA MB 1 64 VAL MG2 . . 5.500 5.209 4.873 5.443 . 0 0 "[ . 1 . 2]" 1
2139 1 96 HIS HE1 1 100 ARG H . . 5.500 4.521 2.808 5.341 . 0 0 "[ . 1 . 2]" 1
2140 1 96 HIS HE1 1 98 GLY HA2 . . 4.600 4.350 3.851 4.596 . 0 0 "[ . 1 . 2]" 1
2141 1 96 HIS HE1 1 98 GLY HA3 . . 4.600 3.177 2.540 4.420 . 0 0 "[ . 1 . 2]" 1
2142 1 84 LEU MD1 1 96 HIS HE1 . . 5.160 4.733 3.962 5.131 . 0 0 "[ . 1 . 2]" 1
2143 1 96 HIS HE1 1 105 LEU MD2 . . 5.360 4.195 3.048 5.008 . 0 0 "[ . 1 . 2]" 1
2144 1 96 HIS HE1 1 108 PHE QD . . 5.200 4.606 4.111 5.120 . 0 0 "[ . 1 . 2]" 1
2145 1 54 PRO HD2 1 106 HIS HE1 . . 4.310 3.549 2.974 4.129 . 0 0 "[ . 1 . 2]" 1
2146 1 51 LYS HE3 1 106 HIS HE1 . . 5.250 3.931 3.472 4.569 . 0 0 "[ . 1 . 2]" 1
2147 1 106 HIS HE1 1 110 LEU HG . . 5.020 4.517 4.101 4.815 . 0 0 "[ . 1 . 2]" 1
2148 1 106 HIS HE1 1 110 LEU MD2 . . 4.330 3.436 2.810 3.780 . 0 0 "[ . 1 . 2]" 1
2149 1 106 HIS HE1 1 110 LEU MD1 . . 3.530 2.655 2.322 3.135 . 0 0 "[ . 1 . 2]" 1
2150 1 30 PHE QD 1 83 THR HB . . 4.290 2.875 2.481 3.186 . 0 0 "[ . 1 . 2]" 1
2151 1 30 PHE QD 1 85 LEU HB2 . . 4.510 3.906 3.315 4.259 . 0 0 "[ . 1 . 2]" 1
2152 1 30 PHE QD 1 78 VAL HB . . 5.500 4.790 4.271 5.241 . 0 0 "[ . 1 . 2]" 1
2153 1 30 PHE QD 1 64 VAL HB . . 3.500 2.934 2.306 3.504 0.004 18 0 "[ . 1 . 2]" 1
2154 1 30 PHE QD 1 85 LEU H . . 4.360 4.050 3.730 4.368 0.008 17 0 "[ . 1 . 2]" 1
2155 1 30 PHE QD 1 85 LEU HG . . 3.830 3.681 3.167 3.830 0.000 16 0 "[ . 1 . 2]" 1
2156 1 28 ILE MG 1 30 PHE QD . . 4.120 3.522 3.131 3.819 . 0 0 "[ . 1 . 2]" 1
2157 1 30 PHE H 1 30 PHE QD . . 3.330 2.087 1.900 2.523 . 0 0 "[ . 1 . 2]" 1
2158 1 30 PHE QD 1 64 VAL H . . 5.500 5.061 4.511 5.452 . 0 0 "[ . 1 . 2]" 1
2159 1 30 PHE QD 1 84 LEU HA . . 4.520 3.529 3.143 3.970 . 0 0 "[ . 1 . 2]" 1
2160 1 30 PHE QD 1 73 CYS HA . . 4.410 3.056 2.768 3.459 . 0 0 "[ . 1 . 2]" 1
2161 1 29 LYS HA 1 30 PHE QD . . 4.550 3.404 2.966 3.753 . 0 0 "[ . 1 . 2]" 1
2162 1 30 PHE QD 1 78 VAL MG1 . . 4.150 3.606 3.175 4.146 . 0 0 "[ . 1 . 2]" 1
2163 1 30 PHE QD 1 64 VAL MG1 . . 3.440 2.622 2.051 3.151 . 0 0 "[ . 1 . 2]" 1
2164 1 30 PHE QD 1 72 ILE MG . . 4.220 3.379 2.837 3.706 . 0 0 "[ . 1 . 2]" 1
2165 1 76 TYR H 1 76 TYR QD . . 3.210 2.953 2.548 3.208 . 0 0 "[ . 1 . 2]" 1
2166 1 76 TYR QD 1 87 PHE HZ . . 4.390 3.563 2.776 4.100 . 0 0 "[ . 1 . 2]" 1
2167 1 76 TYR HA 1 76 TYR QD . . 3.360 2.606 2.337 3.016 . 0 0 "[ . 1 . 2]" 1
2168 1 72 ILE HB 1 76 TYR QD . . 5.110 4.508 4.276 4.838 . 0 0 "[ . 1 . 2]" 1
2169 1 75 LYS HB2 1 76 TYR QD . . 5.500 5.120 4.390 5.461 . 0 0 "[ . 1 . 2]" 1
2170 1 76 TYR QD 1 92 LYS HB3 . . 5.500 4.573 3.878 5.081 . 0 0 "[ . 1 . 2]" 1
2171 1 75 LYS HB3 1 76 TYR QD . . 3.960 3.505 2.704 3.933 . 0 0 "[ . 1 . 2]" 1
2172 1 72 ILE MG 1 76 TYR QD . . 3.380 2.185 1.973 2.491 . 0 0 "[ . 1 . 2]" 1
2173 1 34 TRP HH2 1 81 TYR QD . . 4.340 3.050 2.303 4.102 . 0 0 "[ . 1 . 2]" 1
2174 1 34 TRP HZ3 1 81 TYR QD . . 5.450 4.307 3.801 5.452 0.002 9 0 "[ . 1 . 2]" 1
2175 1 81 TYR QD 1 83 THR HG1 . . 4.910 3.726 2.652 4.797 . 0 0 "[ . 1 . 2]" 1
2176 1 81 TYR HA 1 81 TYR QD . . 3.500 2.985 2.371 3.334 . 0 0 "[ . 1 . 2]" 1
2177 1 32 ALA MB 1 81 TYR QD . . 3.740 2.806 2.031 3.620 . 0 0 "[ . 1 . 2]" 1
2178 1 34 TRP HZ2 1 81 TYR QD . . 4.530 3.805 3.226 4.262 . 0 0 "[ . 1 . 2]" 1
2179 1 30 PHE HB2 1 81 TYR QD . . 4.780 4.012 3.562 4.590 . 0 0 "[ . 1 . 2]" 1
2180 1 30 PHE HB3 1 81 TYR QD . . 4.740 4.340 4.098 4.722 . 0 0 "[ . 1 . 2]" 1
2181 1 66 CYS HB2 1 81 TYR QD . . 4.700 4.124 3.374 4.618 . 0 0 "[ . 1 . 2]" 1
2182 1 27 PHE QE 1 108 PHE QD . . 4.240 3.711 2.323 4.127 . 0 0 "[ . 1 . 2]" 1
2183 1 96 HIS HD2 1 108 PHE QD . . 5.130 3.235 2.798 4.689 . 0 0 "[ . 1 . 2]" 1
2184 1 108 PHE QD 1 112 GLN HG3 . . 5.500 3.744 3.450 4.172 . 0 0 "[ . 1 . 2]" 1
2185 1 105 LEU HA 1 108 PHE QD . . 5.150 4.338 3.913 4.660 . 0 0 "[ . 1 . 2]" 1
2186 1 53 PHE QD 1 59 VAL HB . . 3.890 2.395 2.015 2.934 . 0 0 "[ . 1 . 2]" 1
2187 1 53 PHE QD 1 59 VAL MG1 . . 4.460 3.523 3.106 3.804 . 0 0 "[ . 1 . 2]" 1
2188 1 87 PHE QD 1 92 LYS HB2 . . 4.830 4.250 3.826 4.548 . 0 0 "[ . 1 . 2]" 1
2189 1 17 PHE QD 1 21 ILE QG . . 5.350 4.065 3.829 4.416 . 0 0 "[ . 1 . 2]" 1
2190 1 53 PHE QD 1 56 LEU MD1 . . 3.860 2.668 2.396 3.329 . 0 0 "[ . 1 . 2]" 1
2191 1 28 ILE H 1 87 PHE QD . . 4.100 3.165 2.795 3.507 . 0 0 "[ . 1 . 2]" 1
2192 1 27 PHE QE 1 96 HIS H . . 5.230 4.347 3.842 4.903 . 0 0 "[ . 1 . 2]" 1
2193 1 53 PHE QE 1 109 VAL H . . 4.540 4.249 3.818 4.519 . 0 0 "[ . 1 . 2]" 1
2194 1 53 PHE QE 1 61 ILE HG12 . . 4.940 3.663 3.303 3.828 . 0 0 "[ . 1 . 2]" 1
2195 1 53 PHE QE 1 61 ILE MD . . 4.400 3.413 2.903 3.748 . 0 0 "[ . 1 . 2]" 1
2196 1 27 PHE QE 1 86 LEU MD1 . . 4.650 3.145 2.713 3.982 . 0 0 "[ . 1 . 2]" 1
2197 1 53 PHE QE 1 59 VAL HB . . 3.840 2.600 2.273 2.914 . 0 0 "[ . 1 . 2]" 1
2198 1 27 PHE QE 1 86 LEU HB2 . . 4.340 2.326 2.009 3.579 . 0 0 "[ . 1 . 2]" 1
2199 1 27 PHE QE 1 48 LEU MD2 . . 3.870 2.997 2.773 3.602 . 0 0 "[ . 1 . 2]" 1
2200 1 17 PHE QE 1 21 ILE QG . . 5.500 4.300 3.955 4.561 . 0 0 "[ . 1 . 2]" 1
2201 1 27 PHE QE 1 28 ILE H . . 5.500 4.762 4.081 4.891 . 0 0 "[ . 1 . 2]" 1
2202 1 87 PHE H 1 87 PHE QE . . 5.500 4.920 4.649 5.179 . 0 0 "[ . 1 . 2]" 1
2203 1 27 PHE QE 1 85 LEU H . . 5.160 3.700 2.019 4.113 . 0 0 "[ . 1 . 2]" 1
2204 1 85 LEU HB2 1 87 PHE QE . . 3.700 2.431 2.065 2.725 . 0 0 "[ . 1 . 2]" 1
2205 1 28 ILE HB 1 87 PHE QE . . 4.460 2.700 2.079 3.236 . 0 0 "[ . 1 . 2]" 1
2206 1 21 ILE MD 1 87 PHE QE . . 4.350 3.803 3.286 4.352 0.002 10 0 "[ . 1 . 2]" 1
2207 1 94 SER HB2 1 108 PHE QE . . 5.180 4.774 4.315 5.013 . 0 0 "[ . 1 . 2]" 1
2208 1 94 SER HB3 1 108 PHE QE . . 5.180 3.403 2.922 3.670 . 0 0 "[ . 1 . 2]" 1
2209 1 108 PHE QE 1 112 GLN HG2 . . 4.860 3.457 3.096 4.066 . 0 0 "[ . 1 . 2]" 1
2210 1 86 LEU HB2 1 108 PHE QE . . 3.550 2.324 2.043 2.651 . 0 0 "[ . 1 . 2]" 1
2211 1 28 ILE H 1 30 PHE QE . . 5.180 4.885 4.557 5.139 . 0 0 "[ . 1 . 2]" 1
2212 1 30 PHE QE 1 84 LEU HA . . 5.230 4.358 3.645 5.056 . 0 0 "[ . 1 . 2]" 1
2213 1 30 PHE QE 1 76 TYR HB3 . . 5.500 4.516 4.109 4.860 . 0 0 "[ . 1 . 2]" 1
2214 1 30 PHE QE 1 85 LEU HB2 . . 3.240 2.055 1.997 2.200 . 0 0 "[ . 1 . 2]" 1
2215 1 28 ILE HB 1 30 PHE QE . . 3.340 3.201 2.990 3.343 0.003 14 0 "[ . 1 . 2]" 1
2216 1 30 PHE QE 1 72 ILE HB . . 4.040 3.697 3.185 4.048 0.008 18 0 "[ . 1 . 2]" 1
2217 1 30 PHE QE 1 85 LEU HB3 . . 3.850 3.659 3.424 3.845 . 0 0 "[ . 1 . 2]" 1
2218 1 30 PHE QE 1 85 LEU MD2 . . 4.690 4.342 4.003 4.600 . 0 0 "[ . 1 . 2]" 1
2219 1 30 PHE QE 1 85 LEU MD1 . . 3.310 2.304 1.976 2.708 . 0 0 "[ . 1 . 2]" 1
2220 1 27 PHE HZ 1 96 HIS HD2 . . 4.370 3.049 2.482 3.672 . 0 0 "[ . 1 . 2]" 1
2221 1 27 PHE HZ 1 84 LEU HB2 . . 4.570 3.042 2.309 3.462 . 0 0 "[ . 1 . 2]" 1
2222 1 27 PHE HZ 1 96 HIS HB3 . . 4.000 3.330 2.457 3.730 . 0 0 "[ . 1 . 2]" 1
2223 1 27 PHE HZ 1 84 LEU HB3 . . 4.060 2.681 2.097 3.022 . 0 0 "[ . 1 . 2]" 1
2224 1 27 PHE HZ 1 84 LEU MD1 . . 3.580 2.985 2.542 3.454 . 0 0 "[ . 1 . 2]" 1
2225 1 27 PHE HZ 1 48 LEU MD2 . . 5.380 4.839 4.683 4.967 . 0 0 "[ . 1 . 2]" 1
2226 1 27 PHE HZ 1 105 LEU HA . . 5.500 5.135 4.562 5.459 . 0 0 "[ . 1 . 2]" 1
2227 1 96 HIS HA 1 108 PHE HZ . . 5.050 3.747 3.044 4.363 . 0 0 "[ . 1 . 2]" 1
2228 1 108 PHE HZ 1 112 GLN HG2 . . 5.110 3.940 3.539 4.678 . 0 0 "[ . 1 . 2]" 1
2229 1 86 LEU HB2 1 108 PHE HZ . . 4.010 3.781 3.317 4.007 . 0 0 "[ . 1 . 2]" 1
2230 1 86 LEU MD1 1 108 PHE HZ . . 5.490 5.104 4.748 5.465 . 0 0 "[ . 1 . 2]" 1
2231 1 86 LEU MD2 1 108 PHE HZ . . 4.480 3.913 3.429 4.244 . 0 0 "[ . 1 . 2]" 1
2232 1 17 PHE HZ 1 30 PHE QE . . 4.670 3.409 3.145 3.715 . 0 0 "[ . 1 . 2]" 1
2233 1 17 PHE HZ 1 76 TYR QD . . 5.230 4.109 3.789 4.402 . 0 0 "[ . 1 . 2]" 1
2234 1 17 PHE HZ 1 64 VAL MG1 . . 5.500 5.305 4.958 5.504 0.004 20 0 "[ . 1 . 2]" 1
2235 1 17 PHE HZ 1 64 VAL MG2 . . 5.500 4.556 4.162 4.898 . 0 0 "[ . 1 . 2]" 1
2236 1 17 PHE HZ 1 21 ILE MD . . 4.030 3.856 3.496 4.032 0.002 19 0 "[ . 1 . 2]" 1
2237 1 17 PHE HZ 1 87 PHE QE . . 4.440 4.033 3.687 4.368 . 0 0 "[ . 1 . 2]" 1
2238 1 53 PHE HZ 1 106 HIS HA . . 4.930 4.365 4.117 4.812 . 0 0 "[ . 1 . 2]" 1
