NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
641760 |
6fip   |
34235 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6fip
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 1662
_Distance_constraint_stats_list.Viol_count 1822
_Distance_constraint_stats_list.Viol_total 1042.858
_Distance_constraint_stats_list.Viol_max 0.331
_Distance_constraint_stats_list.Viol_rms 0.0093
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0016
_Distance_constraint_stats_list.Viol_average_violations_only 0.0286
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 3 MET 0.871 0.052 8 0 "[ . 1 . 2]"
1 4 GLY 1.234 0.127 12 0 "[ . 1 . 2]"
1 5 SER 0.851 0.070 4 0 "[ . 1 . 2]"
1 6 LEU 0.863 0.331 8 0 "[ . 1 . 2]"
1 7 ASN 0.372 0.051 2 0 "[ . 1 . 2]"
1 8 ASP 0.091 0.045 5 0 "[ . 1 . 2]"
1 9 SER 0.298 0.079 17 0 "[ . 1 . 2]"
1 10 ASP 0.021 0.006 2 0 "[ . 1 . 2]"
1 11 ILE 1.159 0.079 17 0 "[ . 1 . 2]"
1 12 LYS 0.203 0.032 19 0 "[ . 1 . 2]"
1 13 PRO 0.063 0.020 20 0 "[ . 1 . 2]"
1 14 LEU 0.614 0.076 8 0 "[ . 1 . 2]"
1 15 ARG 1.246 0.064 3 0 "[ . 1 . 2]"
1 16 MET 0.612 0.129 10 0 "[ . 1 . 2]"
1 17 ASP 2.204 0.179 3 0 "[ . 1 . 2]"
1 18 PRO 1.990 0.179 3 0 "[ . 1 . 2]"
1 19 PRO 0.217 0.055 8 0 "[ . 1 . 2]"
1 20 VAL 0.582 0.105 9 0 "[ . 1 . 2]"
1 21 TYR 1.759 0.077 10 0 "[ . 1 . 2]"
1 22 PRO 0.301 0.052 20 0 "[ . 1 . 2]"
1 23 ARG 0.916 0.112 6 0 "[ . 1 . 2]"
1 24 MET 0.045 0.028 4 0 "[ . 1 . 2]"
1 25 ALA 0.479 0.042 2 0 "[ . 1 . 2]"
1 26 GLN 2.842 0.077 10 0 "[ . 1 . 2]"
1 27 ALA 1.252 0.075 9 0 "[ . 1 . 2]"
1 28 ARG 0.734 0.098 18 0 "[ . 1 . 2]"
1 29 GLY 0.595 0.055 18 0 "[ . 1 . 2]"
1 30 ILE 1.555 0.099 6 0 "[ . 1 . 2]"
1 31 GLU 2.119 0.149 16 0 "[ . 1 . 2]"
1 32 GLY 1.234 0.092 6 0 "[ . 1 . 2]"
1 33 ARG 0.650 0.122 10 0 "[ . 1 . 2]"
1 34 VAL 1.506 0.058 17 0 "[ . 1 . 2]"
1 35 LYS 1.702 0.148 12 0 "[ . 1 . 2]"
1 36 VAL 2.028 0.250 18 0 "[ . 1 . 2]"
1 37 LEU 1.966 0.101 11 0 "[ . 1 . 2]"
1 38 PHE 0.442 0.148 8 0 "[ . 1 . 2]"
1 39 THR 1.040 0.052 17 0 "[ . 1 . 2]"
1 40 ILE 1.096 0.218 8 0 "[ . 1 . 2]"
1 41 THR 2.401 0.136 6 0 "[ . 1 . 2]"
1 42 SER 1.735 0.107 19 0 "[ . 1 . 2]"
1 43 ASP 0.704 0.136 6 0 "[ . 1 . 2]"
1 44 GLY 0.219 0.046 1 0 "[ . 1 . 2]"
1 45 ARG 0.672 0.075 7 0 "[ . 1 . 2]"
1 46 ILE 0.732 0.047 13 0 "[ . 1 . 2]"
1 47 ASP 0.279 0.036 3 0 "[ . 1 . 2]"
1 48 ASP 0.626 0.052 17 0 "[ . 1 . 2]"
1 49 ILE 0.894 0.080 20 0 "[ . 1 . 2]"
1 50 GLN 0.955 0.144 19 0 "[ . 1 . 2]"
1 51 VAL 0.938 0.144 19 0 "[ . 1 . 2]"
1 52 LEU 0.592 0.237 4 0 "[ . 1 . 2]"
1 53 GLU 0.392 0.043 17 0 "[ . 1 . 2]"
1 54 SER 0.996 0.057 8 0 "[ . 1 . 2]"
1 55 VAL 1.949 0.058 17 0 "[ . 1 . 2]"
1 56 PRO 0.123 0.027 18 0 "[ . 1 . 2]"
1 57 SER 0.380 0.107 10 0 "[ . 1 . 2]"
1 58 ARG 0.380 0.107 10 0 "[ . 1 . 2]"
1 59 MET 0.596 0.037 9 0 "[ . 1 . 2]"
1 60 PHE 1.114 0.086 3 0 "[ . 1 . 2]"
1 61 ASP 1.027 0.093 16 0 "[ . 1 . 2]"
1 62 ARG 0.331 0.093 16 0 "[ . 1 . 2]"
1 63 GLU 0.983 0.122 17 0 "[ . 1 . 2]"
1 64 VAL 0.492 0.122 17 0 "[ . 1 . 2]"
1 65 ARG 0.669 0.068 18 0 "[ . 1 . 2]"
1 66 GLN 2.797 0.151 18 0 "[ . 1 . 2]"
1 67 ALA 1.414 0.151 18 0 "[ . 1 . 2]"
1 68 MET 1.172 0.127 8 0 "[ . 1 . 2]"
1 69 ALA 0.004 0.004 7 0 "[ . 1 . 2]"
1 70 LYS 0.242 0.053 9 0 "[ . 1 . 2]"
1 71 TRP 1.520 0.062 19 0 "[ . 1 . 2]"
1 72 ARG 0.894 0.062 5 0 "[ . 1 . 2]"
1 73 PHE 0.164 0.029 11 0 "[ . 1 . 2]"
1 74 GLU 0.120 0.030 8 0 "[ . 1 . 2]"
1 75 PRO 0.402 0.042 7 0 "[ . 1 . 2]"
1 76 ARG 0.836 0.171 13 0 "[ . 1 . 2]"
1 77 VAL 1.023 0.056 19 0 "[ . 1 . 2]"
1 78 SER 0.267 0.056 19 0 "[ . 1 . 2]"
1 79 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 GLY 0.263 0.049 7 0 "[ . 1 . 2]"
1 81 LYS 0.700 0.088 13 0 "[ . 1 . 2]"
1 82 ILE 0.505 0.088 13 0 "[ . 1 . 2]"
1 83 VAL 0.192 0.041 16 0 "[ . 1 . 2]"
1 84 ALA 0.439 0.064 5 0 "[ . 1 . 2]"
1 85 ARG 1.199 0.123 15 0 "[ . 1 . 2]"
1 86 GLN 2.136 0.127 12 0 "[ . 1 . 2]"
1 87 ALA 1.381 0.101 11 0 "[ . 1 . 2]"
1 88 THR 2.038 0.158 2 0 "[ . 1 . 2]"
1 89 LYS 2.004 0.250 18 0 "[ . 1 . 2]"
1 90 MET 2.007 0.148 3 0 "[ . 1 . 2]"
1 91 PHE 1.187 0.082 15 0 "[ . 1 . 2]"
1 92 PHE 1.351 0.076 18 0 "[ . 1 . 2]"
1 93 PHE 2.163 0.082 15 0 "[ . 1 . 2]"
1 94 LYS 1.288 0.149 16 0 "[ . 1 . 2]"
1 95 ILE 2.656 0.151 6 0 "[ . 1 . 2]"
1 96 GLU 1.032 0.151 6 0 "[ . 1 . 2]"
1 97 LYS 1.578 0.149 13 0 "[ . 1 . 2]"
1 98 ARG 1.426 0.149 13 0 "[ . 1 . 2]"
1 99 ARG 0.528 0.073 8 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 HIS HA 1 3 MET H . . 3.300 2.536 2.137 3.258 . 0 0 "[ . 1 . 2]" 1
2 1 2 HIS QB 1 3 MET H . . 4.040 3.315 2.373 3.957 . 0 0 "[ . 1 . 2]" 1
3 1 3 MET H 1 3 MET HB2 . . 3.990 3.342 2.288 4.041 0.051 8 0 "[ . 1 . 2]" 1
4 1 3 MET H 1 3 MET QB . . 3.480 2.610 2.156 3.298 . 0 0 "[ . 1 . 2]" 1
5 1 3 MET H 1 3 MET HB3 . . 3.990 2.813 2.276 3.600 . 0 0 "[ . 1 . 2]" 1
6 1 3 MET H 1 3 MET QG . . 4.510 3.036 2.056 4.145 . 0 0 "[ . 1 . 2]" 1
7 1 3 MET HA 1 3 MET ME . . 4.220 4.089 3.348 4.265 0.045 7 0 "[ . 1 . 2]" 1
8 1 3 MET HA 1 3 MET QG . . 3.860 3.020 2.224 3.388 . 0 0 "[ . 1 . 2]" 1
9 1 3 MET HA 1 4 GLY H . . 2.850 2.303 2.055 2.577 . 0 0 "[ . 1 . 2]" 1
10 1 3 MET HA 1 86 GLN H . . 3.900 3.583 2.965 3.943 0.043 9 0 "[ . 1 . 2]" 1
11 1 3 MET HA 1 86 GLN QB . . 3.900 3.132 2.088 3.710 . 0 0 "[ . 1 . 2]" 1
12 1 3 MET QB 1 4 GLY H . . 3.740 2.951 2.239 3.779 0.039 5 0 "[ . 1 . 2]" 1
13 1 3 MET HB2 1 3 MET QG . . 2.620 2.372 2.278 2.501 . 0 0 "[ . 1 . 2]" 1
14 1 3 MET HB2 1 4 GLY H . . 4.300 3.206 2.257 4.300 . 14 0 "[ . 1 . 2]" 1
15 1 3 MET HB3 1 3 MET QG . . 2.620 2.349 2.169 2.478 . 0 0 "[ . 1 . 2]" 1
16 1 3 MET HB3 1 4 GLY H . . 4.300 3.920 2.945 4.301 0.001 13 0 "[ . 1 . 2]" 1
17 1 3 MET ME 1 3 MET QG . . 2.990 2.342 2.142 2.546 . 0 0 "[ . 1 . 2]" 1
18 1 3 MET ME 1 4 GLY H . . 4.490 3.904 3.592 4.290 . 0 0 "[ . 1 . 2]" 1
19 1 3 MET ME 1 37 LEU QD . . 4.580 2.786 2.037 3.976 . 0 0 "[ . 1 . 2]" 1
20 1 3 MET ME 1 87 ALA HA . . 3.740 2.319 2.116 2.549 . 0 0 "[ . 1 . 2]" 1
21 1 3 MET ME 1 87 ALA MB . . 3.710 3.683 3.445 3.754 0.044 9 0 "[ . 1 . 2]" 1
22 1 3 MET ME 1 88 THR H . . 4.580 3.196 2.569 3.747 . 0 0 "[ . 1 . 2]" 1
23 1 3 MET ME 1 88 THR HB . . 5.320 4.559 4.308 4.834 . 0 0 "[ . 1 . 2]" 1
24 1 3 MET ME 1 88 THR MG . . 2.980 2.108 1.986 2.263 . 0 0 "[ . 1 . 2]" 1
25 1 3 MET QG 1 4 GLY H . . 4.080 3.072 2.195 3.830 . 0 0 "[ . 1 . 2]" 1
26 1 3 MET QG 1 87 ALA HA . . 4.640 3.564 2.167 4.420 . 0 0 "[ . 1 . 2]" 1
27 1 3 MET QG 1 88 THR H . . 5.380 4.924 3.678 5.432 0.052 8 0 "[ . 1 . 2]" 1
28 1 4 GLY H 1 5 SER H . . 4.690 4.332 3.957 4.570 . 0 0 "[ . 1 . 2]" 1
29 1 4 GLY H 1 85 ARG HA . . 4.780 4.674 4.385 4.856 0.076 5 0 "[ . 1 . 2]" 1
30 1 4 GLY H 1 85 ARG QG . . 4.540 3.171 2.062 4.555 0.015 14 0 "[ . 1 . 2]" 1
31 1 4 GLY H 1 86 GLN H . . 3.870 3.395 2.934 3.797 . 0 0 "[ . 1 . 2]" 1
32 1 4 GLY H 1 86 GLN HA . . 5.130 4.774 4.611 4.935 . 0 0 "[ . 1 . 2]" 1
33 1 4 GLY H 1 86 GLN QB . . 4.840 3.521 3.209 3.917 . 0 0 "[ . 1 . 2]" 1
34 1 4 GLY H 1 86 GLN QG . . 4.970 4.977 4.700 5.097 0.127 12 0 "[ . 1 . 2]" 1
35 1 4 GLY H 1 87 ALA HA . . 4.130 3.873 3.546 4.058 . 0 0 "[ . 1 . 2]" 1
36 1 4 GLY H 1 87 ALA MB . . 4.410 3.787 3.281 4.106 . 0 0 "[ . 1 . 2]" 1
37 1 4 GLY QA 1 40 ILE MD . . 5.290 3.517 3.092 4.186 . 0 0 "[ . 1 . 2]" 1
38 1 4 GLY QA 1 85 ARG QB . . 4.670 2.483 2.042 3.249 . 0 0 "[ . 1 . 2]" 1
39 1 4 GLY QA 1 85 ARG QG . . 4.750 2.660 2.131 3.777 . 0 0 "[ . 1 . 2]" 1
40 1 4 GLY QA 1 87 ALA MB . . 4.380 3.518 3.064 4.067 . 0 0 "[ . 1 . 2]" 1
41 1 4 GLY HA2 1 5 SER H . . 3.260 2.721 2.498 3.095 . 0 0 "[ . 1 . 2]" 1
42 1 4 GLY HA3 1 5 SER H . . 3.260 2.361 2.178 2.583 . 0 0 "[ . 1 . 2]" 1
43 1 5 SER H 1 5 SER HB2 . . 4.170 3.403 2.771 4.078 . 0 0 "[ . 1 . 2]" 1
44 1 5 SER H 1 5 SER QB . . 3.400 2.920 2.712 3.271 . 0 0 "[ . 1 . 2]" 1
45 1 5 SER H 1 5 SER HB3 . . 4.170 3.403 2.911 3.982 . 0 0 "[ . 1 . 2]" 1
46 1 5 SER H 1 8 ASP H . . 5.210 4.248 3.871 4.982 . 0 0 "[ . 1 . 2]" 1
47 1 5 SER H 1 11 ILE MD . . 5.500 4.519 4.038 5.234 . 0 0 "[ . 1 . 2]" 1
48 1 5 SER H 1 40 ILE MD . . 5.220 3.271 2.910 3.507 . 0 0 "[ . 1 . 2]" 1
49 1 5 SER H 1 40 ILE MG . . 5.500 5.516 5.405 5.559 0.059 20 0 "[ . 1 . 2]" 1
50 1 5 SER H 1 85 ARG QB . . 4.880 4.186 3.590 4.950 0.070 4 0 "[ . 1 . 2]" 1
51 1 5 SER H 1 85 ARG QG . . 5.060 4.526 2.965 5.130 0.070 14 0 "[ . 1 . 2]" 1
52 1 5 SER H 1 87 ALA MB . . 4.370 3.549 3.265 3.858 . 0 0 "[ . 1 . 2]" 1
53 1 5 SER HA 1 6 LEU H . . 3.260 2.292 2.211 2.399 . 0 0 "[ . 1 . 2]" 1
54 1 5 SER HA 1 6 LEU HA . . 4.630 4.491 4.387 4.541 . 0 0 "[ . 1 . 2]" 1
55 1 5 SER HA 1 40 ILE MD . . 4.550 3.499 3.090 3.982 . 0 0 "[ . 1 . 2]" 1
56 1 5 SER HA 1 87 ALA MB . . 3.330 2.427 2.105 3.003 . 0 0 "[ . 1 . 2]" 1
57 1 5 SER HA 1 88 THR H . . 4.620 3.924 3.659 4.266 . 0 0 "[ . 1 . 2]" 1
58 1 5 SER QB 1 6 LEU H . . 3.590 3.068 2.523 3.622 0.032 7 0 "[ . 1 . 2]" 1
59 1 5 SER QB 1 7 ASN QB . . 4.400 3.193 2.719 3.816 . 0 0 "[ . 1 . 2]" 1
60 1 5 SER QB 1 8 ASP H . . 4.020 3.244 2.705 4.019 . 0 0 "[ . 1 . 2]" 1
61 1 5 SER QB 1 87 ALA MB . . 4.500 4.042 3.615 4.526 0.026 13 0 "[ . 1 . 2]" 1
62 1 5 SER HB2 1 7 ASN H . . 3.970 3.554 2.171 4.010 0.040 5 0 "[ . 1 . 2]" 1
63 1 5 SER HB3 1 7 ASN H . . 3.970 2.988 2.108 3.962 . 0 0 "[ . 1 . 2]" 1
64 1 6 LEU H 1 6 LEU HB2 . . 3.900 2.484 2.344 3.740 . 0 0 "[ . 1 . 2]" 1
65 1 6 LEU H 1 6 LEU QB . . 3.380 2.399 2.314 2.696 . 0 0 "[ . 1 . 2]" 1
66 1 6 LEU H 1 6 LEU HB3 . . 3.900 3.558 2.764 3.630 . 0 0 "[ . 1 . 2]" 1
67 1 6 LEU H 1 6 LEU MD1 . . 4.210 3.580 3.300 4.100 . 0 0 "[ . 1 . 2]" 1
68 1 6 LEU H 1 6 LEU MD2 . . 4.210 3.512 1.932 3.875 . 0 0 "[ . 1 . 2]" 1
69 1 6 LEU H 1 6 LEU HG . . 3.380 2.460 2.308 3.405 0.025 8 0 "[ . 1 . 2]" 1
70 1 6 LEU H 1 7 ASN H . . 3.520 2.554 2.270 2.743 . 0 0 "[ . 1 . 2]" 1
71 1 6 LEU H 1 8 ASP H . . 4.610 4.302 4.115 4.655 0.045 5 0 "[ . 1 . 2]" 1
72 1 6 LEU H 1 40 ILE MD . . 5.130 3.485 3.093 4.147 . 0 0 "[ . 1 . 2]" 1
73 1 6 LEU H 1 87 ALA MB . . 4.000 3.152 2.483 3.706 . 0 0 "[ . 1 . 2]" 1
74 1 6 LEU HA 1 6 LEU MD1 . . 4.370 3.913 3.872 4.079 . 0 0 "[ . 1 . 2]" 1
75 1 6 LEU HA 1 6 LEU QD . . 3.100 2.245 2.135 3.431 0.331 8 0 "[ . 1 . 2]" 1
76 1 6 LEU HA 1 6 LEU MD2 . . 4.370 2.269 2.145 3.691 . 0 0 "[ . 1 . 2]" 1
77 1 6 LEU HA 1 6 LEU HG . . 3.910 3.117 2.908 3.660 . 0 0 "[ . 1 . 2]" 1
78 1 6 LEU HA 1 8 ASP H . . 4.030 3.613 3.259 3.833 . 0 0 "[ . 1 . 2]" 1
79 1 6 LEU HA 1 11 ILE MD . . 3.620 2.697 2.206 3.365 . 0 0 "[ . 1 . 2]" 1
80 1 6 LEU HA 1 40 ILE MD . . 3.770 2.998 2.409 3.623 . 0 0 "[ . 1 . 2]" 1
81 1 6 LEU HA 1 87 ALA MB . . 5.500 4.544 3.993 4.939 . 0 0 "[ . 1 . 2]" 1
82 1 6 LEU QB 1 6 LEU QD . . 2.730 1.945 1.920 1.971 . 0 0 "[ . 1 . 2]" 1
83 1 6 LEU QB 1 7 ASN H . . 3.780 3.000 2.390 3.820 0.040 8 0 "[ . 1 . 2]" 1
84 1 6 LEU QB 1 8 ASP H . . 4.730 4.606 4.373 4.742 0.012 20 0 "[ . 1 . 2]" 1
85 1 6 LEU HB2 1 6 LEU MD1 . . 3.610 2.294 2.234 2.335 . 0 0 "[ . 1 . 2]" 1
86 1 6 LEU HB2 1 6 LEU MD2 . . 3.610 3.244 3.220 3.257 . 0 0 "[ . 1 . 2]" 1
87 1 6 LEU HB2 1 7 ASN H . . 4.340 3.119 2.433 4.330 . 0 0 "[ . 1 . 2]" 1
88 1 6 LEU HB2 1 8 ASP H . . 5.500 5.113 4.869 5.283 . 0 0 "[ . 1 . 2]" 1
89 1 6 LEU HB3 1 6 LEU MD1 . . 3.610 2.411 2.344 2.537 . 0 0 "[ . 1 . 2]" 1
90 1 6 LEU HB3 1 6 LEU MD2 . . 3.610 2.373 2.303 2.422 . 0 0 "[ . 1 . 2]" 1
91 1 6 LEU HB3 1 7 ASN H . . 4.340 3.972 3.497 4.249 . 0 0 "[ . 1 . 2]" 1
92 1 6 LEU HB3 1 8 ASP H . . 5.500 5.236 4.949 5.462 . 0 0 "[ . 1 . 2]" 1
93 1 6 LEU QD 1 38 PHE QE . . 2.880 2.321 1.907 2.545 . 0 0 "[ . 1 . 2]" 1
94 1 6 LEU QD 1 40 ILE MD . . 3.180 2.443 2.168 3.398 0.218 8 0 "[ . 1 . 2]" 1
95 1 6 LEU QD 1 40 ILE QG . . 3.760 2.649 2.175 3.524 . 0 0 "[ . 1 . 2]" 1
96 1 6 LEU QD 1 89 LYS QB . . 5.030 3.010 2.427 4.282 . 0 0 "[ . 1 . 2]" 1
97 1 6 LEU QD 1 89 LYS QE . . 4.520 3.107 1.948 4.069 . 0 0 "[ . 1 . 2]" 1
98 1 6 LEU MD1 1 38 PHE QE . . 3.380 2.934 2.122 3.297 . 0 0 "[ . 1 . 2]" 1
99 1 6 LEU MD2 1 38 PHE QE . . 3.380 2.448 2.160 2.701 . 0 0 "[ . 1 . 2]" 1
100 1 6 LEU HG 1 38 PHE QE . . 3.930 2.729 2.340 4.078 0.148 8 0 "[ . 1 . 2]" 1
101 1 6 LEU HG 1 40 ILE MD . . 4.910 3.112 2.643 4.771 . 0 0 "[ . 1 . 2]" 1
102 1 7 ASN H 1 7 ASN HB2 . . 3.690 2.440 2.280 2.555 . 0 0 "[ . 1 . 2]" 1
103 1 7 ASN H 1 7 ASN QB . . 3.050 2.404 2.254 2.510 . 0 0 "[ . 1 . 2]" 1
104 1 7 ASN H 1 7 ASN HB3 . . 3.690 3.619 3.542 3.673 . 0 0 "[ . 1 . 2]" 1
105 1 7 ASN H 1 7 ASN HD21 . . 5.290 4.442 3.912 4.865 . 0 0 "[ . 1 . 2]" 1
106 1 7 ASN H 1 7 ASN HD22 . . 5.290 4.668 4.179 5.125 . 0 0 "[ . 1 . 2]" 1
107 1 7 ASN H 1 8 ASP H . . 3.130 2.751 2.349 3.133 0.003 6 0 "[ . 1 . 2]" 1
108 1 7 ASN H 1 8 ASP HA . . 5.330 5.000 4.665 5.229 . 0 0 "[ . 1 . 2]" 1
109 1 7 ASN HA 1 7 ASN HD21 . . 3.800 2.610 2.190 3.334 . 0 0 "[ . 1 . 2]" 1
110 1 7 ASN HA 1 7 ASN QD . . 3.310 2.555 2.172 3.145 . 0 0 "[ . 1 . 2]" 1
111 1 7 ASN HA 1 7 ASN HD22 . . 3.800 3.753 3.577 3.851 0.051 2 0 "[ . 1 . 2]" 1
112 1 7 ASN HA 1 8 ASP H . . 3.560 3.247 2.917 3.450 . 0 0 "[ . 1 . 2]" 1
113 1 8 ASP H 1 8 ASP HB2 . . 3.810 2.486 2.331 2.848 . 0 0 "[ . 1 . 2]" 1
114 1 8 ASP H 1 8 ASP QB . . 3.180 2.298 2.156 2.399 . 0 0 "[ . 1 . 2]" 1
115 1 8 ASP H 1 8 ASP HB3 . . 3.810 3.158 2.245 3.624 . 0 0 "[ . 1 . 2]" 1
116 1 8 ASP H 1 9 SER H . . 4.840 4.648 4.583 4.712 . 0 0 "[ . 1 . 2]" 1
117 1 8 ASP H 1 11 ILE MD . . 4.420 3.329 2.677 3.883 . 0 0 "[ . 1 . 2]" 1
118 1 8 ASP H 1 11 ILE QG . . 4.790 3.770 3.204 4.281 . 0 0 "[ . 1 . 2]" 1
119 1 8 ASP HA 1 9 SER H . . 2.790 2.165 2.115 2.229 . 0 0 "[ . 1 . 2]" 1
120 1 8 ASP HA 1 10 ASP H . . 4.730 3.944 3.717 4.393 . 0 0 "[ . 1 . 2]" 1
121 1 8 ASP QB 1 11 ILE H . . 4.370 3.898 3.453 4.379 0.009 15 0 "[ . 1 . 2]" 1
122 1 8 ASP QB 1 11 ILE QG . . 4.450 2.601 2.310 3.038 . 0 0 "[ . 1 . 2]" 1
123 1 8 ASP HB2 1 9 SER H . . 4.500 4.188 4.072 4.360 . 0 0 "[ . 1 . 2]" 1
124 1 8 ASP HB2 1 10 ASP H . . 4.670 4.171 3.310 4.673 0.003 15 0 "[ . 1 . 2]" 1
125 1 8 ASP HB2 1 11 ILE MD . . 4.700 3.247 2.370 4.409 . 0 0 "[ . 1 . 2]" 1
126 1 8 ASP HB3 1 9 SER H . . 4.500 3.470 2.857 4.450 . 0 0 "[ . 1 . 2]" 1
127 1 8 ASP HB3 1 10 ASP H . . 4.670 3.126 2.110 4.134 . 0 0 "[ . 1 . 2]" 1
128 1 8 ASP HB3 1 11 ILE MD . . 4.700 3.576 2.512 4.708 0.008 7 0 "[ . 1 . 2]" 1
129 1 9 SER H 1 9 SER HB2 . . 4.210 2.623 2.298 3.631 . 0 0 "[ . 1 . 2]" 1
130 1 9 SER H 1 9 SER QB . . 3.520 2.410 2.226 2.565 . 0 0 "[ . 1 . 2]" 1
131 1 9 SER H 1 9 SER HB3 . . 4.210 3.382 2.442 3.652 . 0 0 "[ . 1 . 2]" 1
132 1 9 SER H 1 10 ASP H . . 3.520 2.762 2.399 3.124 . 0 0 "[ . 1 . 2]" 1
133 1 9 SER H 1 11 ILE H . . 4.800 4.604 4.339 4.808 0.008 17 0 "[ . 1 . 2]" 1
134 1 9 SER HA 1 11 ILE H . . 4.250 3.593 3.375 3.919 . 0 0 "[ . 1 . 2]" 1
135 1 9 SER QB 1 10 ASP H . . 4.090 3.274 2.867 3.797 . 0 0 "[ . 1 . 2]" 1
136 1 9 SER HB2 1 10 ASP H . . 4.750 3.502 2.956 4.294 . 0 0 "[ . 1 . 2]" 1
137 1 9 SER HB2 1 11 ILE H . . 5.500 5.293 5.041 5.579 0.079 17 0 "[ . 1 . 2]" 1
138 1 9 SER HB3 1 10 ASP H . . 4.750 4.081 3.425 4.456 . 0 0 "[ . 1 . 2]" 1
139 1 9 SER HB3 1 11 ILE H . . 5.500 5.288 5.074 5.543 0.043 11 0 "[ . 1 . 2]" 1
140 1 10 ASP H 1 10 ASP HB2 . . 4.030 2.571 2.248 3.679 . 0 0 "[ . 1 . 2]" 1
141 1 10 ASP H 1 10 ASP QB . . 3.190 2.394 2.141 2.914 . 0 0 "[ . 1 . 2]" 1
142 1 10 ASP H 1 10 ASP HB3 . . 4.030 3.374 2.291 3.662 . 0 0 "[ . 1 . 2]" 1
143 1 10 ASP H 1 11 ILE H . . 3.070 2.753 2.003 3.010 . 0 0 "[ . 1 . 2]" 1
144 1 10 ASP H 1 11 ILE MD . . 5.500 5.035 4.305 5.295 . 0 0 "[ . 1 . 2]" 1
145 1 10 ASP H 1 11 ILE HG12 . . 5.230 3.709 2.791 3.996 . 0 0 "[ . 1 . 2]" 1
146 1 10 ASP H 1 11 ILE QG . . 4.450 3.600 2.734 3.852 . 0 0 "[ . 1 . 2]" 1
147 1 10 ASP H 1 11 ILE HG13 . . 5.230 4.890 3.910 5.236 0.006 2 0 "[ . 1 . 2]" 1
148 1 10 ASP H 1 11 ILE MG . . 5.000 4.360 3.829 4.719 . 0 0 "[ . 1 . 2]" 1
149 1 10 ASP HA 1 76 ARG H . . 4.550 3.971 3.586 4.336 . 0 0 "[ . 1 . 2]" 1
150 1 10 ASP HA 1 76 ARG QB . . 3.550 2.830 2.260 3.553 0.003 3 0 "[ . 1 . 2]" 1
151 1 10 ASP QB 1 11 ILE H . . 4.200 3.452 3.045 4.044 . 0 0 "[ . 1 . 2]" 1
152 1 10 ASP QB 1 11 ILE QG . . 4.690 3.658 2.712 4.692 0.002 12 0 "[ . 1 . 2]" 1
153 1 10 ASP QB 1 11 ILE MG . . 4.580 3.014 2.366 3.851 . 0 0 "[ . 1 . 2]" 1
154 1 11 ILE H 1 11 ILE MD . . 3.920 3.952 3.926 3.970 0.050 6 0 "[ . 1 . 2]" 1
155 1 11 ILE H 1 11 ILE HG12 . . 3.270 2.357 2.285 2.448 . 0 0 "[ . 1 . 2]" 1
156 1 11 ILE H 1 11 ILE QG . . 2.830 2.240 2.206 2.269 . 0 0 "[ . 1 . 2]" 1
157 1 11 ILE H 1 11 ILE HG13 . . 3.270 2.835 2.595 3.082 . 0 0 "[ . 1 . 2]" 1
158 1 11 ILE H 1 11 ILE MG . . 3.630 3.182 3.003 3.325 . 0 0 "[ . 1 . 2]" 1
159 1 11 ILE H 1 12 LYS H . . 4.900 4.468 4.392 4.541 . 0 0 "[ . 1 . 2]" 1
160 1 11 ILE H 1 73 PHE QD . . 5.500 5.393 5.097 5.514 0.014 8 0 "[ . 1 . 2]" 1
161 1 11 ILE HA 1 11 ILE MD . . 4.500 4.236 4.219 4.249 . 0 0 "[ . 1 . 2]" 1
162 1 11 ILE HA 1 11 ILE MG . . 3.230 2.249 2.166 2.305 . 0 0 "[ . 1 . 2]" 1
163 1 11 ILE HA 1 12 LYS H . . 2.980 2.307 2.153 2.432 . 0 0 "[ . 1 . 2]" 1
164 1 11 ILE HA 1 75 PRO HA . . 3.540 2.532 2.291 2.829 . 0 0 "[ . 1 . 2]" 1
