NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
392253 |
1puz   |
5846 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1puz
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 1220
_Distance_constraint_stats_list.Viol_count 1423
_Distance_constraint_stats_list.Viol_total 1800.188
_Distance_constraint_stats_list.Viol_max 0.748
_Distance_constraint_stats_list.Viol_rms 0.0217
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0037
_Distance_constraint_stats_list.Viol_average_violations_only 0.0633
_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 MET 0.084 0.034 11 0 "[ . 1 . 2]"
1 3 VAL 0.095 0.034 11 0 "[ . 1 . 2]"
1 4 PHE 0.321 0.062 11 0 "[ . 1 . 2]"
1 5 ASP 0.510 0.088 16 0 "[ . 1 . 2]"
1 6 ASP 0.003 0.003 2 0 "[ . 1 . 2]"
1 7 ILE 0.267 0.043 12 0 "[ . 1 . 2]"
1 8 ALA 0.506 0.088 16 0 "[ . 1 . 2]"
1 9 LYS 0.381 0.072 13 0 "[ . 1 . 2]"
1 10 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 LYS 0.590 0.092 11 0 "[ . 1 . 2]"
1 12 ILE 0.118 0.059 11 0 "[ . 1 . 2]"
1 13 ARG 0.382 0.072 13 0 "[ . 1 . 2]"
1 14 PHE 0.595 0.092 11 0 "[ . 1 . 2]"
1 15 GLN 0.062 0.032 14 0 "[ . 1 . 2]"
1 16 THR 0.340 0.140 14 0 "[ . 1 . 2]"
1 17 ARG 0.844 0.140 14 0 "[ . 1 . 2]"
1 18 ARG 1.426 0.188 11 0 "[ . 1 . 2]"
1 19 GLY 0.315 0.160 18 0 "[ . 1 . 2]"
1 20 LEU 0.708 0.319 18 0 "[ . 1 . 2]"
1 21 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 GLU 0.728 0.109 17 0 "[ . 1 . 2]"
1 23 LEU 1.570 0.109 12 0 "[ . 1 . 2]"
1 24 ASP 1.657 0.188 11 0 "[ . 1 . 2]"
1 25 LEU 3.282 0.120 8 0 "[ . 1 . 2]"
1 26 ILE 0.173 0.047 11 0 "[ . 1 . 2]"
1 27 PHE 2.400 0.119 9 0 "[ . 1 . 2]"
1 28 GLY 1.933 0.119 9 0 "[ . 1 . 2]"
1 29 ARG 2.264 0.153 15 0 "[ . 1 . 2]"
1 30 PHE 8.541 0.748 8 6 "[* *. +*1- . * 2]"
1 31 MET 0.658 0.107 9 0 "[ . 1 . 2]"
1 32 GLU 4.253 0.143 16 0 "[ . 1 . 2]"
1 33 LYS 2.569 0.164 9 0 "[ . 1 . 2]"
1 34 GLU 0.178 0.050 11 0 "[ . 1 . 2]"
1 35 PHE 0.834 0.164 9 0 "[ . 1 . 2]"
1 36 GLU 0.539 0.116 12 0 "[ . 1 . 2]"
1 37 HIS 0.228 0.078 18 0 "[ . 1 . 2]"
1 38 LEU 10.673 0.748 8 6 "[* *. +*1- . * 2]"
1 39 SER 1.827 0.136 1 0 "[ . 1 . 2]"
1 40 ASP 1.430 0.118 4 0 "[ . 1 . 2]"
1 41 LYS 0.437 0.080 11 0 "[ . 1 . 2]"
1 42 GLU 0.545 0.098 19 0 "[ . 1 . 2]"
1 43 LEU 0.930 0.113 8 0 "[ . 1 . 2]"
1 44 SER 0.429 0.080 11 0 "[ . 1 . 2]"
1 45 GLU 1.040 0.130 14 0 "[ . 1 . 2]"
1 46 PHE 1.406 0.122 4 0 "[ . 1 . 2]"
1 47 SER 0.752 0.149 15 0 "[ . 1 . 2]"
1 48 GLU 0.670 0.149 15 0 "[ . 1 . 2]"
1 49 ILE 0.648 0.196 3 0 "[ . 1 . 2]"
1 50 LEU 6.294 0.196 3 0 "[ . 1 . 2]"
1 51 GLU 9.778 0.404 13 0 "[ . 1 . 2]"
1 52 PHE 8.839 0.404 13 0 "[ . 1 . 2]"
1 53 GLN 2.920 0.170 8 0 "[ . 1 . 2]"
1 54 ASP 2.557 0.142 10 0 "[ . 1 . 2]"
1 55 GLN 2.571 0.108 2 0 "[ . 1 . 2]"
1 56 GLU 2.554 0.108 2 0 "[ . 1 . 2]"
1 57 LEU 3.257 0.114 7 0 "[ . 1 . 2]"
1 58 LEU 3.496 0.151 20 0 "[ . 1 . 2]"
1 59 ALA 0.881 0.076 5 0 "[ . 1 . 2]"
1 60 LEU 0.756 0.069 16 0 "[ . 1 . 2]"
1 61 ILE 0.513 0.081 9 0 "[ . 1 . 2]"
1 62 ASN 0.241 0.076 5 0 "[ . 1 . 2]"
1 63 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 HIS 0.100 0.025 19 0 "[ . 1 . 2]"
1 65 SER 0.759 0.060 6 0 "[ . 1 . 2]"
1 66 GLU 3.146 0.247 16 0 "[ . 1 . 2]"
1 67 THR 1.061 0.160 19 0 "[ . 1 . 2]"
1 68 ASP 2.001 0.197 16 0 "[ . 1 . 2]"
1 69 LYS 4.138 0.197 16 0 "[ . 1 . 2]"
1 70 GLY 3.128 0.177 7 0 "[ . 1 . 2]"
1 71 HIS 0.192 0.056 17 0 "[ . 1 . 2]"
1 72 LEU 1.591 0.185 19 0 "[ . 1 . 2]"
1 73 ILE 2.452 0.122 7 0 "[ . 1 . 2]"
1 74 PRO 1.044 0.152 7 0 "[ . 1 . 2]"
1 75 MET 2.648 0.195 6 0 "[ . 1 . 2]"
1 76 LEU 3.919 0.195 6 0 "[ . 1 . 2]"
1 77 GLU 1.725 0.181 7 0 "[ . 1 . 2]"
1 78 LYS 2.467 0.171 17 0 "[ . 1 . 2]"
1 79 ILE 2.840 0.194 18 0 "[ . 1 . 2]"
1 80 ARG 0.130 0.074 10 0 "[ . 1 . 2]"
1 81 ARG 2.158 0.164 18 0 "[ . 1 . 2]"
1 82 ALA 0.539 0.058 14 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 MET HA 1 3 VAL H . . 2.540 2.424 2.207 2.574 0.034 11 0 "[ . 1 . 2]" 1
2 1 3 VAL H 1 3 VAL HB . . 3.230 2.625 2.403 2.996 . 0 0 "[ . 1 . 2]" 1
3 1 3 VAL H 1 3 VAL MG2 . . 3.720 2.411 1.929 2.966 . 0 0 "[ . 1 . 2]" 1
4 1 3 VAL H 1 4 PHE H . . 4.810 4.527 4.356 4.631 . 0 0 "[ . 1 . 2]" 1
5 1 3 VAL HA 1 4 PHE H . . 2.580 2.408 2.298 2.459 . 0 0 "[ . 1 . 2]" 1
6 1 3 VAL HB 1 4 PHE H . . 3.730 3.672 3.581 3.735 0.005 15 0 "[ . 1 . 2]" 1
7 1 3 VAL MG1 1 4 PHE H . . 4.150 2.025 1.870 2.341 . 0 0 "[ . 1 . 2]" 1
8 1 3 VAL MG1 1 5 ASP H . . 7.030 4.499 3.318 5.367 . 0 0 "[ . 1 . 2]" 1
9 1 3 VAL MG2 1 4 PHE H . . 6.670 3.995 3.862 4.229 . 0 0 "[ . 1 . 2]" 1
10 1 4 PHE H 1 4 PHE HB2 . . 3.880 3.361 2.042 3.881 0.001 13 0 "[ . 1 . 2]" 1
11 1 4 PHE H 1 4 PHE QB . . 3.350 2.588 1.938 2.973 . 0 0 "[ . 1 . 2]" 1
12 1 4 PHE H 1 4 PHE HB3 . . 3.880 2.763 1.971 3.361 . 0 0 "[ . 1 . 2]" 1
13 1 4 PHE H 1 5 ASP H . . 5.860 4.138 3.083 4.656 . 0 0 "[ . 1 . 2]" 1
14 1 4 PHE HA 1 5 ASP H . . 2.580 2.330 2.193 2.581 0.001 10 0 "[ . 1 . 2]" 1
15 1 4 PHE HA 1 8 ALA MB . . 4.040 2.397 1.814 3.012 . 0 0 "[ . 1 . 2]" 1
16 1 4 PHE QB 1 8 ALA MB . . 6.400 2.959 1.844 4.130 . 0 0 "[ . 1 . 2]" 1
17 1 4 PHE QB 1 9 LYS QE . . 7.610 5.648 4.789 6.109 . 0 0 "[ . 1 . 2]" 1
18 1 4 PHE QB 1 43 LEU MD1 . . 5.100 3.185 2.386 3.686 . 0 0 "[ . 1 . 2]" 1
19 1 4 PHE HB2 1 5 ASP H . . 6.000 3.777 2.451 4.737 . 0 0 "[ . 1 . 2]" 1
20 1 4 PHE HB2 1 8 ALA MB . . 7.030 3.117 1.856 4.544 . 0 0 "[ . 1 . 2]" 1
21 1 4 PHE HB2 1 43 LEU MD1 . . 5.370 3.392 2.505 3.903 . 0 0 "[ . 1 . 2]" 1
22 1 4 PHE HB3 1 5 ASP H . . 6.000 4.260 3.881 4.662 . 0 0 "[ . 1 . 2]" 1
23 1 4 PHE HB3 1 8 ALA MB . . 7.030 3.983 3.152 4.743 . 0 0 "[ . 1 . 2]" 1
24 1 4 PHE HB3 1 43 LEU MD1 . . 5.370 3.970 2.998 4.529 . 0 0 "[ . 1 . 2]" 1
25 1 4 PHE QD 1 8 ALA MB . . 7.670 2.218 1.760 3.747 . 0 0 "[ . 1 . 2]" 1
26 1 4 PHE QE 1 41 LYS QB . . 9.000 6.462 6.141 7.224 . 0 0 "[ . 1 . 2]" 1
27 1 4 PHE HZ 1 9 LYS QB . . 6.880 5.679 3.852 6.177 . 0 0 "[ . 1 . 2]" 1
28 1 4 PHE HZ 1 9 LYS QG . . 6.700 5.540 4.710 6.006 . 0 0 "[ . 1 . 2]" 1
29 1 4 PHE HZ 1 40 ASP HA . . 4.380 4.208 3.667 4.442 0.062 11 0 "[ . 1 . 2]" 1
30 1 4 PHE HZ 1 43 LEU MD2 . . 6.160 4.325 2.618 5.080 . 0 0 "[ . 1 . 2]" 1
31 1 5 ASP H 1 5 ASP QB . . 3.770 2.894 2.669 3.434 . 0 0 "[ . 1 . 2]" 1
32 1 5 ASP H 1 8 ALA H . . 3.880 2.537 2.266 2.793 . 0 0 "[ . 1 . 2]" 1
33 1 5 ASP H 1 8 ALA HA . . 4.240 4.247 4.092 4.328 0.088 16 0 "[ . 1 . 2]" 1
34 1 5 ASP H 1 8 ALA MB . . 3.570 1.840 1.726 1.938 . 0 0 "[ . 1 . 2]" 1
35 1 5 ASP HB2 1 6 ASP H . . 3.260 3.011 2.003 3.263 0.003 2 0 "[ . 1 . 2]" 1
36 1 5 ASP HB3 1 6 ASP H . . 3.260 2.288 1.990 3.173 . 0 0 "[ . 1 . 2]" 1
37 1 6 ASP H 1 7 ILE H . . 3.620 2.902 2.788 3.023 . 0 0 "[ . 1 . 2]" 1
38 1 6 ASP H 1 8 ALA H . . 4.920 4.540 4.357 4.712 . 0 0 "[ . 1 . 2]" 1
39 1 6 ASP HA 1 9 LYS H . . 5.170 3.492 3.175 3.708 . 0 0 "[ . 1 . 2]" 1
40 1 6 ASP HA 1 9 LYS QB . . 4.680 2.739 2.292 3.489 . 0 0 "[ . 1 . 2]" 1
41 1 7 ILE H 1 7 ILE HB . . 2.760 2.397 2.227 2.582 . 0 0 "[ . 1 . 2]" 1
42 1 7 ILE H 1 7 ILE MD . . 5.410 2.721 1.895 3.807 . 0 0 "[ . 1 . 2]" 1
43 1 7 ILE H 1 7 ILE HG12 . . 3.660 3.476 1.969 3.703 0.043 12 0 "[ . 1 . 2]" 1
44 1 7 ILE H 1 7 ILE QG . . 3.180 2.343 1.958 2.627 . 0 0 "[ . 1 . 2]" 1
45 1 7 ILE H 1 7 ILE HG13 . . 3.660 2.522 2.281 3.653 . 0 0 "[ . 1 . 2]" 1
46 1 7 ILE H 1 8 ALA H . . 2.980 2.775 2.569 2.931 . 0 0 "[ . 1 . 2]" 1
47 1 7 ILE HA 1 7 ILE MD . . 4.360 3.514 1.936 3.813 . 0 0 "[ . 1 . 2]" 1
48 1 7 ILE HA 1 7 ILE HG12 . . 3.730 2.983 2.365 3.456 . 0 0 "[ . 1 . 2]" 1
49 1 7 ILE HA 1 7 ILE HG13 . . 3.730 2.689 2.341 3.691 . 0 0 "[ . 1 . 2]" 1
50 1 7 ILE HA 1 10 ARG H . . 4.090 3.334 3.045 3.618 . 0 0 "[ . 1 . 2]" 1
51 1 7 ILE HA 1 10 ARG QB . . 5.540 2.837 1.983 4.063 . 0 0 "[ . 1 . 2]" 1
52 1 7 ILE HB 1 8 ALA H . . 2.870 2.523 2.345 2.766 . 0 0 "[ . 1 . 2]" 1
53 1 7 ILE MD 1 8 ALA H . . 5.550 4.010 3.210 4.598 . 0 0 "[ . 1 . 2]" 1
54 1 7 ILE QG 1 8 ALA H . . 5.240 4.207 3.983 4.347 . 0 0 "[ . 1 . 2]" 1
55 1 7 ILE HG12 1 8 ALA H . . 6.000 4.990 4.238 5.206 . 0 0 "[ . 1 . 2]" 1
56 1 7 ILE HG13 1 8 ALA H . . 6.000 4.570 4.239 4.963 . 0 0 "[ . 1 . 2]" 1
57 1 7 ILE MG 1 8 ALA H . . 4.180 3.276 2.912 3.475 . 0 0 "[ . 1 . 2]" 1
58 1 8 ALA H 1 8 ALA MB . . 3.430 2.087 1.950 2.162 . 0 0 "[ . 1 . 2]" 1
59 1 8 ALA H 1 9 LYS H . . 3.160 2.859 2.659 2.958 . 0 0 "[ . 1 . 2]" 1
60 1 8 ALA H 1 10 ARG H . . 5.460 4.576 3.787 4.846 . 0 0 "[ . 1 . 2]" 1
61 1 8 ALA HA 1 9 LYS HA . . 6.000 4.807 4.711 4.892 . 0 0 "[ . 1 . 2]" 1
62 1 8 ALA HA 1 11 LYS H . . 4.560 3.428 3.211 3.770 . 0 0 "[ . 1 . 2]" 1
63 1 8 ALA HA 1 11 LYS HB2 . . 4.450 2.826 2.001 3.723 . 0 0 "[ . 1 . 2]" 1
64 1 8 ALA HA 1 11 LYS QB . . 4.040 2.461 1.955 3.169 . 0 0 "[ . 1 . 2]" 1
65 1 8 ALA HA 1 11 LYS HB3 . . 4.450 3.008 2.011 4.180 . 0 0 "[ . 1 . 2]" 1
66 1 8 ALA MB 1 9 LYS H . . 4.290 2.642 2.238 3.030 . 0 0 "[ . 1 . 2]" 1
67 1 8 ALA MB 1 9 LYS HA . . 7.030 3.817 3.756 3.870 . 0 0 "[ . 1 . 2]" 1
68 1 8 ALA MB 1 43 LEU HB2 . . 6.240 4.774 4.174 5.187 . 0 0 "[ . 1 . 2]" 1
69 1 8 ALA MB 1 43 LEU MD1 . . 8.060 2.934 2.051 3.690 . 0 0 "[ . 1 . 2]" 1
70 1 8 ALA MB 1 43 LEU HG . . 7.030 5.279 4.532 5.803 . 0 0 "[ . 1 . 2]" 1
71 1 9 LYS H 1 9 LYS QD . . 5.650 3.786 2.399 4.726 . 0 0 "[ . 1 . 2]" 1
72 1 9 LYS H 1 9 LYS QE . . 6.880 3.686 3.116 4.440 . 0 0 "[ . 1 . 2]" 1
73 1 9 LYS H 1 9 LYS QG . . 4.500 3.732 2.625 3.977 . 0 0 "[ . 1 . 2]" 1
74 1 9 LYS H 1 10 ARG H . . 3.440 2.845 2.596 3.072 . 0 0 "[ . 1 . 2]" 1
75 1 9 LYS HA 1 9 LYS HG2 . . 3.910 3.286 2.562 3.788 . 0 0 "[ . 1 . 2]" 1
76 1 9 LYS HA 1 9 LYS QG . . 3.530 2.257 1.957 3.262 . 0 0 "[ . 1 . 2]" 1
77 1 9 LYS HA 1 9 LYS HG3 . . 3.910 2.355 1.986 3.559 . 0 0 "[ . 1 . 2]" 1
78 1 9 LYS HA 1 12 ILE H . . 4.490 3.476 2.984 3.915 . 0 0 "[ . 1 . 2]" 1
79 1 9 LYS HA 1 12 ILE HB . . 3.410 2.921 2.470 3.469 0.059 11 0 "[ . 1 . 2]" 1
80 1 9 LYS HA 1 13 ARG H . . 5.030 4.951 4.279 5.102 0.072 13 0 "[ . 1 . 2]" 1
81 1 9 LYS HA 1 43 LEU MD1 . . 7.030 3.981 2.637 4.877 . 0 0 "[ . 1 . 2]" 1
82 1 9 LYS QB 1 10 ARG H . . 5.040 2.511 2.286 3.547 . 0 0 "[ . 1 . 2]" 1
83 1 9 LYS QD 1 10 ARG H . . 6.880 4.784 3.879 5.071 . 0 0 "[ . 1 . 2]" 1
84 1 9 LYS QE 1 43 LEU MD1 . . 5.740 3.147 1.829 3.965 . 0 0 "[ . 1 . 2]" 1
85 1 9 LYS QG 1 10 ARG H . . 6.020 4.008 2.262 4.435 . 0 0 "[ . 1 . 2]" 1
86 1 9 LYS QG 1 13 ARG QB . . 7.760 5.473 4.676 6.149 . 0 0 "[ . 1 . 2]" 1
87 1 9 LYS QG 1 43 LEU MD1 . . 7.260 4.306 3.188 5.155 . 0 0 "[ . 1 . 2]" 1
88 1 10 ARG H 1 10 ARG HD2 . . 6.000 4.497 2.896 5.440 . 0 0 "[ . 1 . 2]" 1
89 1 10 ARG H 1 10 ARG HD3 . . 6.000 4.753 3.154 5.858 . 0 0 "[ . 1 . 2]" 1
90 1 10 ARG H 1 10 ARG HG2 . . 4.880 3.861 1.998 4.632 . 0 0 "[ . 1 . 2]" 1
91 1 10 ARG H 1 10 ARG QG . . 4.680 3.103 1.960 3.996 . 0 0 "[ . 1 . 2]" 1
92 1 10 ARG H 1 10 ARG HG3 . . 4.880 3.364 2.127 4.381 . 0 0 "[ . 1 . 2]" 1
93 1 10 ARG H 1 11 LYS H . . 3.300 2.779 2.585 2.951 . 0 0 "[ . 1 . 2]" 1
94 1 10 ARG H 1 12 ILE H . . 5.500 4.407 4.009 4.659 . 0 0 "[ . 1 . 2]" 1
95 1 10 ARG H 1 12 ILE MG . . 6.490 4.986 4.741 5.262 . 0 0 "[ . 1 . 2]" 1
96 1 10 ARG HA 1 13 ARG H . . 4.380 3.520 3.160 3.847 . 0 0 "[ . 1 . 2]" 1
97 1 10 ARG HA 1 13 ARG QB . . 4.540 3.191 2.526 3.858 . 0 0 "[ . 1 . 2]" 1
98 1 10 ARG HA 1 14 PHE H . . 5.420 3.944 3.705 4.548 . 0 0 "[ . 1 . 2]" 1
99 1 10 ARG QD 1 11 LYS H . . 6.880 4.842 3.738 5.295 . 0 0 "[ . 1 . 2]" 1
100 1 10 ARG QG 1 11 LYS H . . 6.630 4.162 2.200 4.592 . 0 0 "[ . 1 . 2]" 1
101 1 11 LYS H 1 11 LYS HB2 . . 3.620 2.231 2.006 2.660 . 0 0 "[ . 1 . 2]" 1
102 1 11 LYS H 1 11 LYS HB3 . . 3.620 2.824 2.353 3.444 . 0 0 "[ . 1 . 2]" 1
103 1 11 LYS H 1 12 ILE H . . 3.410 2.781 2.434 2.994 . 0 0 "[ . 1 . 2]" 1
104 1 11 LYS H 1 13 ARG H . . 5.140 4.393 3.987 4.583 . 0 0 "[ . 1 . 2]" 1
105 1 11 LYS H 1 14 PHE H . . 4.520 4.536 4.436 4.612 0.092 11 0 "[ . 1 . 2]" 1
106 1 11 LYS HA 1 11 LYS QD . . 4.970 3.352 1.969 4.195 . 0 0 "[ . 1 . 2]" 1
107 1 11 LYS HA 1 11 LYS QG . . 3.890 2.374 2.009 2.844 . 0 0 "[ . 1 . 2]" 1
108 1 11 LYS HA 1 14 PHE H . . 4.490 3.240 2.855 3.564 . 0 0 "[ . 1 . 2]" 1
109 1 11 LYS HA 1 14 PHE HB2 . . 4.060 2.536 1.982 3.303 . 0 0 "[ . 1 . 2]" 1
110 1 11 LYS HA 1 14 PHE QB . . 3.850 2.055 1.885 2.789 . 0 0 "[ . 1 . 2]" 1
111 1 11 LYS HA 1 14 PHE HB3 . . 4.060 2.278 1.960 3.740 . 0 0 "[ . 1 . 2]" 1
112 1 11 LYS HA 1 14 PHE QD . . 8.120 3.878 3.176 4.744 . 0 0 "[ . 1 . 2]" 1
113 1 11 LYS HA 1 14 PHE QE . . 8.120 5.773 5.382 6.650 . 0 0 "[ . 1 . 2]" 1
114 1 11 LYS HA 1 15 GLN QB . . 5.400 4.503 4.405 4.656 . 0 0 "[ . 1 . 2]" 1