2239 1 48 LEU HA 1 53 PHE HZ . . 5.360 5.083 4.692 5.323 . 0 0 "[ . 1 . 2]" 1
2240 1 53 PHE HZ 1 109 VAL HB . . 4.860 4.319 4.092 4.555 . 0 0 "[ . 1 . 2]" 1
2241 1 53 PHE HZ 1 61 ILE HG12 . . 5.170 4.190 3.801 4.503 . 0 0 "[ . 1 . 2]" 1
2242 1 48 LEU HG 1 53 PHE HZ . . 3.570 2.892 2.688 3.094 . 0 0 "[ . 1 . 2]" 1
2243 1 53 PHE HZ 1 61 ILE HG13 . . 4.430 4.036 3.701 4.282 . 0 0 "[ . 1 . 2]" 1
2244 1 34 TRP HA 1 34 TRP HD1 . . 4.820 4.438 4.296 4.575 . 0 0 "[ . 1 . 2]" 1
2245 1 76 TYR HB3 1 87 PHE HZ . . 5.370 4.938 4.435 5.355 . 0 0 "[ . 1 . 2]" 1
2246 1 85 LEU HB2 1 87 PHE HZ . . 5.140 3.242 2.755 3.844 . 0 0 "[ . 1 . 2]" 1
2247 1 21 ILE MD 1 87 PHE HZ . . 5.500 4.866 4.319 5.243 . 0 0 "[ . 1 . 2]" 1
2248 1 30 PHE QE 1 87 PHE HZ . . 4.210 3.600 3.110 4.145 . 0 0 "[ . 1 . 2]" 1
2249 1 30 PHE HZ 1 87 PHE HZ . . 3.850 3.122 2.374 3.487 . 0 0 "[ . 1 . 2]" 1
2250 1 87 PHE HZ 1 92 LYS HB2 . . 4.560 4.430 4.030 4.580 0.020 19 0 "[ . 1 . 2]" 1
2251 1 85 LEU MD2 1 87 PHE HZ . . 4.810 4.383 4.015 4.813 0.003 19 0 "[ . 1 . 2]" 1
2252 1 28 ILE MD 1 87 PHE HZ . . 4.760 3.898 3.245 4.479 . 0 0 "[ . 1 . 2]" 1
2253 1 33 PRO HD2 1 34 TRP HD1 . . 4.460 2.973 2.785 3.205 . 0 0 "[ . 1 . 2]" 1
2254 1 34 TRP HB3 1 34 TRP HD1 . . 3.480 2.602 2.566 2.648 . 0 0 "[ . 1 . 2]" 1
2255 1 33 PRO HG2 1 34 TRP HD1 . . 4.410 2.869 2.355 3.304 . 0 0 "[ . 1 . 2]" 1
2256 1 34 TRP HD1 1 67 THR MG . . 3.790 2.044 1.822 2.412 . 0 0 "[ . 1 . 2]" 1
2257 1 32 ALA MB 1 34 TRP HD1 . . 4.230 3.292 3.064 3.605 . 0 0 "[ . 1 . 2]" 1
2258 1 17 PHE HZ 1 30 PHE HZ . . 3.820 2.753 2.091 3.128 . 0 0 "[ . 1 . 2]" 1
2259 1 30 PHE HZ 1 76 TYR HB2 . . 5.100 4.641 4.132 5.067 . 0 0 "[ . 1 . 2]" 1
2260 1 30 PHE HZ 1 72 ILE MG . . 4.150 3.445 3.097 3.770 . 0 0 "[ . 1 . 2]" 1
2261 1 28 ILE MD 1 30 PHE HZ . . 3.930 3.066 2.592 3.340 . 0 0 "[ . 1 . 2]" 1
2262 1 34 TRP HH2 1 81 TYR QE . . 3.980 2.452 1.992 3.731 . 0 0 "[ . 1 . 2]" 1
2263 1 32 ALA MB 1 34 TRP HH2 . . 4.800 3.969 3.576 4.377 . 0 0 "[ . 1 . 2]" 1
2264 1 45 TRP HD1 1 46 GLU H . . 5.090 4.402 3.870 4.681 . 0 0 "[ . 1 . 2]" 1
2265 1 45 TRP HB3 1 45 TRP HD1 . . 3.670 2.549 2.546 2.556 . 0 0 "[ . 1 . 2]" 1
2266 1 29 LYS HE2 1 45 TRP HD1 . . 4.500 3.200 2.746 3.442 . 0 0 "[ . 1 . 2]" 1
2267 1 45 TRP HD1 1 63 GLU HB3 . . 4.840 3.573 2.904 4.385 . 0 0 "[ . 1 . 2]" 1
2268 1 45 TRP HD1 1 63 GLU HB2 . . 4.590 3.395 2.556 4.380 . 0 0 "[ . 1 . 2]" 1
2269 1 9 VAL MG2 1 45 TRP HD1 . . 3.190 2.172 1.911 2.532 . 0 0 "[ . 1 . 2]" 1
2270 1 9 VAL MG1 1 45 TRP HD1 . . 3.050 2.590 2.115 3.055 0.005 16 0 "[ . 1 . 2]" 1
2271 1 29 LYS QG 1 45 TRP HD1 . . 5.500 5.234 4.897 5.507 0.007 13 0 "[ . 1 . 2]" 1
2272 1 45 TRP HD1 1 61 ILE MG . . 4.050 3.708 3.294 4.026 . 0 0 "[ . 1 . 2]" 1
2273 1 45 TRP HD1 1 46 GLU HA . . 5.110 4.360 4.005 4.651 . 0 0 "[ . 1 . 2]" 1
2274 1 81 TYR QD 1 82 PRO HA . . 4.450 3.807 3.616 3.966 . 0 0 "[ . 1 . 2]" 1
2275 1 81 TYR HA 1 82 PRO HA . . 3.290 2.353 2.215 2.385 . 0 0 "[ . 1 . 2]" 1
2276 1 81 TYR HB2 1 82 PRO HA . . 3.800 3.191 3.104 3.443 . 0 0 "[ . 1 . 2]" 1
2277 1 27 PHE QE 1 45 TRP HZ3 . . 4.270 2.380 1.996 4.025 . 0 0 "[ . 1 . 2]" 1
2278 1 45 TRP HZ3 1 84 LEU HB3 . . 5.350 3.678 3.063 4.061 . 0 0 "[ . 1 . 2]" 1
2279 1 45 TRP HH2 1 84 LEU HB3 . . 5.500 3.791 2.729 4.290 . 0 0 "[ . 1 . 2]" 1
2280 1 45 TRP HZ3 1 84 LEU MD1 . . 3.520 3.147 2.104 3.521 0.001 4 0 "[ . 1 . 2]" 1
2281 1 41 LEU MD2 1 45 TRP HZ3 . . 5.150 4.324 3.862 4.780 . 0 0 "[ . 1 . 2]" 1
2282 1 45 TRP HZ3 1 48 LEU MD2 . . 4.060 2.778 2.525 3.262 . 0 0 "[ . 1 . 2]" 1
2283 1 26 THR HA 1 27 PHE HB2 . . 5.100 4.347 4.256 4.476 . 0 0 "[ . 1 . 2]" 1
2284 1 26 THR HA 1 59 VAL MG1 . . 4.920 3.535 3.143 3.942 . 0 0 "[ . 1 . 2]" 1
2285 1 26 THR HA 1 27 PHE H . . 2.880 2.145 2.141 2.161 . 0 0 "[ . 1 . 2]" 1
2286 1 26 THR HA 1 60 LYS H . . 3.530 2.491 2.250 2.799 . 0 0 "[ . 1 . 2]" 1
2287 1 26 THR HA 1 60 LYS HA . . 5.190 4.495 4.326 4.615 . 0 0 "[ . 1 . 2]" 1
2288 1 26 THR HA 1 59 VAL HA . . 4.740 4.099 3.670 4.451 . 0 0 "[ . 1 . 2]" 1
2289 1 26 THR HA 1 27 PHE HB3 . . 4.980 4.938 4.844 4.980 . 0 0 "[ . 1 . 2]" 1
2290 1 26 THR HA 1 60 LYS HB2 . . 3.450 2.522 2.320 2.672 . 0 0 "[ . 1 . 2]" 1
2291 1 26 THR HA 1 60 LYS HG2 . . 5.500 5.396 5.237 5.501 0.001 19 0 "[ . 1 . 2]" 1
2292 1 26 THR HA 1 60 LYS HG3 . . 5.500 4.547 4.269 4.757 . 0 0 "[ . 1 . 2]" 1
2293 1 26 THR HA 1 60 LYS HD2 . . 5.500 4.946 4.505 5.288 . 0 0 "[ . 1 . 2]" 1
2294 1 26 THR HA 1 61 ILE MD . . 5.010 4.349 4.099 4.812 . 0 0 "[ . 1 . 2]" 1
2295 1 34 TRP HZ3 1 35 CYS HA . . 4.930 3.626 2.691 4.477 . 0 0 "[ . 1 . 2]" 1
2296 1 30 PHE HA 1 64 VAL H . . 3.690 3.327 2.864 3.697 0.007 18 0 "[ . 1 . 2]" 1
2297 1 30 PHE HA 1 30 PHE QD . . 3.940 3.100 2.986 3.266 . 0 0 "[ . 1 . 2]" 1
2298 1 30 PHE HA 1 31 TYR QD . . 4.370 4.048 3.821 4.226 . 0 0 "[ . 1 . 2]" 1
2299 1 30 PHE HA 1 64 VAL HB . . 3.590 3.037 2.672 3.243 . 0 0 "[ . 1 . 2]" 1
2300 1 30 PHE HA 1 78 VAL MG1 . . 5.500 4.528 4.043 4.971 . 0 0 "[ . 1 . 2]" 1
2301 1 28 ILE MG 1 30 PHE HA . . 4.570 3.986 3.807 4.321 . 0 0 "[ . 1 . 2]" 1
2302 1 30 PHE HA 1 64 VAL MG1 . . 4.160 3.675 3.335 3.940 . 0 0 "[ . 1 . 2]" 1
2303 1 72 ILE HA 1 76 TYR QE . . 4.700 4.041 3.621 4.339 . 0 0 "[ . 1 . 2]" 1
2304 1 76 TYR QE 1 92 LYS H . . 5.270 4.632 3.788 5.169 . 0 0 "[ . 1 . 2]" 1
2305 1 76 TYR QE 1 87 PHE QE . . 3.560 2.130 1.993 2.722 . 0 0 "[ . 1 . 2]" 1
2306 1 17 PHE QE 1 76 TYR QE . . 3.400 3.014 2.721 3.192 . 0 0 "[ . 1 . 2]" 1
2307 1 17 PHE HZ 1 76 TYR QE . . 3.930 2.163 1.991 2.738 . 0 0 "[ . 1 . 2]" 1
2308 1 76 TYR QE 1 87 PHE HZ . . 4.190 2.627 2.118 3.238 . 0 0 "[ . 1 . 2]" 1
2309 1 76 TYR HA 1 76 TYR QE . . 4.710 4.485 4.409 4.619 . 0 0 "[ . 1 . 2]" 1
2310 1 75 LYS QE 1 76 TYR QE . . 4.380 3.987 2.284 4.388 0.008 20 0 "[ . 1 . 2]" 1
2311 1 75 LYS HB3 1 76 TYR QE . . 4.890 4.151 3.531 4.398 . 0 0 "[ . 1 . 2]" 1
2312 1 76 TYR QE 1 85 LEU MD1 . . 4.690 3.548 3.112 4.070 . 0 0 "[ . 1 . 2]" 1
2313 1 72 ILE MG 1 76 TYR QE . . 3.350 2.010 1.829 2.377 . 0 0 "[ . 1 . 2]" 1
2314 1 45 TRP H 1 45 TRP HE3 . . 4.720 4.135 3.804 4.507 . 0 0 "[ . 1 . 2]" 1
2315 1 45 TRP HB2 1 45 TRP HE3 . . 3.610 2.991 2.919 3.113 . 0 0 "[ . 1 . 2]" 1
2316 1 41 LEU HG 1 45 TRP HE3 . . 4.450 3.702 3.255 4.101 . 0 0 "[ . 1 . 2]" 1
2317 1 45 TRP HE3 1 105 LEU HB3 . . 5.500 5.196 4.817 5.495 . 0 0 "[ . 1 . 2]" 1
2318 1 44 THR MG 1 45 TRP HE3 . . 4.820 4.087 3.793 4.341 . 0 0 "[ . 1 . 2]" 1
2319 1 45 TRP HE3 1 105 LEU MD1 . . 3.290 2.800 2.443 3.113 . 0 0 "[ . 1 . 2]" 1
2320 1 41 LEU MD2 1 45 TRP HE3 . . 4.200 3.337 2.820 3.832 . 0 0 "[ . 1 . 2]" 1
2321 1 45 TRP HE3 1 48 LEU MD2 . . 3.980 3.147 2.789 3.671 . 0 0 "[ . 1 . 2]" 1
2322 1 45 TRP HE3 1 84 LEU MD2 . . 4.390 3.295 2.864 3.946 . 0 0 "[ . 1 . 2]" 1
2323 1 73 CYS HB3 1 81 TYR QE . . 4.970 3.986 3.796 4.258 . 0 0 "[ . 1 . 2]" 1
2324 1 78 VAL HB 1 81 TYR QE . . 4.860 3.211 2.698 3.736 . 0 0 "[ . 1 . 2]" 1
2325 1 78 VAL MG2 1 81 TYR QE . . 5.060 4.272 4.010 4.587 . 0 0 "[ . 1 . 2]" 1
2326 1 66 CYS H 1 81 TYR QE . . 5.500 5.231 4.903 5.501 0.001 17 0 "[ . 1 . 2]" 1
2327 1 31 TYR HA 1 81 TYR QE . . 5.500 5.144 4.961 5.423 . 0 0 "[ . 1 . 2]" 1
2328 1 81 TYR HA 1 81 TYR QE . . 5.310 4.929 4.673 5.060 . 0 0 "[ . 1 . 2]" 1
2329 1 66 CYS HB3 1 81 TYR QE . . 3.720 3.224 2.488 3.725 0.005 18 0 "[ . 1 . 2]" 1
2330 1 78 VAL MG1 1 81 TYR QE . . 3.160 1.948 1.851 2.108 . 0 0 "[ . 1 . 2]" 1
2331 1 32 ALA MB 1 81 TYR QE . . 3.790 3.306 2.566 3.715 . 0 0 "[ . 1 . 2]" 1
2332 1 96 HIS HD2 1 108 PHE HB3 . . 5.200 2.910 2.336 4.503 . 0 0 "[ . 1 . 2]" 1
2333 1 96 HIS HD2 1 108 PHE HB2 . . 5.200 3.224 2.626 4.750 . 0 0 "[ . 1 . 2]" 1
2334 1 84 LEU HB2 1 96 HIS HD2 . . 5.330 4.605 3.773 5.234 . 0 0 "[ . 1 . 2]" 1
2335 1 96 HIS HD2 1 105 LEU MD2 . . 2.960 2.380 1.826 2.876 . 0 0 "[ . 1 . 2]" 1
2336 1 48 LEU MD2 1 96 HIS HD2 . . 5.500 5.280 4.933 5.503 0.003 6 0 "[ . 1 . 2]" 1
2337 1 87 PHE HA 1 93 VAL H . . 3.570 3.094 2.690 3.398 . 0 0 "[ . 1 . 2]" 1
2338 1 87 PHE HA 1 94 SER H . . 5.090 5.009 4.845 5.093 0.003 1 0 "[ . 1 . 2]" 1