165 1 11 ILE HA 1 76 ARG H . . 3.390 2.622 2.357 2.931 . 0 0 "[ . 1 . 2]" 1
166 1 11 ILE HB 1 11 ILE MD . . 3.300 2.418 2.374 2.473 . 0 0 "[ . 1 . 2]" 1
167 1 11 ILE HB 1 12 LYS H . . 3.510 2.531 2.348 3.035 . 0 0 "[ . 1 . 2]" 1
168 1 11 ILE HB 1 73 PHE QB . . 4.980 2.853 2.467 3.230 . 0 0 "[ . 1 . 2]" 1
169 1 11 ILE HB 1 74 GLU H . . 4.070 3.783 3.482 4.058 . 0 0 "[ . 1 . 2]" 1
170 1 11 ILE HB 1 76 ARG H . . 5.500 5.051 4.734 5.342 . 0 0 "[ . 1 . 2]" 1
171 1 11 ILE HB 1 82 ILE MD . . 4.120 3.917 3.554 4.138 0.018 11 0 "[ . 1 . 2]" 1
172 1 11 ILE MD 1 11 ILE MG . . 3.010 2.137 2.118 2.169 . 0 0 "[ . 1 . 2]" 1
173 1 11 ILE MD 1 12 LYS H . . 4.990 4.449 4.239 4.943 . 0 0 "[ . 1 . 2]" 1
174 1 11 ILE MD 1 40 ILE MD . . 3.240 2.896 2.336 3.241 0.001 5 0 "[ . 1 . 2]" 1
175 1 11 ILE MD 1 73 PHE QB . . 4.920 3.111 2.827 3.412 . 0 0 "[ . 1 . 2]" 1
176 1 11 ILE MD 1 73 PHE QD . . 4.020 2.598 2.407 2.729 . 0 0 "[ . 1 . 2]" 1
177 1 11 ILE MD 1 74 GLU H . . 5.110 5.038 4.748 5.129 0.019 7 0 "[ . 1 . 2]" 1
178 1 11 ILE QG 1 12 LYS H . . 4.560 3.860 3.585 4.294 . 0 0 "[ . 1 . 2]" 1
179 1 11 ILE QG 1 82 ILE MG . . 5.340 4.887 4.537 5.362 0.022 6 0 "[ . 1 . 2]" 1
180 1 11 ILE HG12 1 12 LYS H . . 5.390 4.923 4.723 5.243 . 0 0 "[ . 1 . 2]" 1
181 1 11 ILE HG13 1 12 LYS H . . 5.390 4.037 3.714 4.559 . 0 0 "[ . 1 . 2]" 1
182 1 11 ILE MG 1 12 LYS H . . 3.920 3.531 3.360 3.668 . 0 0 "[ . 1 . 2]" 1
183 1 11 ILE MG 1 74 GLU H . . 5.470 4.469 4.156 4.852 . 0 0 "[ . 1 . 2]" 1
184 1 11 ILE MG 1 75 PRO HA . . 3.810 2.407 2.182 2.683 . 0 0 "[ . 1 . 2]" 1
185 1 11 ILE MG 1 76 ARG H . . 4.250 3.589 3.339 3.860 . 0 0 "[ . 1 . 2]" 1
186 1 11 ILE MG 1 82 ILE HA . . 4.040 3.589 3.240 4.044 0.004 16 0 "[ . 1 . 2]" 1
187 1 11 ILE MG 1 82 ILE QG . . 3.810 2.263 2.075 2.566 . 0 0 "[ . 1 . 2]" 1
188 1 11 ILE MG 1 82 ILE MG . . 3.090 2.585 2.196 2.965 . 0 0 "[ . 1 . 2]" 1
189 1 11 ILE MG 1 83 VAL H . . 5.020 4.362 3.833 4.916 . 0 0 "[ . 1 . 2]" 1
190 1 12 LYS H 1 12 LYS QB . . 3.660 2.761 2.427 3.250 . 0 0 "[ . 1 . 2]" 1
191 1 12 LYS H 1 12 LYS QG . . 3.770 2.901 2.334 3.477 . 0 0 "[ . 1 . 2]" 1
192 1 12 LYS H 1 13 PRO HD2 . . 5.300 5.027 4.945 5.320 0.020 20 0 "[ . 1 . 2]" 1
193 1 12 LYS H 1 13 PRO QD . . 4.510 4.367 4.262 4.442 . 0 0 "[ . 1 . 2]" 1
194 1 12 LYS H 1 13 PRO HD3 . . 5.300 4.803 4.635 4.942 . 0 0 "[ . 1 . 2]" 1
195 1 12 LYS H 1 75 PRO HA . . 4.180 3.846 3.671 4.008 . 0 0 "[ . 1 . 2]" 1
196 1 12 LYS H 1 76 ARG H . . 4.510 4.300 4.042 4.527 0.017 2 0 "[ . 1 . 2]" 1
197 1 12 LYS H 1 76 ARG HA . . 4.500 4.317 3.812 4.532 0.032 19 0 "[ . 1 . 2]" 1
198 1 12 LYS HA 1 12 LYS QG . . 4.020 2.676 2.364 3.399 . 0 0 "[ . 1 . 2]" 1
199 1 12 LYS HA 1 13 PRO HD2 . . 3.120 2.449 2.161 2.971 . 0 0 "[ . 1 . 2]" 1
200 1 12 LYS HA 1 13 PRO HD3 . . 3.120 2.362 2.015 2.602 . 0 0 "[ . 1 . 2]" 1
201 1 12 LYS HA 1 13 PRO HG2 . . 4.810 4.567 4.385 4.705 . 0 0 "[ . 1 . 2]" 1
202 1 12 LYS HA 1 13 PRO QG . . 4.190 4.048 3.847 4.138 . 0 0 "[ . 1 . 2]" 1
203 1 12 LYS HA 1 13 PRO HG3 . . 4.810 4.532 4.114 4.624 . 0 0 "[ . 1 . 2]" 1
204 1 12 LYS QB 1 13 PRO QD . . 4.190 2.589 2.241 3.181 . 0 0 "[ . 1 . 2]" 1
205 1 12 LYS QB 1 74 GLU H . . 5.340 3.883 2.915 5.061 . 0 0 "[ . 1 . 2]" 1
206 1 12 LYS HB2 1 12 LYS QE . . 5.020 3.395 2.075 4.289 . 0 0 "[ . 1 . 2]" 1
207 1 12 LYS HB3 1 12 LYS QE . . 5.020 3.536 2.135 4.249 . 0 0 "[ . 1 . 2]" 1
208 1 12 LYS QE 1 76 ARG HA . . 4.190 3.061 1.898 4.214 0.024 4 0 "[ . 1 . 2]" 1
209 1 12 LYS QG 1 13 PRO QD . . 4.610 3.621 3.233 4.093 . 0 0 "[ . 1 . 2]" 1
210 1 12 LYS QG 1 76 ARG HA . . 4.080 2.511 2.133 3.089 . 0 0 "[ . 1 . 2]" 1
211 1 13 PRO HA 1 14 LEU H . . 3.080 2.197 2.115 2.314 . 0 0 "[ . 1 . 2]" 1
212 1 13 PRO HA 1 15 ARG H . . 4.360 3.909 3.670 4.266 . 0 0 "[ . 1 . 2]" 1
213 1 13 PRO HA 1 73 PHE HA . . 3.840 2.627 2.269 3.120 . 0 0 "[ . 1 . 2]" 1
214 1 13 PRO HA 1 73 PHE QD . . 4.030 3.142 2.992 3.308 . 0 0 "[ . 1 . 2]" 1
215 1 13 PRO HA 1 74 GLU H . . 4.670 3.870 3.443 4.414 . 0 0 "[ . 1 . 2]" 1
216 1 13 PRO QB 1 14 LEU H . . 3.710 3.180 2.806 3.720 0.010 12 0 "[ . 1 . 2]" 1
217 1 13 PRO HB2 1 14 LEU H . . 4.550 3.418 2.929 4.040 . 0 0 "[ . 1 . 2]" 1
218 1 13 PRO HB2 1 15 ARG H . . 5.500 4.031 3.404 4.828 . 0 0 "[ . 1 . 2]" 1
219 1 13 PRO HB3 1 14 LEU H . . 4.550 3.858 2.981 4.360 . 0 0 "[ . 1 . 2]" 1
220 1 13 PRO HB3 1 15 ARG H . . 5.500 4.803 3.949 5.518 0.018 12 0 "[ . 1 . 2]" 1
221 1 13 PRO QG 1 14 LEU H . . 4.910 4.575 4.360 4.787 . 0 0 "[ . 1 . 2]" 1
222 1 14 LEU H 1 14 LEU HB2 . . 3.690 2.389 2.117 2.625 . 0 0 "[ . 1 . 2]" 1
223 1 14 LEU H 1 14 LEU QB . . 3.190 2.355 2.095 2.576 . 0 0 "[ . 1 . 2]" 1
224 1 14 LEU H 1 14 LEU HB3 . . 3.690 3.583 3.286 3.739 0.049 20 0 "[ . 1 . 2]" 1
225 1 14 LEU H 1 14 LEU MD1 . . 4.440 4.091 3.697 4.399 . 0 0 "[ . 1 . 2]" 1
226 1 14 LEU H 1 14 LEU MD2 . . 4.440 3.742 2.787 4.304 . 0 0 "[ . 1 . 2]" 1
227 1 14 LEU H 1 14 LEU HG . . 4.270 3.544 2.859 4.346 0.076 8 0 "[ . 1 . 2]" 1
228 1 14 LEU H 1 15 ARG H . . 2.900 2.166 1.881 2.536 . 0 0 "[ . 1 . 2]" 1
229 1 14 LEU H 1 73 PHE HA . . 3.450 2.541 2.211 2.862 . 0 0 "[ . 1 . 2]" 1
230 1 14 LEU H 1 74 GLU H . . 4.900 4.236 3.861 4.744 . 0 0 "[ . 1 . 2]" 1
231 1 14 LEU H 1 74 GLU QG . . 5.500 4.697 3.434 5.507 0.007 12 0 "[ . 1 . 2]" 1
232 1 14 LEU HA 1 14 LEU MD1 . . 3.910 3.357 2.111 3.893 . 0 0 "[ . 1 . 2]" 1
233 1 14 LEU HA 1 14 LEU QD . . 2.900 2.094 1.945 2.224 . 0 0 "[ . 1 . 2]" 1
234 1 14 LEU HA 1 14 LEU MD2 . . 3.910 2.200 2.094 2.489 . 0 0 "[ . 1 . 2]" 1
235 1 14 LEU HA 1 14 LEU HG . . 3.990 3.187 2.703 3.724 . 0 0 "[ . 1 . 2]" 1
236 1 14 LEU QB 1 14 LEU QD . . 2.780 1.980 1.918 2.095 . 0 0 "[ . 1 . 2]" 1
237 1 14 LEU QB 1 15 ARG QB . . 4.780 3.521 3.100 3.972 . 0 0 "[ . 1 . 2]" 1
238 1 14 LEU QB 1 72 ARG QB . . 5.180 2.533 2.136 3.031 . 0 0 "[ . 1 . 2]" 1
239 1 14 LEU QB 1 72 ARG QG . . 5.180 2.967 2.357 4.231 . 0 0 "[ . 1 . 2]" 1
240 1 14 LEU HB2 1 15 ARG H . . 3.360 2.712 2.361 3.209 . 0 0 "[ . 1 . 2]" 1
241 1 14 LEU HB2 1 15 ARG QB . . 5.500 4.084 3.637 4.923 . 0 0 "[ . 1 . 2]" 1
242 1 14 LEU HB3 1 15 ARG H . . 3.360 3.347 3.023 3.424 0.064 3 0 "[ . 1 . 2]" 1
243 1 14 LEU HB3 1 15 ARG QB . . 5.500 3.898 3.337 4.462 . 0 0 "[ . 1 . 2]" 1
244 1 14 LEU QD 1 15 ARG H . . 4.380 4.084 3.934 4.172 . 0 0 "[ . 1 . 2]" 1
245 1 14 LEU QD 1 72 ARG QB . . 5.280 3.525 2.391 4.571 . 0 0 "[ . 1 . 2]" 1
246 1 14 LEU QD 1 74 GLU H . . 4.700 3.610 2.605 4.380 . 0 0 "[ . 1 . 2]" 1
247 1 14 LEU QD 1 74 GLU QB . . 4.680 2.410 2.073 3.482 . 0 0 "[ . 1 . 2]" 1
248 1 14 LEU QD 1 74 GLU QG . . 3.850 2.463 1.924 3.093 . 0 0 "[ . 1 . 2]" 1
249 1 14 LEU MD1 1 15 ARG H . . 5.110 4.544 4.233 4.794 . 0 0 "[ . 1 . 2]" 1
250 1 14 LEU MD1 1 74 GLU QG . . 4.680 3.112 2.051 4.190 . 0 0 "[ . 1 . 2]" 1
251 1 14 LEU MD2 1 15 ARG H . . 5.110 4.657 4.330 4.789 . 0 0 "[ . 1 . 2]" 1
252 1 14 LEU MD2 1 74 GLU QG . . 4.680 2.822 2.047 3.910 . 0 0 "[ . 1 . 2]" 1
253 1 14 LEU HG 1 73 PHE HA . . 4.800 3.848 2.923 4.809 0.009 5 0 "[ . 1 . 2]" 1
254 1 14 LEU HG 1 74 GLU H . . 4.980 4.002 3.192 5.010 0.030 8 0 "[ . 1 . 2]" 1
255 1 14 LEU HG 1 74 GLU QG . . 3.930 2.496 2.187 3.917 . 0 0 "[ . 1 . 2]" 1
256 1 15 ARG H 1 15 ARG QB . . 3.360 2.742 2.551 2.935 . 0 0 "[ . 1 . 2]" 1
257 1 15 ARG H 1 15 ARG QD . . 5.010 4.810 4.082 5.059 0.049 4 0 "[ . 1 . 2]" 1
258 1 15 ARG H 1 15 ARG HG2 . . 5.140 4.203 3.055 5.123 . 0 0 "[ . 1 . 2]" 1
259 1 15 ARG H 1 15 ARG QG . . 4.360 3.678 2.985 4.320 . 0 0 "[ . 1 . 2]" 1
260 1 15 ARG H 1 15 ARG HG3 . . 5.140 4.285 3.318 4.884 . 0 0 "[ . 1 . 2]" 1
261 1 15 ARG H 1 16 MET H . . 4.620 4.254 4.153 4.397 . 0 0 "[ . 1 . 2]" 1
262 1 15 ARG H 1 16 MET HA . . 5.500 5.004 4.836 5.177 . 0 0 "[ . 1 . 2]" 1
263 1 15 ARG H 1 16 MET QB . . 5.340 5.173 4.728 5.341 0.001 10 0 "[ . 1 . 2]" 1
264 1 15 ARG H 1 16 MET QG . . 4.760 3.636 3.270 4.532 . 0 0 "[ . 1 . 2]" 1
265 1 15 ARG H 1 71 TRP HA . . 4.940 4.515 4.263 4.670 . 0 0 "[ . 1 . 2]" 1
266 1 15 ARG H 1 72 ARG H . . 3.450 2.803 2.672 2.979 . 0 0 "[ . 1 . 2]" 1
267 1 15 ARG H 1 72 ARG HA . . 5.370 4.654 4.485 4.953 . 0 0 "[ . 1 . 2]" 1
268 1 15 ARG H 1 72 ARG QB . . 3.410 2.967 2.635 3.252 . 0 0 "[ . 1 . 2]" 1
269 1 15 ARG H 1 73 PHE HA . . 4.300 4.196 4.036 4.329 0.029 11 0 "[ . 1 . 2]" 1
270 1 15 ARG HA 1 15 ARG HD2 . . 4.790 3.983 2.182 4.776 . 0 0 "[ . 1 . 2]" 1
271 1 15 ARG HA 1 15 ARG QD . . 4.130 3.531 2.168 4.176 0.046 3 0 "[ . 1 . 2]" 1
272 1 15 ARG HA 1 15 ARG HD3 . . 4.790 4.175 2.272 4.815 0.025 3 0 "[ . 1 . 2]" 1
273 1 15 ARG HA 1 15 ARG HG2 . . 4.230 2.951 2.414 3.897 . 0 0 "[ . 1 . 2]" 1
274 1 15 ARG HA 1 15 ARG QG . . 3.720 2.598 2.298 3.091 . 0 0 "[ . 1 . 2]" 1
275 1 15 ARG HA 1 15 ARG HG3 . . 4.230 3.102 2.432 3.911 . 0 0 "[ . 1 . 2]" 1
276 1 15 ARG HA 1 16 MET H . . 2.900 2.120 2.065 2.218 . 0 0 "[ . 1 . 2]" 1
277 1 15 ARG QB 1 16 MET H . . 3.760 3.376 2.888 3.794 0.034 4 0 "[ . 1 . 2]" 1
278 1 15 ARG QB 1 71 TRP HA . . 4.630 2.961 2.408 3.872 . 0 0 "[ . 1 . 2]" 1
279 1 15 ARG QB 1 72 ARG H . . 4.090 2.720 2.369 3.342 . 0 0 "[ . 1 . 2]" 1
280 1 15 ARG QD 1 16 MET H . . 5.340 4.410 2.499 5.343 0.003 9 0 "[ . 1 . 2]" 1
281 1 15 ARG QG 1 16 MET H . . 4.580 3.600 2.583 4.634 0.054 2 0 "[ . 1 . 2]" 1
282 1 15 ARG QG 1 72 ARG H . . 4.530 4.281 3.668 4.552 0.022 16 0 "[ . 1 . 2]" 1
283 1 16 MET H 1 16 MET QG . . 5.040 3.278 2.769 3.501 . 0 0 "[ . 1 . 2]" 1
284 1 16 MET H 1 17 ASP H . . 4.030 2.731 2.069 4.159 0.129 10 0 "[ . 1 . 2]" 1
285 1 16 MET HA 1 16 MET ME . . 4.470 3.734 3.126 4.393 . 0 0 "[ . 1 . 2]" 1
286 1 16 MET HA 1 16 MET HG2 . . 3.750 2.631 2.314 3.711 . 0 0 "[ . 1 . 2]" 1
287 1 16 MET HA 1 16 MET HG3 . . 3.750 3.255 2.855 3.798 0.048 3 0 "[ . 1 . 2]" 1
288 1 16 MET HA 1 17 ASP H . . 3.380 2.743 2.076 3.428 0.048 19 0 "[ . 1 . 2]" 1
289 1 16 MET HA 1 71 TRP HA . . 4.320 3.357 2.537 3.758 . 0 0 "[ . 1 . 2]" 1
290 1 16 MET HA 1 71 TRP HD1 . . 4.290 3.248 2.413 3.642 . 0 0 "[ . 1 . 2]" 1
291 1 16 MET HA 1 71 TRP HE1 . . 4.120 3.562 3.244 3.942 . 0 0 "[ . 1 . 2]" 1
292 1 16 MET HA 1 72 ARG H . . 5.080 4.128 3.829 4.382 . 0 0 "[ . 1 . 2]" 1
293 1 16 MET QB 1 16 MET ME . . 3.430 2.199 2.156 2.263 . 0 0 "[ . 1 . 2]" 1
294 1 16 MET QB 1 71 TRP HE1 . . 5.340 4.459 2.903 4.867 . 0 0 "[ . 1 . 2]" 1
295 1 16 MET HB2 1 17 ASP H . . 5.500 4.147 2.059 4.466 . 0 0 "[ . 1 . 2]" 1
296 1 16 MET HB3 1 17 ASP H . . 5.500 4.184 2.450 4.530 . 0 0 "[ . 1 . 2]" 1
297 1 16 MET ME 1 16 MET HG2 . . 3.840 2.688 2.354 3.433 . 0 0 "[ . 1 . 2]" 1
298 1 16 MET ME 1 16 MET QG . . 3.130 2.392 2.313 2.495 . 0 0 "[ . 1 . 2]" 1
299 1 16 MET ME 1 16 MET HG3 . . 3.840 3.177 2.430 3.448 . 0 0 "[ . 1 . 2]" 1
300 1 16 MET ME 1 71 TRP HE3 . . 5.500 3.263 2.726 4.426 . 0 0 "[ . 1 . 2]" 1
301 1 16 MET ME 1 71 TRP HH2 . . 4.060 3.273 3.001 3.669 . 0 0 "[ . 1 . 2]" 1
302 1 16 MET ME 1 71 TRP HZ3 . . 4.840 2.789 2.447 3.503 . 0 0 "[ . 1 . 2]" 1
303 1 17 ASP H 1 18 PRO QD . . 3.880 3.957 3.566 4.059 0.179 3 0 "[ . 1 . 2]" 1
304 1 17 ASP H 1 71 TRP HE1 . . 3.800 3.366 2.197 3.862 0.062 19 0 "[ . 1 . 2]" 1
305 1 18 PRO HA 1 19 PRO HD2 . . 3.540 2.378 2.225 2.557 . 0 0 "[ . 1 . 2]" 1
306 1 18 PRO HA 1 19 PRO QD . . 3.020 2.153 2.069 2.241 . 0 0 "[ . 1 . 2]" 1
307 1 18 PRO HA 1 19 PRO HD3 . . 3.540 2.479 2.216 2.585 . 0 0 "[ . 1 . 2]" 1
308 1 18 PRO HA 1 67 ALA MB . . 4.340 3.799 3.315 4.016 . 0 0 "[ . 1 . 2]" 1
309 1 18 PRO HA 1 71 TRP HE1 . . 4.900 3.660 3.360 4.161 . 0 0 "[ . 1 . 2]" 1
310 1 18 PRO HA 1 71 TRP HZ2 . . 4.450 3.012 2.519 3.889 . 0 0 "[ . 1 . 2]" 1
311 1 18 PRO HA 1 91 PHE QE . . 4.550 3.906 3.070 4.572 0.022 5 0 "[ . 1 . 2]" 1
312 1 18 PRO QB 1 19 PRO QD . . 3.210 2.437 2.238 3.028 . 0 0 "[ . 1 . 2]" 1
313 1 18 PRO QB 1 67 ALA MB . . 4.970 4.891 4.627 5.006 0.036 11 0 "[ . 1 . 2]" 1
314 1 19 PRO HA 1 20 VAL H . . 2.960 2.219 2.155 2.310 . 0 0 "[ . 1 . 2]" 1
315 1 19 PRO HA 1 20 VAL QG . . 4.340 3.491 3.007 4.152 . 0 0 "[ . 1 . 2]" 1
316 1 19 PRO HA 1 67 ALA H . . 4.740 4.631 4.200 4.795 0.055 8 0 "[ . 1 . 2]" 1
317 1 19 PRO HA 1 67 ALA MB . . 2.930 2.257 2.014 2.517 . 0 0 "[ . 1 . 2]" 1
318 1 19 PRO QB 1 20 VAL H . . 3.460 2.961 2.672 3.232 . 0 0 "[ . 1 . 2]" 1
319 1 19 PRO QB 1 64 VAL H . . 5.040 3.925 3.449 4.286 . 0 0 "[ . 1 . 2]" 1
320 1 19 PRO QB 1 64 VAL HA . . 3.730 2.417 2.089 2.813 . 0 0 "[ . 1 . 2]" 1
321 1 19 PRO QB 1 67 ALA H . . 5.340 3.903 3.690 4.316 . 0 0 "[ . 1 . 2]" 1
322 1 19 PRO QB 1 67 ALA MB . . 4.210 2.281 2.098 3.046 . 0 0 "[ . 1 . 2]" 1
323 1 19 PRO QB 1 91 PHE QE . . 5.340 4.604 4.206 5.343 0.003 5 0 "[ . 1 . 2]" 1
324 1 19 PRO QB 1 93 PHE QE . . 4.040 3.092 2.360 3.702 . 0 0 "[ . 1 . 2]" 1
325 1 19 PRO HB2 1 20 VAL H . . 3.980 3.140 2.762 3.686 . 0 0 "[ . 1 . 2]" 1
326 1 19 PRO HB3 1 20 VAL H . . 3.980 3.696 3.100 3.986 0.006 2 0 "[ . 1 . 2]" 1
327 1 19 PRO QD 1 64 VAL QG . . 5.040 3.611 3.177 3.941 . 0 0 "[ . 1 . 2]" 1
328 1 19 PRO QD 1 91 PHE QD . . 4.540 3.679 3.076 4.407 . 0 0 "[ . 1 . 2]" 1
329 1 19 PRO HD2 1 71 TRP HZ2 . . 5.090 4.112 3.532 4.633 . 0 0 "[ . 1 . 2]" 1
330 1 19 PRO HD2 1 91 PHE QE . . 4.480 2.785 2.349 3.789 . 0 0 "[ . 1 . 2]" 1
331 1 19 PRO HD3 1 71 TRP HZ2 . . 5.090 3.255 2.778 4.057 . 0 0 "[ . 1 . 2]" 1
332 1 19 PRO HD3 1 91 PHE QE . . 4.480 2.900 2.423 3.727 . 0 0 "[ . 1 . 2]" 1
333 1 19 PRO QG 1 64 VAL HA . . 4.380 3.092 2.331 3.779 . 0 0 "[ . 1 . 2]" 1
334 1 19 PRO QG 1 64 VAL QG . . 5.050 2.338 2.112 2.753 . 0 0 "[ . 1 . 2]" 1
335 1 19 PRO QG 1 91 PHE QE . . 4.740 3.038 2.620 3.567 . 0 0 "[ . 1 . 2]" 1
336 1 19 PRO QG 1 93 PHE QE . . 4.120 2.834 2.522 3.802 . 0 0 "[ . 1 . 2]" 1
337 1 19 PRO HG2 1 91 PHE QD . . 4.700 3.777 3.130 4.523 . 0 0 "[ . 1 . 2]" 1
338 1 19 PRO HG2 1 93 PHE QE . . 4.970 2.935 2.586 3.945 . 0 0 "[ . 1 . 2]" 1
339 1 19 PRO HG3 1 91 PHE QD . . 4.700 3.497 2.710 4.633 . 0 0 "[ . 1 . 2]" 1
340 1 19 PRO HG3 1 93 PHE QE . . 4.970 3.781 3.379 4.977 0.007 11 0 "[ . 1 . 2]" 1
341 1 20 VAL H 1 20 VAL HB . . 3.730 3.288 2.386 3.776 0.046 5 0 "[ . 1 . 2]" 1
342 1 20 VAL H 1 20 VAL QG . . 2.950 2.075 1.885 2.457 . 0 0 "[ . 1 . 2]" 1
343 1 20 VAL H 1 63 GLU QG . . 5.040 3.519 1.941 4.852 . 0 0 "[ . 1 . 2]" 1
344 1 20 VAL H 1 67 ALA MB . . 4.350 3.796 3.100 4.350 . 0 0 "[ . 1 . 2]" 1
345 1 20 VAL HA 1 20 VAL QG . . 3.070 2.354 2.108 2.543 . 0 0 "[ . 1 . 2]" 1
346 1 20 VAL HA 1 21 TYR H . . 2.690 2.276 2.109 2.407 . 0 0 "[ . 1 . 2]" 1
347 1 20 VAL HA 1 21 TYR HB2 . . 4.790 4.431 4.224 4.673 . 0 0 "[ . 1 . 2]" 1
348 1 20 VAL HB 1 21 TYR H . . 4.130 3.202 2.513 4.159 0.029 13 0 "[ . 1 . 2]" 1
349 1 20 VAL QG 1 21 TYR H . . 3.760 2.926 2.221 3.367 . 0 0 "[ . 1 . 2]" 1
350 1 20 VAL QG 1 63 GLU QG . . 3.950 2.570 2.063 3.641 . 0 0 "[ . 1 . 2]" 1
351 1 20 VAL MG1 1 21 TYR H . . 4.510 3.694 2.494 4.240 . 0 0 "[ . 1 . 2]" 1
352 1 20 VAL MG1 1 63 GLU HG2 . . 5.500 4.705 2.301 5.605 0.105 9 0 "[ . 1 . 2]" 1
353 1 20 VAL MG1 1 63 GLU HG3 . . 5.500 4.306 2.215 5.533 0.033 7 0 "[ . 1 . 2]" 1
354 1 20 VAL MG2 1 21 TYR H . . 4.510 3.331 2.245 4.157 . 0 0 "[ . 1 . 2]" 1
355 1 20 VAL MG2 1 63 GLU HG2 . . 5.500 3.739 2.419 5.539 0.039 4 0 "[ . 1 . 2]" 1
356 1 20 VAL MG2 1 63 GLU HG3 . . 5.500 3.411 2.144 5.590 0.090 13 0 "[ . 1 . 2]" 1
357 1 21 TYR H 1 21 TYR HB2 . . 3.460 2.304 2.213 2.524 . 0 0 "[ . 1 . 2]" 1
358 1 21 TYR H 1 21 TYR HB3 . . 3.500 3.332 2.809 3.562 0.062 14 0 "[ . 1 . 2]" 1
359 1 21 TYR H 1 21 TYR QD . . 4.990 3.016 2.197 4.272 . 0 0 "[ . 1 . 2]" 1
360 1 21 TYR H 1 22 PRO QD . . 5.350 4.399 4.248 4.501 . 0 0 "[ . 1 . 2]" 1
361 1 21 TYR HA 1 22 PRO HD2 . . 3.550 2.474 2.114 2.861 . 0 0 "[ . 1 . 2]" 1
362 1 21 TYR HA 1 22 PRO HD3 . . 3.550 2.324 2.050 2.691 . 0 0 "[ . 1 . 2]" 1
363 1 21 TYR HB2 1 26 GLN HE21 . . 4.850 3.592 2.249 4.863 0.013 16 0 "[ . 1 . 2]" 1
364 1 21 TYR HB2 1 26 GLN HE22 . . 5.030 3.397 2.407 5.051 0.021 8 0 "[ . 1 . 2]" 1
365 1 21 TYR HB3 1 26 GLN HE21 . . 4.300 3.435 2.604 4.309 0.009 7 0 "[ . 1 . 2]" 1
366 1 21 TYR HB3 1 26 GLN HE22 . . 4.560 3.717 2.563 4.514 . 0 0 "[ . 1 . 2]" 1
367 1 21 TYR QE 1 26 GLN HA . . 4.870 4.429 3.124 4.947 0.077 10 0 "[ . 1 . 2]" 1
368 1 21 TYR QE 1 93 PHE HA . . 4.380 3.518 3.069 4.045 . 0 0 "[ . 1 . 2]" 1
369 1 21 TYR QE 1 93 PHE QB . . 4.710 3.335 2.670 4.095 . 0 0 "[ . 1 . 2]" 1
370 1 21 TYR QE 1 94 LYS H . . 4.140 3.665 2.332 4.215 0.075 9 0 "[ . 1 . 2]" 1
371 1 21 TYR QE 1 95 ILE HA . . 4.770 3.496 2.741 4.000 . 0 0 "[ . 1 . 2]" 1
372 1 21 TYR QE 1 95 ILE HB . . 5.500 5.325 4.891 5.541 0.041 15 0 "[ . 1 . 2]" 1
373 1 21 TYR QE 1 95 ILE MD . . 4.030 2.821 2.147 4.031 0.001 14 0 "[ . 1 . 2]" 1
374 1 21 TYR QE 1 95 ILE QG . . 4.300 3.284 2.321 4.316 0.016 19 0 "[ . 1 . 2]" 1
375 1 21 TYR QE 1 95 ILE MG . . 4.750 4.576 3.418 4.799 0.049 16 0 "[ . 1 . 2]" 1
376 1 22 PRO HA 1 23 ARG H . . 3.290 2.182 2.107 2.291 . 0 0 "[ . 1 . 2]" 1
377 1 22 PRO QB 1 23 ARG H . . 3.440 3.322 3.032 3.492 0.052 20 0 "[ . 1 . 2]" 1
378 1 22 PRO QB 1 24 MET H . . 4.610 3.603 3.215 4.259 . 0 0 "[ . 1 . 2]" 1
379 1 22 PRO QB 1 25 ALA H . . 4.020 2.929 2.426 3.481 . 0 0 "[ . 1 . 2]" 1
