NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
402762 |
1wfu   |
10006 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1wfu
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 2644
_Distance_constraint_stats_list.Viol_count 2064
_Distance_constraint_stats_list.Viol_total 1032.178
_Distance_constraint_stats_list.Viol_max 0.318
_Distance_constraint_stats_list.Viol_rms 0.0075
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0010
_Distance_constraint_stats_list.Viol_average_violations_only 0.0250
_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 8 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 GLU 0.060 0.060 20 0 "[ . 1 . 2]"
1 10 PRO 0.148 0.070 2 0 "[ . 1 . 2]"
1 11 HIS 0.207 0.120 8 0 "[ . 1 . 2]"
1 12 LYS 0.846 0.260 4 0 "[ . 1 . 2]"
1 13 VAL 0.630 0.120 8 0 "[ . 1 . 2]"
1 14 VAL 0.116 0.047 8 0 "[ . 1 . 2]"
1 15 PRO 2.741 0.092 19 0 "[ . 1 . 2]"
1 16 LEU 3.253 0.092 19 0 "[ . 1 . 2]"
1 17 SER 0.171 0.096 19 0 "[ . 1 . 2]"
1 18 LYS 0.410 0.096 19 0 "[ . 1 . 2]"
1 19 PRO 0.617 0.039 19 0 "[ . 1 . 2]"
1 20 HIS 1.590 0.141 9 0 "[ . 1 . 2]"
1 21 PRO 1.093 0.118 20 0 "[ . 1 . 2]"
1 22 PRO 0.661 0.061 9 0 "[ . 1 . 2]"
1 23 VAL 1.123 0.053 15 0 "[ . 1 . 2]"
1 24 VAL 1.644 0.054 17 0 "[ . 1 . 2]"
1 25 GLY 0.655 0.054 17 0 "[ . 1 . 2]"
1 26 LYS 0.933 0.073 19 0 "[ . 1 . 2]"
1 27 VAL 0.333 0.035 19 0 "[ . 1 . 2]"
1 28 THR 0.353 0.057 15 0 "[ . 1 . 2]"
1 29 HIS 0.973 0.116 19 0 "[ . 1 . 2]"
1 30 HIS 0.383 0.215 19 0 "[ . 1 . 2]"
1 31 SER 0.891 0.215 19 0 "[ . 1 . 2]"
1 32 ILE 0.494 0.093 19 0 "[ . 1 . 2]"
1 33 GLU 2.060 0.188 13 0 "[ . 1 . 2]"
1 34 LEU 1.749 0.118 19 0 "[ . 1 . 2]"
1 35 TYR 2.163 0.106 10 0 "[ . 1 . 2]"
1 36 TRP 3.178 0.191 20 0 "[ . 1 . 2]"
1 37 ASP 1.129 0.089 11 0 "[ . 1 . 2]"
1 38 LEU 3.280 0.166 13 0 "[ . 1 . 2]"
1 39 GLU 1.472 0.117 11 0 "[ . 1 . 2]"
1 40 GLN 1.754 0.191 20 0 "[ . 1 . 2]"
1 41 LYS 0.442 0.156 14 0 "[ . 1 . 2]"
1 42 GLU 0.102 0.025 10 0 "[ . 1 . 2]"
1 43 LYS 0.071 0.025 10 0 "[ . 1 . 2]"
1 44 ARG 0.189 0.033 15 0 "[ . 1 . 2]"
1 45 GLN 0.272 0.117 11 0 "[ . 1 . 2]"
1 46 GLY 0.243 0.117 11 0 "[ . 1 . 2]"
1 47 PRO 0.152 0.039 10 0 "[ . 1 . 2]"
1 48 GLN 0.099 0.060 15 0 "[ . 1 . 2]"
1 49 GLU 0.403 0.132 6 0 "[ . 1 . 2]"
1 50 GLN 0.213 0.060 15 0 "[ . 1 . 2]"
1 51 TRP 0.208 0.036 5 0 "[ . 1 . 2]"
1 52 LEU 0.306 0.046 18 0 "[ . 1 . 2]"
1 53 ARG 0.493 0.149 17 0 "[ . 1 . 2]"
1 54 PHE 0.799 0.120 7 0 "[ . 1 . 2]"
1 55 SER 1.338 0.116 18 0 "[ . 1 . 2]"
1 56 ILE 1.093 0.071 18 0 "[ . 1 . 2]"
1 57 GLU 1.137 0.138 18 0 "[ . 1 . 2]"
1 58 GLU 0.902 0.118 18 0 "[ . 1 . 2]"
1 59 GLU 0.630 0.127 18 0 "[ . 1 . 2]"
1 60 ASP 0.028 0.028 18 0 "[ . 1 . 2]"
1 61 PRO 0.133 0.037 5 0 "[ . 1 . 2]"
1 62 LYS 0.424 0.090 14 0 "[ . 1 . 2]"
1 63 MET 0.362 0.064 11 0 "[ . 1 . 2]"
1 64 HIS 0.165 0.110 8 0 "[ . 1 . 2]"
1 65 SER 0.024 0.022 3 0 "[ . 1 . 2]"
1 66 TYR 0.319 0.027 18 0 "[ . 1 . 2]"
1 67 GLY 0.091 0.063 18 0 "[ . 1 . 2]"
1 68 VAL 0.791 0.134 18 0 "[ . 1 . 2]"
1 69 ILE 0.698 0.081 20 0 "[ . 1 . 2]"
1 70 TYR 0.363 0.038 6 0 "[ . 1 . 2]"
1 71 THR 0.134 0.038 6 0 "[ . 1 . 2]"
1 72 GLY 0.143 0.020 13 0 "[ . 1 . 2]"
1 73 TYR 0.139 0.032 17 0 "[ . 1 . 2]"
1 74 ALA 0.122 0.032 17 0 "[ . 1 . 2]"
1 75 THR 0.737 0.084 12 0 "[ . 1 . 2]"
1 76 ARG 0.768 0.075 12 0 "[ . 1 . 2]"
1 77 HIS 4.073 0.177 6 0 "[ . 1 . 2]"
1 78 VAL 3.447 0.188 13 0 "[ . 1 . 2]"
1 79 VAL 1.541 0.117 19 0 "[ . 1 . 2]"
1 80 GLU 0.762 0.117 19 0 "[ . 1 . 2]"
1 81 GLY 0.097 0.048 19 0 "[ . 1 . 2]"
1 82 LEU 0.537 0.035 6 0 "[ . 1 . 2]"
1 83 GLU 0.149 0.028 15 0 "[ . 1 . 2]"
1 84 PRO 0.877 0.173 19 0 "[ . 1 . 2]"
1 85 ARG 0.842 0.147 15 0 "[ . 1 . 2]"
1 86 THR 0.211 0.027 5 0 "[ . 1 . 2]"
1 87 LEU 1.823 0.139 12 0 "[ . 1 . 2]"
1 88 TYR 2.910 0.139 12 0 "[ . 1 . 2]"
1 89 LYS 1.871 0.118 18 0 "[ . 1 . 2]"
1 90 PHE 1.097 0.127 18 0 "[ . 1 . 2]"
1 91 ARG 1.541 0.138 18 0 "[ . 1 . 2]"
1 92 LEU 1.202 0.110 9 0 "[ . 1 . 2]"
1 93 LYS 1.895 0.162 16 0 "[ . 1 . 2]"
1 94 VAL 1.765 0.162 16 0 "[ . 1 . 2]"
1 95 THR 1.871 0.149 17 0 "[ . 1 . 2]"
1 96 SER 0.688 0.095 17 0 "[ . 1 . 2]"
1 97 PRO 0.061 0.019 17 0 "[ . 1 . 2]"
1 98 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 GLY 0.868 0.071 9 0 "[ . 1 . 2]"
1 100 GLU 0.791 0.052 17 0 "[ . 1 . 2]"
1 101 TYR 0.522 0.036 7 0 "[ . 1 . 2]"
1 102 GLU 0.552 0.057 20 0 "[ . 1 . 2]"
1 103 TYR 2.032 0.158 20 0 "[ . 1 . 2]"
1 104 SER 0.312 0.042 9 0 "[ . 1 . 2]"
1 105 PRO 1.656 0.104 18 0 "[ . 1 . 2]"
1 106 VAL 1.628 0.104 18 0 "[ . 1 . 2]"
1 107 VAL 0.442 0.042 10 0 "[ . 1 . 2]"
1 108 SER 0.685 0.059 7 0 "[ . 1 . 2]"
1 109 VAL 1.830 0.091 7 0 "[ . 1 . 2]"
1 110 ALA 1.858 0.091 7 0 "[ . 1 . 2]"
1 111 THR 0.771 0.044 12 0 "[ . 1 . 2]"
1 112 THR 0.617 0.110 10 0 "[ . 1 . 2]"
1 113 ARG 0.664 0.135 15 0 "[ . 1 . 2]"
1 114 GLU 0.993 0.318 8 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 8 MET H 1 8 MET QB . . 3.660 2.607 2.264 3.207 . 0 0 "[ . 1 . 2]" 1
2 1 9 GLU H 1 9 GLU QG . . 4.640 3.017 2.205 4.015 . 0 0 "[ . 1 . 2]" 1
3 1 9 GLU HA 1 9 GLU QG . . 3.570 2.725 2.265 3.338 . 0 0 "[ . 1 . 2]" 1
4 1 9 GLU HA 1 10 PRO HD2 . . 2.930 2.253 2.099 2.396 . 0 0 "[ . 1 . 2]" 1
5 1 9 GLU HA 1 10 PRO HD3 . . 2.930 2.264 2.250 2.295 . 0 0 "[ . 1 . 2]" 1
6 1 9 GLU HA 1 10 PRO QG . . 4.480 3.915 3.831 3.998 . 0 0 "[ . 1 . 2]" 1
7 1 9 GLU QB 1 10 PRO QD . . 3.010 2.365 1.984 3.070 0.060 20 0 "[ . 1 . 2]" 1
8 1 9 GLU QG 1 10 PRO QD . . 4.380 3.255 1.829 3.986 . 0 0 "[ . 1 . 2]" 1
9 1 10 PRO HA 1 11 HIS H . . 3.500 2.511 2.154 3.570 0.070 2 0 "[ . 1 . 2]" 1
10 1 10 PRO HA 1 11 HIS QB . . 4.880 4.605 4.178 4.882 0.002 20 0 "[ . 1 . 2]" 1
11 1 10 PRO QB 1 14 VAL HA . . 5.250 3.371 2.172 3.960 . 0 0 "[ . 1 . 2]" 1
12 1 10 PRO QB 1 14 VAL QG . . 4.810 3.907 2.748 4.825 0.015 13 0 "[ . 1 . 2]" 1
13 1 10 PRO QB 1 15 PRO QD . . 3.630 2.592 2.105 3.473 . 0 0 "[ . 1 . 2]" 1
14 1 10 PRO QG 1 14 VAL H . . 5.350 4.871 4.144 5.329 . 0 0 "[ . 1 . 2]" 1
15 1 10 PRO QG 1 14 VAL HA . . 3.460 2.843 2.180 3.412 . 0 0 "[ . 1 . 2]" 1
16 1 10 PRO QG 1 14 VAL QG . . 4.570 2.912 1.880 4.233 . 0 0 "[ . 1 . 2]" 1
17 1 10 PRO QG 1 15 PRO QD . . 3.610 2.366 1.870 3.386 . 0 0 "[ . 1 . 2]" 1
18 1 11 HIS HA 1 11 HIS HD2 . . 4.870 4.509 4.001 4.851 . 0 0 "[ . 1 . 2]" 1
19 1 11 HIS HA 1 12 LYS QB . . 5.210 4.603 4.021 4.944 . 0 0 "[ . 1 . 2]" 1
20 1 11 HIS QB 1 11 HIS HD2 . . 3.570 2.812 2.625 3.221 . 0 0 "[ . 1 . 2]" 1
21 1 11 HIS QB 1 12 LYS HA . . 5.120 4.553 4.074 5.135 0.015 13 0 "[ . 1 . 2]" 1
22 1 11 HIS QB 1 13 VAL QG . . 4.620 4.186 3.358 4.585 . 0 0 "[ . 1 . 2]" 1
23 1 11 HIS HD2 1 13 VAL HB . . 5.190 4.148 2.141 5.310 0.120 8 0 "[ . 1 . 2]" 1
24 1 11 HIS HD2 1 13 VAL QG . . 4.610 3.235 1.871 4.576 . 0 0 "[ . 1 . 2]" 1
25 1 12 LYS HA 1 12 LYS QE . . 4.930 4.345 1.991 5.190 0.260 4 0 "[ . 1 . 2]" 1
26 1 12 LYS HA 1 12 LYS QG . . 3.460 2.881 2.159 3.441 . 0 0 "[ . 1 . 2]" 1
27 1 12 LYS HA 1 13 VAL HA . . 4.730 4.563 4.325 4.750 0.020 16 0 "[ . 1 . 2]" 1
28 1 12 LYS HA 1 13 VAL QG . . 4.630 4.436 4.130 4.642 0.012 2 0 "[ . 1 . 2]" 1
29 1 12 LYS QB 1 12 LYS QE . . 4.450 2.644 1.949 3.677 . 0 0 "[ . 1 . 2]" 1
30 1 12 LYS QB 1 13 VAL H . . 3.940 3.128 2.011 3.974 0.034 1 0 "[ . 1 . 2]" 1
31 1 12 LYS QB 1 13 VAL QG . . 3.790 3.277 2.471 3.898 0.108 8 0 "[ . 1 . 2]" 1
32 1 12 LYS QE 1 12 LYS QG . . 3.330 2.278 2.021 2.732 . 0 0 "[ . 1 . 2]" 1
33 1 12 LYS QE 1 13 VAL QG . . 4.440 3.730 2.268 4.515 0.075 1 0 "[ . 1 . 2]" 1
34 1 12 LYS QG 1 13 VAL H . . 4.890 3.177 1.990 4.768 . 0 0 "[ . 1 . 2]" 1
35 1 13 VAL H 1 13 VAL HB . . 3.780 2.914 2.477 3.636 . 0 0 "[ . 1 . 2]" 1
36 1 13 VAL H 1 13 VAL MG1 . . 4.600 3.287 1.872 3.906 . 0 0 "[ . 1 . 2]" 1
37 1 13 VAL H 1 13 VAL QG . . 3.200 2.331 1.845 3.206 0.006 1 0 "[ . 1 . 2]" 1
38 1 13 VAL H 1 13 VAL MG2 . . 4.600 2.801 1.891 4.022 . 0 0 "[ . 1 . 2]" 1
39 1 13 VAL H 1 14 VAL H . . 4.710 4.468 4.113 4.618 . 0 0 "[ . 1 . 2]" 1
40 1 13 VAL HA 1 13 VAL MG1 . . 3.250 2.574 2.110 3.194 . 0 0 "[ . 1 . 2]" 1
41 1 13 VAL HA 1 13 VAL QG . . 2.750 2.180 2.035 2.391 . 0 0 "[ . 1 . 2]" 1
42 1 13 VAL HA 1 13 VAL MG2 . . 3.250 2.474 2.172 3.202 . 0 0 "[ . 1 . 2]" 1
43 1 13 VAL HA 1 14 VAL H . . 2.510 2.223 2.174 2.349 . 0 0 "[ . 1 . 2]" 1
44 1 13 VAL HA 1 14 VAL HA . . 4.490 4.377 4.335 4.416 . 0 0 "[ . 1 . 2]" 1
45 1 13 VAL HA 1 14 VAL HB . . 4.700 4.565 4.407 4.701 0.001 10 0 "[ . 1 . 2]" 1
46 1 13 VAL HB 1 14 VAL H . . 4.090 3.843 2.513 4.102 0.012 1 0 "[ . 1 . 2]" 1
47 1 13 VAL QG 1 14 VAL H . . 3.670 2.297 1.888 3.269 . 0 0 "[ . 1 . 2]" 1
48 1 13 VAL QG 1 14 VAL HA . . 3.970 3.657 3.389 4.017 0.047 8 0 "[ . 1 . 2]" 1
49 1 14 VAL H 1 14 VAL HB . . 3.090 2.754 2.495 3.112 0.022 8 0 "[ . 1 . 2]" 1
50 1 14 VAL H 1 14 VAL MG1 . . 4.060 2.887 1.891 3.879 . 0 0 "[ . 1 . 2]" 1
51 1 14 VAL H 1 14 VAL QG . . 2.960 2.246 1.887 2.869 . 0 0 "[ . 1 . 2]" 1
52 1 14 VAL H 1 14 VAL MG2 . . 4.060 3.197 2.192 3.916 . 0 0 "[ . 1 . 2]" 1
53 1 14 VAL H 1 15 PRO HD2 . . 5.110 4.771 4.635 4.836 . 0 0 "[ . 1 . 2]" 1
54 1 14 VAL H 1 15 PRO HD3 . . 5.110 4.610 4.245 4.892 . 0 0 "[ . 1 . 2]" 1
55 1 14 VAL HA 1 14 VAL MG1 . . 3.220 2.813 2.368 3.201 . 0 0 "[ . 1 . 2]" 1
56 1 14 VAL HA 1 14 VAL QG . . 2.720 2.212 2.095 2.366 . 0 0 "[ . 1 . 2]" 1
57 1 14 VAL HA 1 14 VAL MG2 . . 3.220 2.359 2.204 2.441 . 0 0 "[ . 1 . 2]" 1
58 1 14 VAL HA 1 15 PRO QB . . 5.230 4.551 4.534 4.588 . 0 0 "[ . 1 . 2]" 1
59 1 14 VAL HA 1 15 PRO HD2 . . 2.770 2.012 1.923 2.152 . 0 0 "[ . 1 . 2]" 1
60 1 14 VAL HA 1 15 PRO HD3 . . 2.770 2.314 2.253 2.420 . 0 0 "[ . 1 . 2]" 1
61 1 14 VAL HB 1 15 PRO QD . . 4.230 3.860 3.467 4.237 0.007 12 0 "[ . 1 . 2]" 1
62 1 14 VAL QG 1 15 PRO QB . . 5.060 4.114 3.850 4.325 . 0 0 "[ . 1 . 2]" 1
63 1 14 VAL QG 1 15 PRO QD . . 3.140 2.151 1.838 2.577 . 0 0 "[ . 1 . 2]" 1
64 1 14 VAL QG 1 15 PRO HG2 . . 4.890 3.369 2.943 3.732 . 0 0 "[ . 1 . 2]" 1
65 1 14 VAL QG 1 16 LEU H . . 5.060 4.813 4.603 4.980 . 0 0 "[ . 1 . 2]" 1
66 1 15 PRO HA 1 16 LEU H . . 2.500 2.383 2.380 2.394 . 0 0 "[ . 1 . 2]" 1
67 1 15 PRO HA 1 16 LEU QB . . 4.490 4.341 4.087 4.505 0.015 19 0 "[ . 1 . 2]" 1
68 1 15 PRO HA 1 100 GLU HB2 . . 4.740 4.322 3.974 4.757 0.017 17 0 "[ . 1 . 2]" 1
69 1 15 PRO HA 1 100 GLU HB3 . . 4.000 3.195 2.646 3.658 . 0 0 "[ . 1 . 2]" 1
70 1 15 PRO QB 1 16 LEU H . . 3.220 2.580 2.553 2.587 . 0 0 "[ . 1 . 2]" 1
71 1 15 PRO HB2 1 16 LEU H . . 3.760 2.659 2.629 2.668 . 0 0 "[ . 1 . 2]" 1
72 1 15 PRO HB3 1 16 LEU H . . 3.760 3.477 3.462 3.482 . 0 0 "[ . 1 . 2]" 1
73 1 15 PRO HD2 1 16 LEU H . . 5.500 5.590 5.583 5.592 0.092 19 0 "[ . 1 . 2]" 1
74 1 15 PRO HD3 1 16 LEU H . . 5.500 5.545 5.540 5.546 0.046 9 0 "[ . 1 . 2]" 1
75 1 15 PRO HG2 1 16 LEU H . . 4.590 4.457 4.435 4.464 . 0 0 "[ . 1 . 2]" 1
76 1 16 LEU H 1 16 LEU QB . . 2.750 2.465 2.203 2.722 . 0 0 "[ . 1 . 2]" 1
77 1 16 LEU H 1 16 LEU MD1 . . 4.440 3.576 1.837 4.073 . 0 0 "[ . 1 . 2]" 1
78 1 16 LEU H 1 16 LEU QD . . 3.740 2.422 1.709 3.046 . 0 0 "[ . 1 . 2]" 1
79 1 16 LEU H 1 16 LEU MD2 . . 4.440 2.547 1.840 3.315 . 0 0 "[ . 1 . 2]" 1
80 1 16 LEU H 1 16 LEU HG . . 3.900 2.864 1.999 3.917 0.017 10 0 "[ . 1 . 2]" 1
81 1 16 LEU H 1 17 SER H . . 5.140 4.601 4.552 4.635 . 0 0 "[ . 1 . 2]" 1
82 1 16 LEU H 1 100 GLU HB2 . . 4.080 3.476 2.960 3.883 . 0 0 "[ . 1 . 2]" 1
83 1 16 LEU H 1 100 GLU HB3 . . 4.030 2.414 2.031 2.704 . 0 0 "[ . 1 . 2]" 1
84 1 16 LEU H 1 101 TYR H . . 4.700 4.335 3.754 4.718 0.018 7 0 "[ . 1 . 2]" 1
85 1 16 LEU HA 1 17 SER H . . 2.810 2.418 2.186 2.551 . 0 0 "[ . 1 . 2]" 1
86 1 16 LEU HA 1 17 SER QB . . 4.890 4.500 4.059 4.705 . 0 0 "[ . 1 . 2]" 1
87 1 16 LEU HA 1 100 GLU HB2 . . 5.500 5.268 4.607 5.523 0.023 20 0 "[ . 1 . 2]" 1
88 1 16 LEU HA 1 100 GLU HB3 . . 5.500 4.910 4.208 5.218 . 0 0 "[ . 1 . 2]" 1
89 1 16 LEU QB 1 16 LEU MD1 . . 3.170 2.031 1.941 2.146 . 0 0 "[ . 1 . 2]" 1
90 1 16 LEU QB 1 16 LEU QD . . 2.700 1.848 1.759 1.935 . 0 0 "[ . 1 . 2]" 1
91 1 16 LEU QB 1 16 LEU MD2 . . 3.170 2.152 1.957 2.511 . 0 0 "[ . 1 . 2]" 1
92 1 16 LEU QB 1 16 LEU HG . . 2.650 2.417 2.147 2.486 . 0 0 "[ . 1 . 2]" 1
93 1 16 LEU QB 1 17 SER H . . 3.480 2.445 2.085 2.984 . 0 0 "[ . 1 . 2]" 1
94 1 16 LEU QB 1 17 SER HA . . 4.850 4.668 4.450 4.837 . 0 0 "[ . 1 . 2]" 1
95 1 16 LEU QB 1 17 SER QB . . 4.550 4.293 3.979 4.555 0.005 3 0 "[ . 1 . 2]" 1
96 1 16 LEU QB 1 94 VAL MG2 . . 4.920 4.247 3.743 4.615 . 0 0 "[ . 1 . 2]" 1
97 1 16 LEU QB 1 96 SER HB2 . . 4.750 3.893 3.387 4.430 . 0 0 "[ . 1 . 2]" 1
98 1 16 LEU QB 1 96 SER QB . . 4.040 3.415 3.089 3.881 . 0 0 "[ . 1 . 2]" 1
99 1 16 LEU QB 1 96 SER HB3 . . 4.750 4.062 3.212 4.776 0.026 15 0 "[ . 1 . 2]" 1
100 1 16 LEU QB 1 100 GLU HB2 . . 4.050 3.193 2.252 3.683 . 0 0 "[ . 1 . 2]" 1
101 1 16 LEU QB 1 100 GLU QG . . 4.480 4.025 3.207 4.499 0.019 7 0 "[ . 1 . 2]" 1
102 1 16 LEU QB 1 101 TYR H . . 5.500 5.186 4.364 5.536 0.036 16 0 "[ . 1 . 2]" 1
103 1 16 LEU QD 1 17 SER H . . 3.660 3.172 2.505 3.618 . 0 0 "[ . 1 . 2]" 1
104 1 16 LEU QD 1 18 LYS HA . . 4.460 3.575 2.960 4.284 . 0 0 "[ . 1 . 2]" 1
105 1 16 LEU QD 1 19 PRO HD2 . . 4.910 4.431 4.018 4.921 0.011 1 0 "[ . 1 . 2]" 1
106 1 16 LEU QD 1 94 VAL H . . 5.440 4.500 4.298 4.968 . 0 0 "[ . 1 . 2]" 1
107 1 16 LEU QD 1 94 VAL MG2 . . 3.300 2.015 1.803 2.564 . 0 0 "[ . 1 . 2]" 1
108 1 16 LEU QD 1 95 THR H . . 5.440 4.423 4.133 5.004 . 0 0 "[ . 1 . 2]" 1
109 1 16 LEU QD 1 95 THR HA . . 3.950 3.143 2.722 3.566 . 0 0 "[ . 1 . 2]" 1
110 1 16 LEU QD 1 96 SER H . . 3.630 2.366 2.163 2.721 . 0 0 "[ . 1 . 2]" 1
111 1 16 LEU QD 1 96 SER QB . . 3.000 2.342 1.794 2.826 . 0 0 "[ . 1 . 2]" 1
112 1 16 LEU QD 1 100 GLU H . . 4.590 4.130 3.796 4.478 . 0 0 "[ . 1 . 2]" 1
113 1 16 LEU QD 1 100 GLU HB2 . . 3.910 2.265 1.898 2.704 . 0 0 "[ . 1 . 2]" 1
114 1 16 LEU QD 1 100 GLU HB3 . . 3.330 2.200 1.788 2.761 . 0 0 "[ . 1 . 2]" 1
115 1 16 LEU QD 1 100 GLU QG . . 4.190 3.563 2.905 4.009 . 0 0 "[ . 1 . 2]" 1
116 1 16 LEU QD 1 101 TYR H . . 3.820 2.875 2.410 3.443 . 0 0 "[ . 1 . 2]" 1
117 1 16 LEU QD 1 101 TYR HA . . 3.500 2.218 1.916 2.547 . 0 0 "[ . 1 . 2]" 1
118 1 16 LEU QD 1 101 TYR HB2 . . 4.780 4.095 3.855 4.329 . 0 0 "[ . 1 . 2]" 1
119 1 16 LEU QD 1 102 GLU H . . 3.940 2.859 2.235 3.284 . 0 0 "[ . 1 . 2]" 1
120 1 16 LEU QD 1 102 GLU HA . . 4.810 3.739 3.284 4.017 . 0 0 "[ . 1 . 2]" 1
121 1 16 LEU QD 1 102 GLU HB2 . . 3.440 2.173 1.850 2.767 . 0 0 "[ . 1 . 2]" 1
122 1 16 LEU QD 1 102 GLU HG2 . . 3.320 2.182 1.839 2.658 . 0 0 "[ . 1 . 2]" 1
123 1 16 LEU QD 1 102 GLU HG3 . . 4.170 2.438 1.946 3.379 . 0 0 "[ . 1 . 2]" 1
124 1 16 LEU MD1 1 94 VAL MG2 . . 3.810 2.162 1.856 3.457 . 0 0 "[ . 1 . 2]" 1
125 1 16 LEU MD1 1 101 TYR H . . 4.620 4.304 2.613 4.646 0.026 6 0 "[ . 1 . 2]" 1
126 1 16 LEU MD1 1 101 TYR HB2 . . 5.500 5.020 4.420 5.367 . 0 0 "[ . 1 . 2]" 1
127 1 16 LEU MD1 1 102 GLU H . . 4.570 3.378 2.787 4.048 . 0 0 "[ . 1 . 2]" 1
128 1 16 LEU MD1 1 102 GLU HA . . 5.500 4.552 3.629 5.252 . 0 0 "[ . 1 . 2]" 1
129 1 16 LEU MD1 1 102 GLU HG2 . . 3.940 3.059 1.970 3.943 0.003 14 0 "[ . 1 . 2]" 1
130 1 16 LEU MD2 1 94 VAL MG2 . . 3.810 2.785 2.139 3.487 . 0 0 "[ . 1 . 2]" 1
131 1 16 LEU MD2 1 101 TYR H . . 4.620 3.050 2.421 3.928 . 0 0 "[ . 1 . 2]" 1
132 1 16 LEU MD2 1 101 TYR HB2 . . 5.500 4.377 4.003 4.966 . 0 0 "[ . 1 . 2]" 1
133 1 16 LEU MD2 1 102 GLU H . . 4.570 3.186 2.268 3.687 . 0 0 "[ . 1 . 2]" 1
134 1 16 LEU MD2 1 102 GLU HA . . 5.500 4.370 3.317 5.296 . 0 0 "[ . 1 . 2]" 1
135 1 16 LEU MD2 1 102 GLU HG2 . . 3.940 2.899 1.848 3.971 0.031 7 0 "[ . 1 . 2]" 1
136 1 16 LEU HG 1 94 VAL MG2 . . 4.310 3.849 2.920 4.317 0.007 17 0 "[ . 1 . 2]" 1
137 1 16 LEU HG 1 96 SER QB . . 5.340 4.725 3.278 5.403 0.063 5 0 "[ . 1 . 2]" 1
138 1 17 SER H 1 17 SER QB . . 3.200 2.419 2.153 2.665 . 0 0 "[ . 1 . 2]" 1
139 1 17 SER H 1 18 LYS H . . 4.840 4.596 4.528 4.637 . 0 0 "[ . 1 . 2]" 1
140 1 17 SER HA 1 18 LYS H . . 2.780 2.273 2.152 2.477 . 0 0 "[ . 1 . 2]" 1
141 1 17 SER HA 1 18 LYS HA . . 4.630 4.323 4.298 4.347 . 0 0 "[ . 1 . 2]" 1
142 1 17 SER HA 1 18 LYS HB2 . . 4.620 4.456 4.311 4.600 . 0 0 "[ . 1 . 2]" 1
143 1 17 SER HA 1 18 LYS QG . . 4.700 4.354 4.106 4.796 0.096 19 0 "[ . 1 . 2]" 1
144 1 17 SER QB 1 18 LYS H . . 3.240 2.813 2.249 3.190 . 0 0 "[ . 1 . 2]" 1
145 1 17 SER QB 1 18 LYS HB2 . . 4.660 4.404 4.050 4.698 0.038 7 0 "[ . 1 . 2]" 1
146 1 18 LYS H 1 18 LYS HB2 . . 3.070 2.238 2.182 2.375 . 0 0 "[ . 1 . 2]" 1
147 1 18 LYS H 1 18 LYS HB3 . . 3.550 3.521 3.491 3.578 0.028 5 0 "[ . 1 . 2]" 1
148 1 18 LYS H 1 18 LYS QD . . 4.510 3.703 1.826 4.185 . 0 0 "[ . 1 . 2]" 1
149 1 18 LYS H 1 18 LYS HG2 . . 4.200 3.973 3.583 4.200 0.000 14 0 "[ . 1 . 2]" 1
150 1 18 LYS H 1 18 LYS QG . . 3.410 2.850 2.522 3.346 . 0 0 "[ . 1 . 2]" 1
151 1 18 LYS H 1 18 LYS HG3 . . 4.200 2.931 2.559 3.597 . 0 0 "[ . 1 . 2]" 1
152 1 18 LYS H 1 19 PRO HD2 . . 5.090 4.795 4.750 4.838 . 0 0 "[ . 1 . 2]" 1
153 1 18 LYS H 1 102 GLU HB3 . . 5.090 4.734 4.380 5.087 . 0 0 "[ . 1 . 2]" 1
154 1 18 LYS HA 1 18 LYS QD . . 4.060 3.882 2.971 4.070 0.010 12 0 "[ . 1 . 2]" 1
155 1 18 LYS HA 1 18 LYS HG2 . . 3.990 2.620 2.246 3.628 . 0 0 "[ . 1 . 2]" 1
156 1 18 LYS HA 1 18 LYS QG . . 3.290 2.278 2.188 2.344 . 0 0 "[ . 1 . 2]" 1
157 1 18 LYS HA 1 18 LYS HG3 . . 3.990 2.666 2.330 3.021 . 0 0 "[ . 1 . 2]" 1
158 1 18 LYS HA 1 19 PRO HB3 . . 4.870 4.833 4.831 4.839 . 0 0 "[ . 1 . 2]" 1
159 1 18 LYS HA 1 19 PRO HD2 . . 3.240 2.159 2.103 2.211 . 0 0 "[ . 1 . 2]" 1
160 1 18 LYS HA 1 19 PRO HD3 . . 3.210 2.255 2.254 2.262 . 0 0 "[ . 1 . 2]" 1
161 1 18 LYS HA 1 19 PRO HG2 . . 4.350 4.319 4.275 4.361 0.011 4 0 "[ . 1 . 2]" 1
162 1 18 LYS HA 1 19 PRO HG3 . . 4.490 4.353 4.334 4.374 . 0 0 "[ . 1 . 2]" 1
163 1 18 LYS HA 1 102 GLU HA . . 5.500 4.656 4.507 4.913 . 0 0 "[ . 1 . 2]" 1
164 1 18 LYS HA 1 102 GLU HB2 . . 4.000 2.831 2.594 3.017 . 0 0 "[ . 1 . 2]" 1
165 1 18 LYS HA 1 102 GLU HB3 . . 3.740 2.143 1.986 2.420 . 0 0 "[ . 1 . 2]" 1
166 1 18 LYS HA 1 102 GLU HG2 . . 4.130 3.925 3.567 4.140 0.010 7 0 "[ . 1 . 2]" 1
167 1 18 LYS HA 1 102 GLU HG3 . . 4.510 2.453 2.177 2.716 . 0 0 "[ . 1 . 2]" 1
168 1 18 LYS HA 1 104 SER HA . . 5.500 5.288 5.025 5.471 . 0 0 "[ . 1 . 2]" 1
169 1 18 LYS HB2 1 18 LYS QE . . 4.490 3.780 2.427 4.277 . 0 0 "[ . 1 . 2]" 1
170 1 18 LYS HB2 1 18 LYS QG . . 2.610 2.372 2.255 2.480 . 0 0 "[ . 1 . 2]" 1
171 1 18 LYS HB2 1 19 PRO HD2 . . 4.320 4.144 4.075 4.238 . 0 0 "[ . 1 . 2]" 1
172 1 18 LYS HB2 1 19 PRO HD3 . . 5.500 5.001 4.968 5.045 . 0 0 "[ . 1 . 2]" 1
173 1 18 LYS HB3 1 18 LYS QE . . 4.600 3.848 2.341 4.447 . 0 0 "[ . 1 . 2]" 1
174 1 18 LYS HB3 1 19 PRO HD2 . . 4.120 2.809 2.702 2.953 . 0 0 "[ . 1 . 2]" 1
175 1 18 LYS QD 1 19 PRO HD2 . . 4.600 4.306 3.629 4.639 0.039 19 0 "[ . 1 . 2]" 1
176 1 18 LYS QE 1 18 LYS HG2 . . 3.740 2.548 2.112 3.221 . 0 0 "[ . 1 . 2]" 1
177 1 18 LYS QE 1 18 LYS QG . . 3.110 2.175 2.021 2.317 . 0 0 "[ . 1 . 2]" 1
178 1 18 LYS QE 1 18 LYS HG3 . . 3.740 2.562 2.084 3.232 . 0 0 "[ . 1 . 2]" 1
179 1 18 LYS QE 1 102 GLU HA . . 5.500 5.232 4.325 5.521 0.021 8 0 "[ . 1 . 2]" 1
180 1 18 LYS QG 1 19 PRO HD2 . . 3.690 2.799 2.636 3.200 . 0 0 "[ . 1 . 2]" 1
181 1 18 LYS QG 1 19 PRO HD3 . . 4.130 3.819 3.678 4.087 . 0 0 "[ . 1 . 2]" 1
182 1 18 LYS QG 1 102 GLU HB3 . . 4.080 2.598 2.165 3.023 . 0 0 "[ . 1 . 2]" 1
183 1 18 LYS QG 1 102 GLU HG2 . . 4.570 4.041 3.792 4.309 . 0 0 "[ . 1 . 2]" 1
184 1 18 LYS QG 1 102 GLU HG3 . . 3.980 2.888 2.279 3.285 . 0 0 "[ . 1 . 2]" 1
185 1 18 LYS QG 1 103 TYR H . . 3.790 2.882 2.408 3.611 . 0 0 "[ . 1 . 2]" 1
186 1 18 LYS HG2 1 19 PRO HD2 . . 4.300 2.958 2.677 4.303 0.003 5 0 "[ . 1 . 2]" 1
187 1 18 LYS HG2 1 102 GLU HG3 . . 4.610 3.667 2.806 4.550 . 0 0 "[ . 1 . 2]" 1
188 1 18 LYS HG3 1 19 PRO HD2 . . 4.300 3.951 3.293 4.289 . 0 0 "[ . 1 . 2]" 1
189 1 18 LYS HG3 1 102 GLU HG3 . . 4.610 3.106 2.293 3.584 . 0 0 "[ . 1 . 2]" 1
190 1 19 PRO HA 1 20 HIS H . . 2.790 2.267 2.177 2.456 . 0 0 "[ . 1 . 2]" 1
191 1 19 PRO HA 1 20 HIS HD2 . . 4.860 3.857 2.789 4.684 . 0 0 "[ . 1 . 2]" 1
192 1 19 PRO HA 1 94 VAL MG1 . . 4.420 3.677 3.517 3.879 . 0 0 "[ . 1 . 2]" 1
193 1 19 PRO HB2 1 20 HIS H . . 3.760 3.017 2.475 3.355 . 0 0 "[ . 1 . 2]" 1
194 1 19 PRO HB2 1 92 LEU MD1 . . 4.380 4.210 4.123 4.330 . 0 0 "[ . 1 . 2]" 1
195 1 19 PRO HB2 1 92 LEU QD . . 3.470 2.717 2.389 3.035 . 0 0 "[ . 1 . 2]" 1
196 1 19 PRO HB2 1 92 LEU MD2 . . 4.380 2.755 2.402 3.106 . 0 0 "[ . 1 . 2]" 1
197 1 19 PRO HB2 1 92 LEU HG . . 4.210 2.740 2.549 2.850 . 0 0 "[ . 1 . 2]" 1
198 1 19 PRO HB2 1 94 VAL MG1 . . 3.980 2.659 2.505 2.830 . 0 0 "[ . 1 . 2]" 1
199 1 19 PRO HB2 1 104 SER HA . . 4.360 4.176 4.032 4.326 . 0 0 "[ . 1 . 2]" 1
200 1 19 PRO HB3 1 20 HIS H . . 3.860 3.681 3.384 3.883 0.023 9 0 "[ . 1 . 2]" 1
201 1 19 PRO HB3 1 92 LEU MD1 . . 4.650 4.661 4.632 4.679 0.029 9 0 "[ . 1 . 2]" 1
202 1 19 PRO HB3 1 92 LEU QD . . 3.800 3.600 3.405 3.796 . 0 0 "[ . 1 . 2]" 1
203 1 19 PRO HB3 1 92 LEU MD2 . . 4.650 3.752 3.502 4.022 . 0 0 "[ . 1 . 2]" 1
204 1 19 PRO HB3 1 94 VAL MG1 . . 3.760 1.858 1.767 2.021 . 0 0 "[ . 1 . 2]" 1
205 1 19 PRO HB3 1 94 VAL MG2 . . 3.820 2.670 2.452 2.960 . 0 0 "[ . 1 . 2]" 1
206 1 19 PRO HB3 1 104 SER H . . 5.500 5.426 5.169 5.521 0.021 10 0 "[ . 1 . 2]" 1
207 1 19 PRO HB3 1 104 SER HB3 . . 4.480 4.309 4.051 4.487 0.007 6 0 "[ . 1 . 2]" 1
208 1 19 PRO HD2 1 94 VAL MG1 . . 4.420 4.379 4.273 4.446 0.026 3 0 "[ . 1 . 2]" 1
209 1 19 PRO HD2 1 94 VAL MG2 . . 4.940 3.991 3.654 4.274 . 0 0 "[ . 1 . 2]" 1
210 1 19 PRO HD2 1 102 GLU HA . . 5.270 4.517 4.391 4.647 . 0 0 "[ . 1 . 2]" 1
211 1 19 PRO HD2 1 102 GLU HB2 . . 4.290 3.181 3.015 3.335 . 0 0 "[ . 1 . 2]" 1
212 1 19 PRO HD2 1 102 GLU HB3 . . 3.840 2.098 1.982 2.335 . 0 0 "[ . 1 . 2]" 1
213 1 19 PRO HD2 1 103 TYR H . . 4.860 2.757 2.542 3.236 . 0 0 "[ . 1 . 2]" 1
214 1 19 PRO HD2 1 104 SER H . . 4.500 4.257 4.021 4.417 . 0 0 "[ . 1 . 2]" 1
215 1 19 PRO HD3 1 94 VAL MG1 . . 3.960 3.501 3.337 3.605 . 0 0 "[ . 1 . 2]" 1
216 1 19 PRO HD3 1 94 VAL MG2 . . 4.250 2.613 2.295 2.905 . 0 0 "[ . 1 . 2]" 1
217 1 19 PRO HD3 1 102 GLU HB2 . . 3.900 2.001 1.967 2.076 . 0 0 "[ . 1 . 2]" 1
218 1 19 PRO HD3 1 102 GLU HB3 . . 3.280 2.118 1.988 2.377 . 0 0 "[ . 1 . 2]" 1
219 1 19 PRO HD3 1 102 GLU HG3 . . 4.770 3.534 3.337 3.823 . 0 0 "[ . 1 . 2]" 1
220 1 19 PRO HG2 1 92 LEU H . . 5.500 5.143 4.659 5.308 . 0 0 "[ . 1 . 2]" 1
221 1 19 PRO HG2 1 92 LEU HB3 . . 4.420 4.315 4.058 4.432 0.012 2 0 "[ . 1 . 2]" 1
222 1 19 PRO HG2 1 92 LEU QD . . 4.960 4.155 3.924 4.458 . 0 0 "[ . 1 . 2]" 1
223 1 19 PRO HG2 1 94 VAL MG1 . . 3.490 3.348 3.231 3.474 . 0 0 "[ . 1 . 2]" 1
224 1 19 PRO HG2 1 103 TYR HA . . 4.660 3.229 2.971 3.412 . 0 0 "[ . 1 . 2]" 1
225 1 19 PRO HG2 1 103 TYR HB3 . . 5.500 4.929 4.732 5.079 . 0 0 "[ . 1 . 2]" 1
226 1 19 PRO HG2 1 104 SER H . . 3.940 2.752 2.583 2.865 . 0 0 "[ . 1 . 2]" 1
227 1 19 PRO HG2 1 104 SER HA . . 4.120 2.616 2.395 2.823 . 0 0 "[ . 1 . 2]" 1
228 1 19 PRO HG2 1 104 SER HB2 . . 4.210 3.207 2.988 3.433 . 0 0 "[ . 1 . 2]" 1
229 1 19 PRO HG2 1 104 SER HB3 . . 3.870 2.339 2.025 2.521 . 0 0 "[ . 1 . 2]" 1
230 1 19 PRO HG3 1 94 VAL MG1 . . 3.880 2.060 1.971 2.204 . 0 0 "[ . 1 . 2]" 1
231 1 19 PRO HG3 1 104 SER H . . 3.950 3.640 3.421 3.829 . 0 0 "[ . 1 . 2]" 1
232 1 19 PRO HG3 1 104 SER HA . . 4.700 4.347 4.113 4.570 . 0 0 "[ . 1 . 2]" 1