115 1 11 LYS QB 1 12 ILE H . . 4.210 2.601 2.384 2.852 . 0 0 "[ . 1 . 2]" 1
116 1 11 LYS HB2 1 12 ILE H . . 4.600 3.602 2.762 4.091 . 0 0 "[ . 1 . 2]" 1
117 1 11 LYS HB3 1 12 ILE H . . 4.600 2.715 2.446 3.385 . 0 0 "[ . 1 . 2]" 1
118 1 11 LYS QD 1 12 ILE H . . 5.360 4.533 3.971 4.839 . 0 0 "[ . 1 . 2]" 1
119 1 11 LYS QG 1 12 ILE H . . 5.480 4.077 3.271 4.521 . 0 0 "[ . 1 . 2]" 1
120 1 12 ILE H 1 12 ILE HB . . 3.050 2.010 1.981 2.026 . 0 0 "[ . 1 . 2]" 1
121 1 12 ILE H 1 12 ILE HG12 . . 4.630 3.968 3.591 4.502 . 0 0 "[ . 1 . 2]" 1
122 1 12 ILE H 1 12 ILE QG . . 4.000 3.563 3.417 3.816 . 0 0 "[ . 1 . 2]" 1
123 1 12 ILE H 1 12 ILE HG13 . . 4.630 4.119 3.702 4.319 . 0 0 "[ . 1 . 2]" 1
124 1 12 ILE H 1 13 ARG H . . 3.620 2.993 2.805 3.092 . 0 0 "[ . 1 . 2]" 1
125 1 12 ILE HA 1 12 ILE QG . . 3.820 2.124 2.000 2.368 . 0 0 "[ . 1 . 2]" 1
126 1 12 ILE HA 1 15 GLN H . . 4.630 3.859 3.371 4.093 . 0 0 "[ . 1 . 2]" 1
127 1 12 ILE HA 1 15 GLN HB2 . . 4.740 2.978 2.042 3.394 . 0 0 "[ . 1 . 2]" 1
128 1 12 ILE HA 1 15 GLN QB . . 4.410 2.925 2.023 3.318 . 0 0 "[ . 1 . 2]" 1
129 1 12 ILE HA 1 15 GLN HB3 . . 4.740 4.295 3.304 4.678 . 0 0 "[ . 1 . 2]" 1
130 1 12 ILE HA 1 50 LEU MD1 . . 5.370 2.414 1.895 3.329 . 0 0 "[ . 1 . 2]" 1
131 1 12 ILE HB 1 13 ARG H . . 3.440 3.359 3.138 3.467 0.027 20 0 "[ . 1 . 2]" 1
132 1 12 ILE HB 1 35 PHE QD . . 8.120 4.365 3.455 5.443 . 0 0 "[ . 1 . 2]" 1
133 1 12 ILE HB 1 46 PHE QE . . 7.400 5.849 5.364 6.776 . 0 0 "[ . 1 . 2]" 1
134 1 12 ILE MD 1 15 GLN QB . . 6.400 4.322 3.365 4.874 . 0 0 "[ . 1 . 2]" 1
135 1 12 ILE MD 1 35 PHE HA . . 5.880 4.437 3.400 4.893 . 0 0 "[ . 1 . 2]" 1
136 1 12 ILE MD 1 43 LEU MD2 . . 6.620 3.245 1.717 4.543 . 0 0 "[ . 1 . 2]" 1
137 1 12 ILE MD 1 46 PHE QE . . 8.320 2.977 1.865 4.582 . 0 0 "[ . 1 . 2]" 1
138 1 12 ILE QG 1 13 ARG H . . 6.840 4.446 4.281 4.561 . 0 0 "[ . 1 . 2]" 1
139 1 12 ILE QG 1 16 THR MG . . 5.960 4.293 3.922 4.499 . 0 0 "[ . 1 . 2]" 1
140 1 12 ILE MG 1 13 ARG H . . 6.600 1.908 1.849 2.044 . 0 0 "[ . 1 . 2]" 1
141 1 12 ILE MG 1 16 THR MG . . 6.830 3.473 3.137 3.915 . 0 0 "[ . 1 . 2]" 1
142 1 12 ILE MG 1 35 PHE QD . . 7.930 2.644 1.890 3.742 . 0 0 "[ . 1 . 2]" 1
143 1 12 ILE MG 1 35 PHE QE . . 9.150 3.306 2.023 4.461 . 0 0 "[ . 1 . 2]" 1
144 1 12 ILE MG 1 43 LEU MD2 . . 6.870 4.155 3.419 4.753 . 0 0 "[ . 1 . 2]" 1
145 1 12 ILE MG 1 46 PHE QD . . 7.750 4.091 2.725 5.142 . 0 0 "[ . 1 . 2]" 1
146 1 12 ILE MG 1 46 PHE QE . . 7.170 3.999 2.811 5.311 . 0 0 "[ . 1 . 2]" 1
147 1 12 ILE MG 1 50 LEU MD1 . . 6.080 3.504 2.798 3.943 . 0 0 "[ . 1 . 2]" 1
148 1 13 ARG H 1 13 ARG HG2 . . 5.100 4.334 4.209 4.489 . 0 0 "[ . 1 . 2]" 1
149 1 13 ARG H 1 13 ARG QG . . 4.560 3.455 3.085 3.925 . 0 0 "[ . 1 . 2]" 1
150 1 13 ARG H 1 13 ARG HG3 . . 5.100 3.643 3.168 4.429 . 0 0 "[ . 1 . 2]" 1
151 1 13 ARG H 1 14 PHE H . . 3.660 2.598 2.468 2.847 . 0 0 "[ . 1 . 2]" 1
152 1 13 ARG HA 1 13 ARG QG . . 3.790 2.198 2.160 2.352 . 0 0 "[ . 1 . 2]" 1
153 1 13 ARG HA 1 16 THR MG . . 5.770 2.843 2.349 3.062 . 0 0 "[ . 1 . 2]" 1
154 1 13 ARG QG 1 14 PHE H . . 6.880 4.310 3.879 4.470 . 0 0 "[ . 1 . 2]" 1
155 1 13 ARG QG 1 16 THR MG . . 5.350 3.860 3.708 4.005 . 0 0 "[ . 1 . 2]" 1
156 1 14 PHE H 1 14 PHE HB2 . . 3.340 2.014 1.912 2.207 . 0 0 "[ . 1 . 2]" 1
157 1 14 PHE H 1 14 PHE QB . . 3.040 1.966 1.894 2.085 . 0 0 "[ . 1 . 2]" 1
158 1 14 PHE H 1 14 PHE HB3 . . 3.340 2.844 2.546 3.345 0.005 20 0 "[ . 1 . 2]" 1
159 1 14 PHE H 1 15 GLN H . . 3.620 2.792 2.615 2.919 . 0 0 "[ . 1 . 2]" 1
160 1 14 PHE HB2 1 15 GLN H . . 4.340 3.726 3.315 4.004 . 0 0 "[ . 1 . 2]" 1
161 1 14 PHE HB3 1 15 GLN H . . 4.340 3.047 2.525 3.862 . 0 0 "[ . 1 . 2]" 1
162 1 15 GLN H 1 15 GLN HB2 . . 3.700 2.110 2.024 2.215 . 0 0 "[ . 1 . 2]" 1
163 1 15 GLN H 1 15 GLN QB . . 3.380 2.088 2.004 2.191 . 0 0 "[ . 1 . 2]" 1
164 1 15 GLN H 1 15 GLN HB3 . . 3.700 3.330 3.212 3.486 . 0 0 "[ . 1 . 2]" 1
165 1 15 GLN H 1 15 GLN HG2 . . 4.060 3.646 3.209 4.092 0.032 14 0 "[ . 1 . 2]" 1
166 1 15 GLN H 1 15 GLN QG . . 3.660 3.265 2.824 3.411 . 0 0 "[ . 1 . 2]" 1
167 1 15 GLN H 1 15 GLN HG3 . . 4.060 3.798 2.879 4.083 0.023 18 0 "[ . 1 . 2]" 1
168 1 15 GLN H 1 16 THR H . . 3.620 2.496 2.323 2.793 . 0 0 "[ . 1 . 2]" 1
169 1 15 GLN HA 1 15 GLN HG2 . . 3.840 2.163 1.982 2.930 . 0 0 "[ . 1 . 2]" 1
170 1 15 GLN HA 1 15 GLN QG . . 3.470 2.099 1.962 2.343 . 0 0 "[ . 1 . 2]" 1
171 1 15 GLN HA 1 15 GLN HG3 . . 3.840 3.307 2.212 3.569 . 0 0 "[ . 1 . 2]" 1
172 1 15 GLN QB 1 50 LEU MD1 . . 6.000 2.562 1.922 3.296 . 0 0 "[ . 1 . 2]" 1
173 1 15 GLN QB 1 50 LEU MD2 . . 7.550 3.219 2.495 4.292 . 0 0 "[ . 1 . 2]" 1
174 1 15 GLN HB2 1 50 LEU MD1 . . 6.380 2.847 2.118 3.685 . 0 0 "[ . 1 . 2]" 1
175 1 15 GLN HB3 1 50 LEU MD1 . . 6.380 2.974 1.986 3.755 . 0 0 "[ . 1 . 2]" 1
176 1 16 THR H 1 16 THR HG1 . . 3.980 2.805 1.844 3.399 . 0 0 "[ . 1 . 2]" 1
177 1 16 THR H 1 16 THR MG . . 4.470 2.110 1.868 2.478 . 0 0 "[ . 1 . 2]" 1
178 1 16 THR H 1 17 ARG H . . 4.490 3.997 2.375 4.630 0.140 14 0 "[ . 1 . 2]" 1
179 1 16 THR HA 1 16 THR HB . . 3.010 2.556 2.440 2.661 . 0 0 "[ . 1 . 2]" 1
180 1 16 THR HA 1 27 PHE QE . . 8.120 3.443 2.867 3.948 . 0 0 "[ . 1 . 2]" 1
181 1 16 THR HA 1 50 LEU MD1 . . 7.030 4.768 3.606 5.632 . 0 0 "[ . 1 . 2]" 1
182 1 16 THR HA 1 50 LEU MD2 . . 4.330 3.262 2.111 3.578 . 0 0 "[ . 1 . 2]" 1
183 1 16 THR HB 1 27 PHE HB2 . . 4.740 3.878 3.055 4.494 . 0 0 "[ . 1 . 2]" 1
184 1 16 THR HB 1 27 PHE QB . . 4.060 3.188 2.433 3.749 . 0 0 "[ . 1 . 2]" 1
185 1 16 THR HB 1 27 PHE HB3 . . 4.740 3.400 2.556 4.087 . 0 0 "[ . 1 . 2]" 1
186 1 16 THR HB 1 50 LEU MD2 . . 7.030 4.021 3.303 4.634 . 0 0 "[ . 1 . 2]" 1
187 1 16 THR MG 1 17 ARG H . . 6.600 3.681 3.429 3.990 . 0 0 "[ . 1 . 2]" 1
188 1 16 THR MG 1 27 PHE QE . . 7.130 2.590 2.193 3.121 . 0 0 "[ . 1 . 2]" 1
189 1 16 THR MG 1 27 PHE HZ . . 4.400 3.474 3.348 3.636 . 0 0 "[ . 1 . 2]" 1
190 1 16 THR MG 1 50 LEU MD1 . . 6.110 2.655 1.903 3.642 . 0 0 "[ . 1 . 2]" 1
191 1 16 THR MG 1 50 LEU MD2 . . 6.080 1.879 1.671 2.253 . 0 0 "[ . 1 . 2]" 1
192 1 17 ARG H 1 17 ARG QB . . 3.860 2.879 2.150 3.460 . 0 0 "[ . 1 . 2]" 1
193 1 17 ARG H 1 18 ARG H . . 5.100 4.222 1.832 4.640 . 0 0 "[ . 1 . 2]" 1
194 1 17 ARG H 1 27 PHE HB2 . . 6.000 5.047 3.926 6.021 0.021 6 0 "[ . 1 . 2]" 1
195 1 17 ARG H 1 27 PHE HB3 . . 6.000 5.103 4.238 6.022 0.022 14 0 "[ . 1 . 2]" 1
196 1 17 ARG HA 1 18 ARG H . . 2.900 2.415 2.226 3.023 0.123 14 0 "[ . 1 . 2]" 1
197 1 17 ARG QB 1 18 ARG H . . 4.060 3.202 2.057 3.822 . 0 0 "[ . 1 . 2]" 1
198 1 17 ARG HB2 1 18 ARG H . . 4.240 3.914 2.069 4.292 0.052 17 0 "[ . 1 . 2]" 1
199 1 17 ARG HB3 1 18 ARG H . . 4.240 3.589 2.247 4.287 0.047 17 0 "[ . 1 . 2]" 1
200 1 17 ARG QG 1 18 ARG H . . 5.720 3.140 1.937 4.676 . 0 0 "[ . 1 . 2]" 1
201 1 17 ARG HG2 1 18 ARG H . . 6.000 3.704 1.946 5.624 . 0 0 "[ . 1 . 2]" 1
202 1 17 ARG HG3 1 18 ARG H . . 6.000 3.835 2.261 5.789 . 0 0 "[ . 1 . 2]" 1
203 1 18 ARG H 1 24 ASP HA . . 4.560 4.570 4.097 4.748 0.188 11 0 "[ . 1 . 2]" 1
204 1 18 ARG H 1 24 ASP QB . . 5.470 3.893 3.009 4.694 . 0 0 "[ . 1 . 2]" 1
205 1 18 ARG HA 1 19 GLY H . . 3.160 2.736 2.230 3.150 . 0 0 "[ . 1 . 2]" 1
206 1 18 ARG HG2 1 19 GLY H . . 6.000 3.343 2.004 4.902 . 0 0 "[ . 1 . 2]" 1
207 1 18 ARG HG3 1 19 GLY H . . 6.000 3.882 2.470 5.486 . 0 0 "[ . 1 . 2]" 1
208 1 19 GLY H 1 20 LEU H . . 3.440 3.077 2.457 3.600 0.160 18 0 "[ . 1 . 2]" 1
209 1 19 GLY H 1 53 GLN QB . . 6.380 5.597 5.493 5.725 . 0 0 "[ . 1 . 2]" 1
210 1 20 LEU H 1 20 LEU HB2 . . 3.660 2.650 2.168 3.718 0.058 18 0 "[ . 1 . 2]" 1
211 1 20 LEU H 1 20 LEU QB . . 3.500 2.570 2.145 3.415 . 0 0 "[ . 1 . 2]" 1
212 1 20 LEU H 1 20 LEU HB3 . . 3.660 3.539 3.148 3.979 0.319 18 0 "[ . 1 . 2]" 1
213 1 20 LEU H 1 20 LEU MD2 . . 5.620 3.826 1.852 4.714 . 0 0 "[ . 1 . 2]" 1
214 1 20 LEU HA 1 20 LEU MD1 . . 4.080 2.411 1.908 3.634 . 0 0 "[ . 1 . 2]" 1
215 1 20 LEU HA 1 21 LEU H . . 3.190 2.250 2.180 2.478 . 0 0 "[ . 1 . 2]" 1
216 1 20 LEU HA 1 23 LEU H . . 5.930 4.464 4.146 4.817 . 0 0 "[ . 1 . 2]" 1
217 1 20 LEU HA 1 23 LEU HB2 . . 4.850 4.491 4.247 4.809 . 0 0 "[ . 1 . 2]" 1
218 1 20 LEU HA 1 23 LEU QB . . 4.470 4.080 3.964 4.277 . 0 0 "[ . 1 . 2]" 1
219 1 20 LEU HA 1 23 LEU HB3 . . 4.850 4.704 4.510 4.855 0.005 4 0 "[ . 1 . 2]" 1
220 1 20 LEU QB 1 21 LEU H . . 5.080 3.296 2.534 3.804 . 0 0 "[ . 1 . 2]" 1
221 1 20 LEU QB 1 24 ASP H . . 4.500 3.825 3.158 4.121 . 0 0 "[ . 1 . 2]" 1
222 1 20 LEU QB 1 24 ASP QB . . 6.600 4.876 4.238 5.214 . 0 0 "[ . 1 . 2]" 1
223 1 20 LEU QB 1 54 ASP QB . . 5.210 2.036 1.770 2.993 . 0 0 "[ . 1 . 2]" 1
224 1 20 LEU HB2 1 54 ASP HB2 . . 6.420 2.867 2.076 4.468 . 0 0 "[ . 1 . 2]" 1
225 1 20 LEU HB2 1 54 ASP HB3 . . 6.420 2.155 1.946 3.104 . 0 0 "[ . 1 . 2]" 1
226 1 20 LEU HB3 1 54 ASP HB2 . . 6.420 4.473 3.139 6.078 . 0 0 "[ . 1 . 2]" 1
227 1 20 LEU HB3 1 54 ASP HB3 . . 6.420 3.493 2.444 4.818 . 0 0 "[ . 1 . 2]" 1
228 1 20 LEU MD1 1 21 LEU H . . 6.340 3.657 1.927 4.827 . 0 0 "[ . 1 . 2]" 1
229 1 20 LEU MD1 1 54 ASP QB . . 5.750 3.192 1.868 4.166 . 0 0 "[ . 1 . 2]" 1
230 1 20 LEU MD1 1 55 GLN H . . 5.730 3.792 2.502 4.931 . 0 0 "[ . 1 . 2]" 1
231 1 20 LEU MD1 1 55 GLN HA . . 6.130 3.052 1.921 4.284 . 0 0 "[ . 1 . 2]" 1
232 1 20 LEU MD1 1 55 GLN QE . . 7.900 4.319 2.668 5.612 . 0 0 "[ . 1 . 2]" 1
233 1 20 LEU MD2 1 54 ASP QB . . 5.930 2.733 1.752 3.920 . 0 0 "[ . 1 . 2]" 1
234 1 20 LEU MD2 1 55 GLN H . . 5.410 3.355 2.099 4.509 . 0 0 "[ . 1 . 2]" 1
235 1 20 LEU MD2 1 55 GLN HA . . 5.120 2.410 1.749 4.053 . 0 0 "[ . 1 . 2]" 1
236 1 20 LEU MD2 1 55 GLN QE . . 7.900 4.297 2.614 5.482 . 0 0 "[ . 1 . 2]" 1
237 1 20 LEU MD2 1 55 GLN QG . . 7.900 2.788 1.804 3.407 . 0 0 "[ . 1 . 2]" 1
238 1 21 LEU H 1 21 LEU HG . . 5.320 4.270 3.064 4.495 . 0 0 "[ . 1 . 2]" 1
239 1 21 LEU H 1 22 GLU H . . 4.020 3.060 2.743 3.453 . 0 0 "[ . 1 . 2]" 1
240 1 21 LEU HA 1 21 LEU MD1 . . 4.080 2.221 1.980 3.295 . 0 0 "[ . 1 . 2]" 1
241 1 21 LEU HA 1 24 ASP H . . 3.770 3.468 3.221 3.681 . 0 0 "[ . 1 . 2]" 1
242 1 21 LEU HA 1 24 ASP QB . . 4.180 2.765 2.396 3.037 . 0 0 "[ . 1 . 2]" 1
243 1 21 LEU HA 1 25 LEU H . . 5.710 4.549 4.165 4.999 . 0 0 "[ . 1 . 2]" 1
244 1 21 LEU QB 1 22 GLU H . . 5.040 2.281 1.965 3.371 . 0 0 "[ . 1 . 2]" 1
245 1 21 LEU QB 1 25 LEU MD1 . . 6.900 4.408 4.179 4.721 . 0 0 "[ . 1 . 2]" 1
246 1 21 LEU QB 1 25 LEU HG . . 6.080 4.725 4.436 5.096 . 0 0 "[ . 1 . 2]" 1
247 1 21 LEU MD1 1 22 GLU H . . 5.840 4.014 3.115 4.408 . 0 0 "[ . 1 . 2]" 1
248 1 21 LEU MD1 1 24 ASP QB . . 6.750 3.199 2.803 3.833 . 0 0 "[ . 1 . 2]" 1
249 1 21 LEU MD1 1 25 LEU HG . . 4.760 3.309 2.117 3.691 . 0 0 "[ . 1 . 2]" 1
250 1 21 LEU MD2 1 22 GLU H . . 7.030 3.510 3.000 3.770 . 0 0 "[ . 1 . 2]" 1
251 1 21 LEU HG 1 22 GLU H . . 5.030 2.789 1.964 3.321 . 0 0 "[ . 1 . 2]" 1
252 1 21 LEU HG 1 25 LEU MD1 . . 5.050 2.734 2.300 3.975 . 0 0 "[ . 1 . 2]" 1
253 1 21 LEU HG 1 25 LEU HG . . 4.420 3.283 2.770 4.105 . 0 0 "[ . 1 . 2]" 1
254 1 22 GLU H 1 22 GLU HB2 . . 3.480 2.084 2.042 2.324 . 0 0 "[ . 1 . 2]" 1
255 1 22 GLU H 1 22 GLU QB . . 3.210 2.048 2.020 2.184 . 0 0 "[ . 1 . 2]" 1
256 1 22 GLU H 1 22 GLU HB3 . . 3.480 3.081 2.654 3.272 . 0 0 "[ . 1 . 2]" 1
257 1 22 GLU H 1 23 LEU H . . 3.730 2.992 2.773 3.148 . 0 0 "[ . 1 . 2]" 1
258 1 22 GLU HA 1 22 GLU HG2 . . 3.660 3.474 2.361 3.602 . 0 0 "[ . 1 . 2]" 1
259 1 22 GLU HA 1 22 GLU QG . . 3.320 2.254 2.036 2.544 . 0 0 "[ . 1 . 2]" 1
260 1 22 GLU HA 1 22 GLU HG3 . . 3.660 2.327 2.052 3.252 . 0 0 "[ . 1 . 2]" 1
261 1 22 GLU HA 1 25 LEU H . . 4.240 3.292 3.120 3.413 . 0 0 "[ . 1 . 2]" 1
262 1 22 GLU HA 1 25 LEU HB2 . . 3.660 3.090 2.942 3.350 . 0 0 "[ . 1 . 2]" 1
263 1 22 GLU HA 1 25 LEU HB3 . . 4.380 4.410 4.318 4.489 0.109 17 0 "[ . 1 . 2]" 1
264 1 22 GLU HA 1 25 LEU MD1 . . 5.080 2.428 2.016 2.739 . 0 0 "[ . 1 . 2]" 1
265 1 22 GLU HA 1 26 ILE MD . . 5.340 4.052 3.643 4.301 . 0 0 "[ . 1 . 2]" 1
266 1 22 GLU QB 1 23 LEU H . . 4.200 2.579 2.363 2.772 . 0 0 "[ . 1 . 2]" 1
267 1 22 GLU QB 1 26 ILE MD . . 5.900 2.577 2.197 3.230 . 0 0 "[ . 1 . 2]" 1
268 1 22 GLU QB 1 26 ILE QG . . 6.600 3.731 3.311 4.493 . 0 0 "[ . 1 . 2]" 1
269 1 22 GLU QB 1 58 LEU MD2 . . 5.230 3.165 2.691 3.624 . 0 0 "[ . 1 . 2]" 1
270 1 22 GLU HB2 1 23 LEU H . . 4.990 3.448 3.180 3.807 . 0 0 "[ . 1 . 2]" 1
271 1 22 GLU HB2 1 26 ILE MD . . 6.600 4.113 3.742 4.466 . 0 0 "[ . 1 . 2]" 1
272 1 22 GLU HB2 1 58 LEU MD2 . . 5.550 3.991 3.373 4.565 . 0 0 "[ . 1 . 2]" 1
273 1 22 GLU HB3 1 23 LEU H . . 4.990 2.670 2.420 2.934 . 0 0 "[ . 1 . 2]" 1