380 1 22 PRO QD 1 60 PHE QD . . 4.290 2.868 2.244 4.310 0.020 16 0 "[ . 1 . 2]" 1
381 1 22 PRO HD2 1 60 PHE QE . . 5.320 2.551 2.199 3.968 . 0 0 "[ . 1 . 2]" 1
382 1 22 PRO HD3 1 60 PHE QE . . 5.320 3.363 2.453 4.663 . 0 0 "[ . 1 . 2]" 1
383 1 22 PRO QG 1 25 ALA H . . 4.490 3.997 2.849 4.532 0.042 2 0 "[ . 1 . 2]" 1
384 1 22 PRO QG 1 25 ALA MB . . 3.820 2.618 2.115 3.313 . 0 0 "[ . 1 . 2]" 1
385 1 22 PRO QG 1 60 PHE QD . . 4.240 3.203 2.671 4.248 0.008 19 0 "[ . 1 . 2]" 1
386 1 22 PRO QG 1 60 PHE QE . . 4.660 3.215 2.867 3.991 . 0 0 "[ . 1 . 2]" 1
387 1 22 PRO HG2 1 25 ALA MB . . 4.550 2.663 2.133 3.403 . 0 0 "[ . 1 . 2]" 1
388 1 22 PRO HG3 1 25 ALA MB . . 4.550 3.946 3.449 4.554 0.004 6 0 "[ . 1 . 2]" 1
389 1 23 ARG H 1 23 ARG QG . . 3.880 2.818 2.106 3.992 0.112 6 0 "[ . 1 . 2]" 1
390 1 23 ARG HA 1 23 ARG QD . . 4.300 3.338 2.076 4.402 0.102 5 0 "[ . 1 . 2]" 1
391 1 23 ARG HA 1 23 ARG HG2 . . 4.190 3.161 2.336 3.860 . 0 0 "[ . 1 . 2]" 1
392 1 23 ARG HA 1 23 ARG HG3 . . 4.190 3.384 2.395 4.236 0.046 17 0 "[ . 1 . 2]" 1
393 1 23 ARG HA 1 25 ALA H . . 5.500 4.509 4.014 4.921 . 0 0 "[ . 1 . 2]" 1
394 1 23 ARG HA 1 26 GLN H . . 4.020 3.574 3.092 3.948 . 0 0 "[ . 1 . 2]" 1
395 1 23 ARG HA 1 26 GLN QB . . 3.790 2.808 2.177 3.690 . 0 0 "[ . 1 . 2]" 1
396 1 23 ARG HA 1 26 GLN HE21 . . 4.980 4.177 3.114 5.054 0.074 20 0 "[ . 1 . 2]" 1
397 1 23 ARG HA 1 27 ALA H . . 4.880 3.924 3.564 4.265 . 0 0 "[ . 1 . 2]" 1
398 1 24 MET H 1 25 ALA H . . 4.250 2.793 2.510 2.977 . 0 0 "[ . 1 . 2]" 1
399 1 24 MET H 1 27 ALA H . . 5.040 4.803 4.659 5.050 0.010 12 0 "[ . 1 . 2]" 1
400 1 24 MET HA 1 24 MET ME . . 4.870 3.898 2.013 4.732 . 0 0 "[ . 1 . 2]" 1
401 1 24 MET HA 1 27 ALA H . . 4.060 3.614 3.283 3.976 . 0 0 "[ . 1 . 2]" 1
402 1 24 MET HA 1 27 ALA MB . . 3.290 2.618 2.348 2.973 . 0 0 "[ . 1 . 2]" 1
403 1 24 MET QB 1 25 ALA H . . 4.360 2.898 2.461 3.878 . 0 0 "[ . 1 . 2]" 1
404 1 24 MET QG 1 25 ALA H . . 4.500 3.445 2.390 4.261 . 0 0 "[ . 1 . 2]" 1
405 1 24 MET QG 1 25 ALA HA . . 4.630 3.834 3.231 4.658 0.028 4 0 "[ . 1 . 2]" 1
406 1 25 ALA H 1 25 ALA MB . . 2.950 2.222 2.178 2.318 . 0 0 "[ . 1 . 2]" 1
407 1 25 ALA H 1 26 GLN H . . 3.140 2.670 2.380 2.881 . 0 0 "[ . 1 . 2]" 1
408 1 25 ALA H 1 26 GLN QB . . 5.340 4.413 4.137 4.755 . 0 0 "[ . 1 . 2]" 1
409 1 25 ALA H 1 27 ALA H . . 4.270 4.218 3.986 4.302 0.032 19 0 "[ . 1 . 2]" 1
410 1 25 ALA H 1 30 ILE HB . . 5.500 5.295 4.844 5.532 0.032 12 0 "[ . 1 . 2]" 1
411 1 25 ALA H 1 30 ILE MD . . 5.000 4.806 4.328 5.019 0.019 7 0 "[ . 1 . 2]" 1
412 1 25 ALA HA 1 30 ILE H . . 3.990 3.579 2.970 3.978 . 0 0 "[ . 1 . 2]" 1
413 1 25 ALA HA 1 30 ILE HB . . 3.420 2.728 2.300 3.076 . 0 0 "[ . 1 . 2]" 1
414 1 25 ALA HA 1 30 ILE MD . . 3.290 2.422 2.184 2.869 . 0 0 "[ . 1 . 2]" 1
415 1 25 ALA HA 1 30 ILE MG . . 4.370 4.014 3.595 4.386 0.016 18 0 "[ . 1 . 2]" 1
416 1 25 ALA MB 1 26 GLN H . . 3.060 2.624 2.525 2.805 . 0 0 "[ . 1 . 2]" 1
417 1 25 ALA MB 1 30 ILE H . . 4.180 3.622 3.168 3.891 . 0 0 "[ . 1 . 2]" 1
418 1 25 ALA MB 1 30 ILE MG . . 3.970 3.110 2.417 3.966 . 0 0 "[ . 1 . 2]" 1
419 1 26 GLN H 1 26 GLN HB2 . . 3.610 2.450 2.298 2.625 . 0 0 "[ . 1 . 2]" 1
420 1 26 GLN H 1 26 GLN HB3 . . 3.610 2.598 2.304 3.633 0.023 20 0 "[ . 1 . 2]" 1
421 1 26 GLN H 1 26 GLN QG . . 4.450 3.888 2.228 4.016 . 0 0 "[ . 1 . 2]" 1
422 1 26 GLN H 1 27 ALA H . . 3.130 2.674 2.609 2.735 . 0 0 "[ . 1 . 2]" 1
423 1 26 GLN H 1 27 ALA MB . . 4.240 4.258 4.212 4.290 0.050 19 0 "[ . 1 . 2]" 1
424 1 26 GLN H 1 28 ARG H . . 4.320 4.271 4.114 4.342 0.022 14 0 "[ . 1 . 2]" 1
425 1 26 GLN HA 1 26 GLN HE21 . . 4.720 4.619 3.914 4.796 0.076 15 0 "[ . 1 . 2]" 1
426 1 26 GLN HA 1 26 GLN HG2 . . 3.590 3.099 2.368 3.450 . 0 0 "[ . 1 . 2]" 1
427 1 26 GLN HA 1 26 GLN HG3 . . 3.590 2.505 2.236 3.301 . 0 0 "[ . 1 . 2]" 1
428 1 26 GLN HA 1 28 ARG H . . 4.950 4.682 4.197 4.958 0.008 4 0 "[ . 1 . 2]" 1
429 1 26 GLN HA 1 29 GLY H . . 4.070 3.604 3.233 4.080 0.010 4 0 "[ . 1 . 2]" 1
430 1 26 GLN HA 1 30 ILE H . . 4.560 3.819 3.404 4.508 . 0 0 "[ . 1 . 2]" 1
431 1 26 GLN HA 1 95 ILE MD . . 3.440 2.251 1.880 2.868 . 0 0 "[ . 1 . 2]" 1
432 1 26 GLN QB 1 26 GLN HE21 . . 3.400 2.459 2.024 3.460 0.060 20 0 "[ . 1 . 2]" 1
433 1 26 GLN QB 1 26 GLN HE22 . . 4.150 3.484 3.345 3.978 . 0 0 "[ . 1 . 2]" 1
434 1 26 GLN QB 1 27 ALA H . . 3.050 2.541 2.405 2.849 . 0 0 "[ . 1 . 2]" 1
435 1 26 GLN QB 1 27 ALA MB . . 4.740 3.784 3.584 3.960 . 0 0 "[ . 1 . 2]" 1
436 1 26 GLN HB2 1 27 ALA H . . 3.790 3.763 2.596 3.865 0.075 9 0 "[ . 1 . 2]" 1
437 1 26 GLN HB3 1 27 ALA H . . 3.790 2.638 2.432 3.722 . 0 0 "[ . 1 . 2]" 1
438 1 26 GLN HE21 1 95 ILE MD . . 5.320 5.219 4.536 5.391 0.071 2 0 "[ . 1 . 2]" 1
439 1 27 ALA H 1 27 ALA MB . . 2.660 2.178 2.141 2.218 . 0 0 "[ . 1 . 2]" 1
440 1 27 ALA H 1 28 ARG H . . 3.260 2.820 2.709 2.933 . 0 0 "[ . 1 . 2]" 1
441 1 27 ALA HA 1 29 GLY H . . 5.330 4.244 4.009 4.677 . 0 0 "[ . 1 . 2]" 1
442 1 27 ALA MB 1 28 ARG H . . 3.210 2.549 2.376 2.870 . 0 0 "[ . 1 . 2]" 1
443 1 27 ALA MB 1 29 GLY H . . 4.810 4.402 4.211 4.619 . 0 0 "[ . 1 . 2]" 1
444 1 28 ARG H 1 28 ARG HB2 . . 3.920 2.414 2.182 2.721 . 0 0 "[ . 1 . 2]" 1
445 1 28 ARG H 1 28 ARG QB . . 3.400 2.301 2.103 2.463 . 0 0 "[ . 1 . 2]" 1
446 1 28 ARG H 1 28 ARG HB3 . . 3.920 3.280 2.268 3.677 . 0 0 "[ . 1 . 2]" 1
447 1 28 ARG H 1 28 ARG QD . . 4.350 3.979 2.337 4.385 0.035 1 0 "[ . 1 . 2]" 1
448 1 28 ARG H 1 28 ARG QG . . 3.820 2.953 2.326 3.918 0.098 18 0 "[ . 1 . 2]" 1
449 1 28 ARG H 1 29 GLY H . . 3.090 2.586 2.358 2.782 . 0 0 "[ . 1 . 2]" 1
450 1 28 ARG H 1 29 GLY HA2 . . 5.500 4.877 4.626 5.083 . 0 0 "[ . 1 . 2]" 1
451 1 28 ARG H 1 29 GLY HA3 . . 5.500 5.275 5.082 5.435 . 0 0 "[ . 1 . 2]" 1
452 1 28 ARG H 1 30 ILE MD . . 4.510 4.103 3.704 4.522 0.012 19 0 "[ . 1 . 2]" 1
453 1 28 ARG HA 1 28 ARG QD . . 4.180 3.387 2.094 4.199 0.019 7 0 "[ . 1 . 2]" 1
454 1 28 ARG HA 1 28 ARG QG . . 3.330 2.563 2.177 3.083 . 0 0 "[ . 1 . 2]" 1
455 1 28 ARG QB 1 28 ARG QD . . 2.910 2.310 2.115 2.644 . 0 0 "[ . 1 . 2]" 1
456 1 28 ARG QB 1 29 GLY H . . 3.520 3.121 2.795 3.422 . 0 0 "[ . 1 . 2]" 1
457 1 28 ARG QB 1 30 ILE MD . . 3.410 2.178 1.929 2.749 . 0 0 "[ . 1 . 2]" 1
458 1 28 ARG HB2 1 28 ARG QD . . 3.440 2.727 2.227 3.508 0.068 13 0 "[ . 1 . 2]" 1
459 1 28 ARG HB2 1 29 GLY H . . 4.280 3.541 2.884 4.193 . 0 0 "[ . 1 . 2]" 1
460 1 28 ARG HB2 1 30 ILE MD . . 4.120 2.659 2.122 3.991 . 0 0 "[ . 1 . 2]" 1
461 1 28 ARG HB3 1 28 ARG QD . . 3.440 2.701 2.339 3.367 . 0 0 "[ . 1 . 2]" 1
462 1 28 ARG HB3 1 29 GLY H . . 4.280 3.777 2.844 4.284 0.004 9 0 "[ . 1 . 2]" 1
463 1 28 ARG HB3 1 30 ILE MD . . 4.120 2.487 2.108 2.802 . 0 0 "[ . 1 . 2]" 1
464 1 28 ARG QD 1 30 ILE MD . . 5.190 3.165 2.138 4.404 . 0 0 "[ . 1 . 2]" 1
465 1 29 GLY H 1 30 ILE H . . 3.110 2.533 2.286 2.715 . 0 0 "[ . 1 . 2]" 1
466 1 29 GLY H 1 30 ILE HB . . 4.500 4.434 4.136 4.555 0.055 18 0 "[ . 1 . 2]" 1
467 1 29 GLY H 1 30 ILE MD . . 4.320 4.107 2.797 4.362 0.042 9 0 "[ . 1 . 2]" 1
468 1 29 GLY QA 1 95 ILE MD . . 3.760 2.663 2.058 3.797 0.037 4 0 "[ . 1 . 2]" 1
469 1 30 ILE H 1 30 ILE HB . . 2.830 2.433 2.244 2.797 . 0 0 "[ . 1 . 2]" 1
470 1 30 ILE H 1 30 ILE MD . . 4.320 3.420 2.414 4.077 . 0 0 "[ . 1 . 2]" 1
471 1 30 ILE H 1 30 ILE HG12 . . 4.760 4.164 3.877 4.423 . 0 0 "[ . 1 . 2]" 1
472 1 30 ILE H 1 30 ILE HG13 . . 4.760 3.024 2.680 4.178 . 0 0 "[ . 1 . 2]" 1
473 1 30 ILE H 1 31 GLU HA . . 5.130 5.102 4.757 5.229 0.099 6 0 "[ . 1 . 2]" 1
474 1 30 ILE H 1 95 ILE MD . . 4.610 3.019 2.294 4.227 . 0 0 "[ . 1 . 2]" 1
475 1 30 ILE H 1 95 ILE QG . . 4.520 3.698 2.399 4.589 0.069 2 0 "[ . 1 . 2]" 1
476 1 30 ILE HA 1 30 ILE MD . . 4.750 3.773 2.713 4.005 . 0 0 "[ . 1 . 2]" 1
477 1 30 ILE HA 1 30 ILE QG . . 3.400 2.420 2.242 2.663 . 0 0 "[ . 1 . 2]" 1
478 1 30 ILE HA 1 30 ILE MG . . 3.350 2.520 2.352 2.785 . 0 0 "[ . 1 . 2]" 1
479 1 30 ILE HA 1 31 GLU H . . 2.780 2.157 2.084 2.273 . 0 0 "[ . 1 . 2]" 1
480 1 30 ILE HA 1 31 GLU QG . . 4.620 4.226 3.865 4.664 0.044 4 0 "[ . 1 . 2]" 1
481 1 30 ILE HB 1 30 ILE MD . . 2.840 2.303 2.216 2.408 . 0 0 "[ . 1 . 2]" 1
482 1 30 ILE HB 1 31 GLU H . . 4.500 4.360 4.031 4.471 . 0 0 "[ . 1 . 2]" 1
483 1 30 ILE QG 1 31 GLU H . . 4.640 4.142 3.573 4.525 . 0 0 "[ . 1 . 2]" 1
484 1 30 ILE HG12 1 30 ILE MG . . 3.580 2.297 2.135 2.443 . 0 0 "[ . 1 . 2]" 1
485 1 30 ILE HG13 1 30 ILE MG . . 3.580 3.124 2.505 3.262 . 0 0 "[ . 1 . 2]" 1
486 1 30 ILE MG 1 31 GLU H . . 4.430 2.932 2.335 3.253 . 0 0 "[ . 1 . 2]" 1
487 1 31 GLU H 1 31 GLU HB2 . . 4.190 2.888 2.339 3.914 . 0 0 "[ . 1 . 2]" 1
488 1 31 GLU H 1 31 GLU QB . . 3.630 2.687 2.311 3.241 . 0 0 "[ . 1 . 2]" 1
489 1 31 GLU H 1 31 GLU HB3 . . 4.190 3.581 3.237 3.733 . 0 0 "[ . 1 . 2]" 1
490 1 31 GLU H 1 31 GLU QG . . 3.470 2.773 2.394 3.357 . 0 0 "[ . 1 . 2]" 1
491 1 31 GLU H 1 32 GLY H . . 4.560 4.577 4.489 4.625 0.065 18 0 "[ . 1 . 2]" 1
492 1 31 GLU H 1 95 ILE H . . 5.500 5.371 4.794 5.535 0.035 8 0 "[ . 1 . 2]" 1
493 1 31 GLU H 1 95 ILE MD . . 5.500 4.622 3.614 5.504 0.004 16 0 "[ . 1 . 2]" 1
494 1 31 GLU HA 1 31 GLU QG . . 3.710 2.739 2.244 3.643 . 0 0 "[ . 1 . 2]" 1
495 1 31 GLU HA 1 32 GLY H . . 3.200 2.363 2.246 2.532 . 0 0 "[ . 1 . 2]" 1
496 1 31 GLU HA 1 93 PHE QB . . 5.090 3.799 3.206 4.321 . 0 0 "[ . 1 . 2]" 1
497 1 31 GLU HA 1 95 ILE MD . . 4.560 3.859 2.893 4.568 0.008 16 0 "[ . 1 . 2]" 1
498 1 31 GLU QB 1 32 GLY H . . 3.130 2.448 2.129 2.737 . 0 0 "[ . 1 . 2]" 1
499 1 31 GLU QB 1 95 ILE H . . 4.690 3.408 2.009 4.463 . 0 0 "[ . 1 . 2]" 1
500 1 31 GLU HB2 1 32 GLY H . . 3.680 3.300 2.153 3.723 0.043 14 0 "[ . 1 . 2]" 1
501 1 31 GLU HB3 1 32 GLY H . . 3.680 2.785 2.292 3.683 0.003 16 0 "[ . 1 . 2]" 1
502 1 31 GLU QG 1 95 ILE H . . 3.310 2.362 1.811 3.328 0.018 9 0 "[ . 1 . 2]" 1
503 1 31 GLU QG 1 95 ILE HB . . 4.520 3.333 2.232 4.523 0.003 9 0 "[ . 1 . 2]" 1
504 1 31 GLU QG 1 95 ILE QG . . 4.090 2.745 2.148 4.097 0.007 9 0 "[ . 1 . 2]" 1
505 1 31 GLU HG2 1 32 GLY H . . 5.080 4.487 3.945 5.053 . 0 0 "[ . 1 . 2]" 1
506 1 31 GLU HG2 1 94 LYS HA . . 4.020 2.856 2.149 3.596 . 0 0 "[ . 1 . 2]" 1
507 1 31 GLU HG2 1 95 ILE H . . 4.190 2.790 1.817 3.830 . 0 0 "[ . 1 . 2]" 1
508 1 31 GLU HG3 1 32 GLY H . . 5.080 4.730 3.948 5.051 . 0 0 "[ . 1 . 2]" 1
509 1 31 GLU HG3 1 94 LYS HA . . 4.020 3.554 2.230 4.169 0.149 16 0 "[ . 1 . 2]" 1
510 1 31 GLU HG3 1 95 ILE H . . 4.190 2.997 1.972 4.042 . 0 0 "[ . 1 . 2]" 1
511 1 32 GLY H 1 33 ARG H . . 4.670 4.435 4.359 4.512 . 0 0 "[ . 1 . 2]" 1
512 1 32 GLY H 1 93 PHE H . . 4.160 3.963 3.502 4.193 0.033 10 0 "[ . 1 . 2]" 1
513 1 32 GLY H 1 93 PHE HB2 . . 4.150 2.922 2.525 3.177 . 0 0 "[ . 1 . 2]" 1
514 1 32 GLY H 1 93 PHE QB . . 3.510 2.777 2.458 3.017 . 0 0 "[ . 1 . 2]" 1
515 1 32 GLY H 1 93 PHE HB3 . . 4.150 3.503 3.144 3.816 . 0 0 "[ . 1 . 2]" 1
516 1 32 GLY H 1 95 ILE H . . 5.500 5.334 5.010 5.592 0.092 6 0 "[ . 1 . 2]" 1
517 1 32 GLY QA 1 33 ARG H . . 2.850 2.258 2.221 2.315 . 0 0 "[ . 1 . 2]" 1
518 1 32 GLY QA 1 55 VAL HB . . 4.740 3.484 3.111 3.881 . 0 0 "[ . 1 . 2]" 1
519 1 32 GLY QA 1 55 VAL MG1 . . 3.790 3.086 2.484 3.401 . 0 0 "[ . 1 . 2]" 1
520 1 32 GLY QA 1 56 PRO QD . . 3.990 2.398 2.196 2.637 . 0 0 "[ . 1 . 2]" 1
521 1 32 GLY QA 1 60 PHE QE . . 4.020 2.787 2.305 3.488 . 0 0 "[ . 1 . 2]" 1
522 1 32 GLY HA2 1 33 ARG H . . 3.280 2.553 2.388 2.713 . 0 0 "[ . 1 . 2]" 1
523 1 32 GLY HA2 1 55 VAL MG1 . . 4.370 3.181 2.522 3.546 . 0 0 "[ . 1 . 2]" 1
524 1 32 GLY HA2 1 60 PHE QE . . 4.740 4.195 3.770 4.763 0.023 9 0 "[ . 1 . 2]" 1
525 1 32 GLY HA3 1 33 ARG H . . 3.280 2.533 2.407 2.707 . 0 0 "[ . 1 . 2]" 1
526 1 32 GLY HA3 1 55 VAL MG1 . . 4.370 4.198 3.741 4.387 0.017 11 0 "[ . 1 . 2]" 1
527 1 32 GLY HA3 1 60 PHE QE . . 4.740 2.833 2.323 3.590 . 0 0 "[ . 1 . 2]" 1
528 1 33 ARG H 1 33 ARG HB3 . . 4.140 3.508 3.397 3.633 . 0 0 "[ . 1 . 2]" 1
529 1 33 ARG H 1 33 ARG QD . . 5.060 4.501 2.309 4.842 . 0 0 "[ . 1 . 2]" 1
530 1 33 ARG H 1 33 ARG QG . . 3.530 2.873 2.540 3.591 0.061 15 0 "[ . 1 . 2]" 1
531 1 33 ARG H 1 34 VAL H . . 4.580 4.359 4.282 4.424 . 0 0 "[ . 1 . 2]" 1
532 1 33 ARG H 1 34 VAL HA . . 5.020 4.831 4.706 4.934 . 0 0 "[ . 1 . 2]" 1
533 1 33 ARG H 1 34 VAL MG2 . . 5.140 3.630 3.470 3.788 . 0 0 "[ . 1 . 2]" 1
534 1 33 ARG H 1 55 VAL H . . 4.110 3.138 2.964 3.423 . 0 0 "[ . 1 . 2]" 1
535 1 33 ARG H 1 55 VAL HB . . 3.370 2.255 1.972 2.501 . 0 0 "[ . 1 . 2]" 1
536 1 33 ARG H 1 55 VAL MG1 . . 3.550 3.408 2.975 3.557 0.007 2 0 "[ . 1 . 2]" 1
537 1 33 ARG H 1 55 VAL MG2 . . 4.150 3.835 3.442 4.159 0.009 3 0 "[ . 1 . 2]" 1
538 1 33 ARG H 1 56 PRO QD . . 5.350 3.864 3.644 4.114 . 0 0 "[ . 1 . 2]" 1
539 1 33 ARG HA 1 34 VAL H . . 3.010 2.289 2.236 2.343 . 0 0 "[ . 1 . 2]" 1
540 1 33 ARG HA 1 34 VAL MG2 . . 4.570 3.410 3.186 3.605 . 0 0 "[ . 1 . 2]" 1
541 1 33 ARG HA 1 92 PHE HA . . 3.720 2.953 2.472 3.330 . 0 0 "[ . 1 . 2]" 1
542 1 33 ARG HA 1 93 PHE H . . 3.910 2.707 2.251 3.194 . 0 0 "[ . 1 . 2]" 1
543 1 33 ARG HA 1 93 PHE QD . . 4.070 3.099 2.585 3.590 . 0 0 "[ . 1 . 2]" 1
544 1 33 ARG HB2 1 34 VAL H . . 4.270 2.672 2.551 2.815 . 0 0 "[ . 1 . 2]" 1
545 1 33 ARG HB2 1 90 MET ME . . 3.620 2.325 2.059 3.020 . 0 0 "[ . 1 . 2]" 1
546 1 33 ARG HB2 1 91 PHE H . . 5.500 4.667 4.050 4.959 . 0 0 "[ . 1 . 2]" 1
547 1 33 ARG HB2 1 92 PHE QE . . 5.160 3.907 3.238 4.903 . 0 0 "[ . 1 . 2]" 1
548 1 33 ARG HB3 1 33 ARG QD . . 3.410 2.740 2.438 3.335 . 0 0 "[ . 1 . 2]" 1
549 1 33 ARG HB3 1 34 VAL H . . 4.530 3.932 3.843 4.086 . 0 0 "[ . 1 . 2]" 1
550 1 33 ARG HB3 1 92 PHE HA . . 4.000 3.222 2.717 3.589 . 0 0 "[ . 1 . 2]" 1
551 1 33 ARG HB3 1 92 PHE QD . . 4.690 2.994 2.483 3.979 . 0 0 "[ . 1 . 2]" 1
552 1 33 ARG HB3 1 93 PHE H . . 4.660 4.033 3.447 4.525 . 0 0 "[ . 1 . 2]" 1
553 1 33 ARG QD 1 90 MET ME . . 3.410 2.595 2.049 3.410 . 0 0 "[ . 1 . 2]" 1
554 1 33 ARG HD2 1 90 MET ME . . 4.000 3.142 2.393 4.122 0.122 10 0 "[ . 1 . 2]" 1
555 1 33 ARG HD3 1 90 MET ME . . 4.000 3.420 2.062 4.042 0.042 7 0 "[ . 1 . 2]" 1
556 1 33 ARG HE 1 90 MET ME . . 4.920 4.139 3.200 4.994 0.074 16 0 "[ . 1 . 2]" 1
557 1 33 ARG QG 1 34 VAL H . . 4.890 3.727 3.264 3.955 . 0 0 "[ . 1 . 2]" 1
558 1 33 ARG QG 1 55 VAL H . . 4.420 3.840 3.466 4.439 0.019 15 0 "[ . 1 . 2]" 1
559 1 33 ARG QG 1 55 VAL HB . . 3.580 2.349 2.112 3.632 0.052 15 0 "[ . 1 . 2]" 1
560 1 34 VAL H 1 34 VAL HB . . 3.660 2.964 2.833 3.121 . 0 0 "[ . 1 . 2]" 1
561 1 34 VAL H 1 34 VAL MG1 . . 4.420 4.041 3.966 4.090 . 0 0 "[ . 1 . 2]" 1
562 1 34 VAL H 1 34 VAL MG2 . . 3.520 3.031 2.862 3.172 . 0 0 "[ . 1 . 2]" 1
563 1 34 VAL H 1 35 LYS H . . 4.560 4.316 4.240 4.417 . 0 0 "[ . 1 . 2]" 1
564 1 34 VAL H 1 90 MET HA . . 5.220 4.674 4.393 4.909 . 0 0 "[ . 1 . 2]" 1
565 1 34 VAL H 1 90 MET ME . . 3.860 2.741 2.468 3.534 . 0 0 "[ . 1 . 2]" 1
566 1 34 VAL H 1 91 PHE H . . 3.760 3.099 2.811 3.263 . 0 0 "[ . 1 . 2]" 1
567 1 34 VAL H 1 91 PHE QB . . 4.300 2.931 2.682 3.197 . 0 0 "[ . 1 . 2]" 1
568 1 34 VAL H 1 92 PHE HA . . 4.420 4.157 3.809 4.433 0.013 2 0 "[ . 1 . 2]" 1
569 1 34 VAL HA 1 34 VAL MG1 . . 3.300 2.388 2.294 2.481 . 0 0 "[ . 1 . 2]" 1
570 1 34 VAL HA 1 34 VAL MG2 . . 3.360 2.459 2.377 2.567 . 0 0 "[ . 1 . 2]" 1
571 1 34 VAL HA 1 35 LYS H . . 2.920 2.165 2.110 2.270 . 0 0 "[ . 1 . 2]" 1
572 1 34 VAL HA 1 53 GLU H . . 5.230 4.626 4.337 4.846 . 0 0 "[ . 1 . 2]" 1
573 1 34 VAL HA 1 55 VAL HB . . 5.230 4.900 4.726 5.055 . 0 0 "[ . 1 . 2]" 1
574 1 34 VAL HB 1 55 VAL H . . 5.500 5.397 5.144 5.513 0.013 18 0 "[ . 1 . 2]" 1
575 1 34 VAL HB 1 64 VAL MG1 . . 4.600 3.683 3.011 4.417 . 0 0 "[ . 1 . 2]" 1
576 1 34 VAL HB 1 64 VAL QG . . 3.600 2.829 2.301 3.466 . 0 0 "[ . 1 . 2]" 1
577 1 34 VAL HB 1 64 VAL MG2 . . 4.600 3.033 2.340 3.942 . 0 0 "[ . 1 . 2]" 1
578 1 34 VAL HB 1 91 PHE H . . 4.900 3.911 3.723 4.131 . 0 0 "[ . 1 . 2]" 1
579 1 34 VAL HB 1 91 PHE QB . . 4.520 2.455 2.271 2.649 . 0 0 "[ . 1 . 2]" 1
580 1 34 VAL HB 1 91 PHE QD . . 4.850 3.777 3.452 4.137 . 0 0 "[ . 1 . 2]" 1
581 1 34 VAL HB 1 93 PHE QE . . 4.430 3.287 2.463 4.417 . 0 0 "[ . 1 . 2]" 1
582 1 34 VAL MG1 1 35 LYS H . . 3.280 2.587 2.311 2.819 . 0 0 "[ . 1 . 2]" 1
583 1 34 VAL MG1 1 35 LYS HA . . 4.370 3.872 3.425 4.152 . 0 0 "[ . 1 . 2]" 1
584 1 34 VAL MG1 1 51 VAL HA . . 4.460 4.026 3.797 4.374 . 0 0 "[ . 1 . 2]" 1
585 1 34 VAL MG1 1 51 VAL HB . . 4.370 4.059 3.322 4.389 0.019 5 0 "[ . 1 . 2]" 1
586 1 34 VAL MG1 1 52 LEU H . . 5.140 4.225 4.015 4.574 . 0 0 "[ . 1 . 2]" 1
587 1 34 VAL MG1 1 53 GLU H . . 4.400 3.932 3.789 4.179 . 0 0 "[ . 1 . 2]" 1
588 1 34 VAL MG1 1 53 GLU HA . . 5.500 5.221 5.011 5.414 . 0 0 "[ . 1 . 2]" 1
589 1 34 VAL MG1 1 54 SER H . . 5.500 4.738 4.441 4.991 . 0 0 "[ . 1 . 2]" 1
590 1 34 VAL MG1 1 54 SER HA . . 4.250 2.794 2.475 3.136 . 0 0 "[ . 1 . 2]" 1
591 1 34 VAL MG1 1 54 SER QB . . 4.550 2.680 2.084 3.875 . 0 0 "[ . 1 . 2]" 1
592 1 34 VAL MG1 1 55 VAL H . . 5.250 4.225 3.965 4.635 . 0 0 "[ . 1 . 2]" 1
593 1 34 VAL MG1 1 61 ASP H . . 4.050 3.956 3.645 4.108 0.058 18 0 "[ . 1 . 2]" 1
594 1 34 VAL MG1 1 61 ASP HA . . 3.560 2.672 2.257 3.430 . 0 0 "[ . 1 . 2]" 1