233 1 19 PRO HG3 1 104 SER HB3 . . 4.100 3.584 3.322 3.839 . 0 0 "[ . 1 . 2]" 1
234 1 20 HIS H 1 20 HIS HB2 . . 3.790 3.027 2.880 3.504 . 0 0 "[ . 1 . 2]" 1
235 1 20 HIS H 1 20 HIS QB . . 3.010 2.817 2.770 2.972 . 0 0 "[ . 1 . 2]" 1
236 1 20 HIS H 1 20 HIS HB3 . . 3.790 3.508 3.036 3.722 . 0 0 "[ . 1 . 2]" 1
237 1 20 HIS H 1 20 HIS HD2 . . 4.150 2.989 2.246 3.916 . 0 0 "[ . 1 . 2]" 1
238 1 20 HIS H 1 21 PRO HD2 . . 4.920 4.760 4.717 4.787 . 0 0 "[ . 1 . 2]" 1
239 1 20 HIS H 1 92 LEU QD . . 4.610 3.655 3.031 4.136 . 0 0 "[ . 1 . 2]" 1
240 1 20 HIS HA 1 20 HIS HD2 . . 4.200 3.277 2.907 4.341 0.141 9 0 "[ . 1 . 2]" 1
241 1 20 HIS HA 1 21 PRO HD2 . . 3.220 2.484 2.453 2.551 . 0 0 "[ . 1 . 2]" 1
242 1 20 HIS HA 1 21 PRO HD3 . . 3.230 2.335 2.320 2.369 . 0 0 "[ . 1 . 2]" 1
243 1 20 HIS HA 1 104 SER HB2 . . 4.350 3.557 3.141 3.798 . 0 0 "[ . 1 . 2]" 1
244 1 20 HIS HA 1 105 PRO HD2 . . 4.360 3.303 2.913 3.432 . 0 0 "[ . 1 . 2]" 1
245 1 20 HIS HA 1 105 PRO HD3 . . 4.430 3.904 3.482 4.078 . 0 0 "[ . 1 . 2]" 1
246 1 20 HIS QB 1 21 PRO HD2 . . 3.280 1.925 1.898 1.942 . 0 0 "[ . 1 . 2]" 1
247 1 20 HIS QB 1 21 PRO HD3 . . 3.510 3.179 3.147 3.207 . 0 0 "[ . 1 . 2]" 1
248 1 20 HIS QB 1 21 PRO HG2 . . 4.160 3.715 3.526 3.773 . 0 0 "[ . 1 . 2]" 1
249 1 20 HIS QB 1 21 PRO HG3 . . 4.390 4.402 4.306 4.443 0.053 1 0 "[ . 1 . 2]" 1
250 1 20 HIS HB2 1 21 PRO HD2 . . 3.790 2.789 1.941 3.053 . 0 0 "[ . 1 . 2]" 1
251 1 20 HIS HB2 1 21 PRO HD3 . . 4.270 4.072 3.394 4.280 0.010 1 0 "[ . 1 . 2]" 1
252 1 20 HIS HB2 1 21 PRO HG2 . . 4.800 4.359 3.619 4.599 . 0 0 "[ . 1 . 2]" 1
253 1 20 HIS HB3 1 21 PRO HD2 . . 3.790 2.101 1.927 2.740 . 0 0 "[ . 1 . 2]" 1
254 1 20 HIS HB3 1 21 PRO HD3 . . 4.270 3.380 3.253 3.776 . 0 0 "[ . 1 . 2]" 1
255 1 20 HIS HB3 1 21 PRO HG2 . . 4.800 4.186 4.000 4.918 0.118 20 0 "[ . 1 . 2]" 1
256 1 20 HIS HD2 1 21 PRO HD2 . . 5.080 4.701 4.411 4.915 . 0 0 "[ . 1 . 2]" 1
257 1 20 HIS HE1 1 39 GLU QB . . 4.460 3.905 2.586 4.534 0.074 9 0 "[ . 1 . 2]" 1
258 1 20 HIS HE1 1 39 GLU QG . . 4.880 3.531 2.447 4.897 0.017 10 0 "[ . 1 . 2]" 1
259 1 21 PRO HA 1 22 PRO HD2 . . 3.510 2.135 2.096 2.165 . 0 0 "[ . 1 . 2]" 1
260 1 21 PRO HA 1 22 PRO HD3 . . 3.550 2.265 2.261 2.273 . 0 0 "[ . 1 . 2]" 1
261 1 21 PRO HA 1 92 LEU HB2 . . 4.690 4.372 4.061 4.691 0.001 6 0 "[ . 1 . 2]" 1
262 1 21 PRO HA 1 92 LEU HB3 . . 4.850 3.548 3.293 3.732 . 0 0 "[ . 1 . 2]" 1
263 1 21 PRO HA 1 92 LEU QD . . 4.590 3.622 3.388 4.054 . 0 0 "[ . 1 . 2]" 1
264 1 21 PRO HA 1 104 SER HB2 . . 4.730 2.994 2.794 3.222 . 0 0 "[ . 1 . 2]" 1
265 1 21 PRO HA 1 104 SER HB3 . . 4.580 4.102 3.839 4.363 . 0 0 "[ . 1 . 2]" 1
266 1 21 PRO HA 1 105 PRO HD2 . . 4.870 3.242 3.072 3.461 . 0 0 "[ . 1 . 2]" 1
267 1 21 PRO HB2 1 22 PRO HD2 . . 3.900 3.017 2.937 3.123 . 0 0 "[ . 1 . 2]" 1
268 1 21 PRO HB2 1 104 SER HG . . 4.690 4.494 4.196 4.709 0.019 20 0 "[ . 1 . 2]" 1
269 1 21 PRO HB2 1 105 PRO HD2 . . 5.160 4.824 4.644 5.041 . 0 0 "[ . 1 . 2]" 1
270 1 21 PRO HB2 1 107 VAL MG1 . . 3.560 1.994 1.858 2.150 . 0 0 "[ . 1 . 2]" 1
271 1 21 PRO HB3 1 22 PRO HD2 . . 3.940 3.258 3.207 3.328 . 0 0 "[ . 1 . 2]" 1
272 1 21 PRO HB3 1 104 SER HB2 . . 4.800 4.233 4.045 4.473 . 0 0 "[ . 1 . 2]" 1
273 1 21 PRO HB3 1 104 SER HG . . 4.520 3.373 2.956 3.633 . 0 0 "[ . 1 . 2]" 1
274 1 21 PRO HB3 1 105 PRO HB2 . . 4.020 3.904 3.727 4.016 . 0 0 "[ . 1 . 2]" 1
275 1 21 PRO HB3 1 105 PRO HD2 . . 4.370 3.277 3.089 3.504 . 0 0 "[ . 1 . 2]" 1
276 1 21 PRO HB3 1 107 VAL MG1 . . 3.330 2.267 2.054 2.375 . 0 0 "[ . 1 . 2]" 1
277 1 21 PRO HD2 1 104 SER HB2 . . 5.190 4.923 4.616 5.105 . 0 0 "[ . 1 . 2]" 1
278 1 21 PRO HD2 1 105 PRO HD2 . . 4.450 4.224 3.849 4.354 . 0 0 "[ . 1 . 2]" 1
279 1 21 PRO HD2 1 105 PRO HD3 . . 5.270 5.138 4.739 5.296 0.026 15 0 "[ . 1 . 2]" 1
280 1 21 PRO HD3 1 105 PRO HB2 . . 4.790 4.744 4.359 4.820 0.030 19 0 "[ . 1 . 2]" 1
281 1 21 PRO HD3 1 105 PRO HD2 . . 4.030 2.678 2.291 2.848 . 0 0 "[ . 1 . 2]" 1
282 1 21 PRO HD3 1 105 PRO HD3 . . 4.200 3.479 3.127 3.643 . 0 0 "[ . 1 . 2]" 1
283 1 21 PRO HG2 1 107 VAL MG1 . . 4.510 3.840 3.621 3.971 . 0 0 "[ . 1 . 2]" 1
284 1 21 PRO HG3 1 105 PRO HD2 . . 4.500 4.238 4.003 4.453 . 0 0 "[ . 1 . 2]" 1
285 1 21 PRO HG3 1 107 VAL MG1 . . 4.510 3.616 3.342 3.746 . 0 0 "[ . 1 . 2]" 1
286 1 22 PRO HA 1 23 VAL H . . 2.980 2.209 2.186 2.293 . 0 0 "[ . 1 . 2]" 1
287 1 22 PRO HA 1 23 VAL HA . . 4.610 4.368 4.361 4.374 . 0 0 "[ . 1 . 2]" 1
288 1 22 PRO HA 1 23 VAL HB . . 4.890 4.780 4.701 4.880 . 0 0 "[ . 1 . 2]" 1
289 1 22 PRO HA 1 23 VAL MG1 . . 5.500 5.453 5.419 5.474 . 0 0 "[ . 1 . 2]" 1
290 1 22 PRO HA 1 23 VAL MG2 . . 3.660 3.412 3.259 3.574 . 0 0 "[ . 1 . 2]" 1
291 1 22 PRO HA 1 34 LEU MD2 . . 4.470 4.304 4.068 4.494 0.024 16 0 "[ . 1 . 2]" 1
292 1 22 PRO HA 1 35 TYR H . . 4.990 4.497 4.297 4.738 . 0 0 "[ . 1 . 2]" 1
293 1 22 PRO HA 1 36 TRP H . . 5.150 4.835 4.596 5.161 0.011 17 0 "[ . 1 . 2]" 1
294 1 22 PRO HA 1 36 TRP HA . . 4.190 3.095 2.765 3.419 . 0 0 "[ . 1 . 2]" 1
295 1 22 PRO HA 1 36 TRP HE3 . . 4.520 3.839 3.536 4.168 . 0 0 "[ . 1 . 2]" 1
296 1 22 PRO HA 1 92 LEU MD1 . . 5.500 5.459 5.089 5.530 0.030 17 0 "[ . 1 . 2]" 1
297 1 22 PRO HA 1 92 LEU QD . . 4.550 3.544 3.213 3.692 . 0 0 "[ . 1 . 2]" 1
298 1 22 PRO HA 1 92 LEU MD2 . . 5.500 3.591 3.249 3.751 . 0 0 "[ . 1 . 2]" 1
299 1 22 PRO HB2 1 23 VAL H . . 3.800 3.209 2.909 3.305 . 0 0 "[ . 1 . 2]" 1
300 1 22 PRO HB2 1 23 VAL HA . . 5.210 4.653 4.541 4.722 . 0 0 "[ . 1 . 2]" 1
301 1 22 PRO HB2 1 23 VAL MG2 . . 4.990 4.892 4.765 5.006 0.016 20 0 "[ . 1 . 2]" 1
302 1 22 PRO HB2 1 24 VAL MG2 . . 4.720 4.357 4.133 4.567 . 0 0 "[ . 1 . 2]" 1
303 1 22 PRO HB2 1 34 LEU HA . . 4.680 4.075 3.892 4.394 . 0 0 "[ . 1 . 2]" 1
304 1 22 PRO HB2 1 34 LEU HB3 . . 4.080 2.737 2.440 3.011 . 0 0 "[ . 1 . 2]" 1
305 1 22 PRO HB2 1 34 LEU MD1 . . 4.140 3.668 3.456 4.007 . 0 0 "[ . 1 . 2]" 1
306 1 22 PRO HB2 1 34 LEU MD2 . . 3.590 2.120 1.913 2.417 . 0 0 "[ . 1 . 2]" 1
307 1 22 PRO HB2 1 35 TYR H . . 4.330 3.499 3.208 3.865 . 0 0 "[ . 1 . 2]" 1
308 1 22 PRO HB2 1 36 TRP HB3 . . 4.540 3.651 3.402 3.953 . 0 0 "[ . 1 . 2]" 1
309 1 22 PRO HB2 1 36 TRP HE3 . . 3.860 2.899 2.668 3.274 . 0 0 "[ . 1 . 2]" 1
310 1 22 PRO HB2 1 56 ILE MD . . 4.930 4.539 4.010 4.940 0.010 5 0 "[ . 1 . 2]" 1
311 1 22 PRO HB2 1 92 LEU HB2 . . 5.100 4.872 4.526 5.051 . 0 0 "[ . 1 . 2]" 1
312 1 22 PRO HB2 1 107 VAL MG2 . . 4.220 4.033 3.634 4.217 . 0 0 "[ . 1 . 2]" 1
313 1 22 PRO HB3 1 23 VAL H . . 3.830 3.791 3.612 3.851 0.021 2 0 "[ . 1 . 2]" 1
314 1 22 PRO HB3 1 34 LEU HB3 . . 4.040 3.785 3.657 4.041 0.001 9 0 "[ . 1 . 2]" 1
315 1 22 PRO HB3 1 34 LEU MD1 . . 4.930 4.553 4.339 4.794 . 0 0 "[ . 1 . 2]" 1
316 1 22 PRO HB3 1 34 LEU MD2 . . 3.890 3.582 3.305 3.902 0.012 19 0 "[ . 1 . 2]" 1
317 1 22 PRO HB3 1 36 TRP HB2 . . 4.420 3.925 3.627 4.270 . 0 0 "[ . 1 . 2]" 1
318 1 22 PRO HB3 1 36 TRP HE3 . . 3.950 2.188 1.991 2.637 . 0 0 "[ . 1 . 2]" 1
319 1 22 PRO HB3 1 92 LEU HB3 . . 5.230 4.651 4.200 4.926 . 0 0 "[ . 1 . 2]" 1
320 1 22 PRO HB3 1 92 LEU MD1 . . 4.860 4.149 3.713 4.326 . 0 0 "[ . 1 . 2]" 1
321 1 22 PRO HB3 1 92 LEU QD . . 3.880 2.997 2.680 3.222 . 0 0 "[ . 1 . 2]" 1
322 1 22 PRO HB3 1 92 LEU MD2 . . 4.860 3.079 2.718 3.351 . 0 0 "[ . 1 . 2]" 1
323 1 22 PRO HB3 1 107 VAL MG2 . . 4.900 4.609 4.357 4.787 . 0 0 "[ . 1 . 2]" 1
324 1 22 PRO HD2 1 34 LEU MD2 . . 5.190 4.466 4.254 4.774 . 0 0 "[ . 1 . 2]" 1
325 1 22 PRO HD2 1 92 LEU H . . 5.410 4.200 4.046 4.453 . 0 0 "[ . 1 . 2]" 1
326 1 22 PRO HD2 1 92 LEU HB2 . . 4.400 3.994 3.574 4.239 . 0 0 "[ . 1 . 2]" 1
327 1 22 PRO HD2 1 92 LEU HB3 . . 4.850 3.965 3.766 4.173 . 0 0 "[ . 1 . 2]" 1
328 1 22 PRO HD2 1 92 LEU QD . . 5.440 4.104 3.796 4.333 . 0 0 "[ . 1 . 2]" 1
329 1 22 PRO HD2 1 104 SER HG . . 4.470 3.089 2.802 3.362 . 0 0 "[ . 1 . 2]" 1
330 1 22 PRO HD2 1 107 VAL HB . . 4.430 4.346 4.118 4.455 0.025 9 0 "[ . 1 . 2]" 1
331 1 22 PRO HD2 1 107 VAL MG1 . . 3.350 2.158 1.998 2.321 . 0 0 "[ . 1 . 2]" 1
332 1 22 PRO HD2 1 107 VAL MG2 . . 3.420 2.230 1.981 2.426 . 0 0 "[ . 1 . 2]" 1
333 1 22 PRO HD3 1 92 LEU H . . 4.640 3.548 3.374 3.684 . 0 0 "[ . 1 . 2]" 1
334 1 22 PRO HD3 1 92 LEU HB2 . . 4.250 2.428 2.030 2.703 . 0 0 "[ . 1 . 2]" 1
335 1 22 PRO HD3 1 92 LEU HB3 . . 4.250 2.511 2.318 2.651 . 0 0 "[ . 1 . 2]" 1
336 1 22 PRO HD3 1 92 LEU QD . . 4.170 2.669 2.346 2.898 . 0 0 "[ . 1 . 2]" 1
337 1 22 PRO HD3 1 104 SER HG . . 4.680 2.911 2.442 3.381 . 0 0 "[ . 1 . 2]" 1
338 1 22 PRO HD3 1 107 VAL MG1 . . 3.770 3.706 3.491 3.791 0.021 20 0 "[ . 1 . 2]" 1
339 1 22 PRO HD3 1 107 VAL MG2 . . 3.640 3.542 3.362 3.657 0.017 3 0 "[ . 1 . 2]" 1
340 1 22 PRO HG2 1 34 LEU MD1 . . 3.920 3.577 3.253 3.925 0.005 7 0 "[ . 1 . 2]" 1
341 1 22 PRO HG2 1 34 LEU MD2 . . 3.800 2.472 2.234 2.843 . 0 0 "[ . 1 . 2]" 1
342 1 22 PRO HG2 1 90 PHE HB2 . . 4.730 3.977 3.664 4.202 . 0 0 "[ . 1 . 2]" 1
343 1 22 PRO HG2 1 90 PHE HB3 . . 5.500 4.996 4.480 5.403 . 0 0 "[ . 1 . 2]" 1
344 1 22 PRO HG2 1 92 LEU H . . 5.500 5.440 5.209 5.561 0.061 9 0 "[ . 1 . 2]" 1
345 1 22 PRO HG2 1 107 VAL MG1 . . 3.450 3.279 2.996 3.453 0.003 6 0 "[ . 1 . 2]" 1
346 1 22 PRO HG2 1 107 VAL MG2 . . 3.340 2.118 1.874 2.308 . 0 0 "[ . 1 . 2]" 1
347 1 22 PRO HG3 1 34 LEU MD2 . . 3.970 3.325 3.011 3.799 . 0 0 "[ . 1 . 2]" 1
348 1 22 PRO HG3 1 56 ILE MD . . 3.820 3.250 2.911 3.595 . 0 0 "[ . 1 . 2]" 1
349 1 22 PRO HG3 1 92 LEU H . . 4.590 4.334 4.113 4.488 . 0 0 "[ . 1 . 2]" 1
350 1 22 PRO HG3 1 92 LEU MD1 . . 5.070 4.388 3.879 4.686 . 0 0 "[ . 1 . 2]" 1
351 1 22 PRO HG3 1 92 LEU QD . . 3.780 3.622 3.338 3.795 0.015 10 0 "[ . 1 . 2]" 1
352 1 22 PRO HG3 1 92 LEU MD2 . . 5.070 3.864 3.594 4.087 . 0 0 "[ . 1 . 2]" 1
353 1 22 PRO HG3 1 107 VAL MG1 . . 4.380 4.254 3.950 4.376 . 0 0 "[ . 1 . 2]" 1
354 1 22 PRO HG3 1 107 VAL MG2 . . 4.040 3.062 2.870 3.225 . 0 0 "[ . 1 . 2]" 1
355 1 23 VAL H 1 23 VAL HB . . 3.190 2.604 2.531 2.700 . 0 0 "[ . 1 . 2]" 1
356 1 23 VAL H 1 23 VAL MG1 . . 3.990 3.798 3.785 3.815 . 0 0 "[ . 1 . 2]" 1
357 1 23 VAL H 1 23 VAL MG2 . . 3.030 2.216 1.931 2.478 . 0 0 "[ . 1 . 2]" 1
358 1 23 VAL H 1 24 VAL H . . 4.700 4.593 4.572 4.606 . 0 0 "[ . 1 . 2]" 1
359 1 23 VAL H 1 24 VAL MG2 . . 5.120 4.913 4.770 5.017 . 0 0 "[ . 1 . 2]" 1
360 1 23 VAL H 1 34 LEU HA . . 5.040 4.765 4.616 4.965 . 0 0 "[ . 1 . 2]" 1
361 1 23 VAL H 1 34 LEU MD2 . . 4.540 3.944 3.782 4.108 . 0 0 "[ . 1 . 2]" 1
362 1 23 VAL H 1 35 TYR H . . 3.500 3.171 2.964 3.384 . 0 0 "[ . 1 . 2]" 1
363 1 23 VAL H 1 35 TYR HA . . 5.230 5.041 4.910 5.187 . 0 0 "[ . 1 . 2]" 1
364 1 23 VAL H 1 35 TYR QD . . 4.990 4.243 4.051 4.582 . 0 0 "[ . 1 . 2]" 1
365 1 23 VAL H 1 36 TRP HA . . 4.000 3.331 3.117 3.550 . 0 0 "[ . 1 . 2]" 1
366 1 23 VAL H 1 36 TRP HB3 . . 4.380 3.906 3.526 4.281 . 0 0 "[ . 1 . 2]" 1
367 1 23 VAL H 1 36 TRP HE3 . . 5.500 4.614 4.220 4.923 . 0 0 "[ . 1 . 2]" 1
368 1 23 VAL HA 1 23 VAL MG1 . . 2.970 2.245 2.140 2.298 . 0 0 "[ . 1 . 2]" 1
369 1 23 VAL HA 1 23 VAL MG2 . . 3.150 2.471 2.338 2.567 . 0 0 "[ . 1 . 2]" 1
370 1 23 VAL HA 1 24 VAL H . . 2.780 2.313 2.267 2.370 . 0 0 "[ . 1 . 2]" 1
371 1 23 VAL HA 1 24 VAL HA . . 4.480 4.395 4.380 4.418 . 0 0 "[ . 1 . 2]" 1
372 1 23 VAL HA 1 24 VAL HB . . 4.800 4.632 4.510 4.771 . 0 0 "[ . 1 . 2]" 1
373 1 23 VAL HA 1 24 VAL MG1 . . 5.500 5.452 5.432 5.462 . 0 0 "[ . 1 . 2]" 1
374 1 23 VAL HA 1 24 VAL MG2 . . 3.680 3.528 3.327 3.681 0.001 14 0 "[ . 1 . 2]" 1
375 1 23 VAL HA 1 34 LEU MD2 . . 4.540 3.985 3.753 4.274 . 0 0 "[ . 1 . 2]" 1
376 1 23 VAL HA 1 35 TYR H . . 4.960 4.812 4.670 4.941 . 0 0 "[ . 1 . 2]" 1
377 1 23 VAL HB 1 24 VAL H . . 4.190 3.657 3.443 3.825 . 0 0 "[ . 1 . 2]" 1
378 1 23 VAL HB 1 35 TYR H . . 3.850 3.621 3.420 3.776 . 0 0 "[ . 1 . 2]" 1
379 1 23 VAL HB 1 35 TYR HB2 . . 5.140 5.133 4.995 5.193 0.053 15 0 "[ . 1 . 2]" 1
380 1 23 VAL HB 1 35 TYR HB3 . . 5.310 5.222 5.058 5.318 0.008 3 0 "[ . 1 . 2]" 1
381 1 23 VAL HB 1 35 TYR QD . . 3.950 3.391 3.294 3.520 . 0 0 "[ . 1 . 2]" 1
382 1 23 VAL HB 1 35 TYR QE . . 3.890 2.779 2.612 3.048 . 0 0 "[ . 1 . 2]" 1
383 1 23 VAL MG1 1 24 VAL H . . 2.990 1.956 1.813 2.114 . 0 0 "[ . 1 . 2]" 1
384 1 23 VAL MG1 1 24 VAL HA . . 4.290 3.815 3.644 3.980 . 0 0 "[ . 1 . 2]" 1
385 1 23 VAL MG1 1 24 VAL HB . . 4.280 3.974 3.859 4.124 . 0 0 "[ . 1 . 2]" 1
386 1 23 VAL MG1 1 25 GLY HA2 . . 4.720 3.701 3.490 4.002 . 0 0 "[ . 1 . 2]" 1
387 1 23 VAL MG1 1 25 GLY HA3 . . 4.980 4.451 4.181 4.849 . 0 0 "[ . 1 . 2]" 1
388 1 23 VAL MG1 1 35 TYR H . . 4.720 4.592 4.485 4.693 . 0 0 "[ . 1 . 2]" 1
389 1 23 VAL MG1 1 35 TYR QD . . 4.100 4.003 3.841 4.118 0.018 19 0 "[ . 1 . 2]" 1
390 1 23 VAL MG1 1 35 TYR QE . . 3.310 2.596 2.297 2.839 . 0 0 "[ . 1 . 2]" 1
391 1 23 VAL MG2 1 24 VAL H . . 4.360 3.911 3.794 4.007 . 0 0 "[ . 1 . 2]" 1
392 1 23 VAL MG2 1 24 VAL HA . . 5.500 5.530 5.495 5.551 0.051 5 0 "[ . 1 . 2]" 1
393 1 23 VAL MG2 1 35 TYR H . . 4.860 4.560 4.322 4.780 . 0 0 "[ . 1 . 2]" 1
394 1 23 VAL MG2 1 35 TYR QD . . 4.030 3.699 3.430 3.945 . 0 0 "[ . 1 . 2]" 1
395 1 23 VAL MG2 1 35 TYR QE . . 3.760 2.693 2.363 3.083 . 0 0 "[ . 1 . 2]" 1
396 1 23 VAL MG2 1 36 TRP HA . . 4.060 3.802 3.402 4.049 . 0 0 "[ . 1 . 2]" 1
397 1 23 VAL MG2 1 38 LEU H . . 5.490 5.024 4.768 5.512 0.022 10 0 "[ . 1 . 2]" 1
398 1 24 VAL H 1 24 VAL HB . . 2.990 2.597 2.516 2.690 . 0 0 "[ . 1 . 2]" 1
399 1 24 VAL H 1 24 VAL MG1 . . 3.830 3.830 3.780 3.874 0.044 9 0 "[ . 1 . 2]" 1
400 1 24 VAL H 1 24 VAL MG2 . . 2.950 2.758 2.503 2.916 . 0 0 "[ . 1 . 2]" 1
401 1 24 VAL H 1 25 GLY H . . 4.420 4.091 3.968 4.254 . 0 0 "[ . 1 . 2]" 1
402 1 24 VAL H 1 34 LEU MD2 . . 4.380 3.954 3.665 4.300 . 0 0 "[ . 1 . 2]" 1
403 1 24 VAL H 1 35 TYR H . . 5.500 5.147 4.980 5.275 . 0 0 "[ . 1 . 2]" 1
404 1 24 VAL H 1 35 TYR QE . . 4.770 4.375 4.241 4.513 . 0 0 "[ . 1 . 2]" 1
405 1 24 VAL H 1 109 VAL MG1 . . 4.860 4.778 4.636 4.868 0.008 7 0 "[ . 1 . 2]" 1
406 1 24 VAL HA 1 24 VAL MG1 . . 2.850 2.395 2.296 2.455 . 0 0 "[ . 1 . 2]" 1
407 1 24 VAL HA 1 24 VAL MG2 . . 3.050 2.326 2.248 2.459 . 0 0 "[ . 1 . 2]" 1
408 1 24 VAL HA 1 25 GLY H . . 2.840 2.191 2.155 2.224 . 0 0 "[ . 1 . 2]" 1
409 1 24 VAL HA 1 25 GLY HA2 . . 4.470 4.449 4.415 4.478 0.008 7 0 "[ . 1 . 2]" 1
410 1 24 VAL HA 1 25 GLY HA3 . . 4.600 4.429 4.404 4.448 . 0 0 "[ . 1 . 2]" 1
411 1 24 VAL HA 1 32 ILE MG . . 4.700 3.927 3.771 4.078 . 0 0 "[ . 1 . 2]" 1
412 1 24 VAL HA 1 33 GLU QG . . 4.500 4.245 3.931 4.520 0.020 12 0 "[ . 1 . 2]" 1
413 1 24 VAL HA 1 34 LEU HA . . 3.830 2.650 2.368 2.890 . 0 0 "[ . 1 . 2]" 1
414 1 24 VAL HA 1 34 LEU MD2 . . 3.170 2.649 2.148 2.931 . 0 0 "[ . 1 . 2]" 1
415 1 24 VAL HA 1 35 TYR H . . 4.120 3.958 3.670 4.122 0.002 4 0 "[ . 1 . 2]" 1
416 1 24 VAL HA 1 35 TYR QD . . 4.220 4.219 4.143 4.250 0.030 10 0 "[ . 1 . 2]" 1
417 1 24 VAL HA 1 35 TYR QE . . 4.630 4.149 3.972 4.307 . 0 0 "[ . 1 . 2]" 1
418 1 24 VAL HA 1 109 VAL MG2 . . 5.500 5.355 5.208 5.518 0.018 10 0 "[ . 1 . 2]" 1
419 1 24 VAL HB 1 25 GLY H . . 4.670 4.420 4.303 4.500 . 0 0 "[ . 1 . 2]" 1
420 1 24 VAL HB 1 109 VAL MG2 . . 4.920 4.862 4.671 4.946 0.026 7 0 "[ . 1 . 2]" 1
421 1 24 VAL MG1 1 25 GLY H . . 3.210 3.098 2.839 3.213 0.003 5 0 "[ . 1 . 2]" 1
422 1 24 VAL MG1 1 25 GLY HA3 . . 4.420 4.403 4.227 4.470 0.050 17 0 "[ . 1 . 2]" 1
423 1 24 VAL MG1 1 26 LYS H . . 4.480 4.028 3.894 4.266 . 0 0 "[ . 1 . 2]" 1
424 1 24 VAL MG1 1 32 ILE MG . . 2.570 2.098 1.843 2.330 . 0 0 "[ . 1 . 2]" 1
425 1 24 VAL MG1 1 33 GLU H . . 3.610 3.350 3.053 3.612 0.002 7 0 "[ . 1 . 2]" 1
426 1 24 VAL MG1 1 33 GLU HB3 . . 4.670 3.574 3.089 4.044 . 0 0 "[ . 1 . 2]" 1
427 1 24 VAL MG1 1 34 LEU MD2 . . 3.570 3.346 2.754 3.588 0.018 7 0 "[ . 1 . 2]" 1
428 1 24 VAL MG1 1 109 VAL HB . . 3.850 3.460 3.334 3.553 . 0 0 "[ . 1 . 2]" 1
429 1 24 VAL MG2 1 25 GLY H . . 4.190 4.197 4.098 4.244 0.054 17 0 "[ . 1 . 2]" 1
430 1 24 VAL MG2 1 32 ILE MG . . 2.970 2.718 2.403 2.957 . 0 0 "[ . 1 . 2]" 1
431 1 24 VAL MG2 1 34 LEU HA . . 4.580 3.587 3.223 3.852 . 0 0 "[ . 1 . 2]" 1
432 1 24 VAL MG2 1 34 LEU MD1 . . 4.550 3.696 3.511 3.951 . 0 0 "[ . 1 . 2]" 1
433 1 24 VAL MG2 1 34 LEU MD2 . . 2.920 1.796 1.723 1.927 . 0 0 "[ . 1 . 2]" 1
434 1 24 VAL MG2 1 109 VAL HB . . 3.380 3.245 2.894 3.388 0.008 12 0 "[ . 1 . 2]" 1
435 1 24 VAL MG2 1 109 VAL MG1 . . 2.560 1.850 1.745 1.955 . 0 0 "[ . 1 . 2]" 1
436 1 25 GLY H 1 26 LYS H . . 3.800 3.100 2.939 3.306 . 0 0 "[ . 1 . 2]" 1
437 1 25 GLY H 1 26 LYS HB3 . . 5.500 5.335 5.223 5.495 . 0 0 "[ . 1 . 2]" 1
438 1 25 GLY H 1 32 ILE MG . . 5.320 4.916 4.555 5.088 . 0 0 "[ . 1 . 2]" 1
439 1 25 GLY H 1 33 GLU H . . 5.100 4.930 4.601 5.094 . 0 0 "[ . 1 . 2]" 1
440 1 25 GLY H 1 33 GLU HB3 . . 4.240 3.295 2.953 3.581 . 0 0 "[ . 1 . 2]" 1
441 1 25 GLY H 1 33 GLU QG . . 3.960 2.864 2.367 3.098 . 0 0 "[ . 1 . 2]" 1
442 1 25 GLY H 1 34 LEU HA . . 3.910 3.316 2.792 3.556 . 0 0 "[ . 1 . 2]" 1
443 1 25 GLY H 1 34 LEU MD2 . . 4.560 4.301 3.935 4.569 0.009 15 0 "[ . 1 . 2]" 1
444 1 25 GLY H 1 35 TYR QD . . 4.320 2.817 2.645 2.986 . 0 0 "[ . 1 . 2]" 1
445 1 25 GLY H 1 35 TYR QE . . 4.170 2.627 2.363 2.949 . 0 0 "[ . 1 . 2]" 1
446 1 25 GLY HA2 1 26 LYS HB2 . . 5.500 5.490 5.443 5.538 0.038 12 0 "[ . 1 . 2]" 1
447 1 25 GLY HA2 1 35 TYR QD . . 4.680 4.408 4.043 4.676 . 0 0 "[ . 1 . 2]" 1
448 1 25 GLY HA2 1 35 TYR QE . . 3.240 2.558 2.136 2.859 . 0 0 "[ . 1 . 2]" 1
449 1 25 GLY HA3 1 26 LYS H . . 3.160 2.329 2.213 2.386 . 0 0 "[ . 1 . 2]" 1
450 1 25 GLY HA3 1 26 LYS HA . . 4.690 4.327 4.316 4.336 . 0 0 "[ . 1 . 2]" 1
451 1 25 GLY HA3 1 26 LYS HB2 . . 4.660 4.487 4.425 4.570 . 0 0 "[ . 1 . 2]" 1
452 1 25 GLY HA3 1 26 LYS HB3 . . 5.090 4.718 4.598 4.840 . 0 0 "[ . 1 . 2]" 1
453 1 25 GLY HA3 1 33 GLU HB3 . . 4.590 3.740 3.449 3.940 . 0 0 "[ . 1 . 2]" 1
454 1 25 GLY HA3 1 33 GLU QG . . 4.130 3.317 2.819 3.554 . 0 0 "[ . 1 . 2]" 1
455 1 25 GLY HA3 1 35 TYR QD . . 4.000 3.308 2.963 3.594 . 0 0 "[ . 1 . 2]" 1
456 1 25 GLY HA3 1 35 TYR QE . . 3.400 2.398 2.183 2.593 . 0 0 "[ . 1 . 2]" 1
457 1 26 LYS H 1 26 LYS HB2 . . 3.340 2.724 2.622 2.816 . 0 0 "[ . 1 . 2]" 1
458 1 26 LYS H 1 26 LYS HB3 . . 3.120 2.455 2.374 2.523 . 0 0 "[ . 1 . 2]" 1
459 1 26 LYS H 1 26 LYS QD . . 4.590 4.455 4.410 4.568 . 0 0 "[ . 1 . 2]" 1
460 1 26 LYS H 1 26 LYS HG2 . . 4.580 4.402 4.320 4.470 . 0 0 "[ . 1 . 2]" 1
461 1 26 LYS H 1 26 LYS HG3 . . 4.650 4.539 4.487 4.601 . 0 0 "[ . 1 . 2]" 1
462 1 26 LYS H 1 27 VAL H . . 4.710 4.529 4.495 4.582 . 0 0 "[ . 1 . 2]" 1
463 1 26 LYS H 1 33 GLU H . . 4.150 4.110 3.841 4.188 0.038 15 0 "[ . 1 . 2]" 1
464 1 26 LYS H 1 33 GLU HB2 . . 3.980 3.061 2.743 3.403 . 0 0 "[ . 1 . 2]" 1
465 1 26 LYS H 1 33 GLU HB3 . . 3.390 1.896 1.878 1.952 . 0 0 "[ . 1 . 2]" 1
466 1 26 LYS H 1 33 GLU HG2 . . 4.150 2.807 2.260 2.981 . 0 0 "[ . 1 . 2]" 1
467 1 26 LYS H 1 33 GLU HG3 . . 4.150 3.842 2.859 4.168 0.018 19 0 "[ . 1 . 2]" 1
468 1 26 LYS H 1 35 TYR QD . . 5.430 4.548 4.357 4.752 . 0 0 "[ . 1 . 2]" 1
469 1 26 LYS H 1 35 TYR QE . . 4.800 4.533 4.343 4.757 . 0 0 "[ . 1 . 2]" 1
470 1 26 LYS H 1 78 VAL QG . . 5.440 4.907 4.564 5.126 . 0 0 "[ . 1 . 2]" 1
471 1 26 LYS HA 1 26 LYS QE . . 4.820 4.657 4.423 4.833 0.013 16 0 "[ . 1 . 2]" 1
472 1 26 LYS HA 1 26 LYS HG2 . . 3.710 3.212 3.081 3.274 . 0 0 "[ . 1 . 2]" 1
473 1 26 LYS HA 1 26 LYS HG3 . . 3.250 2.557 2.459 2.713 . 0 0 "[ . 1 . 2]" 1
474 1 26 LYS HA 1 27 VAL H . . 2.660 2.166 2.149 2.200 . 0 0 "[ . 1 . 2]" 1
475 1 26 LYS HA 1 27 VAL HA . . 4.430 4.399 4.392 4.410 . 0 0 "[ . 1 . 2]" 1
476 1 26 LYS HA 1 27 VAL HB . . 4.810 4.606 4.501 4.815 0.005 9 0 "[ . 1 . 2]" 1
477 1 26 LYS HA 1 27 VAL QG . . 3.890 3.526 3.284 3.677 . 0 0 "[ . 1 . 2]" 1
478 1 26 LYS HA 1 28 THR MG . . 5.220 4.852 4.603 5.145 . 0 0 "[ . 1 . 2]" 1
479 1 26 LYS HA 1 33 GLU QG . . 5.340 5.301 4.673 5.413 0.073 19 0 "[ . 1 . 2]" 1
480 1 26 LYS HB2 1 26 LYS QE . . 4.730 3.896 3.445 4.103 . 0 0 "[ . 1 . 2]" 1
481 1 26 LYS HB2 1 27 VAL H . . 4.370 4.175 4.075 4.261 . 0 0 "[ . 1 . 2]" 1
482 1 26 LYS HB2 1 28 THR MG . . 5.120 4.843 4.673 5.102 . 0 0 "[ . 1 . 2]" 1
483 1 26 LYS HB2 1 33 GLU H . . 5.500 5.369 4.918 5.518 0.018 10 0 "[ . 1 . 2]" 1
484 1 26 LYS HB2 1 33 GLU HB2 . . 3.970 3.774 3.584 3.977 0.007 2 0 "[ . 1 . 2]" 1
485 1 26 LYS HB2 1 33 GLU HB3 . . 4.220 3.769 3.366 4.004 . 0 0 "[ . 1 . 2]" 1
486 1 26 LYS HB3 1 26 LYS QE . . 4.470 3.922 2.344 4.198 . 0 0 "[ . 1 . 2]" 1
487 1 26 LYS HB3 1 27 VAL H . . 4.440 4.162 4.019 4.263 . 0 0 "[ . 1 . 2]" 1
488 1 26 LYS HB3 1 28 THR MG . . 4.560 4.308 3.962 4.572 0.012 16 0 "[ . 1 . 2]" 1
489 1 26 LYS HB3 1 33 GLU H . . 5.210 3.792 3.260 3.966 . 0 0 "[ . 1 . 2]" 1
490 1 26 LYS HB3 1 33 GLU HA . . 4.880 4.548 4.448 4.666 . 0 0 "[ . 1 . 2]" 1
491 1 26 LYS HB3 1 33 GLU HB2 . . 3.070 2.155 2.000 2.462 . 0 0 "[ . 1 . 2]" 1
492 1 26 LYS HB3 1 33 GLU HB3 . . 4.110 2.515 2.130 2.776 . 0 0 "[ . 1 . 2]" 1
493 1 26 LYS HB3 1 33 GLU QG . . 4.430 3.602 2.973 3.827 . 0 0 "[ . 1 . 2]" 1
494 1 26 LYS QD 1 26 LYS HG2 . . 2.760 2.300 2.215 2.475 . 0 0 "[ . 1 . 2]" 1
495 1 26 LYS QD 1 26 LYS HG3 . . 2.660 2.388 2.156 2.477 . 0 0 "[ . 1 . 2]" 1
496 1 26 LYS QD 1 27 VAL H . . 5.020 4.748 4.564 4.883 . 0 0 "[ . 1 . 2]" 1
497 1 26 LYS QD 1 28 THR MG . . 3.560 3.051 2.646 3.544 . 0 0 "[ . 1 . 2]" 1
498 1 26 LYS QD 1 33 GLU H . . 5.500 5.282 4.921 5.507 0.007 9 0 "[ . 1 . 2]" 1
499 1 26 LYS QE 1 26 LYS HG2 . . 3.210 2.500 2.085 2.684 . 0 0 "[ . 1 . 2]" 1
500 1 26 LYS QE 1 26 LYS HG3 . . 3.220 2.468 2.206 3.228 0.008 14 0 "[ . 1 . 2]" 1
501 1 26 LYS QE 1 27 VAL H . . 5.080 4.650 4.381 4.867 . 0 0 "[ . 1 . 2]" 1
502 1 26 LYS QE 1 28 THR HB . . 4.810 4.542 4.144 4.809 . 0 0 "[ . 1 . 2]" 1
503 1 26 LYS QE 1 28 THR MG . . 3.030 2.033 1.809 2.215 . 0 0 "[ . 1 . 2]" 1
504 1 26 LYS HG2 1 27 VAL H . . 3.940 3.110 2.740 3.344 . 0 0 "[ . 1 . 2]" 1
505 1 26 LYS HG2 1 27 VAL HB . . 5.500 5.433 5.101 5.535 0.035 19 0 "[ . 1 . 2]" 1
506 1 26 LYS HG2 1 28 THR HB . . 5.500 5.182 4.819 5.447 . 0 0 "[ . 1 . 2]" 1
507 1 26 LYS HG2 1 28 THR MG . . 3.260 2.284 2.039 2.508 . 0 0 "[ . 1 . 2]" 1
508 1 26 LYS HG3 1 27 VAL H . . 3.000 2.952 2.726 3.024 0.024 19 0 "[ . 1 . 2]" 1
509 1 26 LYS HG3 1 28 THR MG . . 3.750 3.193 2.925 3.488 . 0 0 "[ . 1 . 2]" 1
510 1 26 LYS HG3 1 33 GLU HB3 . . 5.290 5.130 4.909 5.263 . 0 0 "[ . 1 . 2]" 1
511 1 27 VAL H 1 27 VAL HB . . 3.190 2.833 2.597 3.225 0.035 16 0 "[ . 1 . 2]" 1
512 1 27 VAL H 1 27 VAL QG . . 3.260 2.404 1.921 2.848 . 0 0 "[ . 1 . 2]" 1
513 1 27 VAL H 1 28 THR H . . 4.320 4.097 3.918 4.249 . 0 0 "[ . 1 . 2]" 1
514 1 27 VAL H 1 28 THR MG . . 4.660 3.999 3.702 4.234 . 0 0 "[ . 1 . 2]" 1
515 1 27 VAL H 1 112 THR MG . . 4.950 4.544 4.155 4.966 0.016 12 0 "[ . 1 . 2]" 1
516 1 27 VAL HA 1 27 VAL MG1 . . 3.210 2.657 2.199 3.198 . 0 0 "[ . 1 . 2]" 1
517 1 27 VAL HA 1 27 VAL QG . . 2.800 2.193 2.034 2.406 . 0 0 "[ . 1 . 2]" 1
518 1 27 VAL HA 1 27 VAL MG2 . . 3.210 2.407 2.288 2.514 . 0 0 "[ . 1 . 2]" 1
519 1 27 VAL HA 1 28 THR H . . 2.790 2.169 2.139 2.250 . 0 0 "[ . 1 . 2]" 1
520 1 27 VAL HA 1 32 ILE HA . . 3.650 2.940 2.720 3.253 . 0 0 "[ . 1 . 2]" 1
521 1 27 VAL HA 1 32 ILE MG . . 4.080 3.623 3.409 3.972 . 0 0 "[ . 1 . 2]" 1
522 1 27 VAL HA 1 33 GLU H . . 3.820 3.202 2.962 3.761 . 0 0 "[ . 1 . 2]" 1
523 1 27 VAL HB 1 28 THR H . . 4.570 4.377 4.188 4.468 . 0 0 "[ . 1 . 2]" 1
524 1 27 VAL HB 1 111 THR HA . . 5.500 4.954 4.547 5.525 0.025 19 0 "[ . 1 . 2]" 1