274 1 22 GLU HB3 1 26 ILE MD . . 6.600 2.606 2.212 3.322 . 0 0 "[ . 1 . 2]" 1
275 1 22 GLU HB3 1 58 LEU MD2 . . 5.550 3.325 2.828 3.802 . 0 0 "[ . 1 . 2]" 1
276 1 22 GLU QG 1 26 ILE MD . . 4.660 3.032 2.647 3.245 . 0 0 "[ . 1 . 2]" 1
277 1 22 GLU QG 1 58 LEU MD2 . . 6.760 4.345 3.658 4.896 . 0 0 "[ . 1 . 2]" 1
278 1 22 GLU HG2 1 26 ILE MD . . 4.940 3.394 2.823 3.774 . 0 0 "[ . 1 . 2]" 1
279 1 22 GLU HG3 1 26 ILE MD . . 4.940 3.481 2.949 3.840 . 0 0 "[ . 1 . 2]" 1
280 1 23 LEU H 1 23 LEU HB2 . . 3.410 2.082 2.002 2.262 . 0 0 "[ . 1 . 2]" 1
281 1 23 LEU H 1 23 LEU QB . . 3.220 2.033 1.976 2.135 . 0 0 "[ . 1 . 2]" 1
282 1 23 LEU H 1 23 LEU HB3 . . 3.410 2.877 2.622 3.034 . 0 0 "[ . 1 . 2]" 1
283 1 23 LEU H 1 23 LEU MD2 . . 5.230 3.697 3.373 4.141 . 0 0 "[ . 1 . 2]" 1
284 1 23 LEU H 1 23 LEU HG . . 4.960 4.565 4.503 4.594 . 0 0 "[ . 1 . 2]" 1
285 1 23 LEU H 1 24 ASP H . . 2.870 2.865 2.618 2.979 0.109 12 0 "[ . 1 . 2]" 1
286 1 23 LEU H 1 24 ASP QB . . 6.010 4.461 4.321 4.595 . 0 0 "[ . 1 . 2]" 1
287 1 23 LEU HA 1 23 LEU MD1 . . 3.430 1.899 1.834 1.965 . 0 0 "[ . 1 . 2]" 1
288 1 23 LEU HA 1 23 LEU MD2 . . 4.720 3.123 2.604 3.826 . 0 0 "[ . 1 . 2]" 1
289 1 23 LEU HA 1 26 ILE H . . 3.840 3.164 2.974 3.364 . 0 0 "[ . 1 . 2]" 1
290 1 23 LEU HA 1 26 ILE HB . . 3.230 2.388 2.095 2.873 . 0 0 "[ . 1 . 2]" 1
291 1 23 LEU HA 1 26 ILE MD . . 4.900 1.807 1.758 1.887 . 0 0 "[ . 1 . 2]" 1
292 1 23 LEU HA 1 26 ILE MG . . 6.310 3.755 3.385 4.234 . 0 0 "[ . 1 . 2]" 1
293 1 23 LEU HA 1 27 PHE H . . 4.240 3.908 3.625 4.276 0.036 18 0 "[ . 1 . 2]" 1
294 1 23 LEU HA 1 58 LEU HA . . 6.000 5.988 5.504 6.094 0.094 11 0 "[ . 1 . 2]" 1
295 1 23 LEU HA 1 58 LEU MD2 . . 6.090 4.704 4.154 4.985 . 0 0 "[ . 1 . 2]" 1
296 1 23 LEU QB 1 24 ASP H . . 3.620 2.505 2.336 2.944 . 0 0 "[ . 1 . 2]" 1
297 1 23 LEU HB2 1 24 ASP H . . 3.910 3.534 3.293 3.936 0.026 18 0 "[ . 1 . 2]" 1
298 1 23 LEU HB3 1 24 ASP H . . 3.910 2.564 2.372 3.048 . 0 0 "[ . 1 . 2]" 1
299 1 23 LEU MD1 1 24 ASP H . . 6.600 4.092 3.768 4.667 . 0 0 "[ . 1 . 2]" 1
300 1 23 LEU MD1 1 27 PHE QE . . 8.320 2.721 2.201 3.712 . 0 0 "[ . 1 . 2]" 1
301 1 23 LEU MD1 1 54 ASP HA . . 7.030 3.565 3.137 4.349 . 0 0 "[ . 1 . 2]" 1
302 1 23 LEU MD1 1 57 LEU MD1 . . 6.360 4.041 3.802 4.194 . 0 0 "[ . 1 . 2]" 1
303 1 23 LEU MD1 1 57 LEU MD2 . . 6.580 1.838 1.661 2.352 . 0 0 "[ . 1 . 2]" 1
304 1 23 LEU MD1 1 57 LEU HG . . 4.330 3.316 2.641 3.489 . 0 0 "[ . 1 . 2]" 1
305 1 23 LEU MD1 1 58 LEU HA . . 6.490 4.209 3.046 4.721 . 0 0 "[ . 1 . 2]" 1
306 1 23 LEU MD2 1 24 ASP H . . 6.200 4.826 4.376 5.042 . 0 0 "[ . 1 . 2]" 1
307 1 23 LEU MD2 1 27 PHE QE . . 9.150 3.734 2.562 4.128 . 0 0 "[ . 1 . 2]" 1
308 1 23 LEU MD2 1 54 ASP HA . . 3.860 2.060 1.861 2.364 . 0 0 "[ . 1 . 2]" 1
309 1 23 LEU MD2 1 54 ASP HB2 . . 4.800 3.337 2.820 3.776 . 0 0 "[ . 1 . 2]" 1
310 1 23 LEU MD2 1 54 ASP QB . . 4.520 2.120 1.867 2.614 . 0 0 "[ . 1 . 2]" 1
311 1 23 LEU MD2 1 54 ASP HB3 . . 4.800 2.147 1.879 2.684 . 0 0 "[ . 1 . 2]" 1
312 1 23 LEU MD2 1 55 GLN QG . . 7.650 5.165 4.984 5.443 . 0 0 "[ . 1 . 2]" 1
313 1 23 LEU MD2 1 57 LEU HB3 . . 7.030 2.119 1.948 2.548 . 0 0 "[ . 1 . 2]" 1
314 1 23 LEU MD2 1 57 LEU MD2 . . 6.080 2.308 1.905 2.649 . 0 0 "[ . 1 . 2]" 1
315 1 23 LEU MD2 1 57 LEU HG . . 4.940 3.049 2.648 3.851 . 0 0 "[ . 1 . 2]" 1
316 1 23 LEU MD2 1 58 LEU H . . 4.110 2.242 2.050 2.760 . 0 0 "[ . 1 . 2]" 1
317 1 23 LEU MD2 1 58 LEU HA . . 6.060 3.095 2.694 4.060 . 0 0 "[ . 1 . 2]" 1
318 1 23 LEU MD2 1 58 LEU QB . . 5.750 2.036 1.754 2.857 . 0 0 "[ . 1 . 2]" 1
319 1 23 LEU MD2 1 58 LEU MD1 . . 7.770 1.886 1.679 2.874 . 0 0 "[ . 1 . 2]" 1
320 1 23 LEU MD2 1 58 LEU MD2 . . 6.980 3.148 2.718 4.030 . 0 0 "[ . 1 . 2]" 1
321 1 23 LEU MD2 1 61 ILE MD . . 7.410 4.244 3.232 5.060 . 0 0 "[ . 1 . 2]" 1
322 1 23 LEU HG 1 24 ASP H . . 4.880 4.561 4.237 4.865 . 0 0 "[ . 1 . 2]" 1
323 1 23 LEU HG 1 27 PHE H . . 5.530 5.295 4.211 5.587 0.057 14 0 "[ . 1 . 2]" 1
324 1 24 ASP H 1 24 ASP QB . . 3.920 2.156 2.006 2.205 . 0 0 "[ . 1 . 2]" 1
325 1 24 ASP H 1 25 LEU H . . 3.340 2.772 2.457 2.876 . 0 0 "[ . 1 . 2]" 1
326 1 24 ASP H 1 25 LEU HG . . 5.680 4.036 3.685 4.173 . 0 0 "[ . 1 . 2]" 1
327 1 24 ASP HA 1 27 PHE H . . 5.240 3.985 3.809 4.204 . 0 0 "[ . 1 . 2]" 1
328 1 24 ASP HA 1 27 PHE HB2 . . 6.000 3.290 2.759 3.920 . 0 0 "[ . 1 . 2]" 1
329 1 24 ASP HA 1 27 PHE QB . . 5.150 3.235 2.727 3.835 . 0 0 "[ . 1 . 2]" 1
330 1 24 ASP HA 1 27 PHE HB3 . . 6.000 4.784 4.283 5.439 . 0 0 "[ . 1 . 2]" 1
331 1 24 ASP HA 1 28 GLY H . . 5.750 4.800 4.035 5.170 . 0 0 "[ . 1 . 2]" 1
332 1 24 ASP QB 1 25 LEU H . . 4.460 2.649 2.405 2.918 . 0 0 "[ . 1 . 2]" 1
333 1 24 ASP QB 1 25 LEU MD1 . . 7.900 4.487 4.362 4.735 . 0 0 "[ . 1 . 2]" 1
334 1 25 LEU H 1 25 LEU HB2 . . 3.230 2.734 2.675 2.802 . 0 0 "[ . 1 . 2]" 1
335 1 25 LEU H 1 25 LEU HB3 . . 3.440 3.542 3.521 3.560 0.120 8 0 "[ . 1 . 2]" 1
336 1 25 LEU H 1 25 LEU MD1 . . 4.720 3.621 3.548 3.694 . 0 0 "[ . 1 . 2]" 1
337 1 25 LEU H 1 25 LEU MD2 . . 4.980 2.522 2.155 2.967 . 0 0 "[ . 1 . 2]" 1
338 1 25 LEU H 1 25 LEU HG . . 3.840 1.971 1.929 2.102 . 0 0 "[ . 1 . 2]" 1
339 1 25 LEU H 1 26 ILE H . . 3.480 2.576 2.480 2.739 . 0 0 "[ . 1 . 2]" 1
340 1 25 LEU HA 1 25 LEU MD2 . . 3.930 2.120 1.959 2.344 . 0 0 "[ . 1 . 2]" 1
341 1 25 LEU HA 1 27 PHE H . . 5.140 4.690 4.382 4.940 . 0 0 "[ . 1 . 2]" 1
342 1 25 LEU HA 1 28 GLY H . . 3.660 3.291 3.106 3.447 . 0 0 "[ . 1 . 2]" 1
343 1 25 LEU HA 1 29 ARG H . . 4.920 4.836 4.021 4.996 0.076 18 0 "[ . 1 . 2]" 1
344 1 25 LEU HB2 1 26 ILE H . . 3.550 2.545 2.316 2.706 . 0 0 "[ . 1 . 2]" 1
345 1 25 LEU HB3 1 26 ILE H . . 4.130 3.873 3.665 3.992 . 0 0 "[ . 1 . 2]" 1
346 1 25 LEU MD1 1 26 ILE H . . 7.030 4.426 4.111 4.600 . 0 0 "[ . 1 . 2]" 1
347 1 25 LEU MD2 1 26 ILE H . . 7.030 4.343 4.168 4.507 . 0 0 "[ . 1 . 2]" 1
348 1 25 LEU HG 1 26 ILE H . . 3.800 3.756 3.607 3.823 0.023 6 0 "[ . 1 . 2]" 1
349 1 26 ILE H 1 26 ILE HB . . 2.830 2.468 2.332 2.573 . 0 0 "[ . 1 . 2]" 1
350 1 26 ILE H 1 26 ILE MD . . 4.260 3.060 2.662 3.419 . 0 0 "[ . 1 . 2]" 1
351 1 26 ILE H 1 26 ILE HG12 . . 3.550 3.474 3.413 3.597 0.047 11 0 "[ . 1 . 2]" 1
352 1 26 ILE H 1 26 ILE QG . . 3.350 1.980 1.912 2.227 . 0 0 "[ . 1 . 2]" 1
353 1 26 ILE H 1 26 ILE HG13 . . 3.550 1.991 1.922 2.249 . 0 0 "[ . 1 . 2]" 1
354 1 26 ILE H 1 26 ILE MG . . 4.690 3.711 3.693 3.720 . 0 0 "[ . 1 . 2]" 1
355 1 26 ILE H 1 27 PHE H . . 3.230 3.079 2.962 3.212 . 0 0 "[ . 1 . 2]" 1
356 1 26 ILE HA 1 26 ILE HG12 . . 3.550 2.756 2.507 3.008 . 0 0 "[ . 1 . 2]" 1
357 1 26 ILE HA 1 26 ILE HG13 . . 3.550 2.650 2.528 2.736 . 0 0 "[ . 1 . 2]" 1
358 1 26 ILE HA 1 29 ARG H . . 5.060 3.678 3.226 3.953 . 0 0 "[ . 1 . 2]" 1
359 1 26 ILE HA 1 29 ARG HB2 . . 6.000 3.945 3.152 5.714 . 0 0 "[ . 1 . 2]" 1
360 1 26 ILE HA 1 29 ARG QB . . 5.240 3.770 3.098 4.789 . 0 0 "[ . 1 . 2]" 1
361 1 26 ILE HA 1 29 ARG HB3 . . 6.000 5.140 4.322 5.599 . 0 0 "[ . 1 . 2]" 1
362 1 26 ILE HB 1 27 PHE H . . 2.980 2.388 2.283 2.558 . 0 0 "[ . 1 . 2]" 1
363 1 26 ILE MD 1 27 PHE H . . 5.880 4.098 3.792 4.292 . 0 0 "[ . 1 . 2]" 1
364 1 26 ILE MD 1 27 PHE QE . . 9.150 5.038 4.855 5.154 . 0 0 "[ . 1 . 2]" 1
365 1 26 ILE MD 1 27 PHE HZ . . 7.030 5.740 5.703 5.792 . 0 0 "[ . 1 . 2]" 1
366 1 26 ILE MD 1 30 PHE QD . . 9.040 5.941 5.153 6.783 . 0 0 "[ . 1 . 2]" 1
367 1 26 ILE HG12 1 27 PHE H . . 6.000 5.028 4.955 5.134 . 0 0 "[ . 1 . 2]" 1
368 1 26 ILE HG13 1 27 PHE H . . 6.000 4.388 4.316 4.555 . 0 0 "[ . 1 . 2]" 1
369 1 26 ILE MG 1 27 PHE H . . 4.220 3.082 2.533 3.399 . 0 0 "[ . 1 . 2]" 1
370 1 27 PHE H 1 27 PHE HB2 . . 3.440 2.363 2.257 2.457 . 0 0 "[ . 1 . 2]" 1
371 1 27 PHE H 1 27 PHE QB . . 3.160 2.326 2.229 2.411 . 0 0 "[ . 1 . 2]" 1
372 1 27 PHE H 1 27 PHE HB3 . . 3.440 3.474 3.450 3.494 0.054 8 0 "[ . 1 . 2]" 1
373 1 27 PHE H 1 28 GLY H . . 3.410 2.888 2.766 3.098 . 0 0 "[ . 1 . 2]" 1
374 1 27 PHE HA 1 28 GLY H . . 3.520 3.580 3.468 3.639 0.119 9 0 "[ . 1 . 2]" 1
375 1 27 PHE HA 1 29 ARG H . . 5.420 4.539 4.071 5.225 . 0 0 "[ . 1 . 2]" 1
376 1 27 PHE HA 1 30 PHE H . . 5.280 3.676 3.178 5.054 . 0 0 "[ . 1 . 2]" 1
377 1 27 PHE HA 1 30 PHE QB . . 4.820 2.110 1.905 3.970 . 0 0 "[ . 1 . 2]" 1
378 1 27 PHE HA 1 31 MET H . . 5.530 3.153 2.545 3.572 . 0 0 "[ . 1 . 2]" 1
379 1 27 PHE HB2 1 28 GLY H . . 4.670 2.638 2.216 3.122 . 0 0 "[ . 1 . 2]" 1
380 1 27 PHE HB3 1 28 GLY H . . 4.670 3.595 3.236 3.972 . 0 0 "[ . 1 . 2]" 1
381 1 27 PHE QE 1 49 ILE MG . . 8.540 4.704 4.107 5.183 . 0 0 "[ . 1 . 2]" 1
382 1 27 PHE QE 1 50 LEU HA . . 7.010 4.642 4.091 5.298 . 0 0 "[ . 1 . 2]" 1
383 1 27 PHE QE 1 50 LEU MD1 . . 9.150 4.806 3.741 5.717 . 0 0 "[ . 1 . 2]" 1
384 1 27 PHE QE 1 50 LEU MD2 . . 7.170 2.609 1.869 3.233 . 0 0 "[ . 1 . 2]" 1
385 1 27 PHE QE 1 57 LEU MD1 . . 9.150 3.951 3.683 4.207 . 0 0 "[ . 1 . 2]" 1
386 1 27 PHE QE 1 57 LEU MD2 . . 9.150 2.367 1.980 2.778 . 0 0 "[ . 1 . 2]" 1
387 1 27 PHE HZ 1 50 LEU MD2 . . 5.550 3.604 2.885 4.376 . 0 0 "[ . 1 . 2]" 1
388 1 27 PHE HZ 1 57 LEU MD1 . . 5.300 4.274 4.024 4.402 . 0 0 "[ . 1 . 2]" 1
389 1 27 PHE HZ 1 57 LEU MD2 . . 4.800 2.024 1.836 2.451 . 0 0 "[ . 1 . 2]" 1
390 1 28 GLY H 1 29 ARG H . . 3.480 2.988 2.465 3.163 . 0 0 "[ . 1 . 2]" 1
391 1 28 GLY QA 1 31 MET QB . . 5.490 3.737 3.047 4.232 . 0 0 "[ . 1 . 2]" 1
392 1 28 GLY HA2 1 31 MET HB2 . . 6.630 4.152 3.161 5.206 . 0 0 "[ . 1 . 2]" 1
393 1 28 GLY HA2 1 31 MET HB3 . . 6.630 4.938 3.756 5.339 . 0 0 "[ . 1 . 2]" 1
394 1 28 GLY HA3 1 31 MET HB2 . . 6.630 5.499 4.736 6.737 0.107 9 0 "[ . 1 . 2]" 1
395 1 28 GLY HA3 1 31 MET HB3 . . 6.630 6.379 5.118 6.703 0.073 19 0 "[ . 1 . 2]" 1
396 1 29 ARG H 1 29 ARG HB2 . . 3.440 2.288 2.119 3.593 0.153 15 0 "[ . 1 . 2]" 1
397 1 29 ARG H 1 29 ARG QB . . 3.220 2.168 2.098 2.570 . 0 0 "[ . 1 . 2]" 1
398 1 29 ARG H 1 29 ARG HB3 . . 3.440 3.332 2.612 3.448 0.008 5 0 "[ . 1 . 2]" 1
399 1 29 ARG H 1 29 ARG HG2 . . 4.020 3.376 1.938 3.991 . 0 0 "[ . 1 . 2]" 1
400 1 29 ARG H 1 29 ARG QG . . 3.600 3.019 1.928 3.247 . 0 0 "[ . 1 . 2]" 1
401 1 29 ARG H 1 29 ARG HG3 . . 4.020 3.601 3.174 4.023 0.003 9 0 "[ . 1 . 2]" 1
402 1 29 ARG H 1 30 PHE H . . 3.370 2.466 2.318 2.714 . 0 0 "[ . 1 . 2]" 1
403 1 29 ARG HA 1 29 ARG QD . . 5.040 3.206 1.988 4.176 . 0 0 "[ . 1 . 2]" 1
404 1 29 ARG HA 1 30 PHE H . . 3.550 3.625 3.505 3.650 0.100 9 0 "[ . 1 . 2]" 1
405 1 29 ARG HA 1 32 GLU H . . 3.910 3.289 2.903 3.542 . 0 0 "[ . 1 . 2]" 1
406 1 29 ARG HA 1 32 GLU HB2 . . 4.450 2.604 2.224 2.999 . 0 0 "[ . 1 . 2]" 1
407 1 29 ARG HA 1 32 GLU HB3 . . 4.780 3.180 2.839 3.531 . 0 0 "[ . 1 . 2]" 1
408 1 29 ARG QB 1 30 PHE H . . 4.240 2.602 2.203 3.667 . 0 0 "[ . 1 . 2]" 1
409 1 29 ARG HB2 1 30 PHE H . . 4.560 2.796 2.421 4.033 . 0 0 "[ . 1 . 2]" 1
410 1 29 ARG HB3 1 30 PHE H . . 4.560 3.114 2.535 4.260 . 0 0 "[ . 1 . 2]" 1
411 1 29 ARG QD 1 30 PHE H . . 6.880 4.660 3.989 4.860 . 0 0 "[ . 1 . 2]" 1
412 1 29 ARG QG 1 30 PHE H . . 5.560 4.079 1.932 4.392 . 0 0 "[ . 1 . 2]" 1
413 1 29 ARG HG2 1 30 PHE H . . 6.000 4.548 1.945 4.998 . 0 0 "[ . 1 . 2]" 1
414 1 29 ARG HG3 1 30 PHE H . . 6.000 4.684 3.290 4.972 . 0 0 "[ . 1 . 2]" 1
415 1 30 PHE H 1 31 MET H . . 4.240 3.001 2.540 3.299 . 0 0 "[ . 1 . 2]" 1
416 1 30 PHE HA 1 33 LYS H . . 4.880 3.752 3.440 4.018 . 0 0 "[ . 1 . 2]" 1
417 1 30 PHE HA 1 33 LYS QB . . 5.760 3.226 2.764 4.281 . 0 0 "[ . 1 . 2]" 1
418 1 30 PHE HA 1 34 GLU H . . 4.630 4.129 3.706 4.680 0.050 11 0 "[ . 1 . 2]" 1
419 1 30 PHE HA 1 79 ILE HA . . 6.000 5.962 5.761 6.092 0.092 15 0 "[ . 1 . 2]" 1
420 1 30 PHE HA 1 82 ALA MB . . 4.470 2.193 1.885 3.188 . 0 0 "[ . 1 . 2]" 1
421 1 30 PHE QB 1 79 ILE HA . . 6.370 5.486 5.093 5.710 . 0 0 "[ . 1 . 2]" 1
422 1 30 PHE QB 1 79 ILE MG . . 7.180 4.094 3.605 4.488 . 0 0 "[ . 1 . 2]" 1
423 1 30 PHE QB 1 82 ALA MB . . 7.040 3.049 2.150 4.138 . 0 0 "[ . 1 . 2]" 1
424 1 30 PHE QD 1 79 ILE HA . . 6.110 3.630 3.358 4.108 . 0 0 "[ . 1 . 2]" 1
425 1 30 PHE QD 1 79 ILE MG . . 9.150 2.918 1.962 3.585 . 0 0 "[ . 1 . 2]" 1
426 1 30 PHE QD 1 82 ALA MB . . 7.210 2.489 1.875 3.714 . 0 0 "[ . 1 . 2]" 1
427 1 30 PHE QE 1 38 LEU MD1 . . 9.150 4.192 3.205 4.760 . 0 0 "[ . 1 . 2]" 1
428 1 30 PHE QE 1 38 LEU MD2 . . 9.150 4.720 4.210 5.256 . 0 0 "[ . 1 . 2]" 1
429 1 30 PHE QE 1 50 LEU HA . . 7.040 5.964 5.380 6.579 . 0 0 "[ . 1 . 2]" 1
430 1 30 PHE QE 1 50 LEU MD2 . . 9.150 3.045 2.371 3.579 . 0 0 "[ . 1 . 2]" 1
431 1 30 PHE QE 1 79 ILE HA . . 7.650 3.008 2.008 4.126 . 0 0 "[ . 1 . 2]" 1