595 1 34 VAL MG1 1 61 ASP QB . . 4.060 2.871 2.144 4.076 0.016 12 0 "[ . 1 . 2]" 1
596 1 34 VAL MG1 1 64 VAL H . . 5.500 5.083 4.598 5.528 0.028 10 0 "[ . 1 . 2]" 1
597 1 34 VAL MG1 1 64 VAL MG1 . . 3.930 3.073 2.243 3.840 . 0 0 "[ . 1 . 2]" 1
598 1 34 VAL MG1 1 64 VAL QG . . 3.120 2.683 2.225 3.059 . 0 0 "[ . 1 . 2]" 1
599 1 34 VAL MG1 1 64 VAL MG2 . . 3.930 3.206 2.439 3.952 0.022 5 0 "[ . 1 . 2]" 1
600 1 34 VAL MG1 1 91 PHE H . . 5.010 4.547 4.293 4.892 . 0 0 "[ . 1 . 2]" 1
601 1 34 VAL MG1 1 91 PHE QD . . 4.850 4.098 3.648 4.568 . 0 0 "[ . 1 . 2]" 1
602 1 34 VAL MG2 1 35 LYS H . . 4.110 4.067 3.894 4.146 0.036 18 0 "[ . 1 . 2]" 1
603 1 34 VAL MG2 1 54 SER H . . 5.500 5.069 4.770 5.413 . 0 0 "[ . 1 . 2]" 1
604 1 34 VAL MG2 1 54 SER HA . . 3.820 2.433 2.182 2.763 . 0 0 "[ . 1 . 2]" 1
605 1 34 VAL MG2 1 54 SER QB . . 5.480 2.945 2.128 3.616 . 0 0 "[ . 1 . 2]" 1
606 1 34 VAL MG2 1 55 VAL H . . 3.510 2.657 2.434 2.934 . 0 0 "[ . 1 . 2]" 1
607 1 34 VAL MG2 1 55 VAL HB . . 4.460 4.499 4.481 4.518 0.058 17 0 "[ . 1 . 2]" 1
608 1 34 VAL MG2 1 60 PHE H . . 4.090 3.814 3.417 4.140 0.050 16 0 "[ . 1 . 2]" 1
609 1 34 VAL MG2 1 60 PHE HA . . 5.420 4.180 3.864 4.745 . 0 0 "[ . 1 . 2]" 1
610 1 34 VAL MG2 1 60 PHE QB . . 3.270 2.019 1.906 2.148 . 0 0 "[ . 1 . 2]" 1
611 1 34 VAL MG2 1 60 PHE QD . . 4.040 3.264 2.235 3.729 . 0 0 "[ . 1 . 2]" 1
612 1 34 VAL MG2 1 61 ASP H . . 4.230 3.351 2.791 4.117 . 0 0 "[ . 1 . 2]" 1
613 1 34 VAL MG2 1 61 ASP HA . . 4.440 3.330 2.721 4.481 0.041 2 0 "[ . 1 . 2]" 1
614 1 34 VAL MG2 1 61 ASP HB2 . . 5.500 4.022 3.025 5.424 . 0 0 "[ . 1 . 2]" 1
615 1 34 VAL MG2 1 61 ASP QB . . 4.700 3.650 2.899 4.730 0.030 12 0 "[ . 1 . 2]" 1
616 1 34 VAL MG2 1 61 ASP HB3 . . 5.500 4.390 2.949 5.514 0.014 18 0 "[ . 1 . 2]" 1
617 1 34 VAL MG2 1 93 PHE QE . . 5.320 2.960 2.363 3.820 . 0 0 "[ . 1 . 2]" 1
618 1 35 LYS H 1 35 LYS QB . . 3.200 2.458 2.352 2.703 . 0 0 "[ . 1 . 2]" 1
619 1 35 LYS H 1 35 LYS QG . . 4.660 4.008 2.985 4.195 . 0 0 "[ . 1 . 2]" 1
620 1 35 LYS H 1 51 VAL QG . . 4.440 3.196 2.849 3.559 . 0 0 "[ . 1 . 2]" 1
621 1 35 LYS H 1 53 GLU H . . 3.590 2.910 2.691 3.089 . 0 0 "[ . 1 . 2]" 1
622 1 35 LYS H 1 53 GLU QB . . 4.250 3.426 2.821 4.293 0.043 17 0 "[ . 1 . 2]" 1
623 1 35 LYS H 1 90 MET ME . . 4.790 3.501 3.181 4.043 . 0 0 "[ . 1 . 2]" 1
624 1 35 LYS HA 1 35 LYS QD . . 4.710 2.644 2.130 3.936 . 0 0 "[ . 1 . 2]" 1
625 1 35 LYS HA 1 35 LYS QG . . 3.900 2.647 2.177 3.121 . 0 0 "[ . 1 . 2]" 1
626 1 35 LYS HA 1 36 VAL H . . 2.930 2.140 2.066 2.211 . 0 0 "[ . 1 . 2]" 1
627 1 35 LYS HA 1 36 VAL QG . . 3.760 3.464 2.923 3.908 0.148 12 0 "[ . 1 . 2]" 1
628 1 35 LYS HA 1 53 GLU H . . 5.350 4.832 4.628 5.035 . 0 0 "[ . 1 . 2]" 1
629 1 35 LYS HA 1 89 LYS H . . 4.980 4.638 4.214 4.868 . 0 0 "[ . 1 . 2]" 1
630 1 35 LYS HA 1 90 MET H . . 5.500 5.021 4.705 5.163 . 0 0 "[ . 1 . 2]" 1
631 1 35 LYS HA 1 90 MET HA . . 3.410 2.604 2.417 2.752 . 0 0 "[ . 1 . 2]" 1
632 1 35 LYS HA 1 90 MET ME . . 4.090 2.726 2.379 3.218 . 0 0 "[ . 1 . 2]" 1
633 1 35 LYS HA 1 91 PHE H . . 3.780 3.412 3.143 3.814 0.034 15 0 "[ . 1 . 2]" 1
634 1 35 LYS QB 1 35 LYS QE . . 4.390 3.392 2.148 3.957 . 0 0 "[ . 1 . 2]" 1
635 1 35 LYS QB 1 36 VAL H . . 4.120 3.726 3.058 4.050 . 0 0 "[ . 1 . 2]" 1
636 1 35 LYS HB2 1 36 VAL H . . 4.710 4.374 4.062 4.639 . 0 0 "[ . 1 . 2]" 1
637 1 35 LYS HB3 1 36 VAL H . . 4.710 4.068 3.140 4.483 . 0 0 "[ . 1 . 2]" 1
638 1 35 LYS QD 1 36 VAL H . . 4.230 3.187 2.274 4.321 0.091 7 0 "[ . 1 . 2]" 1
639 1 35 LYS QD 1 88 THR HB . . 5.000 3.714 2.249 5.015 0.015 17 0 "[ . 1 . 2]" 1
640 1 35 LYS QD 1 90 MET HA . . 4.430 3.211 2.329 4.451 0.021 17 0 "[ . 1 . 2]" 1
641 1 35 LYS QE 1 35 LYS QG . . 3.400 2.431 2.118 2.898 . 0 0 "[ . 1 . 2]" 1
642 1 35 LYS QE 1 36 VAL H . . 5.050 4.285 3.645 5.053 0.003 4 0 "[ . 1 . 2]" 1
643 1 35 LYS QE 1 88 THR HB . . 4.400 3.149 2.127 4.408 0.008 19 0 "[ . 1 . 2]" 1
644 1 35 LYS QE 1 88 THR MG . . 4.030 3.522 2.485 4.057 0.027 20 0 "[ . 1 . 2]" 1
645 1 35 LYS QE 1 90 MET QB . . 4.940 3.508 2.147 4.942 0.002 19 0 "[ . 1 . 2]" 1
646 1 35 LYS QE 1 90 MET ME . . 4.250 4.195 3.525 4.290 0.040 7 0 "[ . 1 . 2]" 1
647 1 35 LYS QG 1 36 VAL H . . 4.300 3.356 2.240 4.404 0.104 11 0 "[ . 1 . 2]" 1
648 1 35 LYS QG 1 90 MET HA . . 4.640 3.788 2.504 4.788 0.148 3 0 "[ . 1 . 2]" 1
649 1 36 VAL H 1 36 VAL MG1 . . 4.030 2.906 2.247 4.005 . 0 0 "[ . 1 . 2]" 1
650 1 36 VAL H 1 36 VAL QG . . 2.960 2.334 2.004 2.586 . 0 0 "[ . 1 . 2]" 1
651 1 36 VAL H 1 36 VAL MG2 . . 4.030 2.970 2.062 4.039 0.009 6 0 "[ . 1 . 2]" 1
652 1 36 VAL H 1 89 LYS H . . 3.590 3.072 2.860 3.297 . 0 0 "[ . 1 . 2]" 1
653 1 36 VAL H 1 90 MET H . . 5.500 5.103 4.821 5.397 . 0 0 "[ . 1 . 2]" 1
654 1 36 VAL H 1 90 MET HA . . 4.200 3.727 3.442 4.096 . 0 0 "[ . 1 . 2]" 1
655 1 36 VAL H 1 90 MET ME . . 4.760 4.524 4.235 4.826 0.066 3 0 "[ . 1 . 2]" 1
656 1 36 VAL H 1 91 PHE H . . 4.880 4.510 4.082 4.935 0.055 7 0 "[ . 1 . 2]" 1
657 1 36 VAL HA 1 36 VAL QG . . 3.020 2.270 2.115 2.392 . 0 0 "[ . 1 . 2]" 1
658 1 36 VAL HA 1 37 LEU H . . 2.940 2.179 2.118 2.237 . 0 0 "[ . 1 . 2]" 1
659 1 36 VAL HA 1 37 LEU HB2 . . 5.270 4.468 4.244 4.687 . 0 0 "[ . 1 . 2]" 1
660 1 36 VAL HA 1 37 LEU QB . . 4.400 3.868 3.745 4.073 . 0 0 "[ . 1 . 2]" 1
661 1 36 VAL HA 1 37 LEU HB3 . . 5.270 4.241 4.060 4.473 . 0 0 "[ . 1 . 2]" 1
662 1 36 VAL HA 1 49 ILE MG . . 5.170 4.734 4.411 5.147 . 0 0 "[ . 1 . 2]" 1
663 1 36 VAL HA 1 51 VAL HA . . 3.530 2.437 2.294 2.567 . 0 0 "[ . 1 . 2]" 1
664 1 36 VAL HA 1 51 VAL MG1 . . 5.250 4.745 3.228 5.265 0.015 18 0 "[ . 1 . 2]" 1
665 1 36 VAL HA 1 51 VAL QG . . 4.290 3.313 2.449 3.762 . 0 0 "[ . 1 . 2]" 1
666 1 36 VAL HA 1 51 VAL MG2 . . 5.250 3.427 2.456 3.853 . 0 0 "[ . 1 . 2]" 1
667 1 36 VAL HA 1 52 LEU H . . 3.630 3.013 2.772 3.265 . 0 0 "[ . 1 . 2]" 1
668 1 36 VAL HA 1 52 LEU MD1 . . 5.340 4.160 3.671 4.914 . 0 0 "[ . 1 . 2]" 1
669 1 36 VAL HA 1 52 LEU QD . . 4.260 3.894 3.497 4.497 0.237 4 0 "[ . 1 . 2]" 1
670 1 36 VAL HA 1 52 LEU MD2 . . 5.340 4.757 4.175 5.338 . 0 0 "[ . 1 . 2]" 1
671 1 36 VAL HA 1 52 LEU HG . . 4.070 3.388 2.855 4.052 . 0 0 "[ . 1 . 2]" 1
672 1 36 VAL HA 1 53 GLU H . . 4.940 4.711 4.368 4.965 0.025 8 0 "[ . 1 . 2]" 1
673 1 36 VAL HB 1 37 LEU H . . 4.210 3.389 2.537 4.169 . 0 0 "[ . 1 . 2]" 1
674 1 36 VAL HB 1 49 ILE MG . . 4.770 3.754 2.578 4.712 . 0 0 "[ . 1 . 2]" 1
675 1 36 VAL HB 1 64 VAL QG . . 5.030 3.628 2.610 4.509 . 0 0 "[ . 1 . 2]" 1
676 1 36 VAL QG 1 37 LEU H . . 4.200 2.764 2.213 3.334 . 0 0 "[ . 1 . 2]" 1
677 1 36 VAL QG 1 37 LEU HA . . 4.830 3.792 3.542 4.042 . 0 0 "[ . 1 . 2]" 1
678 1 36 VAL QG 1 38 PHE QD . . 3.600 2.393 2.252 2.742 . 0 0 "[ . 1 . 2]" 1
679 1 36 VAL QG 1 38 PHE QE . . 4.150 2.622 2.239 3.944 . 0 0 "[ . 1 . 2]" 1
680 1 36 VAL QG 1 51 VAL HA . . 4.030 2.704 2.351 3.347 . 0 0 "[ . 1 . 2]" 1
681 1 36 VAL QG 1 64 VAL QG . . 2.890 2.153 1.924 2.549 . 0 0 "[ . 1 . 2]" 1
682 1 36 VAL QG 1 68 MET ME . . 3.170 2.494 1.916 3.297 0.127 8 0 "[ . 1 . 2]" 1
683 1 36 VAL QG 1 88 THR HB . . 5.110 4.528 4.247 5.268 0.158 2 0 "[ . 1 . 2]" 1
684 1 36 VAL QG 1 89 LYS H . . 4.160 3.156 2.730 4.183 0.023 18 0 "[ . 1 . 2]" 1
685 1 36 VAL QG 1 89 LYS QB . . 3.720 2.565 2.078 3.970 0.250 18 0 "[ . 1 . 2]" 1
686 1 36 VAL QG 1 90 MET HA . . 4.790 4.308 3.826 4.694 . 0 0 "[ . 1 . 2]" 1
687 1 36 VAL QG 1 91 PHE QD . . 3.840 2.655 2.191 3.116 . 0 0 "[ . 1 . 2]" 1
688 1 36 VAL QG 1 91 PHE QE . . 3.770 2.710 2.247 3.525 . 0 0 "[ . 1 . 2]" 1
689 1 36 VAL MG1 1 38 PHE QD . . 4.840 3.504 2.286 4.838 . 0 0 "[ . 1 . 2]" 1
690 1 36 VAL MG1 1 91 PHE QE . . 5.240 3.512 2.336 4.804 . 0 0 "[ . 1 . 2]" 1
691 1 36 VAL MG2 1 38 PHE QD . . 4.840 2.972 2.282 4.651 . 0 0 "[ . 1 . 2]" 1
692 1 36 VAL MG2 1 91 PHE QE . . 5.240 3.454 2.271 5.241 0.001 1 0 "[ . 1 . 2]" 1
693 1 37 LEU H 1 37 LEU HB2 . . 3.690 3.166 3.069 3.318 . 0 0 "[ . 1 . 2]" 1
694 1 37 LEU H 1 37 LEU QB . . 3.130 2.398 2.328 2.473 . 0 0 "[ . 1 . 2]" 1
695 1 37 LEU H 1 37 LEU HB3 . . 3.690 2.485 2.398 2.579 . 0 0 "[ . 1 . 2]" 1
696 1 37 LEU H 1 37 LEU MD1 . . 4.580 4.519 3.913 4.620 0.040 10 0 "[ . 1 . 2]" 1
697 1 37 LEU H 1 37 LEU MD2 . . 4.580 4.214 3.899 4.488 . 0 0 "[ . 1 . 2]" 1
698 1 37 LEU H 1 37 LEU HG . . 4.770 4.422 4.194 4.791 0.021 15 0 "[ . 1 . 2]" 1
699 1 37 LEU H 1 38 PHE H . . 4.760 4.427 4.377 4.487 . 0 0 "[ . 1 . 2]" 1
700 1 37 LEU H 1 50 GLN H . . 3.830 3.048 2.954 3.174 . 0 0 "[ . 1 . 2]" 1
701 1 37 LEU H 1 50 GLN HB2 . . 5.500 5.231 5.084 5.333 . 0 0 "[ . 1 . 2]" 1
702 1 37 LEU H 1 50 GLN HB3 . . 5.500 5.486 5.332 5.553 0.053 3 0 "[ . 1 . 2]" 1
703 1 37 LEU H 1 50 GLN QG . . 4.710 3.227 2.981 3.484 . 0 0 "[ . 1 . 2]" 1
704 1 37 LEU H 1 51 VAL HA . . 4.120 3.521 3.000 3.757 . 0 0 "[ . 1 . 2]" 1
705 1 37 LEU H 1 52 LEU QD . . 4.440 3.749 3.505 4.115 . 0 0 "[ . 1 . 2]" 1
706 1 37 LEU H 1 52 LEU HG . . 3.770 3.458 3.069 3.786 0.016 4 0 "[ . 1 . 2]" 1
707 1 37 LEU H 1 88 THR MG . . 5.120 4.678 4.315 5.019 . 0 0 "[ . 1 . 2]" 1
708 1 37 LEU HA 1 37 LEU MD1 . . 4.530 2.886 2.337 3.596 . 0 0 "[ . 1 . 2]" 1
709 1 37 LEU HA 1 37 LEU QD . . 3.120 2.686 2.321 3.197 0.077 10 0 "[ . 1 . 2]" 1
710 1 37 LEU HA 1 37 LEU MD2 . . 4.530 3.774 2.513 4.017 . 0 0 "[ . 1 . 2]" 1
711 1 37 LEU HA 1 37 LEU HG . . 4.180 3.032 2.538 3.833 . 0 0 "[ . 1 . 2]" 1
712 1 37 LEU HA 1 38 PHE H . . 2.860 2.213 2.157 2.247 . 0 0 "[ . 1 . 2]" 1
713 1 37 LEU HA 1 38 PHE QD . . 4.660 3.256 3.088 3.436 . 0 0 "[ . 1 . 2]" 1
714 1 37 LEU HA 1 88 THR H . . 5.500 4.881 4.731 5.041 . 0 0 "[ . 1 . 2]" 1
715 1 37 LEU HA 1 88 THR HA . . 3.440 2.448 2.312 2.625 . 0 0 "[ . 1 . 2]" 1
716 1 37 LEU HA 1 88 THR HB . . 4.590 3.518 3.179 3.881 . 0 0 "[ . 1 . 2]" 1
717 1 37 LEU HA 1 88 THR MG . . 3.330 2.510 2.139 3.003 . 0 0 "[ . 1 . 2]" 1
718 1 37 LEU HA 1 89 LYS H . . 4.240 3.952 3.773 4.163 . 0 0 "[ . 1 . 2]" 1
719 1 37 LEU QB 1 37 LEU QD . . 2.770 1.947 1.908 2.101 . 0 0 "[ . 1 . 2]" 1
720 1 37 LEU QB 1 88 THR HA . . 5.340 4.091 3.772 4.470 . 0 0 "[ . 1 . 2]" 1
721 1 37 LEU HB2 1 38 PHE H . . 4.920 4.056 3.944 4.207 . 0 0 "[ . 1 . 2]" 1
722 1 37 LEU HB3 1 38 PHE H . . 4.920 4.167 4.037 4.259 . 0 0 "[ . 1 . 2]" 1
723 1 37 LEU QD 1 38 PHE H . . 3.700 2.549 2.065 3.047 . 0 0 "[ . 1 . 2]" 1
724 1 37 LEU QD 1 50 GLN QE . . 4.010 2.875 2.182 3.899 . 0 0 "[ . 1 . 2]" 1
725 1 37 LEU QD 1 50 GLN QG . . 4.050 2.450 2.188 2.643 . 0 0 "[ . 1 . 2]" 1
726 1 37 LEU QD 1 86 GLN HA . . 4.600 4.096 3.561 4.639 0.039 11 0 "[ . 1 . 2]" 1
727 1 37 LEU QD 1 86 GLN QB . . 5.280 2.961 2.217 4.235 . 0 0 "[ . 1 . 2]" 1
728 1 37 LEU QD 1 86 GLN QE . . 3.250 2.554 1.917 3.110 . 0 0 "[ . 1 . 2]" 1
729 1 37 LEU QD 1 86 GLN QG . . 4.810 3.397 2.068 4.091 . 0 0 "[ . 1 . 2]" 1
730 1 37 LEU QD 1 87 ALA H . . 4.030 3.301 2.599 4.131 0.101 11 0 "[ . 1 . 2]" 1
731 1 37 LEU QD 1 87 ALA HA . . 5.440 4.310 3.632 5.126 . 0 0 "[ . 1 . 2]" 1
732 1 37 LEU QD 1 88 THR MG . . 2.920 2.157 1.925 2.394 . 0 0 "[ . 1 . 2]" 1
733 1 37 LEU MD1 1 86 GLN HE21 . . 4.380 3.485 2.750 4.395 0.015 20 0 "[ . 1 . 2]" 1
734 1 37 LEU MD1 1 86 GLN HE22 . . 4.380 3.669 2.466 4.401 0.021 12 0 "[ . 1 . 2]" 1
735 1 37 LEU MD1 1 87 ALA H . . 5.500 3.623 2.606 4.737 . 0 0 "[ . 1 . 2]" 1
736 1 37 LEU MD2 1 86 GLN HE21 . . 4.380 3.714 2.083 4.408 0.028 16 0 "[ . 1 . 2]" 1
737 1 37 LEU MD2 1 86 GLN HE22 . . 4.380 3.242 2.270 4.405 0.025 17 0 "[ . 1 . 2]" 1
738 1 37 LEU MD2 1 87 ALA H . . 5.500 4.863 2.717 5.513 0.013 8 0 "[ . 1 . 2]" 1
739 1 37 LEU HG 1 50 GLN QE . . 5.120 4.547 2.854 5.155 0.035 20 0 "[ . 1 . 2]" 1
740 1 37 LEU HG 1 86 GLN HE21 . . 4.830 3.694 3.214 4.586 . 0 0 "[ . 1 . 2]" 1
741 1 37 LEU HG 1 86 GLN QE . . 4.180 3.182 2.558 4.198 0.018 15 0 "[ . 1 . 2]" 1
742 1 37 LEU HG 1 86 GLN HE22 . . 4.830 3.654 2.611 4.868 0.038 15 0 "[ . 1 . 2]" 1
743 1 37 LEU HG 1 88 THR HA . . 5.420 5.053 4.003 5.488 0.068 2 0 "[ . 1 . 2]" 1
744 1 38 PHE H 1 38 PHE QE . . 5.050 4.279 4.153 4.401 . 0 0 "[ . 1 . 2]" 1
745 1 38 PHE H 1 39 THR H . . 4.840 4.474 4.443 4.502 . 0 0 "[ . 1 . 2]" 1
746 1 38 PHE H 1 46 ILE MG . . 5.290 5.178 5.043 5.309 0.019 17 0 "[ . 1 . 2]" 1
747 1 38 PHE H 1 88 THR HA . . 3.720 3.529 3.416 3.661 . 0 0 "[ . 1 . 2]" 1
748 1 38 PHE H 1 88 THR HB . . 5.500 5.303 5.017 5.522 0.022 3 0 "[ . 1 . 2]" 1
749 1 38 PHE H 1 88 THR MG . . 4.410 3.700 3.321 4.196 . 0 0 "[ . 1 . 2]" 1
750 1 38 PHE HA 1 38 PHE QD . . 4.300 3.709 3.657 3.737 . 0 0 "[ . 1 . 2]" 1
751 1 38 PHE HA 1 39 THR H . . 3.210 2.405 2.300 2.486 . 0 0 "[ . 1 . 2]" 1
752 1 38 PHE HA 1 39 THR HB . . 4.840 4.736 4.578 4.877 0.037 11 0 "[ . 1 . 2]" 1
753 1 38 PHE HA 1 46 ILE MG . . 4.360 4.228 4.071 4.343 . 0 0 "[ . 1 . 2]" 1
754 1 38 PHE HA 1 49 ILE HA . . 3.610 2.706 2.508 2.920 . 0 0 "[ . 1 . 2]" 1
755 1 38 PHE HA 1 49 ILE QG . . 4.690 3.746 3.614 3.821 . 0 0 "[ . 1 . 2]" 1
756 1 38 PHE HA 1 49 ILE MG . . 4.650 4.346 3.946 4.672 0.022 20 0 "[ . 1 . 2]" 1
757 1 38 PHE HA 1 50 GLN H . . 4.260 3.757 3.582 3.943 . 0 0 "[ . 1 . 2]" 1
758 1 38 PHE QB 1 46 ILE MG . . 3.310 2.160 2.037 2.274 . 0 0 "[ . 1 . 2]" 1
759 1 38 PHE QB 1 47 ASP H . . 5.340 3.233 3.004 3.428 . 0 0 "[ . 1 . 2]" 1
760 1 38 PHE QB 1 49 ILE H . . 5.030 4.043 3.793 4.385 . 0 0 "[ . 1 . 2]" 1
761 1 38 PHE QB 1 49 ILE HA . . 3.630 2.437 2.319 2.550 . 0 0 "[ . 1 . 2]" 1
762 1 38 PHE QB 1 49 ILE MD . . 4.060 3.663 3.261 3.855 . 0 0 "[ . 1 . 2]" 1
763 1 38 PHE QB 1 49 ILE QG . . 3.720 2.257 2.092 2.377 . 0 0 "[ . 1 . 2]" 1
764 1 38 PHE QB 1 49 ILE MG . . 3.970 2.914 2.481 3.348 . 0 0 "[ . 1 . 2]" 1
765 1 38 PHE QB 1 50 GLN H . . 4.740 3.785 3.663 3.893 . 0 0 "[ . 1 . 2]" 1
766 1 38 PHE QB 1 68 MET ME . . 5.340 3.521 2.552 4.491 . 0 0 "[ . 1 . 2]" 1
767 1 38 PHE QB 1 87 ALA MB . . 5.190 4.666 4.375 4.935 . 0 0 "[ . 1 . 2]" 1
768 1 38 PHE HB2 1 39 THR H . . 3.940 2.342 2.155 2.472 . 0 0 "[ . 1 . 2]" 1
769 1 38 PHE HB2 1 46 ILE MG . . 3.840 2.225 2.094 2.346 . 0 0 "[ . 1 . 2]" 1
770 1 38 PHE HB2 1 49 ILE HA . . 4.310 3.682 3.516 3.901 . 0 0 "[ . 1 . 2]" 1
771 1 38 PHE HB2 1 49 ILE MD . . 4.620 4.297 3.931 4.481 . 0 0 "[ . 1 . 2]" 1
772 1 38 PHE HB2 1 49 ILE HG12 . . 4.810 3.013 2.773 3.319 . 0 0 "[ . 1 . 2]" 1
773 1 38 PHE HB2 1 49 ILE HG13 . . 4.810 3.861 3.405 4.528 . 0 0 "[ . 1 . 2]" 1
774 1 38 PHE HB2 1 50 GLN H . . 5.470 5.361 5.247 5.482 0.012 20 0 "[ . 1 . 2]" 1
775 1 38 PHE HB3 1 39 THR H . . 3.940 3.518 3.372 3.639 . 0 0 "[ . 1 . 2]" 1
776 1 38 PHE HB3 1 46 ILE MG . . 3.840 2.923 2.785 3.074 . 0 0 "[ . 1 . 2]" 1
777 1 38 PHE HB3 1 49 ILE HA . . 4.310 2.473 2.349 2.596 . 0 0 "[ . 1 . 2]" 1
778 1 38 PHE HB3 1 49 ILE MD . . 4.620 3.974 3.483 4.229 . 0 0 "[ . 1 . 2]" 1
779 1 38 PHE HB3 1 49 ILE HG12 . . 4.810 2.392 2.191 2.556 . 0 0 "[ . 1 . 2]" 1
780 1 38 PHE HB3 1 49 ILE HG13 . . 4.810 3.663 3.135 4.244 . 0 0 "[ . 1 . 2]" 1
781 1 38 PHE HB3 1 50 GLN H . . 5.470 3.869 3.739 3.983 . 0 0 "[ . 1 . 2]" 1
782 1 38 PHE QD 1 40 ILE HG12 . . 4.590 3.403 3.012 3.665 . 0 0 "[ . 1 . 2]" 1
783 1 38 PHE QD 1 40 ILE QG . . 3.960 2.593 2.428 2.887 . 0 0 "[ . 1 . 2]" 1
784 1 38 PHE QD 1 40 ILE HG13 . . 4.590 2.695 2.500 3.120 . 0 0 "[ . 1 . 2]" 1
785 1 38 PHE QD 1 46 ILE MD . . 3.470 2.952 2.704 3.163 . 0 0 "[ . 1 . 2]" 1
786 1 38 PHE QD 1 46 ILE MG . . 3.530 2.436 2.295 2.709 . 0 0 "[ . 1 . 2]" 1
787 1 38 PHE QD 1 68 MET ME . . 3.460 2.828 2.267 3.339 . 0 0 "[ . 1 . 2]" 1
788 1 38 PHE QD 1 87 ALA MB . . 4.330 3.074 2.821 3.351 . 0 0 "[ . 1 . 2]" 1
789 1 38 PHE QD 1 88 THR HA . . 4.580 3.711 3.402 4.051 . 0 0 "[ . 1 . 2]" 1
790 1 38 PHE QE 1 40 ILE HG12 . . 4.370 3.043 2.601 3.645 . 0 0 "[ . 1 . 2]" 1
791 1 38 PHE QE 1 40 ILE QG . . 3.700 2.652 2.378 3.229 . 0 0 "[ . 1 . 2]" 1
792 1 38 PHE QE 1 40 ILE HG13 . . 4.370 2.934 2.631 3.606 . 0 0 "[ . 1 . 2]" 1
793 1 38 PHE QE 1 40 ILE MG . . 5.500 4.876 4.530 5.368 . 0 0 "[ . 1 . 2]" 1
794 1 38 PHE QE 1 46 ILE MD . . 3.420 3.074 2.806 3.428 0.008 8 0 "[ . 1 . 2]" 1
795 1 38 PHE QE 1 46 ILE MG . . 4.440 3.729 3.560 3.982 . 0 0 "[ . 1 . 2]" 1
796 1 38 PHE QE 1 68 MET ME . . 3.320 2.765 2.305 3.324 0.004 10 0 "[ . 1 . 2]" 1
797 1 38 PHE QE 1 87 ALA MB . . 3.240 2.362 2.239 2.479 . 0 0 "[ . 1 . 2]" 1
798 1 38 PHE QE 1 88 THR HA . . 4.060 2.873 2.644 3.215 . 0 0 "[ . 1 . 2]" 1
799 1 38 PHE QE 1 88 THR HB . . 5.500 4.570 4.252 4.844 . 0 0 "[ . 1 . 2]" 1
800 1 38 PHE QE 1 89 LYS HA . . 4.720 4.244 4.044 4.496 . 0 0 "[ . 1 . 2]" 1
801 1 38 PHE QE 1 89 LYS HB2 . . 3.800 2.536 2.139 3.077 . 0 0 "[ . 1 . 2]" 1
802 1 38 PHE QE 1 89 LYS HB3 . . 3.800 2.720 2.210 3.832 0.032 17 0 "[ . 1 . 2]" 1
803 1 38 PHE QE 1 89 LYS QD . . 5.340 4.910 4.025 5.351 0.011 18 0 "[ . 1 . 2]" 1
804 1 38 PHE QE 1 89 LYS HG2 . . 4.990 4.298 3.629 4.763 . 0 0 "[ . 1 . 2]" 1
805 1 38 PHE QE 1 89 LYS HG3 . . 4.990 4.612 3.832 5.001 0.011 9 0 "[ . 1 . 2]" 1
806 1 39 THR H 1 39 THR HB . . 3.260 2.554 2.413 2.666 . 0 0 "[ . 1 . 2]" 1
807 1 39 THR H 1 39 THR MG . . 3.960 3.850 3.774 3.905 . 0 0 "[ . 1 . 2]" 1
808 1 39 THR H 1 46 ILE MG . . 3.870 3.674 3.383 3.874 0.004 6 0 "[ . 1 . 2]" 1