525 1 27 VAL HB 1 112 THR MG . . 4.180 3.300 2.651 4.181 0.001 15 0 "[ . 1 . 2]" 1
526 1 27 VAL QG 1 28 THR H . . 3.210 2.937 2.616 3.205 . 0 0 "[ . 1 . 2]" 1
527 1 27 VAL QG 1 32 ILE HA . . 4.170 3.692 3.306 4.069 . 0 0 "[ . 1 . 2]" 1
528 1 27 VAL QG 1 32 ILE HG12 . . 3.420 3.005 2.589 3.433 0.013 19 0 "[ . 1 . 2]" 1
529 1 27 VAL QG 1 32 ILE MG . . 3.750 3.227 2.936 3.596 . 0 0 "[ . 1 . 2]" 1
530 1 27 VAL QG 1 33 GLU H . . 5.000 4.042 3.459 4.509 . 0 0 "[ . 1 . 2]" 1
531 1 27 VAL QG 1 111 THR HA . . 2.820 2.255 1.989 2.647 . 0 0 "[ . 1 . 2]" 1
532 1 27 VAL QG 1 112 THR H . . 3.150 2.831 2.501 3.071 . 0 0 "[ . 1 . 2]" 1
533 1 28 THR H 1 28 THR HB . . 3.950 3.691 3.580 3.786 . 0 0 "[ . 1 . 2]" 1
534 1 28 THR H 1 28 THR MG . . 3.290 2.929 2.527 3.195 . 0 0 "[ . 1 . 2]" 1
535 1 28 THR H 1 29 HIS H . . 4.550 4.516 4.474 4.574 0.024 15 0 "[ . 1 . 2]" 1
536 1 28 THR H 1 30 HIS H . . 4.590 4.352 4.254 4.441 . 0 0 "[ . 1 . 2]" 1
537 1 28 THR H 1 31 SER H . . 3.770 3.720 3.612 3.800 0.030 13 0 "[ . 1 . 2]" 1
538 1 28 THR H 1 32 ILE HA . . 3.760 2.957 2.801 3.079 . 0 0 "[ . 1 . 2]" 1
539 1 28 THR H 1 33 GLU H . . 4.440 3.964 3.776 4.101 . 0 0 "[ . 1 . 2]" 1
540 1 28 THR H 1 112 THR H . . 5.060 4.651 4.411 5.040 . 0 0 "[ . 1 . 2]" 1
541 1 28 THR H 1 112 THR MG . . 4.960 4.435 3.772 4.947 . 0 0 "[ . 1 . 2]" 1
542 1 28 THR HB 1 29 HIS H . . 2.930 2.560 2.087 2.877 . 0 0 "[ . 1 . 2]" 1
543 1 28 THR HB 1 29 HIS HB3 . . 5.500 5.036 4.685 5.475 . 0 0 "[ . 1 . 2]" 1
544 1 28 THR HB 1 29 HIS HE1 . . 5.500 5.361 4.889 5.527 0.027 5 0 "[ . 1 . 2]" 1
545 1 28 THR HB 1 30 HIS H . . 3.700 2.341 2.116 2.566 . 0 0 "[ . 1 . 2]" 1
546 1 28 THR HB 1 30 HIS HD2 . . 4.680 3.050 2.556 3.902 . 0 0 "[ . 1 . 2]" 1
547 1 28 THR HB 1 31 SER H . . 4.260 3.090 2.508 3.390 . 0 0 "[ . 1 . 2]" 1
548 1 28 THR MG 1 29 HIS H . . 3.700 3.542 3.187 3.757 0.057 15 0 "[ . 1 . 2]" 1
549 1 28 THR MG 1 30 HIS H . . 4.200 3.968 3.818 4.040 . 0 0 "[ . 1 . 2]" 1
550 1 28 THR MG 1 30 HIS HD2 . . 4.670 4.090 3.776 4.473 . 0 0 "[ . 1 . 2]" 1
551 1 28 THR MG 1 31 SER H . . 4.340 4.139 3.959 4.355 0.015 3 0 "[ . 1 . 2]" 1
552 1 28 THR MG 1 31 SER QB . . 5.340 4.272 3.500 5.101 . 0 0 "[ . 1 . 2]" 1
553 1 29 HIS H 1 29 HIS HB2 . . 3.930 3.613 3.579 3.664 . 0 0 "[ . 1 . 2]" 1
554 1 29 HIS H 1 29 HIS HB3 . . 3.620 2.519 2.352 2.722 . 0 0 "[ . 1 . 2]" 1
555 1 29 HIS H 1 30 HIS H . . 3.370 2.627 2.509 2.690 . 0 0 "[ . 1 . 2]" 1
556 1 29 HIS H 1 30 HIS HD2 . . 4.260 3.266 2.871 3.960 . 0 0 "[ . 1 . 2]" 1
557 1 29 HIS H 1 31 SER H . . 4.150 4.101 4.040 4.178 0.028 12 0 "[ . 1 . 2]" 1
558 1 29 HIS H 1 112 THR HB . . 4.950 4.859 4.513 4.987 0.037 16 0 "[ . 1 . 2]" 1
559 1 29 HIS H 1 112 THR MG . . 4.610 4.326 4.048 4.629 0.019 15 0 "[ . 1 . 2]" 1
560 1 29 HIS H 1 114 GLU HA . . 5.220 4.941 4.693 5.124 . 0 0 "[ . 1 . 2]" 1
561 1 29 HIS HB2 1 29 HIS HD2 . . 3.950 2.817 2.743 2.955 . 0 0 "[ . 1 . 2]" 1
562 1 29 HIS HB2 1 84 PRO HA . . 4.640 2.409 1.998 2.966 . 0 0 "[ . 1 . 2]" 1
563 1 29 HIS HB2 1 84 PRO HB2 . . 4.150 3.396 3.220 3.564 . 0 0 "[ . 1 . 2]" 1
564 1 29 HIS HB2 1 84 PRO HB3 . . 3.690 2.064 1.965 2.218 . 0 0 "[ . 1 . 2]" 1
565 1 29 HIS HB2 1 84 PRO QG . . 4.110 4.035 3.872 4.157 0.047 16 0 "[ . 1 . 2]" 1
566 1 29 HIS HB2 1 112 THR H . . 4.730 4.180 3.960 4.388 . 0 0 "[ . 1 . 2]" 1
567 1 29 HIS HB2 1 112 THR MG . . 5.500 5.474 5.356 5.545 0.045 14 0 "[ . 1 . 2]" 1
568 1 29 HIS HB2 1 114 GLU HA . . 3.800 3.300 2.627 3.800 . 0 0 "[ . 1 . 2]" 1
569 1 29 HIS HB2 1 114 GLU QB . . 5.340 3.951 2.712 4.784 . 0 0 "[ . 1 . 2]" 1
570 1 29 HIS HB2 1 114 GLU QG . . 5.340 3.700 2.698 4.850 . 0 0 "[ . 1 . 2]" 1
571 1 29 HIS HB3 1 29 HIS HE1 . . 4.910 4.763 4.724 4.799 . 0 0 "[ . 1 . 2]" 1
572 1 29 HIS HB3 1 84 PRO HA . . 4.770 3.811 3.392 4.204 . 0 0 "[ . 1 . 2]" 1
573 1 29 HIS HB3 1 112 THR H . . 4.120 3.547 3.328 3.728 . 0 0 "[ . 1 . 2]" 1
574 1 29 HIS HB3 1 112 THR HA . . 4.950 4.550 4.189 4.761 . 0 0 "[ . 1 . 2]" 1
575 1 29 HIS HB3 1 112 THR MG . . 4.760 4.378 4.203 4.612 . 0 0 "[ . 1 . 2]" 1
576 1 29 HIS HB3 1 113 ARG H . . 5.140 3.969 3.579 4.381 . 0 0 "[ . 1 . 2]" 1
577 1 29 HIS HB3 1 113 ARG HA . . 4.540 3.823 3.348 4.290 . 0 0 "[ . 1 . 2]" 1
578 1 29 HIS HB3 1 113 ARG QB . . 5.500 4.968 4.623 5.279 . 0 0 "[ . 1 . 2]" 1
579 1 29 HIS HB3 1 114 GLU HA . . 3.520 3.301 3.080 3.536 0.016 19 0 "[ . 1 . 2]" 1
580 1 29 HIS HB3 1 114 GLU QB . . 5.340 4.626 3.618 5.248 . 0 0 "[ . 1 . 2]" 1
581 1 29 HIS HD2 1 30 HIS QB . . 4.120 3.735 3.261 4.236 0.116 19 0 "[ . 1 . 2]" 1
582 1 29 HIS HD2 1 30 HIS HD2 . . 4.400 4.037 2.796 4.423 0.023 16 0 "[ . 1 . 2]" 1
583 1 29 HIS HD2 1 84 PRO HB3 . . 3.760 2.956 2.444 3.525 . 0 0 "[ . 1 . 2]" 1
584 1 29 HIS HD2 1 84 PRO QG . . 3.970 3.670 3.109 4.059 0.089 19 0 "[ . 1 . 2]" 1
585 1 29 HIS HD2 1 114 GLU HA . . 4.490 3.234 2.692 4.239 . 0 0 "[ . 1 . 2]" 1
586 1 29 HIS HD2 1 114 GLU HB2 . . 4.740 4.047 2.740 4.756 0.016 17 0 "[ . 1 . 2]" 1
587 1 29 HIS HD2 1 114 GLU HB3 . . 4.740 3.305 2.137 4.455 . 0 0 "[ . 1 . 2]" 1
588 1 29 HIS HD2 1 114 GLU QG . . 4.410 2.926 1.905 4.360 . 0 0 "[ . 1 . 2]" 1
589 1 29 HIS HE1 1 30 HIS HD2 . . 3.660 3.006 2.539 3.661 0.001 2 0 "[ . 1 . 2]" 1
590 1 29 HIS HE1 1 114 GLU QB . . 5.180 4.344 3.227 5.192 0.012 15 0 "[ . 1 . 2]" 1
591 1 29 HIS HE1 1 114 GLU QG . . 5.340 5.085 4.026 5.361 0.021 2 0 "[ . 1 . 2]" 1
592 1 30 HIS H 1 30 HIS HB2 . . 4.200 3.636 2.533 3.800 . 0 0 "[ . 1 . 2]" 1
593 1 30 HIS H 1 30 HIS QB . . 3.670 3.079 2.493 3.166 . 0 0 "[ . 1 . 2]" 1
594 1 30 HIS H 1 30 HIS HB3 . . 4.200 3.368 3.248 3.716 . 0 0 "[ . 1 . 2]" 1
595 1 30 HIS H 1 30 HIS HD2 . . 3.600 3.055 2.790 3.519 . 0 0 "[ . 1 . 2]" 1
596 1 30 HIS H 1 31 SER H . . 2.850 1.833 1.790 1.889 . 0 0 "[ . 1 . 2]" 1
597 1 30 HIS H 1 31 SER HA . . 4.850 4.551 4.499 4.600 . 0 0 "[ . 1 . 2]" 1
598 1 30 HIS H 1 111 THR MG . . 4.840 4.380 4.165 4.574 . 0 0 "[ . 1 . 2]" 1
599 1 30 HIS HA 1 82 LEU HB2 . . 4.290 3.324 3.081 3.546 . 0 0 "[ . 1 . 2]" 1
600 1 30 HIS HA 1 82 LEU HB3 . . 4.900 4.607 4.296 4.865 . 0 0 "[ . 1 . 2]" 1
601 1 30 HIS QB 1 82 LEU H . . 4.030 3.869 3.462 4.042 0.012 5 0 "[ . 1 . 2]" 1
602 1 30 HIS HB2 1 31 SER H . . 4.670 3.895 3.009 4.284 . 0 0 "[ . 1 . 2]" 1
603 1 30 HIS HB3 1 31 SER H . . 4.670 4.324 3.849 4.485 . 0 0 "[ . 1 . 2]" 1
604 1 30 HIS HD2 1 31 SER H . . 4.790 4.607 4.213 5.005 0.215 19 0 "[ . 1 . 2]" 1
605 1 31 SER H 1 32 ILE H . . 4.420 4.370 4.335 4.397 . 0 0 "[ . 1 . 2]" 1
606 1 31 SER H 1 82 LEU H . . 5.500 4.932 4.500 5.230 . 0 0 "[ . 1 . 2]" 1
607 1 31 SER H 1 82 LEU HB2 . . 4.560 3.535 3.089 3.808 . 0 0 "[ . 1 . 2]" 1
608 1 31 SER H 1 82 LEU MD1 . . 4.420 3.761 3.452 4.030 . 0 0 "[ . 1 . 2]" 1
609 1 31 SER H 1 111 THR MG . . 4.420 3.726 3.281 4.081 . 0 0 "[ . 1 . 2]" 1
610 1 31 SER HA 1 32 ILE H . . 3.070 2.501 2.399 2.593 . 0 0 "[ . 1 . 2]" 1
611 1 31 SER HA 1 32 ILE HB . . 4.980 4.498 4.415 4.592 . 0 0 "[ . 1 . 2]" 1
612 1 31 SER HA 1 32 ILE MD . . 4.860 4.499 4.283 4.654 . 0 0 "[ . 1 . 2]" 1
613 1 31 SER HA 1 78 VAL QG . . 4.160 4.131 3.982 4.195 0.035 10 0 "[ . 1 . 2]" 1
614 1 31 SER HA 1 79 VAL HB . . 4.400 4.299 4.057 4.485 0.085 19 0 "[ . 1 . 2]" 1
615 1 31 SER HA 1 79 VAL MG1 . . 4.710 3.899 3.614 4.350 . 0 0 "[ . 1 . 2]" 1
616 1 31 SER HA 1 80 GLU HA . . 3.960 3.293 2.891 3.843 . 0 0 "[ . 1 . 2]" 1
617 1 31 SER HA 1 81 GLY H . . 4.800 4.406 4.137 4.705 . 0 0 "[ . 1 . 2]" 1
618 1 31 SER HA 1 82 LEU HB2 . . 4.240 2.566 2.131 2.979 . 0 0 "[ . 1 . 2]" 1
619 1 31 SER HA 1 82 LEU MD1 . . 3.740 2.039 1.864 2.301 . 0 0 "[ . 1 . 2]" 1
620 1 31 SER HA 1 82 LEU MD2 . . 4.640 3.974 3.791 4.123 . 0 0 "[ . 1 . 2]" 1
621 1 31 SER HA 1 82 LEU HG . . 4.320 2.444 2.207 2.712 . 0 0 "[ . 1 . 2]" 1
622 1 31 SER HA 1 111 THR MG . . 5.170 3.924 3.676 4.074 . 0 0 "[ . 1 . 2]" 1
623 1 31 SER QB 1 33 GLU H . . 5.340 5.031 4.576 5.318 . 0 0 "[ . 1 . 2]" 1
624 1 31 SER QB 1 78 VAL QG . . 3.010 2.333 2.087 3.062 0.052 12 0 "[ . 1 . 2]" 1
625 1 31 SER QB 1 80 GLU HA . . 4.210 2.436 1.964 3.352 . 0 0 "[ . 1 . 2]" 1
626 1 31 SER QB 1 80 GLU HG2 . . 4.360 3.439 2.751 4.262 . 0 0 "[ . 1 . 2]" 1
627 1 31 SER QB 1 81 GLY H . . 4.590 3.897 3.229 4.593 0.003 5 0 "[ . 1 . 2]" 1
628 1 31 SER HB2 1 32 ILE H . . 3.740 2.991 2.234 3.833 0.093 19 0 "[ . 1 . 2]" 1
629 1 31 SER HB3 1 32 ILE H . . 3.740 2.979 2.132 3.749 0.009 3 0 "[ . 1 . 2]" 1
630 1 32 ILE H 1 32 ILE HB . . 3.560 2.734 2.601 2.861 . 0 0 "[ . 1 . 2]" 1
631 1 32 ILE H 1 32 ILE MD . . 4.270 4.094 3.810 4.249 . 0 0 "[ . 1 . 2]" 1
632 1 32 ILE H 1 32 ILE HG12 . . 4.400 4.302 4.170 4.411 0.011 19 0 "[ . 1 . 2]" 1
633 1 32 ILE H 1 32 ILE HG13 . . 3.670 3.131 2.967 3.276 . 0 0 "[ . 1 . 2]" 1
634 1 32 ILE H 1 32 ILE MG . . 4.050 3.859 3.782 3.916 . 0 0 "[ . 1 . 2]" 1
635 1 32 ILE H 1 33 GLU H . . 4.400 4.219 3.987 4.334 . 0 0 "[ . 1 . 2]" 1
636 1 32 ILE H 1 78 VAL HA . . 4.690 4.156 3.965 4.360 . 0 0 "[ . 1 . 2]" 1
637 1 32 ILE H 1 78 VAL QG . . 3.640 2.872 2.405 3.166 . 0 0 "[ . 1 . 2]" 1
638 1 32 ILE H 1 79 VAL H . . 3.780 3.300 2.969 3.767 . 0 0 "[ . 1 . 2]" 1
639 1 32 ILE H 1 79 VAL HB . . 3.620 2.908 2.561 3.238 . 0 0 "[ . 1 . 2]" 1
640 1 32 ILE H 1 80 GLU HA . . 4.380 4.147 3.951 4.392 0.012 15 0 "[ . 1 . 2]" 1
641 1 32 ILE H 1 82 LEU MD1 . . 3.510 2.307 1.937 2.681 . 0 0 "[ . 1 . 2]" 1
642 1 32 ILE HA 1 32 ILE MD . . 3.920 3.846 3.823 3.873 . 0 0 "[ . 1 . 2]" 1
643 1 32 ILE HA 1 32 ILE HG12 . . 3.990 2.615 2.543 2.766 . 0 0 "[ . 1 . 2]" 1
644 1 32 ILE HA 1 32 ILE HG13 . . 3.390 2.802 2.634 2.955 . 0 0 "[ . 1 . 2]" 1
645 1 32 ILE HA 1 32 ILE MG . . 3.170 2.409 2.325 2.478 . 0 0 "[ . 1 . 2]" 1
646 1 32 ILE HA 1 33 GLU H . . 3.010 2.149 2.141 2.165 . 0 0 "[ . 1 . 2]" 1
647 1 32 ILE HA 1 33 GLU HB2 . . 4.910 4.577 4.466 4.725 . 0 0 "[ . 1 . 2]" 1
648 1 32 ILE HA 1 33 GLU HB3 . . 4.700 4.575 4.453 4.673 . 0 0 "[ . 1 . 2]" 1
649 1 32 ILE HA 1 78 VAL QG . . 4.440 3.951 3.556 4.160 . 0 0 "[ . 1 . 2]" 1
650 1 32 ILE HA 1 82 LEU MD1 . . 4.640 3.758 3.605 3.922 . 0 0 "[ . 1 . 2]" 1
651 1 32 ILE HA 1 109 VAL MG2 . . 5.500 5.010 4.836 5.141 . 0 0 "[ . 1 . 2]" 1
652 1 32 ILE HB 1 32 ILE MD . . 3.430 2.287 2.184 2.409 . 0 0 "[ . 1 . 2]" 1
653 1 32 ILE HB 1 33 GLU H . . 4.390 4.258 4.165 4.413 0.023 19 0 "[ . 1 . 2]" 1
654 1 32 ILE HB 1 79 VAL H . . 4.120 3.604 3.299 3.925 . 0 0 "[ . 1 . 2]" 1
655 1 32 ILE HB 1 79 VAL HB . . 3.650 2.517 2.324 2.745 . 0 0 "[ . 1 . 2]" 1
656 1 32 ILE HB 1 79 VAL MG2 . . 3.960 3.386 3.232 3.588 . 0 0 "[ . 1 . 2]" 1
657 1 32 ILE HB 1 82 LEU MD1 . . 3.970 2.600 2.309 2.812 . 0 0 "[ . 1 . 2]" 1
658 1 32 ILE HB 1 90 PHE QE . . 4.760 3.357 3.019 3.805 . 0 0 "[ . 1 . 2]" 1
659 1 32 ILE HB 1 90 PHE HZ . . 4.700 4.099 3.534 4.289 . 0 0 "[ . 1 . 2]" 1
660 1 32 ILE MD 1 32 ILE MG . . 2.860 2.209 1.938 2.352 . 0 0 "[ . 1 . 2]" 1
661 1 32 ILE MD 1 79 VAL HB . . 3.900 3.647 2.986 3.897 . 0 0 "[ . 1 . 2]" 1
662 1 32 ILE MD 1 79 VAL MG2 . . 4.180 4.007 3.697 4.218 0.038 13 0 "[ . 1 . 2]" 1
663 1 32 ILE MD 1 82 LEU MD1 . . 3.010 1.851 1.705 2.027 . 0 0 "[ . 1 . 2]" 1
664 1 32 ILE MD 1 87 LEU HA . . 4.920 4.472 4.213 4.824 . 0 0 "[ . 1 . 2]" 1
665 1 32 ILE MD 1 88 TYR H . . 4.420 3.846 3.693 4.071 . 0 0 "[ . 1 . 2]" 1
666 1 32 ILE MD 1 88 TYR HB2 . . 3.830 2.396 2.201 2.523 . 0 0 "[ . 1 . 2]" 1
667 1 32 ILE MD 1 88 TYR HB3 . . 3.810 3.416 3.130 3.664 . 0 0 "[ . 1 . 2]" 1
668 1 32 ILE MD 1 88 TYR QD . . 3.630 2.502 1.985 2.864 . 0 0 "[ . 1 . 2]" 1
669 1 32 ILE MD 1 90 PHE QD . . 4.450 4.156 3.843 4.395 . 0 0 "[ . 1 . 2]" 1
670 1 32 ILE MD 1 90 PHE QE . . 3.120 2.225 1.980 2.431 . 0 0 "[ . 1 . 2]" 1
671 1 32 ILE MD 1 90 PHE HZ . . 3.510 3.145 2.658 3.430 . 0 0 "[ . 1 . 2]" 1
672 1 32 ILE MD 1 109 VAL H . . 4.430 4.265 4.108 4.437 0.007 6 0 "[ . 1 . 2]" 1
673 1 32 ILE MD 1 109 VAL HB . . 4.190 3.470 3.202 3.836 . 0 0 "[ . 1 . 2]" 1
674 1 32 ILE MD 1 109 VAL MG2 . . 2.760 1.882 1.764 2.255 . 0 0 "[ . 1 . 2]" 1
675 1 32 ILE MD 1 111 THR H . . 4.150 3.341 3.019 3.728 . 0 0 "[ . 1 . 2]" 1
676 1 32 ILE MD 1 111 THR HA . . 3.920 3.576 3.345 3.909 . 0 0 "[ . 1 . 2]" 1
677 1 32 ILE MD 1 111 THR MG . . 3.010 1.949 1.754 2.133 . 0 0 "[ . 1 . 2]" 1
678 1 32 ILE HG12 1 33 GLU H . . 4.590 4.373 4.241 4.512 . 0 0 "[ . 1 . 2]" 1
679 1 32 ILE HG12 1 82 LEU MD1 . . 3.580 3.267 3.152 3.437 . 0 0 "[ . 1 . 2]" 1
680 1 32 ILE HG12 1 88 TYR QD . . 5.230 5.019 4.660 5.256 0.026 15 0 "[ . 1 . 2]" 1
681 1 32 ILE HG12 1 109 VAL MG2 . . 3.870 3.401 3.070 3.674 . 0 0 "[ . 1 . 2]" 1
682 1 32 ILE HG13 1 82 LEU MD1 . . 4.330 1.885 1.796 2.049 . 0 0 "[ . 1 . 2]" 1
683 1 32 ILE HG13 1 111 THR HA . . 5.280 4.242 3.889 4.454 . 0 0 "[ . 1 . 2]" 1
684 1 32 ILE HG13 1 111 THR MG . . 3.530 2.136 1.928 2.288 . 0 0 "[ . 1 . 2]" 1
685 1 32 ILE MG 1 33 GLU H . . 3.460 2.492 2.240 2.824 . 0 0 "[ . 1 . 2]" 1
686 1 32 ILE MG 1 33 GLU HB3 . . 4.750 4.125 3.944 4.455 . 0 0 "[ . 1 . 2]" 1
687 1 32 ILE MG 1 34 LEU H . . 4.950 4.563 4.395 4.699 . 0 0 "[ . 1 . 2]" 1
688 1 32 ILE MG 1 34 LEU HA . . 4.470 4.337 4.209 4.473 0.003 19 0 "[ . 1 . 2]" 1
689 1 32 ILE MG 1 34 LEU HB2 . . 5.500 4.485 4.237 4.857 . 0 0 "[ . 1 . 2]" 1
690 1 32 ILE MG 1 34 LEU HB3 . . 5.260 5.041 4.900 5.153 . 0 0 "[ . 1 . 2]" 1
691 1 32 ILE MG 1 34 LEU MD1 . . 3.200 2.747 2.408 3.103 . 0 0 "[ . 1 . 2]" 1
692 1 32 ILE MG 1 34 LEU MD2 . . 3.250 3.077 2.821 3.254 0.004 9 0 "[ . 1 . 2]" 1
693 1 32 ILE MG 1 34 LEU HG . . 3.010 2.470 2.261 2.685 . 0 0 "[ . 1 . 2]" 1
694 1 32 ILE MG 1 79 VAL H . . 4.690 4.115 3.888 4.415 . 0 0 "[ . 1 . 2]" 1
695 1 32 ILE MG 1 79 VAL HB . . 4.500 3.925 3.638 4.155 . 0 0 "[ . 1 . 2]" 1
696 1 32 ILE MG 1 82 LEU MD2 . . 5.500 5.346 5.160 5.505 0.005 11 0 "[ . 1 . 2]" 1
697 1 32 ILE MG 1 90 PHE QE . . 3.690 3.052 2.331 3.441 . 0 0 "[ . 1 . 2]" 1
698 1 32 ILE MG 1 90 PHE HZ . . 4.780 4.654 3.975 4.800 0.020 16 0 "[ . 1 . 2]" 1
699 1 32 ILE MG 1 109 VAL MG1 . . 3.820 3.517 3.356 3.708 . 0 0 "[ . 1 . 2]" 1
700 1 32 ILE MG 1 109 VAL MG2 . . 3.000 2.126 1.940 2.309 . 0 0 "[ . 1 . 2]" 1
701 1 32 ILE MG 1 111 THR MG . . 4.230 3.913 3.754 4.085 . 0 0 "[ . 1 . 2]" 1
702 1 33 GLU H 1 33 GLU HB2 . . 3.440 2.722 2.620 2.854 . 0 0 "[ . 1 . 2]" 1
703 1 33 GLU H 1 33 GLU HB3 . . 3.410 2.446 2.334 2.534 . 0 0 "[ . 1 . 2]" 1
704 1 33 GLU H 1 33 GLU HG2 . . 4.750 4.418 4.331 4.617 . 0 0 "[ . 1 . 2]" 1
705 1 33 GLU H 1 33 GLU QG . . 4.120 3.970 3.937 3.993 . 0 0 "[ . 1 . 2]" 1
706 1 33 GLU H 1 33 GLU HG3 . . 4.750 4.503 4.268 4.564 . 0 0 "[ . 1 . 2]" 1
707 1 33 GLU H 1 34 LEU H . . 4.780 4.573 4.534 4.599 . 0 0 "[ . 1 . 2]" 1
708 1 33 GLU H 1 34 LEU HG . . 5.430 4.620 4.467 4.764 . 0 0 "[ . 1 . 2]" 1
709 1 33 GLU H 1 78 VAL MG1 . . 5.300 4.268 3.611 5.397 0.097 12 0 "[ . 1 . 2]" 1
710 1 33 GLU H 1 78 VAL QG . . 4.230 3.532 2.826 3.783 . 0 0 "[ . 1 . 2]" 1
711 1 33 GLU H 1 78 VAL MG2 . . 5.300 3.926 2.836 4.306 . 0 0 "[ . 1 . 2]" 1
712 1 33 GLU HA 1 33 GLU HG2 . . 4.100 3.313 3.160 3.828 . 0 0 "[ . 1 . 2]" 1
713 1 33 GLU HA 1 33 GLU QG . . 3.530 2.471 2.343 3.113 . 0 0 "[ . 1 . 2]" 1
714 1 33 GLU HA 1 33 GLU HG3 . . 4.100 2.554 2.397 3.295 . 0 0 "[ . 1 . 2]" 1
715 1 33 GLU HA 1 34 LEU H . . 3.030 2.203 2.160 2.259 . 0 0 "[ . 1 . 2]" 1
716 1 33 GLU HA 1 34 LEU HG . . 5.030 4.169 3.858 4.360 . 0 0 "[ . 1 . 2]" 1
717 1 33 GLU HA 1 78 VAL HA . . 3.420 2.320 1.907 2.778 . 0 0 "[ . 1 . 2]" 1
718 1 33 GLU HA 1 78 VAL MG1 . . 3.560 3.168 2.734 3.581 0.021 19 0 "[ . 1 . 2]" 1
719 1 33 GLU HA 1 78 VAL QG . . 2.990 1.997 1.812 2.338 . 0 0 "[ . 1 . 2]" 1
720 1 33 GLU HA 1 78 VAL MG2 . . 3.560 2.021 1.822 2.369 . 0 0 "[ . 1 . 2]" 1
721 1 33 GLU HA 1 79 VAL H . . 4.140 3.961 3.742 4.156 0.016 14 0 "[ . 1 . 2]" 1
722 1 33 GLU HB2 1 33 GLU QG . . 2.520 2.395 2.327 2.441 . 0 0 "[ . 1 . 2]" 1
723 1 33 GLU HB2 1 34 LEU H . . 4.500 4.069 3.918 4.227 . 0 0 "[ . 1 . 2]" 1
724 1 33 GLU HB2 1 78 VAL QG . . 3.360 2.605 2.180 3.084 . 0 0 "[ . 1 . 2]" 1
725 1 33 GLU HB3 1 34 LEU H . . 4.410 4.053 3.966 4.134 . 0 0 "[ . 1 . 2]" 1
726 1 33 GLU HB3 1 35 TYR QD . . 5.200 4.827 4.672 4.987 . 0 0 "[ . 1 . 2]" 1
727 1 33 GLU HB3 1 35 TYR QE . . 5.500 5.435 5.216 5.567 0.067 12 0 "[ . 1 . 2]" 1
728 1 33 GLU HB3 1 78 VAL MG1 . . 5.050 5.029 4.377 5.238 0.188 13 0 "[ . 1 . 2]" 1
729 1 33 GLU HB3 1 78 VAL QG . . 4.380 3.774 3.427 4.065 . 0 0 "[ . 1 . 2]" 1
730 1 33 GLU HB3 1 78 VAL MG2 . . 5.050 3.907 3.474 4.275 . 0 0 "[ . 1 . 2]" 1
731 1 33 GLU QG 1 35 TYR QD . . 3.520 2.842 2.644 3.020 . 0 0 "[ . 1 . 2]" 1
732 1 33 GLU QG 1 35 TYR QE . . 4.480 4.250 3.965 4.458 . 0 0 "[ . 1 . 2]" 1
733 1 33 GLU QG 1 78 VAL HA . . 4.730 4.131 3.724 4.692 . 0 0 "[ . 1 . 2]" 1
734 1 33 GLU QG 1 78 VAL QG . . 3.110 2.551 2.232 3.224 0.114 19 0 "[ . 1 . 2]" 1
735 1 33 GLU HG2 1 34 LEU H . . 4.680 3.041 2.752 4.156 . 0 0 "[ . 1 . 2]" 1
736 1 33 GLU HG2 1 78 VAL HA . . 5.500 5.360 4.886 5.578 0.078 2 0 "[ . 1 . 2]" 1
737 1 33 GLU HG3 1 34 LEU H . . 4.680 2.634 2.229 2.948 . 0 0 "[ . 1 . 2]" 1
738 1 33 GLU HG3 1 78 VAL HA . . 5.500 4.302 3.862 5.047 . 0 0 "[ . 1 . 2]" 1
739 1 34 LEU H 1 34 LEU HB2 . . 3.510 2.692 2.600 2.762 . 0 0 "[ . 1 . 2]" 1
740 1 34 LEU H 1 34 LEU MD1 . . 4.260 4.111 3.845 4.275 0.015 14 0 "[ . 1 . 2]" 1
741 1 34 LEU H 1 34 LEU MD2 . . 4.470 4.335 4.239 4.443 . 0 0 "[ . 1 . 2]" 1
742 1 34 LEU H 1 34 LEU HG . . 3.740 3.541 3.309 3.674 . 0 0 "[ . 1 . 2]" 1
743 1 34 LEU H 1 35 TYR H . . 4.590 4.321 4.216 4.405 . 0 0 "[ . 1 . 2]" 1
744 1 34 LEU H 1 35 TYR QD . . 4.950 4.534 4.319 4.797 . 0 0 "[ . 1 . 2]" 1
745 1 34 LEU H 1 36 TRP HZ3 . . 5.480 5.355 4.950 5.499 0.019 1 0 "[ . 1 . 2]" 1
746 1 34 LEU H 1 77 HIS H . . 3.670 2.957 2.786 3.279 . 0 0 "[ . 1 . 2]" 1
747 1 34 LEU H 1 78 VAL HA . . 3.630 3.074 2.725 3.296 . 0 0 "[ . 1 . 2]" 1
748 1 34 LEU H 1 78 VAL MG1 . . 5.010 4.613 4.266 4.821 . 0 0 "[ . 1 . 2]" 1
749 1 34 LEU H 1 78 VAL QG . . 3.740 2.960 2.451 3.749 0.009 19 0 "[ . 1 . 2]" 1
750 1 34 LEU H 1 78 VAL MG2 . . 5.010 3.034 2.460 4.124 . 0 0 "[ . 1 . 2]" 1
751 1 34 LEU H 1 79 VAL H . . 5.020 4.606 4.270 4.901 . 0 0 "[ . 1 . 2]" 1
752 1 34 LEU HA 1 34 LEU MD1 . . 4.250 3.864 3.845 3.903 . 0 0 "[ . 1 . 2]" 1
753 1 34 LEU HA 1 34 LEU MD2 . . 3.020 2.204 2.002 2.495 . 0 0 "[ . 1 . 2]" 1
754 1 34 LEU HA 1 35 TYR H . . 2.850 2.211 2.155 2.311 . 0 0 "[ . 1 . 2]" 1
755 1 34 LEU HA 1 35 TYR QD . . 4.290 3.572 3.240 3.907 . 0 0 "[ . 1 . 2]" 1
756 1 34 LEU HB2 1 34 LEU MD1 . . 3.240 2.072 1.992 2.137 . 0 0 "[ . 1 . 2]" 1
757 1 34 LEU HB2 1 34 LEU MD2 . . 3.270 3.164 3.125 3.186 . 0 0 "[ . 1 . 2]" 1
758 1 34 LEU HB2 1 35 TYR H . . 4.310 4.138 3.857 4.325 0.015 9 0 "[ . 1 . 2]" 1
759 1 34 LEU HB2 1 36 TRP HE3 . . 4.550 4.375 3.998 4.557 0.007 10 0 "[ . 1 . 2]" 1
760 1 34 LEU HB2 1 36 TRP HZ3 . . 4.020 3.253 2.903 3.534 . 0 0 "[ . 1 . 2]" 1
761 1 34 LEU HB2 1 56 ILE MG . . 5.500 4.821 4.577 5.148 . 0 0 "[ . 1 . 2]" 1
762 1 34 LEU HB2 1 76 ARG HA . . 5.420 4.921 4.709 5.095 . 0 0 "[ . 1 . 2]" 1
763 1 34 LEU HB2 1 77 HIS H . . 4.190 3.378 3.244 3.494 . 0 0 "[ . 1 . 2]" 1
764 1 34 LEU HB2 1 77 HIS HB2 . . 5.050 4.577 4.225 4.748 . 0 0 "[ . 1 . 2]" 1
765 1 34 LEU HB2 1 78 VAL QG . . 5.440 4.603 4.015 5.142 . 0 0 "[ . 1 . 2]" 1
766 1 34 LEU HB3 1 35 TYR H . . 3.740 3.010 2.642 3.294 . 0 0 "[ . 1 . 2]" 1
767 1 34 LEU HB3 1 36 TRP H . . 5.350 5.137 4.948 5.357 0.007 9 0 "[ . 1 . 2]" 1
768 1 34 LEU HB3 1 36 TRP HE3 . . 4.170 3.099 2.942 3.258 . 0 0 "[ . 1 . 2]" 1
769 1 34 LEU HB3 1 36 TRP HZ3 . . 4.210 2.997 2.560 3.461 . 0 0 "[ . 1 . 2]" 1
770 1 34 LEU MD1 1 35 TYR H . . 5.090 4.937 4.804 5.097 0.007 2 0 "[ . 1 . 2]" 1
771 1 34 LEU MD1 1 36 TRP HZ3 . . 4.320 3.556 3.043 3.890 . 0 0 "[ . 1 . 2]" 1
772 1 34 LEU MD1 1 56 ILE MG . . 3.790 3.114 2.710 3.463 . 0 0 "[ . 1 . 2]" 1
773 1 34 LEU MD1 1 69 ILE MD . . 3.880 3.719 3.479 3.891 0.011 12 0 "[ . 1 . 2]" 1
774 1 34 LEU MD1 1 77 HIS H . . 5.050 4.876 4.689 5.019 . 0 0 "[ . 1 . 2]" 1
775 1 34 LEU MD1 1 77 HIS HB3 . . 4.720 3.422 3.066 3.580 . 0 0 "[ . 1 . 2]" 1
776 1 34 LEU MD1 1 77 HIS HD2 . . 4.160 2.794 2.000 3.506 . 0 0 "[ . 1 . 2]" 1
777 1 34 LEU MD1 1 79 VAL H . . 4.390 3.570 3.227 3.892 . 0 0 "[ . 1 . 2]" 1
778 1 34 LEU MD1 1 79 VAL MG2 . . 3.100 2.394 2.006 2.641 . 0 0 "[ . 1 . 2]" 1
779 1 34 LEU MD1 1 90 PHE HB2 . . 4.030 3.006 2.269 3.272 . 0 0 "[ . 1 . 2]" 1
780 1 34 LEU MD1 1 90 PHE HB3 . . 4.120 3.347 2.628 3.595 . 0 0 "[ . 1 . 2]" 1
781 1 34 LEU MD1 1 90 PHE QD . . 4.050 2.627 2.225 3.246 . 0 0 "[ . 1 . 2]" 1
782 1 34 LEU MD1 1 90 PHE QE . . 4.800 3.205 2.718 3.804 . 0 0 "[ . 1 . 2]" 1
783 1 34 LEU MD1 1 107 VAL MG2 . . 4.160 3.574 3.230 3.860 . 0 0 "[ . 1 . 2]" 1
784 1 34 LEU MD1 1 109 VAL MG2 . . 4.430 3.664 3.452 4.124 . 0 0 "[ . 1 . 2]" 1
785 1 34 LEU MD2 1 35 TYR H . . 3.530 3.156 2.926 3.453 . 0 0 "[ . 1 . 2]" 1
786 1 34 LEU MD2 1 36 TRP HE3 . . 4.240 4.108 3.805 4.278 0.038 19 0 "[ . 1 . 2]" 1
787 1 34 LEU MD2 1 36 TRP HZ3 . . 4.750 4.470 4.119 4.698 . 0 0 "[ . 1 . 2]" 1
788 1 34 LEU MD2 1 77 HIS H . . 5.500 5.564 5.517 5.618 0.118 19 0 "[ . 1 . 2]" 1
789 1 34 LEU MD2 1 77 HIS HB3 . . 5.500 5.165 4.836 5.503 0.003 12 0 "[ . 1 . 2]" 1
790 1 34 LEU MD2 1 90 PHE HB2 . . 4.350 3.865 3.280 4.132 . 0 0 "[ . 1 . 2]" 1
791 1 34 LEU MD2 1 90 PHE HB3 . . 5.300 4.764 4.186 5.138 . 0 0 "[ . 1 . 2]" 1
792 1 34 LEU MD2 1 90 PHE QD . . 4.020 3.418 2.933 3.809 . 0 0 "[ . 1 . 2]" 1
793 1 34 LEU MD2 1 90 PHE QE . . 4.940 4.509 3.992 4.796 . 0 0 "[ . 1 . 2]" 1
794 1 34 LEU MD2 1 107 VAL MG2 . . 3.440 2.956 2.784 3.225 . 0 0 "[ . 1 . 2]" 1
795 1 34 LEU MD2 1 109 VAL HB . . 5.500 5.216 4.969 5.442 . 0 0 "[ . 1 . 2]" 1
796 1 34 LEU MD2 1 109 VAL MG1 . . 3.690 3.369 3.132 3.700 0.010 6 0 "[ . 1 . 2]" 1
797 1 34 LEU MD2 1 109 VAL MG2 . . 3.520 3.333 3.113 3.526 0.006 14 0 "[ . 1 . 2]" 1
798 1 34 LEU HG 1 77 HIS HB3 . . 5.500 5.346 4.916 5.535 0.035 19 0 "[ . 1 . 2]" 1
799 1 34 LEU HG 1 79 VAL MG2 . . 4.770 4.078 3.643 4.493 . 0 0 "[ . 1 . 2]" 1
800 1 35 TYR H 1 35 TYR HB2 . . 4.100 3.921 3.859 3.964 . 0 0 "[ . 1 . 2]" 1
801 1 35 TYR H 1 35 TYR HB3 . . 3.950 3.319 3.214 3.434 . 0 0 "[ . 1 . 2]" 1
802 1 35 TYR H 1 35 TYR QD . . 3.470 3.052 2.863 3.271 . 0 0 "[ . 1 . 2]" 1
803 1 35 TYR H 1 35 TYR QE . . 4.590 4.394 4.280 4.564 . 0 0 "[ . 1 . 2]" 1
804 1 35 TYR H 1 36 TRP H . . 4.360 4.110 3.980 4.279 . 0 0 "[ . 1 . 2]" 1
805 1 35 TYR H 1 36 TRP HE3 . . 4.850 3.932 3.473 4.215 . 0 0 "[ . 1 . 2]" 1
806 1 35 TYR H 1 37 ASP H . . 5.500 5.387 5.254 5.527 0.027 17 0 "[ . 1 . 2]" 1
807 1 35 TYR HA 1 35 TYR QD . . 4.050 3.735 3.715 3.742 . 0 0 "[ . 1 . 2]" 1
808 1 35 TYR HA 1 36 TRP H . . 3.060 2.142 2.137 2.158 . 0 0 "[ . 1 . 2]" 1
809 1 35 TYR HA 1 36 TRP HE3 . . 4.010 3.582 3.185 3.803 . 0 0 "[ . 1 . 2]" 1
810 1 35 TYR HA 1 37 ASP H . . 4.400 3.750 3.458 3.993 . 0 0 "[ . 1 . 2]" 1
811 1 35 TYR HA 1 76 ARG H . . 4.610 4.493 4.315 4.654 0.044 1 0 "[ . 1 . 2]" 1
812 1 35 TYR HA 1 76 ARG HA . . 3.430 2.056 1.982 2.134 . 0 0 "[ . 1 . 2]" 1
813 1 35 TYR HA 1 76 ARG HB2 . . 4.280 3.719 3.546 3.913 . 0 0 "[ . 1 . 2]" 1
814 1 35 TYR HA 1 76 ARG HB3 . . 5.020 4.860 4.736 4.989 . 0 0 "[ . 1 . 2]" 1
815 1 35 TYR HA 1 77 HIS H . . 3.830 3.566 3.226 3.711 . 0 0 "[ . 1 . 2]" 1
816 1 35 TYR HB2 1 36 TRP H . . 3.770 3.411 3.231 3.557 . 0 0 "[ . 1 . 2]" 1
817 1 35 TYR HB2 1 37 ASP H . . 4.910 3.051 2.910 3.213 . 0 0 "[ . 1 . 2]" 1