2339 1 87 PHE HA 1 87 PHE QD . . 4.190 3.027 2.800 3.194 . 0 0 "[ . 1 . 2]" 1
2340 1 87 PHE HA 1 92 LYS HA . . 3.380 2.531 2.262 2.922 . 0 0 "[ . 1 . 2]" 1
2341 1 87 PHE HA 1 93 VAL HB . . 5.040 4.059 3.773 4.348 . 0 0 "[ . 1 . 2]" 1
2342 1 87 PHE HA 1 92 LYS HB3 . . 5.500 5.041 4.756 5.481 . 0 0 "[ . 1 . 2]" 1
2343 1 86 LEU HG 1 87 PHE HA . . 5.030 3.730 3.530 3.888 . 0 0 "[ . 1 . 2]" 1
2344 1 31 TYR H 1 31 TYR QE . . 4.830 4.311 4.151 4.524 . 0 0 "[ . 1 . 2]" 1
2345 1 31 TYR QE 1 33 PRO HA . . 3.530 2.647 2.180 3.139 . 0 0 "[ . 1 . 2]" 1
2346 1 31 TYR QE 1 65 ASP HA . . 4.190 4.016 3.726 4.194 0.004 3 0 "[ . 1 . 2]" 1
2347 1 31 TYR QE 1 33 PRO HB3 . . 3.440 3.138 3.057 3.220 . 0 0 "[ . 1 . 2]" 1
2348 1 31 TYR QE 1 63 GLU HG2 . . 4.070 3.211 2.310 4.078 0.008 8 0 "[ . 1 . 2]" 1
2349 1 31 TYR QE 1 63 GLU HG3 . . 4.070 2.591 2.036 4.081 0.011 20 0 "[ . 1 . 2]" 1
2350 1 31 TYR QE 1 64 VAL H . . 4.300 3.995 3.439 4.324 0.024 20 0 "[ . 1 . 2]" 1
2351 1 31 TYR QE 1 33 PRO HD3 . . 4.360 3.460 3.292 3.634 . 0 0 "[ . 1 . 2]" 1
2352 1 106 HIS HD2 1 110 LEU HG . . 5.500 4.199 3.534 4.735 . 0 0 "[ . 1 . 2]" 1
2353 1 106 HIS HD2 1 110 LEU MD2 . . 4.980 4.526 3.964 4.956 . 0 0 "[ . 1 . 2]" 1
2354 1 53 PHE QE 1 106 HIS HD2 . . 3.770 2.776 2.253 3.370 . 0 0 "[ . 1 . 2]" 1
2355 1 53 PHE QD 1 106 HIS HD2 . . 4.450 3.528 2.774 4.202 . 0 0 "[ . 1 . 2]" 1
2356 1 51 LYS HB2 1 106 HIS HD2 . . 4.190 3.379 2.820 3.993 . 0 0 "[ . 1 . 2]" 1
2357 1 51 LYS HB3 1 106 HIS HD2 . . 4.190 2.863 2.387 3.565 . 0 0 "[ . 1 . 2]" 1
2358 1 45 TRP HZ2 1 62 ALA H . . 3.780 3.116 2.720 3.539 . 0 0 "[ . 1 . 2]" 1
2359 1 29 LYS H 1 45 TRP HZ2 . . 3.580 3.058 2.771 3.586 0.006 16 0 "[ . 1 . 2]" 1
2360 1 28 ILE HA 1 45 TRP HZ2 . . 3.640 2.691 2.390 3.025 . 0 0 "[ . 1 . 2]" 1
2361 1 29 LYS HA 1 45 TRP HZ2 . . 5.190 4.347 3.964 4.537 . 0 0 "[ . 1 . 2]" 1
2362 1 27 PHE HB3 1 45 TRP HZ2 . . 4.820 3.692 3.107 3.965 . 0 0 "[ . 1 . 2]" 1
2363 1 29 LYS HB2 1 45 TRP HZ2 . . 4.500 2.904 2.757 3.068 . 0 0 "[ . 1 . 2]" 1
2364 1 45 TRP HZ2 1 61 ILE MD . . 4.720 3.791 3.311 4.312 . 0 0 "[ . 1 . 2]" 1
2365 1 45 TRP HZ2 1 48 LEU MD2 . . 5.180 4.434 4.100 4.744 . 0 0 "[ . 1 . 2]" 1
2366 1 45 TRP HZ2 1 84 LEU MD2 . . 5.500 4.608 3.860 5.099 . 0 0 "[ . 1 . 2]" 1
2367 1 45 TRP HZ2 1 61 ILE MG . . 3.790 2.738 2.407 3.191 . 0 0 "[ . 1 . 2]" 1
2368 1 28 ILE MG 1 45 TRP HZ2 . . 5.090 4.197 3.969 4.558 . 0 0 "[ . 1 . 2]" 1
2369 1 29 LYS HB3 1 45 TRP HZ2 . . 4.500 3.357 2.864 3.869 . 0 0 "[ . 1 . 2]" 1
2370 1 25 ILE HA 1 88 ARG HA . . 3.570 2.787 2.481 3.223 . 0 0 "[ . 1 . 2]" 1
2371 1 88 ARG HA 1 89 GLY HA2 . . 5.210 4.380 4.360 4.433 . 0 0 "[ . 1 . 2]" 1
2372 1 88 ARG HA 1 88 ARG HD2 . . 5.140 4.048 2.356 4.718 . 0 0 "[ . 1 . 2]" 1
2373 1 88 ARG HA 1 88 ARG HG2 . . 4.060 3.308 3.017 3.893 . 0 0 "[ . 1 . 2]" 1
2374 1 88 ARG HA 1 90 GLY H . . 5.030 3.656 3.275 3.874 . 0 0 "[ . 1 . 2]" 1
2375 1 88 ARG HA 1 89 GLY HA3 . . 5.210 4.399 4.370 4.536 . 0 0 "[ . 1 . 2]" 1
2376 1 25 ILE HG12 1 88 ARG HA . . 4.820 3.107 2.715 3.330 . 0 0 "[ . 1 . 2]" 1
2377 1 31 TYR QE 1 63 GLU HA . . 5.320 5.022 4.484 5.321 0.001 16 0 "[ . 1 . 2]" 1
2378 1 62 ALA MB 1 63 GLU HA . . 5.020 3.858 3.775 3.963 . 0 0 "[ . 1 . 2]" 1
2379 1 31 TYR HA 1 32 ALA MB . . 5.050 3.799 3.762 3.885 . 0 0 "[ . 1 . 2]" 1
2380 1 31 TYR HA 1 81 TYR QD . . 3.880 3.331 2.931 3.881 0.001 14 0 "[ . 1 . 2]" 1
2381 1 29 LYS QG 1 31 TYR HA . . 5.400 4.743 4.144 5.095 . 0 0 "[ . 1 . 2]" 1
2382 1 28 ILE HG12 1 63 GLU HA . . 5.500 5.228 4.426 5.505 0.005 7 0 "[ . 1 . 2]" 1
2383 1 29 LYS QG 1 63 GLU HA . . 5.500 4.869 3.480 5.306 . 0 0 "[ . 1 . 2]" 1
2384 1 86 LEU HA 1 87 PHE H . . 2.910 2.256 2.195 2.276 . 0 0 "[ . 1 . 2]" 1
2385 1 27 PHE HD1 1 86 LEU HA . . 3.970 2.102 1.997 3.028 . 0 0 "[ . 1 . 2]" 1
2386 1 86 LEU HA 1 87 PHE QD . . 4.210 3.149 2.672 3.569 . 0 0 "[ . 1 . 2]" 1
2387 1 27 PHE HA 1 86 LEU HA . . 3.310 2.748 2.480 2.921 . 0 0 "[ . 1 . 2]" 1
2388 1 27 PHE HB2 1 86 LEU HA . . 4.860 4.526 4.245 4.663 . 0 0 "[ . 1 . 2]" 1
2389 1 86 LEU HA 1 87 PHE HB2 . . 5.000 4.489 4.373 4.584 . 0 0 "[ . 1 . 2]" 1
2390 1 34 TRP HZ2 1 81 TYR QE . . 3.600 2.455 1.994 3.153 . 0 0 "[ . 1 . 2]" 1
2391 1 32 ALA MB 1 34 TRP HZ2 . . 3.990 2.988 2.648 3.364 . 0 0 "[ . 1 . 2]" 1
2392 1 27 PHE QE 1 85 LEU HA . . 4.920 3.626 3.206 3.855 . 0 0 "[ . 1 . 2]" 1
2393 1 85 LEU HA 1 95 GLU HA . . 3.390 2.671 2.417 2.867 . 0 0 "[ . 1 . 2]" 1
2394 1 85 LEU HA 1 85 LEU HG . . 4.240 2.925 2.779 3.099 . 0 0 "[ . 1 . 2]" 1
2395 1 85 LEU HA 1 108 PHE QE . . 5.500 5.108 4.462 5.501 0.001 2 0 "[ . 1 . 2]" 1
2396 1 85 LEU HA 1 108 PHE HZ . . 5.500 4.981 4.549 5.339 . 0 0 "[ . 1 . 2]" 1
2397 1 12 LEU HA 1 16 ASN HD22 . . 4.290 2.394 1.884 2.935 . 0 0 "[ . 1 . 2]" 1
2398 1 12 LEU HA 1 12 LEU HG . . 4.160 3.193 2.996 3.451 . 0 0 "[ . 1 . 2]" 1
2399 1 12 LEU HA 1 12 LEU MD1 . . 4.560 3.871 3.747 3.922 . 0 0 "[ . 1 . 2]" 1
2400 1 12 LEU HA 1 13 THR HA . . 5.110 4.428 4.409 4.437 . 0 0 "[ . 1 . 2]" 1
2401 1 81 TYR HA 1 83 THR H . . 4.360 3.152 2.962 3.423 . 0 0 "[ . 1 . 2]" 1
2402 1 81 TYR HA 1 83 THR HG1 . . 4.330 3.224 2.816 3.674 . 0 0 "[ . 1 . 2]" 1
2403 1 30 PHE H 1 84 LEU HA . . 4.210 3.394 3.125 3.613 . 0 0 "[ . 1 . 2]" 1
2404 1 27 PHE QE 1 84 LEU HA . . 5.010 4.567 3.109 4.998 . 0 0 "[ . 1 . 2]" 1
2405 1 29 LYS HA 1 84 LEU HA . . 3.760 2.547 2.276 2.784 . 0 0 "[ . 1 . 2]" 1
2406 1 84 LEU HA 1 85 LEU HG . . 5.070 3.984 3.686 4.334 . 0 0 "[ . 1 . 2]" 1
2407 1 84 LEU HA 1 84 LEU HG . . 4.220 3.304 3.204 3.453 . 0 0 "[ . 1 . 2]" 1
2408 1 83 THR MG 1 84 LEU HA . . 4.860 3.740 3.290 4.057 . 0 0 "[ . 1 . 2]" 1
2409 1 84 LEU HA 1 84 LEU MD1 . . 4.350 3.974 3.883 4.038 . 0 0 "[ . 1 . 2]" 1
2410 1 16 ASN HA 1 19 ASP HB3 . . 4.470 3.749 2.711 4.477 0.007 12 0 "[ . 1 . 2]" 1
2411 1 16 ASN HA 1 19 ASP H . . 4.420 3.351 2.869 3.642 . 0 0 "[ . 1 . 2]" 1
2412 1 27 PHE HA 1 28 ILE H . . 3.020 2.146 2.144 2.149 . 0 0 "[ . 1 . 2]" 1
2413 1 27 PHE HA 1 27 PHE HD1 . . 3.260 2.010 1.986 2.169 . 0 0 "[ . 1 . 2]" 1
2414 1 27 PHE HA 1 28 ILE HB . . 4.990 4.700 4.590 4.819 . 0 0 "[ . 1 . 2]" 1
2415 1 27 PHE HA 1 28 ILE HG13 . . 4.540 3.804 3.624 3.998 . 0 0 "[ . 1 . 2]" 1
2416 1 27 PHE HA 1 86 LEU HB2 . . 5.170 4.507 3.909 4.768 . 0 0 "[ . 1 . 2]" 1
2417 1 27 PHE HA 1 86 LEU HG . . 5.500 4.870 4.546 5.168 . 0 0 "[ . 1 . 2]" 1
2418 1 25 ILE MG 1 27 PHE HA . . 5.080 4.260 4.175 4.371 . 0 0 "[ . 1 . 2]" 1
2419 1 27 PHE HA 1 28 ILE MD . . 5.040 4.906 4.638 5.042 0.002 13 0 "[ . 1 . 2]" 1
2420 1 62 ALA HA 1 63 GLU H . . 3.100 2.536 2.361 2.610 . 0 0 "[ . 1 . 2]" 1
2421 1 10 LEU H 1 62 ALA HA . . 3.070 2.035 1.897 2.410 . 0 0 "[ . 1 . 2]" 1
2422 1 9 VAL HB 1 62 ALA HA . . 5.500 5.362 5.052 5.506 0.006 17 0 "[ . 1 . 2]" 1
2423 1 62 ALA HA 1 63 GLU HB2 . . 5.500 5.139 4.555 5.543 0.043 8 0 "[ . 1 . 2]" 1
2424 1 61 ILE HB 1 62 ALA HA . . 5.500 4.800 4.661 4.880 . 0 0 "[ . 1 . 2]" 1
2425 1 10 LEU HB3 1 62 ALA HA . . 3.610 3.248 3.024 3.592 . 0 0 "[ . 1 . 2]" 1
2426 1 10 LEU HB2 1 62 ALA HA . . 4.220 2.131 1.972 2.306 . 0 0 "[ . 1 . 2]" 1
2427 1 9 VAL MG1 1 62 ALA HA . . 3.300 2.709 2.461 2.832 . 0 0 "[ . 1 . 2]" 1
2428 1 61 ILE MG 1 62 ALA HA . . 4.850 3.712 3.550 3.932 . 0 0 "[ . 1 . 2]" 1
2429 1 12 LEU MD1 1 62 ALA HA . . 5.180 4.430 4.133 4.836 . 0 0 "[ . 1 . 2]" 1
2430 1 62 ALA HA 1 63 GLU HB3 . . 4.890 4.072 3.965 4.373 . 0 0 "[ . 1 . 2]" 1
2431 1 86 LEU MD2 1 112 GLN HB2 . . 3.930 2.580 2.222 2.815 . 0 0 "[ . 1 . 2]" 1
2432 1 93 VAL MG2 1 112 GLN HG3 . . 5.500 5.429 5.002 5.504 0.004 15 0 "[ . 1 . 2]" 1
2433 1 45 TRP HA 1 61 ILE MG . . 4.610 4.142 3.938 4.382 . 0 0 "[ . 1 . 2]" 1
2434 1 44 THR MG 1 45 TRP HA . . 4.320 3.438 3.117 3.729 . 0 0 "[ . 1 . 2]" 1
2435 1 66 CYS HA 1 70 ARG QD . . 5.500 5.019 3.675 5.517 0.017 11 0 "[ . 1 . 2]" 1
2436 1 66 CYS HA 1 68 ALA H . . 5.070 4.235 3.630 4.961 . 0 0 "[ . 1 . 2]" 1
2437 1 70 ARG HA 1 71 ASN HB2 . . 5.500 5.504 5.441 5.571 0.071 6 0 "[ . 1 . 2]" 1
2438 1 71 ASN HB3 1 74 SER QB . . 5.500 5.360 5.026 5.517 0.017 20 0 "[ . 1 . 2]" 1