809 1 39 THR H 1 47 ASP H . . 3.730 3.098 2.976 3.228 . 0 0 "[ . 1 . 2]" 1
810 1 39 THR H 1 48 ASP HB2 . . 4.280 3.018 2.390 4.312 0.032 12 0 "[ . 1 . 2]" 1
811 1 39 THR H 1 48 ASP QB . . 3.690 2.681 2.338 3.261 . 0 0 "[ . 1 . 2]" 1
812 1 39 THR H 1 48 ASP HB3 . . 4.280 3.821 2.353 4.307 0.027 1 0 "[ . 1 . 2]" 1
813 1 39 THR H 1 49 ILE H . . 5.410 4.546 4.319 4.861 . 0 0 "[ . 1 . 2]" 1
814 1 39 THR H 1 49 ILE HA . . 4.690 4.312 4.084 4.587 . 0 0 "[ . 1 . 2]" 1
815 1 39 THR H 1 49 ILE MD . . 5.500 5.457 5.239 5.530 0.030 20 0 "[ . 1 . 2]" 1
816 1 39 THR H 1 86 GLN QE . . 5.190 3.706 3.422 4.198 . 0 0 "[ . 1 . 2]" 1
817 1 39 THR HA 1 39 THR MG . . 3.390 2.421 2.297 2.501 . 0 0 "[ . 1 . 2]" 1
818 1 39 THR HA 1 40 ILE H . . 3.040 2.141 2.096 2.168 . 0 0 "[ . 1 . 2]" 1
819 1 39 THR HA 1 85 ARG H . . 5.000 4.386 4.179 4.604 . 0 0 "[ . 1 . 2]" 1
820 1 39 THR HA 1 86 GLN HA . . 3.310 2.377 2.238 2.585 . 0 0 "[ . 1 . 2]" 1
821 1 39 THR HA 1 87 ALA H . . 4.150 3.630 3.487 3.817 . 0 0 "[ . 1 . 2]" 1
822 1 39 THR HB 1 41 THR MG . . 4.390 3.799 2.981 4.405 0.015 9 0 "[ . 1 . 2]" 1
823 1 39 THR HB 1 47 ASP H . . 4.080 3.598 3.195 3.844 . 0 0 "[ . 1 . 2]" 1
824 1 39 THR HB 1 47 ASP HB2 . . 4.940 4.421 3.751 4.796 . 0 0 "[ . 1 . 2]" 1
825 1 39 THR HB 1 47 ASP QB . . 4.110 2.749 2.391 3.169 . 0 0 "[ . 1 . 2]" 1
826 1 39 THR HB 1 47 ASP HB3 . . 4.940 2.785 2.406 3.416 . 0 0 "[ . 1 . 2]" 1
827 1 39 THR HB 1 48 ASP HB2 . . 4.040 2.661 2.354 4.020 . 0 0 "[ . 1 . 2]" 1
828 1 39 THR HB 1 48 ASP QB . . 3.370 2.490 2.209 3.378 0.008 11 0 "[ . 1 . 2]" 1
829 1 39 THR HB 1 48 ASP HB3 . . 4.040 3.828 2.256 4.092 0.052 17 0 "[ . 1 . 2]" 1
830 1 39 THR MG 1 40 ILE H . . 3.330 2.772 2.645 2.974 . 0 0 "[ . 1 . 2]" 1
831 1 39 THR MG 1 41 THR H . . 4.150 3.930 3.511 4.174 0.024 2 0 "[ . 1 . 2]" 1
832 1 39 THR MG 1 41 THR HA . . 3.700 3.093 2.623 3.427 . 0 0 "[ . 1 . 2]" 1
833 1 39 THR MG 1 42 SER H . . 5.390 4.838 4.470 5.226 . 0 0 "[ . 1 . 2]" 1
834 1 39 THR MG 1 47 ASP H . . 4.810 4.213 3.919 4.525 . 0 0 "[ . 1 . 2]" 1
835 1 39 THR MG 1 47 ASP QB . . 4.280 3.318 3.026 3.742 . 0 0 "[ . 1 . 2]" 1
836 1 39 THR MG 1 48 ASP QB . . 4.620 3.810 3.609 4.234 . 0 0 "[ . 1 . 2]" 1
837 1 39 THR MG 1 84 ALA HA . . 4.560 4.063 3.659 4.509 . 0 0 "[ . 1 . 2]" 1
838 1 39 THR MG 1 84 ALA MB . . 3.330 2.807 2.493 3.168 . 0 0 "[ . 1 . 2]" 1
839 1 39 THR MG 1 85 ARG H . . 3.570 3.127 2.726 3.507 . 0 0 "[ . 1 . 2]" 1
840 1 39 THR MG 1 85 ARG HA . . 4.180 4.070 3.644 4.204 0.024 11 0 "[ . 1 . 2]" 1
841 1 39 THR MG 1 86 GLN HA . . 4.570 3.784 3.391 4.016 . 0 0 "[ . 1 . 2]" 1
842 1 39 THR MG 1 86 GLN HE21 . . 5.000 4.378 3.923 4.731 . 0 0 "[ . 1 . 2]" 1
843 1 39 THR MG 1 86 GLN QE . . 4.220 4.008 3.377 4.237 0.017 12 0 "[ . 1 . 2]" 1
844 1 39 THR MG 1 86 GLN HE22 . . 5.000 4.745 3.501 5.032 0.032 16 0 "[ . 1 . 2]" 1
845 1 40 ILE H 1 40 ILE HB . . 3.420 2.417 2.308 2.534 . 0 0 "[ . 1 . 2]" 1
846 1 40 ILE H 1 40 ILE MD . . 4.290 3.553 3.403 3.722 . 0 0 "[ . 1 . 2]" 1
847 1 40 ILE H 1 40 ILE HG12 . . 4.460 3.849 3.668 3.972 . 0 0 "[ . 1 . 2]" 1
848 1 40 ILE H 1 40 ILE QG . . 3.590 2.504 2.339 2.640 . 0 0 "[ . 1 . 2]" 1
849 1 40 ILE H 1 40 ILE HG13 . . 4.460 2.537 2.366 2.680 . 0 0 "[ . 1 . 2]" 1
850 1 40 ILE H 1 40 ILE MG . . 4.090 3.789 3.750 3.829 . 0 0 "[ . 1 . 2]" 1
851 1 40 ILE H 1 84 ALA HA . . 4.830 4.753 4.592 4.858 0.028 19 0 "[ . 1 . 2]" 1
852 1 40 ILE H 1 85 ARG H . . 3.560 3.032 2.881 3.150 . 0 0 "[ . 1 . 2]" 1
853 1 40 ILE H 1 86 GLN HA . . 4.160 3.470 3.272 3.638 . 0 0 "[ . 1 . 2]" 1
854 1 40 ILE H 1 87 ALA MB . . 4.570 3.976 3.757 4.234 . 0 0 "[ . 1 . 2]" 1
855 1 40 ILE HA 1 40 ILE MG . . 3.340 2.473 2.387 2.561 . 0 0 "[ . 1 . 2]" 1
856 1 40 ILE HA 1 41 THR H . . 2.980 2.215 2.177 2.243 . 0 0 "[ . 1 . 2]" 1
857 1 40 ILE HA 1 46 ILE MD . . 3.680 2.794 2.548 3.083 . 0 0 "[ . 1 . 2]" 1
858 1 40 ILE HA 1 47 ASP H . . 4.650 3.879 3.673 4.038 . 0 0 "[ . 1 . 2]" 1
859 1 40 ILE HB 1 40 ILE MD . . 3.250 2.341 2.281 2.388 . 0 0 "[ . 1 . 2]" 1
860 1 40 ILE HB 1 41 THR H . . 4.480 4.306 4.224 4.406 . 0 0 "[ . 1 . 2]" 1
861 1 40 ILE HB 1 84 ALA HA . . 3.930 3.832 3.572 3.994 0.064 5 0 "[ . 1 . 2]" 1
862 1 40 ILE HB 1 85 ARG H . . 3.540 2.713 2.485 2.919 . 0 0 "[ . 1 . 2]" 1
863 1 40 ILE MD 1 40 ILE MG . . 2.990 2.129 2.108 2.153 . 0 0 "[ . 1 . 2]" 1
864 1 40 ILE MD 1 85 ARG H . . 4.730 4.237 3.758 4.397 . 0 0 "[ . 1 . 2]" 1
865 1 40 ILE MD 1 85 ARG HA . . 5.500 5.448 5.018 5.523 0.023 18 0 "[ . 1 . 2]" 1
866 1 40 ILE MD 1 87 ALA MB . . 3.230 2.160 2.090 2.277 . 0 0 "[ . 1 . 2]" 1
867 1 40 ILE QG 1 46 ILE MD . . 3.600 2.570 2.262 3.094 . 0 0 "[ . 1 . 2]" 1
868 1 40 ILE MG 1 41 THR H . . 3.450 2.908 2.753 3.227 . 0 0 "[ . 1 . 2]" 1
869 1 40 ILE MG 1 44 GLY H . . 4.580 4.172 3.711 4.582 0.002 20 0 "[ . 1 . 2]" 1
870 1 40 ILE MG 1 45 ARG H . . 4.520 4.421 3.995 4.549 0.029 20 0 "[ . 1 . 2]" 1
871 1 40 ILE MG 1 46 ILE MD . . 3.500 3.070 2.834 3.469 . 0 0 "[ . 1 . 2]" 1
872 1 40 ILE MG 1 73 PHE HB2 . . 5.200 3.747 3.472 4.094 . 0 0 "[ . 1 . 2]" 1
873 1 40 ILE MG 1 73 PHE QB . . 4.340 3.575 3.316 3.876 . 0 0 "[ . 1 . 2]" 1
874 1 40 ILE MG 1 73 PHE HB3 . . 5.200 4.529 4.128 4.902 . 0 0 "[ . 1 . 2]" 1
875 1 40 ILE MG 1 73 PHE QD . . 5.500 4.357 3.932 4.642 . 0 0 "[ . 1 . 2]" 1
876 1 40 ILE MG 1 85 ARG H . . 4.150 3.744 3.511 4.126 . 0 0 "[ . 1 . 2]" 1
877 1 41 THR H 1 41 THR MG . . 3.050 2.236 2.123 2.312 . 0 0 "[ . 1 . 2]" 1
878 1 41 THR H 1 44 GLY H . . 4.690 4.115 3.884 4.308 . 0 0 "[ . 1 . 2]" 1
879 1 41 THR H 1 45 ARG H . . 3.660 3.265 3.049 3.547 . 0 0 "[ . 1 . 2]" 1
880 1 41 THR H 1 46 ILE HA . . 4.160 3.479 3.294 3.679 . 0 0 "[ . 1 . 2]" 1
881 1 41 THR H 1 46 ILE MD . . 4.360 3.830 3.590 4.031 . 0 0 "[ . 1 . 2]" 1
882 1 41 THR H 1 47 ASP H . . 4.660 4.366 4.021 4.674 0.014 12 0 "[ . 1 . 2]" 1
883 1 41 THR HA 1 41 THR MG . . 3.200 2.500 2.434 2.583 . 0 0 "[ . 1 . 2]" 1
884 1 41 THR HA 1 42 SER H . . 3.000 2.273 2.135 2.364 . 0 0 "[ . 1 . 2]" 1
885 1 41 THR HA 1 43 ASP H . . 4.140 4.041 3.754 4.189 0.049 1 0 "[ . 1 . 2]" 1
886 1 41 THR HA 1 84 ALA MB . . 3.320 2.564 2.374 2.950 . 0 0 "[ . 1 . 2]" 1
887 1 41 THR HB 1 42 SER H . . 3.100 2.284 2.157 2.470 . 0 0 "[ . 1 . 2]" 1
888 1 41 THR HB 1 43 ASP H . . 3.460 2.888 2.215 3.181 . 0 0 "[ . 1 . 2]" 1
889 1 41 THR HB 1 43 ASP QB . . 4.330 4.087 3.673 4.466 0.136 6 0 "[ . 1 . 2]" 1
890 1 41 THR HB 1 44 GLY H . . 4.460 4.302 3.833 4.506 0.046 1 0 "[ . 1 . 2]" 1
891 1 41 THR MG 1 42 SER H . . 3.680 3.756 3.710 3.787 0.107 19 0 "[ . 1 . 2]" 1
892 1 41 THR MG 1 43 ASP H . . 4.280 4.110 3.790 4.298 0.018 15 0 "[ . 1 . 2]" 1
893 1 41 THR MG 1 45 ARG H . . 4.300 3.385 3.089 3.674 . 0 0 "[ . 1 . 2]" 1
894 1 41 THR MG 1 45 ARG QB . . 4.490 2.683 2.348 4.191 . 0 0 "[ . 1 . 2]" 1
895 1 41 THR MG 1 46 ILE HA . . 4.520 3.374 3.009 3.600 . 0 0 "[ . 1 . 2]" 1
896 1 41 THR MG 1 47 ASP H . . 3.730 3.326 2.902 3.584 . 0 0 "[ . 1 . 2]" 1
897 1 41 THR MG 1 47 ASP HA . . 4.430 4.270 4.044 4.437 0.007 6 0 "[ . 1 . 2]" 1
898 1 41 THR MG 1 47 ASP HB2 . . 3.270 2.319 2.182 2.513 . 0 0 "[ . 1 . 2]" 1
899 1 41 THR MG 1 47 ASP HB3 . . 3.270 2.556 2.189 3.294 0.024 6 0 "[ . 1 . 2]" 1
900 1 41 THR MG 1 48 ASP H . . 5.260 5.199 5.042 5.296 0.036 10 0 "[ . 1 . 2]" 1
901 1 42 SER H 1 42 SER HB2 . . 3.750 2.998 2.252 3.670 . 0 0 "[ . 1 . 2]" 1
902 1 42 SER H 1 42 SER QB . . 3.150 2.411 2.161 2.686 . 0 0 "[ . 1 . 2]" 1
903 1 42 SER H 1 42 SER HB3 . . 3.750 2.820 2.298 3.622 . 0 0 "[ . 1 . 2]" 1
904 1 42 SER H 1 43 ASP H . . 3.410 2.671 2.371 2.778 . 0 0 "[ . 1 . 2]" 1
905 1 42 SER H 1 44 GLY H . . 4.650 4.089 3.746 4.385 . 0 0 "[ . 1 . 2]" 1
906 1 42 SER H 1 82 ILE MG . . 5.370 4.514 4.205 4.859 . 0 0 "[ . 1 . 2]" 1
907 1 42 SER H 1 84 ALA H . . 5.150 4.659 3.892 5.152 0.002 2 0 "[ . 1 . 2]" 1
908 1 42 SER H 1 84 ALA MB . . 3.460 2.554 2.329 2.800 . 0 0 "[ . 1 . 2]" 1
909 1 42 SER HA 1 44 GLY H . . 4.400 3.611 3.340 4.023 . 0 0 "[ . 1 . 2]" 1
910 1 42 SER HA 1 82 ILE H . . 4.390 4.179 3.754 4.419 0.029 5 0 "[ . 1 . 2]" 1
911 1 42 SER HA 1 82 ILE HB . . 3.260 2.549 2.272 2.867 . 0 0 "[ . 1 . 2]" 1
912 1 42 SER HA 1 82 ILE MD . . 4.240 4.066 3.670 4.255 0.015 5 0 "[ . 1 . 2]" 1
913 1 42 SER HA 1 82 ILE QG . . 5.140 4.637 4.345 4.881 . 0 0 "[ . 1 . 2]" 1
914 1 42 SER HA 1 82 ILE MG . . 3.540 2.650 2.357 3.075 . 0 0 "[ . 1 . 2]" 1
915 1 42 SER QB 1 43 ASP H . . 3.900 3.408 2.755 3.932 0.032 9 0 "[ . 1 . 2]" 1
916 1 42 SER QB 1 84 ALA H . . 4.550 3.471 2.749 4.335 . 0 0 "[ . 1 . 2]" 1
917 1 42 SER HB2 1 43 ASP H . . 4.480 3.977 2.813 4.360 . 0 0 "[ . 1 . 2]" 1
918 1 42 SER HB2 1 84 ALA MB . . 4.270 3.517 2.251 4.303 0.033 14 0 "[ . 1 . 2]" 1
919 1 42 SER HB3 1 43 ASP H . . 4.480 3.873 2.998 4.472 . 0 0 "[ . 1 . 2]" 1
920 1 42 SER HB3 1 84 ALA MB . . 4.270 3.374 2.254 4.280 0.010 20 0 "[ . 1 . 2]" 1
921 1 43 ASP H 1 43 ASP QB . . 3.260 2.448 2.182 3.155 . 0 0 "[ . 1 . 2]" 1
922 1 43 ASP H 1 44 GLY H . . 3.150 2.493 2.084 2.705 . 0 0 "[ . 1 . 2]" 1
923 1 43 ASP H 1 44 GLY QA . . 5.340 4.406 4.086 4.568 . 0 0 "[ . 1 . 2]" 1
924 1 43 ASP H 1 45 ARG H . . 3.940 3.636 3.428 3.926 . 0 0 "[ . 1 . 2]" 1
925 1 43 ASP H 1 82 ILE MD . . 5.030 4.770 4.144 5.063 0.033 8 0 "[ . 1 . 2]" 1
926 1 43 ASP HA 1 82 ILE MD . . 4.500 4.022 3.427 4.533 0.033 7 0 "[ . 1 . 2]" 1
927 1 43 ASP QB 1 44 GLY H . . 4.280 3.524 2.944 4.075 . 0 0 "[ . 1 . 2]" 1
928 1 43 ASP QB 1 45 ARG H . . 4.440 3.526 2.724 4.481 0.041 10 0 "[ . 1 . 2]" 1
929 1 44 GLY H 1 45 ARG H . . 3.240 2.520 2.086 2.667 . 0 0 "[ . 1 . 2]" 1
930 1 44 GLY H 1 45 ARG QG . . 4.950 4.452 3.868 4.981 0.031 15 0 "[ . 1 . 2]" 1
931 1 44 GLY H 1 82 ILE HB . . 4.530 3.806 3.323 4.385 . 0 0 "[ . 1 . 2]" 1
932 1 44 GLY H 1 82 ILE MD . . 3.510 3.024 2.690 3.350 . 0 0 "[ . 1 . 2]" 1
933 1 44 GLY H 1 82 ILE MG . . 4.300 3.493 3.210 4.095 . 0 0 "[ . 1 . 2]" 1
934 1 44 GLY QA 1 45 ARG HA . . 5.030 4.157 4.081 4.214 . 0 0 "[ . 1 . 2]" 1
935 1 44 GLY QA 1 73 PHE H . . 3.660 2.930 2.646 3.219 . 0 0 "[ . 1 . 2]" 1
936 1 44 GLY QA 1 73 PHE QB . . 3.610 2.782 2.348 3.140 . 0 0 "[ . 1 . 2]" 1
937 1 44 GLY QA 1 82 ILE MG . . 4.630 3.077 2.641 3.576 . 0 0 "[ . 1 . 2]" 1
938 1 44 GLY HA2 1 73 PHE HB2 . . 4.750 3.130 2.848 3.586 . 0 0 "[ . 1 . 2]" 1
939 1 44 GLY HA2 1 73 PHE HB3 . . 4.750 4.147 3.864 4.469 . 0 0 "[ . 1 . 2]" 1
940 1 44 GLY HA2 1 82 ILE MD . . 3.680 2.413 2.070 3.018 . 0 0 "[ . 1 . 2]" 1
941 1 44 GLY HA3 1 73 PHE HB2 . . 4.750 3.415 2.560 3.963 . 0 0 "[ . 1 . 2]" 1
942 1 44 GLY HA3 1 73 PHE HB3 . . 4.750 4.207 3.551 4.752 0.002 6 0 "[ . 1 . 2]" 1
943 1 44 GLY HA3 1 82 ILE MD . . 3.680 2.550 2.289 3.258 . 0 0 "[ . 1 . 2]" 1
944 1 45 ARG H 1 45 ARG HB2 . . 3.730 2.590 2.373 3.745 0.015 5 0 "[ . 1 . 2]" 1
945 1 45 ARG H 1 45 ARG QB . . 3.150 2.507 2.343 2.866 . 0 0 "[ . 1 . 2]" 1
946 1 45 ARG H 1 45 ARG HB3 . . 3.730 3.663 2.975 3.756 0.026 13 0 "[ . 1 . 2]" 1
947 1 45 ARG H 1 45 ARG QD . . 4.730 4.337 3.729 4.805 0.075 7 0 "[ . 1 . 2]" 1
948 1 45 ARG H 1 45 ARG QG . . 3.460 2.742 2.083 3.201 . 0 0 "[ . 1 . 2]" 1
949 1 45 ARG H 1 46 ILE H . . 4.650 4.528 4.447 4.611 . 0 0 "[ . 1 . 2]" 1
950 1 45 ARG H 1 82 ILE MD . . 5.100 4.658 4.394 5.102 0.002 16 0 "[ . 1 . 2]" 1
951 1 45 ARG HA 1 45 ARG QD . . 4.190 3.953 2.170 4.217 0.027 5 0 "[ . 1 . 2]" 1
952 1 45 ARG HA 1 45 ARG QG . . 3.920 2.487 2.266 3.353 . 0 0 "[ . 1 . 2]" 1
953 1 45 ARG HA 1 46 ILE H . . 3.300 2.431 2.299 2.619 . 0 0 "[ . 1 . 2]" 1
954 1 45 ARG HA 1 72 ARG QD . . 5.270 3.127 2.390 4.213 . 0 0 "[ . 1 . 2]" 1
955 1 45 ARG QB 1 45 ARG QD . . 3.340 2.239 2.091 2.443 . 0 0 "[ . 1 . 2]" 1
956 1 45 ARG HB2 1 46 ILE H . . 3.830 3.445 2.158 3.715 . 0 0 "[ . 1 . 2]" 1
957 1 45 ARG HB3 1 46 ILE H . . 3.830 2.356 2.167 3.654 . 0 0 "[ . 1 . 2]" 1
958 1 45 ARG QD 1 46 ILE H . . 4.610 4.330 2.804 4.657 0.047 4 0 "[ . 1 . 2]" 1
959 1 45 ARG QG 1 46 ILE H . . 3.950 3.788 3.218 3.993 0.043 15 0 "[ . 1 . 2]" 1
960 1 45 ARG QG 1 72 ARG HA . . 4.670 4.147 3.534 4.732 0.062 5 0 "[ . 1 . 2]" 1
961 1 45 ARG QG 1 72 ARG QD . . 4.210 2.744 2.133 4.212 0.002 20 0 "[ . 1 . 2]" 1
962 1 46 ILE H 1 46 ILE HB . . 3.050 2.727 2.675 2.797 . 0 0 "[ . 1 . 2]" 1
963 1 46 ILE H 1 46 ILE MD . . 4.340 3.508 3.439 3.665 . 0 0 "[ . 1 . 2]" 1
964 1 46 ILE H 1 46 ILE HG12 . . 4.070 2.628 2.542 2.763 . 0 0 "[ . 1 . 2]" 1
965 1 46 ILE H 1 46 ILE HG13 . . 4.070 4.034 3.962 4.104 0.034 20 0 "[ . 1 . 2]" 1
966 1 46 ILE H 1 46 ILE MG . . 4.110 3.910 3.888 3.951 . 0 0 "[ . 1 . 2]" 1
967 1 46 ILE H 1 47 ASP H . . 4.730 4.451 4.306 4.530 . 0 0 "[ . 1 . 2]" 1
968 1 46 ILE HA 1 46 ILE MD . . 3.230 2.341 2.268 2.366 . 0 0 "[ . 1 . 2]" 1
969 1 46 ILE HA 1 46 ILE MG . . 3.310 2.287 2.256 2.346 . 0 0 "[ . 1 . 2]" 1
970 1 46 ILE HA 1 47 ASP H . . 2.940 2.172 2.097 2.272 . 0 0 "[ . 1 . 2]" 1
971 1 46 ILE HA 1 49 ILE MD . . 5.060 4.684 4.498 4.942 . 0 0 "[ . 1 . 2]" 1
972 1 46 ILE HB 1 47 ASP H . . 4.390 4.036 3.891 4.273 . 0 0 "[ . 1 . 2]" 1
973 1 46 ILE HB 1 49 ILE MD . . 4.130 2.847 2.675 3.131 . 0 0 "[ . 1 . 2]" 1
974 1 46 ILE MD 1 46 ILE MG . . 3.110 2.147 2.129 2.163 . 0 0 "[ . 1 . 2]" 1
975 1 46 ILE MD 1 47 ASP H . . 4.060 4.045 3.944 4.078 0.018 1 0 "[ . 1 . 2]" 1
976 1 46 ILE MD 1 71 TRP HB2 . . 4.670 3.642 3.404 3.922 . 0 0 "[ . 1 . 2]" 1
977 1 46 ILE MD 1 71 TRP QB . . 4.070 3.292 3.088 3.550 . 0 0 "[ . 1 . 2]" 1
978 1 46 ILE MD 1 71 TRP HB3 . . 4.670 3.783 3.487 4.384 . 0 0 "[ . 1 . 2]" 1
979 1 46 ILE MD 1 71 TRP HE3 . . 3.480 3.274 2.882 3.490 0.010 19 0 "[ . 1 . 2]" 1
980 1 46 ILE QG 1 46 ILE MG . . 3.290 2.279 2.258 2.297 . 0 0 "[ . 1 . 2]" 1
981 1 46 ILE QG 1 49 ILE MD . . 4.850 4.097 3.829 4.430 . 0 0 "[ . 1 . 2]" 1
982 1 46 ILE QG 1 71 TRP QB . . 3.550 2.314 2.071 2.674 . 0 0 "[ . 1 . 2]" 1
983 1 46 ILE QG 1 71 TRP HE3 . . 4.260 3.072 2.705 3.282 . 0 0 "[ . 1 . 2]" 1
984 1 46 ILE HG12 1 71 TRP HB2 . . 4.750 2.693 2.428 3.087 . 0 0 "[ . 1 . 2]" 1
985 1 46 ILE HG12 1 71 TRP HB3 . . 4.750 3.604 3.213 4.275 . 0 0 "[ . 1 . 2]" 1
986 1 46 ILE HG13 1 71 TRP HB2 . . 4.750 2.683 2.221 3.239 . 0 0 "[ . 1 . 2]" 1
987 1 46 ILE HG13 1 71 TRP HB3 . . 4.750 3.744 2.849 4.640 . 0 0 "[ . 1 . 2]" 1
988 1 46 ILE MG 1 47 ASP H . . 3.320 2.569 2.352 2.904 . 0 0 "[ . 1 . 2]" 1
989 1 46 ILE MG 1 47 ASP HA . . 4.250 3.831 3.633 4.064 . 0 0 "[ . 1 . 2]" 1
990 1 46 ILE MG 1 49 ILE H . . 5.500 4.381 4.082 4.740 . 0 0 "[ . 1 . 2]" 1
991 1 46 ILE MG 1 49 ILE HA . . 4.750 4.238 4.129 4.361 . 0 0 "[ . 1 . 2]" 1
992 1 46 ILE MG 1 49 ILE QG . . 3.650 2.170 2.048 2.307 . 0 0 "[ . 1 . 2]" 1
993 1 46 ILE MG 1 68 MET HB2 . . 4.980 3.766 3.356 4.516 . 0 0 "[ . 1 . 2]" 1
994 1 46 ILE MG 1 68 MET QB . . 4.110 2.503 2.272 3.246 . 0 0 "[ . 1 . 2]" 1
995 1 46 ILE MG 1 68 MET HB3 . . 4.980 2.543 2.311 3.327 . 0 0 "[ . 1 . 2]" 1
996 1 46 ILE MG 1 71 TRP HZ3 . . 5.500 5.456 4.835 5.547 0.047 13 0 "[ . 1 . 2]" 1
997 1 47 ASP H 1 47 ASP HB2 . . 3.760 3.082 2.656 3.335 . 0 0 "[ . 1 . 2]" 1
998 1 47 ASP H 1 47 ASP HB3 . . 3.760 2.820 2.590 3.540 . 0 0 "[ . 1 . 2]" 1
999 1 47 ASP H 1 48 ASP QB . . 4.870 4.510 4.313 4.687 . 0 0 "[ . 1 . 2]" 1
1000 1 47 ASP HA 1 48 ASP H . . 3.000 2.520 2.371 2.652 . 0 0 "[ . 1 . 2]" 1
1001 1 47 ASP HA 1 49 ILE H . . 4.410 3.576 3.360 3.796 . 0 0 "[ . 1 . 2]" 1
1002 1 47 ASP HA 1 49 ILE MD . . 4.830 3.691 3.328 4.312 . 0 0 "[ . 1 . 2]" 1
1003 1 47 ASP HA 1 49 ILE HG12 . . 4.760 4.539 3.760 4.796 0.036 3 0 "[ . 1 . 2]" 1
1004 1 47 ASP HA 1 49 ILE QG . . 4.110 3.112 2.667 3.401 . 0 0 "[ . 1 . 2]" 1
1005 1 47 ASP HA 1 49 ILE HG13 . . 4.760 3.172 2.717 3.480 . 0 0 "[ . 1 . 2]" 1
1006 1 47 ASP HB2 1 48 ASP H . . 4.220 3.872 3.729 3.976 . 0 0 "[ . 1 . 2]" 1
1007 1 47 ASP HB3 1 48 ASP H . . 4.220 3.339 2.348 3.637 . 0 0 "[ . 1 . 2]" 1
1008 1 48 ASP H 1 48 ASP HA . . 2.780 2.257 2.233 2.296 . 0 0 "[ . 1 . 2]" 1
1009 1 48 ASP H 1 48 ASP QB . . 3.560 3.167 2.778 3.342 . 0 0 "[ . 1 . 2]" 1
1010 1 48 ASP H 1 49 ILE H . . 3.410 2.910 2.752 3.052 . 0 0 "[ . 1 . 2]" 1
1011 1 48 ASP H 1 49 ILE HB . . 5.500 5.307 5.000 5.510 0.010 10 0 "[ . 1 . 2]" 1
1012 1 48 ASP H 1 49 ILE MD . . 5.500 4.962 4.446 5.396 . 0 0 "[ . 1 . 2]" 1
1013 1 48 ASP H 1 49 ILE QG . . 4.410 3.849 3.598 4.096 . 0 0 "[ . 1 . 2]" 1
1014 1 48 ASP HA 1 49 ILE H . . 3.130 2.847 2.655 3.010 . 0 0 "[ . 1 . 2]" 1
1015 1 48 ASP QB 1 49 ILE H . . 4.400 3.888 3.775 4.018 . 0 0 "[ . 1 . 2]" 1
1016 1 49 ILE H 1 49 ILE HB . . 2.910 2.588 2.454 2.748 . 0 0 "[ . 1 . 2]" 1
1017 1 49 ILE H 1 49 ILE MD . . 3.730 3.461 3.122 3.716 . 0 0 "[ . 1 . 2]" 1
1018 1 49 ILE H 1 49 ILE QG . . 3.110 1.983 1.827 2.140 . 0 0 "[ . 1 . 2]" 1
1019 1 49 ILE H 1 50 GLN H . . 4.630 4.585 4.422 4.652 0.022 8 0 "[ . 1 . 2]" 1
1020 1 49 ILE HA 1 49 ILE MG . . 3.320 2.407 2.284 2.552 . 0 0 "[ . 1 . 2]" 1
1021 1 49 ILE HA 1 50 GLN H . . 3.030 2.161 2.100 2.222 . 0 0 "[ . 1 . 2]" 1
1022 1 49 ILE HB 1 49 ILE MD . . 3.140 2.414 2.297 2.613 . 0 0 "[ . 1 . 2]" 1
1023 1 49 ILE MD 1 50 GLN H . . 5.440 5.259 5.029 5.451 0.011 17 0 "[ . 1 . 2]" 1