432 1 30 PHE QE 1 79 ILE MG . . 9.150 2.282 1.840 3.351 . 0 0 "[ . 1 . 2]" 1
433 1 30 PHE QE 1 82 ALA MB . . 9.150 4.054 3.163 5.465 . 0 0 "[ . 1 . 2]" 1
434 1 30 PHE HZ 1 38 LEU MD1 . . 6.670 4.234 3.678 4.838 . 0 0 "[ . 1 . 2]" 1
435 1 30 PHE HZ 1 38 LEU MD2 . . 4.720 5.009 4.457 5.468 0.748 8 6 "[* *. +*1- . * 2]" 1
436 1 31 MET H 1 32 GLU H . . 3.410 2.667 2.388 2.986 . 0 0 "[ . 1 . 2]" 1
437 1 31 MET HA 1 34 GLU H . . 4.850 3.021 2.745 3.278 . 0 0 "[ . 1 . 2]" 1
438 1 31 MET HA 1 34 GLU HB2 . . 4.240 2.639 1.989 3.123 . 0 0 "[ . 1 . 2]" 1
439 1 31 MET HA 1 34 GLU HB3 . . 4.240 3.916 3.381 4.277 0.037 20 0 "[ . 1 . 2]" 1
440 1 31 MET HA 1 35 PHE H . . 4.240 1.998 1.871 2.327 . 0 0 "[ . 1 . 2]" 1
441 1 31 MET HA 1 35 PHE HB2 . . 3.620 3.019 2.282 3.592 . 0 0 "[ . 1 . 2]" 1
442 1 31 MET HA 1 35 PHE QB . . 3.420 2.370 1.993 3.218 . 0 0 "[ . 1 . 2]" 1
443 1 31 MET HA 1 35 PHE HB3 . . 3.620 2.570 2.012 3.632 0.012 14 0 "[ . 1 . 2]" 1
444 1 31 MET HA 1 35 PHE QD . . 8.120 4.368 4.020 5.298 . 0 0 "[ . 1 . 2]" 1
445 1 31 MET QB 1 32 GLU H . . 3.690 2.609 2.244 3.475 . 0 0 "[ . 1 . 2]" 1
446 1 31 MET QB 1 35 PHE H . . 6.630 3.684 3.264 4.048 . 0 0 "[ . 1 . 2]" 1
447 1 31 MET HB2 1 32 GLU H . . 4.020 2.961 2.292 4.002 . 0 0 "[ . 1 . 2]" 1
448 1 31 MET HB3 1 32 GLU H . . 4.020 3.052 2.358 3.950 . 0 0 "[ . 1 . 2]" 1
449 1 31 MET QG 1 32 GLU H . . 5.760 3.927 1.815 4.509 . 0 0 "[ . 1 . 2]" 1
450 1 32 GLU H 1 32 GLU HB2 . . 2.900 2.045 2.037 2.064 . 0 0 "[ . 1 . 2]" 1
451 1 32 GLU H 1 32 GLU HB3 . . 2.980 3.094 3.043 3.123 0.143 16 0 "[ . 1 . 2]" 1
452 1 32 GLU H 1 32 GLU HG2 . . 4.560 4.129 3.723 4.369 . 0 0 "[ . 1 . 2]" 1
453 1 32 GLU H 1 32 GLU QG . . 4.010 3.541 3.515 3.600 . 0 0 "[ . 1 . 2]" 1
454 1 32 GLU H 1 32 GLU HG3 . . 4.560 3.942 3.726 4.388 . 0 0 "[ . 1 . 2]" 1
455 1 32 GLU H 1 33 LYS H . . 3.120 2.769 2.584 2.861 . 0 0 "[ . 1 . 2]" 1
456 1 32 GLU HA 1 32 GLU HB2 . . 2.980 2.769 2.760 2.798 . 0 0 "[ . 1 . 2]" 1
457 1 32 GLU HA 1 32 GLU HG2 . . 3.840 2.330 2.194 2.515 . 0 0 "[ . 1 . 2]" 1
458 1 32 GLU HA 1 32 GLU HG3 . . 3.840 2.891 2.431 3.567 . 0 0 "[ . 1 . 2]" 1
459 1 32 GLU HA 1 35 PHE HB2 . . 6.000 5.618 5.000 6.071 0.071 20 0 "[ . 1 . 2]" 1
460 1 32 GLU HA 1 35 PHE HB3 . . 6.000 3.949 3.445 4.435 . 0 0 "[ . 1 . 2]" 1
461 1 32 GLU HB2 1 32 GLU HG2 . . 3.050 2.883 2.480 3.054 0.004 15 0 "[ . 1 . 2]" 1
462 1 32 GLU HB2 1 32 GLU QG . . 2.650 2.277 2.203 2.367 . 0 0 "[ . 1 . 2]" 1
463 1 32 GLU HB2 1 32 GLU HG3 . . 3.050 2.404 2.325 2.476 . 0 0 "[ . 1 . 2]" 1
464 1 32 GLU HB2 1 33 LYS H . . 3.590 3.685 3.644 3.723 0.133 6 0 "[ . 1 . 2]" 1
465 1 32 GLU HB3 1 33 LYS H . . 3.410 3.234 3.134 3.377 . 0 0 "[ . 1 . 2]" 1
466 1 32 GLU QG 1 33 LYS H . . 5.560 4.620 4.514 4.806 . 0 0 "[ . 1 . 2]" 1
467 1 32 GLU HG2 1 33 LYS H . . 6.000 5.018 4.870 5.269 . 0 0 "[ . 1 . 2]" 1
468 1 32 GLU HG3 1 33 LYS H . . 6.000 5.405 5.297 5.563 . 0 0 "[ . 1 . 2]" 1
469 1 33 LYS H 1 33 LYS HG2 . . 4.810 4.235 1.948 4.731 . 0 0 "[ . 1 . 2]" 1
470 1 33 LYS H 1 33 LYS QG . . 4.580 3.599 1.934 4.051 . 0 0 "[ . 1 . 2]" 1
471 1 33 LYS H 1 33 LYS HG3 . . 4.810 4.024 2.858 4.592 . 0 0 "[ . 1 . 2]" 1
472 1 33 LYS H 1 34 GLU H . . 2.940 2.253 2.102 2.418 . 0 0 "[ . 1 . 2]" 1
473 1 33 LYS H 1 35 PHE H . . 4.310 4.310 4.121 4.474 0.164 9 0 "[ . 1 . 2]" 1
474 1 33 LYS HA 1 36 GLU H . . 5.710 4.358 4.093 4.847 . 0 0 "[ . 1 . 2]" 1
475 1 33 LYS HA 1 36 GLU QB . . 4.360 3.139 2.693 3.883 . 0 0 "[ . 1 . 2]" 1
476 1 33 LYS QB 1 34 GLU H . . 4.390 2.856 2.407 3.606 . 0 0 "[ . 1 . 2]" 1
477 1 33 LYS QD 1 34 GLU H . . 6.880 4.890 3.689 5.886 . 0 0 "[ . 1 . 2]" 1
478 1 33 LYS QG 1 34 GLU H . . 5.480 4.278 1.791 4.861 . 0 0 "[ . 1 . 2]" 1
479 1 34 GLU H 1 34 GLU HB2 . . 3.770 2.327 2.087 2.652 . 0 0 "[ . 1 . 2]" 1
480 1 34 GLU H 1 34 GLU QB . . 3.400 2.296 2.067 2.602 . 0 0 "[ . 1 . 2]" 1
481 1 34 GLU H 1 34 GLU HB3 . . 3.770 3.537 3.362 3.761 . 0 0 "[ . 1 . 2]" 1
482 1 34 GLU H 1 34 GLU HG2 . . 4.600 3.404 2.451 4.602 0.002 13 0 "[ . 1 . 2]" 1
483 1 34 GLU H 1 34 GLU QG . . 4.010 3.107 2.395 3.677 . 0 0 "[ . 1 . 2]" 1
484 1 34 GLU H 1 34 GLU HG3 . . 4.600 3.892 2.466 4.445 . 0 0 "[ . 1 . 2]" 1
485 1 34 GLU H 1 35 PHE H . . 2.940 2.764 2.493 2.973 0.033 7 0 "[ . 1 . 2]" 1
486 1 34 GLU HA 1 37 HIS H . . 5.680 3.931 3.185 4.489 . 0 0 "[ . 1 . 2]" 1
487 1 34 GLU QB 1 35 PHE H . . 4.410 2.116 1.920 2.280 . 0 0 "[ . 1 . 2]" 1
488 1 34 GLU QB 1 38 LEU MD2 . . 6.070 2.382 1.777 3.321 . 0 0 "[ . 1 . 2]" 1
489 1 34 GLU HB2 1 35 PHE H . . 4.670 2.239 1.943 2.546 . 0 0 "[ . 1 . 2]" 1
490 1 34 GLU HB3 1 35 PHE H . . 4.670 2.719 2.363 3.057 . 0 0 "[ . 1 . 2]" 1
491 1 34 GLU QG 1 35 PHE H . . 6.880 4.040 3.763 4.205 . 0 0 "[ . 1 . 2]" 1
492 1 35 PHE H 1 35 PHE HB2 . . 3.480 2.533 2.126 2.831 . 0 0 "[ . 1 . 2]" 1
493 1 35 PHE H 1 35 PHE QB . . 3.300 2.068 1.954 2.135 . 0 0 "[ . 1 . 2]" 1
494 1 35 PHE H 1 35 PHE HB3 . . 3.480 2.263 1.992 2.692 . 0 0 "[ . 1 . 2]" 1
495 1 35 PHE H 1 36 GLU H . . 3.880 2.919 2.851 2.972 . 0 0 "[ . 1 . 2]" 1
496 1 35 PHE H 1 38 LEU MD1 . . 6.600 2.849 2.464 3.159 . 0 0 "[ . 1 . 2]" 1
497 1 35 PHE HA 1 38 LEU H . . 4.020 3.098 2.739 3.410 . 0 0 "[ . 1 . 2]" 1
498 1 35 PHE HA 1 38 LEU MD1 . . 4.580 1.962 1.890 2.175 . 0 0 "[ . 1 . 2]" 1
499 1 35 PHE HA 1 38 LEU HG . . 3.370 2.166 1.886 3.177 . 0 0 "[ . 1 . 2]" 1
500 1 35 PHE HA 1 46 PHE QB . . 6.880 5.901 4.902 6.277 . 0 0 "[ . 1 . 2]" 1
501 1 35 PHE QB 1 36 GLU H . . 4.460 2.886 2.525 3.120 . 0 0 "[ . 1 . 2]" 1
502 1 35 PHE HB2 1 36 GLU H . . 5.210 4.152 3.848 4.341 . 0 0 "[ . 1 . 2]" 1
503 1 35 PHE HB3 1 36 GLU H . . 5.210 2.945 2.556 3.198 . 0 0 "[ . 1 . 2]" 1
504 1 35 PHE QD 1 38 LEU MD1 . . 8.290 3.255 2.184 4.036 . 0 0 "[ . 1 . 2]" 1
505 1 35 PHE QD 1 38 LEU MD2 . . 9.150 5.411 4.672 6.111 . 0 0 "[ . 1 . 2]" 1
506 1 35 PHE QD 1 43 LEU MD2 . . 8.500 4.019 2.303 5.787 . 0 0 "[ . 1 . 2]" 1
507 1 35 PHE QE 1 36 GLU QG . . 9.000 5.657 3.777 7.125 . 0 0 "[ . 1 . 2]" 1
508 1 35 PHE QE 1 38 LEU MD1 . . 8.390 5.074 3.792 5.838 . 0 0 "[ . 1 . 2]" 1
509 1 36 GLU H 1 36 GLU HB2 . . 3.480 2.432 2.079 3.557 0.077 12 0 "[ . 1 . 2]" 1
510 1 36 GLU H 1 36 GLU QB . . 3.220 2.154 2.043 2.544 . 0 0 "[ . 1 . 2]" 1
511 1 36 GLU H 1 36 GLU HB3 . . 3.480 2.748 2.168 3.074 . 0 0 "[ . 1 . 2]" 1
512 1 36 GLU H 1 36 GLU QG . . 5.000 3.633 1.916 4.040 . 0 0 "[ . 1 . 2]" 1
513 1 36 GLU H 1 37 HIS H . . 3.410 2.980 2.615 3.379 . 0 0 "[ . 1 . 2]" 1
514 1 36 GLU H 1 38 LEU H . . 5.860 4.234 3.578 4.572 . 0 0 "[ . 1 . 2]" 1
515 1 36 GLU HA 1 38 LEU H . . 4.990 4.806 4.084 5.106 0.116 12 0 "[ . 1 . 2]" 1
516 1 36 GLU QB 1 37 HIS H . . 4.500 2.641 1.961 3.355 . 0 0 "[ . 1 . 2]" 1
517 1 36 GLU HB2 1 37 HIS H . . 4.670 3.692 3.315 4.275 . 0 0 "[ . 1 . 2]" 1
518 1 36 GLU HB3 1 37 HIS H . . 4.670 2.762 1.973 3.975 . 0 0 "[ . 1 . 2]" 1
519 1 36 GLU QG 1 37 HIS H . . 6.880 3.681 1.806 4.771 . 0 0 "[ . 1 . 2]" 1
520 1 37 HIS H 1 37 HIS HB2 . . 3.910 2.836 2.178 3.988 0.078 18 0 "[ . 1 . 2]" 1
521 1 37 HIS H 1 37 HIS QB . . 3.460 2.611 2.140 3.092 . 0 0 "[ . 1 . 2]" 1
522 1 37 HIS H 1 37 HIS HB3 . . 3.910 3.249 2.560 3.569 . 0 0 "[ . 1 . 2]" 1
523 1 37 HIS H 1 37 HIS HD1 . . 6.000 5.164 3.107 5.746 . 0 0 "[ . 1 . 2]" 1
524 1 37 HIS H 1 38 LEU H . . 2.830 2.475 1.804 2.874 0.044 17 0 "[ . 1 . 2]" 1
525 1 37 HIS H 1 38 LEU HB2 . . 5.140 4.590 3.875 5.151 0.011 15 0 "[ . 1 . 2]" 1
526 1 37 HIS H 1 38 LEU HG . . 4.850 3.676 3.399 4.008 . 0 0 "[ . 1 . 2]" 1
527 1 37 HIS QB 1 38 LEU H . . 5.270 3.692 2.735 4.114 . 0 0 "[ . 1 . 2]" 1
528 1 37 HIS HB2 1 38 LEU H . . 6.000 4.269 2.876 4.702 . 0 0 "[ . 1 . 2]" 1
529 1 37 HIS HB3 1 38 LEU H . . 6.000 4.095 2.863 4.691 . 0 0 "[ . 1 . 2]" 1
530 1 38 LEU H 1 38 LEU HB2 . . 2.900 2.314 2.222 2.559 . 0 0 "[ . 1 . 2]" 1
531 1 38 LEU H 1 38 LEU HB3 . . 3.440 3.507 3.482 3.541 0.101 9 0 "[ . 1 . 2]" 1
532 1 38 LEU H 1 38 LEU MD1 . . 4.400 3.589 3.313 3.835 . 0 0 "[ . 1 . 2]" 1
533 1 38 LEU H 1 38 LEU MD2 . . 4.290 3.518 3.128 3.746 . 0 0 "[ . 1 . 2]" 1
534 1 38 LEU H 1 38 LEU HG . . 2.440 2.433 1.983 2.611 0.171 13 0 "[ . 1 . 2]" 1
535 1 38 LEU H 1 39 SER H . . 4.630 4.549 4.444 4.650 0.020 18 0 "[ . 1 . 2]" 1
536 1 38 LEU H 1 43 LEU MD2 . . 5.590 4.475 4.042 4.776 . 0 0 "[ . 1 . 2]" 1
537 1 38 LEU HA 1 38 LEU MD2 . . 3.820 2.045 1.900 2.204 . 0 0 "[ . 1 . 2]" 1
538 1 38 LEU HA 1 39 SER H . . 2.760 2.527 2.177 2.880 0.120 13 0 "[ . 1 . 2]" 1
539 1 38 LEU HB2 1 39 SER H . . 4.310 3.756 3.169 4.446 0.136 1 0 "[ . 1 . 2]" 1
540 1 38 LEU HB3 1 39 SER H . . 4.090 2.540 1.756 3.685 . 0 0 "[ . 1 . 2]" 1
541 1 38 LEU HB3 1 43 LEU H . . 4.850 3.878 3.320 4.607 . 0 0 "[ . 1 . 2]" 1
542 1 38 LEU MD1 1 39 SER H . . 7.030 4.459 3.726 5.408 . 0 0 "[ . 1 . 2]" 1
543 1 38 LEU MD1 1 43 LEU H . . 5.950 4.891 4.433 5.349 . 0 0 "[ . 1 . 2]" 1
544 1 38 LEU MD2 1 39 SER H . . 4.540 3.126 2.843 3.733 . 0 0 "[ . 1 . 2]" 1
545 1 38 LEU MD2 1 42 GLU HB2 . . 5.880 3.125 2.237 4.161 . 0 0 "[ . 1 . 2]" 1
546 1 38 LEU MD2 1 42 GLU QB . . 5.180 2.169 1.859 3.200 . 0 0 "[ . 1 . 2]" 1
547 1 38 LEU MD2 1 42 GLU HB3 . . 5.880 2.234 1.955 3.326 . 0 0 "[ . 1 . 2]" 1
548 1 38 LEU MD2 1 78 LYS QD . . 6.140 4.248 2.572 4.881 . 0 0 "[ . 1 . 2]" 1
549 1 38 LEU MD2 1 78 LYS QE . . 6.210 4.323 2.737 5.119 . 0 0 "[ . 1 . 2]" 1
550 1 38 LEU HG 1 39 SER H . . 6.000 4.768 4.484 5.189 . 0 0 "[ . 1 . 2]" 1
551 1 39 SER H 1 39 SER HB2 . . 3.950 3.109 2.601 3.619 . 0 0 "[ . 1 . 2]" 1
552 1 39 SER H 1 39 SER QB . . 3.580 2.910 2.541 3.318 . 0 0 "[ . 1 . 2]" 1
553 1 39 SER H 1 39 SER HB3 . . 3.950 3.687 2.947 4.035 0.085 14 0 "[ . 1 . 2]" 1
554 1 39 SER H 1 40 ASP H . . 4.740 4.455 4.305 4.628 . 0 0 "[ . 1 . 2]" 1
555 1 39 SER H 1 42 GLU H . . 4.700 3.486 2.938 4.099 . 0 0 "[ . 1 . 2]" 1
556 1 39 SER H 1 42 GLU HB2 . . 3.840 2.067 1.864 2.626 . 0 0 "[ . 1 . 2]" 1
557 1 39 SER H 1 42 GLU QB . . 3.520 1.962 1.700 2.361 . 0 0 "[ . 1 . 2]" 1
558 1 39 SER H 1 42 GLU HB3 . . 3.840 2.880 1.893 3.624 . 0 0 "[ . 1 . 2]" 1
559 1 39 SER H 1 43 LEU MD1 . . 5.840 4.646 4.440 4.885 . 0 0 "[ . 1 . 2]" 1
560 1 39 SER HA 1 40 ASP H . . 2.800 2.560 2.379 2.761 . 0 0 "[ . 1 . 2]" 1
561 1 39 SER HA 1 41 LYS H . . 5.060 4.780 4.234 5.072 0.012 4 0 "[ . 1 . 2]" 1
562 1 39 SER QB 1 40 ASP H . . 3.080 2.536 2.057 3.056 . 0 0 "[ . 1 . 2]" 1
563 1 39 SER QB 1 41 LYS H . . 4.760 3.003 2.445 3.698 . 0 0 "[ . 1 . 2]" 1
564 1 39 SER HB2 1 40 ASP H . . 3.340 3.184 2.676 3.458 0.118 4 0 "[ . 1 . 2]" 1
565 1 39 SER HB3 1 40 ASP H . . 3.340 2.716 2.097 3.404 0.064 4 0 "[ . 1 . 2]" 1
566 1 40 ASP H 1 40 ASP HB2 . . 3.660 2.530 2.091 2.877 . 0 0 "[ . 1 . 2]" 1
567 1 40 ASP H 1 40 ASP QB . . 3.200 2.292 2.057 2.749 . 0 0 "[ . 1 . 2]" 1
568 1 40 ASP H 1 40 ASP HB3 . . 3.660 2.831 2.146 3.550 . 0 0 "[ . 1 . 2]" 1
569 1 40 ASP H 1 41 LYS H . . 3.260 2.946 2.660 3.184 . 0 0 "[ . 1 . 2]" 1
570 1 40 ASP HA 1 43 LEU H . . 3.480 3.462 3.172 3.593 0.113 8 0 "[ . 1 . 2]" 1
571 1 40 ASP HA 1 43 LEU HB2 . . 3.300 2.664 2.013 3.160 . 0 0 "[ . 1 . 2]" 1
572 1 40 ASP HA 1 43 LEU HB3 . . 4.880 4.109 3.490 4.578 . 0 0 "[ . 1 . 2]" 1
573 1 40 ASP HA 1 43 LEU MD1 . . 3.820 2.463 1.771 3.147 . 0 0 "[ . 1 . 2]" 1
574 1 40 ASP QB 1 41 LYS H . . 3.380 2.247 2.010 2.604 . 0 0 "[ . 1 . 2]" 1
575 1 40 ASP HB2 1 41 LYS H . . 3.800 3.249 2.023 3.863 0.063 11 0 "[ . 1 . 2]" 1
576 1 40 ASP HB3 1 41 LYS H . . 3.800 2.637 2.035 3.809 0.009 5 0 "[ . 1 . 2]" 1
577 1 41 LYS H 1 41 LYS HB2 . . 2.900 2.411 2.253 2.642 . 0 0 "[ . 1 . 2]" 1
578 1 41 LYS H 1 41 LYS HB3 . . 2.900 2.528 2.297 2.738 . 0 0 "[ . 1 . 2]" 1
579 1 41 LYS H 1 41 LYS HG2 . . 5.030 4.466 4.288 4.629 . 0 0 "[ . 1 . 2]" 1
580 1 41 LYS H 1 41 LYS HG3 . . 5.030 4.357 4.278 4.474 . 0 0 "[ . 1 . 2]" 1
581 1 41 LYS H 1 42 GLU H . . 3.190 2.782 2.568 3.113 . 0 0 "[ . 1 . 2]" 1
582 1 41 LYS H 1 43 LEU H . . 4.630 4.115 3.823 4.538 . 0 0 "[ . 1 . 2]" 1
583 1 41 LYS HA 1 41 LYS HG2 . . 3.700 3.265 2.440 3.709 0.009 17 0 "[ . 1 . 2]" 1
584 1 41 LYS HA 1 41 LYS QG . . 3.500 2.376 2.205 2.539 . 0 0 "[ . 1 . 2]" 1
585 1 41 LYS HA 1 41 LYS HG3 . . 3.700 2.483 2.234 2.997 . 0 0 "[ . 1 . 2]" 1
586 1 41 LYS HA 1 44 SER H . . 3.700 3.594 3.234 3.780 0.080 11 0 "[ . 1 . 2]" 1
587 1 41 LYS HA 1 44 SER QB . . 5.800 3.117 2.604 4.124 . 0 0 "[ . 1 . 2]" 1
588 1 41 LYS QB 1 42 GLU H . . 4.330 2.636 2.165 3.175 . 0 0 "[ . 1 . 2]" 1
589 1 41 LYS HB2 1 42 GLU H . . 4.960 3.915 3.624 4.308 . 0 0 "[ . 1 . 2]" 1