818 1 35 TYR HB2 1 76 ARG HA . . 4.200 3.686 3.462 3.806 . 0 0 "[ . 1 . 2]" 1
819 1 35 TYR HB2 1 76 ARG HB2 . . 4.800 3.752 3.554 3.892 . 0 0 "[ . 1 . 2]" 1
820 1 35 TYR HB2 1 76 ARG HB3 . . 5.500 5.421 5.247 5.524 0.024 7 0 "[ . 1 . 2]" 1
821 1 35 TYR HB2 1 76 ARG HG3 . . 5.030 4.071 3.443 4.756 . 0 0 "[ . 1 . 2]" 1
822 1 35 TYR HB2 1 77 HIS H . . 5.500 5.364 5.079 5.505 0.005 4 0 "[ . 1 . 2]" 1
823 1 35 TYR HB3 1 36 TRP H . . 4.490 4.290 4.202 4.348 . 0 0 "[ . 1 . 2]" 1
824 1 35 TYR HB3 1 37 ASP H . . 5.200 4.690 4.530 4.857 . 0 0 "[ . 1 . 2]" 1
825 1 35 TYR HB3 1 76 ARG HA . . 4.090 3.341 3.097 3.574 . 0 0 "[ . 1 . 2]" 1
826 1 35 TYR HB3 1 76 ARG HB2 . . 4.650 3.522 3.224 3.930 . 0 0 "[ . 1 . 2]" 1
827 1 35 TYR HB3 1 76 ARG HB3 . . 5.190 5.000 4.767 5.215 0.025 6 0 "[ . 1 . 2]" 1
828 1 35 TYR HB3 1 76 ARG HG3 . . 4.090 2.803 2.434 3.382 . 0 0 "[ . 1 . 2]" 1
829 1 35 TYR HB3 1 77 HIS H . . 4.400 4.311 4.152 4.426 0.026 18 0 "[ . 1 . 2]" 1
830 1 35 TYR QD 1 36 TRP H . . 4.640 4.179 3.942 4.440 . 0 0 "[ . 1 . 2]" 1
831 1 35 TYR QD 1 36 TRP HA . . 4.810 3.764 3.474 4.005 . 0 0 "[ . 1 . 2]" 1
832 1 35 TYR QD 1 37 ASP H . . 4.040 2.942 2.585 3.396 . 0 0 "[ . 1 . 2]" 1
833 1 35 TYR QD 1 38 LEU HB2 . . 5.500 5.484 5.087 5.606 0.106 10 0 "[ . 1 . 2]" 1
834 1 35 TYR QD 1 38 LEU MD1 . . 4.260 3.686 2.176 4.291 0.031 10 0 "[ . 1 . 2]" 1
835 1 35 TYR QD 1 38 LEU MD2 . . 4.260 3.141 2.117 4.273 0.013 17 0 "[ . 1 . 2]" 1
836 1 35 TYR QD 1 38 LEU HG . . 5.500 4.397 3.249 5.427 . 0 0 "[ . 1 . 2]" 1
837 1 35 TYR QD 1 76 ARG HA . . 5.500 4.991 4.836 5.118 . 0 0 "[ . 1 . 2]" 1
838 1 35 TYR QD 1 76 ARG HB2 . . 5.500 5.293 5.070 5.510 0.010 14 0 "[ . 1 . 2]" 1
839 1 35 TYR QD 1 76 ARG HG3 . . 4.620 4.289 4.006 4.615 . 0 0 "[ . 1 . 2]" 1
840 1 35 TYR QD 1 77 HIS H . . 5.500 5.468 5.273 5.570 0.070 17 0 "[ . 1 . 2]" 1
841 1 35 TYR QE 1 38 LEU MD1 . . 4.520 3.148 1.973 4.123 . 0 0 "[ . 1 . 2]" 1
842 1 35 TYR QE 1 38 LEU QD . . 3.890 2.433 1.955 2.902 . 0 0 "[ . 1 . 2]" 1
843 1 35 TYR QE 1 38 LEU MD2 . . 4.520 2.776 2.232 3.475 . 0 0 "[ . 1 . 2]" 1
844 1 35 TYR QE 1 38 LEU HG . . 4.550 4.017 3.403 4.610 0.060 15 0 "[ . 1 . 2]" 1
845 1 36 TRP H 1 36 TRP HE3 . . 3.610 3.063 2.866 3.290 . 0 0 "[ . 1 . 2]" 1
846 1 36 TRP H 1 36 TRP HZ3 . . 5.060 4.699 4.497 4.917 . 0 0 "[ . 1 . 2]" 1
847 1 36 TRP H 1 37 ASP H . . 3.700 2.591 2.250 2.890 . 0 0 "[ . 1 . 2]" 1
848 1 36 TRP H 1 37 ASP HA . . 4.900 4.398 4.248 4.546 . 0 0 "[ . 1 . 2]" 1
849 1 36 TRP H 1 75 THR HA . . 3.980 3.737 3.495 3.940 . 0 0 "[ . 1 . 2]" 1
850 1 36 TRP H 1 75 THR HB . . 3.720 3.023 2.634 3.342 . 0 0 "[ . 1 . 2]" 1
851 1 36 TRP H 1 75 THR MG . . 4.630 4.423 4.021 4.630 0.000 19 0 "[ . 1 . 2]" 1
852 1 36 TRP H 1 76 ARG H . . 4.980 4.754 4.638 4.913 . 0 0 "[ . 1 . 2]" 1
853 1 36 TRP H 1 76 ARG HA . . 3.760 3.412 3.079 3.590 . 0 0 "[ . 1 . 2]" 1
854 1 36 TRP H 1 76 ARG HB2 . . 5.300 4.989 4.694 5.230 . 0 0 "[ . 1 . 2]" 1
855 1 36 TRP H 1 77 HIS H . . 5.390 5.220 4.756 5.417 0.027 7 0 "[ . 1 . 2]" 1
856 1 36 TRP HA 1 36 TRP HE3 . . 4.550 4.217 4.080 4.303 . 0 0 "[ . 1 . 2]" 1
857 1 36 TRP HA 1 38 LEU H . . 4.270 3.078 2.867 3.418 . 0 0 "[ . 1 . 2]" 1
858 1 36 TRP HA 1 38 LEU MD1 . . 5.180 4.144 2.627 5.218 0.038 19 0 "[ . 1 . 2]" 1
859 1 36 TRP HA 1 38 LEU QD . . 4.100 2.678 2.069 3.409 . 0 0 "[ . 1 . 2]" 1
860 1 36 TRP HA 1 38 LEU MD2 . . 5.180 3.522 2.072 5.197 0.017 6 0 "[ . 1 . 2]" 1
861 1 36 TRP HB2 1 36 TRP HE3 . . 4.210 4.096 4.070 4.142 . 0 0 "[ . 1 . 2]" 1
862 1 36 TRP HB2 1 37 ASP H . . 4.470 4.423 4.314 4.461 . 0 0 "[ . 1 . 2]" 1
863 1 36 TRP HB2 1 38 LEU QD . . 4.580 4.280 3.710 4.661 0.081 9 0 "[ . 1 . 2]" 1
864 1 36 TRP HB2 1 39 GLU QB . . 4.810 4.213 3.450 4.767 . 0 0 "[ . 1 . 2]" 1
865 1 36 TRP HB2 1 39 GLU QG . . 4.590 3.341 2.606 3.584 . 0 0 "[ . 1 . 2]" 1
866 1 36 TRP HB2 1 92 LEU QD . . 3.950 2.333 1.888 2.610 . 0 0 "[ . 1 . 2]" 1
867 1 36 TRP HB2 1 94 VAL MG1 . . 5.500 5.474 5.284 5.565 0.065 16 0 "[ . 1 . 2]" 1
868 1 36 TRP HB3 1 37 ASP H . . 4.600 4.609 4.523 4.649 0.049 1 0 "[ . 1 . 2]" 1
869 1 36 TRP HB3 1 39 GLU QG . . 4.990 4.856 4.117 5.021 0.031 12 0 "[ . 1 . 2]" 1
870 1 36 TRP HB3 1 92 LEU MD1 . . 4.580 3.925 3.606 4.222 . 0 0 "[ . 1 . 2]" 1
871 1 36 TRP HB3 1 92 LEU QD . . 3.640 2.495 2.180 2.788 . 0 0 "[ . 1 . 2]" 1
872 1 36 TRP HB3 1 92 LEU MD2 . . 4.580 2.525 2.198 2.832 . 0 0 "[ . 1 . 2]" 1
873 1 36 TRP HD1 1 37 ASP H . . 4.790 4.759 4.387 4.879 0.089 11 0 "[ . 1 . 2]" 1
874 1 36 TRP HD1 1 37 ASP HA . . 4.890 3.955 3.857 4.111 . 0 0 "[ . 1 . 2]" 1
875 1 36 TRP HD1 1 39 GLU HB2 . . 5.440 4.000 2.685 5.490 0.050 10 0 "[ . 1 . 2]" 1
876 1 36 TRP HD1 1 39 GLU HB3 . . 5.440 5.184 3.997 5.493 0.053 17 0 "[ . 1 . 2]" 1
877 1 36 TRP HD1 1 39 GLU QG . . 4.710 3.798 2.677 4.693 . 0 0 "[ . 1 . 2]" 1
878 1 36 TRP HD1 1 40 GLN QB . . 5.340 5.126 4.730 5.531 0.191 20 0 "[ . 1 . 2]" 1
879 1 36 TRP HD1 1 54 PHE QE . . 3.950 3.617 3.342 3.954 0.004 14 0 "[ . 1 . 2]" 1
880 1 36 TRP HD1 1 75 THR HA . . 4.230 3.427 3.227 3.778 . 0 0 "[ . 1 . 2]" 1
881 1 36 TRP HD1 1 75 THR MG . . 3.800 3.388 3.031 3.833 0.033 5 0 "[ . 1 . 2]" 1
882 1 36 TRP HD1 1 92 LEU MD1 . . 4.240 3.597 3.239 3.936 . 0 0 "[ . 1 . 2]" 1
883 1 36 TRP HD1 1 92 LEU QD . . 3.730 2.981 2.657 3.252 . 0 0 "[ . 1 . 2]" 1
884 1 36 TRP HD1 1 92 LEU MD2 . . 4.240 3.191 2.821 3.524 . 0 0 "[ . 1 . 2]" 1
885 1 36 TRP HE1 1 54 PHE H . . 5.500 5.393 5.200 5.532 0.032 12 0 "[ . 1 . 2]" 1
886 1 36 TRP HE1 1 54 PHE HA . . 5.250 4.747 4.476 5.189 . 0 0 "[ . 1 . 2]" 1
887 1 36 TRP HE1 1 54 PHE HB2 . . 3.880 2.878 2.528 3.113 . 0 0 "[ . 1 . 2]" 1
888 1 36 TRP HE1 1 54 PHE HB3 . . 3.810 2.681 2.292 3.159 . 0 0 "[ . 1 . 2]" 1
889 1 36 TRP HE1 1 54 PHE QD . . 3.420 2.517 1.897 3.037 . 0 0 "[ . 1 . 2]" 1
890 1 36 TRP HE1 1 54 PHE QE . . 4.710 3.596 3.278 3.921 . 0 0 "[ . 1 . 2]" 1
891 1 36 TRP HE1 1 56 ILE QG . . 5.500 5.355 5.091 5.514 0.014 5 0 "[ . 1 . 2]" 1
892 1 36 TRP HE1 1 75 THR H . . 5.270 4.894 4.746 5.237 . 0 0 "[ . 1 . 2]" 1
893 1 36 TRP HE1 1 75 THR HA . . 3.300 2.287 2.150 2.505 . 0 0 "[ . 1 . 2]" 1
894 1 36 TRP HE1 1 75 THR HB . . 4.480 4.283 3.962 4.500 0.020 10 0 "[ . 1 . 2]" 1
895 1 36 TRP HE1 1 75 THR MG . . 3.520 3.261 3.064 3.478 . 0 0 "[ . 1 . 2]" 1
896 1 36 TRP HE1 1 92 LEU MD1 . . 4.880 3.432 3.007 3.934 . 0 0 "[ . 1 . 2]" 1
897 1 36 TRP HE1 1 92 LEU QD . . 3.970 3.296 2.939 3.727 . 0 0 "[ . 1 . 2]" 1
898 1 36 TRP HE1 1 92 LEU MD2 . . 4.880 4.279 3.876 4.670 . 0 0 "[ . 1 . 2]" 1
899 1 36 TRP HE1 1 94 VAL MG1 . . 5.500 5.163 4.713 5.516 0.016 10 0 "[ . 1 . 2]" 1
900 1 36 TRP HE3 1 56 ILE MD . . 4.140 3.355 2.992 3.954 . 0 0 "[ . 1 . 2]" 1
901 1 36 TRP HE3 1 76 ARG HA . . 4.820 4.512 4.298 4.738 . 0 0 "[ . 1 . 2]" 1
902 1 36 TRP HE3 1 77 HIS H . . 5.500 5.057 4.661 5.226 . 0 0 "[ . 1 . 2]" 1
903 1 36 TRP HE3 1 92 LEU QD . . 5.170 3.511 3.257 3.703 . 0 0 "[ . 1 . 2]" 1
904 1 36 TRP HH2 1 56 ILE HB . . 5.500 4.331 4.033 4.680 . 0 0 "[ . 1 . 2]" 1
905 1 36 TRP HH2 1 56 ILE MD . . 3.810 3.128 2.821 3.537 . 0 0 "[ . 1 . 2]" 1
906 1 36 TRP HH2 1 56 ILE QG . . 4.310 2.222 1.945 2.553 . 0 0 "[ . 1 . 2]" 1
907 1 36 TRP HH2 1 70 TYR HB3 . . 5.270 4.169 3.920 4.723 . 0 0 "[ . 1 . 2]" 1
908 1 36 TRP HH2 1 70 TYR QD . . 4.730 3.249 2.942 3.539 . 0 0 "[ . 1 . 2]" 1
909 1 36 TRP HH2 1 70 TYR QE . . 4.680 3.851 3.270 4.230 . 0 0 "[ . 1 . 2]" 1
910 1 36 TRP HH2 1 77 HIS H . . 4.750 4.726 4.433 4.841 0.091 16 0 "[ . 1 . 2]" 1
911 1 36 TRP HH2 1 77 HIS HA . . 5.210 4.455 4.325 4.800 . 0 0 "[ . 1 . 2]" 1
912 1 36 TRP HH2 1 77 HIS HB2 . . 3.750 2.074 1.988 2.454 . 0 0 "[ . 1 . 2]" 1
913 1 36 TRP HH2 1 77 HIS HB3 . . 3.950 2.695 2.566 2.883 . 0 0 "[ . 1 . 2]" 1
914 1 36 TRP HZ2 1 54 PHE H . . 5.500 5.469 5.327 5.525 0.025 16 0 "[ . 1 . 2]" 1
915 1 36 TRP HZ2 1 54 PHE HB2 . . 4.110 3.014 2.897 3.122 . 0 0 "[ . 1 . 2]" 1
916 1 36 TRP HZ2 1 54 PHE HB3 . . 4.190 2.876 2.410 3.389 . 0 0 "[ . 1 . 2]" 1
917 1 36 TRP HZ2 1 54 PHE QD . . 4.260 4.044 3.772 4.269 0.009 14 0 "[ . 1 . 2]" 1
918 1 36 TRP HZ2 1 56 ILE MD . . 4.770 3.609 3.131 4.150 . 0 0 "[ . 1 . 2]" 1
919 1 36 TRP HZ2 1 56 ILE QG . . 4.840 3.441 3.107 3.793 . 0 0 "[ . 1 . 2]" 1
920 1 36 TRP HZ2 1 70 TYR QD . . 4.380 3.726 3.479 3.924 . 0 0 "[ . 1 . 2]" 1
921 1 36 TRP HZ2 1 70 TYR QE . . 3.690 3.247 2.839 3.627 . 0 0 "[ . 1 . 2]" 1
922 1 36 TRP HZ2 1 74 ALA H . . 4.930 4.426 3.828 4.886 . 0 0 "[ . 1 . 2]" 1
923 1 36 TRP HZ2 1 74 ALA MB . . 4.230 3.861 3.423 4.132 . 0 0 "[ . 1 . 2]" 1
924 1 36 TRP HZ2 1 75 THR H . . 5.500 4.784 4.420 5.143 . 0 0 "[ . 1 . 2]" 1
925 1 36 TRP HZ2 1 75 THR HA . . 4.110 3.292 3.103 3.517 . 0 0 "[ . 1 . 2]" 1
926 1 36 TRP HZ2 1 75 THR MG . . 5.190 4.870 4.656 5.100 . 0 0 "[ . 1 . 2]" 1
927 1 36 TRP HZ2 1 76 ARG H . . 5.330 4.992 4.623 5.248 . 0 0 "[ . 1 . 2]" 1
928 1 36 TRP HZ2 1 77 HIS HB2 . . 4.580 4.127 3.918 4.399 . 0 0 "[ . 1 . 2]" 1
929 1 36 TRP HZ2 1 77 HIS HB3 . . 5.200 5.015 4.835 5.214 0.014 10 0 "[ . 1 . 2]" 1
930 1 36 TRP HZ2 1 92 LEU QD . . 4.650 3.869 3.492 4.283 . 0 0 "[ . 1 . 2]" 1
931 1 36 TRP HZ3 1 56 ILE MD . . 4.000 2.858 2.515 3.386 . 0 0 "[ . 1 . 2]" 1
932 1 36 TRP HZ3 1 76 ARG HA . . 4.710 4.353 3.881 4.694 . 0 0 "[ . 1 . 2]" 1
933 1 36 TRP HZ3 1 77 HIS H . . 4.160 3.947 3.577 4.120 . 0 0 "[ . 1 . 2]" 1
934 1 36 TRP HZ3 1 77 HIS HB2 . . 4.800 3.101 2.841 3.544 . 0 0 "[ . 1 . 2]" 1
935 1 36 TRP HZ3 1 77 HIS HB3 . . 4.430 2.081 1.989 2.429 . 0 0 "[ . 1 . 2]" 1
936 1 37 ASP H 1 37 ASP HB2 . . 3.940 3.111 2.231 3.623 . 0 0 "[ . 1 . 2]" 1
937 1 37 ASP H 1 37 ASP HB3 . . 3.940 2.664 2.254 2.921 . 0 0 "[ . 1 . 2]" 1
938 1 37 ASP H 1 38 LEU H . . 3.770 2.892 2.700 3.328 . 0 0 "[ . 1 . 2]" 1
939 1 37 ASP H 1 75 THR HB . . 4.090 2.839 2.362 3.305 . 0 0 "[ . 1 . 2]" 1
940 1 37 ASP H 1 75 THR MG . . 4.640 4.040 3.772 4.471 . 0 0 "[ . 1 . 2]" 1
941 1 37 ASP HA 1 38 LEU H . . 3.560 3.137 2.745 3.474 . 0 0 "[ . 1 . 2]" 1
942 1 37 ASP HA 1 75 THR HB . . 3.880 2.464 2.118 2.768 . 0 0 "[ . 1 . 2]" 1
943 1 37 ASP HA 1 75 THR MG . . 3.880 2.156 1.954 2.661 . 0 0 "[ . 1 . 2]" 1
944 1 37 ASP QB 1 38 LEU H . . 4.100 3.702 2.865 4.064 . 0 0 "[ . 1 . 2]" 1
945 1 37 ASP QB 1 38 LEU HA . . 5.150 4.439 3.916 4.812 . 0 0 "[ . 1 . 2]" 1
946 1 37 ASP QB 1 38 LEU QD . . 5.280 3.761 2.741 4.909 . 0 0 "[ . 1 . 2]" 1
947 1 37 ASP QB 1 75 THR MG . . 3.910 2.823 2.373 3.320 . 0 0 "[ . 1 . 2]" 1
948 1 37 ASP HB2 1 38 LEU H . . 4.680 4.299 3.820 4.607 . 0 0 "[ . 1 . 2]" 1
949 1 37 ASP HB2 1 75 THR HB . . 4.430 3.180 2.116 3.973 . 0 0 "[ . 1 . 2]" 1
950 1 37 ASP HB3 1 38 LEU H . . 4.680 4.101 2.960 4.664 . 0 0 "[ . 1 . 2]" 1
951 1 37 ASP HB3 1 75 THR HB . . 4.430 3.020 2.128 4.264 . 0 0 "[ . 1 . 2]" 1
952 1 38 LEU H 1 38 LEU HB2 . . 2.870 2.505 2.351 2.667 . 0 0 "[ . 1 . 2]" 1
953 1 38 LEU H 1 38 LEU HB3 . . 3.840 3.635 3.582 3.764 . 0 0 "[ . 1 . 2]" 1
954 1 38 LEU H 1 38 LEU MD1 . . 3.900 3.194 1.756 3.899 . 0 0 "[ . 1 . 2]" 1
955 1 38 LEU H 1 38 LEU QD . . 3.270 2.343 1.753 3.346 0.076 14 0 "[ . 1 . 2]" 1
956 1 38 LEU H 1 38 LEU MD2 . . 3.900 2.768 1.765 3.928 0.028 14 0 "[ . 1 . 2]" 1
957 1 38 LEU H 1 38 LEU HG . . 4.170 3.412 2.044 4.236 0.066 10 0 "[ . 1 . 2]" 1
958 1 38 LEU H 1 75 THR HB . . 5.020 4.760 4.453 5.031 0.011 20 0 "[ . 1 . 2]" 1
959 1 38 LEU H 1 75 THR MG . . 5.500 4.812 4.198 5.245 . 0 0 "[ . 1 . 2]" 1
960 1 38 LEU HA 1 38 LEU MD1 . . 3.810 2.744 1.892 3.976 0.166 13 0 "[ . 1 . 2]" 1
961 1 38 LEU HA 1 38 LEU QD . . 2.850 2.146 1.879 2.855 0.005 3 0 "[ . 1 . 2]" 1
962 1 38 LEU HA 1 38 LEU MD2 . . 3.810 2.874 2.096 3.852 0.042 11 0 "[ . 1 . 2]" 1
963 1 38 LEU HA 1 38 LEU HG . . 3.900 3.322 2.462 3.802 . 0 0 "[ . 1 . 2]" 1
964 1 38 LEU HA 1 41 LYS QE . . 4.400 3.242 2.373 4.317 . 0 0 "[ . 1 . 2]" 1
965 1 38 LEU HB2 1 38 LEU QD . . 2.770 2.134 1.994 2.235 . 0 0 "[ . 1 . 2]" 1
966 1 38 LEU HB2 1 39 GLU H . . 4.070 2.856 1.959 3.823 . 0 0 "[ . 1 . 2]" 1
967 1 38 LEU HB2 1 39 GLU QG . . 4.300 3.852 3.168 4.404 0.104 14 0 "[ . 1 . 2]" 1
968 1 38 LEU HB2 1 40 GLN QE . . 5.340 4.878 3.946 5.385 0.045 12 0 "[ . 1 . 2]" 1
969 1 38 LEU HB3 1 38 LEU QD . . 3.070 2.250 2.070 2.464 . 0 0 "[ . 1 . 2]" 1
970 1 38 LEU QD 1 39 GLU H . . 4.210 3.734 3.243 4.204 . 0 0 "[ . 1 . 2]" 1
971 1 38 LEU QD 1 40 GLN QE . . 4.850 4.452 3.547 4.947 0.097 9 0 "[ . 1 . 2]" 1
972 1 38 LEU QD 1 41 LYS QE . . 4.030 3.188 1.944 4.050 0.020 15 0 "[ . 1 . 2]" 1
973 1 38 LEU QD 1 41 LYS QG . . 4.630 3.866 2.746 4.689 0.059 19 0 "[ . 1 . 2]" 1
974 1 38 LEU MD1 1 39 GLU H . . 4.780 4.391 3.746 4.744 . 0 0 "[ . 1 . 2]" 1
975 1 38 LEU MD2 1 39 GLU H . . 4.780 4.216 3.347 4.866 0.086 13 0 "[ . 1 . 2]" 1
976 1 39 GLU H 1 39 GLU HB2 . . 3.950 2.717 2.194 3.620 . 0 0 "[ . 1 . 2]" 1
977 1 39 GLU H 1 39 GLU QB . . 3.380 2.517 2.172 2.848 . 0 0 "[ . 1 . 2]" 1
978 1 39 GLU H 1 39 GLU HB3 . . 3.950 3.462 2.740 3.780 . 0 0 "[ . 1 . 2]" 1
979 1 39 GLU H 1 39 GLU QG . . 3.790 2.477 1.827 3.581 . 0 0 "[ . 1 . 2]" 1
980 1 39 GLU H 1 40 GLN H . . 4.190 2.724 2.195 3.217 . 0 0 "[ . 1 . 2]" 1
981 1 39 GLU HA 1 39 GLU QG . . 3.490 2.749 2.231 3.399 . 0 0 "[ . 1 . 2]" 1
982 1 39 GLU QB 1 40 GLN H . . 4.070 2.437 1.886 3.229 . 0 0 "[ . 1 . 2]" 1
983 1 39 GLU QB 1 40 GLN QE . . 4.170 3.015 1.756 4.287 0.117 11 0 "[ . 1 . 2]" 1
984 1 39 GLU QB 1 54 PHE QE . . 4.590 3.657 2.896 4.355 . 0 0 "[ . 1 . 2]" 1
985 1 39 GLU QB 1 54 PHE HZ . . 4.760 3.317 2.032 4.311 . 0 0 "[ . 1 . 2]" 1
986 1 39 GLU HB2 1 54 PHE HZ . . 5.500 3.565 2.083 4.508 . 0 0 "[ . 1 . 2]" 1
987 1 39 GLU HB3 1 54 PHE HZ . . 5.500 4.166 2.402 5.490 . 0 0 "[ . 1 . 2]" 1
988 1 39 GLU QG 1 54 PHE QE . . 4.850 3.970 2.153 4.878 0.028 7 0 "[ . 1 . 2]" 1
989 1 39 GLU QG 1 54 PHE HZ . . 5.500 4.289 2.158 5.511 0.011 7 0 "[ . 1 . 2]" 1
990 1 39 GLU QG 1 92 LEU QD . . 3.950 3.216 2.312 3.840 . 0 0 "[ . 1 . 2]" 1
991 1 39 GLU QG 1 94 VAL MG1 . . 4.690 4.154 2.736 4.686 . 0 0 "[ . 1 . 2]" 1
992 1 40 GLN H 1 40 GLN QB . . 3.640 2.595 2.427 2.829 . 0 0 "[ . 1 . 2]" 1
993 1 40 GLN H 1 40 GLN QG . . 4.040 2.646 1.842 3.494 . 0 0 "[ . 1 . 2]" 1
994 1 40 GLN H 1 54 PHE QE . . 5.500 4.445 3.741 5.366 . 0 0 "[ . 1 . 2]" 1
995 1 40 GLN H 1 75 THR MG . . 4.910 4.039 3.818 4.521 . 0 0 "[ . 1 . 2]" 1
996 1 40 GLN HA 1 40 GLN HE21 . . 5.280 4.158 3.036 4.734 . 0 0 "[ . 1 . 2]" 1
997 1 40 GLN HA 1 40 GLN QE . . 4.420 3.932 2.998 4.421 0.001 14 0 "[ . 1 . 2]" 1
998 1 40 GLN HA 1 40 GLN HE22 . . 5.280 4.926 4.095 5.300 0.020 14 0 "[ . 1 . 2]" 1
999 1 40 GLN HA 1 40 GLN QG . . 3.640 3.346 2.359 3.593 . 0 0 "[ . 1 . 2]" 1
1000 1 40 GLN HA 1 41 LYS HA . . 5.130 4.689 4.390 5.286 0.156 14 0 "[ . 1 . 2]" 1
1001 1 40 GLN HA 1 54 PHE QE . . 5.500 5.164 4.682 5.492 . 0 0 "[ . 1 . 2]" 1
1002 1 40 GLN HA 1 54 PHE HZ . . 5.500 4.475 3.966 4.993 . 0 0 "[ . 1 . 2]" 1
1003 1 40 GLN HA 1 75 THR MG . . 5.500 5.438 4.875 5.584 0.084 12 0 "[ . 1 . 2]" 1
1004 1 40 GLN QB 1 54 PHE QE . . 4.980 3.228 2.570 4.396 . 0 0 "[ . 1 . 2]" 1
1005 1 40 GLN QB 1 75 THR MG . . 3.810 3.527 2.537 3.842 0.032 9 0 "[ . 1 . 2]" 1
1006 1 40 GLN HB2 1 54 PHE HZ . . 5.500 4.481 3.433 5.620 0.120 7 0 "[ . 1 . 2]" 1
1007 1 40 GLN HB2 1 75 THR MG . . 4.440 4.019 2.644 4.481 0.041 8 0 "[ . 1 . 2]" 1
1008 1 40 GLN HB3 1 54 PHE HZ . . 5.500 3.136 1.983 5.455 . 0 0 "[ . 1 . 2]" 1
1009 1 40 GLN HB3 1 75 THR MG . . 4.440 3.986 3.223 4.332 . 0 0 "[ . 1 . 2]" 1
1010 1 40 GLN QE 1 75 THR MG . . 4.750 2.730 1.902 3.790 . 0 0 "[ . 1 . 2]" 1
1011 1 40 GLN QG 1 54 PHE QE . . 4.330 2.626 1.903 4.324 . 0 0 "[ . 1 . 2]" 1
1012 1 40 GLN QG 1 75 THR MG . . 3.790 2.267 2.043 3.022 . 0 0 "[ . 1 . 2]" 1
1013 1 41 LYS HA 1 41 LYS QE . . 4.990 4.193 1.965 4.785 . 0 0 "[ . 1 . 2]" 1
1014 1 41 LYS HA 1 41 LYS QG . . 3.340 2.431 2.136 3.357 0.017 19 0 "[ . 1 . 2]" 1
1015 1 41 LYS QB 1 42 GLU H . . 4.000 2.976 2.115 4.010 0.010 19 0 "[ . 1 . 2]" 1
1016 1 41 LYS QB 1 42 GLU HA . . 4.840 4.036 3.691 4.740 . 0 0 "[ . 1 . 2]" 1
1017 1 41 LYS QE 1 41 LYS QG . . 2.850 2.199 2.020 2.616 . 0 0 "[ . 1 . 2]" 1
1018 1 41 LYS QG 1 42 GLU H . . 5.030 4.218 3.523 4.770 . 0 0 "[ . 1 . 2]" 1
1019 1 42 GLU H 1 42 GLU HB2 . . 4.060 2.809 2.209 3.698 . 0 0 "[ . 1 . 2]" 1
1020 1 42 GLU H 1 42 GLU QB . . 3.520 2.407 2.155 2.772 . 0 0 "[ . 1 . 2]" 1
1021 1 42 GLU H 1 42 GLU HB3 . . 4.060 2.839 2.281 3.745 . 0 0 "[ . 1 . 2]" 1
1022 1 42 GLU H 1 42 GLU QG . . 4.060 3.663 1.957 4.078 0.018 14 0 "[ . 1 . 2]" 1
1023 1 42 GLU HA 1 42 GLU QG . . 3.460 2.595 2.278 3.332 . 0 0 "[ . 1 . 2]" 1
1024 1 42 GLU HA 1 43 LYS H . . 3.530 2.357 2.148 3.536 0.006 6 0 "[ . 1 . 2]" 1
1025 1 42 GLU HA 1 43 LYS QG . . 4.490 3.906 3.558 4.481 . 0 0 "[ . 1 . 2]" 1
1026 1 42 GLU QG 1 43 LYS QG . . 4.060 3.445 2.060 4.085 0.025 10 0 "[ . 1 . 2]" 1
1027 1 43 LYS H 1 43 LYS QB . . 3.620 2.577 2.363 3.354 . 0 0 "[ . 1 . 2]" 1
1028 1 43 LYS H 1 43 LYS HG2 . . 4.810 2.537 1.887 4.075 . 0 0 "[ . 1 . 2]" 1
1029 1 43 LYS H 1 43 LYS QG . . 4.190 2.184 1.873 2.985 . 0 0 "[ . 1 . 2]" 1
1030 1 43 LYS H 1 43 LYS HG3 . . 4.810 3.079 1.986 3.741 . 0 0 "[ . 1 . 2]" 1
1031 1 43 LYS HA 1 43 LYS QG . . 3.420 2.958 2.351 3.343 . 0 0 "[ . 1 . 2]" 1
1032 1 44 ARG HA 1 44 ARG HD2 . . 4.940 3.945 2.347 4.964 0.024 14 0 "[ . 1 . 2]" 1
1033 1 44 ARG HA 1 44 ARG HD3 . . 4.940 4.022 2.147 4.884 . 0 0 "[ . 1 . 2]" 1
1034 1 44 ARG HA 1 44 ARG HG2 . . 4.200 3.383 2.590 4.221 0.021 14 0 "[ . 1 . 2]" 1
1035 1 44 ARG HA 1 44 ARG QG . . 3.540 2.912 2.262 3.447 . 0 0 "[ . 1 . 2]" 1
1036 1 44 ARG HA 1 44 ARG HG3 . . 4.200 3.432 2.293 4.233 0.033 15 0 "[ . 1 . 2]" 1
1037 1 44 ARG HA 1 51 TRP HD1 . . 4.940 4.743 4.516 4.961 0.021 16 0 "[ . 1 . 2]" 1
1038 1 44 ARG HA 1 51 TRP HE1 . . 4.510 4.035 3.534 4.520 0.010 15 0 "[ . 1 . 2]" 1
1039 1 44 ARG QB 1 44 ARG QD . . 3.250 2.205 1.997 2.448 . 0 0 "[ . 1 . 2]" 1
1040 1 44 ARG QB 1 45 GLN HA . . 5.340 4.616 3.914 5.130 . 0 0 "[ . 1 . 2]" 1
1041 1 44 ARG QB 1 51 TRP HE1 . . 4.410 2.385 1.861 3.944 . 0 0 "[ . 1 . 2]" 1
1042 1 44 ARG QB 1 51 TRP HH2 . . 5.340 4.799 3.696 5.352 0.012 17 0 "[ . 1 . 2]" 1
1043 1 44 ARG QB 1 51 TRP HZ2 . . 4.310 3.103 2.299 3.897 . 0 0 "[ . 1 . 2]" 1
1044 1 45 GLN H 1 45 GLN QG . . 4.330 3.012 1.886 4.063 . 0 0 "[ . 1 . 2]" 1
1045 1 45 GLN HA 1 45 GLN QG . . 3.360 2.566 2.175 3.388 0.028 20 0 "[ . 1 . 2]" 1
1046 1 45 GLN QB 1 45 GLN QG . . 2.430 2.044 1.972 2.086 . 0 0 "[ . 1 . 2]" 1
1047 1 45 GLN QB 1 46 GLY QA . . 3.890 3.702 3.413 4.007 0.117 11 0 "[ . 1 . 2]" 1
1048 1 46 GLY H 1 47 PRO QD . . 5.010 4.242 3.998 4.363 . 0 0 "[ . 1 . 2]" 1
1049 1 46 GLY QA 1 47 PRO HA . . 4.260 4.029 4.019 4.043 . 0 0 "[ . 1 . 2]" 1
1050 1 46 GLY QA 1 47 PRO QG . . 4.040 3.686 3.659 3.700 . 0 0 "[ . 1 . 2]" 1
1051 1 46 GLY QA 1 50 GLN QG . . 4.690 3.150 2.024 4.685 . 0 0 "[ . 1 . 2]" 1
1052 1 46 GLY HA2 1 47 PRO QD . . 3.080 2.416 2.210 2.646 . 0 0 "[ . 1 . 2]" 1
1053 1 46 GLY HA2 1 47 PRO QG . . 4.620 4.333 4.129 4.551 . 0 0 "[ . 1 . 2]" 1
1054 1 46 GLY HA3 1 47 PRO QD . . 3.080 2.152 1.957 2.375 . 0 0 "[ . 1 . 2]" 1
1055 1 46 GLY HA3 1 47 PRO QG . . 4.620 4.004 3.856 4.177 . 0 0 "[ . 1 . 2]" 1
1056 1 47 PRO HA 1 48 GLN H . . 3.100 2.380 2.238 2.695 . 0 0 "[ . 1 . 2]" 1
1057 1 47 PRO HA 1 48 GLN HB2 . . 4.940 4.681 4.443 4.863 . 0 0 "[ . 1 . 2]" 1
1058 1 47 PRO HA 1 48 GLN HB3 . . 5.210 4.886 4.594 5.149 . 0 0 "[ . 1 . 2]" 1
1059 1 47 PRO HA 1 49 GLU H . . 4.480 4.299 3.899 4.486 0.006 6 0 "[ . 1 . 2]" 1
1060 1 47 PRO HB2 1 48 GLN H . . 3.870 2.681 1.959 3.089 . 0 0 "[ . 1 . 2]" 1
1061 1 47 PRO HB2 1 48 GLN HB2 . . 5.370 5.020 4.497 5.377 0.007 6 0 "[ . 1 . 2]" 1
1062 1 47 PRO HB2 1 48 GLN HB3 . . 5.220 4.262 3.892 4.642 . 0 0 "[ . 1 . 2]" 1
1063 1 47 PRO HB2 1 49 GLU H . . 3.210 2.561 2.157 2.855 . 0 0 "[ . 1 . 2]" 1
1064 1 47 PRO HB3 1 48 GLN H . . 4.060 3.495 3.167 3.718 . 0 0 "[ . 1 . 2]" 1
1065 1 47 PRO HB3 1 49 GLU H . . 4.420 4.271 3.881 4.450 0.030 10 0 "[ . 1 . 2]" 1
1066 1 47 PRO QD 1 50 GLN HE21 . . 5.400 4.046 3.136 5.102 . 0 0 "[ . 1 . 2]" 1
1067 1 47 PRO QD 1 50 GLN QE . . 4.550 3.809 3.093 4.574 0.024 10 0 "[ . 1 . 2]" 1
1068 1 47 PRO QD 1 50 GLN HE22 . . 5.400 4.972 4.434 5.439 0.039 10 0 "[ . 1 . 2]" 1
1069 1 47 PRO QD 1 50 GLN QG . . 3.980 2.747 1.802 3.722 . 0 0 "[ . 1 . 2]" 1
1070 1 47 PRO QG 1 49 GLU H . . 4.660 3.536 2.689 4.288 . 0 0 "[ . 1 . 2]" 1
1071 1 48 GLN H 1 48 GLN HB2 . . 3.870 2.540 2.282 2.957 . 0 0 "[ . 1 . 2]" 1
1072 1 48 GLN H 1 48 GLN HB3 . . 3.620 2.536 2.293 2.815 . 0 0 "[ . 1 . 2]" 1
1073 1 48 GLN H 1 48 GLN QG . . 4.390 3.975 3.870 4.059 . 0 0 "[ . 1 . 2]" 1
1074 1 48 GLN H 1 49 GLU H . . 4.060 2.763 2.364 3.060 . 0 0 "[ . 1 . 2]" 1
1075 1 48 GLN H 1 49 GLU QG . . 4.670 4.177 3.243 4.622 . 0 0 "[ . 1 . 2]" 1
1076 1 48 GLN HA 1 50 GLN H . . 4.860 3.781 3.280 4.373 . 0 0 "[ . 1 . 2]" 1
1077 1 48 GLN HA 1 51 TRP HD1 . . 4.900 3.272 2.862 3.649 . 0 0 "[ . 1 . 2]" 1
1078 1 48 GLN HB2 1 51 TRP HH2 . . 5.500 4.807 3.981 5.408 . 0 0 "[ . 1 . 2]" 1
1079 1 48 GLN HB3 1 49 GLU H . . 3.720 2.706 2.500 3.268 . 0 0 "[ . 1 . 2]" 1
1080 1 48 GLN HB3 1 49 GLU QB . . 5.500 4.789 4.442 5.064 . 0 0 "[ . 1 . 2]" 1
1081 1 48 GLN HB3 1 49 GLU QG . . 4.840 3.630 3.332 4.234 . 0 0 "[ . 1 . 2]" 1
1082 1 48 GLN HB3 1 50 GLN H . . 5.050 4.886 4.680 5.110 0.060 15 0 "[ . 1 . 2]" 1
1083 1 48 GLN QG 1 49 GLU H . . 4.710 3.746 3.150 4.261 . 0 0 "[ . 1 . 2]" 1
1084 1 48 GLN QG 1 49 GLU HA . . 4.650 3.821 3.202 4.479 . 0 0 "[ . 1 . 2]" 1
1085 1 48 GLN QG 1 49 GLU QG . . 4.630 4.460 4.019 4.640 0.010 15 0 "[ . 1 . 2]" 1
1086 1 48 GLN QG 1 51 TRP HE3 . . 4.660 3.102 2.549 3.848 . 0 0 "[ . 1 . 2]" 1
1087 1 48 GLN QG 1 51 TRP HH2 . . 4.710 4.351 3.945 4.710 . 0 0 "[ . 1 . 2]" 1
1088 1 48 GLN QG 1 51 TRP HZ3 . . 4.500 3.698 3.129 4.337 . 0 0 "[ . 1 . 2]" 1
1089 1 48 GLN QG 1 73 TYR QD . . 4.950 3.544 2.815 4.423 . 0 0 "[ . 1 . 2]" 1
1090 1 49 GLU H 1 49 GLU QB . . 3.380 2.506 2.370 2.603 . 0 0 "[ . 1 . 2]" 1
1091 1 49 GLU H 1 49 GLU QG . . 3.430 2.143 1.871 2.830 . 0 0 "[ . 1 . 2]" 1
1092 1 49 GLU H 1 50 GLN H . . 3.710 2.743 2.591 2.937 . 0 0 "[ . 1 . 2]" 1
1093 1 49 GLU H 1 51 TRP H . . 4.740 4.404 4.205 4.564 . 0 0 "[ . 1 . 2]" 1
1094 1 49 GLU HA 1 49 GLU QB . . 2.780 2.340 2.174 2.430 . 0 0 "[ . 1 . 2]" 1
1095 1 49 GLU HA 1 49 GLU QG . . 3.240 2.639 2.309 3.372 0.132 6 0 "[ . 1 . 2]" 1
1096 1 49 GLU HA 1 51 TRP H . . 4.510 3.693 3.367 4.429 . 0 0 "[ . 1 . 2]" 1
1097 1 49 GLU QB 1 50 GLN H . . 4.230 3.020 2.686 3.769 . 0 0 "[ . 1 . 2]" 1
1098 1 50 GLN H 1 50 GLN HB2 . . 3.820 2.379 2.221 2.578 . 0 0 "[ . 1 . 2]" 1
1099 1 50 GLN H 1 50 GLN QB . . 3.090 2.297 2.160 2.498 . 0 0 "[ . 1 . 2]" 1
1100 1 50 GLN H 1 50 GLN HB3 . . 3.820 3.225 2.650 3.677 . 0 0 "[ . 1 . 2]" 1
1101 1 50 GLN H 1 50 GLN QG . . 4.110 3.435 2.387 4.119 0.009 9 0 "[ . 1 . 2]" 1
1102 1 50 GLN H 1 51 TRP HB2 . . 4.940 4.650 3.905 4.943 0.003 15 0 "[ . 1 . 2]" 1
1103 1 50 GLN H 1 51 TRP HD1 . . 4.380 3.559 3.180 4.183 . 0 0 "[ . 1 . 2]" 1
1104 1 50 GLN HA 1 50 GLN HE21 . . 5.030 3.887 1.884 4.836 . 0 0 "[ . 1 . 2]" 1
1105 1 50 GLN HA 1 50 GLN QE . . 4.350 3.561 1.877 4.321 . 0 0 "[ . 1 . 2]" 1
1106 1 50 GLN HA 1 50 GLN HE22 . . 5.030 4.354 3.472 5.042 0.012 12 0 "[ . 1 . 2]" 1
1107 1 50 GLN HA 1 50 GLN QG . . 3.060 2.535 2.087 2.868 . 0 0 "[ . 1 . 2]" 1