2439 1 31 TYR QD 1 63 GLU HA . . 5.370 4.600 4.303 4.822 . 0 0 "[ . 1 . 2]" 1
2440 1 67 THR MG 1 81 TYR QE . . 5.500 5.312 4.835 5.523 0.023 20 0 "[ . 1 . 2]" 1
2441 1 12 LEU HB3 1 17 PHE QD . . 3.730 3.218 2.839 3.666 . 0 0 "[ . 1 . 2]" 1
2442 1 25 ILE MG 1 109 VAL MG1 . . 3.420 2.917 2.469 3.222 . 0 0 "[ . 1 . 2]" 1
2443 1 25 ILE MG 1 59 VAL MG2 . . 3.440 2.629 2.007 3.011 . 0 0 "[ . 1 . 2]" 1
2444 1 25 ILE MG 1 86 LEU MD2 . . 3.770 2.955 2.644 3.097 . 0 0 "[ . 1 . 2]" 1
2445 1 25 ILE MD 1 59 VAL MG2 . . 3.310 2.424 2.081 2.582 . 0 0 "[ . 1 . 2]" 1
2446 1 64 VAL MG1 1 72 ILE MG . . 3.420 2.645 2.056 3.156 . 0 0 "[ . 1 . 2]" 1
2447 1 13 THR H 1 72 ILE MD . . 5.200 4.902 4.518 5.196 . 0 0 "[ . 1 . 2]" 1
2448 1 13 THR HA 1 64 VAL MG1 . . 5.220 4.848 4.512 5.227 0.007 12 0 "[ . 1 . 2]" 1
2449 1 20 THR MG 1 60 LYS HD3 . . 4.500 3.834 3.450 4.075 . 0 0 "[ . 1 . 2]" 1
2450 1 10 LEU HB3 1 20 THR MG . . 4.380 4.090 3.571 4.353 . 0 0 "[ . 1 . 2]" 1
2451 1 12 LEU HG 1 20 THR MG . . 4.650 3.900 3.632 4.086 . 0 0 "[ . 1 . 2]" 1
2452 1 20 THR MG 1 60 LYS HB3 . . 3.950 3.732 3.493 3.937 . 0 0 "[ . 1 . 2]" 1
2453 1 20 THR MG 1 60 LYS HD2 . . 3.210 2.648 2.376 2.926 . 0 0 "[ . 1 . 2]" 1
2454 1 12 LEU MD1 1 20 THR MG . . 3.380 2.366 2.015 3.004 . 0 0 "[ . 1 . 2]" 1
2455 1 44 THR MG 1 47 GLU HB2 . . 4.180 3.523 3.181 3.803 . 0 0 "[ . 1 . 2]" 1
2456 1 44 THR MG 1 105 LEU HB2 . . 4.490 4.200 3.676 4.505 0.015 19 0 "[ . 1 . 2]" 1
2457 1 44 THR MG 1 105 LEU HG . . 4.110 3.950 3.705 4.102 . 0 0 "[ . 1 . 2]" 1
2458 1 44 THR MG 1 102 LEU HB3 . . 3.730 3.549 3.253 3.736 0.006 19 0 "[ . 1 . 2]" 1
2459 1 44 THR MG 1 102 LEU HB2 . . 3.160 2.372 1.988 2.645 . 0 0 "[ . 1 . 2]" 1
2460 1 44 THR MG 1 105 LEU MD1 . . 2.880 2.120 1.834 2.512 . 0 0 "[ . 1 . 2]" 1
2461 1 78 VAL MG1 1 83 THR MG . . 2.960 2.443 2.037 2.866 . 0 0 "[ . 1 . 2]" 1
2462 1 88 ARG HB2 1 93 VAL MG2 . . 3.270 2.301 2.004 2.527 . 0 0 "[ . 1 . 2]" 1
2463 1 88 ARG HB3 1 93 VAL MG2 . . 3.270 2.221 1.905 2.570 . 0 0 "[ . 1 . 2]" 1
2464 1 86 LEU MD2 1 93 VAL MG2 . . 3.040 2.449 1.966 2.959 . 0 0 "[ . 1 . 2]" 1
2465 1 9 VAL MG1 1 61 ILE MG . . 3.590 3.259 2.937 3.574 . 0 0 "[ . 1 . 2]" 1
2466 1 56 LEU HB3 1 59 VAL MG2 . . 3.810 3.022 2.742 3.433 . 0 0 "[ . 1 . 2]" 1
2467 1 56 LEU MD1 1 59 VAL MG2 . . 3.190 2.951 2.613 3.199 0.009 20 0 "[ . 1 . 2]" 1
2468 1 57 ALA MB 1 59 VAL MG2 . . 3.960 3.649 3.363 3.926 . 0 0 "[ . 1 . 2]" 1
2469 1 9 VAL MG2 1 46 GLU HG2 . . 3.960 2.165 1.957 3.502 . 0 0 "[ . 1 . 2]" 1
2470 1 95 GLU H 1 95 GLU HB2 . . 4.190 2.863 2.657 3.092 . 0 0 "[ . 1 . 2]" 1
2471 1 36 GLY HA2 1 39 LYS QD . . 4.060 2.381 1.964 3.528 . 0 0 "[ . 1 . 2]" 1
2472 1 51 LYS HE2 1 106 HIS HD2 . . 5.270 3.801 3.005 4.990 . 0 0 "[ . 1 . 2]" 1
2473 1 51 LYS HE2 1 106 HIS HE1 . . 5.250 4.821 3.814 5.251 0.001 16 0 "[ . 1 . 2]" 1
2474 1 41 LEU HA 1 41 LEU HG . . 3.960 2.929 2.825 3.035 . 0 0 "[ . 1 . 2]" 1
2475 1 60 LYS HA 1 60 LYS HG3 . . 3.730 2.816 2.604 3.067 . 0 0 "[ . 1 . 2]" 1
2476 1 60 LYS HG2 1 61 ILE H . . 5.290 4.049 3.766 4.333 . 0 0 "[ . 1 . 2]" 1
2477 1 92 LYS HB2 1 92 LYS QE . . 4.610 3.132 2.294 4.195 . 0 0 "[ . 1 . 2]" 1
2478 1 10 LEU HB2 1 10 LEU MD2 . . 3.390 2.774 2.626 3.180 . 0 0 "[ . 1 . 2]" 1
2479 1 110 LEU HB3 1 110 LEU MD2 . . 3.490 2.193 2.128 2.282 . 0 0 "[ . 1 . 2]" 1
2480 1 12 LEU HB3 1 12 LEU MD2 . . 3.140 2.360 2.241 2.524 . 0 0 "[ . 1 . 2]" 1
2481 1 12 LEU MD2 1 20 THR MG . . 2.940 2.023 1.821 2.290 . 0 0 "[ . 1 . 2]" 1
2482 1 56 LEU MD1 1 109 VAL MG1 . . 3.330 2.535 1.873 2.880 . 0 0 "[ . 1 . 2]" 1
2483 1 41 LEU MD2 1 84 LEU MD2 . . 3.150 2.225 1.883 2.576 . 0 0 "[ . 1 . 2]" 1
2484 1 41 LEU MD1 1 84 LEU MD2 . . 4.230 3.429 3.083 3.732 . 0 0 "[ . 1 . 2]" 1
2485 1 85 LEU MD1 1 95 GLU HA . . 5.220 4.925 4.572 5.190 . 0 0 "[ . 1 . 2]" 1
2486 1 76 TYR HB2 1 85 LEU MD1 . . 3.860 3.407 3.182 3.740 . 0 0 "[ . 1 . 2]" 1
2487 1 102 LEU MD1 1 103 ASP HA . . 4.140 3.998 3.789 4.139 . 0 0 "[ . 1 . 2]" 1
2488 1 48 LEU HG 1 49 SER HA . . 4.370 4.038 3.845 4.262 . 0 0 "[ . 1 . 2]" 1
2489 1 49 SER HA 1 53 PHE HZ . . 5.500 5.231 4.788 5.493 . 0 0 "[ . 1 . 2]" 1
2490 1 53 PHE QD 1 59 VAL MG2 . . 3.760 2.895 2.622 3.188 . 0 0 "[ . 1 . 2]" 1
2491 1 48 LEU MD2 1 53 PHE HZ . . 4.410 3.548 3.179 3.848 . 0 0 "[ . 1 . 2]" 1
2492 1 53 PHE HZ 1 109 VAL MG1 . . 4.840 3.806 3.469 4.290 . 0 0 "[ . 1 . 2]" 1
2493 1 53 PHE HZ 1 106 HIS HD2 . . 4.340 3.626 3.220 4.006 . 0 0 "[ . 1 . 2]" 1
2494 1 6 SER QB 1 8 THR MG . . 5.340 4.772 4.051 5.255 . 0 0 "[ . 1 . 2]" 1
2495 1 6 SER QB 1 9 VAL H . . 4.720 2.580 2.082 2.952 . 0 0 "[ . 1 . 2]" 1
2496 1 6 SER QB 1 9 VAL HB . . 5.260 4.708 4.375 5.065 . 0 0 "[ . 1 . 2]" 1
2497 1 6 SER QB 1 9 VAL MG1 . . 4.990 4.656 4.378 4.916 . 0 0 "[ . 1 . 2]" 1
2498 1 6 SER QB 1 9 VAL MG2 . . 5.340 4.987 4.719 5.239 . 0 0 "[ . 1 . 2]" 1
2499 1 9 VAL H 1 10 LEU QD . . 5.400 4.404 4.111 5.221 . 0 0 "[ . 1 . 2]" 1
2500 1 9 VAL MG1 1 63 GLU QG . . 4.070 2.971 2.128 3.629 . 0 0 "[ . 1 . 2]" 1
2501 1 9 VAL MG2 1 46 GLU QG . . 3.300 1.990 1.815 2.743 . 0 0 "[ . 1 . 2]" 1
2502 1 10 LEU H 1 10 LEU QD . . 3.810 2.673 2.406 3.465 . 0 0 "[ . 1 . 2]" 1
2503 1 10 LEU HA 1 10 LEU QD . . 3.070 2.787 2.129 2.935 . 0 0 "[ . 1 . 2]" 1
2504 1 10 LEU HB2 1 10 LEU QD . . 2.920 2.074 1.952 2.180 . 0 0 "[ . 1 . 2]" 1
2505 1 10 LEU HB3 1 10 LEU QD . . 2.980 2.053 1.941 2.141 . 0 0 "[ . 1 . 2]" 1
2506 1 10 LEU QD 1 11 ALA H . . 4.570 4.023 3.125 4.488 . 0 0 "[ . 1 . 2]" 1
2507 1 10 LEU QD 1 11 ALA MB . . 5.260 5.019 4.511 5.283 0.023 4 0 "[ . 1 . 2]" 1
2508 1 10 LEU QD 1 20 THR HA . . 5.440 5.386 5.121 5.467 0.027 12 0 "[ . 1 . 2]" 1
2509 1 10 LEU QD 1 20 THR HB . . 5.440 5.185 5.001 5.421 . 0 0 "[ . 1 . 2]" 1
2510 1 10 LEU QD 1 60 LYS HA . . 4.400 3.281 2.800 3.589 . 0 0 "[ . 1 . 2]" 1
2511 1 10 LEU QD 1 60 LYS HB2 . . 4.220 3.638 3.224 3.968 . 0 0 "[ . 1 . 2]" 1
2512 1 10 LEU QD 1 60 LYS HB3 . . 3.440 2.344 1.862 2.646 . 0 0 "[ . 1 . 2]" 1
2513 1 10 LEU QD 1 60 LYS HD2 . . 3.470 2.874 2.247 3.367 . 0 0 "[ . 1 . 2]" 1
2514 1 10 LEU QD 1 61 ILE H . . 3.940 2.379 1.900 2.536 . 0 0 "[ . 1 . 2]" 1
2515 1 10 LEU QD 1 62 ALA HA . . 4.650 3.454 3.276 3.564 . 0 0 "[ . 1 . 2]" 1
2516 1 10 LEU QD 1 62 ALA MB . . 3.780 3.000 2.771 3.281 . 0 0 "[ . 1 . 2]" 1
2517 1 11 ALA MB 1 63 GLU QG . . 5.090 4.047 2.907 5.095 0.005 2 0 "[ . 1 . 2]" 1
2518 1 12 LEU H 1 63 GLU QG . . 5.340 4.600 3.756 5.343 0.003 9 0 "[ . 1 . 2]" 1
2519 1 12 LEU HA 1 16 ASN QD . . 3.490 2.157 1.853 2.844 . 0 0 "[ . 1 . 2]" 1
2520 1 12 LEU MD2 1 16 ASN QD . . 3.490 2.447 1.847 2.873 . 0 0 "[ . 1 . 2]" 1
2521 1 13 THR H 1 16 ASN QD . . 4.030 1.920 1.619 3.318 . 0 0 "[ . 1 . 2]" 1
2522 1 13 THR HA 1 14 GLU QB . . 5.050 4.333 4.205 4.691 . 0 0 "[ . 1 . 2]" 1
2523 1 13 THR HA 1 69 GLU QG . . 3.590 3.298 2.774 3.593 0.003 15 0 "[ . 1 . 2]" 1
2524 1 13 THR HB 1 14 GLU QB . . 4.710 3.956 3.837 4.064 . 0 0 "[ . 1 . 2]" 1
2525 1 13 THR MG 1 15 ASN QB . . 4.630 4.153 4.056 4.277 . 0 0 "[ . 1 . 2]" 1
2526 1 13 THR MG 1 15 ASN QD . . 5.110 4.886 4.644 5.118 0.008 12 0 "[ . 1 . 2]" 1
2527 1 13 THR MG 1 16 ASN QD . . 4.140 2.701 2.044 3.547 . 0 0 "[ . 1 . 2]" 1
2528 1 13 THR MG 1 69 GLU QG . . 4.400 4.223 3.997 4.397 . 0 0 "[ . 1 . 2]" 1
2529 1 13 THR HG1 1 15 ASN QD . . 5.120 3.864 3.366 4.941 . 0 0 "[ . 1 . 2]" 1
2530 1 14 GLU H 1 14 GLU QB . . 3.000 2.211 2.133 2.425 . 0 0 "[ . 1 . 2]" 1
2531 1 14 GLU HA 1 14 GLU QG . . 3.520 2.314 2.158 2.804 . 0 0 "[ . 1 . 2]" 1
2532 1 14 GLU QB 1 15 ASN H . . 4.030 3.286 3.145 3.835 . 0 0 "[ . 1 . 2]" 1
2533 1 14 GLU QB 1 69 GLU QG . . 4.840 3.980 3.083 4.763 . 0 0 "[ . 1 . 2]" 1
2534 1 14 GLU QB 1 72 ILE HG13 . . 5.020 3.940 3.220 4.571 . 0 0 "[ . 1 . 2]" 1
2535 1 14 GLU QB 1 72 ILE MD . . 3.920 3.236 2.474 3.835 . 0 0 "[ . 1 . 2]" 1
2536 1 14 GLU QG 1 72 ILE HG13 . . 4.110 2.707 2.175 3.878 . 0 0 "[ . 1 . 2]" 1
2537 1 14 GLU QG 1 72 ILE MD . . 3.590 2.705 1.995 3.597 0.007 7 0 "[ . 1 . 2]" 1
2538 1 15 ASN H 1 15 ASN QB . . 3.330 2.309 2.207 2.562 . 0 0 "[ . 1 . 2]" 1