590 1 41 LYS HB3 1 42 GLU H . . 4.960 2.683 2.181 3.269 . 0 0 "[ . 1 . 2]" 1
591 1 41 LYS QD 1 42 GLU H . . 6.880 4.837 3.726 5.445 . 0 0 "[ . 1 . 2]" 1
592 1 41 LYS QG 1 42 GLU H . . 5.760 3.727 3.045 4.185 . 0 0 "[ . 1 . 2]" 1
593 1 41 LYS HG2 1 42 GLU H . . 6.000 4.024 3.116 4.856 . 0 0 "[ . 1 . 2]" 1
594 1 41 LYS HG3 1 42 GLU H . . 6.000 4.554 3.947 5.160 . 0 0 "[ . 1 . 2]" 1
595 1 42 GLU H 1 42 GLU HB2 . . 4.160 2.257 2.017 2.662 . 0 0 "[ . 1 . 2]" 1
596 1 42 GLU H 1 42 GLU HB3 . . 4.160 3.389 3.076 3.553 . 0 0 "[ . 1 . 2]" 1
597 1 42 GLU H 1 42 GLU HG2 . . 5.600 3.484 1.935 4.593 . 0 0 "[ . 1 . 2]" 1
598 1 42 GLU H 1 42 GLU HG3 . . 5.600 3.329 2.095 4.334 . 0 0 "[ . 1 . 2]" 1
599 1 42 GLU H 1 43 LEU H . . 3.260 2.678 2.354 2.873 . 0 0 "[ . 1 . 2]" 1
600 1 42 GLU HA 1 45 GLU H . . 3.910 3.406 2.987 3.847 . 0 0 "[ . 1 . 2]" 1
601 1 42 GLU HA 1 45 GLU HB2 . . 4.960 3.711 2.737 5.058 0.098 19 0 "[ . 1 . 2]" 1
602 1 42 GLU HA 1 45 GLU QB . . 4.830 3.463 2.711 4.307 . 0 0 "[ . 1 . 2]" 1
603 1 42 GLU HA 1 45 GLU HB3 . . 4.960 4.723 4.227 5.013 0.053 14 0 "[ . 1 . 2]" 1
604 1 42 GLU HA 1 46 PHE H . . 5.060 4.234 3.566 4.641 . 0 0 "[ . 1 . 2]" 1
605 1 42 GLU HB2 1 43 LEU H . . 4.020 3.031 2.626 3.614 . 0 0 "[ . 1 . 2]" 1
606 1 42 GLU HB3 1 43 LEU H . . 4.020 3.430 2.643 4.092 0.072 10 0 "[ . 1 . 2]" 1
607 1 42 GLU QG 1 43 LEU H . . 4.930 4.285 3.864 4.654 . 0 0 "[ . 1 . 2]" 1
608 1 42 GLU HG2 1 43 LEU H . . 5.500 4.857 4.209 5.286 . 0 0 "[ . 1 . 2]" 1
609 1 42 GLU HG3 1 43 LEU H . . 5.500 4.806 4.210 5.411 . 0 0 "[ . 1 . 2]" 1
610 1 43 LEU H 1 43 LEU HB2 . . 3.010 2.384 2.181 2.750 . 0 0 "[ . 1 . 2]" 1
611 1 43 LEU H 1 43 LEU MD1 . . 4.760 3.647 3.059 4.080 . 0 0 "[ . 1 . 2]" 1
612 1 43 LEU H 1 43 LEU MD2 . . 5.120 3.072 2.027 3.928 . 0 0 "[ . 1 . 2]" 1
613 1 43 LEU H 1 43 LEU HG . . 2.720 2.513 2.086 2.770 0.050 8 0 "[ . 1 . 2]" 1
614 1 43 LEU H 1 44 SER H . . 3.190 2.793 2.438 3.014 . 0 0 "[ . 1 . 2]" 1
615 1 43 LEU HA 1 43 LEU MD1 . . 4.720 3.690 3.277 3.906 . 0 0 "[ . 1 . 2]" 1
616 1 43 LEU HA 1 43 LEU MD2 . . 3.900 2.084 1.853 2.579 . 0 0 "[ . 1 . 2]" 1
617 1 43 LEU HA 1 43 LEU HG . . 4.200 3.082 2.577 3.539 . 0 0 "[ . 1 . 2]" 1
618 1 43 LEU HA 1 46 PHE H . . 3.840 3.503 3.082 3.872 0.032 3 0 "[ . 1 . 2]" 1
619 1 43 LEU HA 1 46 PHE HB2 . . 3.770 2.472 2.122 2.928 . 0 0 "[ . 1 . 2]" 1
620 1 43 LEU HA 1 46 PHE QB . . 3.370 2.380 2.103 2.620 . 0 0 "[ . 1 . 2]" 1
621 1 43 LEU HA 1 46 PHE HB3 . . 3.770 3.267 2.553 3.755 . 0 0 "[ . 1 . 2]" 1
622 1 43 LEU HB2 1 44 SER H . . 3.520 2.791 2.380 3.324 . 0 0 "[ . 1 . 2]" 1
623 1 43 LEU HB3 1 44 SER H . . 4.810 3.650 3.102 4.096 . 0 0 "[ . 1 . 2]" 1
624 1 43 LEU MD1 1 44 SER H . . 5.910 4.727 4.167 4.992 . 0 0 "[ . 1 . 2]" 1
625 1 43 LEU MD2 1 44 SER H . . 7.030 4.603 4.257 5.028 . 0 0 "[ . 1 . 2]" 1
626 1 43 LEU MD2 1 46 PHE QB . . 7.040 3.241 2.960 3.465 . 0 0 "[ . 1 . 2]" 1
627 1 43 LEU MD2 1 46 PHE QE . . 7.060 4.871 3.655 5.354 . 0 0 "[ . 1 . 2]" 1
628 1 43 LEU HG 1 44 SER H . . 5.390 4.586 4.021 4.878 . 0 0 "[ . 1 . 2]" 1
629 1 44 SER H 1 44 SER QB . . 3.920 2.147 1.998 2.570 . 0 0 "[ . 1 . 2]" 1
630 1 44 SER H 1 45 GLU H . . 3.190 2.925 2.675 3.138 . 0 0 "[ . 1 . 2]" 1
631 1 44 SER H 1 45 GLU QB . . 6.450 4.977 4.580 5.415 . 0 0 "[ . 1 . 2]" 1
632 1 44 SER H 1 45 GLU QG . . 6.880 4.330 3.450 5.048 . 0 0 "[ . 1 . 2]" 1
633 1 44 SER HA 1 47 SER H . . 4.240 3.772 3.448 4.115 . 0 0 "[ . 1 . 2]" 1
634 1 44 SER HA 1 47 SER HB2 . . 4.450 3.864 3.068 4.234 . 0 0 "[ . 1 . 2]" 1
635 1 44 SER HA 1 47 SER QB . . 4.220 3.175 2.570 3.824 . 0 0 "[ . 1 . 2]" 1
636 1 44 SER HA 1 47 SER HB3 . . 4.450 3.522 2.619 4.512 0.062 17 0 "[ . 1 . 2]" 1
637 1 45 GLU H 1 45 GLU HB2 . . 3.620 2.776 2.271 3.551 . 0 0 "[ . 1 . 2]" 1
638 1 45 GLU H 1 45 GLU QB . . 3.370 2.501 2.244 2.709 . 0 0 "[ . 1 . 2]" 1
639 1 45 GLU H 1 45 GLU HB3 . . 3.620 3.323 2.563 3.562 . 0 0 "[ . 1 . 2]" 1
640 1 45 GLU H 1 45 GLU HG2 . . 3.590 2.532 1.891 3.720 0.130 14 0 "[ . 1 . 2]" 1
641 1 45 GLU H 1 45 GLU QG . . 3.110 2.112 1.845 2.468 . 0 0 "[ . 1 . 2]" 1
642 1 45 GLU H 1 45 GLU HG3 . . 3.590 3.029 1.875 3.648 0.058 18 0 "[ . 1 . 2]" 1
643 1 45 GLU H 1 46 PHE H . . 3.300 2.864 2.622 3.052 . 0 0 "[ . 1 . 2]" 1
644 1 45 GLU HA 1 48 GLU H . . 4.810 3.333 3.100 4.038 . 0 0 "[ . 1 . 2]" 1
645 1 45 GLU HA 1 48 GLU HB2 . . 4.600 2.509 2.135 3.421 . 0 0 "[ . 1 . 2]" 1
646 1 45 GLU HA 1 48 GLU QB . . 4.370 2.410 2.107 2.959 . 0 0 "[ . 1 . 2]" 1
647 1 45 GLU HA 1 48 GLU HB3 . . 4.600 3.467 2.686 4.315 . 0 0 "[ . 1 . 2]" 1
648 1 45 GLU HA 1 72 LEU MD2 . . 4.440 3.504 2.713 3.815 . 0 0 "[ . 1 . 2]" 1
649 1 45 GLU QB 1 46 PHE H . . 4.040 2.575 2.201 3.376 . 0 0 "[ . 1 . 2]" 1
650 1 45 GLU QB 1 79 ILE MD . . 5.420 3.716 3.517 3.923 . 0 0 "[ . 1 . 2]" 1
651 1 45 GLU HB2 1 46 PHE H . . 4.560 2.657 2.229 3.608 . 0 0 "[ . 1 . 2]" 1
652 1 45 GLU HB3 1 46 PHE H . . 4.560 3.602 3.095 4.117 . 0 0 "[ . 1 . 2]" 1
653 1 45 GLU QG 1 46 PHE H . . 5.870 3.457 1.860 4.240 . 0 0 "[ . 1 . 2]" 1
654 1 45 GLU QG 1 79 ILE MD . . 7.220 5.034 3.784 5.406 . 0 0 "[ . 1 . 2]" 1
655 1 45 GLU HG2 1 46 PHE H . . 6.000 4.011 1.935 5.068 . 0 0 "[ . 1 . 2]" 1
656 1 45 GLU HG3 1 46 PHE H . . 6.000 4.068 1.897 4.943 . 0 0 "[ . 1 . 2]" 1
657 1 46 PHE H 1 46 PHE HB2 . . 3.160 1.938 1.890 2.082 . 0 0 "[ . 1 . 2]" 1
658 1 46 PHE H 1 46 PHE QB . . 2.980 1.918 1.874 2.009 . 0 0 "[ . 1 . 2]" 1
659 1 46 PHE H 1 46 PHE HB3 . . 3.160 3.144 2.649 3.282 0.122 4 0 "[ . 1 . 2]" 1
660 1 46 PHE H 1 47 SER H . . 3.620 2.976 2.733 3.154 . 0 0 "[ . 1 . 2]" 1
661 1 46 PHE HA 1 49 ILE H . . 4.060 3.351 3.032 3.731 . 0 0 "[ . 1 . 2]" 1
662 1 46 PHE HA 1 49 ILE HB . . 3.080 3.022 2.596 3.137 0.057 20 0 "[ . 1 . 2]" 1
663 1 46 PHE HA 1 49 ILE MD . . 5.260 4.039 3.716 4.222 . 0 0 "[ . 1 . 2]" 1
664 1 46 PHE QB 1 47 SER H . . 3.470 2.373 2.059 2.624 . 0 0 "[ . 1 . 2]" 1
665 1 46 PHE QB 1 49 ILE HB . . 6.840 5.124 4.795 5.225 . 0 0 "[ . 1 . 2]" 1
666 1 46 PHE QB 1 50 LEU MD2 . . 6.900 4.536 3.678 5.127 . 0 0 "[ . 1 . 2]" 1
667 1 46 PHE HB2 1 47 SER H . . 3.800 2.988 2.691 3.528 . 0 0 "[ . 1 . 2]" 1
668 1 46 PHE HB3 1 47 SER H . . 3.800 2.531 2.077 2.931 . 0 0 "[ . 1 . 2]" 1
669 1 46 PHE QD 1 49 ILE HA . . 8.120 6.918 5.637 7.511 . 0 0 "[ . 1 . 2]" 1
670 1 46 PHE QD 1 49 ILE MG . . 9.150 3.774 2.230 4.615 . 0 0 "[ . 1 . 2]" 1
671 1 46 PHE QD 1 79 ILE MD . . 7.390 3.324 2.651 4.194 . 0 0 "[ . 1 . 2]" 1
672 1 47 SER H 1 47 SER HB2 . . 3.230 2.524 2.017 3.302 0.072 17 0 "[ . 1 . 2]" 1
673 1 47 SER H 1 47 SER QB . . 3.050 2.302 1.998 2.901 . 0 0 "[ . 1 . 2]" 1
674 1 47 SER H 1 47 SER HB3 . . 3.230 2.772 2.383 3.287 0.057 15 0 "[ . 1 . 2]" 1
675 1 47 SER H 1 48 GLU H . . 3.260 2.683 2.523 3.128 . 0 0 "[ . 1 . 2]" 1
676 1 47 SER HA 1 47 SER HB2 . . 3.050 2.626 2.389 2.913 . 0 0 "[ . 1 . 2]" 1
677 1 47 SER HA 1 47 SER HB3 . . 3.050 2.874 2.255 3.051 0.001 16 0 "[ . 1 . 2]" 1
678 1 47 SER HA 1 50 LEU H . . 4.700 3.598 3.170 3.975 . 0 0 "[ . 1 . 2]" 1
679 1 47 SER HA 1 50 LEU HB2 . . 4.130 2.442 1.981 2.749 . 0 0 "[ . 1 . 2]" 1
680 1 47 SER HA 1 50 LEU HB3 . . 4.240 3.993 3.506 4.263 0.023 15 0 "[ . 1 . 2]" 1
681 1 47 SER HA 1 50 LEU MD1 . . 4.220 2.664 1.971 3.177 . 0 0 "[ . 1 . 2]" 1
682 1 47 SER QB 1 48 GLU H . . 3.960 2.951 2.236 3.141 . 0 0 "[ . 1 . 2]" 1
683 1 47 SER HB2 1 48 GLU H . . 4.160 3.792 3.019 4.155 . 0 0 "[ . 1 . 2]" 1
684 1 47 SER HB3 1 48 GLU H . . 4.160 3.275 2.254 4.309 0.149 15 0 "[ . 1 . 2]" 1
685 1 48 GLU H 1 48 GLU QB . . 3.550 2.120 2.025 2.389 . 0 0 "[ . 1 . 2]" 1
686 1 48 GLU H 1 49 ILE H . . 3.190 2.542 2.359 3.067 . 0 0 "[ . 1 . 2]" 1
687 1 48 GLU H 1 72 LEU MD2 . . 6.450 4.069 3.605 4.569 . 0 0 "[ . 1 . 2]" 1
688 1 48 GLU HA 1 50 LEU H . . 5.140 4.667 4.023 5.015 . 0 0 "[ . 1 . 2]" 1
689 1 48 GLU HA 1 51 GLU H . . 4.340 3.622 3.153 3.807 . 0 0 "[ . 1 . 2]" 1
690 1 48 GLU HA 1 51 GLU HB2 . . 4.880 3.703 3.006 4.023 . 0 0 "[ . 1 . 2]" 1
691 1 48 GLU HA 1 51 GLU HB3 . . 4.850 4.740 4.350 4.945 0.095 7 0 "[ . 1 . 2]" 1
692 1 48 GLU HA 1 51 GLU HG2 . . 3.800 3.148 2.571 3.746 . 0 0 "[ . 1 . 2]" 1
693 1 48 GLU HA 1 51 GLU HG3 . . 4.490 2.081 1.972 2.368 . 0 0 "[ . 1 . 2]" 1
694 1 48 GLU QB 1 49 ILE H . . 4.090 2.637 2.109 2.850 . 0 0 "[ . 1 . 2]" 1
695 1 48 GLU QB 1 72 LEU MD1 . . 6.540 3.429 2.765 4.074 . 0 0 "[ . 1 . 2]" 1
696 1 48 GLU QB 1 72 LEU MD2 . . 5.280 1.927 1.612 2.429 . 0 0 "[ . 1 . 2]" 1
697 1 48 GLU HB2 1 49 ILE H . . 4.700 3.126 2.644 3.621 . 0 0 "[ . 1 . 2]" 1
698 1 48 GLU HB3 1 49 ILE H . . 4.700 2.991 2.147 3.674 . 0 0 "[ . 1 . 2]" 1
699 1 48 GLU QG 1 49 ILE H . . 6.880 4.335 3.924 4.624 . 0 0 "[ . 1 . 2]" 1
700 1 49 ILE H 1 49 ILE HB . . 3.010 2.022 1.987 2.035 . 0 0 "[ . 1 . 2]" 1
701 1 49 ILE H 1 49 ILE MD . . 5.700 3.944 3.673 4.204 . 0 0 "[ . 1 . 2]" 1
702 1 49 ILE H 1 49 ILE HG12 . . 4.520 4.352 4.211 4.478 . 0 0 "[ . 1 . 2]" 1
703 1 49 ILE H 1 49 ILE QG . . 3.740 3.390 3.215 3.499 . 0 0 "[ . 1 . 2]" 1
704 1 49 ILE H 1 49 ILE HG13 . . 4.520 3.537 3.323 3.653 . 0 0 "[ . 1 . 2]" 1
705 1 49 ILE H 1 49 ILE MG . . 4.800 3.153 3.090 3.284 . 0 0 "[ . 1 . 2]" 1
706 1 49 ILE H 1 50 LEU H . . 3.260 2.552 2.441 2.894 . 0 0 "[ . 1 . 2]" 1
707 1 49 ILE H 1 72 LEU MD2 . . 5.190 2.801 1.997 3.336 . 0 0 "[ . 1 . 2]" 1
708 1 49 ILE HA 1 49 ILE MD . . 4.580 3.669 3.636 3.690 . 0 0 "[ . 1 . 2]" 1
709 1 49 ILE HA 1 49 ILE HG12 . . 3.620 2.455 2.177 2.672 . 0 0 "[ . 1 . 2]" 1
710 1 49 ILE HA 1 49 ILE QG . . 3.410 2.111 2.069 2.141 . 0 0 "[ . 1 . 2]" 1
711 1 49 ILE HA 1 49 ILE HG13 . . 3.620 2.356 2.154 2.650 . 0 0 "[ . 1 . 2]" 1
712 1 49 ILE HA 1 51 GLU H . . 5.030 3.856 3.561 4.506 . 0 0 "[ . 1 . 2]" 1
713 1 49 ILE HA 1 52 PHE QD . . 7.040 3.735 3.153 4.531 . 0 0 "[ . 1 . 2]" 1
714 1 49 ILE HA 1 52 PHE QE . . 8.120 5.379 4.749 6.346 . 0 0 "[ . 1 . 2]" 1
715 1 49 ILE HA 1 79 ILE MD . . 6.920 5.044 4.730 5.658 . 0 0 "[ . 1 . 2]" 1
716 1 49 ILE HB 1 50 LEU H . . 3.230 3.204 3.076 3.426 0.196 3 0 "[ . 1 . 2]" 1
717 1 49 ILE HB 1 72 LEU MD1 . . 5.770 4.536 4.093 4.762 . 0 0 "[ . 1 . 2]" 1
718 1 49 ILE HB 1 72 LEU MD2 . . 4.080 2.930 2.277 3.240 . 0 0 "[ . 1 . 2]" 1
719 1 49 ILE HB 1 75 MET QB . . 3.890 3.592 3.420 3.701 . 0 0 "[ . 1 . 2]" 1
720 1 49 ILE HB 1 79 ILE MD . . 6.490 3.077 2.780 3.608 . 0 0 "[ . 1 . 2]" 1
721 1 49 ILE MD 1 50 LEU H . . 6.240 4.798 4.622 5.016 . 0 0 "[ . 1 . 2]" 1
722 1 49 ILE MD 1 61 ILE MD . . 8.060 5.210 4.144 5.396 . 0 0 "[ . 1 . 2]" 1
723 1 49 ILE MD 1 75 MET HB2 . . 4.940 2.407 1.880 3.222 . 0 0 "[ . 1 . 2]" 1
724 1 49 ILE MD 1 75 MET QB . . 4.650 1.909 1.734 2.318 . 0 0 "[ . 1 . 2]" 1
725 1 49 ILE MD 1 75 MET HB3 . . 4.940 2.104 1.798 2.741 . 0 0 "[ . 1 . 2]" 1
726 1 49 ILE MD 1 75 MET QG . . 6.390 3.482 3.035 3.898 . 0 0 "[ . 1 . 2]" 1
727 1 49 ILE MD 1 76 LEU MD2 . . 6.150 2.136 1.848 2.646 . 0 0 "[ . 1 . 2]" 1
728 1 49 ILE MD 1 76 LEU HG . . 5.730 2.027 1.807 2.609 . 0 0 "[ . 1 . 2]" 1
729 1 49 ILE MD 1 79 ILE MD . . 6.400 1.722 1.637 1.936 . 0 0 "[ . 1 . 2]" 1
730 1 49 ILE MD 1 79 ILE QG . . 7.480 3.460 1.696 3.742 . 0 0 "[ . 1 . 2]" 1
731 1 49 ILE QG 1 50 LEU H . . 5.380 4.474 4.373 4.572 . 0 0 "[ . 1 . 2]" 1
732 1 49 ILE QG 1 72 LEU MD1 . . 5.600 2.658 2.289 2.992 . 0 0 "[ . 1 . 2]" 1
733 1 49 ILE QG 1 72 LEU MD2 . . 4.850 1.938 1.787 2.513 . 0 0 "[ . 1 . 2]" 1
734 1 49 ILE QG 1 76 LEU HG . . 5.010 2.806 2.192 3.200 . 0 0 "[ . 1 . 2]" 1
735 1 49 ILE QG 1 79 ILE MD . . 5.330 3.480 3.204 3.928 . 0 0 "[ . 1 . 2]" 1
736 1 49 ILE HG12 1 50 LEU H . . 6.000 5.000 4.864 5.139 . 0 0 "[ . 1 . 2]" 1
737 1 49 ILE HG12 1 72 LEU MD2 . . 5.370 3.273 2.703 4.058 . 0 0 "[ . 1 . 2]" 1
738 1 49 ILE HG12 1 79 ILE MD . . 5.770 3.864 3.400 4.352 . 0 0 "[ . 1 . 2]" 1
739 1 49 ILE HG13 1 50 LEU H . . 6.000 5.046 4.943 5.125 . 0 0 "[ . 1 . 2]" 1
740 1 49 ILE HG13 1 72 LEU MD2 . . 5.370 1.954 1.814 2.538 . 0 0 "[ . 1 . 2]" 1
741 1 49 ILE HG13 1 79 ILE MD . . 5.770 3.981 3.814 4.471 . 0 0 "[ . 1 . 2]" 1
742 1 49 ILE MG 1 50 LEU H . . 4.470 2.274 2.007 2.526 . 0 0 "[ . 1 . 2]" 1
743 1 49 ILE MG 1 50 LEU HA . . 5.340 2.876 2.795 2.964 . 0 0 "[ . 1 . 2]" 1
744 1 49 ILE MG 1 50 LEU MD1 . . 8.060 3.988 3.767 4.239 . 0 0 "[ . 1 . 2]" 1
745 1 49 ILE MG 1 50 LEU MD2 . . 8.060 2.877 2.475 3.205 . 0 0 "[ . 1 . 2]" 1
746 1 49 ILE MG 1 52 PHE H . . 5.910 4.323 4.154 4.603 . 0 0 "[ . 1 . 2]" 1
747 1 49 ILE MG 1 79 ILE MD . . 6.260 2.035 1.767 2.672 . 0 0 "[ . 1 . 2]" 1
748 1 50 LEU H 1 50 LEU HB2 . . 3.010 2.366 2.265 2.560 . 0 0 "[ . 1 . 2]" 1