1108 1 50 GLN HA 1 51 TRP HB2 . . 5.500 5.409 5.313 5.523 0.023 15 0 "[ . 1 . 2]" 1
1109 1 50 GLN QB 1 51 TRP H . . 3.850 3.436 2.634 3.793 . 0 0 "[ . 1 . 2]" 1
1110 1 50 GLN QB 1 51 TRP HD1 . . 3.800 3.034 2.862 3.265 . 0 0 "[ . 1 . 2]" 1
1111 1 50 GLN QB 1 51 TRP HE1 . . 5.340 4.421 3.963 4.846 . 0 0 "[ . 1 . 2]" 1
1112 1 50 GLN HB2 1 51 TRP H . . 4.710 3.923 2.715 4.499 . 0 0 "[ . 1 . 2]" 1
1113 1 50 GLN HB2 1 51 TRP HD1 . . 4.640 3.782 3.027 4.564 . 0 0 "[ . 1 . 2]" 1
1114 1 50 GLN HB3 1 51 TRP H . . 4.710 3.925 2.741 4.433 . 0 0 "[ . 1 . 2]" 1
1115 1 50 GLN HB3 1 51 TRP HD1 . . 4.640 3.495 2.901 4.279 . 0 0 "[ . 1 . 2]" 1
1116 1 50 GLN QG 1 51 TRP H . . 5.380 4.532 4.046 4.977 . 0 0 "[ . 1 . 2]" 1
1117 1 50 GLN QG 1 51 TRP HD1 . . 5.500 4.708 3.880 5.238 . 0 0 "[ . 1 . 2]" 1
1118 1 51 TRP H 1 51 TRP HB2 . . 3.240 2.481 2.391 2.636 . 0 0 "[ . 1 . 2]" 1
1119 1 51 TRP H 1 51 TRP HB3 . . 3.670 3.642 3.614 3.685 0.015 6 0 "[ . 1 . 2]" 1
1120 1 51 TRP H 1 51 TRP HD1 . . 3.730 2.722 1.932 3.161 . 0 0 "[ . 1 . 2]" 1
1121 1 51 TRP H 1 51 TRP HE1 . . 5.260 4.944 4.204 5.296 0.036 5 0 "[ . 1 . 2]" 1
1122 1 51 TRP H 1 52 LEU H . . 4.770 4.570 4.460 4.649 . 0 0 "[ . 1 . 2]" 1
1123 1 51 TRP H 1 73 TYR QD . . 4.870 4.512 4.072 4.854 . 0 0 "[ . 1 . 2]" 1
1124 1 51 TRP H 1 73 TYR QE . . 4.210 3.255 2.474 4.166 . 0 0 "[ . 1 . 2]" 1
1125 1 51 TRP HA 1 51 TRP HD1 . . 3.430 2.450 2.265 2.530 . 0 0 "[ . 1 . 2]" 1
1126 1 51 TRP HA 1 52 LEU H . . 3.310 2.367 2.234 2.650 . 0 0 "[ . 1 . 2]" 1
1127 1 51 TRP HB2 1 51 TRP HE3 . . 4.190 3.137 2.928 3.226 . 0 0 "[ . 1 . 2]" 1
1128 1 51 TRP HB2 1 52 LEU H . . 4.030 3.770 3.232 4.015 . 0 0 "[ . 1 . 2]" 1
1129 1 51 TRP HB2 1 73 TYR QD . . 4.050 2.159 1.990 2.414 . 0 0 "[ . 1 . 2]" 1
1130 1 51 TRP HB2 1 73 TYR QE . . 3.650 2.119 1.994 2.441 . 0 0 "[ . 1 . 2]" 1
1131 1 51 TRP HB3 1 52 LEU H . . 3.810 2.536 1.951 2.904 . 0 0 "[ . 1 . 2]" 1
1132 1 51 TRP HB3 1 73 TYR QD . . 3.920 2.351 1.998 3.030 . 0 0 "[ . 1 . 2]" 1
1133 1 51 TRP HB3 1 73 TYR QE . . 4.130 3.218 2.905 3.727 . 0 0 "[ . 1 . 2]" 1
1134 1 51 TRP HD1 1 52 LEU H . . 4.760 4.708 4.549 4.786 0.026 5 0 "[ . 1 . 2]" 1
1135 1 51 TRP HE3 1 73 TYR HA . . 5.500 5.104 4.761 5.379 . 0 0 "[ . 1 . 2]" 1
1136 1 51 TRP HE3 1 73 TYR HB2 . . 4.500 3.880 3.385 4.500 . 0 0 "[ . 1 . 2]" 1
1137 1 51 TRP HE3 1 73 TYR QB . . 3.920 2.595 2.187 2.923 . 0 0 "[ . 1 . 2]" 1
1138 1 51 TRP HE3 1 73 TYR HB3 . . 4.500 2.639 2.211 2.972 . 0 0 "[ . 1 . 2]" 1
1139 1 51 TRP HE3 1 73 TYR QD . . 3.870 2.401 2.129 2.869 . 0 0 "[ . 1 . 2]" 1
1140 1 51 TRP HE3 1 73 TYR QE . . 5.050 4.498 4.186 4.842 . 0 0 "[ . 1 . 2]" 1
1141 1 52 LEU H 1 52 LEU HB2 . . 3.790 2.324 2.180 2.626 . 0 0 "[ . 1 . 2]" 1
1142 1 52 LEU H 1 52 LEU QB . . 3.250 2.294 2.159 2.565 . 0 0 "[ . 1 . 2]" 1
1143 1 52 LEU H 1 52 LEU HB3 . . 3.790 3.559 3.476 3.666 . 0 0 "[ . 1 . 2]" 1
1144 1 52 LEU H 1 52 LEU QD . . 3.840 2.950 2.282 3.586 . 0 0 "[ . 1 . 2]" 1
1145 1 52 LEU H 1 52 LEU HG . . 4.080 3.301 2.086 3.988 . 0 0 "[ . 1 . 2]" 1
1146 1 52 LEU H 1 53 ARG H . . 4.750 4.572 4.468 4.606 . 0 0 "[ . 1 . 2]" 1
1147 1 52 LEU H 1 54 PHE QE . . 5.320 4.682 3.829 5.224 . 0 0 "[ . 1 . 2]" 1
1148 1 52 LEU H 1 73 TYR QD . . 5.500 4.323 3.093 5.227 . 0 0 "[ . 1 . 2]" 1
1149 1 52 LEU HA 1 52 LEU MD1 . . 3.890 3.500 2.798 3.936 0.046 18 0 "[ . 1 . 2]" 1
1150 1 52 LEU HA 1 52 LEU QD . . 3.320 2.518 1.995 2.949 . 0 0 "[ . 1 . 2]" 1
1151 1 52 LEU HA 1 52 LEU MD2 . . 3.890 2.841 2.001 3.675 . 0 0 "[ . 1 . 2]" 1
1152 1 52 LEU HA 1 53 ARG H . . 2.800 2.297 2.211 2.421 . 0 0 "[ . 1 . 2]" 1
1153 1 52 LEU HA 1 95 THR H . . 5.250 4.683 4.517 4.866 . 0 0 "[ . 1 . 2]" 1
1154 1 52 LEU HA 1 95 THR HB . . 5.500 5.367 4.895 5.515 0.015 20 0 "[ . 1 . 2]" 1
1155 1 52 LEU HA 1 97 PRO HB3 . . 4.730 4.395 3.915 4.726 . 0 0 "[ . 1 . 2]" 1
1156 1 52 LEU HA 1 97 PRO HD2 . . 5.330 5.198 4.734 5.340 0.010 7 0 "[ . 1 . 2]" 1
1157 1 52 LEU HA 1 97 PRO HD3 . . 4.410 3.533 3.077 3.714 . 0 0 "[ . 1 . 2]" 1
1158 1 52 LEU QB 1 52 LEU QD . . 2.750 1.859 1.808 1.935 . 0 0 "[ . 1 . 2]" 1
1159 1 52 LEU QB 1 53 ARG H . . 3.790 2.691 2.388 2.952 . 0 0 "[ . 1 . 2]" 1
1160 1 52 LEU QB 1 54 PHE QE . . 4.220 3.266 2.551 3.739 . 0 0 "[ . 1 . 2]" 1
1161 1 52 LEU QB 1 54 PHE HZ . . 4.540 3.284 2.586 3.835 . 0 0 "[ . 1 . 2]" 1
1162 1 52 LEU QB 1 94 VAL HB . . 4.180 3.532 3.149 3.999 . 0 0 "[ . 1 . 2]" 1
1163 1 52 LEU HB2 1 53 ARG H . . 4.390 3.961 3.772 4.201 . 0 0 "[ . 1 . 2]" 1
1164 1 52 LEU HB2 1 54 PHE QE . . 4.920 3.557 2.665 4.037 . 0 0 "[ . 1 . 2]" 1
1165 1 52 LEU HB2 1 54 PHE HZ . . 5.220 3.537 2.610 4.184 . 0 0 "[ . 1 . 2]" 1
1166 1 52 LEU HB3 1 53 ARG H . . 4.390 2.740 2.414 3.016 . 0 0 "[ . 1 . 2]" 1
1167 1 52 LEU HB3 1 54 PHE QE . . 4.920 3.858 3.256 4.415 . 0 0 "[ . 1 . 2]" 1
1168 1 52 LEU HB3 1 54 PHE HZ . . 5.220 4.007 3.357 4.599 . 0 0 "[ . 1 . 2]" 1
1169 1 52 LEU QD 1 53 ARG H . . 4.130 3.378 2.828 3.826 . 0 0 "[ . 1 . 2]" 1
1170 1 52 LEU QD 1 53 ARG HB3 . . 5.440 5.164 4.539 5.443 0.003 10 0 "[ . 1 . 2]" 1
1171 1 52 LEU QD 1 54 PHE QE . . 4.240 3.557 2.962 3.996 . 0 0 "[ . 1 . 2]" 1
1172 1 52 LEU QD 1 54 PHE HZ . . 3.970 3.317 2.618 3.970 . 0 0 "[ . 1 . 2]" 1
1173 1 52 LEU QD 1 94 VAL HB . . 3.730 3.116 2.516 3.713 . 0 0 "[ . 1 . 2]" 1
1174 1 52 LEU QD 1 95 THR H . . 4.760 3.588 2.917 4.283 . 0 0 "[ . 1 . 2]" 1
1175 1 52 LEU QD 1 96 SER HA . . 3.040 2.146 1.775 3.064 0.024 17 0 "[ . 1 . 2]" 1
1176 1 52 LEU QD 1 96 SER QB . . 4.010 3.435 2.960 3.886 . 0 0 "[ . 1 . 2]" 1
1177 1 52 LEU QD 1 97 PRO HD2 . . 3.900 2.996 2.669 3.614 . 0 0 "[ . 1 . 2]" 1
1178 1 52 LEU QD 1 97 PRO HD3 . . 3.590 2.126 1.825 2.827 . 0 0 "[ . 1 . 2]" 1
1179 1 52 LEU QD 1 97 PRO HG3 . . 5.370 3.404 2.804 4.128 . 0 0 "[ . 1 . 2]" 1
1180 1 52 LEU MD1 1 53 ARG H . . 4.820 4.726 4.492 4.845 0.025 12 0 "[ . 1 . 2]" 1
1181 1 52 LEU MD1 1 54 PHE HZ . . 5.500 3.790 2.732 4.850 . 0 0 "[ . 1 . 2]" 1
1182 1 52 LEU MD1 1 96 SER HB2 . . 6.400 5.533 4.137 6.380 . 0 0 "[ . 1 . 2]" 1
1183 1 52 LEU MD1 1 96 SER HB3 . . 6.400 5.454 4.518 6.106 . 0 0 "[ . 1 . 2]" 1
1184 1 52 LEU MD1 1 97 PRO HD3 . . 4.840 3.384 1.906 4.427 . 0 0 "[ . 1 . 2]" 1
1185 1 52 LEU MD2 1 53 ARG H . . 4.820 3.480 2.852 4.040 . 0 0 "[ . 1 . 2]" 1
1186 1 52 LEU MD2 1 54 PHE HZ . . 5.500 4.455 2.647 5.461 . 0 0 "[ . 1 . 2]" 1
1187 1 52 LEU MD2 1 96 SER HB2 . . 6.400 4.039 3.183 4.647 . 0 0 "[ . 1 . 2]" 1
1188 1 52 LEU MD2 1 96 SER HB3 . . 6.400 3.958 3.487 4.645 . 0 0 "[ . 1 . 2]" 1
1189 1 52 LEU MD2 1 97 PRO HD3 . . 4.840 2.547 1.827 3.827 . 0 0 "[ . 1 . 2]" 1
1190 1 53 ARG H 1 53 ARG HB2 . . 3.490 2.697 2.487 2.979 . 0 0 "[ . 1 . 2]" 1
1191 1 53 ARG H 1 53 ARG HB3 . . 3.430 2.599 2.417 2.706 . 0 0 "[ . 1 . 2]" 1
1192 1 53 ARG H 1 53 ARG HG2 . . 4.770 4.501 4.424 4.609 . 0 0 "[ . 1 . 2]" 1
1193 1 53 ARG H 1 53 ARG QG . . 4.190 4.022 3.977 4.055 . 0 0 "[ . 1 . 2]" 1
1194 1 53 ARG H 1 53 ARG HG3 . . 4.770 4.533 4.346 4.634 . 0 0 "[ . 1 . 2]" 1
1195 1 53 ARG H 1 54 PHE H . . 4.830 4.555 4.488 4.609 . 0 0 "[ . 1 . 2]" 1
1196 1 53 ARG H 1 73 TYR QE . . 4.610 4.479 4.061 4.619 0.009 6 0 "[ . 1 . 2]" 1
1197 1 53 ARG H 1 94 VAL MG2 . . 5.500 5.390 5.024 5.511 0.011 4 0 "[ . 1 . 2]" 1
1198 1 53 ARG H 1 95 THR H . . 3.740 2.913 2.676 3.097 . 0 0 "[ . 1 . 2]" 1
1199 1 53 ARG H 1 95 THR HB . . 4.050 3.630 3.208 3.789 . 0 0 "[ . 1 . 2]" 1
1200 1 53 ARG H 1 95 THR MG . . 4.840 4.682 4.333 4.859 0.019 16 0 "[ . 1 . 2]" 1
1201 1 53 ARG H 1 97 PRO HD3 . . 5.440 5.183 4.774 5.452 0.012 3 0 "[ . 1 . 2]" 1
1202 1 53 ARG HA 1 53 ARG HD2 . . 4.890 4.503 3.705 4.803 . 0 0 "[ . 1 . 2]" 1
1203 1 53 ARG HA 1 53 ARG QD . . 4.200 3.961 2.236 4.205 0.005 4 0 "[ . 1 . 2]" 1
1204 1 53 ARG HA 1 53 ARG HD3 . . 4.890 4.475 2.254 4.860 . 0 0 "[ . 1 . 2]" 1
1205 1 53 ARG HA 1 53 ARG HG2 . . 4.060 3.038 2.722 3.845 . 0 0 "[ . 1 . 2]" 1
1206 1 53 ARG HA 1 53 ARG QG . . 3.450 2.421 2.286 2.874 . 0 0 "[ . 1 . 2]" 1
1207 1 53 ARG HA 1 53 ARG HG3 . . 4.060 2.566 2.332 2.967 . 0 0 "[ . 1 . 2]" 1
1208 1 53 ARG HA 1 54 PHE H . . 2.890 2.248 2.168 2.300 . 0 0 "[ . 1 . 2]" 1
1209 1 53 ARG HA 1 54 PHE QD . . 4.960 4.289 3.721 4.596 . 0 0 "[ . 1 . 2]" 1
1210 1 53 ARG HA 1 72 GLY H . . 5.410 5.229 4.894 5.417 0.007 15 0 "[ . 1 . 2]" 1
1211 1 53 ARG HA 1 73 TYR HA . . 4.500 2.975 2.619 3.197 . 0 0 "[ . 1 . 2]" 1
1212 1 53 ARG HA 1 73 TYR QD . . 3.830 3.139 2.868 3.491 . 0 0 "[ . 1 . 2]" 1
1213 1 53 ARG HA 1 73 TYR QE . . 3.770 3.224 2.802 3.636 . 0 0 "[ . 1 . 2]" 1
1214 1 53 ARG HA 1 94 VAL HA . . 5.500 5.398 5.134 5.505 0.005 11 0 "[ . 1 . 2]" 1
1215 1 53 ARG HA 1 95 THR H . . 5.500 4.874 4.468 4.993 . 0 0 "[ . 1 . 2]" 1
1216 1 53 ARG HA 1 95 THR HB . . 5.500 5.361 4.891 5.506 0.006 20 0 "[ . 1 . 2]" 1
1217 1 53 ARG HB2 1 53 ARG QD . . 3.340 2.621 2.126 3.064 . 0 0 "[ . 1 . 2]" 1
1218 1 53 ARG HB2 1 54 PHE H . . 4.400 4.082 3.903 4.224 . 0 0 "[ . 1 . 2]" 1
1219 1 53 ARG HB2 1 73 TYR QD . . 4.850 4.188 3.878 4.539 . 0 0 "[ . 1 . 2]" 1
1220 1 53 ARG HB2 1 73 TYR QE . . 3.640 2.667 2.042 3.191 . 0 0 "[ . 1 . 2]" 1
1221 1 53 ARG HB3 1 53 ARG QD . . 3.520 2.538 2.218 3.432 . 0 0 "[ . 1 . 2]" 1
1222 1 53 ARG HB3 1 54 PHE H . . 4.310 3.829 3.643 4.081 . 0 0 "[ . 1 . 2]" 1
1223 1 53 ARG HB3 1 95 THR H . . 4.080 3.054 2.355 3.372 . 0 0 "[ . 1 . 2]" 1
1224 1 53 ARG HB3 1 95 THR HB . . 3.380 2.522 1.941 2.688 . 0 0 "[ . 1 . 2]" 1
1225 1 53 ARG HB3 1 95 THR MG . . 4.230 4.075 3.665 4.238 0.008 13 0 "[ . 1 . 2]" 1
1226 1 53 ARG QD 1 54 PHE H . . 5.140 4.126 2.461 4.466 . 0 0 "[ . 1 . 2]" 1
1227 1 53 ARG QD 1 72 GLY H . . 4.910 4.666 2.912 4.930 0.020 13 0 "[ . 1 . 2]" 1
1228 1 53 ARG QD 1 73 TYR QE . . 4.130 3.203 1.964 3.920 . 0 0 "[ . 1 . 2]" 1
1229 1 53 ARG QD 1 95 THR HB . . 4.610 3.695 3.029 4.759 0.149 17 0 "[ . 1 . 2]" 1
1230 1 53 ARG HD2 1 73 TYR QE . . 4.690 3.860 2.326 4.641 . 0 0 "[ . 1 . 2]" 1
1231 1 53 ARG HD3 1 73 TYR QE . . 4.690 3.605 1.975 4.708 0.018 20 0 "[ . 1 . 2]" 1
1232 1 53 ARG QG 1 54 PHE H . . 3.360 2.267 2.140 2.573 . 0 0 "[ . 1 . 2]" 1
1233 1 53 ARG QG 1 54 PHE HB2 . . 5.340 4.593 4.442 4.820 . 0 0 "[ . 1 . 2]" 1
1234 1 53 ARG QG 1 55 SER H . . 5.010 4.110 3.655 4.443 . 0 0 "[ . 1 . 2]" 1
1235 1 53 ARG QG 1 72 GLY H . . 4.120 3.640 3.345 4.001 . 0 0 "[ . 1 . 2]" 1
1236 1 53 ARG QG 1 73 TYR QD . . 4.410 2.884 2.398 4.151 . 0 0 "[ . 1 . 2]" 1
1237 1 53 ARG QG 1 73 TYR QE . . 3.540 2.341 1.986 3.567 0.027 17 0 "[ . 1 . 2]" 1
1238 1 53 ARG QG 1 95 THR HB . . 5.340 4.345 2.998 4.637 . 0 0 "[ . 1 . 2]" 1
1239 1 53 ARG HG2 1 54 PHE H . . 3.840 2.530 2.204 3.791 . 0 0 "[ . 1 . 2]" 1
1240 1 53 ARG HG2 1 73 TYR QD . . 5.150 4.291 3.941 5.018 . 0 0 "[ . 1 . 2]" 1
1241 1 53 ARG HG2 1 73 TYR QE . . 4.180 3.913 3.662 4.185 0.005 14 0 "[ . 1 . 2]" 1
1242 1 53 ARG HG3 1 54 PHE H . . 3.840 2.861 2.155 3.451 . 0 0 "[ . 1 . 2]" 1
1243 1 53 ARG HG3 1 73 TYR QD . . 5.150 2.940 2.417 4.427 . 0 0 "[ . 1 . 2]" 1
1244 1 53 ARG HG3 1 73 TYR QE . . 4.180 2.384 1.994 4.120 . 0 0 "[ . 1 . 2]" 1
1245 1 54 PHE H 1 54 PHE HB2 . . 3.530 2.677 2.520 2.820 . 0 0 "[ . 1 . 2]" 1
1246 1 54 PHE H 1 54 PHE HB3 . . 4.030 3.795 3.704 3.877 . 0 0 "[ . 1 . 2]" 1
1247 1 54 PHE H 1 54 PHE QD . . 4.290 3.635 3.045 3.891 . 0 0 "[ . 1 . 2]" 1
1248 1 54 PHE H 1 55 SER H . . 4.710 4.131 4.033 4.268 . 0 0 "[ . 1 . 2]" 1
1249 1 54 PHE H 1 70 TYR QE . . 5.500 5.416 5.230 5.516 0.016 17 0 "[ . 1 . 2]" 1
1250 1 54 PHE H 1 73 TYR HA . . 4.210 3.032 2.751 3.227 . 0 0 "[ . 1 . 2]" 1
1251 1 54 PHE H 1 73 TYR QD . . 4.610 3.739 3.418 4.072 . 0 0 "[ . 1 . 2]" 1
1252 1 54 PHE H 1 73 TYR QE . . 4.920 4.558 4.283 4.890 . 0 0 "[ . 1 . 2]" 1
1253 1 54 PHE H 1 92 LEU QD . . 5.430 5.221 5.020 5.433 0.003 3 0 "[ . 1 . 2]" 1
1254 1 54 PHE H 1 94 VAL HA . . 5.100 5.008 4.724 5.111 0.011 4 0 "[ . 1 . 2]" 1
1255 1 54 PHE HA 1 54 PHE QD . . 3.630 2.304 2.038 2.779 . 0 0 "[ . 1 . 2]" 1
1256 1 54 PHE HA 1 55 SER H . . 2.990 2.142 2.138 2.146 . 0 0 "[ . 1 . 2]" 1
1257 1 54 PHE HA 1 55 SER QB . . 4.720 4.439 4.100 4.566 . 0 0 "[ . 1 . 2]" 1
1258 1 54 PHE HA 1 92 LEU QD . . 3.840 3.129 2.823 3.485 . 0 0 "[ . 1 . 2]" 1
1259 1 54 PHE HA 1 93 LYS H . . 4.450 4.269 4.046 4.453 0.003 9 0 "[ . 1 . 2]" 1
1260 1 54 PHE HA 1 94 VAL HA . . 3.960 2.938 2.729 3.058 . 0 0 "[ . 1 . 2]" 1
1261 1 54 PHE HA 1 94 VAL MG1 . . 3.980 3.371 3.067 3.529 . 0 0 "[ . 1 . 2]" 1
1262 1 54 PHE HA 1 95 THR H . . 4.660 4.468 4.220 4.625 . 0 0 "[ . 1 . 2]" 1
1263 1 54 PHE HB2 1 55 SER H . . 4.580 4.381 4.257 4.451 . 0 0 "[ . 1 . 2]" 1
1264 1 54 PHE HB2 1 70 TYR QE . . 4.500 4.213 4.055 4.316 . 0 0 "[ . 1 . 2]" 1
1265 1 54 PHE HB2 1 72 GLY H . . 4.720 4.266 3.942 4.621 . 0 0 "[ . 1 . 2]" 1
1266 1 54 PHE HB2 1 92 LEU QD . . 4.170 3.942 3.785 4.131 . 0 0 "[ . 1 . 2]" 1
1267 1 54 PHE HB2 1 94 VAL MG1 . . 5.500 5.250 5.064 5.349 . 0 0 "[ . 1 . 2]" 1
1268 1 54 PHE HB3 1 55 SER H . . 3.830 3.561 3.391 3.654 . 0 0 "[ . 1 . 2]" 1
1269 1 54 PHE HB3 1 70 TYR QE . . 5.450 4.967 4.599 5.343 . 0 0 "[ . 1 . 2]" 1
1270 1 54 PHE HB3 1 72 GLY H . . 5.480 5.161 4.751 5.497 0.017 7 0 "[ . 1 . 2]" 1
1271 1 54 PHE HB3 1 92 LEU QD . . 3.370 2.599 2.397 2.825 . 0 0 "[ . 1 . 2]" 1
1272 1 54 PHE HB3 1 93 LYS H . . 4.950 4.766 4.498 5.009 0.059 17 0 "[ . 1 . 2]" 1
1273 1 54 PHE HB3 1 94 VAL MG1 . . 4.580 4.305 3.950 4.555 . 0 0 "[ . 1 . 2]" 1
1274 1 54 PHE QD 1 55 SER H . . 4.120 3.858 3.617 4.159 0.039 20 0 "[ . 1 . 2]" 1
1275 1 54 PHE QD 1 70 TYR QE . . 5.500 5.467 5.292 5.520 0.020 18 0 "[ . 1 . 2]" 1
1276 1 54 PHE QD 1 73 TYR HA . . 4.270 3.354 2.578 3.823 . 0 0 "[ . 1 . 2]" 1
1277 1 54 PHE QD 1 75 THR HA . . 4.570 3.755 3.293 4.514 . 0 0 "[ . 1 . 2]" 1
1278 1 54 PHE QD 1 75 THR MG . . 4.470 3.412 2.933 4.282 . 0 0 "[ . 1 . 2]" 1
1279 1 54 PHE QD 1 92 LEU MD1 . . 4.180 2.197 1.872 2.946 . 0 0 "[ . 1 . 2]" 1
1280 1 54 PHE QD 1 92 LEU QD . . 3.050 2.179 1.865 2.886 . 0 0 "[ . 1 . 2]" 1
1281 1 54 PHE QD 1 92 LEU MD2 . . 4.180 3.696 3.447 4.182 0.002 8 0 "[ . 1 . 2]" 1
1282 1 54 PHE QD 1 94 VAL HA . . 4.560 3.232 2.701 3.640 . 0 0 "[ . 1 . 2]" 1
1283 1 54 PHE QD 1 94 VAL MG1 . . 3.310 1.977 1.946 2.065 . 0 0 "[ . 1 . 2]" 1
1284 1 54 PHE QD 1 95 THR H . . 5.210 4.901 4.338 5.173 . 0 0 "[ . 1 . 2]" 1
1285 1 54 PHE QE 1 75 THR MG . . 3.810 3.055 2.370 3.826 0.016 20 0 "[ . 1 . 2]" 1
1286 1 54 PHE QE 1 94 VAL HB . . 4.610 2.955 2.370 3.290 . 0 0 "[ . 1 . 2]" 1
1287 1 54 PHE QE 1 94 VAL MG1 . . 3.590 2.105 1.809 2.681 . 0 0 "[ . 1 . 2]" 1
1288 1 54 PHE QE 1 94 VAL MG2 . . 3.970 3.932 3.602 4.025 0.055 5 0 "[ . 1 . 2]" 1
1289 1 54 PHE QE 1 95 THR H . . 5.500 5.238 4.778 5.468 . 0 0 "[ . 1 . 2]" 1
1290 1 55 SER H 1 55 SER QB . . 3.590 2.621 2.513 2.699 . 0 0 "[ . 1 . 2]" 1
1291 1 55 SER H 1 56 ILE H . . 4.570 4.328 4.209 4.480 . 0 0 "[ . 1 . 2]" 1
1292 1 55 SER H 1 72 GLY H . . 5.440 5.109 4.793 5.413 . 0 0 "[ . 1 . 2]" 1
1293 1 55 SER H 1 92 LEU QD . . 3.550 3.265 3.046 3.443 . 0 0 "[ . 1 . 2]" 1
1294 1 55 SER H 1 92 LEU HG . . 5.500 5.394 5.092 5.522 0.022 3 0 "[ . 1 . 2]" 1
1295 1 55 SER H 1 93 LYS H . . 3.680 3.001 2.739 3.162 . 0 0 "[ . 1 . 2]" 1
1296 1 55 SER H 1 93 LYS HB2 . . 4.550 4.254 3.744 4.599 0.049 6 0 "[ . 1 . 2]" 1
1297 1 55 SER H 1 93 LYS HB3 . . 4.130 2.738 2.396 3.016 . 0 0 "[ . 1 . 2]" 1
1298 1 55 SER H 1 93 LYS QD . . 5.340 3.875 3.530 4.932 . 0 0 "[ . 1 . 2]" 1
1299 1 55 SER H 1 93 LYS QG . . 5.340 4.287 3.075 4.867 . 0 0 "[ . 1 . 2]" 1
1300 1 55 SER H 1 94 VAL H . . 5.500 4.864 4.699 5.021 . 0 0 "[ . 1 . 2]" 1
1301 1 55 SER H 1 94 VAL HA . . 3.940 3.849 3.702 3.968 0.028 6 0 "[ . 1 . 2]" 1
1302 1 55 SER H 1 94 VAL MG1 . . 5.500 4.264 4.026 4.434 . 0 0 "[ . 1 . 2]" 1
1303 1 55 SER H 1 95 THR H . . 5.500 5.509 5.402 5.554 0.054 20 0 "[ . 1 . 2]" 1
1304 1 55 SER HA 1 56 ILE H . . 3.110 2.154 2.138 2.203 . 0 0 "[ . 1 . 2]" 1
1305 1 55 SER HA 1 56 ILE HB . . 4.820 4.689 4.602 4.821 0.001 11 0 "[ . 1 . 2]" 1
1306 1 55 SER HA 1 68 VAL QG . . 4.390 3.740 3.533 4.050 . 0 0 "[ . 1 . 2]" 1
1307 1 55 SER HA 1 70 TYR H . . 5.150 4.944 4.714 5.122 . 0 0 "[ . 1 . 2]" 1
1308 1 55 SER HA 1 70 TYR QD . . 4.430 3.767 3.188 4.102 . 0 0 "[ . 1 . 2]" 1
1309 1 55 SER HA 1 71 THR HA . . 3.550 2.342 2.096 2.587 . 0 0 "[ . 1 . 2]" 1
1310 1 55 SER HA 1 71 THR HB . . 4.040 3.686 3.141 4.034 . 0 0 "[ . 1 . 2]" 1
1311 1 55 SER HA 1 71 THR MG . . 5.020 4.848 4.491 5.033 0.013 7 0 "[ . 1 . 2]" 1
1312 1 55 SER HA 1 72 GLY H . . 3.680 3.425 2.998 3.616 . 0 0 "[ . 1 . 2]" 1
1313 1 55 SER QB 1 56 ILE H . . 3.550 3.281 3.004 3.582 0.032 14 0 "[ . 1 . 2]" 1
1314 1 55 SER QB 1 56 ILE HA . . 5.340 4.411 4.222 4.795 . 0 0 "[ . 1 . 2]" 1
1315 1 55 SER QB 1 57 GLU QG . . 5.180 3.765 3.569 3.944 . 0 0 "[ . 1 . 2]" 1
1316 1 55 SER QB 1 68 VAL HB . . 5.340 5.303 5.062 5.443 0.103 18 0 "[ . 1 . 2]" 1
1317 1 55 SER QB 1 68 VAL QG . . 3.180 2.565 2.346 2.710 . 0 0 "[ . 1 . 2]" 1
1318 1 55 SER QB 1 71 THR HA . . 4.060 3.498 2.766 3.814 . 0 0 "[ . 1 . 2]" 1
1319 1 55 SER QB 1 71 THR MG . . 4.930 4.645 4.192 4.823 . 0 0 "[ . 1 . 2]" 1
1320 1 55 SER QB 1 93 LYS H . . 4.320 3.954 3.659 4.357 0.037 7 0 "[ . 1 . 2]" 1
1321 1 55 SER QB 1 93 LYS HB2 . . 3.830 3.562 2.885 3.946 0.116 18 0 "[ . 1 . 2]" 1
1322 1 55 SER QB 1 93 LYS HB3 . . 3.400 2.309 1.981 2.866 . 0 0 "[ . 1 . 2]" 1
1323 1 55 SER QB 1 93 LYS QD . . 3.630 2.617 1.974 3.497 . 0 0 "[ . 1 . 2]" 1
1324 1 55 SER QB 1 93 LYS QG . . 5.070 3.883 2.597 4.517 . 0 0 "[ . 1 . 2]" 1
1325 1 55 SER HB2 1 56 ILE H . . 4.310 4.060 3.146 4.352 0.042 14 0 "[ . 1 . 2]" 1
1326 1 55 SER HB2 1 68 VAL MG1 . . 4.880 3.950 2.691 4.395 . 0 0 "[ . 1 . 2]" 1
1327 1 55 SER HB2 1 68 VAL MG2 . . 4.880 4.106 3.385 4.374 . 0 0 "[ . 1 . 2]" 1
1328 1 55 SER HB2 1 93 LYS HB3 . . 4.090 2.542 1.990 3.982 . 0 0 "[ . 1 . 2]" 1
1329 1 55 SER HB3 1 56 ILE H . . 4.310 3.591 3.120 4.357 0.047 18 0 "[ . 1 . 2]" 1
1330 1 55 SER HB3 1 68 VAL MG1 . . 4.880 2.989 2.446 4.205 . 0 0 "[ . 1 . 2]" 1
1331 1 55 SER HB3 1 68 VAL MG2 . . 4.880 3.487 2.962 4.901 0.021 18 0 "[ . 1 . 2]" 1
1332 1 55 SER HB3 1 93 LYS HB3 . . 4.090 3.675 2.670 4.115 0.025 20 0 "[ . 1 . 2]" 1
1333 1 56 ILE H 1 56 ILE HB . . 3.320 2.616 2.526 2.712 . 0 0 "[ . 1 . 2]" 1
1334 1 56 ILE H 1 56 ILE MD . . 4.330 3.495 3.221 3.803 . 0 0 "[ . 1 . 2]" 1
1335 1 56 ILE H 1 56 ILE QG . . 3.860 2.447 2.151 2.733 . 0 0 "[ . 1 . 2]" 1
1336 1 56 ILE H 1 56 ILE MG . . 4.080 3.831 3.793 3.878 . 0 0 "[ . 1 . 2]" 1
1337 1 56 ILE H 1 57 GLU H . . 5.060 4.474 4.183 4.569 . 0 0 "[ . 1 . 2]" 1
1338 1 56 ILE H 1 68 VAL MG1 . . 5.170 3.529 3.088 3.825 . 0 0 "[ . 1 . 2]" 1
1339 1 56 ILE H 1 68 VAL QG . . 3.820 3.460 3.051 3.722 . 0 0 "[ . 1 . 2]" 1
1340 1 56 ILE H 1 68 VAL MG2 . . 5.170 5.021 4.593 5.220 0.050 18 0 "[ . 1 . 2]" 1
1341 1 56 ILE H 1 69 ILE MD . . 5.500 5.129 4.908 5.355 . 0 0 "[ . 1 . 2]" 1
1342 1 56 ILE H 1 69 ILE HG12 . . 5.440 4.839 4.544 5.111 . 0 0 "[ . 1 . 2]" 1
1343 1 56 ILE H 1 70 TYR H . . 3.790 3.297 3.036 3.455 . 0 0 "[ . 1 . 2]" 1
1344 1 56 ILE H 1 70 TYR HB2 . . 5.060 4.784 4.342 5.054 . 0 0 "[ . 1 . 2]" 1
1345 1 56 ILE H 1 70 TYR HB3 . . 4.070 3.149 2.668 3.457 . 0 0 "[ . 1 . 2]" 1
1346 1 56 ILE H 1 70 TYR QD . . 4.040 3.235 2.788 3.484 . 0 0 "[ . 1 . 2]" 1
1347 1 56 ILE H 1 70 TYR QE . . 5.500 5.346 4.921 5.525 0.025 7 0 "[ . 1 . 2]" 1
1348 1 56 ILE H 1 71 THR H . . 4.920 4.801 4.560 4.927 0.007 12 0 "[ . 1 . 2]" 1
1349 1 56 ILE H 1 71 THR HA . . 4.290 3.464 3.211 3.682 . 0 0 "[ . 1 . 2]" 1
1350 1 56 ILE H 1 71 THR MG . . 5.450 5.226 5.033 5.386 . 0 0 "[ . 1 . 2]" 1
1351 1 56 ILE H 1 72 GLY H . . 5.210 4.900 4.547 5.134 . 0 0 "[ . 1 . 2]" 1
1352 1 56 ILE HA 1 56 ILE MD . . 3.190 2.085 1.946 2.278 . 0 0 "[ . 1 . 2]" 1
1353 1 56 ILE HA 1 56 ILE MG . . 3.270 2.317 2.217 2.425 . 0 0 "[ . 1 . 2]" 1
1354 1 56 ILE HA 1 57 GLU H . . 3.100 2.194 2.140 2.270 . 0 0 "[ . 1 . 2]" 1
1355 1 56 ILE HA 1 70 TYR H . . 5.500 4.896 4.750 5.020 . 0 0 "[ . 1 . 2]" 1
1356 1 56 ILE HA 1 91 ARG H . . 4.760 4.286 3.909 4.586 . 0 0 "[ . 1 . 2]" 1
1357 1 56 ILE HB 1 56 ILE MD . . 3.430 3.221 3.211 3.229 . 0 0 "[ . 1 . 2]" 1
1358 1 56 ILE HB 1 68 VAL QG . . 5.210 4.596 4.285 4.809 . 0 0 "[ . 1 . 2]" 1
1359 1 56 ILE HB 1 69 ILE H . . 4.400 4.316 4.050 4.421 0.021 20 0 "[ . 1 . 2]" 1
1360 1 56 ILE HB 1 69 ILE MD . . 3.590 3.007 2.785 3.343 . 0 0 "[ . 1 . 2]" 1
1361 1 56 ILE HB 1 69 ILE HG12 . . 4.370 3.298 3.058 3.706 . 0 0 "[ . 1 . 2]" 1
1362 1 56 ILE HB 1 69 ILE HG13 . . 4.180 2.610 2.390 2.781 . 0 0 "[ . 1 . 2]" 1
1363 1 56 ILE HB 1 70 TYR H . . 3.650 3.043 2.870 3.224 . 0 0 "[ . 1 . 2]" 1
1364 1 56 ILE HB 1 70 TYR HB3 . . 3.900 2.217 1.987 2.369 . 0 0 "[ . 1 . 2]" 1
1365 1 56 ILE HB 1 70 TYR QD . . 4.510 3.629 3.301 3.907 . 0 0 "[ . 1 . 2]" 1
1366 1 56 ILE HB 1 77 HIS HD2 . . 5.500 3.518 3.108 4.065 . 0 0 "[ . 1 . 2]" 1
1367 1 56 ILE MD 1 56 ILE MG . . 2.850 2.001 1.891 2.110 . 0 0 "[ . 1 . 2]" 1
1368 1 56 ILE MD 1 57 GLU H . . 3.830 3.623 3.342 3.847 0.017 20 0 "[ . 1 . 2]" 1
1369 1 56 ILE MD 1 70 TYR HB3 . . 5.290 4.523 4.248 4.667 . 0 0 "[ . 1 . 2]" 1
1370 1 56 ILE MD 1 77 HIS HB3 . . 5.500 4.197 3.807 4.471 . 0 0 "[ . 1 . 2]" 1
1371 1 56 ILE MD 1 90 PHE HB3 . . 4.500 4.060 3.756 4.468 . 0 0 "[ . 1 . 2]" 1
1372 1 56 ILE MD 1 91 ARG H . . 5.070 4.564 4.148 5.008 . 0 0 "[ . 1 . 2]" 1
1373 1 56 ILE MD 1 92 LEU HA . . 4.480 2.096 1.965 2.346 . 0 0 "[ . 1 . 2]" 1
1374 1 56 ILE MD 1 92 LEU HB2 . . 4.110 2.701 2.312 2.909 . 0 0 "[ . 1 . 2]" 1
1375 1 56 ILE MD 1 92 LEU HB3 . . 4.360 3.982 3.659 4.165 . 0 0 "[ . 1 . 2]" 1
1376 1 56 ILE MD 1 92 LEU MD1 . . 3.650 1.864 1.784 2.046 . 0 0 "[ . 1 . 2]" 1
1377 1 56 ILE MD 1 92 LEU QD . . 2.700 1.856 1.779 2.025 . 0 0 "[ . 1 . 2]" 1
1378 1 56 ILE MD 1 92 LEU MD2 . . 3.650 3.463 3.178 3.640 . 0 0 "[ . 1 . 2]" 1
1379 1 56 ILE MD 1 92 LEU HG . . 4.190 4.131 3.872 4.230 0.040 18 0 "[ . 1 . 2]" 1
1380 1 56 ILE MD 1 93 LYS H . . 4.090 3.067 2.798 3.410 . 0 0 "[ . 1 . 2]" 1
1381 1 56 ILE QG 1 57 GLU H . . 4.700 4.606 4.463 4.770 0.070 18 0 "[ . 1 . 2]" 1
1382 1 56 ILE QG 1 69 ILE HG13 . . 4.500 4.319 4.113 4.492 . 0 0 "[ . 1 . 2]" 1
1383 1 56 ILE QG 1 70 TYR HB2 . . 4.490 4.314 3.999 4.505 0.015 5 0 "[ . 1 . 2]" 1
1384 1 56 ILE QG 1 70 TYR HB3 . . 4.480 2.946 2.629 3.104 . 0 0 "[ . 1 . 2]" 1
1385 1 56 ILE QG 1 70 TYR QD . . 4.360 2.681 2.366 3.029 . 0 0 "[ . 1 . 2]" 1
1386 1 56 ILE QG 1 77 HIS HB3 . . 5.350 3.210 2.856 3.396 . 0 0 "[ . 1 . 2]" 1
1387 1 56 ILE QG 1 92 LEU MD1 . . 5.480 3.431 3.254 3.647 . 0 0 "[ . 1 . 2]" 1
1388 1 56 ILE QG 1 92 LEU QD . . 4.300 3.384 3.209 3.585 . 0 0 "[ . 1 . 2]" 1
1389 1 56 ILE QG 1 92 LEU MD2 . . 5.480 5.160 4.896 5.391 . 0 0 "[ . 1 . 2]" 1
1390 1 56 ILE QG 1 93 LYS H . . 5.120 4.647 4.425 5.023 . 0 0 "[ . 1 . 2]" 1
1391 1 56 ILE MG 1 57 GLU H . . 3.400 2.362 2.029 2.966 . 0 0 "[ . 1 . 2]" 1
1392 1 56 ILE MG 1 57 GLU HA . . 4.740 3.649 3.402 3.897 . 0 0 "[ . 1 . 2]" 1
1393 1 56 ILE MG 1 58 GLU H . . 5.100 4.844 4.463 5.098 . 0 0 "[ . 1 . 2]" 1
1394 1 56 ILE MG 1 69 ILE HB . . 5.070 4.700 4.470 5.058 . 0 0 "[ . 1 . 2]" 1
1395 1 56 ILE MG 1 69 ILE MD . . 3.000 1.981 1.831 2.212 . 0 0 "[ . 1 . 2]" 1
1396 1 56 ILE MG 1 69 ILE HG12 . . 3.820 2.652 2.277 3.192 . 0 0 "[ . 1 . 2]" 1
1397 1 56 ILE MG 1 69 ILE MG . . 4.360 4.019 3.682 4.361 0.001 11 0 "[ . 1 . 2]" 1
1398 1 56 ILE MG 1 70 TYR HB2 . . 4.680 4.581 4.319 4.688 0.008 11 0 "[ . 1 . 2]" 1