2539 1 15 ASN H 1 15 ASN QD . . 4.920 3.885 2.694 4.517 . 0 0 "[ . 1 . 2]" 1
2540 1 15 ASN QB 1 16 ASN H . . 4.370 2.785 2.615 2.910 . 0 0 "[ . 1 . 2]" 1
2541 1 16 ASN HA 1 19 ASP QB . . 3.710 2.811 2.468 3.042 . 0 0 "[ . 1 . 2]" 1
2542 1 16 ASN HB2 1 16 ASN QD . . 3.450 2.407 2.210 3.067 . 0 0 "[ . 1 . 2]" 1
2543 1 16 ASN HB2 1 19 ASP QB . . 4.700 3.555 3.049 3.955 . 0 0 "[ . 1 . 2]" 1
2544 1 16 ASN HB3 1 16 ASN QD . . 3.440 3.247 2.099 3.348 . 0 0 "[ . 1 . 2]" 1
2545 1 16 ASN HB3 1 19 ASP QB . . 4.240 4.065 3.807 4.241 0.001 18 0 "[ . 1 . 2]" 1
2546 1 16 ASN QD 1 17 PHE HA . . 5.120 3.530 2.443 5.109 . 0 0 "[ . 1 . 2]" 1
2547 1 19 ASP H 1 19 ASP QB . . 3.090 2.300 2.136 2.640 . 0 0 "[ . 1 . 2]" 1
2548 1 19 ASP QB 1 20 THR H . . 3.450 2.507 2.088 2.947 . 0 0 "[ . 1 . 2]" 1
2549 1 19 ASP QB 1 20 THR HG1 . . 4.560 3.445 3.192 3.745 . 0 0 "[ . 1 . 2]" 1
2550 1 19 ASP QB 1 22 ALA MB . . 5.160 4.008 3.582 4.408 . 0 0 "[ . 1 . 2]" 1
2551 1 20 THR HA 1 60 LYS QE . . 4.520 4.264 4.044 4.451 . 0 0 "[ . 1 . 2]" 1
2552 1 20 THR MG 1 60 LYS QE . . 3.430 2.717 2.327 3.413 . 0 0 "[ . 1 . 2]" 1
2553 1 21 ILE HA 1 60 LYS QE . . 4.820 4.064 3.801 4.324 . 0 0 "[ . 1 . 2]" 1
2554 1 21 ILE HB 1 90 GLY QA . . 4.760 3.417 2.866 3.837 . 0 0 "[ . 1 . 2]" 1
2555 1 21 ILE QG 1 90 GLY QA . . 3.720 2.596 1.999 3.135 . 0 0 "[ . 1 . 2]" 1
2556 1 21 ILE MD 1 90 GLY QA . . 3.470 3.009 2.593 3.379 . 0 0 "[ . 1 . 2]" 1
2557 1 22 ALA MB 1 23 GLU QG . . 3.380 2.926 2.528 3.333 . 0 0 "[ . 1 . 2]" 1
2558 1 23 GLU H 1 23 GLU QB . . 3.100 2.518 2.247 3.095 . 0 0 "[ . 1 . 2]" 1
2559 1 23 GLU H 1 23 GLU QG . . 4.020 2.542 1.885 2.995 . 0 0 "[ . 1 . 2]" 1
2560 1 23 GLU QB 1 24 GLY H . . 4.100 3.253 2.906 3.482 . 0 0 "[ . 1 . 2]" 1
2561 1 24 GLY HA2 1 60 LYS QE . . 5.340 5.069 4.681 5.313 . 0 0 "[ . 1 . 2]" 1
2562 1 24 GLY HA3 1 60 LYS QE . . 4.260 3.692 3.251 4.126 . 0 0 "[ . 1 . 2]" 1
2563 1 25 ILE H 1 60 LYS QE . . 4.370 4.275 3.963 4.373 0.003 3 0 "[ . 1 . 2]" 1
2564 1 25 ILE HA 1 88 ARG QG . . 5.340 3.893 3.334 5.342 0.002 19 0 "[ . 1 . 2]" 1
2565 1 25 ILE MG 1 112 GLN QB . . 5.340 4.731 4.422 5.193 . 0 0 "[ . 1 . 2]" 1
2566 1 25 ILE HG12 1 88 ARG QB . . 3.960 2.763 2.373 3.066 . 0 0 "[ . 1 . 2]" 1
2567 1 25 ILE HG12 1 88 ARG QD . . 3.660 2.532 2.073 2.994 . 0 0 "[ . 1 . 2]" 1
2568 1 25 ILE HG13 1 88 ARG QD . . 4.710 3.463 2.561 3.900 . 0 0 "[ . 1 . 2]" 1
2569 1 25 ILE MD 1 56 LEU QB . . 3.980 3.223 2.560 3.902 . 0 0 "[ . 1 . 2]" 1
2570 1 25 ILE MD 1 88 ARG QG . . 4.320 3.428 2.864 4.289 . 0 0 "[ . 1 . 2]" 1
2571 1 25 ILE MD 1 88 ARG QD . . 3.840 2.443 2.036 2.831 . 0 0 "[ . 1 . 2]" 1
2572 1 25 ILE MD 1 112 GLN QB . . 5.340 4.816 4.194 5.339 . 0 0 "[ . 1 . 2]" 1
2573 1 26 THR HA 1 60 LYS QE . . 4.360 3.523 3.020 3.796 . 0 0 "[ . 1 . 2]" 1
2574 1 26 THR HB 1 60 LYS QE . . 5.330 4.151 3.966 4.458 . 0 0 "[ . 1 . 2]" 1
2575 1 26 THR MG 1 60 LYS QE . . 4.010 3.344 2.999 3.748 . 0 0 "[ . 1 . 2]" 1
2576 1 26 THR HG1 1 60 LYS QE . . 3.890 2.465 2.293 2.702 . 0 0 "[ . 1 . 2]" 1
2577 1 27 PHE QE 1 96 HIS QB . . 4.060 3.504 3.162 3.849 . 0 0 "[ . 1 . 2]" 1
2578 1 27 PHE HZ 1 108 PHE QB . . 5.040 4.638 4.233 4.844 . 0 0 "[ . 1 . 2]" 1
2579 1 28 ILE HA 1 29 LYS QB . . 4.560 3.955 3.909 3.984 . 0 0 "[ . 1 . 2]" 1
2580 1 29 LYS H 1 29 LYS QB . . 3.120 2.544 2.450 2.592 . 0 0 "[ . 1 . 2]" 1
2581 1 29 LYS H 1 29 LYS QE . . 4.880 4.234 3.796 4.876 . 0 0 "[ . 1 . 2]" 1
2582 1 29 LYS H 1 63 GLU QG . . 5.340 4.981 4.423 5.343 0.003 14 0 "[ . 1 . 2]" 1
2583 1 29 LYS QB 1 29 LYS QD . . 3.290 2.436 2.029 2.588 . 0 0 "[ . 1 . 2]" 1
2584 1 29 LYS QB 1 29 LYS QE . . 3.130 1.983 1.884 2.585 . 0 0 "[ . 1 . 2]" 1
2585 1 29 LYS QB 1 30 PHE H . . 4.470 3.845 3.593 3.950 . 0 0 "[ . 1 . 2]" 1
2586 1 29 LYS QB 1 41 LEU MD2 . . 4.850 3.738 3.503 3.979 . 0 0 "[ . 1 . 2]" 1
2587 1 29 LYS QB 1 45 TRP HE1 . . 4.050 3.100 2.939 3.253 . 0 0 "[ . 1 . 2]" 1
2588 1 29 LYS QB 1 45 TRP HZ2 . . 3.960 2.728 2.530 2.845 . 0 0 "[ . 1 . 2]" 1
2589 1 29 LYS QB 1 63 GLU HA . . 3.820 2.964 2.592 3.234 . 0 0 "[ . 1 . 2]" 1
2590 1 29 LYS QB 1 63 GLU HB2 . . 4.820 3.440 3.069 3.972 . 0 0 "[ . 1 . 2]" 1
2591 1 29 LYS QB 1 84 LEU MD2 . . 3.620 2.502 2.078 2.887 . 0 0 "[ . 1 . 2]" 1
2592 1 29 LYS QD 1 30 PHE H . . 5.290 3.870 3.473 4.677 . 0 0 "[ . 1 . 2]" 1
2593 1 29 LYS QD 1 30 PHE HA . . 5.340 4.152 3.520 5.403 0.063 18 0 "[ . 1 . 2]" 1
2594 1 29 LYS QD 1 31 TYR H . . 5.340 3.428 2.826 4.592 . 0 0 "[ . 1 . 2]" 1
2595 1 29 LYS QD 1 31 TYR HA . . 5.340 3.911 3.455 4.865 . 0 0 "[ . 1 . 2]" 1
2596 1 29 LYS QD 1 31 TYR HB2 . . 4.600 3.425 3.154 4.004 . 0 0 "[ . 1 . 2]" 1
2597 1 29 LYS QD 1 31 TYR HB3 . . 3.980 2.103 1.839 2.733 . 0 0 "[ . 1 . 2]" 1
2598 1 29 LYS QD 1 31 TYR QD . . 4.540 2.787 2.091 3.676 . 0 0 "[ . 1 . 2]" 1
2599 1 29 LYS QD 1 41 LEU HG . . 5.130 4.068 3.151 4.664 . 0 0 "[ . 1 . 2]" 1
2600 1 29 LYS QD 1 41 LEU MD2 . . 3.820 2.330 1.789 2.780 . 0 0 "[ . 1 . 2]" 1
2601 1 29 LYS QD 1 45 TRP HD1 . . 5.340 4.957 3.729 5.347 0.007 20 0 "[ . 1 . 2]" 1
2602 1 29 LYS QD 1 45 TRP HE1 . . 5.340 5.011 4.118 5.346 0.006 16 0 "[ . 1 . 2]" 1
2603 1 29 LYS QD 1 63 GLU HB2 . . 5.200 4.309 3.698 5.137 . 0 0 "[ . 1 . 2]" 1
2604 1 29 LYS QD 1 82 PRO HB3 . . 4.860 3.432 3.064 4.029 . 0 0 "[ . 1 . 2]" 1
2605 1 29 LYS QD 1 82 PRO QG . . 5.180 4.691 4.396 5.090 . 0 0 "[ . 1 . 2]" 1
2606 1 29 LYS QE 1 31 TYR HB2 . . 5.150 4.326 3.791 5.018 . 0 0 "[ . 1 . 2]" 1
2607 1 29 LYS QE 1 31 TYR HB3 . . 4.490 2.964 2.512 3.607 . 0 0 "[ . 1 . 2]" 1
2608 1 29 LYS QE 1 31 TYR QD . . 4.010 2.264 1.982 2.897 . 0 0 "[ . 1 . 2]" 1
2609 1 29 LYS QE 1 41 LEU MD2 . . 4.440 3.408 2.704 3.990 . 0 0 "[ . 1 . 2]" 1
2610 1 29 LYS QE 1 45 TRP HB2 . . 4.190 3.137 2.583 3.966 . 0 0 "[ . 1 . 2]" 1
2611 1 29 LYS QE 1 45 TRP HB3 . . 5.060 3.617 3.332 4.094 . 0 0 "[ . 1 . 2]" 1
2612 1 29 LYS QE 1 45 TRP HD1 . . 3.910 3.078 2.714 3.268 . 0 0 "[ . 1 . 2]" 1
2613 1 29 LYS QE 1 45 TRP HE1 . . 4.860 3.419 2.627 3.809 . 0 0 "[ . 1 . 2]" 1
2614 1 29 LYS QE 1 61 ILE MG . . 5.340 4.926 4.448 5.319 . 0 0 "[ . 1 . 2]" 1
2615 1 29 LYS QE 1 63 GLU HA . . 4.510 3.629 2.733 4.364 . 0 0 "[ . 1 . 2]" 1
2616 1 29 LYS QE 1 63 GLU HB2 . . 3.880 2.824 1.905 3.509 . 0 0 "[ . 1 . 2]" 1
2617 1 29 LYS QE 1 64 VAL H . . 5.120 3.889 2.880 4.608 . 0 0 "[ . 1 . 2]" 1
2618 1 31 TYR HA 1 81 TYR QB . . 4.020 2.459 1.984 3.032 . 0 0 "[ . 1 . 2]" 1
2619 1 31 TYR HB3 1 38 CYS QB . . 4.400 3.924 3.406 4.365 . 0 0 "[ . 1 . 2]" 1
2620 1 31 TYR QD 1 38 CYS QB . . 4.550 2.914 2.035 3.747 . 0 0 "[ . 1 . 2]" 1
2621 1 31 TYR QD 1 63 GLU QG . . 4.930 3.395 2.332 4.341 . 0 0 "[ . 1 . 2]" 1
2622 1 31 TYR QE 1 63 GLU QG . . 3.430 2.416 1.910 2.944 . 0 0 "[ . 1 . 2]" 1
2623 1 31 TYR QE 1 65 ASP QB . . 4.620 4.191 3.455 4.634 0.014 20 0 "[ . 1 . 2]" 1
2624 1 32 ALA H 1 35 CYS QB . . 4.650 3.209 2.934 3.560 . 0 0 "[ . 1 . 2]" 1
2625 1 32 ALA H 1 38 CYS QB . . 4.100 2.946 2.566 3.439 . 0 0 "[ . 1 . 2]" 1
2626 1 32 ALA MB 1 35 CYS QB . . 3.510 2.301 1.921 2.624 . 0 0 "[ . 1 . 2]" 1
2627 1 32 ALA MB 1 81 TYR QB . . 4.250 3.107 2.729 3.640 . 0 0 "[ . 1 . 2]" 1
2628 1 33 PRO HD3 1 65 ASP QB . . 4.810 3.066 2.251 3.986 . 0 0 "[ . 1 . 2]" 1
2629 1 34 TRP H 1 35 CYS QB . . 4.880 3.704 3.595 4.151 . 0 0 "[ . 1 . 2]" 1
2630 1 34 TRP HE3 1 35 CYS QB . . 4.220 3.650 3.275 4.137 . 0 0 "[ . 1 . 2]" 1
2631 1 34 TRP HZ3 1 35 CYS QB . . 4.650 3.756 2.896 4.487 . 0 0 "[ . 1 . 2]" 1
2632 1 35 CYS H 1 35 CYS QB . . 2.720 2.343 2.228 2.492 . 0 0 "[ . 1 . 2]" 1
2633 1 35 CYS H 1 38 CYS QB . . 4.270 3.975 3.565 4.280 0.010 19 0 "[ . 1 . 2]" 1
2634 1 35 CYS QB 1 38 CYS H . . 4.420 2.952 2.573 3.307 . 0 0 "[ . 1 . 2]" 1
2635 1 35 CYS QB 1 38 CYS QB . . 3.620 2.355 2.112 2.976 . 0 0 "[ . 1 . 2]" 1
2636 1 35 CYS QB 1 81 TYR QD . . 4.740 3.652 2.776 4.282 . 0 0 "[ . 1 . 2]" 1
2637 1 36 GLY HA2 1 39 LYS QG . . 4.480 3.399 1.996 4.416 . 0 0 "[ . 1 . 2]" 1
2638 1 37 HIS H 1 37 HIS QB . . 3.490 2.411 2.178 2.750 . 0 0 "[ . 1 . 2]" 1
2639 1 37 HIS QB 1 38 CYS H . . 3.820 2.648 2.364 2.839 . 0 0 "[ . 1 . 2]" 1
2640 1 37 HIS QB 1 82 PRO QG . . 4.690 3.678 2.951 4.640 . 0 0 "[ . 1 . 2]" 1