749 1 50 LEU H 1 50 LEU HB3 . . 3.410 3.520 3.498 3.540 0.130 8 0 "[ . 1 . 2]" 1
750 1 50 LEU H 1 50 LEU MD1 . . 4.510 3.504 3.034 3.779 . 0 0 "[ . 1 . 2]" 1
751 1 50 LEU H 1 50 LEU MD2 . . 4.150 3.490 3.426 3.626 . 0 0 "[ . 1 . 2]" 1
752 1 50 LEU H 1 50 LEU HG . . 2.620 2.328 1.999 2.540 . 0 0 "[ . 1 . 2]" 1
753 1 50 LEU H 1 51 GLU H . . 3.340 2.723 2.604 2.877 . 0 0 "[ . 1 . 2]" 1
754 1 50 LEU HA 1 50 LEU MD2 . . 3.680 2.127 1.949 2.567 . 0 0 "[ . 1 . 2]" 1
755 1 50 LEU HA 1 50 LEU HG . . 3.370 2.916 2.794 3.073 . 0 0 "[ . 1 . 2]" 1
756 1 50 LEU HB2 1 50 LEU HG . . 3.010 2.513 2.417 2.656 . 0 0 "[ . 1 . 2]" 1
757 1 50 LEU HB2 1 51 GLU H . . 4.130 3.049 2.681 3.364 . 0 0 "[ . 1 . 2]" 1
758 1 50 LEU HB3 1 50 LEU HG . . 2.900 3.025 2.996 3.032 0.132 17 0 "[ . 1 . 2]" 1
759 1 50 LEU HB3 1 51 GLU H . . 5.320 3.885 3.548 4.208 . 0 0 "[ . 1 . 2]" 1
760 1 50 LEU MD1 1 51 GLU H . . 7.030 4.816 4.510 5.038 . 0 0 "[ . 1 . 2]" 1
761 1 50 LEU MD2 1 51 GLU H . . 6.130 4.843 4.671 5.056 . 0 0 "[ . 1 . 2]" 1
762 1 50 LEU MD2 1 57 LEU MD1 . . 8.060 3.829 2.729 4.221 . 0 0 "[ . 1 . 2]" 1
763 1 50 LEU MD2 1 57 LEU MD2 . . 7.300 3.309 2.598 3.674 . 0 0 "[ . 1 . 2]" 1
764 1 50 LEU HG 1 51 GLU H . . 5.350 4.640 4.389 4.795 . 0 0 "[ . 1 . 2]" 1
765 1 50 LEU HG 1 52 PHE H . . 6.000 6.055 5.955 6.114 0.114 6 0 "[ . 1 . 2]" 1
766 1 51 GLU H 1 51 GLU HB2 . . 2.900 2.445 2.315 2.590 . 0 0 "[ . 1 . 2]" 1
767 1 51 GLU H 1 51 GLU HB3 . . 3.620 3.563 3.534 3.578 . 0 0 "[ . 1 . 2]" 1
768 1 51 GLU H 1 51 GLU HG2 . . 2.690 2.517 2.158 2.727 0.037 13 0 "[ . 1 . 2]" 1
769 1 51 GLU H 1 51 GLU HG3 . . 3.230 2.944 2.629 3.180 . 0 0 "[ . 1 . 2]" 1
770 1 51 GLU H 1 52 PHE H . . 3.010 2.973 2.939 3.019 0.009 8 0 "[ . 1 . 2]" 1
771 1 51 GLU HA 1 51 GLU HG2 . . 4.200 2.256 2.160 2.413 . 0 0 "[ . 1 . 2]" 1
772 1 51 GLU HA 1 51 GLU HG3 . . 3.370 3.538 3.410 3.654 0.284 9 0 "[ . 1 . 2]" 1
773 1 51 GLU HB2 1 51 GLU HG3 . . 2.440 2.269 2.264 2.282 . 0 0 "[ . 1 . 2]" 1
774 1 51 GLU HB2 1 52 PHE H . . 4.630 2.911 2.783 3.014 . 0 0 "[ . 1 . 2]" 1
775 1 51 GLU HB3 1 51 GLU HG3 . . 2.760 2.843 2.784 2.946 0.186 10 0 "[ . 1 . 2]" 1
776 1 51 GLU HB3 1 52 PHE H . . 4.130 3.683 3.510 3.845 . 0 0 "[ . 1 . 2]" 1
777 1 51 GLU HG2 1 52 PHE H . . 6.000 4.757 4.583 4.849 . 0 0 "[ . 1 . 2]" 1
778 1 51 GLU HG3 1 52 PHE H . . 4.700 4.916 4.702 5.104 0.404 13 0 "[ . 1 . 2]" 1
779 1 52 PHE H 1 52 PHE HB2 . . 3.190 1.958 1.906 2.027 . 0 0 "[ . 1 . 2]" 1
780 1 52 PHE H 1 52 PHE QB . . 2.980 1.944 1.892 2.012 . 0 0 "[ . 1 . 2]" 1
781 1 52 PHE H 1 52 PHE HB3 . . 3.190 3.279 3.221 3.364 0.174 19 0 "[ . 1 . 2]" 1
782 1 52 PHE H 1 53 GLN H . . 4.810 4.638 4.622 4.661 . 0 0 "[ . 1 . 2]" 1
783 1 52 PHE HA 1 53 GLN H . . 3.010 2.347 2.300 2.394 . 0 0 "[ . 1 . 2]" 1
784 1 52 PHE HA 1 57 LEU H . . 5.680 5.376 4.784 5.714 0.034 18 0 "[ . 1 . 2]" 1
785 1 52 PHE QB 1 53 GLN H . . 3.890 2.957 2.890 3.103 . 0 0 "[ . 1 . 2]" 1
786 1 52 PHE QB 1 57 LEU H . . 5.350 3.178 2.659 3.598 . 0 0 "[ . 1 . 2]" 1
787 1 52 PHE QB 1 57 LEU HB2 . . 4.240 2.873 2.473 3.321 . 0 0 "[ . 1 . 2]" 1
788 1 52 PHE QB 1 57 LEU MD1 . . 5.800 3.204 2.475 3.472 . 0 0 "[ . 1 . 2]" 1
789 1 52 PHE QB 1 57 LEU MD2 . . 6.190 4.426 4.165 4.587 . 0 0 "[ . 1 . 2]" 1
790 1 52 PHE HB2 1 53 GLN H . . 4.160 4.235 4.194 4.330 0.170 8 0 "[ . 1 . 2]" 1
791 1 52 PHE HB2 1 57 LEU H . . 6.000 4.814 4.129 5.346 . 0 0 "[ . 1 . 2]" 1
792 1 52 PHE HB2 1 57 LEU HB2 . . 4.380 3.800 2.947 4.143 . 0 0 "[ . 1 . 2]" 1
793 1 52 PHE HB2 1 57 LEU MD1 . . 6.020 3.565 2.560 3.860 . 0 0 "[ . 1 . 2]" 1
794 1 52 PHE HB2 1 57 LEU MD2 . . 6.880 5.103 4.631 5.382 . 0 0 "[ . 1 . 2]" 1
795 1 52 PHE HB3 1 53 GLN H . . 4.160 3.018 2.945 3.179 . 0 0 "[ . 1 . 2]" 1
796 1 52 PHE HB3 1 57 LEU H . . 6.000 3.225 2.692 3.657 . 0 0 "[ . 1 . 2]" 1
797 1 52 PHE HB3 1 57 LEU HB2 . . 4.380 2.981 2.656 3.533 . 0 0 "[ . 1 . 2]" 1
798 1 52 PHE HB3 1 57 LEU MD1 . . 6.020 3.655 3.282 4.038 . 0 0 "[ . 1 . 2]" 1
799 1 52 PHE HB3 1 57 LEU MD2 . . 6.880 4.860 4.534 5.112 . 0 0 "[ . 1 . 2]" 1
800 1 52 PHE QD 1 60 LEU MD1 . . 9.150 2.532 1.943 3.000 . 0 0 "[ . 1 . 2]" 1
801 1 52 PHE QD 1 60 LEU MD2 . . 9.150 4.412 3.962 4.796 . 0 0 "[ . 1 . 2]" 1
802 1 52 PHE QD 1 66 GLU QB . . 9.000 7.302 7.061 7.397 . 0 0 "[ . 1 . 2]" 1
803 1 52 PHE QE 1 60 LEU MD1 . . 9.080 2.669 2.180 3.236 . 0 0 "[ . 1 . 2]" 1
804 1 52 PHE QE 1 60 LEU MD2 . . 9.150 3.765 3.100 4.324 . 0 0 "[ . 1 . 2]" 1
805 1 52 PHE QE 1 67 THR MG . . 9.150 4.856 3.744 5.608 . 0 0 "[ . 1 . 2]" 1
806 1 52 PHE QE 1 76 LEU MD1 . . 8.830 5.194 3.782 6.116 . 0 0 "[ . 1 . 2]" 1
807 1 53 GLN H 1 53 GLN HB2 . . 3.800 2.831 2.640 3.573 . 0 0 "[ . 1 . 2]" 1
808 1 53 GLN H 1 53 GLN QB . . 3.480 2.668 2.576 2.740 . 0 0 "[ . 1 . 2]" 1
809 1 53 GLN H 1 53 GLN HB3 . . 3.800 3.491 2.762 3.604 . 0 0 "[ . 1 . 2]" 1
810 1 53 GLN H 1 53 GLN HG2 . . 3.910 2.418 1.919 3.651 . 0 0 "[ . 1 . 2]" 1
811 1 53 GLN H 1 53 GLN HG3 . . 3.910 2.438 2.016 3.451 . 0 0 "[ . 1 . 2]" 1
812 1 53 GLN H 1 54 ASP H . . 4.700 4.582 4.515 4.638 . 0 0 "[ . 1 . 2]" 1
813 1 53 GLN H 1 56 GLU H . . 5.100 3.878 3.505 4.184 . 0 0 "[ . 1 . 2]" 1
814 1 53 GLN H 1 56 GLU QB . . 6.520 2.499 2.059 3.132 . 0 0 "[ . 1 . 2]" 1
815 1 53 GLN HA 1 53 GLN HG2 . . 4.130 2.897 2.604 3.548 . 0 0 "[ . 1 . 2]" 1
816 1 53 GLN HA 1 53 GLN QG . . 3.890 2.685 2.528 3.362 . 0 0 "[ . 1 . 2]" 1
817 1 53 GLN HA 1 53 GLN HG3 . . 4.130 3.581 2.625 4.167 0.037 5 0 "[ . 1 . 2]" 1
818 1 53 GLN HA 1 54 ASP H . . 2.580 2.598 2.459 2.706 0.126 5 0 "[ . 1 . 2]" 1
819 1 53 GLN QB 1 54 ASP H . . 3.370 2.344 2.037 2.601 . 0 0 "[ . 1 . 2]" 1
820 1 53 GLN QB 1 55 GLN H . . 4.970 3.049 2.753 3.390 . 0 0 "[ . 1 . 2]" 1
821 1 53 GLN QB 1 56 GLU H . . 4.740 2.761 2.363 3.857 . 0 0 "[ . 1 . 2]" 1
822 1 53 GLN HB2 1 53 GLN HG2 . . 2.940 2.928 2.836 2.979 0.039 16 0 "[ . 1 . 2]" 1
823 1 53 GLN HB2 1 53 GLN HG3 . . 2.940 2.409 2.265 2.932 . 0 0 "[ . 1 . 2]" 1
824 1 53 GLN HB2 1 54 ASP H . . 3.550 3.030 2.050 3.398 . 0 0 "[ . 1 . 2]" 1
825 1 53 GLN HB2 1 56 GLU H . . 5.170 2.803 2.382 4.078 . 0 0 "[ . 1 . 2]" 1
826 1 53 GLN HB3 1 53 GLN HG2 . . 2.940 2.707 2.264 2.919 . 0 0 "[ . 1 . 2]" 1
827 1 53 GLN HB3 1 53 GLN HG3 . . 2.940 2.928 2.836 2.979 0.039 16 0 "[ . 1 . 2]" 1
828 1 53 GLN HB3 1 54 ASP H . . 3.550 2.566 2.300 3.567 0.017 8 0 "[ . 1 . 2]" 1
829 1 53 GLN HB3 1 56 GLU H . . 5.170 4.313 3.964 4.758 . 0 0 "[ . 1 . 2]" 1
830 1 53 GLN HG2 1 54 ASP H . . 5.750 4.582 3.908 4.756 . 0 0 "[ . 1 . 2]" 1
831 1 53 GLN HG3 1 54 ASP H . . 5.750 4.828 3.690 5.208 . 0 0 "[ . 1 . 2]" 1
832 1 54 ASP H 1 54 ASP HB2 . . 3.410 2.486 2.021 3.121 . 0 0 "[ . 1 . 2]" 1
833 1 54 ASP H 1 54 ASP QB . . 3.080 2.423 2.004 2.875 . 0 0 "[ . 1 . 2]" 1
834 1 54 ASP H 1 54 ASP HB3 . . 3.410 3.486 3.293 3.552 0.142 10 0 "[ . 1 . 2]" 1
835 1 54 ASP H 1 55 GLN H . . 3.340 2.863 2.585 3.035 . 0 0 "[ . 1 . 2]" 1
836 1 54 ASP HA 1 57 LEU H . . 3.980 3.510 3.255 3.742 . 0 0 "[ . 1 . 2]" 1
837 1 54 ASP HA 1 57 LEU HB2 . . 4.420 3.390 2.888 4.064 . 0 0 "[ . 1 . 2]" 1
838 1 54 ASP HA 1 57 LEU HB3 . . 4.310 2.312 2.038 2.683 . 0 0 "[ . 1 . 2]" 1
839 1 54 ASP HA 1 58 LEU H . . 5.170 3.617 3.440 3.981 . 0 0 "[ . 1 . 2]" 1
840 1 54 ASP QB 1 55 GLN H . . 3.290 2.215 1.966 2.539 . 0 0 "[ . 1 . 2]" 1
841 1 54 ASP HB2 1 55 GLN H . . 3.730 2.292 1.978 2.752 . 0 0 "[ . 1 . 2]" 1
842 1 54 ASP HB3 1 55 GLN H . . 3.730 3.253 2.492 3.690 . 0 0 "[ . 1 . 2]" 1
843 1 55 GLN H 1 55 GLN HB2 . . 3.010 2.095 2.079 2.141 . 0 0 "[ . 1 . 2]" 1
844 1 55 GLN H 1 55 GLN HB3 . . 3.010 2.985 2.921 3.047 0.037 17 0 "[ . 1 . 2]" 1
845 1 55 GLN H 1 55 GLN QG . . 4.360 3.685 3.637 3.776 . 0 0 "[ . 1 . 2]" 1
846 1 55 GLN H 1 56 GLU H . . 3.050 3.042 2.800 3.134 0.084 2 0 "[ . 1 . 2]" 1
847 1 55 GLN H 1 57 LEU H . . 4.560 4.235 4.041 4.463 . 0 0 "[ . 1 . 2]" 1
848 1 55 GLN HA 1 56 GLU H . . 3.590 3.641 3.632 3.645 0.055 15 0 "[ . 1 . 2]" 1
849 1 55 GLN HA 1 58 LEU H . . 4.020 3.869 3.565 4.044 0.024 19 0 "[ . 1 . 2]" 1
850 1 55 GLN HA 1 58 LEU HB2 . . 3.840 3.494 3.123 3.715 . 0 0 "[ . 1 . 2]" 1
851 1 55 GLN HA 1 58 LEU HB3 . . 3.840 3.589 3.123 3.859 0.019 4 0 "[ . 1 . 2]" 1
852 1 55 GLN QB 1 56 GLU H . . 3.130 2.288 2.185 2.461 . 0 0 "[ . 1 . 2]" 1
853 1 55 GLN HB2 1 56 GLU H . . 3.340 3.390 3.350 3.448 0.108 2 0 "[ . 1 . 2]" 1
854 1 55 GLN HB3 1 56 GLU H . . 3.340 2.327 2.209 2.528 . 0 0 "[ . 1 . 2]" 1
855 1 55 GLN QG 1 56 GLU H . . 6.300 4.145 3.906 4.329 . 0 0 "[ . 1 . 2]" 1
856 1 56 GLU H 1 56 GLU HA . . 2.900 2.756 2.711 2.796 . 0 0 "[ . 1 . 2]" 1
857 1 56 GLU H 1 56 GLU QG . . 3.420 2.315 1.928 2.855 . 0 0 "[ . 1 . 2]" 1
858 1 56 GLU H 1 57 LEU H . . 2.870 2.758 2.599 2.898 0.028 6 0 "[ . 1 . 2]" 1
859 1 56 GLU H 1 58 LEU H . . 4.810 4.569 4.408 4.636 . 0 0 "[ . 1 . 2]" 1
860 1 56 GLU HA 1 56 GLU QG . . 3.820 2.472 2.116 2.874 . 0 0 "[ . 1 . 2]" 1
861 1 56 GLU HA 1 58 LEU H . . 4.920 4.847 4.679 4.951 0.031 6 0 "[ . 1 . 2]" 1
862 1 56 GLU HA 1 59 ALA H . . 4.270 3.696 3.525 3.919 . 0 0 "[ . 1 . 2]" 1
863 1 56 GLU HA 1 59 ALA MB . . 4.110 2.692 2.426 2.927 . 0 0 "[ . 1 . 2]" 1
864 1 56 GLU QG 1 57 LEU H . . 5.040 4.154 3.858 4.451 . 0 0 "[ . 1 . 2]" 1
865 1 57 LEU H 1 57 LEU HB2 . . 3.230 2.473 2.370 2.678 . 0 0 "[ . 1 . 2]" 1
866 1 57 LEU H 1 57 LEU HB3 . . 3.080 2.400 2.214 2.508 . 0 0 "[ . 1 . 2]" 1
867 1 57 LEU H 1 57 LEU MD1 . . 5.410 4.039 3.909 4.233 . 0 0 "[ . 1 . 2]" 1
868 1 57 LEU H 1 57 LEU MD2 . . 5.260 4.133 4.006 4.203 . 0 0 "[ . 1 . 2]" 1
869 1 57 LEU H 1 57 LEU HG . . 5.280 4.388 4.254 4.449 . 0 0 "[ . 1 . 2]" 1
870 1 57 LEU H 1 58 LEU H . . 3.160 2.970 2.883 3.109 . 0 0 "[ . 1 . 2]" 1
871 1 57 LEU HA 1 57 LEU MD1 . . 3.860 2.211 1.980 2.591 . 0 0 "[ . 1 . 2]" 1
872 1 57 LEU HA 1 57 LEU HG . . 3.080 3.112 2.861 3.194 0.114 7 0 "[ . 1 . 2]" 1
873 1 57 LEU HA 1 60 LEU H . . 4.240 3.482 3.362 3.569 . 0 0 "[ . 1 . 2]" 1
874 1 57 LEU HA 1 60 LEU HA . . 5.170 5.187 5.128 5.239 0.069 16 0 "[ . 1 . 2]" 1
875 1 57 LEU HA 1 60 LEU HB2 . . 3.840 2.289 2.214 2.368 . 0 0 "[ . 1 . 2]" 1
876 1 57 LEU HA 1 60 LEU QB . . 3.650 2.264 2.192 2.341 . 0 0 "[ . 1 . 2]" 1
877 1 57 LEU HA 1 60 LEU HB3 . . 3.840 3.592 3.493 3.687 . 0 0 "[ . 1 . 2]" 1
878 1 57 LEU HA 1 60 LEU MD1 . . 4.360 2.444 2.112 2.771 . 0 0 "[ . 1 . 2]" 1
879 1 57 LEU HA 1 60 LEU MD2 . . 5.840 4.703 4.420 4.855 . 0 0 "[ . 1 . 2]" 1
880 1 57 LEU HB2 1 57 LEU HG . . 2.940 3.025 2.993 3.031 0.091 18 0 "[ . 1 . 2]" 1
881 1 57 LEU HB2 1 58 LEU H . . 4.130 3.814 3.728 3.917 . 0 0 "[ . 1 . 2]" 1
882 1 57 LEU HB3 1 57 LEU HG . . 2.940 2.539 2.483 2.662 . 0 0 "[ . 1 . 2]" 1
883 1 57 LEU HB3 1 58 LEU H . . 3.700 2.374 2.294 2.513 . 0 0 "[ . 1 . 2]" 1
884 1 57 LEU MD1 1 58 LEU H . . 6.600 4.392 4.275 4.668 . 0 0 "[ . 1 . 2]" 1
885 1 57 LEU MD1 1 61 ILE MD . . 6.620 2.686 2.063 3.433 . 0 0 "[ . 1 . 2]" 1
886 1 57 LEU MD2 1 58 LEU H . . 7.030 3.792 3.537 3.958 . 0 0 "[ . 1 . 2]" 1
887 1 57 LEU MD2 1 58 LEU HA . . 6.990 4.468 4.047 4.721 . 0 0 "[ . 1 . 2]" 1
888 1 57 LEU MD2 1 61 ILE MD . . 7.770 3.429 2.719 4.315 . 0 0 "[ . 1 . 2]" 1
889 1 57 LEU HG 1 58 LEU H . . 4.920 3.342 3.013 3.679 . 0 0 "[ . 1 . 2]" 1
890 1 57 LEU HG 1 61 ILE MD . . 5.520 2.731 1.956 3.794 . 0 0 "[ . 1 . 2]" 1
891 1 58 LEU H 1 58 LEU HB2 . . 2.940 2.040 2.015 2.058 . 0 0 "[ . 1 . 2]" 1
892 1 58 LEU H 1 58 LEU HB3 . . 2.940 2.955 2.932 2.999 0.059 11 0 "[ . 1 . 2]" 1
893 1 58 LEU H 1 58 LEU MD1 . . 4.220 3.355 3.245 3.447 . 0 0 "[ . 1 . 2]" 1
894 1 58 LEU H 1 58 LEU MD2 . . 5.700 4.202 4.147 4.273 . 0 0 "[ . 1 . 2]" 1
895 1 58 LEU H 1 58 LEU HG . . 4.340 4.427 4.383 4.491 0.151 20 0 "[ . 1 . 2]" 1
896 1 58 LEU H 1 59 ALA H . . 3.120 3.036 2.966 3.085 . 0 0 "[ . 1 . 2]" 1
897 1 58 LEU H 1 59 ALA MB . . 5.950 4.448 4.364 4.513 . 0 0 "[ . 1 . 2]" 1
898 1 58 LEU H 1 60 LEU H . . 5.860 4.180 4.052 4.327 . 0 0 "[ . 1 . 2]" 1
899 1 58 LEU HA 1 58 LEU MD1 . . 3.430 2.084 1.937 2.378 . 0 0 "[ . 1 . 2]" 1
900 1 58 LEU HA 1 58 LEU HG . . 3.620 2.613 2.504 2.788 . 0 0 "[ . 1 . 2]" 1
901 1 58 LEU HA 1 61 ILE H . . 4.490 3.552 3.316 3.730 . 0 0 "[ . 1 . 2]" 1
902 1 58 LEU HA 1 61 ILE HB . . 3.550 2.939 2.809 3.073 . 0 0 "[ . 1 . 2]" 1
903 1 58 LEU HA 1 61 ILE MD . . 5.300 3.304 2.132 4.507 . 0 0 "[ . 1 . 2]" 1
904 1 58 LEU HA 1 62 ASN H . . 4.700 4.120 3.878 4.369 . 0 0 "[ . 1 . 2]" 1
905 1 58 LEU QB 1 59 ALA H . . 3.630 2.277 2.186 2.355 . 0 0 "[ . 1 . 2]" 1
906 1 58 LEU HB2 1 59 ALA H . . 4.090 3.372 3.243 3.448 . 0 0 "[ . 1 . 2]" 1