1399 1 56 ILE MG 1 70 TYR HB3 . . 3.810 3.738 3.506 3.826 0.016 19 0 "[ . 1 . 2]" 1
1400 1 56 ILE MG 1 77 HIS HD2 . . 3.950 2.455 2.008 2.926 . 0 0 "[ . 1 . 2]" 1
1401 1 56 ILE MG 1 90 PHE H . . 5.500 5.507 5.445 5.571 0.071 18 0 "[ . 1 . 2]" 1
1402 1 56 ILE MG 1 90 PHE HA . . 4.540 3.753 3.472 3.984 . 0 0 "[ . 1 . 2]" 1
1403 1 56 ILE MG 1 90 PHE HB2 . . 3.830 3.650 3.514 3.849 0.019 19 0 "[ . 1 . 2]" 1
1404 1 56 ILE MG 1 90 PHE HB3 . . 3.620 2.399 2.301 2.491 . 0 0 "[ . 1 . 2]" 1
1405 1 56 ILE MG 1 90 PHE QD . . 3.580 3.178 2.888 3.473 . 0 0 "[ . 1 . 2]" 1
1406 1 56 ILE MG 1 91 ARG H . . 3.930 3.240 3.013 3.608 . 0 0 "[ . 1 . 2]" 1
1407 1 56 ILE MG 1 92 LEU QD . . 4.480 4.083 3.740 4.316 . 0 0 "[ . 1 . 2]" 1
1408 1 57 GLU H 1 57 GLU HB2 . . 3.650 2.632 2.395 2.903 . 0 0 "[ . 1 . 2]" 1
1409 1 57 GLU H 1 57 GLU HG2 . . 4.840 4.339 3.841 4.527 . 0 0 "[ . 1 . 2]" 1
1410 1 57 GLU H 1 57 GLU QG . . 4.160 3.192 2.335 3.584 . 0 0 "[ . 1 . 2]" 1
1411 1 57 GLU H 1 57 GLU HG3 . . 4.840 3.292 2.355 3.804 . 0 0 "[ . 1 . 2]" 1
1412 1 57 GLU H 1 58 GLU H . . 4.740 4.457 4.394 4.534 . 0 0 "[ . 1 . 2]" 1
1413 1 57 GLU H 1 68 VAL HA . . 4.930 4.594 4.271 4.824 . 0 0 "[ . 1 . 2]" 1
1414 1 57 GLU H 1 69 ILE H . . 5.420 4.509 4.338 4.712 . 0 0 "[ . 1 . 2]" 1
1415 1 57 GLU H 1 69 ILE MD . . 5.210 4.268 3.727 4.740 . 0 0 "[ . 1 . 2]" 1
1416 1 57 GLU H 1 69 ILE HG12 . . 4.690 3.927 3.530 4.245 . 0 0 "[ . 1 . 2]" 1
1417 1 57 GLU H 1 90 PHE HA . . 4.730 4.206 4.007 4.522 . 0 0 "[ . 1 . 2]" 1
1418 1 57 GLU H 1 91 ARG H . . 3.790 2.669 2.396 2.845 . 0 0 "[ . 1 . 2]" 1
1419 1 57 GLU H 1 91 ARG HG2 . . 4.730 2.993 2.131 4.799 0.069 3 0 "[ . 1 . 2]" 1
1420 1 57 GLU H 1 91 ARG QG . . 3.930 2.649 2.113 3.341 . 0 0 "[ . 1 . 2]" 1
1421 1 57 GLU H 1 91 ARG HG3 . . 4.730 3.251 2.194 4.391 . 0 0 "[ . 1 . 2]" 1
1422 1 57 GLU H 1 93 LYS H . . 5.230 4.988 4.603 5.223 . 0 0 "[ . 1 . 2]" 1
1423 1 57 GLU HA 1 57 GLU HG2 . . 4.090 2.838 2.238 3.597 . 0 0 "[ . 1 . 2]" 1
1424 1 57 GLU HA 1 57 GLU HG3 . . 4.090 2.731 2.425 3.060 . 0 0 "[ . 1 . 2]" 1
1425 1 57 GLU HA 1 58 GLU H . . 3.140 2.417 2.247 2.516 . 0 0 "[ . 1 . 2]" 1
1426 1 57 GLU HA 1 58 GLU HB3 . . 4.490 4.187 3.981 4.324 . 0 0 "[ . 1 . 2]" 1
1427 1 57 GLU HA 1 67 GLY H . . 4.430 3.899 3.538 4.281 . 0 0 "[ . 1 . 2]" 1
1428 1 57 GLU HA 1 68 VAL H . . 4.830 4.421 4.116 4.716 . 0 0 "[ . 1 . 2]" 1
1429 1 57 GLU HA 1 68 VAL HA . . 3.620 2.372 2.008 2.605 . 0 0 "[ . 1 . 2]" 1
1430 1 57 GLU HA 1 68 VAL MG1 . . 4.400 4.051 3.710 4.339 . 0 0 "[ . 1 . 2]" 1
1431 1 57 GLU HA 1 68 VAL QG . . 3.770 3.615 3.367 3.780 0.010 2 0 "[ . 1 . 2]" 1
1432 1 57 GLU HA 1 68 VAL MG2 . . 4.400 4.069 3.746 4.331 . 0 0 "[ . 1 . 2]" 1
1433 1 57 GLU HA 1 69 ILE H . . 3.870 2.112 1.889 2.346 . 0 0 "[ . 1 . 2]" 1
1434 1 57 GLU HA 1 69 ILE MD . . 4.670 3.871 3.546 4.125 . 0 0 "[ . 1 . 2]" 1
1435 1 57 GLU HA 1 69 ILE MG . . 4.110 3.170 2.601 3.515 . 0 0 "[ . 1 . 2]" 1
1436 1 57 GLU HA 1 70 TYR H . . 4.430 3.951 3.772 4.187 . 0 0 "[ . 1 . 2]" 1
1437 1 57 GLU HB2 1 58 GLU H . . 4.090 3.638 3.084 4.072 . 0 0 "[ . 1 . 2]" 1
1438 1 57 GLU HB2 1 66 TYR HB3 . . 4.520 3.550 3.001 3.894 . 0 0 "[ . 1 . 2]" 1
1439 1 57 GLU HB2 1 66 TYR QD . . 4.300 3.356 3.075 3.780 . 0 0 "[ . 1 . 2]" 1
1440 1 57 GLU HB2 1 67 GLY H . . 4.430 4.321 3.949 4.445 0.015 5 0 "[ . 1 . 2]" 1
1441 1 57 GLU HB2 1 68 VAL QG . . 4.680 4.313 3.994 4.574 . 0 0 "[ . 1 . 2]" 1
1442 1 57 GLU HB2 1 91 ARG H . . 4.410 3.468 3.158 3.805 . 0 0 "[ . 1 . 2]" 1
1443 1 57 GLU HB2 1 91 ARG HD2 . . 4.870 3.520 2.152 4.119 . 0 0 "[ . 1 . 2]" 1
1444 1 57 GLU HB2 1 91 ARG QD . . 4.130 2.458 1.975 3.412 . 0 0 "[ . 1 . 2]" 1
1445 1 57 GLU HB2 1 91 ARG HD3 . . 4.870 2.587 2.004 3.997 . 0 0 "[ . 1 . 2]" 1
1446 1 57 GLU HB2 1 91 ARG HE . . 4.510 3.754 1.898 4.425 . 0 0 "[ . 1 . 2]" 1
1447 1 57 GLU HB2 1 91 ARG QG . . 2.980 1.931 1.845 2.167 . 0 0 "[ . 1 . 2]" 1
1448 1 57 GLU HB2 1 103 TYR QE . . 4.870 4.462 3.201 4.916 0.046 18 0 "[ . 1 . 2]" 1
1449 1 57 GLU HB3 1 58 GLU H . . 3.090 2.456 2.198 2.876 . 0 0 "[ . 1 . 2]" 1
1450 1 57 GLU HB3 1 66 TYR HB2 . . 5.220 4.170 3.553 4.825 . 0 0 "[ . 1 . 2]" 1
1451 1 57 GLU HB3 1 66 TYR HB3 . . 3.870 2.520 2.006 3.224 . 0 0 "[ . 1 . 2]" 1
1452 1 57 GLU HB3 1 66 TYR QD . . 4.440 3.051 2.093 3.886 . 0 0 "[ . 1 . 2]" 1
1453 1 57 GLU HB3 1 67 GLY H . . 3.680 2.685 2.403 2.903 . 0 0 "[ . 1 . 2]" 1
1454 1 57 GLU HB3 1 67 GLY QA . . 4.780 3.999 3.617 4.464 . 0 0 "[ . 1 . 2]" 1
1455 1 57 GLU HB3 1 91 ARG H . . 4.600 4.570 4.306 4.738 0.138 18 0 "[ . 1 . 2]" 1
1456 1 57 GLU HB3 1 91 ARG QG . . 4.600 3.212 2.769 3.644 . 0 0 "[ . 1 . 2]" 1
1457 1 57 GLU QG 1 66 TYR HB3 . . 5.020 3.821 3.400 4.679 . 0 0 "[ . 1 . 2]" 1
1458 1 57 GLU QG 1 68 VAL HA . . 3.110 1.951 1.849 2.409 . 0 0 "[ . 1 . 2]" 1
1459 1 57 GLU QG 1 68 VAL QG . . 2.780 2.056 1.809 2.289 . 0 0 "[ . 1 . 2]" 1
1460 1 57 GLU QG 1 69 ILE H . . 3.800 3.424 3.178 3.827 0.027 18 0 "[ . 1 . 2]" 1
1461 1 57 GLU QG 1 70 TYR H . . 5.340 4.518 4.181 4.850 . 0 0 "[ . 1 . 2]" 1
1462 1 57 GLU QG 1 91 ARG QG . . 4.340 3.530 2.877 4.135 . 0 0 "[ . 1 . 2]" 1
1463 1 57 GLU HG2 1 69 ILE H . . 4.550 3.994 3.450 4.631 0.081 20 0 "[ . 1 . 2]" 1
1464 1 57 GLU HG3 1 69 ILE H . . 4.550 3.917 3.242 4.558 0.008 4 0 "[ . 1 . 2]" 1
1465 1 58 GLU H 1 58 GLU HB2 . . 4.060 3.867 3.719 3.961 . 0 0 "[ . 1 . 2]" 1
1466 1 58 GLU H 1 58 GLU HB3 . . 3.520 3.076 2.721 3.266 . 0 0 "[ . 1 . 2]" 1
1467 1 58 GLU H 1 59 GLU H . . 4.520 4.350 4.212 4.421 . 0 0 "[ . 1 . 2]" 1
1468 1 58 GLU H 1 66 TYR HA . . 5.000 3.929 3.568 4.145 . 0 0 "[ . 1 . 2]" 1
1469 1 58 GLU H 1 66 TYR HB2 . . 5.500 5.430 5.025 5.525 0.025 20 0 "[ . 1 . 2]" 1
1470 1 58 GLU H 1 66 TYR HB3 . . 4.760 3.775 3.363 3.863 . 0 0 "[ . 1 . 2]" 1
1471 1 58 GLU H 1 66 TYR QD . . 4.520 3.722 3.161 3.991 . 0 0 "[ . 1 . 2]" 1
1472 1 58 GLU H 1 67 GLY H . . 3.640 2.196 1.796 2.663 . 0 0 "[ . 1 . 2]" 1
1473 1 58 GLU H 1 68 VAL HA . . 4.250 4.140 3.858 4.290 0.040 20 0 "[ . 1 . 2]" 1
1474 1 58 GLU H 1 69 ILE H . . 4.470 3.721 3.270 4.220 . 0 0 "[ . 1 . 2]" 1
1475 1 58 GLU H 1 69 ILE MD . . 4.560 4.253 3.927 4.533 . 0 0 "[ . 1 . 2]" 1
1476 1 58 GLU H 1 69 ILE MG . . 3.750 2.973 2.411 3.551 . 0 0 "[ . 1 . 2]" 1
1477 1 58 GLU HA 1 59 GLU H . . 3.080 2.212 2.164 2.324 . 0 0 "[ . 1 . 2]" 1
1478 1 58 GLU HA 1 66 TYR QE . . 4.920 4.346 3.768 4.877 . 0 0 "[ . 1 . 2]" 1
1479 1 58 GLU HA 1 69 ILE MD . . 4.290 4.143 3.884 4.307 0.017 18 0 "[ . 1 . 2]" 1
1480 1 58 GLU HA 1 69 ILE MG . . 4.600 4.154 3.986 4.613 0.013 18 0 "[ . 1 . 2]" 1
1481 1 58 GLU HA 1 89 LYS H . . 5.120 4.896 4.645 5.115 . 0 0 "[ . 1 . 2]" 1
1482 1 58 GLU HA 1 90 PHE HA . . 3.610 2.543 2.312 2.805 . 0 0 "[ . 1 . 2]" 1
1483 1 58 GLU HA 1 90 PHE QD . . 3.810 2.760 2.394 3.142 . 0 0 "[ . 1 . 2]" 1
1484 1 58 GLU HA 1 90 PHE QE . . 4.660 4.124 3.860 4.487 . 0 0 "[ . 1 . 2]" 1
1485 1 58 GLU HA 1 91 ARG H . . 4.130 3.820 3.498 4.010 . 0 0 "[ . 1 . 2]" 1
1486 1 58 GLU HB2 1 59 GLU H . . 3.550 3.098 2.771 3.492 . 0 0 "[ . 1 . 2]" 1
1487 1 58 GLU HB2 1 69 ILE MD . . 4.110 3.768 2.945 4.084 . 0 0 "[ . 1 . 2]" 1
1488 1 58 GLU HB2 1 69 ILE MG . . 3.600 3.413 3.287 3.624 0.024 14 0 "[ . 1 . 2]" 1
1489 1 58 GLU HB2 1 88 TYR QD . . 4.740 4.054 3.838 4.602 . 0 0 "[ . 1 . 2]" 1
1490 1 58 GLU HB2 1 89 LYS H . . 4.620 4.507 4.148 4.738 0.118 18 0 "[ . 1 . 2]" 1
1491 1 58 GLU HB2 1 90 PHE HA . . 4.640 4.189 3.162 4.543 . 0 0 "[ . 1 . 2]" 1
1492 1 58 GLU HB2 1 90 PHE QD . . 4.010 2.919 1.930 3.391 . 0 0 "[ . 1 . 2]" 1
1493 1 58 GLU HB2 1 90 PHE QE . . 4.200 2.620 2.185 3.080 . 0 0 "[ . 1 . 2]" 1
1494 1 58 GLU HB3 1 59 GLU H . . 4.180 4.167 4.046 4.236 0.056 3 0 "[ . 1 . 2]" 1
1495 1 58 GLU HB3 1 67 GLY H . . 5.390 4.966 4.452 5.392 0.002 14 0 "[ . 1 . 2]" 1
1496 1 58 GLU HB3 1 69 ILE MD . . 3.810 2.467 2.099 3.033 . 0 0 "[ . 1 . 2]" 1
1497 1 58 GLU HB3 1 88 TYR QD . . 5.500 5.217 4.994 5.415 . 0 0 "[ . 1 . 2]" 1
1498 1 58 GLU HB3 1 90 PHE QD . . 4.100 2.320 1.983 3.123 . 0 0 "[ . 1 . 2]" 1
1499 1 58 GLU HB3 1 90 PHE QE . . 4.050 2.508 2.170 3.034 . 0 0 "[ . 1 . 2]" 1
1500 1 58 GLU HB3 1 90 PHE HZ . . 5.360 4.925 4.589 5.394 0.034 11 0 "[ . 1 . 2]" 1
1501 1 58 GLU HB3 1 91 ARG H . . 5.470 5.342 5.139 5.567 0.097 18 0 "[ . 1 . 2]" 1
1502 1 59 GLU H 1 59 GLU HB2 . . 3.430 2.759 2.652 2.922 . 0 0 "[ . 1 . 2]" 1
1503 1 59 GLU H 1 59 GLU HB3 . . 3.480 2.458 2.367 2.540 . 0 0 "[ . 1 . 2]" 1
1504 1 59 GLU H 1 59 GLU HG2 . . 5.030 4.388 4.293 4.461 . 0 0 "[ . 1 . 2]" 1
1505 1 59 GLU H 1 60 ASP H . . 4.610 4.587 4.556 4.608 . 0 0 "[ . 1 . 2]" 1
1506 1 59 GLU H 1 66 TYR HA . . 5.030 4.313 3.968 4.792 . 0 0 "[ . 1 . 2]" 1
1507 1 59 GLU H 1 66 TYR QD . . 4.360 3.705 3.148 4.190 . 0 0 "[ . 1 . 2]" 1
1508 1 59 GLU H 1 66 TYR QE . . 4.120 3.800 3.143 4.114 . 0 0 "[ . 1 . 2]" 1
1509 1 59 GLU H 1 89 LYS H . . 4.320 3.839 3.596 4.088 . 0 0 "[ . 1 . 2]" 1
1510 1 59 GLU H 1 89 LYS HB2 . . 3.880 3.089 2.432 3.507 . 0 0 "[ . 1 . 2]" 1
1511 1 59 GLU H 1 89 LYS HB3 . . 5.240 3.805 3.180 4.138 . 0 0 "[ . 1 . 2]" 1
1512 1 59 GLU H 1 90 PHE HA . . 4.290 3.987 3.741 4.309 0.019 18 0 "[ . 1 . 2]" 1
1513 1 59 GLU H 1 90 PHE QD . . 4.760 4.545 4.141 4.887 0.127 18 0 "[ . 1 . 2]" 1
1514 1 59 GLU H 1 91 ARG H . . 5.500 5.383 5.180 5.523 0.023 3 0 "[ . 1 . 2]" 1
1515 1 59 GLU H 1 106 VAL QG . . 4.980 4.401 3.878 4.834 . 0 0 "[ . 1 . 2]" 1
1516 1 59 GLU HA 1 59 GLU HG2 . . 3.810 3.125 2.937 3.320 . 0 0 "[ . 1 . 2]" 1
1517 1 59 GLU HA 1 59 GLU HG3 . . 3.690 2.618 2.434 2.874 . 0 0 "[ . 1 . 2]" 1
1518 1 59 GLU HA 1 60 ASP H . . 3.230 2.304 2.223 2.420 . 0 0 "[ . 1 . 2]" 1
1519 1 59 GLU HA 1 60 ASP HB2 . . 4.420 4.269 4.073 4.418 . 0 0 "[ . 1 . 2]" 1
1520 1 59 GLU HA 1 66 TYR HA . . 3.520 2.166 1.993 2.564 . 0 0 "[ . 1 . 2]" 1
1521 1 59 GLU HA 1 66 TYR QD . . 4.400 3.474 3.238 3.660 . 0 0 "[ . 1 . 2]" 1
1522 1 59 GLU HA 1 66 TYR QE . . 4.390 4.187 3.687 4.407 0.017 7 0 "[ . 1 . 2]" 1
1523 1 59 GLU HA 1 67 GLY H . . 4.370 4.031 3.730 4.433 0.063 18 0 "[ . 1 . 2]" 1
1524 1 59 GLU HB2 1 60 ASP H . . 4.680 3.904 3.782 4.092 . 0 0 "[ . 1 . 2]" 1
1525 1 59 GLU HB2 1 66 TYR QD . . 4.980 3.309 2.989 3.801 . 0 0 "[ . 1 . 2]" 1
1526 1 59 GLU HB2 1 66 TYR QE . . 3.480 2.667 2.377 2.942 . 0 0 "[ . 1 . 2]" 1
1527 1 59 GLU HB3 1 60 ASP H . . 4.770 3.814 3.535 4.061 . 0 0 "[ . 1 . 2]" 1
1528 1 59 GLU HB3 1 66 TYR QE . . 4.130 3.887 3.525 4.149 0.019 18 0 "[ . 1 . 2]" 1
1529 1 59 GLU HB3 1 89 LYS H . . 4.400 4.072 3.718 4.396 . 0 0 "[ . 1 . 2]" 1
1530 1 59 GLU HG2 1 60 ASP H . . 4.160 2.312 2.079 2.724 . 0 0 "[ . 1 . 2]" 1
1531 1 59 GLU HG2 1 60 ASP HA . . 4.980 3.869 3.721 4.096 . 0 0 "[ . 1 . 2]" 1
1532 1 59 GLU HG2 1 60 ASP HB2 . . 4.760 4.470 4.246 4.693 . 0 0 "[ . 1 . 2]" 1
1533 1 59 GLU HG2 1 61 PRO HA . . 4.330 4.232 4.047 4.336 0.006 15 0 "[ . 1 . 2]" 1
1534 1 59 GLU HG2 1 64 HIS H . . 5.200 4.712 4.461 4.965 . 0 0 "[ . 1 . 2]" 1
1535 1 59 GLU HG2 1 65 SER H . . 4.540 4.186 3.778 4.494 . 0 0 "[ . 1 . 2]" 1
1536 1 59 GLU HG2 1 66 TYR QD . . 5.500 5.229 4.942 5.500 . 0 0 "[ . 1 . 2]" 1
1537 1 59 GLU HG3 1 60 ASP H . . 4.100 2.520 2.004 2.963 . 0 0 "[ . 1 . 2]" 1
1538 1 59 GLU HG3 1 60 ASP HB2 . . 5.220 4.763 4.349 5.088 . 0 0 "[ . 1 . 2]" 1
1539 1 59 GLU HG3 1 64 HIS HA . . 4.090 3.624 2.962 4.067 . 0 0 "[ . 1 . 2]" 1
1540 1 59 GLU HG3 1 65 SER H . . 4.400 3.844 3.355 4.403 0.003 14 0 "[ . 1 . 2]" 1
1541 1 59 GLU HG3 1 66 TYR HA . . 4.820 4.115 3.748 4.682 . 0 0 "[ . 1 . 2]" 1
1542 1 59 GLU HG3 1 66 TYR QE . . 4.500 3.596 2.607 4.210 . 0 0 "[ . 1 . 2]" 1
1543 1 60 ASP H 1 60 ASP HB2 . . 3.450 2.413 2.301 2.639 . 0 0 "[ . 1 . 2]" 1
1544 1 60 ASP H 1 61 PRO QD . . 4.620 4.235 4.098 4.289 . 0 0 "[ . 1 . 2]" 1
1545 1 60 ASP H 1 65 SER H . . 3.760 2.654 2.482 2.834 . 0 0 "[ . 1 . 2]" 1
1546 1 60 ASP HA 1 61 PRO HA . . 4.680 4.433 4.417 4.467 . 0 0 "[ . 1 . 2]" 1
1547 1 60 ASP HA 1 61 PRO HB3 . . 4.990 4.847 4.833 4.890 . 0 0 "[ . 1 . 2]" 1
1548 1 60 ASP HA 1 61 PRO QD . . 2.970 1.915 1.868 1.948 . 0 0 "[ . 1 . 2]" 1
1549 1 60 ASP HA 1 61 PRO HG2 . . 4.480 4.243 4.165 4.296 . 0 0 "[ . 1 . 2]" 1
1550 1 60 ASP HA 1 61 PRO QG . . 3.920 3.815 3.775 3.847 . 0 0 "[ . 1 . 2]" 1
1551 1 60 ASP HA 1 61 PRO HG3 . . 4.480 4.324 4.316 4.341 . 0 0 "[ . 1 . 2]" 1
1552 1 60 ASP HA 1 62 LYS H . . 4.880 3.730 3.617 3.857 . 0 0 "[ . 1 . 2]" 1
1553 1 60 ASP HB2 1 61 PRO QD . . 4.200 4.066 3.964 4.228 0.028 18 0 "[ . 1 . 2]" 1
1554 1 60 ASP HB2 1 62 LYS H . . 4.650 4.248 3.975 4.643 . 0 0 "[ . 1 . 2]" 1
1555 1 60 ASP HB2 1 63 MET H . . 3.850 3.133 2.826 3.844 . 0 0 "[ . 1 . 2]" 1
1556 1 60 ASP HB2 1 63 MET HB2 . . 4.060 2.081 1.981 2.572 . 0 0 "[ . 1 . 2]" 1
1557 1 60 ASP HB2 1 63 MET HB3 . . 4.410 3.672 3.462 4.221 . 0 0 "[ . 1 . 2]" 1
1558 1 60 ASP HB2 1 64 HIS H . . 4.740 3.416 2.763 4.054 . 0 0 "[ . 1 . 2]" 1
1559 1 60 ASP HB2 1 65 SER H . . 3.290 2.340 2.051 2.832 . 0 0 "[ . 1 . 2]" 1
1560 1 60 ASP HB2 1 65 SER QB . . 5.210 3.656 3.434 4.090 . 0 0 "[ . 1 . 2]" 1
1561 1 60 ASP HB3 1 61 PRO QD . . 4.190 3.057 2.812 3.780 . 0 0 "[ . 1 . 2]" 1
1562 1 60 ASP HB3 1 62 LYS H . . 4.810 2.747 2.512 3.341 . 0 0 "[ . 1 . 2]" 1
1563 1 60 ASP HB3 1 63 MET HB2 . . 4.110 2.331 1.982 2.967 . 0 0 "[ . 1 . 2]" 1
1564 1 60 ASP HB3 1 63 MET HB3 . . 4.530 4.008 3.414 4.504 . 0 0 "[ . 1 . 2]" 1
1565 1 60 ASP HB3 1 64 HIS H . . 4.300 3.115 1.991 3.672 . 0 0 "[ . 1 . 2]" 1
1566 1 61 PRO HA 1 63 MET H . . 5.070 4.802 4.484 5.107 0.037 5 0 "[ . 1 . 2]" 1
1567 1 61 PRO HA 1 64 HIS H . . 4.330 3.981 3.673 4.284 . 0 0 "[ . 1 . 2]" 1
1568 1 61 PRO HB2 1 62 LYS H . . 4.300 3.541 3.367 3.624 . 0 0 "[ . 1 . 2]" 1
1569 1 61 PRO HB3 1 62 LYS H . . 4.310 4.261 4.159 4.309 . 0 0 "[ . 1 . 2]" 1
1570 1 61 PRO QD 1 62 LYS H . . 3.880 2.641 2.602 2.669 . 0 0 "[ . 1 . 2]" 1
1571 1 61 PRO QD 1 62 LYS HB3 . . 5.110 4.644 4.336 4.868 . 0 0 "[ . 1 . 2]" 1
1572 1 61 PRO QD 1 63 MET H . . 5.000 3.932 3.804 4.033 . 0 0 "[ . 1 . 2]" 1
1573 1 61 PRO QG 1 62 LYS H . . 3.540 2.617 2.389 2.729 . 0 0 "[ . 1 . 2]" 1
1574 1 61 PRO QG 1 62 LYS QG . . 4.310 3.471 2.792 4.111 . 0 0 "[ . 1 . 2]" 1
1575 1 61 PRO HG2 1 62 LYS H . . 4.160 2.648 2.411 2.766 . 0 0 "[ . 1 . 2]" 1
1576 1 61 PRO HG3 1 62 LYS H . . 4.160 4.088 3.912 4.176 0.016 12 0 "[ . 1 . 2]" 1
1577 1 62 LYS H 1 62 LYS HB3 . . 3.090 2.888 2.517 3.078 . 0 0 "[ . 1 . 2]" 1
1578 1 62 LYS H 1 62 LYS QD . . 4.590 3.542 1.865 4.141 . 0 0 "[ . 1 . 2]" 1
1579 1 62 LYS H 1 62 LYS QE . . 4.900 4.174 3.414 4.933 0.033 5 0 "[ . 1 . 2]" 1
1580 1 62 LYS H 1 62 LYS HG2 . . 3.850 2.295 1.902 3.511 . 0 0 "[ . 1 . 2]" 1
1581 1 62 LYS H 1 62 LYS QG . . 3.270 2.135 1.892 2.482 . 0 0 "[ . 1 . 2]" 1
1582 1 62 LYS H 1 62 LYS HG3 . . 3.850 3.102 2.279 3.738 . 0 0 "[ . 1 . 2]" 1
1583 1 62 LYS H 1 63 MET H . . 2.880 2.142 2.039 2.238 . 0 0 "[ . 1 . 2]" 1
1584 1 62 LYS H 1 63 MET HA . . 4.990 4.856 4.762 4.952 . 0 0 "[ . 1 . 2]" 1
1585 1 62 LYS H 1 63 MET QG . . 4.120 3.977 3.684 4.150 0.030 3 0 "[ . 1 . 2]" 1
1586 1 62 LYS HA 1 62 LYS HB3 . . 2.690 2.450 2.362 2.611 . 0 0 "[ . 1 . 2]" 1
1587 1 62 LYS HA 1 62 LYS QE . . 5.290 4.894 4.092 5.372 0.082 19 0 "[ . 1 . 2]" 1
1588 1 62 LYS HA 1 62 LYS QG . . 3.540 3.359 3.306 3.434 . 0 0 "[ . 1 . 2]" 1
1589 1 62 LYS HA 1 63 MET HA . . 4.910 4.627 4.570 4.687 . 0 0 "[ . 1 . 2]" 1
1590 1 62 LYS HB3 1 62 LYS QE . . 3.910 3.269 2.393 4.000 0.090 14 0 "[ . 1 . 2]" 1
1591 1 62 LYS QD 1 62 LYS QG . . 2.370 2.044 2.018 2.077 . 0 0 "[ . 1 . 2]" 1
1592 1 62 LYS QD 1 63 MET H . . 4.490 3.793 2.913 4.411 . 0 0 "[ . 1 . 2]" 1
1593 1 62 LYS QD 1 63 MET QG . . 3.670 3.137 1.726 3.701 0.031 3 0 "[ . 1 . 2]" 1
1594 1 62 LYS QE 1 63 MET H . . 5.290 4.322 3.560 4.906 . 0 0 "[ . 1 . 2]" 1
1595 1 62 LYS QE 1 63 MET ME . . 4.520 3.470 2.054 4.536 0.016 6 0 "[ . 1 . 2]" 1
1596 1 62 LYS QG 1 63 MET HA . . 4.850 3.637 3.189 3.928 . 0 0 "[ . 1 . 2]" 1
1597 1 62 LYS QG 1 63 MET HB3 . . 5.340 4.360 4.100 4.584 . 0 0 "[ . 1 . 2]" 1
1598 1 62 LYS QG 1 63 MET ME . . 5.340 3.201 1.924 4.510 . 0 0 "[ . 1 . 2]" 1
1599 1 62 LYS QG 1 63 MET QG . . 4.310 1.976 1.897 2.250 . 0 0 "[ . 1 . 2]" 1
1600 1 62 LYS HG2 1 63 MET H . . 4.610 2.557 1.875 3.623 . 0 0 "[ . 1 . 2]" 1
1601 1 62 LYS HG3 1 63 MET H . . 4.610 2.528 1.876 3.671 . 0 0 "[ . 1 . 2]" 1
1602 1 63 MET H 1 63 MET HB2 . . 2.980 2.522 2.405 2.728 . 0 0 "[ . 1 . 2]" 1
1603 1 63 MET H 1 63 MET HB3 . . 3.820 3.651 3.601 3.712 . 0 0 "[ . 1 . 2]" 1
1604 1 63 MET H 1 63 MET ME . . 4.720 4.391 2.860 4.784 0.064 11 0 "[ . 1 . 2]" 1
1605 1 63 MET H 1 63 MET HG2 . . 3.920 2.948 2.462 3.929 0.009 1 0 "[ . 1 . 2]" 1
1606 1 63 MET H 1 63 MET QG . . 3.360 2.465 2.232 2.824 . 0 0 "[ . 1 . 2]" 1
1607 1 63 MET H 1 63 MET HG3 . . 3.920 3.064 2.277 3.886 . 0 0 "[ . 1 . 2]" 1
1608 1 63 MET H 1 64 HIS H . . 3.300 2.309 2.144 2.422 . 0 0 "[ . 1 . 2]" 1
1609 1 63 MET H 1 65 SER H . . 4.270 3.943 3.728 4.245 . 0 0 "[ . 1 . 2]" 1
1610 1 63 MET HA 1 63 MET ME . . 4.370 3.900 2.603 4.419 0.049 11 0 "[ . 1 . 2]" 1
1611 1 63 MET HA 1 63 MET HG2 . . 3.950 2.690 2.466 3.003 . 0 0 "[ . 1 . 2]" 1
1612 1 63 MET HA 1 63 MET QG . . 3.460 2.610 2.397 2.895 . 0 0 "[ . 1 . 2]" 1
1613 1 63 MET HA 1 63 MET HG3 . . 3.950 3.559 2.865 3.807 . 0 0 "[ . 1 . 2]" 1
1614 1 63 MET HA 1 64 HIS HD2 . . 4.500 3.803 2.806 4.520 0.020 8 0 "[ . 1 . 2]" 1
1615 1 63 MET HA 1 65 SER H . . 4.650 4.385 4.149 4.635 . 0 0 "[ . 1 . 2]" 1
1616 1 63 MET HA 1 65 SER QB . . 4.770 4.452 4.298 4.715 . 0 0 "[ . 1 . 2]" 1
1617 1 63 MET HB2 1 64 HIS H . . 4.000 3.359 2.752 3.650 . 0 0 "[ . 1 . 2]" 1
1618 1 63 MET HB2 1 65 SER H . . 3.740 2.829 2.589 3.016 . 0 0 "[ . 1 . 2]" 1
1619 1 63 MET HB2 1 65 SER HB2 . . 4.640 3.872 3.109 4.393 . 0 0 "[ . 1 . 2]" 1
1620 1 63 MET HB2 1 65 SER QB . . 3.830 3.289 3.064 3.557 . 0 0 "[ . 1 . 2]" 1
1621 1 63 MET HB2 1 65 SER HB3 . . 4.640 3.727 3.339 4.639 . 0 0 "[ . 1 . 2]" 1
1622 1 63 MET HB3 1 64 HIS H . . 4.410 4.197 3.751 4.408 . 0 0 "[ . 1 . 2]" 1
1623 1 63 MET HB3 1 65 SER H . . 4.080 3.556 3.237 3.915 . 0 0 "[ . 1 . 2]" 1
1624 1 63 MET HB3 1 65 SER QB . . 3.480 2.917 2.545 3.213 . 0 0 "[ . 1 . 2]" 1
1625 1 63 MET ME 1 63 MET QG . . 3.350 2.161 2.002 2.421 . 0 0 "[ . 1 . 2]" 1
1626 1 63 MET QG 1 64 HIS H . . 4.560 4.227 4.009 4.386 . 0 0 "[ . 1 . 2]" 1
1627 1 63 MET QG 1 65 SER H . . 5.080 4.634 4.474 4.793 . 0 0 "[ . 1 . 2]" 1
1628 1 64 HIS H 1 64 HIS HA . . 2.940 2.296 2.275 2.328 . 0 0 "[ . 1 . 2]" 1
1629 1 64 HIS H 1 64 HIS QB . . 3.690 3.144 2.792 3.466 . 0 0 "[ . 1 . 2]" 1
1630 1 64 HIS H 1 64 HIS HD2 . . 4.440 2.726 2.044 4.430 . 0 0 "[ . 1 . 2]" 1
1631 1 64 HIS H 1 65 SER H . . 3.390 2.857 2.490 3.039 . 0 0 "[ . 1 . 2]" 1
1632 1 64 HIS HA 1 64 HIS HD2 . . 3.970 3.648 2.711 4.080 0.110 8 0 "[ . 1 . 2]" 1
1633 1 64 HIS HA 1 65 SER H . . 3.310 2.892 2.818 2.982 . 0 0 "[ . 1 . 2]" 1
1634 1 64 HIS QB 1 64 HIS HD2 . . 3.250 2.975 2.794 3.253 0.003 2 0 "[ . 1 . 2]" 1
1635 1 64 HIS QB 1 65 SER H . . 4.130 3.864 3.739 4.045 . 0 0 "[ . 1 . 2]" 1
1636 1 64 HIS HB2 1 65 SER H . . 4.830 4.213 4.020 4.464 . 0 0 "[ . 1 . 2]" 1
1637 1 64 HIS HB3 1 65 SER H . . 4.830 4.495 4.318 4.671 . 0 0 "[ . 1 . 2]" 1
1638 1 65 SER H 1 65 SER HB2 . . 3.740 2.880 2.468 3.133 . 0 0 "[ . 1 . 2]" 1
1639 1 65 SER H 1 65 SER QB . . 3.250 2.599 2.428 2.755 . 0 0 "[ . 1 . 2]" 1
1640 1 65 SER H 1 65 SER HB3 . . 3.740 3.049 2.812 3.659 . 0 0 "[ . 1 . 2]" 1
1641 1 65 SER H 1 66 TYR H . . 4.650 4.451 4.403 4.494 . 0 0 "[ . 1 . 2]" 1
1642 1 65 SER HA 1 66 TYR H . . 3.100 2.383 2.311 2.551 . 0 0 "[ . 1 . 2]" 1
1643 1 65 SER HA 1 66 TYR QD . . 4.900 3.260 2.619 3.630 . 0 0 "[ . 1 . 2]" 1
1644 1 65 SER HA 1 66 TYR QE . . 5.000 4.628 4.045 4.986 . 0 0 "[ . 1 . 2]" 1
1645 1 65 SER QB 1 66 TYR H . . 3.340 3.080 2.150 3.305 . 0 0 "[ . 1 . 2]" 1
1646 1 65 SER QB 1 66 TYR HB2 . . 5.340 5.161 4.501 5.315 . 0 0 "[ . 1 . 2]" 1
1647 1 65 SER HB2 1 66 TYR H . . 4.060 3.961 3.646 4.082 0.022 3 0 "[ . 1 . 2]" 1
1648 1 65 SER HB3 1 66 TYR H . . 4.060 3.232 2.165 3.549 . 0 0 "[ . 1 . 2]" 1
1649 1 66 TYR H 1 66 TYR HB2 . . 3.500 2.400 2.326 2.508 . 0 0 "[ . 1 . 2]" 1
1650 1 66 TYR H 1 66 TYR HB3 . . 3.800 3.630 3.584 3.698 . 0 0 "[ . 1 . 2]" 1
1651 1 66 TYR H 1 66 TYR QD . . 3.720 2.541 2.259 2.736 . 0 0 "[ . 1 . 2]" 1
1652 1 66 TYR H 1 66 TYR QE . . 4.920 4.732 4.489 4.922 0.002 12 0 "[ . 1 . 2]" 1
1653 1 66 TYR H 1 67 GLY H . . 4.730 4.550 4.492 4.576 . 0 0 "[ . 1 . 2]" 1
1654 1 66 TYR HA 1 66 TYR QD . . 4.260 3.039 2.879 3.123 . 0 0 "[ . 1 . 2]" 1
1655 1 66 TYR HA 1 67 GLY H . . 3.040 2.375 2.252 2.524 . 0 0 "[ . 1 . 2]" 1
1656 1 66 TYR HB2 1 67 GLY H . . 4.100 3.789 3.578 4.007 . 0 0 "[ . 1 . 2]" 1
1657 1 66 TYR HB2 1 91 ARG QD . . 5.340 3.934 3.297 5.101 . 0 0 "[ . 1 . 2]" 1
1658 1 66 TYR HB3 1 67 GLY H . . 3.770 2.522 2.183 2.849 . 0 0 "[ . 1 . 2]" 1
1659 1 66 TYR HB3 1 91 ARG HE . . 5.500 4.877 2.795 5.494 . 0 0 "[ . 1 . 2]" 1
1660 1 66 TYR QD 1 67 GLY H . . 4.080 3.602 3.197 3.982 . 0 0 "[ . 1 . 2]" 1
1661 1 66 TYR QD 1 91 ARG H . . 4.800 4.327 4.062 4.556 . 0 0 "[ . 1 . 2]" 1
1662 1 66 TYR QD 1 91 ARG QB . . 5.340 4.038 3.498 4.558 . 0 0 "[ . 1 . 2]" 1
1663 1 66 TYR QD 1 91 ARG QD . . 4.480 2.485 1.981 3.638 . 0 0 "[ . 1 . 2]" 1
1664 1 66 TYR QD 1 91 ARG QG . . 4.780 3.120 2.405 3.917 . 0 0 "[ . 1 . 2]" 1
1665 1 66 TYR QE 1 89 LYS HB3 . . 4.190 3.698 2.794 4.114 . 0 0 "[ . 1 . 2]" 1
1666 1 66 TYR QE 1 90 PHE H . . 5.500 5.330 4.122 5.512 0.012 5 0 "[ . 1 . 2]" 1
1667 1 66 TYR QE 1 90 PHE HA . . 5.020 4.540 3.638 4.966 . 0 0 "[ . 1 . 2]" 1
1668 1 66 TYR QE 1 91 ARG H . . 4.720 4.520 4.036 4.729 0.009 18 0 "[ . 1 . 2]" 1
1669 1 66 TYR QE 1 91 ARG QD . . 3.720 2.809 2.244 3.717 . 0 0 "[ . 1 . 2]" 1
1670 1 66 TYR QE 1 106 VAL MG1 . . 4.110 3.583 2.776 4.137 0.027 18 0 "[ . 1 . 2]" 1
1671 1 66 TYR QE 1 106 VAL QG . . 3.450 2.592 2.196 3.020 . 0 0 "[ . 1 . 2]" 1
1672 1 66 TYR QE 1 106 VAL MG2 . . 4.110 2.695 2.204 3.160 . 0 0 "[ . 1 . 2]" 1
1673 1 67 GLY H 1 68 VAL H . . 4.350 4.162 3.769 4.329 . 0 0 "[ . 1 . 2]" 1
1674 1 67 GLY QA 1 68 VAL HB . . 4.490 4.375 4.215 4.468 . 0 0 "[ . 1 . 2]" 1
1675 1 67 GLY QA 1 68 VAL QG . . 3.760 3.441 2.953 3.736 . 0 0 "[ . 1 . 2]" 1
1676 1 67 GLY HA2 1 68 VAL H . . 3.260 2.211 2.139 3.224 . 0 0 "[ . 1 . 2]" 1
1677 1 67 GLY HA3 1 68 VAL H . . 3.260 3.106 2.138 3.256 . 0 0 "[ . 1 . 2]" 1
1678 1 68 VAL H 1 68 VAL HB . . 3.030 2.550 2.401 2.981 . 0 0 "[ . 1 . 2]" 1
1679 1 68 VAL H 1 68 VAL MG1 . . 3.830 3.771 3.737 3.952 0.122 18 0 "[ . 1 . 2]" 1
1680 1 68 VAL H 1 68 VAL QG . . 2.860 2.146 1.920 2.994 0.134 18 0 "[ . 1 . 2]" 1
1681 1 68 VAL H 1 68 VAL MG2 . . 3.830 2.162 1.926 3.101 . 0 0 "[ . 1 . 2]" 1
1682 1 68 VAL H 1 69 ILE H . . 4.500 4.249 3.798 4.418 . 0 0 "[ . 1 . 2]" 1
1683 1 68 VAL HA 1 68 VAL MG1 . . 3.230 2.363 2.235 2.519 . 0 0 "[ . 1 . 2]" 1
1684 1 68 VAL HA 1 68 VAL QG . . 2.770 2.118 2.043 2.163 . 0 0 "[ . 1 . 2]" 1
1685 1 68 VAL HA 1 68 VAL MG2 . . 3.230 2.398 2.303 2.458 . 0 0 "[ . 1 . 2]" 1
1686 1 68 VAL HA 1 69 ILE H . . 3.220 2.197 2.145 2.288 . 0 0 "[ . 1 . 2]" 1
1687 1 68 VAL HA 1 69 ILE MD . . 5.490 5.279 5.180 5.398 . 0 0 "[ . 1 . 2]" 1
1688 1 68 VAL HA 1 69 ILE HG13 . . 5.020 4.803 4.587 5.025 0.005 16 0 "[ . 1 . 2]" 1
1689 1 68 VAL HA 1 69 ILE MG . . 4.290 4.045 3.875 4.224 . 0 0 "[ . 1 . 2]" 1