2641 1 37 HIS QB 1 82 PRO QD . . 3.460 2.352 1.817 3.251 . 0 0 "[ . 1 . 2]" 1
2642 1 38 CYS H 1 38 CYS QB . . 3.570 2.302 2.182 2.455 . 0 0 "[ . 1 . 2]" 1
2643 1 38 CYS H 1 82 PRO QD . . 5.070 3.493 2.961 4.022 . 0 0 "[ . 1 . 2]" 1
2644 1 38 CYS HA 1 41 LEU QB . . 3.280 2.845 2.445 3.260 . 0 0 "[ . 1 . 2]" 1
2645 1 38 CYS HA 1 82 PRO QG . . 4.550 3.229 2.722 3.610 . 0 0 "[ . 1 . 2]" 1
2646 1 38 CYS HA 1 82 PRO QD . . 3.910 3.223 2.511 3.781 . 0 0 "[ . 1 . 2]" 1
2647 1 38 CYS QB 1 39 LYS H . . 3.620 2.802 2.431 3.624 0.004 5 0 "[ . 1 . 2]" 1
2648 1 39 LYS H 1 39 LYS QG . . 3.300 2.743 1.961 3.322 0.022 11 0 "[ . 1 . 2]" 1
2649 1 39 LYS HA 1 39 LYS QG . . 3.170 2.323 2.142 2.536 . 0 0 "[ . 1 . 2]" 1
2650 1 39 LYS QE 1 39 LYS QG . . 3.300 2.211 2.027 2.346 . 0 0 "[ . 1 . 2]" 1
2651 1 39 LYS QG 1 40 THR H . . 5.340 4.363 3.893 4.686 . 0 0 "[ . 1 . 2]" 1
2652 1 40 THR H 1 41 LEU QB . . 5.340 4.321 4.235 4.396 . 0 0 "[ . 1 . 2]" 1
2653 1 41 LEU H 1 41 LEU QB . . 2.980 2.305 2.263 2.394 . 0 0 "[ . 1 . 2]" 1
2654 1 41 LEU QB 1 41 LEU MD1 . . 3.030 2.210 2.011 2.307 . 0 0 "[ . 1 . 2]" 1
2655 1 41 LEU QB 1 41 LEU MD2 . . 3.060 2.040 1.939 2.100 . 0 0 "[ . 1 . 2]" 1
2656 1 41 LEU QB 1 42 ALA H . . 3.570 3.071 2.774 3.447 . 0 0 "[ . 1 . 2]" 1
2657 1 41 LEU MD1 1 100 ARG QB . . 3.230 2.301 1.945 3.173 . 0 0 "[ . 1 . 2]" 1
2658 1 41 LEU MD1 1 100 ARG QG . . 4.340 3.773 2.970 4.268 . 0 0 "[ . 1 . 2]" 1
2659 1 41 LEU MD1 1 100 ARG QD . . 3.700 2.953 1.890 3.516 . 0 0 "[ . 1 . 2]" 1
2660 1 41 LEU MD2 1 82 PRO QG . . 3.390 2.529 2.115 2.835 . 0 0 "[ . 1 . 2]" 1
2661 1 41 LEU MD2 1 82 PRO QD . . 4.530 4.118 3.771 4.427 . 0 0 "[ . 1 . 2]" 1
2662 1 43 PRO HA 1 46 GLU QG . . 4.220 3.756 3.357 4.010 . 0 0 "[ . 1 . 2]" 1
2663 1 45 TRP HB3 1 46 GLU QG . . 4.410 3.510 3.211 4.423 0.013 3 0 "[ . 1 . 2]" 1
2664 1 45 TRP HE1 1 63 GLU QG . . 4.950 4.470 3.940 4.806 . 0 0 "[ . 1 . 2]" 1
2665 1 46 GLU H 1 46 GLU QG . . 3.430 2.545 2.169 3.323 . 0 0 "[ . 1 . 2]" 1
2666 1 46 GLU HA 1 46 GLU QG . . 3.210 2.380 2.222 2.703 . 0 0 "[ . 1 . 2]" 1
2667 1 46 GLU QG 1 49 SER HG . . 4.670 4.039 3.638 4.653 . 0 0 "[ . 1 . 2]" 1
2668 1 46 GLU QG 1 50 LYS QE . . 5.100 4.717 4.467 5.030 . 0 0 "[ . 1 . 2]" 1
2669 1 47 GLU H 1 47 GLU QG . . 3.200 2.172 1.969 2.662 . 0 0 "[ . 1 . 2]" 1
2670 1 47 GLU HA 1 47 GLU QG . . 3.340 2.628 2.299 2.940 . 0 0 "[ . 1 . 2]" 1
2671 1 47 GLU HA 1 50 LYS QD . . 3.720 2.313 2.003 2.826 . 0 0 "[ . 1 . 2]" 1
2672 1 47 GLU HB3 1 51 LYS QG . . 5.200 3.865 3.364 4.493 . 0 0 "[ . 1 . 2]" 1
2673 1 47 GLU QG 1 48 LEU H . . 4.900 4.061 3.845 4.288 . 0 0 "[ . 1 . 2]" 1
2674 1 47 GLU QG 1 50 LYS QE . . 5.000 4.370 3.493 4.963 . 0 0 "[ . 1 . 2]" 1
2675 1 47 GLU QG 1 102 LEU MD1 . . 5.040 3.612 3.187 3.960 . 0 0 "[ . 1 . 2]" 1
2676 1 47 GLU QG 1 102 LEU MD2 . . 5.240 3.093 2.275 3.903 . 0 0 "[ . 1 . 2]" 1
2677 1 48 LEU H 1 51 LYS QG . . 4.800 4.074 3.843 4.380 . 0 0 "[ . 1 . 2]" 1
2678 1 48 LEU HA 1 51 LYS QB . . 4.940 2.908 2.624 3.439 . 0 0 "[ . 1 . 2]" 1
2679 1 48 LEU HA 1 51 LYS QD . . 4.470 3.961 3.364 4.352 . 0 0 "[ . 1 . 2]" 1
2680 1 48 LEU HA 1 51 LYS QE . . 4.970 4.314 3.913 4.479 . 0 0 "[ . 1 . 2]" 1
2681 1 48 LEU MD1 1 51 LYS QB . . 3.830 2.826 2.422 3.214 . 0 0 "[ . 1 . 2]" 1
2682 1 50 LYS H 1 50 LYS QD . . 4.250 3.570 3.360 3.832 . 0 0 "[ . 1 . 2]" 1
2683 1 50 LYS HA 1 50 LYS QD . . 4.590 4.072 4.023 4.111 . 0 0 "[ . 1 . 2]" 1
2684 1 51 LYS H 1 51 LYS QB . . 3.120 2.526 2.386 2.606 . 0 0 "[ . 1 . 2]" 1
2685 1 51 LYS H 1 51 LYS QG . . 3.200 2.070 1.932 2.631 . 0 0 "[ . 1 . 2]" 1
2686 1 51 LYS H 1 51 LYS QD . . 4.860 3.492 3.211 3.965 . 0 0 "[ . 1 . 2]" 1
2687 1 51 LYS HA 1 51 LYS QG . . 3.470 2.818 2.715 2.928 . 0 0 "[ . 1 . 2]" 1
2688 1 51 LYS HA 1 51 LYS QD . . 3.210 2.081 1.990 2.243 . 0 0 "[ . 1 . 2]" 1
2689 1 51 LYS HA 1 51 LYS QE . . 4.410 3.508 3.099 3.717 . 0 0 "[ . 1 . 2]" 1
2690 1 51 LYS HA 1 52 GLU QG . . 4.500 3.475 2.973 4.388 . 0 0 "[ . 1 . 2]" 1
2691 1 51 LYS QB 1 51 LYS QE . . 3.810 2.148 1.989 2.464 . 0 0 "[ . 1 . 2]" 1
2692 1 51 LYS QB 1 52 GLU H . . 3.320 2.518 2.097 3.018 . 0 0 "[ . 1 . 2]" 1
2693 1 51 LYS QB 1 53 PHE QD . . 5.340 4.579 4.193 4.747 . 0 0 "[ . 1 . 2]" 1
2694 1 51 LYS QB 1 53 PHE QE . . 4.390 3.765 3.452 3.963 . 0 0 "[ . 1 . 2]" 1
2695 1 51 LYS QB 1 53 PHE HZ . . 4.230 3.775 3.437 4.115 . 0 0 "[ . 1 . 2]" 1
2696 1 51 LYS QE 1 51 LYS QG . . 3.220 2.244 2.108 2.427 . 0 0 "[ . 1 . 2]" 1
2697 1 51 LYS QG 1 52 GLU H . . 4.870 4.320 4.135 4.568 . 0 0 "[ . 1 . 2]" 1
2698 1 51 LYS QG 1 106 HIS HB2 . . 4.420 3.321 2.984 3.797 . 0 0 "[ . 1 . 2]" 1
2699 1 51 LYS QG 1 106 HIS HD2 . . 4.240 3.699 3.107 4.205 . 0 0 "[ . 1 . 2]" 1
2700 1 51 LYS QD 1 52 GLU H . . 4.230 3.467 3.134 3.737 . 0 0 "[ . 1 . 2]" 1
2701 1 51 LYS QD 1 102 LEU MD1 . . 3.620 2.499 2.047 2.997 . 0 0 "[ . 1 . 2]" 1
2702 1 51 LYS QD 1 102 LEU MD2 . . 4.240 2.943 2.200 3.613 . 0 0 "[ . 1 . 2]" 1
2703 1 51 LYS QD 1 106 HIS HB2 . . 5.060 4.321 4.132 4.488 . 0 0 "[ . 1 . 2]" 1
2704 1 51 LYS QE 1 52 GLU H . . 4.290 3.630 3.293 4.053 . 0 0 "[ . 1 . 2]" 1
2705 1 51 LYS QE 1 102 LEU HG . . 4.280 3.693 3.044 4.137 . 0 0 "[ . 1 . 2]" 1
2706 1 51 LYS QE 1 102 LEU MD1 . . 3.360 3.123 2.590 3.366 0.006 11 0 "[ . 1 . 2]" 1
2707 1 51 LYS QE 1 106 HIS HA . . 5.340 4.227 3.919 4.629 . 0 0 "[ . 1 . 2]" 1
2708 1 51 LYS QE 1 106 HIS HB3 . . 5.290 3.322 3.087 3.594 . 0 0 "[ . 1 . 2]" 1
2709 1 51 LYS QE 1 106 HIS HD2 . . 4.590 3.155 2.650 3.658 . 0 0 "[ . 1 . 2]" 1
2710 1 51 LYS QE 1 106 HIS HE1 . . 4.510 3.727 3.381 4.239 . 0 0 "[ . 1 . 2]" 1
2711 1 52 GLU HA 1 52 GLU QG . . 3.560 2.641 2.114 3.043 . 0 0 "[ . 1 . 2]" 1
2712 1 52 GLU QG 1 53 PHE H . . 4.880 4.347 3.582 4.756 . 0 0 "[ . 1 . 2]" 1
2713 1 53 PHE HB2 1 56 LEU QB . . 3.660 2.444 2.249 2.849 . 0 0 "[ . 1 . 2]" 1
2714 1 53 PHE HB3 1 56 LEU QB . . 3.550 2.325 2.051 3.019 . 0 0 "[ . 1 . 2]" 1
2715 1 54 PRO QB 1 55 GLY H . . 4.020 3.172 2.842 3.578 . 0 0 "[ . 1 . 2]" 1
2716 1 54 PRO QG 1 110 LEU MD1 . . 4.410 4.163 3.949 4.368 . 0 0 "[ . 1 . 2]" 1
2717 1 54 PRO QG 1 110 LEU MD2 . . 3.580 3.040 2.930 3.203 . 0 0 "[ . 1 . 2]" 1
2718 1 55 GLY QA 1 56 LEU HG . . 5.140 4.049 3.464 4.419 . 0 0 "[ . 1 . 2]" 1
2719 1 56 LEU H 1 56 LEU QB . . 3.060 2.480 2.377 2.664 . 0 0 "[ . 1 . 2]" 1
2720 1 56 LEU QB 1 56 LEU MD1 . . 3.030 2.056 1.984 2.100 . 0 0 "[ . 1 . 2]" 1
2721 1 56 LEU QB 1 56 LEU MD2 . . 3.170 2.314 2.193 2.487 . 0 0 "[ . 1 . 2]" 1
2722 1 56 LEU QB 1 57 ALA H . . 3.550 2.557 2.181 2.760 . 0 0 "[ . 1 . 2]" 1
2723 1 56 LEU QB 1 59 VAL MG2 . . 3.140 2.751 2.480 2.906 . 0 0 "[ . 1 . 2]" 1
2724 1 56 LEU MD2 1 114 LYS QB . . 5.170 3.535 1.974 4.437 . 0 0 "[ . 1 . 2]" 1
2725 1 56 LEU MD2 1 114 LYS QE . . 4.840 4.009 2.562 4.848 0.008 14 0 "[ . 1 . 2]" 1
2726 1 59 VAL HA 1 60 LYS QG . . 5.340 3.959 3.617 4.309 . 0 0 "[ . 1 . 2]" 1
2727 1 60 LYS H 1 60 LYS QG . . 3.870 2.893 2.479 3.228 . 0 0 "[ . 1 . 2]" 1
2728 1 60 LYS H 1 60 LYS QE . . 4.190 3.318 2.788 3.971 . 0 0 "[ . 1 . 2]" 1
2729 1 60 LYS HA 1 60 LYS QG . . 3.210 2.406 2.337 2.483 . 0 0 "[ . 1 . 2]" 1
2730 1 60 LYS HA 1 60 LYS QE . . 5.050 4.392 4.212 4.590 . 0 0 "[ . 1 . 2]" 1
2731 1 60 LYS HB2 1 60 LYS QE . . 3.160 2.231 1.989 2.499 . 0 0 "[ . 1 . 2]" 1
2732 1 60 LYS HB3 1 60 LYS QE . . 3.880 3.376 3.185 3.596 . 0 0 "[ . 1 . 2]" 1
2733 1 60 LYS QE 1 60 LYS QG . . 3.140 2.287 2.071 2.574 . 0 0 "[ . 1 . 2]" 1
2734 1 60 LYS QG 1 61 ILE H . . 4.610 3.837 3.627 4.091 . 0 0 "[ . 1 . 2]" 1
2735 1 63 GLU H 1 63 GLU QG . . 3.910 3.374 2.697 4.048 0.138 7 0 "[ . 1 . 2]" 1
2736 1 63 GLU HA 1 63 GLU QG . . 3.350 3.055 2.555 3.459 0.109 20 0 "[ . 1 . 2]" 1
2737 1 63 GLU QG 1 64 VAL H . . 3.700 2.628 2.011 3.725 0.025 20 0 "[ . 1 . 2]" 1
2738 1 64 VAL HA 1 65 ASP QB . . 4.490 4.358 4.023 4.550 0.060 18 0 "[ . 1 . 2]" 1
2739 1 64 VAL HA 1 69 GLU QG . . 5.340 4.571 3.847 5.041 . 0 0 "[ . 1 . 2]" 1
2740 1 64 VAL MG1 1 65 ASP QB . . 4.740 4.063 3.784 4.440 . 0 0 "[ . 1 . 2]" 1
2741 1 65 ASP H 1 65 ASP QB . . 3.080 2.487 2.185 2.930 . 0 0 "[ . 1 . 2]" 1