907 1 58 LEU HB3 1 59 ALA H . . 4.090 2.316 2.222 2.399 . 0 0 "[ . 1 . 2]" 1
908 1 58 LEU MD1 1 59 ALA H . . 6.520 4.678 4.629 4.752 . 0 0 "[ . 1 . 2]" 1
909 1 58 LEU MD1 1 62 ASN HD21 . . 6.090 4.415 3.760 4.997 . 0 0 "[ . 1 . 2]" 1
910 1 58 LEU MD1 1 62 ASN QD . . 5.620 3.753 3.231 4.152 . 0 0 "[ . 1 . 2]" 1
911 1 58 LEU MD1 1 62 ASN HD22 . . 6.090 4.157 3.521 4.874 . 0 0 "[ . 1 . 2]" 1
912 1 58 LEU MD2 1 59 ALA H . . 6.490 4.128 3.958 4.313 . 0 0 "[ . 1 . 2]" 1
913 1 58 LEU MD2 1 62 ASN QD . . 6.820 3.479 2.952 3.992 . 0 0 "[ . 1 . 2]" 1
914 1 58 LEU HG 1 59 ALA H . . 4.270 4.307 4.254 4.345 0.075 9 0 "[ . 1 . 2]" 1
915 1 58 LEU HG 1 62 ASN HD21 . . 6.000 3.262 2.567 4.498 . 0 0 "[ . 1 . 2]" 1
916 1 58 LEU HG 1 62 ASN QD . . 5.390 2.677 2.269 3.183 . 0 0 "[ . 1 . 2]" 1
917 1 58 LEU HG 1 62 ASN HD22 . . 6.000 3.013 2.446 4.019 . 0 0 "[ . 1 . 2]" 1
918 1 59 ALA H 1 59 ALA MB . . 3.430 1.957 1.940 2.010 . 0 0 "[ . 1 . 2]" 1
919 1 59 ALA H 1 60 LEU H . . 3.230 2.876 2.851 2.909 . 0 0 "[ . 1 . 2]" 1
920 1 59 ALA HA 1 62 ASN H . . 3.770 3.396 3.270 3.561 . 0 0 "[ . 1 . 2]" 1
921 1 59 ALA HA 1 62 ASN HB2 . . 4.090 2.339 2.069 2.717 . 0 0 "[ . 1 . 2]" 1
922 1 59 ALA HA 1 62 ASN QB . . 3.940 2.317 2.055 2.681 . 0 0 "[ . 1 . 2]" 1
923 1 59 ALA HA 1 62 ASN HB3 . . 4.090 3.771 3.462 4.166 0.076 5 0 "[ . 1 . 2]" 1
924 1 59 ALA HA 1 62 ASN QD . . 5.000 3.349 2.239 4.433 . 0 0 "[ . 1 . 2]" 1
925 1 59 ALA HA 1 64 HIS H . . 3.590 3.502 3.347 3.608 0.018 6 0 "[ . 1 . 2]" 1
926 1 59 ALA HA 1 64 HIS QB . . 4.970 2.420 2.319 2.635 . 0 0 "[ . 1 . 2]" 1
927 1 59 ALA MB 1 60 LEU H . . 4.110 2.604 2.523 2.688 . 0 0 "[ . 1 . 2]" 1
928 1 59 ALA MB 1 64 HIS H . . 5.440 3.360 3.215 3.568 . 0 0 "[ . 1 . 2]" 1
929 1 59 ALA MB 1 64 HIS HB2 . . 5.480 1.999 1.884 2.395 . 0 0 "[ . 1 . 2]" 1
930 1 59 ALA MB 1 64 HIS QB . . 5.110 1.769 1.658 1.987 . 0 0 "[ . 1 . 2]" 1
931 1 59 ALA MB 1 64 HIS HB3 . . 5.480 1.979 1.825 2.122 . 0 0 "[ . 1 . 2]" 1
932 1 59 ALA MB 1 65 SER H . . 6.160 2.086 1.916 2.404 . 0 0 "[ . 1 . 2]" 1
933 1 59 ALA MB 1 65 SER QB . . 5.780 2.746 2.335 3.573 . 0 0 "[ . 1 . 2]" 1
934 1 60 LEU H 1 60 LEU HB2 . . 3.700 2.062 2.043 2.113 . 0 0 "[ . 1 . 2]" 1
935 1 60 LEU H 1 60 LEU QB . . 3.380 2.044 2.026 2.094 . 0 0 "[ . 1 . 2]" 1
936 1 60 LEU H 1 60 LEU HB3 . . 3.700 3.379 3.357 3.424 . 0 0 "[ . 1 . 2]" 1
937 1 60 LEU H 1 60 LEU MD1 . . 4.940 3.590 3.257 3.790 . 0 0 "[ . 1 . 2]" 1
938 1 60 LEU H 1 60 LEU MD2 . . 5.840 4.062 3.966 4.201 . 0 0 "[ . 1 . 2]" 1
939 1 60 LEU H 1 60 LEU HG . . 3.080 3.084 2.931 3.146 0.066 16 0 "[ . 1 . 2]" 1
940 1 60 LEU H 1 61 ILE H . . 3.370 2.973 2.796 3.085 . 0 0 "[ . 1 . 2]" 1
941 1 60 LEU H 1 61 ILE MG . . 7.030 5.966 5.922 6.018 . 0 0 "[ . 1 . 2]" 1
942 1 60 LEU H 1 62 ASN H . . 4.630 4.224 4.049 4.519 . 0 0 "[ . 1 . 2]" 1
943 1 60 LEU HA 1 60 LEU MD2 . . 3.460 2.214 1.953 2.601 . 0 0 "[ . 1 . 2]" 1
944 1 60 LEU HA 1 60 LEU HG . . 3.700 2.477 2.283 2.580 . 0 0 "[ . 1 . 2]" 1
945 1 60 LEU HA 1 63 GLY H . . 6.000 3.251 3.092 3.456 . 0 0 "[ . 1 . 2]" 1
946 1 60 LEU HA 1 64 HIS HB2 . . 5.030 4.266 4.156 4.434 . 0 0 "[ . 1 . 2]" 1
947 1 60 LEU HA 1 64 HIS QB . . 4.390 3.936 3.851 4.019 . 0 0 "[ . 1 . 2]" 1
948 1 60 LEU HA 1 64 HIS HB3 . . 5.030 4.626 4.372 4.771 . 0 0 "[ . 1 . 2]" 1
949 1 60 LEU HA 1 65 SER H . . 3.950 2.969 2.706 3.231 . 0 0 "[ . 1 . 2]" 1
950 1 60 LEU HA 1 65 SER QB . . 5.830 3.102 2.864 3.639 . 0 0 "[ . 1 . 2]" 1
951 1 60 LEU QB 1 61 ILE H . . 3.480 2.509 2.412 2.752 . 0 0 "[ . 1 . 2]" 1
952 1 60 LEU QB 1 61 ILE HA . . 5.080 3.763 3.718 3.857 . 0 0 "[ . 1 . 2]" 1
953 1 60 LEU QB 1 61 ILE MD . . 7.840 4.089 2.624 4.605 . 0 0 "[ . 1 . 2]" 1
954 1 60 LEU QB 1 61 ILE MG . . 6.680 5.052 5.018 5.111 . 0 0 "[ . 1 . 2]" 1
955 1 60 LEU QB 1 65 SER QB . . 6.630 3.578 3.296 3.997 . 0 0 "[ . 1 . 2]" 1
956 1 60 LEU QB 1 76 LEU MD2 . . 5.140 3.007 2.552 3.415 . 0 0 "[ . 1 . 2]" 1
957 1 60 LEU HB2 1 61 ILE H . . 3.800 2.793 2.624 3.007 . 0 0 "[ . 1 . 2]" 1
958 1 60 LEU HB2 1 65 SER QB . . 6.880 3.774 3.431 4.279 . 0 0 "[ . 1 . 2]" 1
959 1 60 LEU HB3 1 61 ILE H . . 3.800 2.850 2.656 3.214 . 0 0 "[ . 1 . 2]" 1
960 1 60 LEU HB3 1 65 SER QB . . 6.880 4.448 4.251 4.793 . 0 0 "[ . 1 . 2]" 1
961 1 60 LEU MD1 1 61 ILE H . . 7.030 4.450 4.334 4.727 . 0 0 "[ . 1 . 2]" 1
962 1 60 LEU MD1 1 67 THR HB . . 4.760 3.512 2.944 3.821 . 0 0 "[ . 1 . 2]" 1
963 1 60 LEU MD1 1 67 THR MG . . 7.300 4.652 4.067 4.943 . 0 0 "[ . 1 . 2]" 1
964 1 60 LEU MD1 1 76 LEU MD1 . . 7.260 3.276 2.771 4.115 . 0 0 "[ . 1 . 2]" 1
965 1 60 LEU MD1 1 76 LEU MD2 . . 6.360 3.526 2.935 4.133 . 0 0 "[ . 1 . 2]" 1
966 1 60 LEU MD2 1 61 ILE H . . 7.030 4.451 4.300 4.703 . 0 0 "[ . 1 . 2]" 1
967 1 60 LEU MD2 1 65 SER QB . . 5.820 2.731 2.273 3.271 . 0 0 "[ . 1 . 2]" 1
968 1 60 LEU MD2 1 66 GLU H . . 4.940 3.367 3.078 3.771 . 0 0 "[ . 1 . 2]" 1
969 1 60 LEU MD2 1 66 GLU HA . . 4.400 2.539 2.215 2.810 . 0 0 "[ . 1 . 2]" 1
970 1 60 LEU MD2 1 67 THR H . . 4.180 3.475 3.382 3.527 . 0 0 "[ . 1 . 2]" 1
971 1 60 LEU MD2 1 67 THR HB . . 4.290 2.472 1.965 2.915 . 0 0 "[ . 1 . 2]" 1
972 1 60 LEU MD2 1 67 THR MG . . 6.690 3.601 2.986 4.083 . 0 0 "[ . 1 . 2]" 1
973 1 60 LEU MD2 1 76 LEU MD1 . . 6.800 2.532 2.066 2.948 . 0 0 "[ . 1 . 2]" 1
974 1 60 LEU MD2 1 76 LEU MD2 . . 6.220 3.651 2.950 4.059 . 0 0 "[ . 1 . 2]" 1
975 1 60 LEU HG 1 61 ILE H . . 6.000 4.884 4.795 4.993 . 0 0 "[ . 1 . 2]" 1
976 1 60 LEU HG 1 65 SER QB . . 6.590 1.875 1.772 2.045 . 0 0 "[ . 1 . 2]" 1
977 1 61 ILE H 1 61 ILE HB . . 2.980 2.362 2.238 2.583 . 0 0 "[ . 1 . 2]" 1
978 1 61 ILE H 1 61 ILE MD . . 4.940 3.267 2.198 3.648 . 0 0 "[ . 1 . 2]" 1
979 1 61 ILE H 1 61 ILE HG12 . . 3.550 3.174 1.930 3.631 0.081 9 0 "[ . 1 . 2]" 1
980 1 61 ILE H 1 61 ILE QG . . 3.120 2.135 1.918 2.350 . 0 0 "[ . 1 . 2]" 1
981 1 61 ILE H 1 61 ILE HG13 . . 3.550 2.509 2.086 3.493 . 0 0 "[ . 1 . 2]" 1
982 1 61 ILE H 1 61 ILE MG . . 4.400 3.689 3.652 3.713 . 0 0 "[ . 1 . 2]" 1
983 1 61 ILE H 1 62 ASN H . . 3.120 2.859 2.735 3.015 . 0 0 "[ . 1 . 2]" 1
984 1 61 ILE HA 1 61 ILE HG12 . . 3.950 2.689 2.363 3.419 . 0 0 "[ . 1 . 2]" 1
985 1 61 ILE HA 1 61 ILE QG . . 3.730 2.475 2.241 3.125 . 0 0 "[ . 1 . 2]" 1
986 1 61 ILE HA 1 61 ILE HG13 . . 3.950 2.950 2.600 3.774 . 0 0 "[ . 1 . 2]" 1
987 1 61 ILE HB 1 62 ASN H . . 3.160 2.629 2.335 2.821 . 0 0 "[ . 1 . 2]" 1
988 1 61 ILE HG12 1 62 ASN H . . 6.000 4.906 4.057 5.215 . 0 0 "[ . 1 . 2]" 1
989 1 61 ILE HG13 1 62 ASN H . . 6.000 4.582 4.454 4.862 . 0 0 "[ . 1 . 2]" 1
990 1 61 ILE MG 1 62 ASN H . . 4.040 3.243 3.043 3.370 . 0 0 "[ . 1 . 2]" 1
991 1 61 ILE MG 1 62 ASN HD21 . . 6.160 3.824 2.934 4.611 . 0 0 "[ . 1 . 2]" 1
992 1 61 ILE MG 1 62 ASN QD . . 5.800 3.557 2.777 4.153 . 0 0 "[ . 1 . 2]" 1
993 1 61 ILE MG 1 62 ASN HD22 . . 6.160 4.248 3.429 4.715 . 0 0 "[ . 1 . 2]" 1
994 1 62 ASN H 1 62 ASN HB2 . . 3.520 2.259 2.102 2.753 . 0 0 "[ . 1 . 2]" 1
995 1 62 ASN H 1 62 ASN QB . . 3.140 2.227 2.083 2.661 . 0 0 "[ . 1 . 2]" 1
996 1 62 ASN H 1 62 ASN HB3 . . 3.520 3.466 3.407 3.549 0.029 20 0 "[ . 1 . 2]" 1
997 1 62 ASN H 1 63 GLY H . . 3.260 2.643 2.546 2.717 . 0 0 "[ . 1 . 2]" 1
998 1 62 ASN H 1 63 GLY QA . . 6.050 4.516 4.438 4.573 . 0 0 "[ . 1 . 2]" 1
999 1 62 ASN HA 1 64 HIS H . . 5.060 4.991 4.774 5.085 0.025 19 0 "[ . 1 . 2]" 1
1000 1 62 ASN QB 1 64 HIS H . . 5.570 3.055 2.842 3.264 . 0 0 "[ . 1 . 2]" 1
1001 1 62 ASN HB2 1 63 GLY H . . 6.000 2.982 2.705 3.217 . 0 0 "[ . 1 . 2]" 1
1002 1 62 ASN HB2 1 64 HIS H . . 5.820 3.231 2.939 3.528 . 0 0 "[ . 1 . 2]" 1
1003 1 62 ASN HB3 1 63 GLY H . . 6.000 3.619 3.350 4.070 . 0 0 "[ . 1 . 2]" 1
1004 1 62 ASN HB3 1 64 HIS H . . 5.820 3.888 3.384 4.678 . 0 0 "[ . 1 . 2]" 1
1005 1 63 GLY H 1 64 HIS H . . 3.230 1.974 1.883 2.149 . 0 0 "[ . 1 . 2]" 1
1006 1 64 HIS H 1 64 HIS HB2 . . 3.800 2.095 2.022 2.184 . 0 0 "[ . 1 . 2]" 1
1007 1 64 HIS H 1 64 HIS QB . . 3.380 2.069 2.003 2.147 . 0 0 "[ . 1 . 2]" 1
1008 1 64 HIS H 1 64 HIS HB3 . . 3.800 3.216 3.120 3.302 . 0 0 "[ . 1 . 2]" 1
1009 1 64 HIS H 1 65 SER H . . 3.050 2.992 2.835 3.050 . 14 0 "[ . 1 . 2]" 1
1010 1 64 HIS QB 1 65 SER H . . 4.120 1.949 1.891 2.107 . 0 0 "[ . 1 . 2]" 1
1011 1 64 HIS HB2 1 65 SER H . . 4.340 2.729 2.584 2.871 . 0 0 "[ . 1 . 2]" 1
1012 1 64 HIS HB3 1 65 SER H . . 4.340 1.997 1.936 2.189 . 0 0 "[ . 1 . 2]" 1
1013 1 65 SER H 1 66 GLU H . . 4.600 4.628 4.580 4.660 0.060 6 0 "[ . 1 . 2]" 1
1014 1 65 SER HA 1 66 GLU H . . 2.620 2.582 2.456 2.654 0.034 3 0 "[ . 1 . 2]" 1
1015 1 65 SER QB 1 66 GLU H . . 4.180 2.566 2.185 3.165 . 0 0 "[ . 1 . 2]" 1
1016 1 66 GLU H 1 66 GLU HB2 . . 3.520 2.579 2.394 3.767 0.247 16 0 "[ . 1 . 2]" 1
1017 1 66 GLU H 1 66 GLU QB . . 3.230 2.458 2.360 2.945 . 0 0 "[ . 1 . 2]" 1
1018 1 66 GLU H 1 66 GLU HB3 . . 3.520 3.511 2.962 3.606 0.086 11 0 "[ . 1 . 2]" 1
1019 1 66 GLU H 1 66 GLU HG2 . . 4.630 4.033 2.824 4.682 0.052 10 0 "[ . 1 . 2]" 1
1020 1 66 GLU H 1 66 GLU QG . . 4.440 3.432 1.929 4.029 . 0 0 "[ . 1 . 2]" 1
1021 1 66 GLU H 1 66 GLU HG3 . . 4.630 3.894 1.946 4.635 0.005 5 0 "[ . 1 . 2]" 1
1022 1 66 GLU H 1 67 THR H . . 4.490 4.483 4.451 4.532 0.042 19 0 "[ . 1 . 2]" 1
1023 1 66 GLU HA 1 67 THR H . . 2.580 2.559 2.473 2.624 0.044 6 0 "[ . 1 . 2]" 1
1024 1 66 GLU QB 1 67 THR H . . 3.450 2.365 2.217 2.508 . 0 0 "[ . 1 . 2]" 1
1025 1 66 GLU QB 1 67 THR MG . . 7.870 4.245 3.818 4.510 . 0 0 "[ . 1 . 2]" 1
1026 1 66 GLU QB 1 68 ASP H . . 5.380 4.765 4.563 4.885 . 0 0 "[ . 1 . 2]" 1
1027 1 66 GLU HB2 1 66 GLU HG2 . . 3.010 2.772 2.458 2.993 . 0 0 "[ . 1 . 2]" 1
1028 1 66 GLU HB2 1 66 GLU HG3 . . 3.010 2.593 2.264 3.057 0.047 8 0 "[ . 1 . 2]" 1
1029 1 66 GLU HB2 1 67 THR H . . 3.840 3.678 2.507 3.866 0.026 11 0 "[ . 1 . 2]" 1
1030 1 66 GLU HB2 1 68 ASP H . . 6.000 5.811 4.703 5.973 . 0 0 "[ . 1 . 2]" 1
1031 1 66 GLU HB3 1 66 GLU HG2 . . 3.010 2.667 2.279 3.055 0.045 18 0 "[ . 1 . 2]" 1
1032 1 66 GLU HB3 1 66 GLU HG3 . . 3.010 2.772 2.457 2.994 . 0 0 "[ . 1 . 2]" 1
1033 1 66 GLU HB3 1 67 THR H . . 3.840 2.524 2.235 3.879 0.039 16 0 "[ . 1 . 2]" 1
1034 1 66 GLU HB3 1 68 ASP H . . 6.000 5.163 4.958 6.168 0.168 19 0 "[ . 1 . 2]" 1
1035 1 66 GLU QG 1 67 THR H . . 4.540 3.553 3.180 4.015 . 0 0 "[ . 1 . 2]" 1
1036 1 66 GLU HG2 1 67 THR H . . 5.240 3.957 3.450 4.901 . 0 0 "[ . 1 . 2]" 1
1037 1 66 GLU HG3 1 67 THR H . . 5.240 4.251 3.293 4.841 . 0 0 "[ . 1 . 2]" 1
1038 1 67 THR H 1 67 THR HB . . 3.520 2.876 2.673 3.289 . 0 0 "[ . 1 . 2]" 1
1039 1 67 THR H 1 67 THR MG . . 3.430 2.381 1.906 2.621 . 0 0 "[ . 1 . 2]" 1
1040 1 67 THR H 1 68 ASP H . . 5.170 4.250 3.844 4.378 . 0 0 "[ . 1 . 2]" 1
1041 1 67 THR HA 1 67 THR HB . . 2.900 2.626 2.408 2.709 . 0 0 "[ . 1 . 2]" 1
1042 1 67 THR HA 1 68 ASP H . . 2.580 2.158 2.150 2.208 . 0 0 "[ . 1 . 2]" 1
1043 1 67 THR HB 1 68 ASP H . . 4.520 4.519 4.250 4.680 0.160 19 0 "[ . 1 . 2]" 1
1044 1 67 THR MG 1 68 ASP H . . 5.440 3.878 3.677 4.273 . 0 0 "[ . 1 . 2]" 1
1045 1 67 THR MG 1 69 LYS H . . 4.220 2.287 1.909 3.201 . 0 0 "[ . 1 . 2]" 1
1046 1 67 THR MG 1 72 LEU MD2 . . 7.120 4.858 4.693 4.924 . 0 0 "[ . 1 . 2]" 1
1047 1 67 THR MG 1 73 ILE HG12 . . 5.980 2.848 2.168 3.793 . 0 0 "[ . 1 . 2]" 1
1048 1 67 THR MG 1 73 ILE HG13 . . 5.160 2.629 1.908 3.536 . 0 0 "[ . 1 . 2]" 1
1049 1 68 ASP H 1 68 ASP HB2 . . 3.620 2.203 2.070 2.365 . 0 0 "[ . 1 . 2]" 1
1050 1 68 ASP H 1 68 ASP HB3 . . 3.620 2.982 2.675 3.488 . 0 0 "[ . 1 . 2]" 1
1051 1 68 ASP H 1 69 LYS H . . 2.980 2.942 2.551 3.177 0.197 16 0 "[ . 1 . 2]" 1
1052 1 68 ASP HB2 1 69 LYS H . . 6.000 4.373 3.935 4.528 . 0 0 "[ . 1 . 2]" 1
1053 1 68 ASP HB3 1 69 LYS H . . 6.000 4.123 3.609 4.403 . 0 0 "[ . 1 . 2]" 1
1054 1 69 LYS H 1 69 LYS HB2 . . 3.980 2.891 2.719 3.268 . 0 0 "[ . 1 . 2]" 1
1055 1 69 LYS H 1 69 LYS QB . . 3.700 2.766 2.662 2.883 . 0 0 "[ . 1 . 2]" 1
1056 1 69 LYS H 1 69 LYS HB3 . . 3.980 3.715 3.079 3.929 . 0 0 "[ . 1 . 2]" 1
1057 1 69 LYS H 1 69 LYS HD2 . . 6.000 4.943 2.363 5.824 . 0 0 "[ . 1 . 2]" 1
1058 1 69 LYS H 1 69 LYS QD . . 5.760 4.345 2.312 4.934 . 0 0 "[ . 1 . 2]" 1
1059 1 69 LYS H 1 69 LYS HD3 . . 6.000 4.984 3.092 5.751 . 0 0 "[ . 1 . 2]" 1
1060 1 69 LYS H 1 69 LYS QE . . 6.880 5.277 4.509 6.147 . 0 0 "[ . 1 . 2]" 1
1061 1 69 LYS H 1 70 GLY H . . 4.020 4.095 4.034 4.172 0.152 14 0 "[ . 1 . 2]" 1
1062 1 69 LYS HA 1 69 LYS HD2 . . 5.710 3.778 2.065 4.759 . 0 0 "[ . 1 . 2]" 1
1063 1 69 LYS HA 1 69 LYS HD3 . . 5.710 3.505 2.105 4.622 . 0 0 "[ . 1 . 2]" 1
1064 1 69 LYS HA 1 70 GLY H . . 2.760 2.182 2.176 2.202 . 0 0 "[ . 1 . 2]" 1