1690 1 68 VAL HA 1 70 TYR H . . 3.650 3.546 3.452 3.647 . 0 0 "[ . 1 . 2]" 1
1691 1 68 VAL HB 1 70 TYR H . . 5.500 5.043 4.829 5.163 . 0 0 "[ . 1 . 2]" 1
1692 1 68 VAL QG 1 69 ILE H . . 3.280 3.047 2.814 3.275 . 0 0 "[ . 1 . 2]" 1
1693 1 68 VAL QG 1 70 TYR H . . 3.070 2.621 2.441 2.856 . 0 0 "[ . 1 . 2]" 1
1694 1 68 VAL QG 1 70 TYR HA . . 5.310 3.766 3.666 3.906 . 0 0 "[ . 1 . 2]" 1
1695 1 68 VAL QG 1 70 TYR HB2 . . 5.440 5.070 4.938 5.160 . 0 0 "[ . 1 . 2]" 1
1696 1 68 VAL QG 1 70 TYR HB3 . . 4.840 4.550 4.353 4.672 . 0 0 "[ . 1 . 2]" 1
1697 1 68 VAL QG 1 71 THR H . . 4.710 4.003 3.866 4.183 . 0 0 "[ . 1 . 2]" 1
1698 1 68 VAL QG 1 71 THR HA . . 4.460 3.654 3.476 3.844 . 0 0 "[ . 1 . 2]" 1
1699 1 69 ILE H 1 69 ILE HB . . 4.140 3.628 3.614 3.650 . 0 0 "[ . 1 . 2]" 1
1700 1 69 ILE H 1 69 ILE MD . . 3.820 3.642 3.583 3.723 . 0 0 "[ . 1 . 2]" 1
1701 1 69 ILE H 1 69 ILE HG12 . . 3.300 1.982 1.885 2.133 . 0 0 "[ . 1 . 2]" 1
1702 1 69 ILE H 1 69 ILE HG13 . . 3.860 2.884 2.577 3.165 . 0 0 "[ . 1 . 2]" 1
1703 1 69 ILE H 1 69 ILE MG . . 3.430 2.481 2.126 2.791 . 0 0 "[ . 1 . 2]" 1
1704 1 69 ILE H 1 70 TYR H . . 2.970 2.400 2.195 2.574 . 0 0 "[ . 1 . 2]" 1
1705 1 69 ILE HA 1 69 ILE MG . . 2.860 2.297 2.134 2.397 . 0 0 "[ . 1 . 2]" 1
1706 1 69 ILE HB 1 69 ILE MD . . 2.960 2.296 2.211 2.410 . 0 0 "[ . 1 . 2]" 1
1707 1 69 ILE HB 1 70 TYR H . . 4.430 3.789 3.702 3.868 . 0 0 "[ . 1 . 2]" 1
1708 1 69 ILE HB 1 70 TYR HB2 . . 4.710 4.099 3.941 4.274 . 0 0 "[ . 1 . 2]" 1
1709 1 69 ILE HB 1 79 VAL MG1 . . 4.460 4.310 4.169 4.452 . 0 0 "[ . 1 . 2]" 1
1710 1 69 ILE HB 1 79 VAL MG2 . . 4.230 4.105 3.977 4.245 0.015 16 0 "[ . 1 . 2]" 1
1711 1 69 ILE MD 1 70 TYR H . . 3.910 3.836 3.732 3.916 0.006 7 0 "[ . 1 . 2]" 1
1712 1 69 ILE MD 1 70 TYR HB2 . . 4.550 3.846 3.707 3.953 . 0 0 "[ . 1 . 2]" 1
1713 1 69 ILE MD 1 70 TYR HB3 . . 5.360 3.844 3.669 3.969 . 0 0 "[ . 1 . 2]" 1
1714 1 69 ILE MD 1 77 HIS HD2 . . 3.740 2.565 2.196 3.079 . 0 0 "[ . 1 . 2]" 1
1715 1 69 ILE MD 1 79 VAL HA . . 4.420 3.776 3.522 4.020 . 0 0 "[ . 1 . 2]" 1
1716 1 69 ILE MD 1 79 VAL MG1 . . 3.110 3.029 2.804 3.129 0.019 2 0 "[ . 1 . 2]" 1
1717 1 69 ILE MD 1 79 VAL MG2 . . 2.960 2.125 1.987 2.249 . 0 0 "[ . 1 . 2]" 1
1718 1 69 ILE MD 1 82 LEU MD2 . . 5.120 5.040 4.776 5.137 0.017 13 0 "[ . 1 . 2]" 1
1719 1 69 ILE MD 1 90 PHE QD . . 3.590 2.304 1.964 2.735 . 0 0 "[ . 1 . 2]" 1
1720 1 69 ILE MD 1 90 PHE QE . . 3.290 2.697 2.372 3.090 . 0 0 "[ . 1 . 2]" 1
1721 1 69 ILE MD 1 90 PHE HZ . . 4.840 4.254 3.903 4.520 . 0 0 "[ . 1 . 2]" 1
1722 1 69 ILE HG12 1 70 TYR H . . 3.380 2.847 2.646 3.109 . 0 0 "[ . 1 . 2]" 1
1723 1 69 ILE HG12 1 70 TYR HB3 . . 5.180 4.366 4.069 4.668 . 0 0 "[ . 1 . 2]" 1
1724 1 69 ILE HG13 1 70 TYR H . . 3.690 2.181 2.048 2.325 . 0 0 "[ . 1 . 2]" 1
1725 1 69 ILE HG13 1 70 TYR HA . . 4.600 4.058 3.914 4.230 . 0 0 "[ . 1 . 2]" 1
1726 1 69 ILE HG13 1 70 TYR HB2 . . 4.860 2.994 2.785 3.239 . 0 0 "[ . 1 . 2]" 1
1727 1 69 ILE HG13 1 70 TYR HB3 . . 4.340 2.897 2.792 3.060 . 0 0 "[ . 1 . 2]" 1
1728 1 69 ILE HG13 1 79 VAL MG2 . . 5.130 4.179 4.016 4.358 . 0 0 "[ . 1 . 2]" 1
1729 1 69 ILE MG 1 70 TYR H . . 4.230 3.998 3.900 4.093 . 0 0 "[ . 1 . 2]" 1
1730 1 69 ILE MG 1 79 VAL MG1 . . 3.830 3.801 3.683 3.852 0.022 6 0 "[ . 1 . 2]" 1
1731 1 69 ILE MG 1 79 VAL MG2 . . 4.200 3.878 3.580 4.074 . 0 0 "[ . 1 . 2]" 1
1732 1 69 ILE MG 1 90 PHE HA . . 5.500 5.389 5.265 5.503 0.003 18 0 "[ . 1 . 2]" 1
1733 1 69 ILE MG 1 90 PHE QD . . 4.860 3.678 3.477 3.931 . 0 0 "[ . 1 . 2]" 1
1734 1 69 ILE MG 1 90 PHE QE . . 4.390 3.340 3.009 3.678 . 0 0 "[ . 1 . 2]" 1
1735 1 70 TYR H 1 70 TYR HB2 . . 4.040 3.289 3.243 3.330 . 0 0 "[ . 1 . 2]" 1
1736 1 70 TYR H 1 70 TYR HB3 . . 3.560 2.809 2.731 2.849 . 0 0 "[ . 1 . 2]" 1
1737 1 70 TYR H 1 70 TYR QD . . 4.610 4.350 4.307 4.386 . 0 0 "[ . 1 . 2]" 1
1738 1 70 TYR H 1 71 THR H . . 4.430 4.356 4.341 4.382 . 0 0 "[ . 1 . 2]" 1
1739 1 70 TYR H 1 71 THR HA . . 5.500 4.909 4.881 4.940 . 0 0 "[ . 1 . 2]" 1
1740 1 70 TYR H 1 71 THR MG . . 4.650 4.583 4.428 4.659 0.009 6 0 "[ . 1 . 2]" 1
1741 1 70 TYR HA 1 70 TYR QD . . 4.000 2.842 2.693 2.993 . 0 0 "[ . 1 . 2]" 1
1742 1 70 TYR HA 1 70 TYR QE . . 4.680 4.662 4.613 4.689 0.009 15 0 "[ . 1 . 2]" 1
1743 1 70 TYR HA 1 71 THR H . . 2.690 2.233 2.208 2.273 . 0 0 "[ . 1 . 2]" 1
1744 1 70 TYR HA 1 71 THR HA . . 4.710 4.458 4.443 4.472 . 0 0 "[ . 1 . 2]" 1
1745 1 70 TYR HA 1 71 THR MG . . 3.800 3.312 3.207 3.411 . 0 0 "[ . 1 . 2]" 1
1746 1 70 TYR HA 1 77 HIS HE1 . . 4.980 4.366 4.172 4.553 . 0 0 "[ . 1 . 2]" 1
1747 1 70 TYR HB2 1 71 THR H . . 4.030 4.018 3.942 4.068 0.038 6 0 "[ . 1 . 2]" 1
1748 1 70 TYR HB3 1 71 THR H . . 4.070 3.953 3.850 4.066 . 0 0 "[ . 1 . 2]" 1
1749 1 70 TYR HB3 1 77 HIS HD2 . . 5.500 3.999 3.472 4.584 . 0 0 "[ . 1 . 2]" 1
1750 1 70 TYR HB3 1 77 HIS HE1 . . 4.500 3.927 3.521 4.345 . 0 0 "[ . 1 . 2]" 1
1751 1 70 TYR QD 1 71 THR H . . 3.720 3.230 3.074 3.276 . 0 0 "[ . 1 . 2]" 1
1752 1 70 TYR QD 1 72 GLY H . . 4.250 3.867 3.429 4.239 . 0 0 "[ . 1 . 2]" 1
1753 1 70 TYR QD 1 77 HIS HE1 . . 3.990 3.095 2.696 3.478 . 0 0 "[ . 1 . 2]" 1
1754 1 70 TYR QE 1 71 THR H . . 4.350 4.067 3.936 4.110 . 0 0 "[ . 1 . 2]" 1
1755 1 70 TYR QE 1 72 GLY H . . 3.910 3.574 3.255 3.902 . 0 0 "[ . 1 . 2]" 1
1756 1 70 TYR QE 1 72 GLY HA2 . . 5.500 4.855 4.526 5.127 . 0 0 "[ . 1 . 2]" 1
1757 1 70 TYR QE 1 73 TYR H . . 4.920 4.395 4.163 4.676 . 0 0 "[ . 1 . 2]" 1
1758 1 70 TYR QE 1 74 ALA H . . 4.110 3.045 2.829 3.473 . 0 0 "[ . 1 . 2]" 1
1759 1 70 TYR QE 1 74 ALA MB . . 4.020 2.659 2.372 3.116 . 0 0 "[ . 1 . 2]" 1
1760 1 70 TYR QE 1 77 HIS HE1 . . 5.380 4.949 4.398 5.209 . 0 0 "[ . 1 . 2]" 1
1761 1 71 THR H 1 71 THR HB . . 3.690 3.520 3.476 3.587 . 0 0 "[ . 1 . 2]" 1
1762 1 71 THR H 1 71 THR MG . . 3.230 2.345 2.245 2.415 . 0 0 "[ . 1 . 2]" 1
1763 1 71 THR H 1 72 GLY H . . 4.250 4.026 3.857 4.205 . 0 0 "[ . 1 . 2]" 1
1764 1 71 THR HA 1 71 THR MG . . 3.590 3.192 3.170 3.202 . 0 0 "[ . 1 . 2]" 1
1765 1 71 THR HA 1 72 GLY H . . 2.870 2.151 2.145 2.171 . 0 0 "[ . 1 . 2]" 1
1766 1 71 THR HB 1 72 GLY H . . 4.280 4.220 4.074 4.294 0.014 18 0 "[ . 1 . 2]" 1
1767 1 71 THR MG 1 72 GLY H . . 4.330 4.195 4.046 4.318 . 0 0 "[ . 1 . 2]" 1
1768 1 71 THR MG 1 72 GLY HA3 . . 4.940 4.676 4.499 4.825 . 0 0 "[ . 1 . 2]" 1
1769 1 72 GLY H 1 73 TYR H . . 4.450 4.261 4.209 4.351 . 0 0 "[ . 1 . 2]" 1
1770 1 72 GLY H 1 73 TYR QD . . 4.570 4.412 4.304 4.514 . 0 0 "[ . 1 . 2]" 1
1771 1 72 GLY HA2 1 73 TYR H . . 3.180 2.903 2.758 2.955 . 0 0 "[ . 1 . 2]" 1
1772 1 72 GLY HA2 1 73 TYR QD . . 4.740 3.038 2.802 3.277 . 0 0 "[ . 1 . 2]" 1
1773 1 72 GLY HA2 1 74 ALA H . . 4.560 4.508 4.311 4.575 0.015 5 0 "[ . 1 . 2]" 1
1774 1 72 GLY HA3 1 73 TYR H . . 3.260 2.277 2.241 2.385 . 0 0 "[ . 1 . 2]" 1
1775 1 72 GLY HA3 1 73 TYR QD . . 4.880 3.976 3.808 4.162 . 0 0 "[ . 1 . 2]" 1
1776 1 72 GLY HA3 1 74 ALA H . . 4.200 3.291 3.131 3.370 . 0 0 "[ . 1 . 2]" 1
1777 1 72 GLY HA3 1 74 ALA MB . . 4.710 4.068 3.878 4.171 . 0 0 "[ . 1 . 2]" 1
1778 1 73 TYR H 1 73 TYR HB2 . . 3.680 2.448 2.349 2.507 . 0 0 "[ . 1 . 2]" 1
1779 1 73 TYR H 1 73 TYR QB . . 3.160 2.410 2.320 2.466 . 0 0 "[ . 1 . 2]" 1
1780 1 73 TYR H 1 73 TYR HB3 . . 3.680 3.602 3.569 3.655 . 0 0 "[ . 1 . 2]" 1
1781 1 73 TYR H 1 73 TYR QD . . 3.440 3.049 2.644 3.223 . 0 0 "[ . 1 . 2]" 1
1782 1 73 TYR H 1 73 TYR QE . . 5.500 5.324 4.908 5.473 . 0 0 "[ . 1 . 2]" 1
1783 1 73 TYR H 1 74 ALA H . . 3.140 2.358 2.063 2.503 . 0 0 "[ . 1 . 2]" 1
1784 1 73 TYR H 1 74 ALA HA . . 4.730 4.514 4.432 4.600 . 0 0 "[ . 1 . 2]" 1
1785 1 73 TYR H 1 74 ALA MB . . 3.980 3.662 3.536 3.819 . 0 0 "[ . 1 . 2]" 1
1786 1 73 TYR HA 1 73 TYR QD . . 3.250 2.627 2.318 2.859 . 0 0 "[ . 1 . 2]" 1
1787 1 73 TYR HA 1 73 TYR QE . . 4.560 4.388 4.266 4.497 . 0 0 "[ . 1 . 2]" 1
1788 1 73 TYR QB 1 74 ALA H . . 3.730 3.647 3.116 3.762 0.032 17 0 "[ . 1 . 2]" 1
1789 1 73 TYR HB2 1 74 ALA H . . 4.340 3.984 3.279 4.161 . 0 0 "[ . 1 . 2]" 1
1790 1 73 TYR HB3 1 74 ALA H . . 4.340 4.241 3.892 4.327 . 0 0 "[ . 1 . 2]" 1
1791 1 73 TYR QD 1 74 ALA H . . 4.730 4.544 4.340 4.625 . 0 0 "[ . 1 . 2]" 1
1792 1 74 ALA H 1 74 ALA MB . . 2.870 2.204 2.044 2.308 . 0 0 "[ . 1 . 2]" 1
1793 1 74 ALA H 1 75 THR H . . 4.650 4.525 4.456 4.645 . 0 0 "[ . 1 . 2]" 1
1794 1 74 ALA HA 1 75 THR H . . 2.890 2.532 2.332 2.652 . 0 0 "[ . 1 . 2]" 1
1795 1 74 ALA HA 1 76 ARG H . . 4.570 4.332 3.915 4.575 0.005 5 0 "[ . 1 . 2]" 1
1796 1 74 ALA MB 1 75 THR H . . 3.000 2.175 1.903 2.679 . 0 0 "[ . 1 . 2]" 1
1797 1 74 ALA MB 1 75 THR HA . . 4.130 4.012 3.929 4.121 . 0 0 "[ . 1 . 2]" 1
1798 1 74 ALA MB 1 75 THR MG . . 4.430 4.125 3.846 4.385 . 0 0 "[ . 1 . 2]" 1
1799 1 74 ALA MB 1 76 ARG H . . 3.000 2.761 2.450 2.930 . 0 0 "[ . 1 . 2]" 1
1800 1 74 ALA MB 1 76 ARG HB3 . . 4.490 4.069 3.884 4.235 . 0 0 "[ . 1 . 2]" 1
1801 1 75 THR H 1 75 THR MG . . 3.410 2.873 2.647 3.116 . 0 0 "[ . 1 . 2]" 1
1802 1 75 THR H 1 76 ARG H . . 2.910 1.969 1.862 2.110 . 0 0 "[ . 1 . 2]" 1
1803 1 75 THR HA 1 75 THR MG . . 2.960 2.296 2.201 2.413 . 0 0 "[ . 1 . 2]" 1
1804 1 75 THR HB 1 76 ARG H . . 4.520 3.832 3.632 4.043 . 0 0 "[ . 1 . 2]" 1
1805 1 75 THR MG 1 76 ARG H . . 4.250 3.976 3.720 4.189 . 0 0 "[ . 1 . 2]" 1
1806 1 75 THR MG 1 76 ARG HA . . 5.500 5.452 5.412 5.509 0.009 1 0 "[ . 1 . 2]" 1
1807 1 75 THR MG 1 76 ARG HB2 . . 5.500 5.472 5.285 5.575 0.075 12 0 "[ . 1 . 2]" 1
1808 1 76 ARG H 1 76 ARG HB2 . . 3.810 2.799 2.640 2.969 . 0 0 "[ . 1 . 2]" 1
1809 1 76 ARG H 1 76 ARG HB3 . . 3.590 2.502 2.318 2.610 . 0 0 "[ . 1 . 2]" 1
1810 1 76 ARG H 1 76 ARG HG2 . . 4.440 4.405 4.238 4.468 0.028 14 0 "[ . 1 . 2]" 1
1811 1 76 ARG H 1 77 HIS H . . 4.640 4.565 4.519 4.598 . 0 0 "[ . 1 . 2]" 1
1812 1 76 ARG HA 1 76 ARG HG2 . . 4.030 3.053 2.765 3.457 . 0 0 "[ . 1 . 2]" 1
1813 1 76 ARG HA 1 76 ARG HG3 . . 3.830 2.645 2.525 2.803 . 0 0 "[ . 1 . 2]" 1
1814 1 76 ARG HA 1 77 HIS H . . 2.960 2.319 2.186 2.395 . 0 0 "[ . 1 . 2]" 1
1815 1 76 ARG HB2 1 76 ARG QD . . 3.390 2.602 2.284 3.057 . 0 0 "[ . 1 . 2]" 1
1816 1 76 ARG HB2 1 77 HIS H . . 4.050 3.910 3.819 4.032 . 0 0 "[ . 1 . 2]" 1
1817 1 76 ARG HB3 1 76 ARG HD2 . . 3.790 3.085 2.142 3.778 . 0 0 "[ . 1 . 2]" 1
1818 1 76 ARG HB3 1 76 ARG HD3 . . 3.790 3.058 2.202 3.718 . 0 0 "[ . 1 . 2]" 1
1819 1 76 ARG HB3 1 77 HIS H . . 4.260 3.760 3.542 4.168 . 0 0 "[ . 1 . 2]" 1
1820 1 76 ARG QD 1 78 VAL QG . . 4.650 3.282 2.803 4.183 . 0 0 "[ . 1 . 2]" 1
1821 1 76 ARG HG2 1 77 HIS H . . 4.170 2.192 1.893 3.194 . 0 0 "[ . 1 . 2]" 1
1822 1 76 ARG HG2 1 78 VAL QG . . 4.610 3.206 2.878 3.916 . 0 0 "[ . 1 . 2]" 1
1823 1 76 ARG HG3 1 77 HIS H . . 3.930 2.623 2.294 3.030 . 0 0 "[ . 1 . 2]" 1
1824 1 76 ARG HG3 1 78 VAL QG . . 4.450 3.933 3.592 4.490 0.040 12 0 "[ . 1 . 2]" 1
1825 1 77 HIS H 1 77 HIS HB2 . . 4.020 3.500 3.306 3.565 . 0 0 "[ . 1 . 2]" 1
1826 1 77 HIS H 1 77 HIS HB3 . . 3.890 3.023 2.988 3.095 . 0 0 "[ . 1 . 2]" 1
1827 1 77 HIS H 1 78 VAL H . . 4.640 3.940 3.705 4.338 . 0 0 "[ . 1 . 2]" 1
1828 1 77 HIS H 1 78 VAL HB . . 5.500 5.476 4.788 5.677 0.177 6 0 "[ . 1 . 2]" 1
1829 1 77 HIS H 1 78 VAL QG . . 4.520 3.792 3.363 4.624 0.104 19 0 "[ . 1 . 2]" 1
1830 1 77 HIS HA 1 77 HIS HE1 . . 5.500 4.828 4.662 4.903 . 0 0 "[ . 1 . 2]" 1
1831 1 77 HIS HA 1 78 VAL H . . 3.110 2.170 2.140 2.365 . 0 0 "[ . 1 . 2]" 1
1832 1 77 HIS HA 1 78 VAL HB . . 5.220 4.518 4.348 4.741 . 0 0 "[ . 1 . 2]" 1
1833 1 77 HIS HA 1 78 VAL MG1 . . 5.500 5.167 3.544 5.474 . 0 0 "[ . 1 . 2]" 1
1834 1 77 HIS HA 1 78 VAL QG . . 4.180 3.826 3.470 4.052 . 0 0 "[ . 1 . 2]" 1
1835 1 77 HIS HA 1 78 VAL MG2 . . 5.500 4.190 3.512 5.456 . 0 0 "[ . 1 . 2]" 1
1836 1 77 HIS HB2 1 78 VAL H . . 4.530 4.268 3.788 4.411 . 0 0 "[ . 1 . 2]" 1
1837 1 77 HIS HB3 1 78 VAL H . . 4.670 4.277 3.735 4.447 . 0 0 "[ . 1 . 2]" 1
1838 1 77 HIS HD2 1 78 VAL H . . 5.500 5.163 3.905 5.525 0.025 2 0 "[ . 1 . 2]" 1
1839 1 77 HIS HD2 1 79 VAL H . . 4.770 4.418 4.113 4.556 . 0 0 "[ . 1 . 2]" 1
1840 1 77 HIS HD2 1 79 VAL MG1 . . 5.460 5.224 4.975 5.438 . 0 0 "[ . 1 . 2]" 1
1841 1 77 HIS HD2 1 79 VAL MG2 . . 3.120 2.821 2.543 3.114 . 0 0 "[ . 1 . 2]" 1
1842 1 77 HIS HE1 1 78 VAL H . . 4.990 4.653 3.616 5.024 0.034 5 0 "[ . 1 . 2]" 1
1843 1 78 VAL H 1 78 VAL HB . . 3.750 2.594 2.379 3.326 . 0 0 "[ . 1 . 2]" 1
1844 1 78 VAL H 1 78 VAL MG1 . . 3.920 3.487 1.958 3.872 . 0 0 "[ . 1 . 2]" 1
1845 1 78 VAL H 1 78 VAL QG . . 3.090 2.658 1.952 3.033 . 0 0 "[ . 1 . 2]" 1
1846 1 78 VAL H 1 78 VAL MG2 . . 3.920 3.004 2.677 3.831 . 0 0 "[ . 1 . 2]" 1
1847 1 78 VAL H 1 79 VAL H . . 4.740 4.113 3.998 4.192 . 0 0 "[ . 1 . 2]" 1
1848 1 78 VAL HA 1 78 VAL MG1 . . 3.140 2.616 2.463 3.185 0.045 19 0 "[ . 1 . 2]" 1
1849 1 78 VAL HA 1 78 VAL MG2 . . 3.140 2.290 2.151 2.432 . 0 0 "[ . 1 . 2]" 1
1850 1 78 VAL HA 1 79 VAL H . . 3.010 2.185 2.141 2.243 . 0 0 "[ . 1 . 2]" 1
1851 1 78 VAL HA 1 79 VAL HB . . 5.500 4.548 4.493 4.598 . 0 0 "[ . 1 . 2]" 1
1852 1 78 VAL HB 1 79 VAL H . . 4.570 4.468 4.351 4.535 . 0 0 "[ . 1 . 2]" 1
1853 1 78 VAL QG 1 79 VAL H . . 4.970 3.075 2.706 3.280 . 0 0 "[ . 1 . 2]" 1
1854 1 78 VAL QG 1 80 GLU H . . 4.200 3.857 3.682 4.045 . 0 0 "[ . 1 . 2]" 1
1855 1 78 VAL QG 1 80 GLU QB . . 4.710 4.201 4.054 4.411 . 0 0 "[ . 1 . 2]" 1
1856 1 78 VAL QG 1 80 GLU HG2 . . 3.820 3.280 3.024 3.687 . 0 0 "[ . 1 . 2]" 1
1857 1 78 VAL QG 1 80 GLU HG3 . . 3.440 2.744 2.380 3.000 . 0 0 "[ . 1 . 2]" 1
1858 1 79 VAL H 1 79 VAL HB . . 3.380 2.496 2.434 2.637 . 0 0 "[ . 1 . 2]" 1
1859 1 79 VAL H 1 79 VAL MG1 . . 3.830 3.758 3.748 3.768 . 0 0 "[ . 1 . 2]" 1
1860 1 79 VAL H 1 79 VAL MG2 . . 3.050 2.295 2.180 2.457 . 0 0 "[ . 1 . 2]" 1
1861 1 79 VAL H 1 80 GLU H . . 4.740 4.363 4.304 4.444 . 0 0 "[ . 1 . 2]" 1
1862 1 79 VAL H 1 82 LEU MD1 . . 5.050 4.210 4.053 4.389 . 0 0 "[ . 1 . 2]" 1
1863 1 79 VAL HA 1 79 VAL MG1 . . 3.100 2.474 2.394 2.508 . 0 0 "[ . 1 . 2]" 1
1864 1 79 VAL HA 1 79 VAL MG2 . . 3.340 2.240 2.190 2.295 . 0 0 "[ . 1 . 2]" 1
1865 1 79 VAL HA 1 80 GLU H . . 2.840 2.163 2.143 2.185 . 0 0 "[ . 1 . 2]" 1
1866 1 79 VAL HA 1 80 GLU HG3 . . 4.880 4.415 4.172 4.887 0.007 3 0 "[ . 1 . 2]" 1
1867 1 79 VAL HB 1 80 GLU H . . 4.810 4.419 4.343 4.477 . 0 0 "[ . 1 . 2]" 1
1868 1 79 VAL HB 1 82 LEU MD1 . . 3.690 2.399 2.043 2.587 . 0 0 "[ . 1 . 2]" 1
1869 1 79 VAL HB 1 82 LEU MD2 . . 3.900 3.566 3.125 3.750 . 0 0 "[ . 1 . 2]" 1
1870 1 79 VAL HB 1 82 LEU HG . . 4.920 3.939 3.597 4.230 . 0 0 "[ . 1 . 2]" 1
1871 1 79 VAL HB 1 111 THR MG . . 5.500 5.360 5.198 5.530 0.030 12 0 "[ . 1 . 2]" 1
1872 1 79 VAL MG1 1 80 GLU H . . 3.480 3.104 2.894 3.244 . 0 0 "[ . 1 . 2]" 1
1873 1 79 VAL MG1 1 82 LEU MD1 . . 2.950 2.263 1.973 2.519 . 0 0 "[ . 1 . 2]" 1
1874 1 79 VAL MG1 1 82 LEU MD2 . . 2.560 1.901 1.770 2.006 . 0 0 "[ . 1 . 2]" 1
1875 1 79 VAL MG1 1 88 TYR HB3 . . 4.010 4.029 3.980 4.077 0.067 12 0 "[ . 1 . 2]" 1
1876 1 79 VAL MG1 1 88 TYR QE . . 5.030 4.432 4.127 4.777 . 0 0 "[ . 1 . 2]" 1
1877 1 79 VAL MG1 1 90 PHE QD . . 4.630 4.530 4.316 4.668 0.038 19 0 "[ . 1 . 2]" 1
1878 1 79 VAL MG1 1 90 PHE QE . . 3.530 2.910 2.701 3.094 . 0 0 "[ . 1 . 2]" 1
1879 1 79 VAL MG1 1 90 PHE HZ . . 3.500 2.228 1.959 2.618 . 0 0 "[ . 1 . 2]" 1
1880 1 79 VAL MG2 1 80 GLU H . . 4.060 4.091 4.068 4.177 0.117 19 0 "[ . 1 . 2]" 1
1881 1 79 VAL MG2 1 82 LEU MD2 . . 3.960 3.872 3.626 3.976 0.016 17 0 "[ . 1 . 2]" 1
1882 1 79 VAL MG2 1 90 PHE HB3 . . 5.500 4.385 4.128 4.555 . 0 0 "[ . 1 . 2]" 1
1883 1 79 VAL MG2 1 90 PHE QD . . 4.610 3.367 3.214 3.538 . 0 0 "[ . 1 . 2]" 1
1884 1 79 VAL MG2 1 90 PHE QE . . 3.880 2.541 2.156 2.848 . 0 0 "[ . 1 . 2]" 1
1885 1 79 VAL MG2 1 90 PHE HZ . . 4.120 2.634 2.409 2.855 . 0 0 "[ . 1 . 2]" 1
1886 1 80 GLU H 1 80 GLU HB2 . . 3.620 2.324 2.242 2.424 . 0 0 "[ . 1 . 2]" 1
1887 1 80 GLU H 1 80 GLU QB . . 3.130 2.296 2.218 2.390 . 0 0 "[ . 1 . 2]" 1
1888 1 80 GLU H 1 80 GLU HB3 . . 3.620 3.576 3.521 3.636 0.016 3 0 "[ . 1 . 2]" 1
1889 1 80 GLU H 1 80 GLU HG2 . . 4.310 3.966 3.748 4.198 . 0 0 "[ . 1 . 2]" 1
1890 1 80 GLU H 1 80 GLU HG3 . . 3.660 2.845 2.491 3.465 . 0 0 "[ . 1 . 2]" 1
1891 1 80 GLU H 1 81 GLY H . . 4.760 4.568 4.464 4.615 . 0 0 "[ . 1 . 2]" 1
1892 1 80 GLU H 1 82 LEU MD2 . . 5.150 4.872 4.632 5.081 . 0 0 "[ . 1 . 2]" 1
1893 1 80 GLU HA 1 80 GLU HG2 . . 3.720 2.561 2.296 3.517 . 0 0 "[ . 1 . 2]" 1
1894 1 80 GLU HA 1 80 GLU HG3 . . 3.850 2.830 2.330 3.031 . 0 0 "[ . 1 . 2]" 1
1895 1 80 GLU HA 1 82 LEU MD1 . . 4.380 4.206 3.942 4.390 0.010 12 0 "[ . 1 . 2]" 1
1896 1 80 GLU HA 1 82 LEU HG . . 4.710 3.611 3.303 3.853 . 0 0 "[ . 1 . 2]" 1
1897 1 80 GLU QB 1 81 GLY H . . 3.280 2.302 1.940 2.690 . 0 0 "[ . 1 . 2]" 1
1898 1 80 GLU QB 1 81 GLY QA . . 4.540 3.477 3.410 3.579 . 0 0 "[ . 1 . 2]" 1
1899 1 80 GLU HB2 1 81 GLY H . . 3.930 3.665 3.236 3.978 0.048 19 0 "[ . 1 . 2]" 1
1900 1 80 GLU HB3 1 81 GLY H . . 3.930 2.327 1.956 2.736 . 0 0 "[ . 1 . 2]" 1
1901 1 80 GLU HG2 1 81 GLY H . . 4.080 3.717 3.440 4.093 0.013 3 0 "[ . 1 . 2]" 1
1902 1 80 GLU HG3 1 81 GLY H . . 4.720 4.596 4.001 4.741 0.021 19 0 "[ . 1 . 2]" 1
1903 1 81 GLY H 1 82 LEU H . . 3.490 3.049 2.889 3.227 . 0 0 "[ . 1 . 2]" 1
1904 1 81 GLY H 1 82 LEU MD2 . . 5.150 4.851 4.686 5.041 . 0 0 "[ . 1 . 2]" 1
1905 1 81 GLY H 1 82 LEU HG . . 4.290 4.090 3.885 4.296 0.006 3 0 "[ . 1 . 2]" 1
1906 1 81 GLY QA 1 82 LEU MD2 . . 4.290 3.939 3.762 4.107 . 0 0 "[ . 1 . 2]" 1
1907 1 82 LEU H 1 82 LEU HB2 . . 2.900 2.651 2.541 2.752 . 0 0 "[ . 1 . 2]" 1
1908 1 82 LEU H 1 82 LEU MD1 . . 4.610 4.245 4.151 4.346 . 0 0 "[ . 1 . 2]" 1
1909 1 82 LEU H 1 82 LEU HG . . 3.620 3.138 2.999 3.221 . 0 0 "[ . 1 . 2]" 1
1910 1 82 LEU HA 1 82 LEU MD1 . . 4.050 3.824 3.770 3.878 . 0 0 "[ . 1 . 2]" 1
1911 1 82 LEU HA 1 82 LEU MD2 . . 2.730 1.989 1.937 2.134 . 0 0 "[ . 1 . 2]" 1
1912 1 82 LEU HA 1 83 GLU H . . 3.470 2.402 2.324 2.505 . 0 0 "[ . 1 . 2]" 1
1913 1 82 LEU HA 1 83 GLU QG . . 4.220 3.800 3.511 4.113 . 0 0 "[ . 1 . 2]" 1
1914 1 82 LEU HA 1 88 TYR QE . . 4.670 3.615 3.483 3.744 . 0 0 "[ . 1 . 2]" 1
1915 1 82 LEU HB2 1 82 LEU MD1 . . 3.220 2.368 2.207 2.496 . 0 0 "[ . 1 . 2]" 1
1916 1 82 LEU HB2 1 88 TYR QE . . 4.690 4.376 3.947 4.705 0.015 20 0 "[ . 1 . 2]" 1
1917 1 82 LEU HB2 1 111 THR MG . . 4.230 3.091 2.943 3.289 . 0 0 "[ . 1 . 2]" 1
1918 1 82 LEU HB3 1 82 LEU MD1 . . 3.450 2.275 2.141 2.437 . 0 0 "[ . 1 . 2]" 1
1919 1 82 LEU HB3 1 82 LEU MD2 . . 3.230 2.366 2.273 2.427 . 0 0 "[ . 1 . 2]" 1
1920 1 82 LEU HB3 1 83 GLU H . . 3.260 2.423 2.208 2.611 . 0 0 "[ . 1 . 2]" 1
1921 1 82 LEU HB3 1 88 TYR QD . . 4.830 3.943 3.680 4.281 . 0 0 "[ . 1 . 2]" 1
1922 1 82 LEU HB3 1 88 TYR QE . . 4.090 2.722 2.328 3.096 . 0 0 "[ . 1 . 2]" 1
1923 1 82 LEU HB3 1 111 THR H . . 5.500 5.507 5.405 5.535 0.035 6 0 "[ . 1 . 2]" 1
1924 1 82 LEU HB3 1 111 THR MG . . 4.060 2.560 2.335 2.773 . 0 0 "[ . 1 . 2]" 1
1925 1 82 LEU MD1 1 83 GLU H . . 5.010 4.306 4.046 4.501 . 0 0 "[ . 1 . 2]" 1
1926 1 82 LEU MD1 1 88 TYR HB2 . . 4.780 3.633 3.444 3.819 . 0 0 "[ . 1 . 2]" 1
1927 1 82 LEU MD1 1 88 TYR HB3 . . 5.320 4.037 3.752 4.322 . 0 0 "[ . 1 . 2]" 1
1928 1 82 LEU MD1 1 88 TYR QD . . 4.320 3.230 2.695 3.527 . 0 0 "[ . 1 . 2]" 1
1929 1 82 LEU MD1 1 90 PHE QE . . 5.200 3.694 3.466 3.973 . 0 0 "[ . 1 . 2]" 1
1930 1 82 LEU MD1 1 90 PHE HZ . . 3.840 3.027 2.827 3.456 . 0 0 "[ . 1 . 2]" 1
1931 1 82 LEU MD1 1 109 VAL MG2 . . 4.940 4.217 4.069 4.378 . 0 0 "[ . 1 . 2]" 1
1932 1 82 LEU MD1 1 111 THR H . . 5.210 4.825 4.598 5.015 . 0 0 "[ . 1 . 2]" 1
1933 1 82 LEU MD1 1 111 THR MG . . 3.130 2.193 1.977 2.501 . 0 0 "[ . 1 . 2]" 1
1934 1 82 LEU MD2 1 83 GLU H . . 3.220 3.198 3.070 3.248 0.028 15 0 "[ . 1 . 2]" 1
1935 1 82 LEU MD2 1 83 GLU HB2 . . 5.250 5.048 4.836 5.198 . 0 0 "[ . 1 . 2]" 1
1936 1 82 LEU MD2 1 86 THR MG . . 4.400 4.206 3.996 4.377 . 0 0 "[ . 1 . 2]" 1
1937 1 82 LEU MD2 1 88 TYR HB2 . . 4.880 4.069 3.802 4.318 . 0 0 "[ . 1 . 2]" 1
1938 1 82 LEU MD2 1 88 TYR HB3 . . 4.480 3.819 3.641 4.028 . 0 0 "[ . 1 . 2]" 1
1939 1 82 LEU MD2 1 88 TYR QD . . 3.810 3.055 2.857 3.267 . 0 0 "[ . 1 . 2]" 1
1940 1 82 LEU MD2 1 88 TYR QE . . 3.380 2.591 2.254 2.754 . 0 0 "[ . 1 . 2]" 1
1941 1 82 LEU MD2 1 90 PHE HZ . . 4.470 2.935 2.686 3.233 . 0 0 "[ . 1 . 2]" 1
1942 1 82 LEU MD2 1 111 THR MG . . 3.960 3.766 3.517 3.933 . 0 0 "[ . 1 . 2]" 1
1943 1 83 GLU H 1 83 GLU HB2 . . 3.680 2.413 2.323 2.504 . 0 0 "[ . 1 . 2]" 1
1944 1 83 GLU H 1 83 GLU HB3 . . 3.720 3.631 3.559 3.689 . 0 0 "[ . 1 . 2]" 1
1945 1 83 GLU H 1 83 GLU HG2 . . 4.200 3.723 2.785 4.201 0.001 10 0 "[ . 1 . 2]" 1
1946 1 83 GLU H 1 83 GLU QG . . 3.550 2.945 2.514 3.189 . 0 0 "[ . 1 . 2]" 1
1947 1 83 GLU H 1 83 GLU HG3 . . 4.200 3.286 2.548 4.160 . 0 0 "[ . 1 . 2]" 1
1948 1 83 GLU H 1 84 PRO HD2 . . 4.900 4.806 4.777 4.824 . 0 0 "[ . 1 . 2]" 1
1949 1 83 GLU H 1 84 PRO HD3 . . 5.200 5.033 4.996 5.071 . 0 0 "[ . 1 . 2]" 1
1950 1 83 GLU H 1 86 THR MG . . 4.480 3.522 3.391 3.751 . 0 0 "[ . 1 . 2]" 1
1951 1 83 GLU H 1 88 TYR QD . . 5.500 4.737 4.479 4.922 . 0 0 "[ . 1 . 2]" 1
1952 1 83 GLU H 1 88 TYR QE . . 3.910 2.548 2.213 2.856 . 0 0 "[ . 1 . 2]" 1
1953 1 83 GLU H 1 111 THR MG . . 3.870 3.776 3.546 3.886 0.016 19 0 "[ . 1 . 2]" 1
1954 1 83 GLU HA 1 83 GLU HG2 . . 3.940 2.488 2.186 2.963 . 0 0 "[ . 1 . 2]" 1
1955 1 83 GLU HA 1 83 GLU QG . . 3.420 2.395 2.149 2.853 . 0 0 "[ . 1 . 2]" 1
1956 1 83 GLU HA 1 83 GLU HG3 . . 3.940 3.216 2.831 3.722 . 0 0 "[ . 1 . 2]" 1
1957 1 83 GLU HA 1 84 PRO HD2 . . 3.090 2.399 2.338 2.479 . 0 0 "[ . 1 . 2]" 1
1958 1 83 GLU HA 1 84 PRO HD3 . . 3.100 2.298 2.277 2.332 . 0 0 "[ . 1 . 2]" 1
1959 1 83 GLU HA 1 84 PRO QG . . 4.130 4.000 3.963 4.052 . 0 0 "[ . 1 . 2]" 1
1960 1 83 GLU HB2 1 84 PRO HD2 . . 3.920 3.671 3.599 3.838 . 0 0 "[ . 1 . 2]" 1
1961 1 83 GLU HB2 1 84 PRO HD3 . . 4.960 4.731 4.681 4.835 . 0 0 "[ . 1 . 2]" 1
1962 1 83 GLU HB2 1 86 THR HB . . 4.280 2.922 2.624 3.278 . 0 0 "[ . 1 . 2]" 1
1963 1 83 GLU HB2 1 86 THR MG . . 4.080 2.905 2.679 3.079 . 0 0 "[ . 1 . 2]" 1
1964 1 83 GLU HB2 1 88 TYR QE . . 4.720 3.622 3.333 3.892 . 0 0 "[ . 1 . 2]" 1
1965 1 83 GLU HB3 1 84 PRO HD2 . . 3.050 2.089 1.991 2.330 . 0 0 "[ . 1 . 2]" 1
1966 1 83 GLU HB3 1 84 PRO HD3 . . 4.190 3.526 3.442 3.724 . 0 0 "[ . 1 . 2]" 1
1967 1 83 GLU HB3 1 86 THR HB . . 4.200 3.908 3.507 4.149 . 0 0 "[ . 1 . 2]" 1
1968 1 83 GLU HB3 1 86 THR MG . . 4.330 4.178 3.936 4.306 . 0 0 "[ . 1 . 2]" 1
1969 1 83 GLU HB3 1 88 TYR QE . . 5.250 4.998 4.743 5.203 . 0 0 "[ . 1 . 2]" 1
1970 1 83 GLU QG 1 84 PRO HD2 . . 3.860 3.158 2.620 3.765 . 0 0 "[ . 1 . 2]" 1
1971 1 83 GLU QG 1 84 PRO HD3 . . 4.680 3.918 3.426 4.636 . 0 0 "[ . 1 . 2]" 1
1972 1 83 GLU QG 1 86 THR MG . . 4.330 4.182 4.017 4.323 . 0 0 "[ . 1 . 2]" 1
1973 1 83 GLU HG2 1 84 PRO HD2 . . 4.490 3.318 2.656 4.358 . 0 0 "[ . 1 . 2]" 1
1974 1 83 GLU HG2 1 84 PRO HD3 . . 5.410 4.087 3.515 5.068 . 0 0 "[ . 1 . 2]" 1
1975 1 83 GLU HG3 1 84 PRO HD2 . . 4.490 4.242 3.966 4.405 . 0 0 "[ . 1 . 2]" 1
1976 1 83 GLU HG3 1 84 PRO HD3 . . 5.410 5.136 4.745 5.368 . 0 0 "[ . 1 . 2]" 1
1977 1 84 PRO HA 1 85 ARG H . . 3.010 2.193 2.167 2.296 . 0 0 "[ . 1 . 2]" 1
1978 1 84 PRO HA 1 85 ARG HA . . 4.490 4.391 4.381 4.415 . 0 0 "[ . 1 . 2]" 1
1979 1 84 PRO HA 1 85 ARG QG . . 4.660 3.993 3.808 4.139 . 0 0 "[ . 1 . 2]" 1
1980 1 84 PRO HA 1 86 THR H . . 4.020 3.780 3.410 4.021 0.001 14 0 "[ . 1 . 2]" 1