1024 1 49 ILE MD 1 65 ARG HA . . 3.930 2.863 2.298 3.575 . 0 0 "[ . 1 . 2]" 1
1025 1 49 ILE MD 1 68 MET H . . 4.600 4.227 3.935 4.475 . 0 0 "[ . 1 . 2]" 1
1026 1 49 ILE MD 1 68 MET HA . . 4.990 4.452 4.255 4.676 . 0 0 "[ . 1 . 2]" 1
1027 1 49 ILE MD 1 68 MET HB2 . . 4.220 2.356 2.194 2.555 . 0 0 "[ . 1 . 2]" 1
1028 1 49 ILE MD 1 68 MET HB3 . . 4.220 2.739 2.323 3.145 . 0 0 "[ . 1 . 2]" 1
1029 1 49 ILE MD 1 69 ALA H . . 4.340 3.322 2.830 4.102 . 0 0 "[ . 1 . 2]" 1
1030 1 49 ILE MD 1 69 ALA HA . . 4.140 3.211 2.436 3.886 . 0 0 "[ . 1 . 2]" 1
1031 1 49 ILE QG 1 50 GLN H . . 4.990 4.257 4.081 4.388 . 0 0 "[ . 1 . 2]" 1
1032 1 49 ILE MG 1 50 GLN H . . 3.470 2.750 2.565 3.064 . 0 0 "[ . 1 . 2]" 1
1033 1 49 ILE MG 1 50 GLN HA . . 4.450 3.510 3.090 3.788 . 0 0 "[ . 1 . 2]" 1
1034 1 49 ILE MG 1 65 ARG HA . . 4.610 2.519 2.246 2.839 . 0 0 "[ . 1 . 2]" 1
1035 1 49 ILE MG 1 66 GLN H . . 5.500 5.462 5.210 5.580 0.080 20 0 "[ . 1 . 2]" 1
1036 1 49 ILE MG 1 68 MET QB . . 3.390 3.231 2.533 3.421 0.031 16 0 "[ . 1 . 2]" 1
1037 1 50 GLN H 1 50 GLN HB2 . . 4.170 3.958 3.895 4.018 . 0 0 "[ . 1 . 2]" 1
1038 1 50 GLN H 1 50 GLN HB3 . . 3.600 3.323 3.202 3.451 . 0 0 "[ . 1 . 2]" 1
1039 1 50 GLN H 1 50 GLN HG2 . . 4.050 2.474 2.274 2.969 . 0 0 "[ . 1 . 2]" 1
1040 1 50 GLN H 1 50 GLN HG3 . . 4.050 3.566 3.068 3.842 . 0 0 "[ . 1 . 2]" 1
1041 1 50 GLN H 1 51 VAL H . . 4.640 4.416 4.353 4.464 . 0 0 "[ . 1 . 2]" 1
1042 1 50 GLN HA 1 50 GLN HG2 . . 4.090 3.752 3.681 3.914 . 0 0 "[ . 1 . 2]" 1
1043 1 50 GLN HA 1 50 GLN QG . . 3.550 3.388 3.368 3.418 . 0 0 "[ . 1 . 2]" 1
1044 1 50 GLN HA 1 50 GLN HG3 . . 4.090 3.870 3.727 3.981 . 0 0 "[ . 1 . 2]" 1
1045 1 50 GLN HA 1 51 VAL H . . 2.780 2.283 2.170 2.566 . 0 0 "[ . 1 . 2]" 1
1046 1 50 GLN HA 1 51 VAL QG . . 4.150 3.900 3.280 4.294 0.144 19 0 "[ . 1 . 2]" 1
1047 1 50 GLN HB2 1 51 VAL H . . 3.190 2.746 2.330 2.951 . 0 0 "[ . 1 . 2]" 1
1048 1 50 GLN HB3 1 51 VAL H . . 4.860 3.961 3.734 4.097 . 0 0 "[ . 1 . 2]" 1
1049 1 50 GLN QG 1 51 VAL H . . 3.870 3.776 3.405 3.914 0.044 6 0 "[ . 1 . 2]" 1
1050 1 51 VAL H 1 51 VAL HB . . 3.490 2.564 2.407 2.735 . 0 0 "[ . 1 . 2]" 1
1051 1 51 VAL H 1 51 VAL MG1 . . 3.870 2.832 2.012 3.879 0.009 12 0 "[ . 1 . 2]" 1
1052 1 51 VAL H 1 51 VAL QG . . 3.010 2.446 2.005 2.766 . 0 0 "[ . 1 . 2]" 1
1053 1 51 VAL H 1 51 VAL MG2 . . 3.870 3.482 2.505 3.905 0.035 4 0 "[ . 1 . 2]" 1
1054 1 51 VAL H 1 52 LEU HG . . 5.500 5.432 5.095 5.546 0.046 19 0 "[ . 1 . 2]" 1
1055 1 51 VAL HA 1 51 VAL MG1 . . 3.290 2.983 2.286 3.267 . 0 0 "[ . 1 . 2]" 1
1056 1 51 VAL HA 1 51 VAL MG2 . . 3.290 2.248 2.126 2.407 . 0 0 "[ . 1 . 2]" 1
1057 1 51 VAL HA 1 52 LEU H . . 3.050 2.150 2.063 2.214 . 0 0 "[ . 1 . 2]" 1
1058 1 51 VAL HA 1 52 LEU HG . . 4.290 3.699 3.472 4.149 . 0 0 "[ . 1 . 2]" 1
1059 1 51 VAL HA 1 53 GLU H . . 4.220 3.940 3.803 4.221 0.001 16 0 "[ . 1 . 2]" 1
1060 1 51 VAL HB 1 52 LEU H . . 4.710 4.152 4.053 4.303 . 0 0 "[ . 1 . 2]" 1
1061 1 51 VAL QG 1 52 LEU H . . 3.300 2.398 2.167 2.697 . 0 0 "[ . 1 . 2]" 1
1062 1 51 VAL QG 1 53 GLU H . . 4.010 2.386 2.139 2.697 . 0 0 "[ . 1 . 2]" 1
1063 1 51 VAL QG 1 54 SER HA . . 4.460 3.634 3.249 3.957 . 0 0 "[ . 1 . 2]" 1
1064 1 51 VAL QG 1 54 SER QB . . 3.720 2.347 2.043 3.520 . 0 0 "[ . 1 . 2]" 1
1065 1 51 VAL QG 1 61 ASP QB . . 4.990 2.430 2.172 2.800 . 0 0 "[ . 1 . 2]" 1
1066 1 51 VAL MG1 1 52 LEU H . . 4.000 3.280 2.507 3.937 . 0 0 "[ . 1 . 2]" 1
1067 1 51 VAL MG1 1 53 GLU H . . 4.860 3.486 2.329 4.262 . 0 0 "[ . 1 . 2]" 1
1068 1 51 VAL MG2 1 52 LEU H . . 4.000 2.819 2.194 4.020 0.020 13 0 "[ . 1 . 2]" 1
1069 1 51 VAL MG2 1 53 GLU H . . 4.860 3.084 2.169 4.866 0.006 12 0 "[ . 1 . 2]" 1
1070 1 52 LEU H 1 52 LEU HB2 . . 3.990 2.562 2.400 2.670 . 0 0 "[ . 1 . 2]" 1
1071 1 52 LEU H 1 52 LEU QB . . 3.360 2.519 2.369 2.613 . 0 0 "[ . 1 . 2]" 1
1072 1 52 LEU H 1 52 LEU HB3 . . 3.990 3.713 3.636 3.772 . 0 0 "[ . 1 . 2]" 1
1073 1 52 LEU H 1 52 LEU MD1 . . 5.040 3.915 3.673 4.043 . 0 0 "[ . 1 . 2]" 1
1074 1 52 LEU H 1 52 LEU QD . . 3.970 3.356 3.105 3.545 . 0 0 "[ . 1 . 2]" 1
1075 1 52 LEU H 1 52 LEU MD2 . . 5.040 3.661 3.291 3.934 . 0 0 "[ . 1 . 2]" 1
1076 1 52 LEU H 1 52 LEU HG . . 4.570 2.747 2.343 3.029 . 0 0 "[ . 1 . 2]" 1
1077 1 52 LEU H 1 53 GLU H . . 2.850 2.145 1.979 2.359 . 0 0 "[ . 1 . 2]" 1
1078 1 52 LEU HA 1 52 LEU MD1 . . 4.250 3.884 3.848 3.911 . 0 0 "[ . 1 . 2]" 1
1079 1 52 LEU HA 1 52 LEU MD2 . . 4.250 2.206 2.127 2.312 . 0 0 "[ . 1 . 2]" 1
1080 1 52 LEU QB 1 53 GLU H . . 3.310 2.763 2.467 3.076 . 0 0 "[ . 1 . 2]" 1
1081 1 52 LEU QD 1 53 GLU H . . 4.360 4.209 4.008 4.354 . 0 0 "[ . 1 . 2]" 1
1082 1 52 LEU MD1 1 53 GLU H . . 4.980 4.693 4.395 4.960 . 0 0 "[ . 1 . 2]" 1
1083 1 52 LEU MD2 1 53 GLU H . . 4.980 4.765 4.615 4.862 . 0 0 "[ . 1 . 2]" 1
1084 1 52 LEU HG 1 53 GLU H . . 4.640 4.409 4.018 4.644 0.004 7 0 "[ . 1 . 2]" 1
1085 1 53 GLU H 1 53 GLU QB . . 3.220 2.879 2.625 3.245 0.025 17 0 "[ . 1 . 2]" 1
1086 1 53 GLU H 1 53 GLU QG . . 4.210 3.873 2.692 4.233 0.023 8 0 "[ . 1 . 2]" 1
1087 1 53 GLU H 1 54 SER H . . 4.540 4.297 4.205 4.395 . 0 0 "[ . 1 . 2]" 1
1088 1 53 GLU H 1 54 SER HA . . 5.420 4.805 4.682 4.967 . 0 0 "[ . 1 . 2]" 1
1089 1 53 GLU HA 1 53 GLU QG . . 3.680 2.651 2.222 3.404 . 0 0 "[ . 1 . 2]" 1
1090 1 53 GLU HA 1 54 SER H . . 2.770 2.279 2.182 2.353 . 0 0 "[ . 1 . 2]" 1
1091 1 53 GLU QB 1 54 SER H . . 3.730 3.350 2.627 3.747 0.017 12 0 "[ . 1 . 2]" 1
1092 1 53 GLU QG 1 54 SER H . . 3.720 2.930 2.220 3.749 0.029 17 0 "[ . 1 . 2]" 1
1093 1 54 SER H 1 55 VAL H . . 4.190 4.147 3.668 4.247 0.057 8 0 "[ . 1 . 2]" 1
1094 1 54 SER H 1 55 VAL MG1 . . 5.500 5.531 5.506 5.548 0.048 13 0 "[ . 1 . 2]" 1
1095 1 54 SER H 1 55 VAL MG2 . . 4.020 3.238 2.967 3.421 . 0 0 "[ . 1 . 2]" 1
1096 1 54 SER HA 1 55 VAL H . . 2.860 2.107 2.065 2.180 . 0 0 "[ . 1 . 2]" 1
1097 1 54 SER HA 1 55 VAL HA . . 4.560 4.424 4.338 4.477 . 0 0 "[ . 1 . 2]" 1
1098 1 54 SER HA 1 55 VAL HB . . 5.500 4.403 4.005 4.857 . 0 0 "[ . 1 . 2]" 1
1099 1 54 SER HA 1 55 VAL MG2 . . 4.200 3.241 2.803 3.777 . 0 0 "[ . 1 . 2]" 1
1100 1 54 SER QB 1 55 VAL H . . 4.110 3.317 2.770 3.782 . 0 0 "[ . 1 . 2]" 1
1101 1 55 VAL H 1 55 VAL HB . . 3.430 2.676 2.367 2.887 . 0 0 "[ . 1 . 2]" 1
1102 1 55 VAL H 1 55 VAL MG1 . . 4.230 3.899 3.750 3.973 . 0 0 "[ . 1 . 2]" 1
1103 1 55 VAL H 1 55 VAL MG2 . . 3.570 2.696 2.527 2.900 . 0 0 "[ . 1 . 2]" 1
1104 1 55 VAL HA 1 55 VAL MG1 . . 3.270 2.359 2.255 2.500 . 0 0 "[ . 1 . 2]" 1
1105 1 55 VAL HA 1 55 VAL MG2 . . 3.300 2.502 2.343 2.602 . 0 0 "[ . 1 . 2]" 1
1106 1 55 VAL HA 1 56 PRO HA . . 3.220 2.219 2.069 2.326 . 0 0 "[ . 1 . 2]" 1
1107 1 55 VAL HA 1 56 PRO HB2 . . 4.700 4.630 4.579 4.691 . 0 0 "[ . 1 . 2]" 1
1108 1 55 VAL HA 1 56 PRO QB . . 4.030 4.016 3.897 4.057 0.027 18 0 "[ . 1 . 2]" 1
1109 1 55 VAL HA 1 56 PRO HB3 . . 4.700 4.409 4.185 4.522 . 0 0 "[ . 1 . 2]" 1
1110 1 55 VAL HA 1 57 SER H . . 4.790 3.317 2.826 3.880 . 0 0 "[ . 1 . 2]" 1
1111 1 55 VAL MG1 1 56 PRO HA . . 3.560 2.283 2.121 2.570 . 0 0 "[ . 1 . 2]" 1
1112 1 55 VAL MG1 1 56 PRO QB . . 4.400 3.389 2.987 3.908 . 0 0 "[ . 1 . 2]" 1
1113 1 55 VAL MG1 1 56 PRO QD . . 5.080 3.218 2.961 3.372 . 0 0 "[ . 1 . 2]" 1
1114 1 55 VAL MG2 1 56 PRO HA . . 4.130 3.888 3.516 4.091 . 0 0 "[ . 1 . 2]" 1
1115 1 56 PRO HD2 1 60 PHE QE . . 4.280 2.544 2.210 3.248 . 0 0 "[ . 1 . 2]" 1
1116 1 56 PRO HD3 1 60 PHE QE . . 4.280 3.215 2.482 4.284 0.004 12 0 "[ . 1 . 2]" 1
1117 1 57 SER H 1 57 SER QB . . 3.710 3.006 2.601 3.305 . 0 0 "[ . 1 . 2]" 1
1118 1 57 SER HA 1 59 MET H . . 5.500 4.287 4.096 4.550 . 0 0 "[ . 1 . 2]" 1
1119 1 57 SER QB 1 58 ARG H . . 3.110 2.461 2.082 3.094 . 0 0 "[ . 1 . 2]" 1
1120 1 57 SER QB 1 58 ARG QG . . 4.480 3.800 2.768 4.517 0.037 18 0 "[ . 1 . 2]" 1
1121 1 57 SER QB 1 59 MET H . . 3.920 3.049 2.678 3.539 . 0 0 "[ . 1 . 2]" 1
1122 1 57 SER HB2 1 58 ARG QG . . 5.250 4.375 2.798 5.294 0.044 9 0 "[ . 1 . 2]" 1
1123 1 57 SER HB3 1 58 ARG QG . . 5.250 4.680 3.724 5.357 0.107 10 0 "[ . 1 . 2]" 1
1124 1 58 ARG H 1 59 MET H . . 3.480 2.981 2.778 3.359 . 0 0 "[ . 1 . 2]" 1
1125 1 58 ARG HA 1 58 ARG QG . . 3.790 3.082 2.291 3.545 . 0 0 "[ . 1 . 2]" 1
1126 1 58 ARG HA 1 61 ASP H . . 3.780 3.083 2.698 3.716 . 0 0 "[ . 1 . 2]" 1
1127 1 58 ARG HA 1 61 ASP QB . . 4.710 2.848 2.054 4.449 . 0 0 "[ . 1 . 2]" 1
1128 1 58 ARG QB 1 58 ARG QD . . 3.390 2.337 2.099 2.930 . 0 0 "[ . 1 . 2]" 1
1129 1 58 ARG QB 1 59 MET H . . 4.150 3.690 3.042 4.067 . 0 0 "[ . 1 . 2]" 1
1130 1 58 ARG QB 1 61 ASP H . . 5.340 4.100 3.693 4.492 . 0 0 "[ . 1 . 2]" 1
1131 1 58 ARG HB2 1 59 MET H . . 4.730 4.025 3.162 4.531 . 0 0 "[ . 1 . 2]" 1
1132 1 58 ARG HB3 1 59 MET H . . 4.730 4.347 3.952 4.628 . 0 0 "[ . 1 . 2]" 1
1133 1 58 ARG QG 1 59 MET H . . 5.500 3.680 2.564 4.489 . 0 0 "[ . 1 . 2]" 1
1134 1 59 MET H 1 59 MET HB2 . . 3.120 2.432 2.328 2.557 . 0 0 "[ . 1 . 2]" 1
1135 1 59 MET H 1 59 MET HB3 . . 3.120 2.421 2.310 2.587 . 0 0 "[ . 1 . 2]" 1
1136 1 59 MET H 1 59 MET ME . . 4.200 4.075 3.829 4.232 0.032 5 0 "[ . 1 . 2]" 1
1137 1 59 MET H 1 59 MET QG . . 4.520 3.972 3.922 4.047 . 0 0 "[ . 1 . 2]" 1
1138 1 59 MET H 1 60 PHE H . . 3.440 3.010 2.711 3.244 . 0 0 "[ . 1 . 2]" 1
1139 1 59 MET HA 1 59 MET ME . . 3.600 2.817 2.025 3.631 0.031 4 0 "[ . 1 . 2]" 1
1140 1 59 MET HA 1 59 MET HG2 . . 4.180 3.783 3.363 4.009 . 0 0 "[ . 1 . 2]" 1
1141 1 59 MET HA 1 59 MET QG . . 3.530 2.957 2.521 3.221 . 0 0 "[ . 1 . 2]" 1
1142 1 59 MET HA 1 59 MET HG3 . . 4.180 3.096 2.599 3.427 . 0 0 "[ . 1 . 2]" 1
1143 1 59 MET HA 1 61 ASP H . . 4.960 4.628 4.332 4.977 0.017 7 0 "[ . 1 . 2]" 1
1144 1 59 MET QB 1 59 MET ME . . 3.230 2.268 2.043 2.821 . 0 0 "[ . 1 . 2]" 1
1145 1 59 MET QB 1 60 PHE H . . 3.730 2.641 2.467 2.935 . 0 0 "[ . 1 . 2]" 1
1146 1 59 MET QB 1 60 PHE HA . . 5.340 4.459 4.310 4.595 . 0 0 "[ . 1 . 2]" 1
1147 1 59 MET QB 1 60 PHE QD . . 5.040 3.355 2.518 3.948 . 0 0 "[ . 1 . 2]" 1
1148 1 59 MET HB2 1 60 PHE H . . 4.290 3.991 3.861 4.160 . 0 0 "[ . 1 . 2]" 1
1149 1 59 MET HB3 1 60 PHE H . . 4.290 2.681 2.496 3.000 . 0 0 "[ . 1 . 2]" 1
1150 1 59 MET ME 1 59 MET HG2 . . 3.930 2.929 2.439 3.441 . 0 0 "[ . 1 . 2]" 1
1151 1 59 MET ME 1 59 MET QG . . 3.250 2.443 2.344 2.591 . 0 0 "[ . 1 . 2]" 1
1152 1 59 MET ME 1 59 MET HG3 . . 3.930 2.998 2.390 3.457 . 0 0 "[ . 1 . 2]" 1
1153 1 59 MET ME 1 60 PHE H . . 5.300 5.180 4.507 5.333 0.033 12 0 "[ . 1 . 2]" 1
1154 1 59 MET QG 1 60 PHE H . . 4.340 3.467 3.218 3.829 . 0 0 "[ . 1 . 2]" 1
1155 1 59 MET QG 1 60 PHE HA . . 4.980 3.655 3.467 3.901 . 0 0 "[ . 1 . 2]" 1
1156 1 59 MET HG2 1 60 PHE H . . 5.160 4.298 3.374 5.035 . 0 0 "[ . 1 . 2]" 1
1157 1 59 MET HG2 1 60 PHE QD . . 5.010 4.396 3.265 5.033 0.023 2 0 "[ . 1 . 2]" 1
1158 1 59 MET HG2 1 60 PHE QE . . 5.060 4.369 3.603 5.068 0.008 3 0 "[ . 1 . 2]" 1
1159 1 59 MET HG3 1 60 PHE H . . 5.160 3.821 3.376 4.464 . 0 0 "[ . 1 . 2]" 1
1160 1 59 MET HG3 1 60 PHE QD . . 5.010 4.242 3.562 4.903 . 0 0 "[ . 1 . 2]" 1
1161 1 59 MET HG3 1 60 PHE QE . . 5.060 4.628 3.642 5.097 0.037 9 0 "[ . 1 . 2]" 1
1162 1 60 PHE H 1 60 PHE HB2 . . 4.130 2.399 2.281 2.593 . 0 0 "[ . 1 . 2]" 1
1163 1 60 PHE H 1 60 PHE QB . . 3.580 2.365 2.255 2.543 . 0 0 "[ . 1 . 2]" 1
1164 1 60 PHE H 1 60 PHE HB3 . . 4.130 3.603 3.554 3.672 . 0 0 "[ . 1 . 2]" 1
1165 1 60 PHE H 1 61 ASP H . . 3.010 2.529 2.155 2.713 . 0 0 "[ . 1 . 2]" 1
1166 1 60 PHE H 1 61 ASP HA . . 5.170 5.088 4.567 5.256 0.086 3 0 "[ . 1 . 2]" 1
1167 1 60 PHE HA 1 60 PHE QD . . 3.680 2.734 2.335 3.166 . 0 0 "[ . 1 . 2]" 1
1168 1 60 PHE QB 1 61 ASP H . . 4.030 2.970 2.768 3.274 . 0 0 "[ . 1 . 2]" 1
1169 1 60 PHE QB 1 64 VAL QG . . 4.490 3.323 2.365 4.128 . 0 0 "[ . 1 . 2]" 1
1170 1 60 PHE QB 1 93 PHE QE . . 4.070 2.853 2.496 3.300 . 0 0 "[ . 1 . 2]" 1
1171 1 60 PHE HB2 1 93 PHE QE . . 4.700 4.211 3.184 4.714 0.014 14 0 "[ . 1 . 2]" 1
1172 1 60 PHE HB3 1 93 PHE QE . . 4.700 2.918 2.517 3.385 . 0 0 "[ . 1 . 2]" 1
1173 1 60 PHE QE 1 93 PHE H . . 5.500 5.443 4.673 5.544 0.044 19 0 "[ . 1 . 2]" 1
1174 1 60 PHE QE 1 93 PHE HB2 . . 5.060 3.458 2.416 3.628 . 0 0 "[ . 1 . 2]" 1
1175 1 60 PHE QE 1 93 PHE QB . . 4.430 2.648 2.260 3.107 . 0 0 "[ . 1 . 2]" 1
1176 1 60 PHE QE 1 93 PHE HB3 . . 5.060 2.787 2.301 3.377 . 0 0 "[ . 1 . 2]" 1
1177 1 61 ASP H 1 61 ASP QB . . 3.110 2.248 1.976 2.950 . 0 0 "[ . 1 . 2]" 1
1178 1 61 ASP H 1 62 ARG H . . 3.650 2.936 2.628 3.345 . 0 0 "[ . 1 . 2]" 1
1179 1 61 ASP HA 1 63 GLU H . . 4.750 4.352 4.047 4.762 0.012 10 0 "[ . 1 . 2]" 1
1180 1 61 ASP HA 1 64 VAL H . . 4.090 3.522 3.195 3.967 . 0 0 "[ . 1 . 2]" 1
1181 1 61 ASP HA 1 64 VAL HB . . 4.410 3.009 2.206 4.223 . 0 0 "[ . 1 . 2]" 1
1182 1 61 ASP HA 1 64 VAL MG1 . . 4.810 3.523 2.093 4.324 . 0 0 "[ . 1 . 2]" 1
1183 1 61 ASP HA 1 64 VAL QG . . 3.850 2.852 2.090 3.355 . 0 0 "[ . 1 . 2]" 1
1184 1 61 ASP HA 1 64 VAL MG2 . . 4.810 3.614 2.686 4.846 0.036 18 0 "[ . 1 . 2]" 1
1185 1 61 ASP QB 1 62 ARG H . . 3.200 2.929 2.499 3.293 0.093 16 0 "[ . 1 . 2]" 1
1186 1 61 ASP QB 1 62 ARG HA . . 4.760 4.543 3.799 4.784 0.024 20 0 "[ . 1 . 2]" 1
1187 1 61 ASP QB 1 64 VAL QG . . 5.280 4.105 3.715 4.651 . 0 0 "[ . 1 . 2]" 1
1188 1 62 ARG H 1 62 ARG QB . . 2.900 2.242 2.004 2.538 . 0 0 "[ . 1 . 2]" 1
1189 1 62 ARG H 1 62 ARG QD . . 4.920 4.383 3.821 4.811 . 0 0 "[ . 1 . 2]" 1
1190 1 62 ARG H 1 62 ARG QG . . 4.490 3.553 2.302 4.083 . 0 0 "[ . 1 . 2]" 1
1191 1 62 ARG H 1 63 GLU H . . 3.230 2.860 2.355 3.057 . 0 0 "[ . 1 . 2]" 1
1192 1 62 ARG H 1 64 VAL H . . 4.700 4.323 4.025 4.475 . 0 0 "[ . 1 . 2]" 1
1193 1 62 ARG H 1 65 ARG QD . . 5.500 4.464 3.867 5.475 . 0 0 "[ . 1 . 2]" 1
1194 1 62 ARG HA 1 62 ARG QD . . 4.480 3.357 2.083 4.180 . 0 0 "[ . 1 . 2]" 1
1195 1 62 ARG HA 1 62 ARG QG . . 3.410 2.582 2.269 3.114 . 0 0 "[ . 1 . 2]" 1
1196 1 62 ARG HA 1 65 ARG H . . 4.190 3.890 3.186 4.158 . 0 0 "[ . 1 . 2]" 1
1197 1 62 ARG HA 1 65 ARG QD . . 4.470 2.593 2.150 3.402 . 0 0 "[ . 1 . 2]" 1
1198 1 62 ARG QB 1 63 GLU H . . 3.240 2.790 2.470 3.181 . 0 0 "[ . 1 . 2]" 1
1199 1 62 ARG QD 1 63 GLU H . . 5.450 4.648 3.408 5.342 . 0 0 "[ . 1 . 2]" 1
1200 1 62 ARG QD 1 66 GLN HE21 . . 5.220 3.780 2.057 5.071 . 0 0 "[ . 1 . 2]" 1
1201 1 62 ARG QD 1 66 GLN QE . . 4.550 3.358 2.006 4.573 0.023 7 0 "[ . 1 . 2]" 1
1202 1 62 ARG QD 1 66 GLN HE22 . . 5.220 3.885 2.470 5.243 0.023 4 0 "[ . 1 . 2]" 1
1203 1 62 ARG QG 1 63 GLU H . . 5.390 4.117 3.541 4.767 . 0 0 "[ . 1 . 2]" 1
1204 1 63 GLU H 1 63 GLU HB2 . . 4.040 2.475 2.087 3.076 . 0 0 "[ . 1 . 2]" 1
1205 1 63 GLU H 1 63 GLU QB . . 3.460 2.322 2.066 2.571 . 0 0 "[ . 1 . 2]" 1
1206 1 63 GLU H 1 63 GLU HB3 . . 4.040 3.179 2.323 3.678 . 0 0 "[ . 1 . 2]" 1
1207 1 63 GLU H 1 63 GLU HG2 . . 4.920 3.763 2.243 4.756 . 0 0 "[ . 1 . 2]" 1
1208 1 63 GLU H 1 63 GLU QG . . 4.310 3.414 2.222 4.187 . 0 0 "[ . 1 . 2]" 1
1209 1 63 GLU H 1 63 GLU HG3 . . 4.920 4.207 3.618 4.648 . 0 0 "[ . 1 . 2]" 1
1210 1 63 GLU H 1 64 VAL H . . 3.170 2.549 2.318 2.904 . 0 0 "[ . 1 . 2]" 1
1211 1 63 GLU H 1 64 VAL QG . . 4.580 4.102 3.810 4.702 0.122 17 0 "[ . 1 . 2]" 1
1212 1 63 GLU H 1 65 ARG H . . 4.540 4.292 3.991 4.514 . 0 0 "[ . 1 . 2]" 1
1213 1 63 GLU H 1 65 ARG QD . . 5.500 5.366 4.948 5.568 0.068 18 0 "[ . 1 . 2]" 1
1214 1 63 GLU HA 1 63 GLU HG2 . . 3.960 3.474 2.772 3.872 . 0 0 "[ . 1 . 2]" 1
1215 1 63 GLU HA 1 63 GLU QG . . 3.470 2.830 2.339 3.249 . 0 0 "[ . 1 . 2]" 1
1216 1 63 GLU HA 1 63 GLU HG3 . . 3.960 3.200 2.368 3.868 . 0 0 "[ . 1 . 2]" 1
1217 1 63 GLU HA 1 65 ARG H . . 5.010 4.623 4.420 4.804 . 0 0 "[ . 1 . 2]" 1
1218 1 63 GLU HA 1 66 GLN H . . 3.730 3.502 3.112 3.737 0.007 3 0 "[ . 1 . 2]" 1
1219 1 63 GLU HA 1 66 GLN QB . . 3.360 2.798 2.246 3.455 0.095 18 0 "[ . 1 . 2]" 1
1220 1 63 GLU HA 1 66 GLN QE . . 4.960 3.504 2.196 4.972 0.012 16 0 "[ . 1 . 2]" 1
1221 1 63 GLU HA 1 66 GLN QG . . 4.480 3.610 2.137 4.310 . 0 0 "[ . 1 . 2]" 1
1222 1 63 GLU HA 1 67 ALA H . . 5.500 4.081 3.711 4.426 . 0 0 "[ . 1 . 2]" 1
1223 1 63 GLU QB 1 64 VAL H . . 3.590 2.802 2.600 3.098 . 0 0 "[ . 1 . 2]" 1
1224 1 63 GLU HB2 1 64 VAL H . . 4.380 3.397 2.728 4.173 . 0 0 "[ . 1 . 2]" 1
1225 1 63 GLU HB3 1 64 VAL H . . 4.380 3.294 2.642 4.111 . 0 0 "[ . 1 . 2]" 1
1226 1 63 GLU QG 1 64 VAL H . . 5.130 4.192 3.359 4.699 . 0 0 "[ . 1 . 2]" 1
1227 1 64 VAL H 1 64 VAL HB . . 2.930 2.411 2.227 2.619 . 0 0 "[ . 1 . 2]" 1
1228 1 64 VAL H 1 64 VAL MG1 . . 3.930 3.470 2.367 3.831 . 0 0 "[ . 1 . 2]" 1
1229 1 64 VAL H 1 64 VAL QG . . 3.000 2.348 2.135 2.719 . 0 0 "[ . 1 . 2]" 1
1230 1 64 VAL H 1 64 VAL MG2 . . 3.930 2.683 2.146 3.825 . 0 0 "[ . 1 . 2]" 1
1231 1 64 VAL H 1 65 ARG H . . 3.270 2.807 2.648 2.902 . 0 0 "[ . 1 . 2]" 1
1232 1 64 VAL H 1 65 ARG QG . . 5.500 4.282 3.778 4.956 . 0 0 "[ . 1 . 2]" 1
1233 1 64 VAL H 1 66 GLN H . . 4.600 4.161 4.001 4.350 . 0 0 "[ . 1 . 2]" 1
1234 1 64 VAL H 1 67 ALA H . . 4.980 4.800 4.616 4.991 0.011 18 0 "[ . 1 . 2]" 1
1235 1 64 VAL H 1 67 ALA MB . . 4.880 4.739 4.503 4.912 0.032 11 0 "[ . 1 . 2]" 1
1236 1 64 VAL HA 1 64 VAL MG1 . . 3.460 2.696 2.296 3.259 . 0 0 "[ . 1 . 2]" 1
1237 1 64 VAL HA 1 64 VAL QG . . 2.990 2.160 2.105 2.222 . 0 0 "[ . 1 . 2]" 1