2742 1 65 ASP H 1 69 GLU QG . . 4.380 3.912 3.127 4.333 . 0 0 "[ . 1 . 2]" 1
2743 1 65 ASP QB 1 67 THR H . . 4.290 2.617 2.318 3.936 . 0 0 "[ . 1 . 2]" 1
2744 1 65 ASP QB 1 67 THR MG . . 5.120 3.918 3.335 4.943 . 0 0 "[ . 1 . 2]" 1
2745 1 65 ASP QB 1 68 ALA MB . . 3.290 2.807 2.202 3.292 0.002 14 0 "[ . 1 . 2]" 1
2746 1 65 ASP QB 1 69 GLU H . . 4.730 3.425 3.098 3.753 . 0 0 "[ . 1 . 2]" 1
2747 1 65 ASP QB 1 69 GLU QG . . 4.420 4.286 3.795 4.462 0.042 9 0 "[ . 1 . 2]" 1
2748 1 67 THR HA 1 70 ARG QG . . 4.420 3.035 2.551 4.014 . 0 0 "[ . 1 . 2]" 1
2749 1 68 ALA MB 1 69 GLU QG . . 3.230 2.875 2.592 3.235 0.005 1 0 "[ . 1 . 2]" 1
2750 1 69 GLU H 1 69 GLU QG . . 3.340 2.983 2.630 3.331 . 0 0 "[ . 1 . 2]" 1
2751 1 69 GLU QG 1 72 ILE MD . . 4.150 2.959 2.478 3.606 . 0 0 "[ . 1 . 2]" 1
2752 1 70 ARG H 1 70 ARG QG . . 3.100 2.223 1.894 2.971 . 0 0 "[ . 1 . 2]" 1
2753 1 70 ARG HA 1 70 ARG QG . . 3.360 2.579 2.272 3.404 0.044 10 0 "[ . 1 . 2]" 1
2754 1 70 ARG QB 1 70 ARG QG . . 2.430 2.046 1.969 2.087 . 0 0 "[ . 1 . 2]" 1
2755 1 71 ASN H 1 71 ASN QD . . 4.930 3.350 1.805 4.412 . 0 0 "[ . 1 . 2]" 1
2756 1 71 ASN HB2 1 71 ASN QD . . 3.250 2.480 2.095 3.116 . 0 0 "[ . 1 . 2]" 1
2757 1 72 ILE HA 1 75 LYS QD . . 4.150 3.478 3.134 4.099 . 0 0 "[ . 1 . 2]" 1
2758 1 72 ILE MG 1 75 LYS QD . . 4.400 3.567 3.251 4.048 . 0 0 "[ . 1 . 2]" 1
2759 1 75 LYS H 1 75 LYS QG . . 4.260 3.977 3.942 4.036 . 0 0 "[ . 1 . 2]" 1
2760 1 75 LYS H 1 75 LYS QD . . 5.010 4.333 4.017 4.502 . 0 0 "[ . 1 . 2]" 1
2761 1 75 LYS HA 1 75 LYS QG . . 3.560 2.538 2.441 2.625 . 0 0 "[ . 1 . 2]" 1
2762 1 75 LYS HA 1 75 LYS QD . . 4.790 4.060 3.586 4.267 . 0 0 "[ . 1 . 2]" 1
2763 1 75 LYS QG 1 76 TYR H . . 4.370 3.821 3.586 4.152 . 0 0 "[ . 1 . 2]" 1
2764 1 75 LYS QG 1 76 TYR HA . . 5.100 3.798 3.514 4.332 . 0 0 "[ . 1 . 2]" 1
2765 1 75 LYS QG 1 76 TYR QD . . 4.590 4.271 3.944 4.599 0.009 19 0 "[ . 1 . 2]" 1
2766 1 75 LYS QG 1 76 TYR QE . . 4.960 4.516 4.282 4.724 . 0 0 "[ . 1 . 2]" 1
2767 1 75 LYS QD 1 76 TYR QD . . 4.400 3.671 2.782 4.316 . 0 0 "[ . 1 . 2]" 1
2768 1 75 LYS QD 1 76 TYR QE . . 3.750 3.224 2.627 3.734 . 0 0 "[ . 1 . 2]" 1
2769 1 76 TYR QD 1 92 LYS QD . . 5.340 4.295 2.971 5.336 . 0 0 "[ . 1 . 2]" 1
2770 1 76 TYR QE 1 92 LYS QD . . 5.040 4.033 3.066 5.024 . 0 0 "[ . 1 . 2]" 1
2771 1 77 SER H 1 77 SER QB . . 3.450 2.930 2.695 3.195 . 0 0 "[ . 1 . 2]" 1
2772 1 77 SER QB 1 78 VAL H . . 4.390 3.889 3.741 4.049 . 0 0 "[ . 1 . 2]" 1
2773 1 78 VAL HA 1 79 ARG QB . . 4.980 4.468 4.250 4.654 . 0 0 "[ . 1 . 2]" 1
2774 1 79 ARG H 1 79 ARG QB . . 3.470 2.670 2.345 2.947 . 0 0 "[ . 1 . 2]" 1
2775 1 79 ARG QB 1 79 ARG QD . . 3.360 2.263 2.066 2.610 . 0 0 "[ . 1 . 2]" 1
2776 1 79 ARG QB 1 80 GLY H . . 3.780 3.133 2.538 3.750 . 0 0 "[ . 1 . 2]" 1
2777 1 80 GLY QA 1 81 TYR H . . 2.900 2.168 2.110 2.282 . 0 0 "[ . 1 . 2]" 1
2778 1 80 GLY QA 1 81 TYR QD . . 4.470 3.687 2.787 4.192 . 0 0 "[ . 1 . 2]" 1
2779 1 80 GLY QA 1 81 TYR QE . . 5.340 4.354 3.150 4.775 . 0 0 "[ . 1 . 2]" 1
2780 1 81 TYR H 1 81 TYR QB . . 3.340 2.787 2.687 3.128 . 0 0 "[ . 1 . 2]" 1
2781 1 81 TYR QB 1 82 PRO HA . . 3.300 2.005 1.957 2.271 . 0 0 "[ . 1 . 2]" 1
2782 1 81 TYR QB 1 83 THR H . . 4.610 3.504 3.229 3.945 . 0 0 "[ . 1 . 2]" 1
2783 1 82 PRO QG 1 84 LEU MD1 . . 4.620 4.353 4.075 4.518 . 0 0 "[ . 1 . 2]" 1
2784 1 82 PRO QG 1 84 LEU MD2 . . 4.350 4.038 3.529 4.289 . 0 0 "[ . 1 . 2]" 1
2785 1 82 PRO QG 1 100 ARG QD . . 4.000 2.129 1.781 3.328 . 0 0 "[ . 1 . 2]" 1
2786 1 83 THR HA 1 95 GLU QG . . 5.340 4.786 4.351 5.208 . 0 0 "[ . 1 . 2]" 1
2787 1 83 THR MG 1 95 GLU QB . . 5.340 4.786 4.474 5.166 . 0 0 "[ . 1 . 2]" 1
2788 1 83 THR MG 1 95 GLU QG . . 3.560 3.303 3.022 3.558 . 0 0 "[ . 1 . 2]" 1
2789 1 84 LEU H 1 95 GLU QG . . 4.510 3.538 3.053 4.134 . 0 0 "[ . 1 . 2]" 1
2790 1 84 LEU HB2 1 96 HIS QB . . 3.430 2.148 1.959 2.591 . 0 0 "[ . 1 . 2]" 1
2791 1 84 LEU HB3 1 96 HIS QB . . 4.090 3.328 2.979 3.749 . 0 0 "[ . 1 . 2]" 1
2792 1 84 LEU MD1 1 96 HIS QB . . 3.760 2.188 1.931 2.635 . 0 0 "[ . 1 . 2]" 1
2793 1 84 LEU MD1 1 100 ARG QG . . 3.710 2.522 1.879 3.618 . 0 0 "[ . 1 . 2]" 1
2794 1 84 LEU MD1 1 100 ARG QD . . 3.850 2.772 1.831 3.637 . 0 0 "[ . 1 . 2]" 1
2795 1 84 LEU MD2 1 96 HIS QB . . 4.940 4.267 4.036 4.528 . 0 0 "[ . 1 . 2]" 1
2796 1 84 LEU MD2 1 100 ARG QG . . 5.340 4.284 3.412 5.215 . 0 0 "[ . 1 . 2]" 1
2797 1 85 LEU HA 1 95 GLU QG . . 4.910 3.761 3.516 4.126 . 0 0 "[ . 1 . 2]" 1
2798 1 85 LEU MD2 1 95 GLU QG . . 3.380 2.114 1.800 2.544 . 0 0 "[ . 1 . 2]" 1
2799 1 86 LEU HB2 1 94 SER QB . . 5.340 4.643 4.335 5.020 . 0 0 "[ . 1 . 2]" 1
2800 1 86 LEU HB3 1 94 SER QB . . 4.160 3.832 3.649 4.043 . 0 0 "[ . 1 . 2]" 1
2801 1 86 LEU MD2 1 88 ARG QB . . 4.750 3.384 3.119 3.668 . 0 0 "[ . 1 . 2]" 1
2802 1 86 LEU MD2 1 88 ARG QD . . 4.770 3.945 3.528 4.512 . 0 0 "[ . 1 . 2]" 1
2803 1 86 LEU MD2 1 94 SER QB . . 4.150 3.695 3.375 3.950 . 0 0 "[ . 1 . 2]" 1
2804 1 86 LEU MD2 1 112 GLN QB . . 3.100 2.062 1.783 2.300 . 0 0 "[ . 1 . 2]" 1
2805 1 86 LEU MD2 1 112 GLN QE . . 4.960 4.353 3.068 4.948 . 0 0 "[ . 1 . 2]" 1
2806 1 87 PHE HA 1 88 ARG QB . . 5.050 4.053 3.972 4.107 . 0 0 "[ . 1 . 2]" 1
2807 1 88 ARG H 1 88 ARG QB . . 3.470 2.550 2.453 2.641 . 0 0 "[ . 1 . 2]" 1
2808 1 88 ARG H 1 91 LYS QB . . 5.340 4.617 3.737 5.272 . 0 0 "[ . 1 . 2]" 1
2809 1 88 ARG HA 1 88 ARG QG . . 3.450 2.433 2.219 2.942 . 0 0 "[ . 1 . 2]" 1
2810 1 88 ARG HA 1 89 GLY QA . . 4.550 3.910 3.895 3.994 . 0 0 "[ . 1 . 2]" 1
2811 1 88 ARG QB 1 88 ARG QD . . 3.070 2.124 2.044 2.248 . 0 0 "[ . 1 . 2]" 1
2812 1 88 ARG QB 1 93 VAL MG1 . . 3.440 3.371 3.114 3.441 0.001 18 0 "[ . 1 . 2]" 1
2813 1 88 ARG QB 1 93 VAL MG2 . . 2.840 1.992 1.836 2.143 . 0 0 "[ . 1 . 2]" 1
2814 1 88 ARG QG 1 89 GLY H . . 3.730 3.022 2.266 3.248 . 0 0 "[ . 1 . 2]" 1
2815 1 88 ARG QG 1 89 GLY QA . . 3.880 3.400 2.773 3.750 . 0 0 "[ . 1 . 2]" 1
2816 1 88 ARG QD 1 93 VAL MG2 . . 4.330 3.415 2.999 4.079 . 0 0 "[ . 1 . 2]" 1
2817 1 88 ARG QD 1 113 ALA HA . . 4.770 3.301 2.603 3.830 . 0 0 "[ . 1 . 2]" 1
2818 1 88 ARG QD 1 113 ALA MB . . 4.740 3.361 2.871 4.048 . 0 0 "[ . 1 . 2]" 1
2819 1 89 GLY QA 1 91 LYS H . . 4.370 3.901 3.531 4.260 . 0 0 "[ . 1 . 2]" 1
2820 1 90 GLY QA 1 91 LYS QG . . 4.770 4.003 3.308 4.735 . 0 0 "[ . 1 . 2]" 1
2821 1 91 LYS H 1 91 LYS QB . . 3.200 2.812 2.366 3.181 . 0 0 "[ . 1 . 2]" 1
2822 1 91 LYS QB 1 92 LYS QG . . 4.580 3.695 3.227 4.645 0.065 5 0 "[ . 1 . 2]" 1
2823 1 91 LYS QE 1 92 LYS QG . . 4.740 4.076 3.491 4.799 0.059 5 0 "[ . 1 . 2]" 1
2824 1 92 LYS HA 1 92 LYS QG . . 3.430 3.299 2.806 3.363 . 0 0 "[ . 1 . 2]" 1
2825 1 92 LYS QE 1 92 LYS QG . . 3.180 2.239 2.057 2.555 . 0 0 "[ . 1 . 2]" 1
2826 1 92 LYS QG 1 93 VAL H . . 3.950 3.459 2.372 3.938 . 0 0 "[ . 1 . 2]" 1
2827 1 93 VAL MG1 1 94 SER QB . . 3.200 2.691 2.400 2.984 . 0 0 "[ . 1 . 2]" 1
2828 1 93 VAL MG1 1 112 GLN QB . . 4.260 2.852 2.294 3.440 . 0 0 "[ . 1 . 2]" 1
2829 1 93 VAL MG2 1 94 SER QB . . 4.790 4.677 4.634 4.697 . 0 0 "[ . 1 . 2]" 1
2830 1 93 VAL MG2 1 112 GLN QB . . 5.340 4.336 3.931 4.615 . 0 0 "[ . 1 . 2]" 1
2831 1 94 SER QB 1 95 GLU H . . 3.590 3.269 2.996 3.547 . 0 0 "[ . 1 . 2]" 1
2832 1 94 SER QB 1 108 PHE HZ . . 3.670 2.374 2.015 2.551 . 0 0 "[ . 1 . 2]" 1
2833 1 94 SER QB 1 112 GLN QB . . 5.180 4.069 3.585 4.742 . 0 0 "[ . 1 . 2]" 1
2834 1 94 SER QB 1 112 GLN HG2 . . 5.340 4.199 3.679 4.689 . 0 0 "[ . 1 . 2]" 1
2835 1 94 SER QB 1 112 GLN HG3 . . 4.640 3.081 2.704 3.706 . 0 0 "[ . 1 . 2]" 1
2836 1 94 SER QB 1 112 GLN QE . . 5.180 2.987 2.177 3.885 . 0 0 "[ . 1 . 2]" 1
2837 1 95 GLU HA 1 95 GLU QG . . 3.520 2.438 2.283 2.607 . 0 0 "[ . 1 . 2]" 1
2838 1 95 GLU QB 1 96 HIS H . . 4.350 3.734 3.440 3.935 . 0 0 "[ . 1 . 2]" 1
2839 1 95 GLU QG 1 96 HIS H . . 3.380 2.737 1.948 3.316 . 0 0 "[ . 1 . 2]" 1
2840 1 95 GLU QG 1 96 HIS HA . . 5.340 4.292 3.873 4.726 . 0 0 "[ . 1 . 2]" 1
2841 1 96 HIS QB 1 108 PHE QD . . 4.960 3.693 3.012 4.319 . 0 0 "[ . 1 . 2]" 1
2842 1 96 HIS HD2 1 108 PHE QB . . 4.430 2.700 2.198 4.111 . 0 0 "[ . 1 . 2]" 1