1065 1 69 LYS QB 1 69 LYS QD . . 3.290 2.129 1.952 2.304 . 0 0 "[ . 1 . 2]" 1
1066 1 69 LYS QB 1 72 LEU MD1 . . 6.680 1.907 1.784 2.391 . 0 0 "[ . 1 . 2]" 1
1067 1 69 LYS QB 1 72 LEU HG . . 5.910 2.145 1.901 2.771 . 0 0 "[ . 1 . 2]" 1
1068 1 69 LYS HB2 1 70 GLY H . . 4.340 4.421 4.377 4.517 0.177 7 0 "[ . 1 . 2]" 1
1069 1 69 LYS HB3 1 70 GLY H . . 4.340 3.722 3.493 4.215 . 0 0 "[ . 1 . 2]" 1
1070 1 69 LYS QG 1 70 GLY H . . 6.880 4.065 2.510 4.766 . 0 0 "[ . 1 . 2]" 1
1071 1 70 GLY QA 1 72 LEU H . . 5.510 3.267 3.103 3.621 . 0 0 "[ . 1 . 2]" 1
1072 1 70 GLY QA 1 73 ILE MD . . 5.450 3.107 2.731 3.480 . 0 0 "[ . 1 . 2]" 1
1073 1 70 GLY QA 1 73 ILE HG13 . . 5.040 2.558 1.988 3.129 . 0 0 "[ . 1 . 2]" 1
1074 1 70 GLY HA2 1 73 ILE MD . . 5.620 3.230 2.839 3.627 . 0 0 "[ . 1 . 2]" 1
1075 1 70 GLY HA3 1 73 ILE MD . . 5.620 4.080 3.550 4.484 . 0 0 "[ . 1 . 2]" 1
1076 1 71 HIS HA 1 74 PRO HB2 . . 6.000 5.634 5.269 5.999 . 0 0 "[ . 1 . 2]" 1
1077 1 71 HIS HA 1 74 PRO HB3 . . 6.000 5.895 5.661 6.056 0.056 17 0 "[ . 1 . 2]" 1
1078 1 71 HIS QB 1 72 LEU H . . 5.100 3.401 3.024 3.565 . 0 0 "[ . 1 . 2]" 1
1079 1 71 HIS HB2 1 72 LEU H . . 5.640 3.661 3.172 3.968 . 0 0 "[ . 1 . 2]" 1
1080 1 71 HIS HB3 1 72 LEU H . . 5.640 4.106 3.602 4.495 . 0 0 "[ . 1 . 2]" 1
1081 1 72 LEU H 1 72 LEU HB2 . . 3.190 2.721 2.546 2.898 . 0 0 "[ . 1 . 2]" 1
1082 1 72 LEU H 1 72 LEU HB3 . . 3.620 3.700 3.636 3.805 0.185 19 0 "[ . 1 . 2]" 1
1083 1 72 LEU H 1 72 LEU MD1 . . 4.800 3.647 3.242 3.981 . 0 0 "[ . 1 . 2]" 1
1084 1 72 LEU H 1 72 LEU MD2 . . 4.470 3.476 2.984 3.696 . 0 0 "[ . 1 . 2]" 1
1085 1 72 LEU H 1 72 LEU HG . . 2.760 2.369 2.092 2.757 . 0 0 "[ . 1 . 2]" 1
1086 1 72 LEU H 1 73 ILE H . . 2.980 1.996 1.855 2.147 . 0 0 "[ . 1 . 2]" 1
1087 1 72 LEU HA 1 72 LEU MD2 . . 3.430 2.227 1.990 2.530 . 0 0 "[ . 1 . 2]" 1
1088 1 72 LEU HA 1 75 MET QB . . 6.880 2.031 1.935 2.299 . 0 0 "[ . 1 . 2]" 1
1089 1 72 LEU HB2 1 73 ILE H . . 4.630 2.976 2.737 3.252 . 0 0 "[ . 1 . 2]" 1
1090 1 72 LEU HB3 1 73 ILE H . . 5.320 4.126 3.881 4.335 . 0 0 "[ . 1 . 2]" 1
1091 1 72 LEU MD1 1 73 ILE H . . 5.370 4.496 4.385 4.564 . 0 0 "[ . 1 . 2]" 1
1092 1 72 LEU MD2 1 73 ILE H . . 6.560 4.693 4.345 4.921 . 0 0 "[ . 1 . 2]" 1
1093 1 72 LEU HG 1 73 ILE H . . 6.000 4.019 3.626 4.248 . 0 0 "[ . 1 . 2]" 1
1094 1 73 ILE H 1 73 ILE HB . . 2.980 2.160 2.147 2.178 . 0 0 "[ . 1 . 2]" 1
1095 1 73 ILE H 1 73 ILE MD . . 4.900 4.026 3.975 4.058 . 0 0 "[ . 1 . 2]" 1
1096 1 73 ILE H 1 73 ILE HG12 . . 3.440 3.482 3.468 3.499 0.059 18 0 "[ . 1 . 2]" 1
1097 1 73 ILE H 1 73 ILE HG13 . . 2.940 2.728 2.661 2.768 . 0 0 "[ . 1 . 2]" 1
1098 1 73 ILE H 1 73 ILE MG . . 4.580 3.596 3.586 3.609 . 0 0 "[ . 1 . 2]" 1
1099 1 73 ILE H 1 74 PRO HD2 . . 3.440 2.476 2.410 2.554 . 0 0 "[ . 1 . 2]" 1
1100 1 73 ILE H 1 74 PRO HD3 . . 3.440 2.718 2.615 2.823 . 0 0 "[ . 1 . 2]" 1
1101 1 73 ILE HA 1 73 ILE MD . . 4.180 3.546 3.525 3.582 . 0 0 "[ . 1 . 2]" 1
1102 1 73 ILE HA 1 73 ILE HG12 . . 3.230 2.086 2.068 2.119 . 0 0 "[ . 1 . 2]" 1
1103 1 73 ILE HA 1 73 ILE HG13 . . 3.660 2.964 2.939 2.981 . 0 0 "[ . 1 . 2]" 1
1104 1 73 ILE HA 1 76 LEU H . . 3.980 3.883 3.653 4.009 0.029 14 0 "[ . 1 . 2]" 1
1105 1 73 ILE HA 1 76 LEU HB2 . . 3.120 2.892 2.763 3.080 . 0 0 "[ . 1 . 2]" 1
1106 1 73 ILE HA 1 76 LEU HB3 . . 4.130 4.206 4.126 4.252 0.122 7 0 "[ . 1 . 2]" 1
1107 1 73 ILE HA 1 76 LEU MD1 . . 5.520 2.995 2.222 3.711 . 0 0 "[ . 1 . 2]" 1
1108 1 73 ILE HA 1 77 GLU H . . 5.530 4.840 4.575 5.046 . 0 0 "[ . 1 . 2]" 1
1109 1 74 PRO HA 1 77 GLU H . . 4.670 3.227 3.088 3.655 . 0 0 "[ . 1 . 2]" 1
1110 1 74 PRO HA 1 77 GLU HB2 . . 4.380 2.783 2.613 2.944 . 0 0 "[ . 1 . 2]" 1
1111 1 74 PRO HA 1 77 GLU QB . . 3.960 2.754 2.590 2.905 . 0 0 "[ . 1 . 2]" 1
1112 1 74 PRO HA 1 77 GLU HB3 . . 4.380 4.405 4.234 4.532 0.152 7 0 "[ . 1 . 2]" 1
1113 1 74 PRO QB 1 75 MET H . . 4.310 2.860 2.550 3.270 . 0 0 "[ . 1 . 2]" 1
1114 1 74 PRO QD 1 75 MET H . . 5.380 2.373 2.234 2.567 . 0 0 "[ . 1 . 2]" 1
1115 1 74 PRO HG2 1 75 MET H . . 5.390 2.507 2.272 2.941 . 0 0 "[ . 1 . 2]" 1
1116 1 74 PRO HG3 1 75 MET H . . 5.390 3.874 3.726 4.147 . 0 0 "[ . 1 . 2]" 1
1117 1 75 MET H 1 75 MET HB2 . . 3.590 2.297 1.969 2.636 . 0 0 "[ . 1 . 2]" 1
1118 1 75 MET H 1 75 MET HB3 . . 3.590 3.444 3.122 3.527 . 0 0 "[ . 1 . 2]" 1
1119 1 75 MET H 1 76 LEU H . . 3.660 2.759 2.549 2.850 . 0 0 "[ . 1 . 2]" 1
1120 1 75 MET HA 1 76 LEU H . . 3.440 3.524 3.487 3.635 0.195 6 0 "[ . 1 . 2]" 1
1121 1 75 MET HA 1 78 LYS H . . 3.480 3.490 2.972 3.605 0.125 19 0 "[ . 1 . 2]" 1
1122 1 75 MET HA 1 78 LYS QB . . 4.430 3.790 2.976 4.081 . 0 0 "[ . 1 . 2]" 1
1123 1 75 MET QB 1 76 LEU H . . 3.940 2.926 2.299 3.062 . 0 0 "[ . 1 . 2]" 1
1124 1 75 MET HB2 1 76 LEU H . . 4.130 3.107 2.329 3.455 . 0 0 "[ . 1 . 2]" 1
1125 1 75 MET HB2 1 79 ILE MD . . 7.030 3.353 3.012 4.155 . 0 0 "[ . 1 . 2]" 1
1126 1 75 MET HB3 1 76 LEU H . . 4.130 3.734 3.067 4.152 0.022 17 0 "[ . 1 . 2]" 1
1127 1 75 MET HB3 1 79 ILE MD . . 7.030 2.077 1.768 3.035 . 0 0 "[ . 1 . 2]" 1
1128 1 75 MET QG 1 79 ILE MD . . 6.860 3.379 1.783 4.672 . 0 0 "[ . 1 . 2]" 1
1129 1 76 LEU H 1 76 LEU HB2 . . 3.120 2.063 2.017 2.182 . 0 0 "[ . 1 . 2]" 1
1130 1 76 LEU H 1 76 LEU HB3 . . 3.620 3.354 3.305 3.470 . 0 0 "[ . 1 . 2]" 1
1131 1 76 LEU H 1 76 LEU MD2 . . 4.800 3.977 3.878 4.041 . 0 0 "[ . 1 . 2]" 1
1132 1 76 LEU H 1 76 LEU HG . . 3.230 3.212 2.824 3.292 0.062 12 0 "[ . 1 . 2]" 1
1133 1 76 LEU H 1 77 GLU H . . 3.340 2.518 2.409 2.856 . 0 0 "[ . 1 . 2]" 1
1134 1 76 LEU H 1 78 LYS H . . 4.380 4.322 4.099 4.464 0.084 9 0 "[ . 1 . 2]" 1
1135 1 76 LEU HA 1 76 LEU MD2 . . 3.750 1.998 1.913 2.285 . 0 0 "[ . 1 . 2]" 1
1136 1 76 LEU HA 1 76 LEU HG . . 3.980 2.704 2.611 2.798 . 0 0 "[ . 1 . 2]" 1
1137 1 76 LEU HA 1 79 ILE H . . 3.910 3.632 3.264 3.929 0.019 12 0 "[ . 1 . 2]" 1
1138 1 76 LEU HA 1 79 ILE HB . . 3.480 2.530 2.291 2.927 . 0 0 "[ . 1 . 2]" 1
1139 1 76 LEU HA 1 80 ARG H . . 4.880 3.246 2.720 4.377 . 0 0 "[ . 1 . 2]" 1
1140 1 76 LEU HB2 1 77 GLU H . . 3.800 3.076 2.792 3.376 . 0 0 "[ . 1 . 2]" 1
1141 1 76 LEU HB3 1 77 GLU H . . 4.160 3.361 3.101 3.600 . 0 0 "[ . 1 . 2]" 1
1142 1 76 LEU MD1 1 77 GLU H . . 6.240 4.836 4.603 5.048 . 0 0 "[ . 1 . 2]" 1
1143 1 76 LEU MD2 1 77 GLU H . . 6.670 4.630 4.478 4.793 . 0 0 "[ . 1 . 2]" 1
1144 1 76 LEU HG 1 77 GLU H . . 6.000 5.008 4.756 5.224 . 0 0 "[ . 1 . 2]" 1
1145 1 77 GLU H 1 77 GLU HB2 . . 3.700 2.104 2.054 2.218 . 0 0 "[ . 1 . 2]" 1
1146 1 77 GLU H 1 77 GLU QB . . 3.410 2.085 2.036 2.194 . 0 0 "[ . 1 . 2]" 1
1147 1 77 GLU H 1 77 GLU HB3 . . 3.700 3.398 3.344 3.488 . 0 0 "[ . 1 . 2]" 1
1148 1 77 GLU H 1 77 GLU HG2 . . 3.800 3.317 3.107 3.981 0.181 7 0 "[ . 1 . 2]" 1
1149 1 77 GLU H 1 77 GLU QG . . 3.570 3.101 2.975 3.464 . 0 0 "[ . 1 . 2]" 1
1150 1 77 GLU H 1 77 GLU HG3 . . 3.800 3.809 3.624 3.885 0.085 6 0 "[ . 1 . 2]" 1
1151 1 77 GLU H 1 78 LYS H . . 3.120 2.797 2.578 2.920 . 0 0 "[ . 1 . 2]" 1
1152 1 77 GLU HA 1 80 ARG H . . 4.310 3.834 3.280 4.348 0.038 15 0 "[ . 1 . 2]" 1
1153 1 77 GLU HA 1 80 ARG QB . . 4.320 2.815 2.189 3.836 . 0 0 "[ . 1 . 2]" 1
1154 1 77 GLU HA 1 80 ARG QD . . 5.120 3.449 1.810 4.425 . 0 0 "[ . 1 . 2]" 1
1155 1 77 GLU QB 1 77 GLU QG . . 2.430 2.054 2.035 2.058 . 0 0 "[ . 1 . 2]" 1
1156 1 77 GLU HB2 1 78 LYS H . . 3.590 2.768 2.543 3.018 . 0 0 "[ . 1 . 2]" 1
1157 1 77 GLU HB3 1 78 LYS H . . 3.590 2.975 2.733 3.278 . 0 0 "[ . 1 . 2]" 1
1158 1 77 GLU QG 1 78 LYS H . . 6.160 4.399 4.325 4.533 . 0 0 "[ . 1 . 2]" 1
1159 1 78 LYS H 1 78 LYS QB . . 3.780 2.470 1.983 2.692 . 0 0 "[ . 1 . 2]" 1
1160 1 78 LYS H 1 78 LYS QD . . 4.970 3.877 2.967 4.323 . 0 0 "[ . 1 . 2]" 1
1161 1 78 LYS H 1 78 LYS HG2 . . 5.170 2.554 1.806 3.587 . 0 0 "[ . 1 . 2]" 1
1162 1 78 LYS H 1 78 LYS QG . . 4.320 2.171 1.743 3.405 . 0 0 "[ . 1 . 2]" 1
1163 1 78 LYS H 1 78 LYS HG3 . . 5.170 2.673 1.776 4.240 . 0 0 "[ . 1 . 2]" 1
1164 1 78 LYS H 1 79 ILE H . . 3.120 2.776 2.564 2.994 . 0 0 "[ . 1 . 2]" 1
1165 1 78 LYS HA 1 78 LYS QD . . 5.040 4.219 3.960 4.530 . 0 0 "[ . 1 . 2]" 1
1166 1 78 LYS HA 1 81 ARG H . . 4.090 3.535 3.261 3.827 . 0 0 "[ . 1 . 2]" 1
1167 1 78 LYS HA 1 81 ARG HB2 . . 3.800 2.611 2.222 3.328 . 0 0 "[ . 1 . 2]" 1
1168 1 78 LYS HA 1 81 ARG QB . . 3.420 2.556 2.195 3.135 . 0 0 "[ . 1 . 2]" 1
1169 1 78 LYS HA 1 81 ARG HB3 . . 3.800 3.697 3.420 3.866 0.066 10 0 "[ . 1 . 2]" 1
1170 1 78 LYS QB 1 79 ILE H . . 4.540 3.244 2.921 3.646 . 0 0 "[ . 1 . 2]" 1
1171 1 78 LYS QB 1 79 ILE MD . . 7.900 4.844 3.755 5.170 . 0 0 "[ . 1 . 2]" 1
1172 1 78 LYS QD 1 79 ILE H . . 5.720 3.261 2.265 4.158 . 0 0 "[ . 1 . 2]" 1
1173 1 78 LYS HG2 1 79 ILE H . . 3.370 2.931 1.928 3.541 0.171 17 0 "[ . 1 . 2]" 1
1174 1 78 LYS HG3 1 79 ILE H . . 3.370 2.075 1.779 3.006 . 0 0 "[ . 1 . 2]" 1
1175 1 79 ILE H 1 79 ILE HB . . 3.190 2.379 2.307 2.591 . 0 0 "[ . 1 . 2]" 1
1176 1 79 ILE H 1 79 ILE MD . . 4.540 3.179 2.529 3.367 . 0 0 "[ . 1 . 2]" 1
1177 1 79 ILE H 1 79 ILE HG12 . . 3.520 3.494 1.891 3.714 0.194 18 0 "[ . 1 . 2]" 1
1178 1 79 ILE H 1 79 ILE QG . . 3.160 2.123 1.883 2.316 . 0 0 "[ . 1 . 2]" 1
1179 1 79 ILE H 1 79 ILE HG13 . . 3.520 2.216 1.950 3.428 . 0 0 "[ . 1 . 2]" 1
1180 1 79 ILE H 1 80 ARG H . . 3.190 2.876 2.514 3.081 . 0 0 "[ . 1 . 2]" 1
1181 1 79 ILE HA 1 79 ILE HG12 . . 3.880 2.713 2.601 3.371 . 0 0 "[ . 1 . 2]" 1
1182 1 79 ILE HA 1 79 ILE QG . . 3.650 2.426 2.346 3.135 . 0 0 "[ . 1 . 2]" 1
1183 1 79 ILE HA 1 79 ILE HG13 . . 3.880 2.744 2.573 3.729 . 0 0 "[ . 1 . 2]" 1
1184 1 79 ILE HA 1 82 ALA H . . 4.380 3.617 3.274 3.886 . 0 0 "[ . 1 . 2]" 1
1185 1 79 ILE HA 1 82 ALA MB . . 6.020 3.355 2.530 3.987 . 0 0 "[ . 1 . 2]" 1
1186 1 79 ILE HB 1 80 ARG H . . 3.230 2.447 2.224 2.751 . 0 0 "[ . 1 . 2]" 1
1187 1 79 ILE MD 1 80 ARG H . . 5.480 4.206 3.926 4.451 . 0 0 "[ . 1 . 2]" 1
1188 1 79 ILE MD 1 80 ARG HA . . 7.030 5.725 5.630 5.834 . 0 0 "[ . 1 . 2]" 1
1189 1 79 ILE QG 1 80 ARG H . . 6.520 4.117 3.712 4.224 . 0 0 "[ . 1 . 2]" 1
1190 1 79 ILE MG 1 80 ARG H . . 5.340 3.127 2.745 3.533 . 0 0 "[ . 1 . 2]" 1
1191 1 79 ILE MG 1 80 ARG HA . . 7.030 3.343 3.020 3.757 . 0 0 "[ . 1 . 2]" 1
1192 1 79 ILE MG 1 82 ALA MB . . 7.080 3.900 3.369 4.502 . 0 0 "[ . 1 . 2]" 1
1193 1 80 ARG H 1 80 ARG HD2 . . 6.000 4.811 3.770 5.813 . 0 0 "[ . 1 . 2]" 1
1194 1 80 ARG H 1 80 ARG HD3 . . 6.000 4.762 2.675 5.780 . 0 0 "[ . 1 . 2]" 1
1195 1 80 ARG H 1 80 ARG QG . . 4.250 3.502 2.651 3.975 . 0 0 "[ . 1 . 2]" 1
1196 1 80 ARG H 1 81 ARG H . . 3.480 2.869 2.613 3.068 . 0 0 "[ . 1 . 2]" 1
1197 1 80 ARG HA 1 80 ARG HD2 . . 5.240 4.322 3.634 4.748 . 0 0 "[ . 1 . 2]" 1
1198 1 80 ARG HA 1 80 ARG QD . . 4.410 3.820 2.593 4.349 . 0 0 "[ . 1 . 2]" 1
1199 1 80 ARG HA 1 80 ARG HD3 . . 5.240 4.390 2.648 5.314 0.074 10 0 "[ . 1 . 2]" 1
1200 1 80 ARG HA 1 82 ALA H . . 5.390 4.838 4.486 5.157 . 0 0 "[ . 1 . 2]" 1
1201 1 80 ARG QD 1 81 ARG H . . 6.880 4.090 2.873 5.257 . 0 0 "[ . 1 . 2]" 1
1202 1 80 ARG QG 1 81 ARG H . . 6.880 3.487 1.984 4.466 . 0 0 "[ . 1 . 2]" 1
1203 1 81 ARG H 1 81 ARG HB2 . . 3.300 2.079 2.033 2.116 . 0 0 "[ . 1 . 2]" 1
1204 1 81 ARG H 1 81 ARG QB . . 3.120 2.043 2.008 2.070 . 0 0 "[ . 1 . 2]" 1
1205 1 81 ARG H 1 81 ARG HB3 . . 3.300 3.012 2.931 3.117 . 0 0 "[ . 1 . 2]" 1
1206 1 81 ARG H 1 81 ARG HD2 . . 6.000 5.119 4.828 5.892 . 0 0 "[ . 1 . 2]" 1
1207 1 81 ARG H 1 81 ARG HD3 . . 6.000 5.364 4.845 5.890 . 0 0 "[ . 1 . 2]" 1
1208 1 81 ARG H 1 81 ARG HG2 . . 4.090 4.160 4.093 4.254 0.164 18 0 "[ . 1 . 2]" 1
1209 1 81 ARG H 1 81 ARG HG3 . . 4.090 4.002 3.791 4.082 . 0 0 "[ . 1 . 2]" 1
1210 1 81 ARG H 1 82 ALA H . . 3.010 3.015 2.854 3.068 0.058 14 0 "[ . 1 . 2]" 1
1211 1 81 ARG HA 1 81 ARG HG2 . . 3.230 2.142 2.064 2.247 . 0 0 "[ . 1 . 2]" 1
1212 1 81 ARG HA 1 81 ARG QG . . 3.030 2.098 2.032 2.180 . 0 0 "[ . 1 . 2]" 1
1213 1 81 ARG HA 1 81 ARG HG3 . . 3.230 3.012 2.927 3.073 . 0 0 "[ . 1 . 2]" 1
1214 1 81 ARG QB 1 82 ALA H . . 3.840 2.139 1.976 2.371 . 0 0 "[ . 1 . 2]" 1
1215 1 81 ARG HB2 1 82 ALA H . . 4.200 3.219 2.944 3.441 . 0 0 "[ . 1 . 2]" 1
1216 1 81 ARG HB3 1 82 ALA H . . 4.200 2.172 2.003 2.417 . 0 0 "[ . 1 . 2]" 1
1217 1 81 ARG QG 1 82 ALA H . . 4.710 4.119 4.061 4.194 . 0 0 "[ . 1 . 2]" 1
1218 1 81 ARG HG2 1 82 ALA H . . 5.170 4.425 4.393 4.468 . 0 0 "[ . 1 . 2]" 1
1219 1 81 ARG HG3 1 82 ALA H . . 5.170 4.909 4.769 5.083 . 0 0 "[ . 1 . 2]" 1
1220 1 82 ALA H 1 82 ALA MB . . 3.430 2.029 1.933 2.165 . 0 0 "[ . 1 . 2]" 1
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