1238 1 64 VAL HA 1 64 VAL MG2 . . 3.460 2.317 2.149 2.445 . 0 0 "[ . 1 . 2]" 1
1239 1 64 VAL HA 1 66 GLN H . . 4.600 4.341 3.912 4.580 . 0 0 "[ . 1 . 2]" 1
1240 1 64 VAL HA 1 67 ALA H . . 4.110 3.500 3.156 3.847 . 0 0 "[ . 1 . 2]" 1
1241 1 64 VAL HA 1 67 ALA MB . . 3.590 2.644 2.343 2.851 . 0 0 "[ . 1 . 2]" 1
1242 1 64 VAL HA 1 68 MET H . . 4.740 3.934 3.693 4.157 . 0 0 "[ . 1 . 2]" 1
1243 1 64 VAL HA 1 93 PHE QE . . 5.500 4.953 4.247 5.484 . 0 0 "[ . 1 . 2]" 1
1244 1 64 VAL HB 1 65 ARG H . . 4.090 2.929 2.445 4.028 . 0 0 "[ . 1 . 2]" 1
1245 1 64 VAL QG 1 65 ARG H . . 3.510 2.878 2.154 3.299 . 0 0 "[ . 1 . 2]" 1
1246 1 64 VAL QG 1 65 ARG HA . . 4.450 3.336 3.076 3.876 . 0 0 "[ . 1 . 2]" 1
1247 1 64 VAL QG 1 66 GLN H . . 4.810 4.503 4.181 4.694 . 0 0 "[ . 1 . 2]" 1
1248 1 64 VAL QG 1 67 ALA H . . 4.720 4.447 4.203 4.656 . 0 0 "[ . 1 . 2]" 1
1249 1 64 VAL QG 1 67 ALA MB . . 4.280 3.440 3.067 3.745 . 0 0 "[ . 1 . 2]" 1
1250 1 64 VAL QG 1 68 MET H . . 4.580 3.857 3.599 4.071 . 0 0 "[ . 1 . 2]" 1
1251 1 64 VAL QG 1 68 MET QB . . 4.650 3.788 3.526 4.104 . 0 0 "[ . 1 . 2]" 1
1252 1 64 VAL QG 1 68 MET QG . . 4.280 2.767 2.406 3.119 . 0 0 "[ . 1 . 2]" 1
1253 1 64 VAL QG 1 91 PHE QB . . 4.060 2.852 2.511 3.255 . 0 0 "[ . 1 . 2]" 1
1254 1 64 VAL QG 1 91 PHE QD . . 3.700 2.608 2.288 2.897 . 0 0 "[ . 1 . 2]" 1
1255 1 64 VAL QG 1 91 PHE QE . . 3.620 2.571 2.155 2.850 . 0 0 "[ . 1 . 2]" 1
1256 1 64 VAL QG 1 93 PHE QE . . 3.620 2.462 2.057 3.396 . 0 0 "[ . 1 . 2]" 1
1257 1 64 VAL MG1 1 65 ARG H . . 4.090 2.980 2.167 3.566 . 0 0 "[ . 1 . 2]" 1
1258 1 64 VAL MG1 1 66 GLN H . . 5.500 4.817 4.395 5.086 . 0 0 "[ . 1 . 2]" 1
1259 1 64 VAL MG1 1 67 ALA H . . 5.440 4.917 4.502 5.366 . 0 0 "[ . 1 . 2]" 1
1260 1 64 VAL MG1 1 67 ALA MB . . 5.500 4.015 3.263 4.861 . 0 0 "[ . 1 . 2]" 1
1261 1 64 VAL MG1 1 91 PHE QD . . 4.360 3.052 2.349 4.231 . 0 0 "[ . 1 . 2]" 1
1262 1 64 VAL MG1 1 91 PHE QE . . 4.950 2.982 2.179 4.372 . 0 0 "[ . 1 . 2]" 1
1263 1 64 VAL MG2 1 65 ARG H . . 4.090 3.970 3.766 4.097 0.007 16 0 "[ . 1 . 2]" 1
1264 1 64 VAL MG2 1 66 GLN H . . 5.500 5.423 5.211 5.532 0.032 16 0 "[ . 1 . 2]" 1
1265 1 64 VAL MG2 1 67 ALA H . . 5.440 5.129 4.646 5.464 0.024 14 0 "[ . 1 . 2]" 1
1266 1 64 VAL MG2 1 67 ALA MB . . 5.500 3.911 3.119 4.320 . 0 0 "[ . 1 . 2]" 1
1267 1 64 VAL MG2 1 91 PHE QD . . 4.360 3.059 2.717 3.611 . 0 0 "[ . 1 . 2]" 1
1268 1 64 VAL MG2 1 91 PHE QE . . 4.950 3.458 2.646 4.213 . 0 0 "[ . 1 . 2]" 1
1269 1 65 ARG H 1 65 ARG QD . . 4.510 3.559 3.219 4.079 . 0 0 "[ . 1 . 2]" 1
1270 1 65 ARG H 1 65 ARG QG . . 2.950 2.236 1.920 2.598 . 0 0 "[ . 1 . 2]" 1
1271 1 65 ARG H 1 66 GLN H . . 3.400 2.773 2.634 2.883 . 0 0 "[ . 1 . 2]" 1
1272 1 65 ARG H 1 67 ALA H . . 4.640 4.317 4.116 4.440 . 0 0 "[ . 1 . 2]" 1
1273 1 65 ARG HA 1 67 ALA H . . 5.020 4.475 4.145 4.704 . 0 0 "[ . 1 . 2]" 1
1274 1 65 ARG HA 1 68 MET H . . 4.360 3.582 3.190 4.293 . 0 0 "[ . 1 . 2]" 1
1275 1 65 ARG HA 1 69 ALA H . . 4.970 4.108 3.645 4.718 . 0 0 "[ . 1 . 2]" 1
1276 1 65 ARG QB 1 66 GLN H . . 3.970 3.397 2.359 3.850 . 0 0 "[ . 1 . 2]" 1
1277 1 65 ARG QB 1 66 GLN HA . . 4.560 4.435 3.835 4.610 0.050 3 0 "[ . 1 . 2]" 1
1278 1 65 ARG QD 1 66 GLN H . . 5.500 4.460 2.525 5.018 . 0 0 "[ . 1 . 2]" 1
1279 1 65 ARG QG 1 66 GLN H . . 4.230 2.970 2.305 4.275 0.045 5 0 "[ . 1 . 2]" 1
1280 1 66 GLN H 1 66 GLN QB . . 2.870 2.314 2.083 2.697 . 0 0 "[ . 1 . 2]" 1
1281 1 66 GLN H 1 66 GLN HG2 . . 3.940 3.610 2.467 3.946 0.006 8 0 "[ . 1 . 2]" 1
1282 1 66 GLN H 1 66 GLN QG . . 3.170 2.673 2.443 3.121 . 0 0 "[ . 1 . 2]" 1
1283 1 66 GLN H 1 66 GLN HG3 . . 3.940 3.007 2.500 4.068 0.128 7 0 "[ . 1 . 2]" 1
1284 1 66 GLN H 1 67 ALA H . . 3.240 2.587 2.283 2.770 . 0 0 "[ . 1 . 2]" 1
1285 1 66 GLN H 1 67 ALA MB . . 4.230 4.205 3.912 4.281 0.051 5 0 "[ . 1 . 2]" 1
1286 1 66 GLN H 1 68 MET H . . 4.570 4.276 4.033 4.528 . 0 0 "[ . 1 . 2]" 1
1287 1 66 GLN HA 1 66 GLN QE . . 5.290 4.695 3.919 5.339 0.049 13 0 "[ . 1 . 2]" 1
1288 1 66 GLN HA 1 66 GLN HG2 . . 3.780 2.811 2.316 3.886 0.106 7 0 "[ . 1 . 2]" 1
1289 1 66 GLN HA 1 66 GLN QG . . 3.300 2.563 2.251 3.323 0.023 18 0 "[ . 1 . 2]" 1
1290 1 66 GLN HA 1 66 GLN HG3 . . 3.780 3.047 2.668 3.820 0.040 11 0 "[ . 1 . 2]" 1
1291 1 66 GLN HA 1 69 ALA H . . 3.970 3.570 3.273 3.954 . 0 0 "[ . 1 . 2]" 1
1292 1 66 GLN HA 1 69 ALA MB . . 3.310 2.698 2.310 3.069 . 0 0 "[ . 1 . 2]" 1
1293 1 66 GLN QB 1 67 ALA H . . 3.210 2.867 2.589 3.361 0.151 18 0 "[ . 1 . 2]" 1
1294 1 66 GLN QB 1 67 ALA MB . . 5.500 4.079 3.741 4.677 . 0 0 "[ . 1 . 2]" 1
1295 1 66 GLN QB 1 69 ALA MB . . 5.420 4.164 3.947 4.600 . 0 0 "[ . 1 . 2]" 1
1296 1 66 GLN QG 1 67 ALA H . . 4.800 3.935 2.170 4.476 . 0 0 "[ . 1 . 2]" 1
1297 1 67 ALA H 1 67 ALA MB . . 2.820 2.193 2.132 2.246 . 0 0 "[ . 1 . 2]" 1
1298 1 67 ALA H 1 68 MET H . . 3.090 2.834 2.682 2.956 . 0 0 "[ . 1 . 2]" 1
1299 1 67 ALA HA 1 69 ALA H . . 4.810 4.383 3.995 4.678 . 0 0 "[ . 1 . 2]" 1
1300 1 67 ALA HA 1 70 LYS H . . 4.290 3.748 3.428 4.299 0.009 20 0 "[ . 1 . 2]" 1
1301 1 67 ALA HA 1 70 LYS QB . . 4.550 3.670 2.692 4.574 0.024 11 0 "[ . 1 . 2]" 1
1302 1 67 ALA HA 1 70 LYS QE . . 3.910 2.851 1.956 3.963 0.053 9 0 "[ . 1 . 2]" 1
1303 1 67 ALA MB 1 68 MET H . . 3.200 2.395 2.283 2.598 . 0 0 "[ . 1 . 2]" 1
1304 1 67 ALA MB 1 68 MET HA . . 5.360 3.919 3.816 4.020 . 0 0 "[ . 1 . 2]" 1
1305 1 67 ALA MB 1 71 TRP HD1 . . 4.660 4.334 3.898 4.672 0.012 3 0 "[ . 1 . 2]" 1
1306 1 67 ALA MB 1 71 TRP HE1 . . 3.710 2.979 2.352 3.384 . 0 0 "[ . 1 . 2]" 1
1307 1 68 MET H 1 68 MET HB2 . . 3.600 2.433 2.315 2.503 . 0 0 "[ . 1 . 2]" 1
1308 1 68 MET H 1 68 MET QB . . 3.090 2.397 2.287 2.460 . 0 0 "[ . 1 . 2]" 1
1309 1 68 MET H 1 68 MET HB3 . . 3.600 3.600 3.568 3.621 0.021 14 0 "[ . 1 . 2]" 1
1310 1 68 MET H 1 68 MET ME . . 5.500 4.552 3.748 4.861 . 0 0 "[ . 1 . 2]" 1
1311 1 68 MET H 1 68 MET HG2 . . 3.700 3.301 2.240 3.703 0.003 9 0 "[ . 1 . 2]" 1
1312 1 68 MET H 1 68 MET QG . . 3.240 2.301 2.160 2.459 . 0 0 "[ . 1 . 2]" 1
1313 1 68 MET H 1 68 MET HG3 . . 3.700 2.541 2.185 3.654 . 0 0 "[ . 1 . 2]" 1
1314 1 68 MET H 1 69 ALA H . . 3.160 2.870 2.767 2.956 . 0 0 "[ . 1 . 2]" 1
1315 1 68 MET HA 1 68 MET ME . . 5.200 3.919 2.828 4.427 . 0 0 "[ . 1 . 2]" 1
1316 1 68 MET HA 1 68 MET QG . . 3.450 2.393 2.227 2.962 . 0 0 "[ . 1 . 2]" 1
1317 1 68 MET HA 1 71 TRP H . . 4.140 3.233 2.838 3.764 . 0 0 "[ . 1 . 2]" 1
1318 1 68 MET HA 1 71 TRP QB . . 4.870 3.028 2.467 3.447 . 0 0 "[ . 1 . 2]" 1
1319 1 68 MET HA 1 71 TRP HD1 . . 4.350 3.626 3.114 4.198 . 0 0 "[ . 1 . 2]" 1
1320 1 68 MET HA 1 71 TRP HE1 . . 4.310 3.981 3.426 4.357 0.047 17 0 "[ . 1 . 2]" 1
1321 1 68 MET QB 1 69 ALA H . . 3.390 2.890 2.642 3.201 . 0 0 "[ . 1 . 2]" 1
1322 1 68 MET HB2 1 69 ALA H . . 4.210 2.996 2.711 3.348 . 0 0 "[ . 1 . 2]" 1
1323 1 68 MET HB3 1 69 ALA H . . 4.210 3.806 3.583 4.074 . 0 0 "[ . 1 . 2]" 1
1324 1 68 MET ME 1 68 MET HG2 . . 3.330 2.704 2.274 3.387 0.057 13 0 "[ . 1 . 2]" 1
1325 1 68 MET ME 1 68 MET HG3 . . 3.330 2.947 2.430 3.378 0.048 18 0 "[ . 1 . 2]" 1
1326 1 68 MET ME 1 89 LYS QB . . 4.080 3.086 2.244 4.083 0.003 14 0 "[ . 1 . 2]" 1
1327 1 68 MET ME 1 91 PHE QE . . 3.730 3.235 2.269 3.740 0.010 6 0 "[ . 1 . 2]" 1
1328 1 68 MET QG 1 69 ALA H . . 5.060 4.338 4.208 4.489 . 0 0 "[ . 1 . 2]" 1
1329 1 69 ALA H 1 69 ALA MB . . 2.740 2.190 2.157 2.220 . 0 0 "[ . 1 . 2]" 1
1330 1 69 ALA H 1 70 LYS H . . 3.370 2.825 2.660 2.947 . 0 0 "[ . 1 . 2]" 1
1331 1 69 ALA HA 1 71 TRP H . . 4.650 4.044 3.822 4.394 . 0 0 "[ . 1 . 2]" 1
1332 1 69 ALA MB 1 70 LYS H . . 3.260 3.018 2.797 3.264 0.004 7 0 "[ . 1 . 2]" 1
1333 1 69 ALA MB 1 70 LYS QB . . 5.500 4.313 3.642 4.788 . 0 0 "[ . 1 . 2]" 1
1334 1 69 ALA MB 1 71 TRP H . . 4.990 4.604 4.455 4.894 . 0 0 "[ . 1 . 2]" 1
1335 1 70 LYS H 1 70 LYS QD . . 4.730 3.899 2.167 4.755 0.025 17 0 "[ . 1 . 2]" 1
1336 1 70 LYS H 1 70 LYS QE . . 4.420 3.943 2.822 4.452 0.032 1 0 "[ . 1 . 2]" 1
1337 1 70 LYS HA 1 70 LYS QG . . 3.400 2.614 2.293 3.393 . 0 0 "[ . 1 . 2]" 1
1338 1 70 LYS QB 1 70 LYS QE . . 3.590 2.448 2.001 3.539 . 0 0 "[ . 1 . 2]" 1
1339 1 70 LYS QE 1 70 LYS QG . . 3.380 2.285 2.065 2.457 . 0 0 "[ . 1 . 2]" 1
1340 1 70 LYS QG 1 71 TRP H . . 5.390 4.208 3.033 4.915 . 0 0 "[ . 1 . 2]" 1
1341 1 71 TRP H 1 71 TRP HB2 . . 3.820 2.429 2.287 2.526 . 0 0 "[ . 1 . 2]" 1
1342 1 71 TRP H 1 71 TRP QB . . 3.300 2.392 2.262 2.481 . 0 0 "[ . 1 . 2]" 1
1343 1 71 TRP H 1 71 TRP HB3 . . 3.820 3.594 3.559 3.632 . 0 0 "[ . 1 . 2]" 1
1344 1 71 TRP H 1 71 TRP HD1 . . 4.020 2.762 2.440 3.011 . 0 0 "[ . 1 . 2]" 1
1345 1 71 TRP H 1 72 ARG H . . 4.620 4.657 4.640 4.676 0.056 16 0 "[ . 1 . 2]" 1
1346 1 71 TRP HA 1 71 TRP HD1 . . 4.120 2.585 2.444 2.741 . 0 0 "[ . 1 . 2]" 1
1347 1 71 TRP HA 1 71 TRP HE3 . . 5.500 5.086 4.932 5.202 . 0 0 "[ . 1 . 2]" 1
1348 1 71 TRP HA 1 72 ARG H . . 3.070 2.270 2.165 2.406 . 0 0 "[ . 1 . 2]" 1
1349 1 71 TRP QB 1 72 ARG H . . 3.530 2.629 2.398 2.898 . 0 0 "[ . 1 . 2]" 1
1350 1 71 TRP HB2 1 72 ARG H . . 4.380 3.899 3.657 4.126 . 0 0 "[ . 1 . 2]" 1
1351 1 71 TRP HB3 1 72 ARG H . . 4.380 2.674 2.428 2.960 . 0 0 "[ . 1 . 2]" 1
1352 1 71 TRP HH2 1 89 LYS QD . . 5.340 4.338 2.902 5.066 . 0 0 "[ . 1 . 2]" 1
1353 1 71 TRP HH2 1 89 LYS HE2 . . 4.700 3.905 2.222 4.726 0.026 8 0 "[ . 1 . 2]" 1
1354 1 71 TRP HH2 1 89 LYS QE . . 3.960 2.930 2.203 3.649 . 0 0 "[ . 1 . 2]" 1
1355 1 71 TRP HH2 1 89 LYS HE3 . . 4.700 3.332 2.464 4.334 . 0 0 "[ . 1 . 2]" 1
1356 1 71 TRP HH2 1 89 LYS QG . . 5.290 3.258 2.531 3.858 . 0 0 "[ . 1 . 2]" 1
1357 1 71 TRP HZ3 1 89 LYS HE2 . . 5.130 4.231 3.510 5.155 0.025 11 0 "[ . 1 . 2]" 1
1358 1 71 TRP HZ3 1 89 LYS QE . . 4.410 3.604 2.501 4.414 0.004 10 0 "[ . 1 . 2]" 1
1359 1 71 TRP HZ3 1 89 LYS HE3 . . 5.130 4.254 2.536 5.165 0.035 2 0 "[ . 1 . 2]" 1
1360 1 72 ARG H 1 72 ARG QB . . 3.230 2.744 2.597 2.889 . 0 0 "[ . 1 . 2]" 1
1361 1 72 ARG H 1 73 PHE H . . 4.550 4.303 4.148 4.433 . 0 0 "[ . 1 . 2]" 1
1362 1 72 ARG HA 1 72 ARG HD2 . . 3.950 2.909 2.111 3.884 . 0 0 "[ . 1 . 2]" 1
1363 1 72 ARG HA 1 72 ARG QD . . 3.410 2.243 2.054 2.608 . 0 0 "[ . 1 . 2]" 1
1364 1 72 ARG HA 1 72 ARG HD3 . . 3.950 2.781 2.072 3.767 . 0 0 "[ . 1 . 2]" 1
1365 1 72 ARG HA 1 73 PHE H . . 2.940 2.121 2.053 2.172 . 0 0 "[ . 1 . 2]" 1
1366 1 72 ARG HA 1 73 PHE QD . . 4.860 3.569 3.262 3.865 . 0 0 "[ . 1 . 2]" 1
1367 1 72 ARG QB 1 72 ARG HE . . 4.980 3.500 2.056 4.379 . 0 0 "[ . 1 . 2]" 1
1368 1 72 ARG QB 1 73 PHE H . . 3.810 3.542 2.857 3.771 . 0 0 "[ . 1 . 2]" 1
1369 1 72 ARG HB2 1 73 PHE H . . 4.530 4.185 4.006 4.418 . 0 0 "[ . 1 . 2]" 1
1370 1 72 ARG HB3 1 73 PHE H . . 4.530 3.871 2.925 4.251 . 0 0 "[ . 1 . 2]" 1
1371 1 72 ARG QD 1 73 PHE H . . 4.060 2.662 2.085 3.450 . 0 0 "[ . 1 . 2]" 1
1372 1 72 ARG HD2 1 73 PHE H . . 4.900 3.114 2.115 3.851 . 0 0 "[ . 1 . 2]" 1
1373 1 72 ARG HD3 1 73 PHE H . . 4.900 3.560 2.097 4.829 . 0 0 "[ . 1 . 2]" 1
1374 1 72 ARG HG2 1 73 PHE H . . 5.050 4.326 3.686 5.004 . 0 0 "[ . 1 . 2]" 1
1375 1 72 ARG HG3 1 73 PHE H . . 5.050 3.245 2.273 5.071 0.021 4 0 "[ . 1 . 2]" 1
1376 1 73 PHE H 1 73 PHE HB2 . . 4.070 2.570 2.479 2.690 . 0 0 "[ . 1 . 2]" 1
1377 1 73 PHE H 1 73 PHE HB3 . . 4.070 3.694 3.642 3.762 . 0 0 "[ . 1 . 2]" 1
1378 1 73 PHE H 1 82 ILE MD . . 5.330 4.409 3.986 5.250 . 0 0 "[ . 1 . 2]" 1
1379 1 73 PHE HA 1 74 GLU H . . 2.950 2.324 2.218 2.410 . 0 0 "[ . 1 . 2]" 1
1380 1 73 PHE QB 1 74 GLU H . . 3.730 2.482 2.351 2.641 . 0 0 "[ . 1 . 2]" 1
1381 1 73 PHE QB 1 82 ILE MD . . 3.690 2.877 2.491 3.496 . 0 0 "[ . 1 . 2]" 1
1382 1 73 PHE HB2 1 74 GLU H . . 4.410 3.882 3.776 4.001 . 0 0 "[ . 1 . 2]" 1
1383 1 73 PHE HB2 1 82 ILE MD . . 4.400 3.374 3.008 4.155 . 0 0 "[ . 1 . 2]" 1
1384 1 73 PHE HB3 1 74 GLU H . . 4.410 2.511 2.374 2.679 . 0 0 "[ . 1 . 2]" 1
1385 1 73 PHE HB3 1 82 ILE MD . . 4.400 3.126 2.658 3.761 . 0 0 "[ . 1 . 2]" 1
1386 1 74 GLU H 1 74 GLU QB . . 3.620 2.867 2.477 3.170 . 0 0 "[ . 1 . 2]" 1
1387 1 74 GLU H 1 74 GLU QG . . 3.730 2.944 2.261 3.736 0.006 3 0 "[ . 1 . 2]" 1
1388 1 74 GLU H 1 75 PRO HD2 . . 5.320 4.883 4.798 4.963 . 0 0 "[ . 1 . 2]" 1
1389 1 74 GLU H 1 75 PRO QD . . 4.620 4.452 4.413 4.483 . 0 0 "[ . 1 . 2]" 1
1390 1 74 GLU H 1 75 PRO HD3 . . 5.320 5.138 5.036 5.240 . 0 0 "[ . 1 . 2]" 1
1391 1 74 GLU H 1 82 ILE MD . . 4.380 3.750 3.289 4.292 . 0 0 "[ . 1 . 2]" 1
1392 1 74 GLU HA 1 74 GLU QG . . 3.790 2.969 2.130 3.418 . 0 0 "[ . 1 . 2]" 1
1393 1 74 GLU HA 1 75 PRO HD2 . . 3.200 2.471 2.258 2.665 . 0 0 "[ . 1 . 2]" 1
1394 1 74 GLU HA 1 75 PRO HD3 . . 3.200 2.619 2.475 2.733 . 0 0 "[ . 1 . 2]" 1
1395 1 74 GLU HA 1 75 PRO QG . . 4.620 4.169 4.051 4.294 . 0 0 "[ . 1 . 2]" 1
1396 1 74 GLU HA 1 82 ILE MD . . 3.460 2.445 2.144 2.909 . 0 0 "[ . 1 . 2]" 1
1397 1 74 GLU QB 1 75 PRO QD . . 3.240 2.149 2.010 2.328 . 0 0 "[ . 1 . 2]" 1
1398 1 74 GLU QG 1 75 PRO QD . . 4.040 3.421 2.257 3.864 . 0 0 "[ . 1 . 2]" 1
1399 1 75 PRO HA 1 76 ARG H . . 2.980 2.263 2.198 2.336 . 0 0 "[ . 1 . 2]" 1
1400 1 75 PRO HA 1 76 ARG QB . . 5.030 4.095 3.962 4.176 . 0 0 "[ . 1 . 2]" 1
1401 1 75 PRO HA 1 77 VAL H . . 4.110 4.106 3.942 4.152 0.042 7 0 "[ . 1 . 2]" 1
1402 1 75 PRO HA 1 82 ILE MD . . 4.230 3.717 3.184 4.131 . 0 0 "[ . 1 . 2]" 1
1403 1 75 PRO HA 1 82 ILE QG . . 4.480 2.967 2.639 3.211 . 0 0 "[ . 1 . 2]" 1
1404 1 75 PRO QB 1 76 ARG H . . 3.390 2.938 2.800 3.045 . 0 0 "[ . 1 . 2]" 1
1405 1 75 PRO QB 1 80 GLY H . . 4.560 3.586 3.045 4.067 . 0 0 "[ . 1 . 2]" 1
1406 1 75 PRO QB 1 80 GLY QA . . 4.260 2.898 2.370 3.503 . 0 0 "[ . 1 . 2]" 1
1407 1 75 PRO QB 1 81 LYS H . . 4.110 3.577 2.862 4.117 0.007 1 0 "[ . 1 . 2]" 1
1408 1 75 PRO HB2 1 76 ARG H . . 4.130 3.071 2.912 3.207 . 0 0 "[ . 1 . 2]" 1
1409 1 75 PRO HB2 1 77 VAL H . . 4.620 2.677 2.452 2.902 . 0 0 "[ . 1 . 2]" 1
1410 1 75 PRO HB2 1 80 GLY H . . 5.420 3.696 3.121 4.203 . 0 0 "[ . 1 . 2]" 1
1411 1 75 PRO HB3 1 76 ARG H . . 4.130 3.751 3.629 3.837 . 0 0 "[ . 1 . 2]" 1
1412 1 75 PRO HB3 1 77 VAL H . . 4.620 4.290 4.054 4.450 . 0 0 "[ . 1 . 2]" 1
1413 1 75 PRO HB3 1 80 GLY H . . 5.420 4.846 4.184 5.424 0.004 6 0 "[ . 1 . 2]" 1
1414 1 75 PRO QD 1 82 ILE MD . . 3.400 2.485 2.222 2.850 . 0 0 "[ . 1 . 2]" 1
1415 1 75 PRO HD2 1 82 ILE MD . . 4.020 3.667 3.504 4.023 0.003 7 0 "[ . 1 . 2]" 1
1416 1 75 PRO HD3 1 82 ILE MD . . 4.020 2.532 2.246 2.951 . 0 0 "[ . 1 . 2]" 1
1417 1 75 PRO QG 1 80 GLY QA . . 4.410 3.448 2.888 3.981 . 0 0 "[ . 1 . 2]" 1
1418 1 75 PRO QG 1 81 LYS HA . . 4.630 3.304 2.314 4.343 . 0 0 "[ . 1 . 2]" 1
1419 1 75 PRO HG2 1 76 ARG H . . 5.500 4.688 4.548 4.799 . 0 0 "[ . 1 . 2]" 1
1420 1 75 PRO HG2 1 77 VAL H . . 5.500 4.235 3.618 4.672 . 0 0 "[ . 1 . 2]" 1
1421 1 75 PRO HG2 1 80 GLY H . . 4.470 3.569 2.430 4.175 . 0 0 "[ . 1 . 2]" 1
1422 1 75 PRO HG3 1 76 ARG H . . 5.500 5.431 5.330 5.504 0.004 13 0 "[ . 1 . 2]" 1
1423 1 75 PRO HG3 1 77 VAL H . . 5.500 5.185 4.732 5.525 0.025 13 0 "[ . 1 . 2]" 1
1424 1 75 PRO HG3 1 80 GLY H . . 4.470 3.767 2.640 4.472 0.002 12 0 "[ . 1 . 2]" 1
1425 1 76 ARG H 1 76 ARG HB2 . . 3.240 2.559 2.318 2.726 . 0 0 "[ . 1 . 2]" 1
1426 1 76 ARG H 1 76 ARG QB . . 2.790 2.212 2.155 2.276 . 0 0 "[ . 1 . 2]" 1
1427 1 76 ARG H 1 76 ARG HB3 . . 3.240 2.452 2.277 2.873 . 0 0 "[ . 1 . 2]" 1
1428 1 76 ARG H 1 76 ARG QD . . 4.900 4.389 4.182 4.824 . 0 0 "[ . 1 . 2]" 1
1429 1 76 ARG H 1 76 ARG QG . . 4.540 4.011 3.945 4.078 . 0 0 "[ . 1 . 2]" 1
1430 1 76 ARG HA 1 76 ARG QD . . 3.800 3.444 2.103 3.971 0.171 13 0 "[ . 1 . 2]" 1
1431 1 76 ARG HA 1 76 ARG QG . . 3.480 2.551 2.145 3.139 . 0 0 "[ . 1 . 2]" 1
1432 1 76 ARG HB2 1 77 VAL H . . 4.090 4.054 3.924 4.138 0.048 10 0 "[ . 1 . 2]" 1
1433 1 76 ARG HB3 1 77 VAL H . . 4.090 2.906 2.604 3.351 . 0 0 "[ . 1 . 2]" 1
1434 1 76 ARG QD 1 77 VAL H . . 5.470 4.403 3.103 5.443 . 0 0 "[ . 1 . 2]" 1
1435 1 76 ARG QG 1 77 VAL H . . 4.620 3.971 3.292 4.487 . 0 0 "[ . 1 . 2]" 1
1436 1 76 ARG QG 1 77 VAL HA . . 5.210 4.365 3.730 5.160 . 0 0 "[ . 1 . 2]" 1
1437 1 77 VAL H 1 77 VAL HB . . 2.860 2.546 2.319 2.879 0.019 11 0 "[ . 1 . 2]" 1
1438 1 77 VAL H 1 77 VAL QG . . 2.980 2.524 2.233 2.838 . 0 0 "[ . 1 . 2]" 1
1439 1 77 VAL H 1 78 SER H . . 4.540 4.475 4.291 4.577 0.037 9 0 "[ . 1 . 2]" 1
1440 1 77 VAL H 1 80 GLY H . . 4.660 4.509 4.007 4.709 0.049 7 0 "[ . 1 . 2]" 1
1441 1 77 VAL HA 1 77 VAL QG . . 2.820 2.150 2.131 2.171 . 0 0 "[ . 1 . 2]" 1
1442 1 77 VAL HA 1 78 SER H . . 2.690 2.197 2.131 2.256 . 0 0 "[ . 1 . 2]" 1
1443 1 77 VAL HB 1 78 SER H . . 4.480 4.260 3.921 4.490 0.010 18 0 "[ . 1 . 2]" 1
1444 1 77 VAL HB 1 80 GLY H . . 5.110 3.511 2.936 4.271 . 0 0 "[ . 1 . 2]" 1
1445 1 77 VAL HB 1 80 GLY HA2 . . 5.500 4.199 3.255 5.285 . 0 0 "[ . 1 . 2]" 1
1446 1 77 VAL HB 1 80 GLY HA3 . . 5.500 2.984 2.203 4.290 . 0 0 "[ . 1 . 2]" 1
1447 1 77 VAL QG 1 78 SER H . . 3.100 2.757 2.373 3.156 0.056 19 0 "[ . 1 . 2]" 1
1448 1 77 VAL QG 1 80 GLY H . . 4.500 3.041 2.513 4.068 . 0 0 "[ . 1 . 2]" 1
1449 1 77 VAL QG 1 80 GLY QA . . 5.090 3.215 2.515 4.361 . 0 0 "[ . 1 . 2]" 1
1450 1 78 SER H 1 78 SER QB . . 2.910 2.405 2.151 2.677 . 0 0 "[ . 1 . 2]" 1