2843 1 96 HIS HE1 1 98 GLY QA . . 3.740 3.073 2.507 3.738 . 0 0 "[ . 1 . 2]" 1
2844 1 96 HIS HE1 1 100 ARG QG . . 5.040 4.555 3.734 5.039 . 0 0 "[ . 1 . 2]" 1
2845 1 96 HIS HE1 1 104 SER QB . . 4.250 3.161 2.123 4.241 . 0 0 "[ . 1 . 2]" 1
2846 1 96 HIS HE1 1 108 PHE QB . . 4.700 4.049 3.489 4.627 . 0 0 "[ . 1 . 2]" 1
2847 1 97 SER QB 1 98 GLY H . . 4.420 3.424 2.023 4.047 . 0 0 "[ . 1 . 2]" 1
2848 1 98 GLY QA 1 99 GLY H . . 3.090 2.284 2.113 2.559 . 0 0 "[ . 1 . 2]" 1
2849 1 99 GLY H 1 104 SER QB . . 5.250 4.290 3.511 5.233 . 0 0 "[ . 1 . 2]" 1
2850 1 99 GLY QA 1 100 ARG H . . 2.890 2.316 2.110 2.887 . 0 0 "[ . 1 . 2]" 1
2851 1 99 GLY QA 1 100 ARG QB . . 4.570 4.069 3.824 4.486 . 0 0 "[ . 1 . 2]" 1
2852 1 99 GLY QA 1 101 ASP H . . 3.950 3.261 3.010 3.572 . 0 0 "[ . 1 . 2]" 1
2853 1 100 ARG H 1 100 ARG QB . . 3.330 2.627 2.247 3.335 0.005 1 0 "[ . 1 . 2]" 1
2854 1 100 ARG H 1 100 ARG QG . . 3.690 2.799 1.870 3.092 . 0 0 "[ . 1 . 2]" 1
2855 1 100 ARG H 1 100 ARG QD . . 4.780 4.304 3.344 4.764 . 0 0 "[ . 1 . 2]" 1
2856 1 100 ARG H 1 104 SER QB . . 5.340 3.970 2.867 4.647 . 0 0 "[ . 1 . 2]" 1
2857 1 100 ARG HA 1 100 ARG QG . . 3.450 2.436 2.291 3.399 . 0 0 "[ . 1 . 2]" 1
2858 1 100 ARG QB 1 100 ARG QD . . 3.000 2.141 2.017 2.279 . 0 0 "[ . 1 . 2]" 1
2859 1 100 ARG QB 1 105 LEU MD1 . . 4.300 3.824 3.165 4.301 0.001 17 0 "[ . 1 . 2]" 1
2860 1 100 ARG QB 1 105 LEU MD2 . . 5.110 3.786 2.230 4.593 . 0 0 "[ . 1 . 2]" 1
2861 1 101 ASP H 1 104 SER QB . . 3.840 2.085 1.879 3.206 . 0 0 "[ . 1 . 2]" 1
2862 1 101 ASP HB2 1 104 SER QB . . 4.980 2.332 1.995 2.882 . 0 0 "[ . 1 . 2]" 1
2863 1 102 LEU HB3 1 103 ASP QB . . 5.080 4.144 3.868 4.694 . 0 0 "[ . 1 . 2]" 1
2864 1 103 ASP H 1 103 ASP QB . . 3.080 2.304 2.181 2.504 . 0 0 "[ . 1 . 2]" 1
2865 1 103 ASP QB 1 104 SER HA . . 5.140 3.964 3.744 4.402 . 0 0 "[ . 1 . 2]" 1
2866 1 104 SER H 1 104 SER QB . . 3.440 2.348 2.178 2.534 . 0 0 "[ . 1 . 2]" 1
2867 1 104 SER HA 1 107 ARG QB . . 4.100 3.959 3.718 4.091 . 0 0 "[ . 1 . 2]" 1
2868 1 104 SER HA 1 107 ARG QG . . 3.780 2.435 2.022 2.767 . 0 0 "[ . 1 . 2]" 1
2869 1 104 SER HA 1 107 ARG QD . . 4.340 2.326 1.866 3.371 . 0 0 "[ . 1 . 2]" 1
2870 1 104 SER QB 1 105 LEU H . . 3.650 3.023 2.686 3.579 . 0 0 "[ . 1 . 2]" 1
2871 1 105 LEU HA 1 107 ARG QD . . 5.330 5.245 4.878 5.336 0.006 19 0 "[ . 1 . 2]" 1
2872 1 105 LEU HA 1 108 PHE QB . . 3.450 2.659 2.248 2.950 . 0 0 "[ . 1 . 2]" 1
2873 1 106 HIS HB3 1 107 ARG QB . . 4.890 3.966 3.866 4.172 . 0 0 "[ . 1 . 2]" 1
2874 1 107 ARG H 1 107 ARG QB . . 2.950 2.426 2.321 2.640 . 0 0 "[ . 1 . 2]" 1
2875 1 107 ARG H 1 107 ARG QG . . 3.340 2.252 2.037 2.442 . 0 0 "[ . 1 . 2]" 1
2876 1 107 ARG H 1 107 ARG QD . . 4.880 3.698 3.302 4.060 . 0 0 "[ . 1 . 2]" 1
2877 1 107 ARG HA 1 107 ARG QG . . 3.560 3.365 3.324 3.439 . 0 0 "[ . 1 . 2]" 1
2878 1 107 ARG HA 1 107 ARG QD . . 4.530 4.231 3.585 4.577 0.047 13 0 "[ . 1 . 2]" 1
2879 1 107 ARG QB 1 107 ARG QD . . 3.220 2.299 2.073 2.569 . 0 0 "[ . 1 . 2]" 1
2880 1 107 ARG QB 1 108 PHE H . . 4.050 3.394 3.261 3.702 . 0 0 "[ . 1 . 2]" 1
2881 1 107 ARG QB 1 110 LEU MD1 . . 4.180 3.462 3.213 3.709 . 0 0 "[ . 1 . 2]" 1
2882 1 107 ARG QG 1 108 PHE H . . 4.550 1.991 1.810 2.553 . 0 0 "[ . 1 . 2]" 1
2883 1 108 PHE H 1 108 PHE QB . . 2.800 2.249 2.206 2.269 . 0 0 "[ . 1 . 2]" 1
2884 1 108 PHE QB 1 109 VAL H . . 3.270 2.294 2.095 2.540 . 0 0 "[ . 1 . 2]" 1
2885 1 108 PHE QB 1 109 VAL MG2 . . 4.080 3.156 2.963 3.393 . 0 0 "[ . 1 . 2]" 1
2886 1 109 VAL HA 1 112 GLN QB . . 4.120 2.297 2.000 2.531 . 0 0 "[ . 1 . 2]" 1
2887 1 109 VAL MG2 1 112 GLN QB . . 4.590 3.952 3.691 4.095 . 0 0 "[ . 1 . 2]" 1
2888 1 111 SER HA 1 114 LYS QB . . 3.840 2.706 2.207 3.873 0.033 3 0 "[ . 1 . 2]" 1
2889 1 111 SER HA 1 114 LYS QG . . 4.780 3.963 1.935 4.794 0.014 14 0 "[ . 1 . 2]" 1
2890 1 111 SER QB 1 112 GLN QB . . 5.120 4.426 4.237 4.937 . 0 0 "[ . 1 . 2]" 1
2891 1 111 SER QB 1 112 GLN QE . . 4.500 3.960 2.636 4.481 . 0 0 "[ . 1 . 2]" 1
2892 1 112 GLN H 1 112 GLN QB . . 3.340 2.313 2.176 2.504 . 0 0 "[ . 1 . 2]" 1
2893 1 112 GLN H 1 112 GLN QE . . 4.720 3.932 2.936 4.555 . 0 0 "[ . 1 . 2]" 1
2894 1 112 GLN HA 1 112 GLN QE . . 4.260 2.838 2.214 3.416 . 0 0 "[ . 1 . 2]" 1
2895 1 112 GLN QB 1 113 ALA H . . 3.830 2.325 2.118 2.759 . 0 0 "[ . 1 . 2]" 1
2896 1 112 GLN QB 1 113 ALA HA . . 4.880 3.807 3.702 3.983 . 0 0 "[ . 1 . 2]" 1
2897 1 112 GLN QB 1 113 ALA MB . . 4.790 3.587 3.440 3.741 . 0 0 "[ . 1 . 2]" 1
2898 1 112 GLN QE 1 112 GLN HG2 . . 3.440 2.443 2.099 3.349 . 0 0 "[ . 1 . 2]" 1
2899 1 113 ALA MB 1 114 LYS QB . . 4.650 4.042 3.520 4.444 . 0 0 "[ . 1 . 2]" 1
2900 1 114 LYS H 1 114 LYS QB . . 3.220 2.370 2.129 2.762 . 0 0 "[ . 1 . 2]" 1
2901 1 114 LYS H 1 114 LYS QG . . 4.500 3.491 1.911 4.312 . 0 0 "[ . 1 . 2]" 1
2902 1 114 LYS HA 1 114 LYS QG . . 3.640 2.432 2.149 3.337 . 0 0 "[ . 1 . 2]" 1
2903 1 114 LYS HA 1 114 LYS QE . . 4.730 4.138 3.257 4.735 0.005 12 0 "[ . 1 . 2]" 1
2904 1 114 LYS HA 1 115 ASP QB . . 5.340 4.327 3.927 5.016 . 0 0 "[ . 1 . 2]" 1
2905 1 114 LYS QB 1 115 ASP H . . 4.110 3.698 3.084 4.012 . 0 0 "[ . 1 . 2]" 1
2906 1 114 LYS QE 1 114 LYS QG . . 3.330 2.204 2.073 2.493 . 0 0 "[ . 1 . 2]" 1
2907 1 115 ASP H 1 115 ASP QB . . 3.460 2.523 2.194 3.128 . 0 0 "[ . 1 . 2]" 1
2908 1 115 ASP QB 1 116 GLU H . . 4.050 3.594 2.759 4.049 . 0 0 "[ . 1 . 2]" 1
2909 1 116 GLU H 1 116 GLU QB . . 3.420 2.477 2.185 3.258 . 0 0 "[ . 1 . 2]" 1
2910 1 116 GLU H 1 116 GLU QG . . 4.330 3.160 1.874 4.149 . 0 0 "[ . 1 . 2]" 1
2911 1 116 GLU HA 1 116 GLU QG . . 3.700 2.662 2.196 3.466 . 0 0 "[ . 1 . 2]" 1
2912 1 116 GLU QB 1 116 GLU QG . . 2.290 2.048 1.971 2.086 . 0 0 "[ . 1 . 2]" 1
2913 1 116 GLU QB 1 117 LEU H . . 4.390 3.523 2.192 4.050 . 0 0 "[ . 1 . 2]" 1
2914 1 117 LEU H 1 117 LEU QD . . 4.550 2.710 1.811 4.086 . 0 0 "[ . 1 . 2]" 1
2915 1 117 LEU HA 1 117 LEU QD . . 3.920 2.683 2.016 3.363 . 0 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 3
_Distance_constraint_stats_list.Viol_count 41
_Distance_constraint_stats_list.Viol_total 83.907
_Distance_constraint_stats_list.Viol_max 0.133
_Distance_constraint_stats_list.Viol_rms 0.0520
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0699
_Distance_constraint_stats_list.Viol_average_violations_only 0.1023
_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 66 CYS 4.195 0.133 13 0 "[ . 1 . 2]"
1 73 CYS 4.195 0.133 13 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 66 CYS SG 1 73 CYS SG . . 2.000 1.989 1.970 2.005 0.005 10 0 "[ . 1 . 2]" 2
2 1 66 CYS SG 1 73 CYS CB . . 3.000 3.096 3.019 3.106 0.106 15 0 "[ . 1 . 2]" 2
3 1 66 CYS CB 1 73 CYS SG . . 3.000 3.113 3.098 3.133 0.133 13 0 "[ . 1 . 2]" 2
stop_
save_
save_distance_constraint_statistics_3
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 3
_Distance_constraint_stats_list.Constraint_count 5
_Distance_constraint_stats_list.Viol_count 13
_Distance_constraint_stats_list.Viol_total 1.577
_Distance_constraint_stats_list.Viol_max 0.014
_Distance_constraint_stats_list.Viol_rms 0.0024
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0008
_Distance_constraint_stats_list.Viol_average_violations_only 0.0061
_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 15 ASN 0.048 0.011 19 0 "[ . 1 . 2]"
1 16 ASN 0.048 0.011 19 0 "[ . 1 . 2]"
1 23 GLU 0.023 0.014 4 0 "[ . 1 . 2]"
1 24 GLY 0.023 0.014 4 0 "[ . 1 . 2]"
1 35 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 GLY 0.003 0.003 14 0 "[ . 1 . 2]"
1 56 LEU 0.003 0.003 14 0 "[ . 1 . 2]"
1 96 HIS 0.004 0.004 12 0 "[ . 1 . 2]"
1 97 SER 0.004 0.004 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 35 CYS HA 1 36 GLY H . . 2.500 2.301 2.146 2.487 . 0 0 "[ . 1 . 2]" 3
2 1 96 HIS HA 1 97 SER H . . 2.200 2.156 2.139 2.204 0.004 12 0 "[ . 1 . 2]" 3
3 1 55 GLY H 1 56 LEU H . . 3.000 2.842 2.575 3.003 0.003 14 0 "[ . 1 . 2]" 3
4 1 15 ASN H 1 16 ASN H . . 2.200 2.147 1.868 2.211 0.011 19 0 "[ . 1 . 2]" 3
5 1 23 GLU HA 1 24 GLY H . . 2.200 2.156 2.142 2.214 0.014 4 0 "[ . 1 . 2]" 3
stop_
save_
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