1451 1 78 SER H 1 79 GLY H . . 4.850 3.816 2.767 4.670 . 0 0 "[ . 1 . 2]" 1
1452 1 78 SER HA 1 80 GLY H . . 4.140 3.562 3.138 3.874 . 0 0 "[ . 1 . 2]" 1
1453 1 78 SER QB 1 79 GLY H . . 4.960 3.407 2.672 3.941 . 0 0 "[ . 1 . 2]" 1
1454 1 79 GLY H 1 80 GLY H . . 3.570 2.678 2.414 2.860 . 0 0 "[ . 1 . 2]" 1
1455 1 79 GLY QA 1 80 GLY H . . 3.050 2.982 2.915 3.022 . 0 0 "[ . 1 . 2]" 1
1456 1 80 GLY HA2 1 81 LYS H . . 2.950 2.569 2.387 2.745 . 0 0 "[ . 1 . 2]" 1
1457 1 80 GLY HA3 1 81 LYS H . . 2.950 2.509 2.370 2.784 . 0 0 "[ . 1 . 2]" 1
1458 1 81 LYS H 1 81 LYS QB . . 2.980 2.730 2.446 3.058 0.078 20 0 "[ . 1 . 2]" 1
1459 1 81 LYS H 1 81 LYS QG . . 3.450 2.986 2.253 3.450 0.000 10 0 "[ . 1 . 2]" 1
1460 1 81 LYS H 1 82 ILE H . . 4.540 4.449 4.316 4.554 0.014 14 0 "[ . 1 . 2]" 1
1461 1 81 LYS HA 1 81 LYS QD . . 4.440 3.784 2.199 4.479 0.039 20 0 "[ . 1 . 2]" 1
1462 1 81 LYS HA 1 81 LYS QG . . 3.680 2.743 2.269 3.403 . 0 0 "[ . 1 . 2]" 1
1463 1 81 LYS HA 1 82 ILE H . . 2.790 2.258 2.110 2.536 . 0 0 "[ . 1 . 2]" 1
1464 1 81 LYS QB 1 81 LYS QE . . 3.610 2.857 2.087 3.636 0.026 3 0 "[ . 1 . 2]" 1
1465 1 81 LYS QB 1 82 ILE H . . 3.140 2.721 2.152 3.161 0.021 18 0 "[ . 1 . 2]" 1
1466 1 81 LYS QG 1 82 ILE H . . 4.310 3.883 3.195 4.398 0.088 13 0 "[ . 1 . 2]" 1
1467 1 82 ILE H 1 82 ILE HB . . 3.050 2.504 2.302 2.690 . 0 0 "[ . 1 . 2]" 1
1468 1 82 ILE H 1 82 ILE MD . . 3.980 3.740 3.227 3.996 0.016 5 0 "[ . 1 . 2]" 1
1469 1 82 ILE H 1 82 ILE QG . . 3.860 2.537 2.224 2.866 . 0 0 "[ . 1 . 2]" 1
1470 1 82 ILE H 1 82 ILE MG . . 4.030 3.839 3.751 3.923 . 0 0 "[ . 1 . 2]" 1
1471 1 82 ILE H 1 83 VAL H . . 4.730 4.532 4.341 4.655 . 0 0 "[ . 1 . 2]" 1
1472 1 82 ILE HA 1 82 ILE MD . . 3.960 3.887 3.809 3.943 . 0 0 "[ . 1 . 2]" 1
1473 1 82 ILE HA 1 82 ILE HG12 . . 3.930 2.587 2.426 2.702 . 0 0 "[ . 1 . 2]" 1
1474 1 82 ILE HA 1 82 ILE QG . . 3.360 2.430 2.283 2.531 . 0 0 "[ . 1 . 2]" 1
1475 1 82 ILE HA 1 82 ILE HG13 . . 3.930 2.969 2.646 3.137 . 0 0 "[ . 1 . 2]" 1
1476 1 82 ILE HA 1 82 ILE MG . . 3.190 2.463 2.373 2.590 . 0 0 "[ . 1 . 2]" 1
1477 1 82 ILE HA 1 83 VAL H . . 2.840 2.171 2.125 2.255 . 0 0 "[ . 1 . 2]" 1
1478 1 82 ILE HB 1 82 ILE MD . . 3.270 2.380 2.284 2.480 . 0 0 "[ . 1 . 2]" 1
1479 1 82 ILE HB 1 83 VAL H . . 4.790 4.222 4.065 4.328 . 0 0 "[ . 1 . 2]" 1
1480 1 82 ILE MG 1 83 VAL H . . 3.450 2.664 2.410 2.902 . 0 0 "[ . 1 . 2]" 1
1481 1 82 ILE MG 1 83 VAL HB . . 4.950 4.430 4.114 4.837 . 0 0 "[ . 1 . 2]" 1
1482 1 82 ILE MG 1 83 VAL QG . . 5.440 3.896 3.516 4.111 . 0 0 "[ . 1 . 2]" 1
1483 1 82 ILE MG 1 84 ALA H . . 4.650 3.958 3.711 4.289 . 0 0 "[ . 1 . 2]" 1
1484 1 82 ILE MG 1 84 ALA HA . . 4.160 3.303 2.920 3.669 . 0 0 "[ . 1 . 2]" 1
1485 1 82 ILE MG 1 84 ALA MB . . 4.440 4.016 3.631 4.368 . 0 0 "[ . 1 . 2]" 1
1486 1 83 VAL H 1 83 VAL HB . . 3.060 2.642 2.386 2.889 . 0 0 "[ . 1 . 2]" 1
1487 1 83 VAL H 1 83 VAL QG . . 4.240 2.407 2.133 2.853 . 0 0 "[ . 1 . 2]" 1
1488 1 83 VAL H 1 84 ALA H . . 4.510 4.477 4.317 4.551 0.041 16 0 "[ . 1 . 2]" 1
1489 1 83 VAL HA 1 84 ALA H . . 2.690 2.165 2.106 2.226 . 0 0 "[ . 1 . 2]" 1
1490 1 83 VAL HA 1 84 ALA MB . . 4.100 3.967 3.890 4.051 . 0 0 "[ . 1 . 2]" 1
1491 1 83 VAL HB 1 84 ALA H . . 4.530 4.264 3.922 4.472 . 0 0 "[ . 1 . 2]" 1
1492 1 83 VAL QG 1 84 ALA H . . 3.180 2.731 2.429 3.103 . 0 0 "[ . 1 . 2]" 1
1493 1 83 VAL QG 1 84 ALA HA . . 4.960 4.139 3.858 4.316 . 0 0 "[ . 1 . 2]" 1
1494 1 84 ALA H 1 84 ALA MB . . 2.840 2.218 2.178 2.257 . 0 0 "[ . 1 . 2]" 1
1495 1 84 ALA HA 1 85 ARG H . . 2.830 2.208 2.155 2.242 . 0 0 "[ . 1 . 2]" 1
1496 1 84 ALA MB 1 85 ARG H . . 3.110 2.950 2.722 3.109 . 0 0 "[ . 1 . 2]" 1
1497 1 85 ARG H 1 85 ARG QB . . 3.680 2.831 2.692 3.315 . 0 0 "[ . 1 . 2]" 1
1498 1 85 ARG HA 1 86 GLN H . . 3.040 2.271 2.177 2.340 . 0 0 "[ . 1 . 2]" 1
1499 1 85 ARG QB 1 86 GLN H . . 3.590 2.932 2.331 3.537 . 0 0 "[ . 1 . 2]" 1
1500 1 85 ARG QG 1 86 GLN H . . 4.130 3.221 2.244 4.253 0.123 15 0 "[ . 1 . 2]" 1
1501 1 86 GLN H 1 86 GLN QB . . 3.120 2.370 2.188 2.531 . 0 0 "[ . 1 . 2]" 1
1502 1 86 GLN H 1 87 ALA MB . . 5.500 4.996 4.817 5.136 . 0 0 "[ . 1 . 2]" 1
1503 1 86 GLN HA 1 86 GLN QE . . 5.120 2.161 1.895 2.678 . 0 0 "[ . 1 . 2]" 1
1504 1 86 GLN HA 1 87 ALA H . . 2.860 2.296 2.226 2.363 . 0 0 "[ . 1 . 2]" 1
1505 1 86 GLN HA 1 87 ALA MB . . 4.660 3.932 3.841 3.998 . 0 0 "[ . 1 . 2]" 1
1506 1 86 GLN QB 1 87 ALA H . . 3.480 2.999 2.697 3.580 0.100 13 0 "[ . 1 . 2]" 1
1507 1 86 GLN HB2 1 87 ALA H . . 4.300 4.043 3.808 4.253 . 0 0 "[ . 1 . 2]" 1
1508 1 86 GLN HB3 1 87 ALA H . . 4.300 3.113 2.750 3.880 . 0 0 "[ . 1 . 2]" 1
1509 1 86 GLN QE 1 87 ALA H . . 3.830 2.872 2.512 3.251 . 0 0 "[ . 1 . 2]" 1
1510 1 86 GLN QE 1 87 ALA MB . . 4.910 4.839 4.648 4.957 0.047 9 0 "[ . 1 . 2]" 1
1511 1 87 ALA H 1 87 ALA MB . . 3.420 2.697 2.630 2.770 . 0 0 "[ . 1 . 2]" 1
1512 1 87 ALA H 1 88 THR H . . 4.430 4.416 4.368 4.440 0.010 13 0 "[ . 1 . 2]" 1
1513 1 87 ALA H 1 88 THR MG . . 4.740 4.254 4.004 4.661 . 0 0 "[ . 1 . 2]" 1
1514 1 87 ALA HA 1 88 THR H . . 2.890 2.387 2.337 2.444 . 0 0 "[ . 1 . 2]" 1
1515 1 87 ALA HA 1 88 THR MG . . 4.290 3.474 3.290 3.721 . 0 0 "[ . 1 . 2]" 1
1516 1 87 ALA MB 1 88 THR H . . 3.010 2.457 2.299 2.693 . 0 0 "[ . 1 . 2]" 1
1517 1 87 ALA MB 1 88 THR HA . . 4.690 4.009 3.851 4.134 . 0 0 "[ . 1 . 2]" 1
1518 1 87 ALA MB 1 89 LYS H . . 5.500 5.491 5.327 5.548 0.048 14 0 "[ . 1 . 2]" 1
1519 1 88 THR H 1 88 THR HB . . 4.150 3.961 3.821 4.052 . 0 0 "[ . 1 . 2]" 1
1520 1 88 THR H 1 88 THR MG . . 3.580 2.846 2.681 3.054 . 0 0 "[ . 1 . 2]" 1
1521 1 88 THR H 1 89 LYS H . . 4.600 4.502 4.455 4.556 . 0 0 "[ . 1 . 2]" 1
1522 1 88 THR HA 1 88 THR MG . . 3.240 2.519 2.360 2.629 . 0 0 "[ . 1 . 2]" 1
1523 1 88 THR HA 1 89 LYS H . . 2.910 2.316 2.264 2.395 . 0 0 "[ . 1 . 2]" 1
1524 1 88 THR HA 1 89 LYS QB . . 5.340 3.919 3.736 4.031 . 0 0 "[ . 1 . 2]" 1
1525 1 88 THR HB 1 89 LYS H . . 3.280 2.285 2.195 2.424 . 0 0 "[ . 1 . 2]" 1
1526 1 88 THR HB 1 89 LYS HA . . 4.870 4.440 4.202 4.655 . 0 0 "[ . 1 . 2]" 1
1527 1 88 THR MG 1 89 LYS H . . 3.710 3.754 3.707 3.791 0.081 19 0 "[ . 1 . 2]" 1
1528 1 89 LYS H 1 89 LYS QB . . 3.470 2.763 2.613 2.858 . 0 0 "[ . 1 . 2]" 1
1529 1 89 LYS H 1 89 LYS QG . . 4.860 4.286 4.121 4.456 . 0 0 "[ . 1 . 2]" 1
1530 1 89 LYS HA 1 89 LYS HD2 . . 4.260 3.252 2.232 4.082 . 0 0 "[ . 1 . 2]" 1
1531 1 89 LYS HA 1 89 LYS QD . . 3.470 2.423 2.175 2.890 . 0 0 "[ . 1 . 2]" 1
1532 1 89 LYS HA 1 89 LYS HD3 . . 4.260 2.745 2.190 3.273 . 0 0 "[ . 1 . 2]" 1
1533 1 89 LYS HA 1 89 LYS QE . . 4.720 3.901 2.247 4.492 . 0 0 "[ . 1 . 2]" 1
1534 1 89 LYS HA 1 89 LYS QG . . 3.730 2.872 2.342 3.187 . 0 0 "[ . 1 . 2]" 1
1535 1 89 LYS HA 1 90 MET H . . 2.870 2.168 2.099 2.279 . 0 0 "[ . 1 . 2]" 1
1536 1 89 LYS QB 1 89 LYS QD . . 3.340 2.526 2.217 2.997 . 0 0 "[ . 1 . 2]" 1
1537 1 89 LYS QB 1 91 PHE QE . . 4.750 2.938 2.316 3.846 . 0 0 "[ . 1 . 2]" 1
1538 1 89 LYS HB2 1 90 MET H . . 4.680 4.255 4.065 4.457 . 0 0 "[ . 1 . 2]" 1
1539 1 89 LYS HB3 1 90 MET H . . 4.680 4.031 3.378 4.419 . 0 0 "[ . 1 . 2]" 1
1540 1 89 LYS QD 1 90 MET H . . 3.550 2.372 2.016 2.998 . 0 0 "[ . 1 . 2]" 1
1541 1 89 LYS HD2 1 90 MET H . . 4.350 3.131 2.268 3.863 . 0 0 "[ . 1 . 2]" 1
1542 1 89 LYS HD3 1 90 MET H . . 4.350 2.998 2.031 4.422 0.072 16 0 "[ . 1 . 2]" 1
1543 1 89 LYS QE 1 89 LYS QG . . 3.220 2.195 2.065 2.530 . 0 0 "[ . 1 . 2]" 1
1544 1 89 LYS QE 1 90 MET H . . 5.340 4.265 3.621 4.746 . 0 0 "[ . 1 . 2]" 1
1545 1 89 LYS QE 1 91 PHE QE . . 4.860 3.979 2.972 4.864 0.004 20 0 "[ . 1 . 2]" 1
1546 1 89 LYS HE2 1 89 LYS HG2 . . 4.210 2.731 2.355 3.687 . 0 0 "[ . 1 . 2]" 1
1547 1 89 LYS HE2 1 89 LYS HG3 . . 4.210 3.328 2.521 3.886 . 0 0 "[ . 1 . 2]" 1
1548 1 89 LYS HE3 1 89 LYS HG2 . . 4.210 2.832 2.350 3.474 . 0 0 "[ . 1 . 2]" 1
1549 1 89 LYS HE3 1 89 LYS HG3 . . 4.210 2.936 2.378 3.948 . 0 0 "[ . 1 . 2]" 1
1550 1 89 LYS QG 1 90 MET H . . 3.680 3.230 2.321 3.700 0.020 17 0 "[ . 1 . 2]" 1
1551 1 90 MET H 1 90 MET HB2 . . 4.110 2.694 2.279 3.102 . 0 0 "[ . 1 . 2]" 1
1552 1 90 MET H 1 90 MET QB . . 3.240 2.287 2.162 2.475 . 0 0 "[ . 1 . 2]" 1
1553 1 90 MET H 1 90 MET HB3 . . 4.110 2.801 2.242 3.686 . 0 0 "[ . 1 . 2]" 1
1554 1 90 MET H 1 90 MET ME . . 4.970 4.681 4.454 4.991 0.021 10 0 "[ . 1 . 2]" 1
1555 1 90 MET H 1 90 MET HG2 . . 5.130 4.128 3.111 4.649 . 0 0 "[ . 1 . 2]" 1
1556 1 90 MET H 1 90 MET QG . . 4.500 3.640 2.897 4.017 . 0 0 "[ . 1 . 2]" 1
1557 1 90 MET H 1 90 MET HG3 . . 5.130 4.087 3.286 4.420 . 0 0 "[ . 1 . 2]" 1
1558 1 90 MET H 1 91 PHE H . . 4.860 4.359 4.056 4.597 . 0 0 "[ . 1 . 2]" 1
1559 1 90 MET H 1 92 PHE QE . . 5.500 5.430 4.868 5.549 0.049 11 0 "[ . 1 . 2]" 1
1560 1 90 MET HA 1 90 MET ME . . 4.090 2.289 2.048 3.003 . 0 0 "[ . 1 . 2]" 1
1561 1 90 MET HA 1 90 MET QG . . 3.740 2.760 2.131 3.053 . 0 0 "[ . 1 . 2]" 1
1562 1 90 MET HA 1 91 PHE H . . 2.950 2.166 2.065 2.278 . 0 0 "[ . 1 . 2]" 1
1563 1 90 MET QB 1 91 PHE H . . 4.000 3.660 2.648 4.023 0.023 6 0 "[ . 1 . 2]" 1
1564 1 90 MET HB2 1 91 PHE H . . 4.590 4.384 3.972 4.528 . 0 0 "[ . 1 . 2]" 1
1565 1 90 MET HB3 1 91 PHE H . . 4.590 4.012 2.689 4.529 . 0 0 "[ . 1 . 2]" 1
1566 1 90 MET ME 1 91 PHE H . . 3.930 2.550 1.963 3.341 . 0 0 "[ . 1 . 2]" 1
1567 1 90 MET ME 1 92 PHE H . . 5.190 4.952 4.710 5.192 0.002 15 0 "[ . 1 . 2]" 1
1568 1 90 MET ME 1 92 PHE HA . . 4.360 4.308 4.003 4.407 0.047 13 0 "[ . 1 . 2]" 1
1569 1 90 MET ME 1 92 PHE QE . . 4.100 3.578 2.732 4.128 0.028 18 0 "[ . 1 . 2]" 1
1570 1 90 MET QG 1 91 PHE H . . 4.660 3.750 3.361 4.286 . 0 0 "[ . 1 . 2]" 1
1571 1 90 MET QG 1 92 PHE QE . . 4.190 2.754 2.169 3.776 . 0 0 "[ . 1 . 2]" 1
1572 1 90 MET HG2 1 91 PHE H . . 5.500 4.822 3.778 5.285 . 0 0 "[ . 1 . 2]" 1
1573 1 90 MET HG3 1 91 PHE H . . 5.500 4.196 3.421 5.504 0.004 8 0 "[ . 1 . 2]" 1
1574 1 91 PHE H 1 92 PHE H . . 4.680 4.525 4.172 4.652 . 0 0 "[ . 1 . 2]" 1
1575 1 91 PHE HA 1 91 PHE QD . . 4.040 2.803 2.575 3.002 . 0 0 "[ . 1 . 2]" 1
1576 1 91 PHE HA 1 92 PHE H . . 2.850 2.133 2.087 2.181 . 0 0 "[ . 1 . 2]" 1
1577 1 91 PHE QB 1 92 PHE H . . 3.810 3.130 2.899 3.605 . 0 0 "[ . 1 . 2]" 1
1578 1 91 PHE HB2 1 93 PHE QE . . 4.420 3.274 2.903 3.849 . 0 0 "[ . 1 . 2]" 1
1579 1 91 PHE HB3 1 93 PHE QE . . 4.420 2.803 2.566 3.134 . 0 0 "[ . 1 . 2]" 1
1580 1 91 PHE QD 1 92 PHE H . . 4.190 3.485 3.201 4.027 . 0 0 "[ . 1 . 2]" 1
1581 1 91 PHE QD 1 93 PHE H . . 5.500 5.547 5.499 5.582 0.082 15 0 "[ . 1 . 2]" 1
1582 1 92 PHE H 1 92 PHE HB2 . . 3.160 2.593 2.444 2.779 . 0 0 "[ . 1 . 2]" 1
1583 1 92 PHE H 1 92 PHE QD . . 4.140 3.250 2.663 3.603 . 0 0 "[ . 1 . 2]" 1
1584 1 92 PHE HA 1 93 PHE H . . 3.060 2.206 2.112 2.279 . 0 0 "[ . 1 . 2]" 1
1585 1 92 PHE HA 1 93 PHE HA . . 4.720 4.475 4.421 4.511 . 0 0 "[ . 1 . 2]" 1
1586 1 92 PHE HA 1 93 PHE QB . . 5.340 4.379 4.251 4.474 . 0 0 "[ . 1 . 2]" 1
1587 1 92 PHE HB3 1 93 PHE H . . 4.000 4.008 3.646 4.076 0.076 18 0 "[ . 1 . 2]" 1
1588 1 93 PHE H 1 93 PHE QB . . 3.590 2.367 2.326 2.409 . 0 0 "[ . 1 . 2]" 1
1589 1 93 PHE H 1 94 LYS H . . 4.610 4.045 3.474 4.574 . 0 0 "[ . 1 . 2]" 1
1590 1 93 PHE H 1 94 LYS QG . . 4.720 4.435 4.047 4.779 0.059 12 0 "[ . 1 . 2]" 1
1591 1 93 PHE HA 1 93 PHE QD . . 4.140 2.794 2.560 3.093 . 0 0 "[ . 1 . 2]" 1
1592 1 93 PHE HA 1 94 LYS H . . 2.940 2.342 2.108 2.605 . 0 0 "[ . 1 . 2]" 1
1593 1 94 LYS H 1 94 LYS HB2 . . 4.050 2.822 2.312 3.988 . 0 0 "[ . 1 . 2]" 1
1594 1 94 LYS H 1 94 LYS QB . . 3.480 2.643 2.285 3.397 . 0 0 "[ . 1 . 2]" 1
1595 1 94 LYS H 1 94 LYS HB3 . . 4.050 3.645 2.812 3.885 . 0 0 "[ . 1 . 2]" 1
1596 1 94 LYS H 1 94 LYS QG . . 3.770 2.691 1.938 3.417 . 0 0 "[ . 1 . 2]" 1
1597 1 94 LYS H 1 95 ILE H . . 4.740 4.506 4.041 4.684 . 0 0 "[ . 1 . 2]" 1
1598 1 94 LYS HA 1 94 LYS QD . . 4.390 4.002 2.338 4.456 0.066 16 0 "[ . 1 . 2]" 1
1599 1 94 LYS HA 1 94 LYS QG . . 3.860 2.589 2.260 3.400 . 0 0 "[ . 1 . 2]" 1
1600 1 94 LYS HA 1 95 ILE H . . 3.020 2.168 2.023 2.335 . 0 0 "[ . 1 . 2]" 1
1601 1 94 LYS HA 1 95 ILE HB . . 4.910 4.639 4.307 4.929 0.019 4 0 "[ . 1 . 2]" 1
1602 1 94 LYS QB 1 95 ILE H . . 3.660 2.904 2.685 3.202 . 0 0 "[ . 1 . 2]" 1
1603 1 94 LYS HB2 1 94 LYS QE . . 4.110 3.143 2.023 4.161 0.051 8 0 "[ . 1 . 2]" 1
1604 1 94 LYS HB2 1 95 ILE H . . 4.220 3.864 2.926 4.225 0.005 3 0 "[ . 1 . 2]" 1
1605 1 94 LYS HB3 1 94 LYS QE . . 4.110 3.033 2.118 4.160 0.050 17 0 "[ . 1 . 2]" 1
1606 1 94 LYS HB3 1 95 ILE H . . 4.220 3.154 2.735 4.013 . 0 0 "[ . 1 . 2]" 1
1607 1 94 LYS QD 1 94 LYS QG . . 2.480 2.043 1.984 2.126 . 0 0 "[ . 1 . 2]" 1
1608 1 94 LYS QD 1 95 ILE H . . 5.430 5.000 3.630 5.457 0.027 19 0 "[ . 1 . 2]" 1
1609 1 94 LYS QE 1 94 LYS QG . . 3.370 2.444 2.116 2.967 . 0 0 "[ . 1 . 2]" 1
1610 1 94 LYS QG 1 95 ILE H . . 4.320 4.015 3.545 4.428 0.108 20 0 "[ . 1 . 2]" 1
1611 1 95 ILE H 1 95 ILE HB . . 2.920 2.552 2.289 2.897 . 0 0 "[ . 1 . 2]" 1
1612 1 95 ILE H 1 95 ILE MD . . 4.180 3.686 2.933 4.039 . 0 0 "[ . 1 . 2]" 1
1613 1 95 ILE H 1 95 ILE HG12 . . 3.960 2.965 2.020 3.913 . 0 0 "[ . 1 . 2]" 1
1614 1 95 ILE H 1 95 ILE HG13 . . 3.960 3.193 2.046 4.013 0.053 13 0 "[ . 1 . 2]" 1
1615 1 95 ILE H 1 95 ILE MG . . 3.960 3.833 3.688 3.959 . 0 0 "[ . 1 . 2]" 1
1616 1 95 ILE H 1 96 GLU H . . 4.670 4.529 4.118 4.679 0.009 19 0 "[ . 1 . 2]" 1
1617 1 95 ILE H 1 97 LYS H . . 5.500 5.254 4.666 5.560 0.060 6 0 "[ . 1 . 2]" 1
1618 1 95 ILE HA 1 95 ILE HG12 . . 3.850 2.866 2.345 3.449 . 0 0 "[ . 1 . 2]" 1
1619 1 95 ILE HA 1 95 ILE HG13 . . 3.850 3.505 2.918 3.896 0.046 4 0 "[ . 1 . 2]" 1
1620 1 95 ILE HA 1 95 ILE MG . . 3.240 2.406 2.199 2.602 . 0 0 "[ . 1 . 2]" 1
1621 1 95 ILE HA 1 96 GLU H . . 2.690 2.170 1.971 2.395 . 0 0 "[ . 1 . 2]" 1
1622 1 95 ILE HB 1 95 ILE MD . . 3.670 2.942 2.307 3.308 . 0 0 "[ . 1 . 2]" 1
1623 1 95 ILE HB 1 96 GLU H . . 4.180 4.102 3.866 4.331 0.151 6 0 "[ . 1 . 2]" 1
1624 1 95 ILE MD 1 96 GLU H . . 5.430 4.380 3.451 5.280 . 0 0 "[ . 1 . 2]" 1
1625 1 95 ILE QG 1 95 ILE MG . . 3.280 2.345 2.180 2.490 . 0 0 "[ . 1 . 2]" 1
1626 1 95 ILE QG 1 96 GLU H . . 4.660 4.420 3.960 4.716 0.056 18 0 "[ . 1 . 2]" 1
1627 1 95 ILE HG12 1 96 GLU H . . 5.350 4.784 4.151 5.281 . 0 0 "[ . 1 . 2]" 1
1628 1 95 ILE HG13 1 96 GLU H . . 5.350 5.239 4.999 5.402 0.052 11 0 "[ . 1 . 2]" 1
1629 1 95 ILE MG 1 96 GLU H . . 3.220 2.563 2.218 3.173 . 0 0 "[ . 1 . 2]" 1
1630 1 95 ILE MG 1 96 GLU HA . . 4.400 4.213 3.998 4.405 0.005 3 0 "[ . 1 . 2]" 1
1631 1 95 ILE MG 1 97 LYS H . . 4.470 2.563 1.814 4.057 . 0 0 "[ . 1 . 2]" 1
1632 1 95 ILE MG 1 97 LYS HA . . 4.810 4.184 3.253 4.796 . 0 0 "[ . 1 . 2]" 1
1633 1 96 GLU H 1 96 GLU HB2 . . 3.740 2.757 2.250 3.674 . 0 0 "[ . 1 . 2]" 1
1634 1 96 GLU H 1 96 GLU QB . . 2.880 2.387 2.173 2.671 . 0 0 "[ . 1 . 2]" 1
1635 1 96 GLU H 1 96 GLU HB3 . . 3.740 3.057 2.411 3.737 . 0 0 "[ . 1 . 2]" 1
1636 1 96 GLU H 1 96 GLU HG2 . . 5.450 3.329 1.990 4.709 . 0 0 "[ . 1 . 2]" 1
1637 1 96 GLU H 1 96 GLU QG . . 4.640 2.951 1.978 4.144 . 0 0 "[ . 1 . 2]" 1
1638 1 96 GLU H 1 96 GLU HG3 . . 5.450 3.752 2.430 4.598 . 0 0 "[ . 1 . 2]" 1
1639 1 96 GLU HA 1 96 GLU HG2 . . 4.210 3.253 2.481 3.781 . 0 0 "[ . 1 . 2]" 1
1640 1 96 GLU HA 1 96 GLU QG . . 3.590 2.864 2.173 3.531 . 0 0 "[ . 1 . 2]" 1
1641 1 96 GLU HA 1 96 GLU HG3 . . 4.210 3.401 2.218 4.243 0.033 8 0 "[ . 1 . 2]" 1
1642 1 96 GLU HA 1 97 LYS H . . 3.390 2.973 2.220 3.446 0.056 17 0 "[ . 1 . 2]" 1
1643 1 96 GLU QB 1 97 LYS H . . 4.280 3.679 2.815 4.105 . 0 0 "[ . 1 . 2]" 1
1644 1 96 GLU QG 1 97 LYS H . . 4.590 4.077 2.636 4.599 0.009 14 0 "[ . 1 . 2]" 1
1645 1 97 LYS H 1 97 LYS QB . . 3.180 2.367 2.138 2.730 . 0 0 "[ . 1 . 2]" 1
1646 1 97 LYS H 1 97 LYS QG . . 4.030 3.471 2.210 4.065 0.035 13 0 "[ . 1 . 2]" 1
1647 1 97 LYS HA 1 97 LYS QD . . 4.350 3.506 2.239 4.405 0.055 15 0 "[ . 1 . 2]" 1
1648 1 97 LYS HA 1 97 LYS QG . . 3.520 2.725 2.236 3.406 . 0 0 "[ . 1 . 2]" 1
1649 1 97 LYS HA 1 98 ARG H . . 3.230 2.445 2.064 3.353 0.123 5 0 "[ . 1 . 2]" 1
1650 1 97 LYS QB 1 98 ARG H . . 3.760 3.535 2.353 3.909 0.149 13 0 "[ . 1 . 2]" 1
1651 1 97 LYS QG 1 98 ARG H . . 5.140 3.623 2.447 4.634 . 0 0 "[ . 1 . 2]" 1
1652 1 98 ARG H 1 98 ARG QG . . 4.800 3.519 2.112 4.354 . 0 0 "[ . 1 . 2]" 1
1653 1 98 ARG H 1 99 ARG H . . 4.540 4.488 4.023 4.613 0.073 20 0 "[ . 1 . 2]" 1
1654 1 98 ARG HA 1 98 ARG QD . . 4.640 3.753 2.269 4.576 . 0 0 "[ . 1 . 2]" 1
1655 1 98 ARG HA 1 99 ARG H . . 2.890 2.207 2.081 2.551 . 0 0 "[ . 1 . 2]" 1
1656 1 98 ARG QD 1 99 ARG H . . 5.340 4.233 2.579 5.240 . 0 0 "[ . 1 . 2]" 1
1657 1 99 ARG H 1 99 ARG HB2 . . 3.920 3.012 2.323 3.993 0.073 8 0 "[ . 1 . 2]" 1
1658 1 99 ARG H 1 99 ARG QB . . 3.360 2.543 2.054 3.280 . 0 0 "[ . 1 . 2]" 1
1659 1 99 ARG H 1 99 ARG HB3 . . 3.920 3.067 2.226 3.659 . 0 0 "[ . 1 . 2]" 1
1660 1 99 ARG H 1 99 ARG QD . . 5.500 4.085 2.823 4.953 . 0 0 "[ . 1 . 2]" 1
1661 1 99 ARG QB 1 99 ARG QD . . 3.010 2.368 2.064 2.904 . 0 0 "[ . 1 . 2]" 1
1662 1 99 ARG QB 1 99 ARG QG . . 2.420 2.082 1.987 2.132 . 0 0 "[ . 1 . 2]" 1
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