1981 1 84 PRO HA 1 111 THR HG1 . . 3.850 2.084 1.989 2.225 . 0 0 "[ . 1 . 2]" 1
1982 1 84 PRO HA 1 111 THR MG . . 4.370 4.203 3.792 4.380 0.010 3 0 "[ . 1 . 2]" 1
1983 1 84 PRO HA 1 112 THR H . . 4.980 4.345 3.912 4.600 . 0 0 "[ . 1 . 2]" 1
1984 1 84 PRO HA 1 113 ARG HA . . 4.580 3.829 3.554 4.278 . 0 0 "[ . 1 . 2]" 1
1985 1 84 PRO HB2 1 85 ARG H . . 3.670 3.288 2.899 3.423 . 0 0 "[ . 1 . 2]" 1
1986 1 84 PRO HB2 1 85 ARG HB2 . . 4.340 3.762 3.633 4.010 . 0 0 "[ . 1 . 2]" 1
1987 1 84 PRO HB2 1 85 ARG HG2 . . 4.290 3.229 2.934 4.430 0.140 15 0 "[ . 1 . 2]" 1
1988 1 84 PRO HB2 1 85 ARG QG . . 3.670 2.995 2.484 3.166 . 0 0 "[ . 1 . 2]" 1
1989 1 84 PRO HB2 1 85 ARG HG3 . . 4.290 3.796 2.565 4.227 . 0 0 "[ . 1 . 2]" 1
1990 1 84 PRO HB2 1 111 THR HG1 . . 4.650 4.510 4.166 4.660 0.010 1 0 "[ . 1 . 2]" 1
1991 1 84 PRO HB2 1 114 GLU H . . 4.820 2.657 2.241 3.047 . 0 0 "[ . 1 . 2]" 1
1992 1 84 PRO HB3 1 85 ARG H . . 3.920 3.841 3.608 3.927 0.007 14 0 "[ . 1 . 2]" 1
1993 1 84 PRO HB3 1 85 ARG QG . . 4.390 4.289 3.959 4.440 0.050 17 0 "[ . 1 . 2]" 1
1994 1 84 PRO HB3 1 111 THR HG1 . . 4.510 4.258 4.044 4.445 . 0 0 "[ . 1 . 2]" 1
1995 1 84 PRO HB3 1 113 ARG HA . . 4.140 3.323 2.909 3.767 . 0 0 "[ . 1 . 2]" 1
1996 1 84 PRO HB3 1 114 GLU H . . 4.540 2.735 2.303 3.117 . 0 0 "[ . 1 . 2]" 1
1997 1 84 PRO HB3 1 114 GLU HA . . 4.830 3.634 3.183 4.044 . 0 0 "[ . 1 . 2]" 1
1998 1 84 PRO HB3 1 114 GLU HB2 . . 4.660 4.088 3.599 4.646 . 0 0 "[ . 1 . 2]" 1
1999 1 84 PRO HB3 1 114 GLU QB . . 3.950 3.192 1.979 4.123 0.173 19 0 "[ . 1 . 2]" 1
2000 1 84 PRO HB3 1 114 GLU HB3 . . 4.660 3.646 1.986 4.685 0.025 16 0 "[ . 1 . 2]" 1
2001 1 84 PRO HB3 1 114 GLU HG2 . . 4.570 3.142 2.130 4.147 . 0 0 "[ . 1 . 2]" 1
2002 1 84 PRO HB3 1 114 GLU QG . . 3.870 2.477 1.923 3.681 . 0 0 "[ . 1 . 2]" 1
2003 1 84 PRO HB3 1 114 GLU HG3 . . 4.570 3.053 1.935 4.595 0.025 14 0 "[ . 1 . 2]" 1
2004 1 84 PRO HD3 1 114 GLU QG . . 5.340 3.802 2.827 4.946 . 0 0 "[ . 1 . 2]" 1
2005 1 84 PRO QG 1 85 ARG H . . 4.670 4.554 4.348 4.617 . 0 0 "[ . 1 . 2]" 1
2006 1 84 PRO QG 1 85 ARG HB2 . . 4.380 4.228 4.123 4.400 0.020 12 0 "[ . 1 . 2]" 1
2007 1 84 PRO QG 1 113 ARG HA . . 4.710 4.441 3.816 4.683 . 0 0 "[ . 1 . 2]" 1
2008 1 84 PRO QG 1 114 GLU HA . . 5.070 4.708 4.082 5.079 0.009 9 0 "[ . 1 . 2]" 1
2009 1 84 PRO QG 1 114 GLU QB . . 4.030 3.291 2.500 4.004 . 0 0 "[ . 1 . 2]" 1
2010 1 84 PRO QG 1 114 GLU QG . . 3.860 2.215 1.897 3.084 . 0 0 "[ . 1 . 2]" 1
2011 1 85 ARG H 1 85 ARG HA . . 2.870 2.278 2.274 2.298 . 0 0 "[ . 1 . 2]" 1
2012 1 85 ARG H 1 85 ARG HB2 . . 3.790 3.529 3.426 3.644 . 0 0 "[ . 1 . 2]" 1
2013 1 85 ARG H 1 85 ARG HB3 . . 4.080 4.027 3.857 4.077 . 0 0 "[ . 1 . 2]" 1
2014 1 85 ARG H 1 85 ARG QD . . 4.220 3.792 3.439 4.291 0.071 12 0 "[ . 1 . 2]" 1
2015 1 85 ARG H 1 85 ARG HG2 . . 4.280 2.696 2.431 3.980 . 0 0 "[ . 1 . 2]" 1
2016 1 85 ARG H 1 85 ARG QG . . 3.440 2.590 2.358 2.715 . 0 0 "[ . 1 . 2]" 1
2017 1 85 ARG H 1 85 ARG HG3 . . 4.280 4.053 2.444 4.291 0.011 19 0 "[ . 1 . 2]" 1
2018 1 85 ARG H 1 86 THR H . . 3.470 2.792 2.668 2.946 . 0 0 "[ . 1 . 2]" 1
2019 1 85 ARG H 1 111 THR H . . 4.590 4.504 4.369 4.634 0.044 12 0 "[ . 1 . 2]" 1
2020 1 85 ARG H 1 111 THR HG1 . . 3.560 2.098 1.883 2.644 . 0 0 "[ . 1 . 2]" 1
2021 1 85 ARG H 1 111 THR MG . . 4.690 4.450 4.206 4.586 . 0 0 "[ . 1 . 2]" 1
2022 1 85 ARG H 1 112 THR H . . 4.610 4.032 3.757 4.288 . 0 0 "[ . 1 . 2]" 1
2023 1 85 ARG H 1 113 ARG HA . . 3.740 3.360 3.082 3.564 . 0 0 "[ . 1 . 2]" 1
2024 1 85 ARG HA 1 85 ARG QD . . 3.900 2.646 2.083 4.047 0.147 15 0 "[ . 1 . 2]" 1
2025 1 85 ARG HA 1 85 ARG HG2 . . 3.900 2.810 2.647 3.210 . 0 0 "[ . 1 . 2]" 1
2026 1 85 ARG HA 1 85 ARG QG . . 3.280 2.713 2.568 2.803 . 0 0 "[ . 1 . 2]" 1
2027 1 85 ARG HA 1 85 ARG HG3 . . 3.900 3.727 2.702 3.841 . 0 0 "[ . 1 . 2]" 1
2028 1 85 ARG HA 1 86 THR H . . 3.040 2.763 2.643 2.939 . 0 0 "[ . 1 . 2]" 1
2029 1 85 ARG HA 1 86 THR HA . . 4.760 4.434 4.390 4.498 . 0 0 "[ . 1 . 2]" 1
2030 1 85 ARG HA 1 110 ALA MB . . 3.990 3.569 3.369 3.723 . 0 0 "[ . 1 . 2]" 1
2031 1 85 ARG HA 1 111 THR H . . 4.530 4.384 4.034 4.546 0.016 19 0 "[ . 1 . 2]" 1
2032 1 85 ARG HA 1 111 THR HG1 . . 4.270 3.815 3.427 4.254 . 0 0 "[ . 1 . 2]" 1
2033 1 85 ARG HA 1 112 THR HA . . 5.020 4.293 3.869 4.636 . 0 0 "[ . 1 . 2]" 1
2034 1 85 ARG HA 1 113 ARG HA . . 4.920 4.627 4.326 4.827 . 0 0 "[ . 1 . 2]" 1
2035 1 85 ARG HB2 1 85 ARG QD . . 3.600 3.273 1.999 3.508 . 0 0 "[ . 1 . 2]" 1
2036 1 85 ARG HB2 1 86 THR H . . 4.430 4.253 4.062 4.342 . 0 0 "[ . 1 . 2]" 1
2037 1 85 ARG HB2 1 113 ARG HA . . 4.600 4.554 4.340 4.623 0.023 12 0 "[ . 1 . 2]" 1
2038 1 85 ARG HB3 1 85 ARG QD . . 3.210 2.405 2.066 2.913 . 0 0 "[ . 1 . 2]" 1
2039 1 85 ARG HB3 1 86 THR H . . 4.580 4.441 4.413 4.544 . 0 0 "[ . 1 . 2]" 1
2040 1 85 ARG HB3 1 110 ALA MB . . 5.100 4.905 4.574 5.125 0.025 9 0 "[ . 1 . 2]" 1
2041 1 85 ARG QD 1 85 ARG QG . . 2.340 2.031 2.004 2.071 . 0 0 "[ . 1 . 2]" 1
2042 1 85 ARG QD 1 113 ARG H . . 4.420 3.898 3.456 4.555 0.135 15 0 "[ . 1 . 2]" 1
2043 1 85 ARG QD 1 113 ARG HA . . 4.260 3.570 2.326 4.265 0.005 10 0 "[ . 1 . 2]" 1
2044 1 85 ARG QG 1 86 THR H . . 4.730 4.606 4.368 4.693 . 0 0 "[ . 1 . 2]" 1
2045 1 85 ARG QG 1 113 ARG H . . 5.310 3.834 3.091 4.052 . 0 0 "[ . 1 . 2]" 1
2046 1 85 ARG QG 1 113 ARG HA . . 3.200 2.267 1.946 2.546 . 0 0 "[ . 1 . 2]" 1
2047 1 85 ARG HG2 1 113 ARG HA . . 3.800 2.368 2.000 3.523 . 0 0 "[ . 1 . 2]" 1
2048 1 85 ARG HG3 1 113 ARG HA . . 3.800 3.412 2.139 3.709 . 0 0 "[ . 1 . 2]" 1
2049 1 86 THR H 1 86 THR HB . . 3.520 2.628 2.546 2.700 . 0 0 "[ . 1 . 2]" 1
2050 1 86 THR H 1 86 THR MG . . 3.840 3.820 3.769 3.858 0.018 13 0 "[ . 1 . 2]" 1
2051 1 86 THR H 1 87 LEU H . . 4.540 4.394 4.269 4.469 . 0 0 "[ . 1 . 2]" 1
2052 1 86 THR H 1 88 TYR QD . . 4.850 4.774 4.496 4.869 0.019 12 0 "[ . 1 . 2]" 1
2053 1 86 THR H 1 88 TYR QE . . 4.320 4.128 3.790 4.347 0.027 5 0 "[ . 1 . 2]" 1
2054 1 86 THR H 1 110 ALA HA . . 4.450 4.113 3.883 4.323 . 0 0 "[ . 1 . 2]" 1
2055 1 86 THR H 1 111 THR H . . 3.250 2.897 2.716 3.104 . 0 0 "[ . 1 . 2]" 1
2056 1 86 THR H 1 111 THR HG1 . . 3.130 2.873 2.426 3.138 0.008 19 0 "[ . 1 . 2]" 1
2057 1 86 THR H 1 111 THR MG . . 3.570 3.431 3.171 3.583 0.013 6 0 "[ . 1 . 2]" 1
2058 1 86 THR H 1 112 THR H . . 5.500 5.327 5.128 5.517 0.017 19 0 "[ . 1 . 2]" 1
2059 1 86 THR HA 1 86 THR MG . . 2.880 2.469 2.386 2.531 . 0 0 "[ . 1 . 2]" 1
2060 1 86 THR HA 1 87 LEU H . . 2.640 2.192 2.154 2.235 . 0 0 "[ . 1 . 2]" 1
2061 1 86 THR HA 1 87 LEU HB2 . . 4.660 4.511 4.362 4.622 . 0 0 "[ . 1 . 2]" 1
2062 1 86 THR HA 1 87 LEU HB3 . . 4.750 4.569 4.471 4.704 . 0 0 "[ . 1 . 2]" 1
2063 1 86 THR HB 1 87 LEU H . . 4.240 4.122 4.014 4.256 0.016 18 0 "[ . 1 . 2]" 1
2064 1 86 THR HB 1 88 TYR QD . . 4.160 3.789 3.595 3.975 . 0 0 "[ . 1 . 2]" 1
2065 1 86 THR HB 1 88 TYR QE . . 3.230 2.118 1.967 2.318 . 0 0 "[ . 1 . 2]" 1
2066 1 86 THR HB 1 111 THR H . . 4.790 4.203 4.039 4.344 . 0 0 "[ . 1 . 2]" 1
2067 1 86 THR HB 1 111 THR MG . . 4.340 3.401 3.162 3.649 . 0 0 "[ . 1 . 2]" 1
2068 1 86 THR MG 1 87 LEU H . . 3.080 2.399 2.226 2.558 . 0 0 "[ . 1 . 2]" 1
2069 1 86 THR MG 1 87 LEU HB2 . . 4.800 4.575 4.400 4.698 . 0 0 "[ . 1 . 2]" 1
2070 1 86 THR MG 1 87 LEU HB3 . . 4.180 3.920 3.849 4.027 . 0 0 "[ . 1 . 2]" 1
2071 1 86 THR MG 1 88 TYR H . . 4.960 4.512 4.378 4.684 . 0 0 "[ . 1 . 2]" 1
2072 1 86 THR MG 1 88 TYR HA . . 4.900 4.215 4.139 4.282 . 0 0 "[ . 1 . 2]" 1
2073 1 86 THR MG 1 88 TYR QD . . 3.940 3.024 2.683 3.392 . 0 0 "[ . 1 . 2]" 1
2074 1 86 THR MG 1 88 TYR QE . . 3.400 2.323 1.926 2.718 . 0 0 "[ . 1 . 2]" 1
2075 1 86 THR MG 1 111 THR H . . 4.650 4.583 4.473 4.660 0.010 12 0 "[ . 1 . 2]" 1
2076 1 86 THR MG 1 111 THR MG . . 4.140 4.048 3.891 4.151 0.011 7 0 "[ . 1 . 2]" 1
2077 1 87 LEU H 1 87 LEU HB2 . . 3.030 2.733 2.585 2.805 . 0 0 "[ . 1 . 2]" 1
2078 1 87 LEU H 1 87 LEU HB3 . . 3.090 2.420 2.330 2.539 . 0 0 "[ . 1 . 2]" 1
2079 1 87 LEU H 1 87 LEU MD1 . . 4.490 4.016 3.754 4.319 . 0 0 "[ . 1 . 2]" 1
2080 1 87 LEU H 1 87 LEU QD . . 3.920 3.630 3.491 3.804 . 0 0 "[ . 1 . 2]" 1
2081 1 87 LEU H 1 87 LEU MD2 . . 4.490 4.158 4.041 4.225 . 0 0 "[ . 1 . 2]" 1
2082 1 87 LEU H 1 87 LEU HG . . 4.920 4.565 4.441 4.660 . 0 0 "[ . 1 . 2]" 1
2083 1 87 LEU H 1 88 TYR H . . 4.730 4.582 4.567 4.608 . 0 0 "[ . 1 . 2]" 1
2084 1 87 LEU H 1 110 ALA HA . . 4.540 4.150 4.010 4.260 . 0 0 "[ . 1 . 2]" 1
2085 1 87 LEU H 1 110 ALA MB . . 4.100 3.934 3.748 4.118 0.018 9 0 "[ . 1 . 2]" 1
2086 1 87 LEU H 1 111 THR H . . 5.230 5.023 4.936 5.130 . 0 0 "[ . 1 . 2]" 1
2087 1 87 LEU HA 1 87 LEU QD . . 2.880 2.175 1.931 2.619 . 0 0 "[ . 1 . 2]" 1
2088 1 87 LEU HA 1 87 LEU HG . . 4.000 3.394 2.726 3.813 . 0 0 "[ . 1 . 2]" 1
2089 1 87 LEU HA 1 88 TYR H . . 2.920 2.232 2.194 2.265 . 0 0 "[ . 1 . 2]" 1
2090 1 87 LEU HA 1 88 TYR QD . . 4.700 3.624 3.066 4.026 . 0 0 "[ . 1 . 2]" 1
2091 1 87 LEU HA 1 109 VAL H . . 4.430 4.169 4.042 4.342 . 0 0 "[ . 1 . 2]" 1
2092 1 87 LEU HA 1 109 VAL MG2 . . 5.080 4.467 4.293 4.630 . 0 0 "[ . 1 . 2]" 1
2093 1 87 LEU HA 1 110 ALA H . . 4.150 4.060 3.942 4.167 0.017 4 0 "[ . 1 . 2]" 1
2094 1 87 LEU HA 1 110 ALA HA . . 3.230 1.982 1.940 2.015 . 0 0 "[ . 1 . 2]" 1
2095 1 87 LEU HA 1 110 ALA MB . . 3.130 2.803 2.576 2.967 . 0 0 "[ . 1 . 2]" 1
2096 1 87 LEU HA 1 111 THR H . . 4.120 3.680 3.588 3.798 . 0 0 "[ . 1 . 2]" 1
2097 1 87 LEU HB2 1 87 LEU QD . . 2.810 2.218 1.947 2.368 . 0 0 "[ . 1 . 2]" 1
2098 1 87 LEU HB2 1 88 TYR H . . 4.250 4.002 3.944 4.068 . 0 0 "[ . 1 . 2]" 1
2099 1 87 LEU HB2 1 110 ALA H . . 5.420 5.089 4.888 5.264 . 0 0 "[ . 1 . 2]" 1
2100 1 87 LEU HB2 1 110 ALA HA . . 4.040 3.794 3.686 4.000 . 0 0 "[ . 1 . 2]" 1
2101 1 87 LEU HB3 1 87 LEU MD1 . . 3.240 2.554 2.145 3.124 . 0 0 "[ . 1 . 2]" 1
2102 1 87 LEU HB3 1 87 LEU QD . . 2.680 2.125 1.957 2.169 . 0 0 "[ . 1 . 2]" 1
2103 1 87 LEU HB3 1 87 LEU MD2 . . 3.240 2.758 1.979 3.180 . 0 0 "[ . 1 . 2]" 1
2104 1 87 LEU HB3 1 88 TYR H . . 4.410 3.983 3.829 4.104 . 0 0 "[ . 1 . 2]" 1
2105 1 87 LEU HB3 1 88 TYR HA . . 4.810 4.692 4.538 4.807 . 0 0 "[ . 1 . 2]" 1
2106 1 87 LEU HB3 1 110 ALA HA . . 5.100 4.842 4.773 4.914 . 0 0 "[ . 1 . 2]" 1
2107 1 87 LEU HB3 1 110 ALA MB . . 4.630 4.308 4.129 4.461 . 0 0 "[ . 1 . 2]" 1
2108 1 87 LEU QD 1 88 TYR H . . 3.090 2.260 1.783 2.902 . 0 0 "[ . 1 . 2]" 1
2109 1 87 LEU QD 1 88 TYR HA . . 5.440 3.141 2.468 4.117 . 0 0 "[ . 1 . 2]" 1
2110 1 87 LEU QD 1 88 TYR QD . . 4.690 4.280 3.986 4.754 0.064 12 0 "[ . 1 . 2]" 1
2111 1 87 LEU QD 1 89 LYS H . . 4.930 3.343 2.543 4.620 . 0 0 "[ . 1 . 2]" 1
2112 1 87 LEU QD 1 89 LYS HA . . 4.690 3.709 3.176 4.514 . 0 0 "[ . 1 . 2]" 1
2113 1 87 LEU QD 1 89 LYS QD . . 4.140 3.317 2.668 3.921 . 0 0 "[ . 1 . 2]" 1
2114 1 87 LEU QD 1 89 LYS QE . . 2.750 2.192 1.914 2.588 . 0 0 "[ . 1 . 2]" 1
2115 1 87 LEU QD 1 89 LYS HG3 . . 4.530 2.409 1.955 3.037 . 0 0 "[ . 1 . 2]" 1
2116 1 87 LEU QD 1 108 SER H . . 4.590 4.149 3.941 4.469 . 0 0 "[ . 1 . 2]" 1
2117 1 87 LEU QD 1 108 SER HA . . 3.460 2.757 2.324 3.452 . 0 0 "[ . 1 . 2]" 1
2118 1 87 LEU QD 1 108 SER HB2 . . 2.800 1.804 1.744 1.973 . 0 0 "[ . 1 . 2]" 1
2119 1 87 LEU QD 1 108 SER HB3 . . 3.370 2.938 2.830 3.027 . 0 0 "[ . 1 . 2]" 1
2120 1 87 LEU QD 1 109 VAL H . . 3.310 2.357 1.844 2.949 . 0 0 "[ . 1 . 2]" 1
2121 1 87 LEU QD 1 109 VAL HA . . 3.630 2.927 2.736 3.082 . 0 0 "[ . 1 . 2]" 1
2122 1 87 LEU QD 1 109 VAL HB . . 4.470 4.420 4.259 4.498 0.028 11 0 "[ . 1 . 2]" 1
2123 1 87 LEU QD 1 110 ALA H . . 3.510 3.022 2.880 3.144 . 0 0 "[ . 1 . 2]" 1
2124 1 87 LEU QD 1 110 ALA HA . . 3.450 2.965 2.827 3.131 . 0 0 "[ . 1 . 2]" 1
2125 1 87 LEU QD 1 110 ALA MB . . 2.760 2.486 2.180 2.765 0.005 2 0 "[ . 1 . 2]" 1
2126 1 87 LEU QD 1 111 THR H . . 4.840 4.720 4.535 4.873 0.033 9 0 "[ . 1 . 2]" 1
2127 1 87 LEU MD1 1 88 TYR H . . 4.200 2.615 2.225 3.020 . 0 0 "[ . 1 . 2]" 1
2128 1 87 LEU MD1 1 88 TYR QD . . 5.500 4.630 4.327 5.120 . 0 0 "[ . 1 . 2]" 1
2129 1 87 LEU MD1 1 108 SER HA . . 4.260 3.237 2.778 3.929 . 0 0 "[ . 1 . 2]" 1
2130 1 87 LEU MD1 1 108 SER HB2 . . 3.250 2.221 1.972 2.453 . 0 0 "[ . 1 . 2]" 1
2131 1 87 LEU MD1 1 108 SER HB3 . . 4.020 3.494 3.146 3.879 . 0 0 "[ . 1 . 2]" 1
2132 1 87 LEU MD2 1 88 TYR H . . 4.200 2.690 1.825 3.839 . 0 0 "[ . 1 . 2]" 1
2133 1 87 LEU MD2 1 88 TYR QD . . 5.500 5.046 4.588 5.639 0.139 12 0 "[ . 1 . 2]" 1
2134 1 87 LEU MD2 1 108 SER HA . . 4.260 3.081 2.391 3.975 . 0 0 "[ . 1 . 2]" 1
2135 1 87 LEU MD2 1 108 SER HB2 . . 3.250 1.922 1.855 2.080 . 0 0 "[ . 1 . 2]" 1
2136 1 87 LEU MD2 1 108 SER HB3 . . 4.020 3.176 2.987 3.291 . 0 0 "[ . 1 . 2]" 1
2137 1 87 LEU HG 1 88 TYR H . . 4.500 3.345 2.087 4.273 . 0 0 "[ . 1 . 2]" 1
2138 1 87 LEU HG 1 89 LYS H . . 5.500 5.177 4.430 5.589 0.089 14 0 "[ . 1 . 2]" 1
2139 1 87 LEU HG 1 89 LYS QE . . 4.630 3.770 3.207 4.423 . 0 0 "[ . 1 . 2]" 1
2140 1 87 LEU HG 1 108 SER HB2 . . 4.730 2.687 2.479 2.923 . 0 0 "[ . 1 . 2]" 1
2141 1 87 LEU HG 1 108 SER HB3 . . 4.710 4.262 4.035 4.463 . 0 0 "[ . 1 . 2]" 1
2142 1 87 LEU HG 1 109 VAL H . . 5.180 4.163 2.774 5.077 . 0 0 "[ . 1 . 2]" 1
2143 1 87 LEU HG 1 110 ALA HA . . 5.500 5.032 4.278 5.535 0.035 18 0 "[ . 1 . 2]" 1
2144 1 88 TYR H 1 88 TYR HB2 . . 3.620 2.714 2.656 2.749 . 0 0 "[ . 1 . 2]" 1
2145 1 88 TYR H 1 88 TYR HB3 . . 3.810 3.801 3.762 3.836 0.026 4 0 "[ . 1 . 2]" 1
2146 1 88 TYR H 1 88 TYR QD . . 3.560 3.368 2.970 3.570 0.010 18 0 "[ . 1 . 2]" 1
2147 1 88 TYR H 1 89 LYS H . . 4.370 4.140 4.018 4.327 . 0 0 "[ . 1 . 2]" 1
2148 1 88 TYR H 1 108 SER HA . . 4.790 3.873 3.785 3.960 . 0 0 "[ . 1 . 2]" 1
2149 1 88 TYR H 1 109 VAL H . . 3.710 2.476 2.334 2.621 . 0 0 "[ . 1 . 2]" 1
2150 1 88 TYR H 1 109 VAL MG2 . . 3.630 3.192 3.048 3.285 . 0 0 "[ . 1 . 2]" 1
2151 1 88 TYR H 1 110 ALA H . . 4.890 4.631 4.432 4.739 . 0 0 "[ . 1 . 2]" 1
2152 1 88 TYR H 1 110 ALA HA . . 3.470 3.437 3.285 3.531 0.061 11 0 "[ . 1 . 2]" 1
2153 1 88 TYR H 1 110 ALA MB . . 4.660 4.356 4.146 4.471 . 0 0 "[ . 1 . 2]" 1
2154 1 88 TYR H 1 111 THR H . . 4.930 4.845 4.680 4.956 0.026 12 0 "[ . 1 . 2]" 1
2155 1 88 TYR HA 1 88 TYR QD . . 3.680 2.854 2.633 3.114 . 0 0 "[ . 1 . 2]" 1
2156 1 88 TYR HA 1 88 TYR QE . . 5.500 4.541 4.467 4.657 . 0 0 "[ . 1 . 2]" 1
2157 1 88 TYR HA 1 89 LYS H . . 2.770 2.155 2.138 2.200 . 0 0 "[ . 1 . 2]" 1
2158 1 88 TYR HA 1 89 LYS HA . . 4.750 4.394 4.378 4.405 . 0 0 "[ . 1 . 2]" 1
2159 1 88 TYR HA 1 89 LYS HB2 . . 4.540 4.405 4.319 4.485 . 0 0 "[ . 1 . 2]" 1
2160 1 88 TYR HA 1 89 LYS HG3 . . 5.060 4.268 3.870 4.581 . 0 0 "[ . 1 . 2]" 1
2161 1 88 TYR HB2 1 89 LYS H . . 4.500 4.350 4.126 4.466 . 0 0 "[ . 1 . 2]" 1
2162 1 88 TYR HB2 1 90 PHE QE . . 4.560 2.779 2.425 3.199 . 0 0 "[ . 1 . 2]" 1
2163 1 88 TYR HB2 1 90 PHE HZ . . 4.380 3.073 2.744 3.568 . 0 0 "[ . 1 . 2]" 1
2164 1 88 TYR HB2 1 109 VAL H . . 4.670 3.866 3.724 3.926 . 0 0 "[ . 1 . 2]" 1
2165 1 88 TYR HB2 1 109 VAL MG2 . . 4.160 2.860 2.673 3.021 . 0 0 "[ . 1 . 2]" 1
2166 1 88 TYR HB2 1 111 THR MG . . 4.690 4.039 3.699 4.330 . 0 0 "[ . 1 . 2]" 1
2167 1 88 TYR HB3 1 89 LYS H . . 3.580 3.427 3.025 3.642 0.062 14 0 "[ . 1 . 2]" 1
2168 1 88 TYR HB3 1 90 PHE QE . . 4.250 2.754 2.571 2.863 . 0 0 "[ . 1 . 2]" 1
2169 1 88 TYR HB3 1 90 PHE HZ . . 4.310 2.209 2.136 2.569 . 0 0 "[ . 1 . 2]" 1
2170 1 88 TYR HB3 1 108 SER HA . . 5.500 5.526 5.506 5.559 0.059 7 0 "[ . 1 . 2]" 1
2171 1 88 TYR QD 1 89 LYS H . . 4.040 4.017 3.942 4.083 0.043 12 0 "[ . 1 . 2]" 1
2172 1 88 TYR QD 1 109 VAL H . . 5.460 5.196 4.970 5.346 . 0 0 "[ . 1 . 2]" 1
2173 1 88 TYR QD 1 110 ALA HA . . 4.390 3.876 3.589 4.171 . 0 0 "[ . 1 . 2]" 1
2174 1 88 TYR QD 1 111 THR H . . 3.850 3.545 3.097 3.737 . 0 0 "[ . 1 . 2]" 1
2175 1 88 TYR QD 1 111 THR MG . . 3.530 2.689 2.166 3.140 . 0 0 "[ . 1 . 2]" 1
2176 1 88 TYR QE 1 111 THR H . . 4.550 4.370 4.044 4.569 0.019 5 0 "[ . 1 . 2]" 1
2177 1 88 TYR QE 1 111 THR MG . . 3.390 2.748 2.151 3.194 . 0 0 "[ . 1 . 2]" 1
2178 1 89 LYS H 1 89 LYS HB2 . . 3.360 2.337 2.229 2.477 . 0 0 "[ . 1 . 2]" 1
2179 1 89 LYS H 1 89 LYS HB3 . . 4.150 3.590 3.512 3.679 . 0 0 "[ . 1 . 2]" 1
2180 1 89 LYS H 1 89 LYS QD . . 4.510 3.803 3.499 4.388 . 0 0 "[ . 1 . 2]" 1
2181 1 89 LYS H 1 89 LYS QE . . 5.340 4.324 2.775 4.876 . 0 0 "[ . 1 . 2]" 1
2182 1 89 LYS H 1 89 LYS HG2 . . 4.200 4.210 4.120 4.269 0.069 12 0 "[ . 1 . 2]" 1
2183 1 89 LYS H 1 89 LYS HG3 . . 3.680 2.993 2.910 3.114 . 0 0 "[ . 1 . 2]" 1
2184 1 89 LYS H 1 90 PHE H . . 4.560 4.522 4.456 4.576 0.016 3 0 "[ . 1 . 2]" 1
2185 1 89 LYS H 1 106 VAL QG . . 4.850 4.634 4.491 4.851 0.001 6 0 "[ . 1 . 2]" 1
2186 1 89 LYS H 1 108 SER HA . . 5.070 4.157 3.867 4.431 . 0 0 "[ . 1 . 2]" 1
2187 1 89 LYS HA 1 89 LYS HD2 . . 4.930 4.497 4.430 4.561 . 0 0 "[ . 1 . 2]" 1
2188 1 89 LYS HA 1 89 LYS QD . . 4.290 4.050 3.997 4.134 . 0 0 "[ . 1 . 2]" 1
2189 1 89 LYS HA 1 89 LYS HD3 . . 4.930 4.601 4.473 4.775 . 0 0 "[ . 1 . 2]" 1
2190 1 89 LYS HA 1 89 LYS QE . . 4.810 4.512 4.029 4.762 . 0 0 "[ . 1 . 2]" 1
2191 1 89 LYS HA 1 89 LYS HG2 . . 4.170 2.709 2.543 2.841 . 0 0 "[ . 1 . 2]" 1
2192 1 89 LYS HA 1 89 LYS HG3 . . 3.660 2.638 2.538 2.713 . 0 0 "[ . 1 . 2]" 1
2193 1 89 LYS HA 1 90 PHE H . . 2.880 2.187 2.164 2.241 . 0 0 "[ . 1 . 2]" 1
2194 1 89 LYS HA 1 106 VAL QG . . 3.700 3.103 2.961 3.229 . 0 0 "[ . 1 . 2]" 1
2195 1 89 LYS HA 1 107 VAL H . . 4.610 3.942 3.732 4.184 . 0 0 "[ . 1 . 2]" 1
2196 1 89 LYS HA 1 108 SER H . . 4.900 4.136 3.983 4.363 . 0 0 "[ . 1 . 2]" 1
2197 1 89 LYS HA 1 108 SER HA . . 3.460 2.091 1.984 2.304 . 0 0 "[ . 1 . 2]" 1
2198 1 89 LYS HA 1 108 SER HB2 . . 4.280 3.904 3.670 4.160 . 0 0 "[ . 1 . 2]" 1
2199 1 89 LYS HA 1 108 SER HB3 . . 4.480 3.766 3.617 3.896 . 0 0 "[ . 1 . 2]" 1
2200 1 89 LYS HA 1 109 VAL H . . 3.800 3.521 3.352 3.711 . 0 0 "[ . 1 . 2]" 1
2201 1 89 LYS HB2 1 90 PHE H . . 4.800 4.210 4.108 4.328 . 0 0 "[ . 1 . 2]" 1
2202 1 89 LYS HB2 1 106 VAL QG . . 3.650 3.181 3.121 3.303 . 0 0 "[ . 1 . 2]" 1
2203 1 89 LYS HB3 1 89 LYS QE . . 5.060 4.042 3.271 4.287 . 0 0 "[ . 1 . 2]" 1
2204 1 89 LYS HB3 1 90 PHE H . . 3.720 3.121 2.910 3.271 . 0 0 "[ . 1 . 2]" 1
2205 1 89 LYS HB3 1 106 VAL HA . . 5.040 4.578 4.337 4.793 . 0 0 "[ . 1 . 2]" 1
2206 1 89 LYS HB3 1 106 VAL HB . . 5.020 4.407 4.035 4.794 . 0 0 "[ . 1 . 2]" 1
2207 1 89 LYS HB3 1 106 VAL QG . . 2.920 1.865 1.822 1.962 . 0 0 "[ . 1 . 2]" 1
2208 1 89 LYS HB3 1 107 VAL H . . 4.840 4.130 3.784 4.539 . 0 0 "[ . 1 . 2]" 1
2209 1 89 LYS HB3 1 108 SER HA . . 4.370 4.183 4.084 4.301 . 0 0 "[ . 1 . 2]" 1
2210 1 89 LYS HB3 1 108 SER HB2 . . 5.500 5.136 4.835 5.518 0.018 9 0 "[ . 1 . 2]" 1
2211 1 89 LYS QD 1 106 VAL HB . . 5.340 4.602 3.927 5.128 . 0 0 "[ . 1 . 2]" 1
2212 1 89 LYS QD 1 106 VAL QG . . 3.060 2.462 1.937 2.917 . 0 0 "[ . 1 . 2]" 1
2213 1 89 LYS QD 1 108 SER HB2 . . 5.340 4.185 3.472 4.856 . 0 0 "[ . 1 . 2]" 1
2214 1 89 LYS QD 1 108 SER HB3 . . 4.600 3.648 2.652 4.131 . 0 0 "[ . 1 . 2]" 1
2215 1 89 LYS QE 1 89 LYS HG3 . . 3.120 2.293 2.117 2.497 . 0 0 "[ . 1 . 2]" 1
2216 1 89 LYS QE 1 106 VAL QG . . 4.160 3.688 2.957 4.174 0.014 12 0 "[ . 1 . 2]" 1
2217 1 89 LYS QE 1 108 SER HA . . 4.490 4.341 4.041 4.509 0.019 12 0 "[ . 1 . 2]" 1
2218 1 89 LYS QE 1 108 SER HB2 . . 3.890 3.074 2.423 3.848 . 0 0 "[ . 1 . 2]" 1
2219 1 89 LYS QE 1 108 SER HB3 . . 4.280 2.942 2.209 4.296 0.016 3 0 "[ . 1 . 2]" 1
2220 1 89 LYS HG2 1 90 PHE H . . 5.500 4.070 3.758 4.362 . 0 0 "[ . 1 . 2]" 1
2221 1 89 LYS HG2 1 106 VAL QG . . 3.870 2.173 1.940 2.556 . 0 0 "[ . 1 . 2]" 1
2222 1 89 LYS HG2 1 107 VAL H . . 5.190 4.514 3.930 4.909 . 0 0 "[ . 1 . 2]" 1
2223 1 89 LYS HG3 1 90 PHE H . . 4.720 4.637 4.480 4.738 0.018 6 0 "[ . 1 . 2]" 1
2224 1 89 LYS HG3 1 108 SER HA . . 3.710 2.768 2.452 3.089 . 0 0 "[ . 1 . 2]" 1
2225 1 89 LYS HG3 1 108 SER HB2 . . 3.700 2.535 2.080 3.185 . 0 0 "[ . 1 . 2]" 1
2226 1 89 LYS HG3 1 108 SER HB3 . . 3.750 2.647 2.199 3.086 . 0 0 "[ . 1 . 2]" 1
2227 1 89 LYS HG3 1 109 VAL H . . 4.530 4.294 4.081 4.454 . 0 0 "[ . 1 . 2]" 1
2228 1 90 PHE H 1 90 PHE HB2 . . 3.790 2.827 2.748 2.916 . 0 0 "[ . 1 . 2]" 1
2229 1 90 PHE H 1 90 PHE HB3 . . 4.090 3.878 3.832 3.923 . 0 0 "[ . 1 . 2]" 1
2230 1 90 PHE H 1 90 PHE QD . . 3.860 3.460 3.150 3.666 . 0 0 "[ . 1 . 2]" 1
2231 1 90 PHE H 1 91 ARG H . . 4.550 4.341 4.258 4.444 . 0 0 "[ . 1 . 2]" 1
2232 1 90 PHE H 1 91 ARG HA . . 5.460 4.751 4.685 4.857 . 0 0 "[ . 1 . 2]" 1
2233 1 90 PHE H 1 106 VAL HA . . 4.250 4.024 3.852 4.224 . 0 0 "[ . 1 . 2]" 1
2234 1 90 PHE H 1 106 VAL QG . . 3.570 2.746 2.412 3.113 . 0 0 "[ . 1 . 2]" 1
2235 1 90 PHE H 1 107 VAL H . . 3.540 2.466 2.222 2.659 . 0 0 "[ . 1 . 2]" 1
2236 1 90 PHE H 1 107 VAL HA . . 5.500 4.585 4.399 4.806 . 0 0 "[ . 1 . 2]" 1
2237 1 90 PHE H 1 107 VAL HB . . 5.000 4.691 4.442 4.934 . 0 0 "[ . 1 . 2]" 1
2238 1 90 PHE H 1 107 VAL MG1 . . 5.350 4.757 4.448 4.958 . 0 0 "[ . 1 . 2]" 1
2239 1 90 PHE H 1 107 VAL MG2 . . 4.010 2.422 2.016 2.747 . 0 0 "[ . 1 . 2]" 1
2240 1 90 PHE H 1 108 SER H . . 5.140 4.729 4.526 4.925 . 0 0 "[ . 1 . 2]" 1
2241 1 90 PHE H 1 108 SER HA . . 3.880 3.735 3.522 3.894 0.014 6 0 "[ . 1 . 2]" 1
2242 1 90 PHE H 1 108 SER HB3 . . 5.500 5.284 5.052 5.419 . 0 0 "[ . 1 . 2]" 1
2243 1 90 PHE H 1 109 VAL H . . 5.180 4.982 4.813 5.187 0.007 4 0 "[ . 1 . 2]" 1
2244 1 90 PHE H 1 109 VAL MG1 . . 5.500 5.233 4.882 5.482 . 0 0 "[ . 1 . 2]" 1
2245 1 90 PHE HA 1 90 PHE QD . . 3.740 2.492 2.233 2.711 . 0 0 "[ . 1 . 2]" 1
2246 1 90 PHE HA 1 90 PHE QE . . 4.870 4.553 4.449 4.673 . 0 0 "[ . 1 . 2]" 1
2247 1 90 PHE HA 1 91 ARG H . . 2.980 2.209 2.156 2.291 . 0 0 "[ . 1 . 2]" 1
2248 1 90 PHE HB2 1 91 ARG H . . 4.230 3.963 3.776 4.177 . 0 0 "[ . 1 . 2]" 1
2249 1 90 PHE HB2 1 107 VAL H . . 4.700 4.070 3.762 4.364 . 0 0 "[ . 1 . 2]" 1
2250 1 90 PHE HB2 1 107 VAL MG2 . . 3.580 2.452 2.193 2.701 . 0 0 "[ . 1 . 2]" 1
2251 1 90 PHE HB3 1 91 ARG H . . 3.560 3.018 2.729 3.261 . 0 0 "[ . 1 . 2]" 1
2252 1 90 PHE HB3 1 107 VAL MG2 . . 3.970 3.764 3.515 3.988 0.018 20 0 "[ . 1 . 2]" 1
2253 1 90 PHE QD 1 91 ARG H . . 4.200 3.975 3.854 4.142 . 0 0 "[ . 1 . 2]" 1
2254 1 90 PHE QD 1 107 VAL MG2 . . 3.670 3.119 2.909 3.594 . 0 0 "[ . 1 . 2]" 1
2255 1 90 PHE QD 1 109 VAL MG1 . . 4.190 4.043 3.818 4.171 . 0 0 "[ . 1 . 2]" 1
2256 1 90 PHE QD 1 109 VAL MG2 . . 3.530 2.872 2.603 3.105 . 0 0 "[ . 1 . 2]" 1
2257 1 90 PHE QE 1 109 VAL MG1 . . 4.610 4.588 4.434 4.634 0.024 18 0 "[ . 1 . 2]" 1
2258 1 90 PHE QE 1 109 VAL MG2 . . 3.380 2.524 2.384 2.651 . 0 0 "[ . 1 . 2]" 1
2259 1 90 PHE HZ 1 109 VAL MG2 . . 4.480 4.322 4.074 4.502 0.022 7 0 "[ . 1 . 2]" 1
2260 1 91 ARG H 1 91 ARG QB . . 3.700 2.913 2.582 3.088 . 0 0 "[ . 1 . 2]" 1
2261 1 91 ARG H 1 91 ARG HD2 . . 5.090 4.219 3.806 4.898 . 0 0 "[ . 1 . 2]" 1
2262 1 91 ARG H 1 91 ARG QD . . 4.410 3.813 3.524 4.278 . 0 0 "[ . 1 . 2]" 1
2263 1 91 ARG H 1 91 ARG HD3 . . 5.090 4.399 3.839 5.138 0.048 9 0 "[ . 1 . 2]" 1
2264 1 91 ARG H 1 91 ARG HG2 . . 3.790 2.196 1.864 3.062 . 0 0 "[ . 1 . 2]" 1
2265 1 91 ARG H 1 91 ARG HG3 . . 3.790 3.223 2.376 3.893 0.103 18 0 "[ . 1 . 2]" 1
2266 1 91 ARG H 1 92 LEU H . . 4.850 4.398 4.309 4.484 . 0 0 "[ . 1 . 2]" 1
2267 1 91 ARG HA 1 92 LEU H . . 3.260 2.190 2.151 2.516 . 0 0 "[ . 1 . 2]" 1
2268 1 91 ARG HA 1 92 LEU HB2 . . 5.160 4.663 4.455 4.773 . 0 0 "[ . 1 . 2]" 1
2269 1 91 ARG HA 1 92 LEU HB3 . . 5.500 4.386 4.311 4.439 . 0 0 "[ . 1 . 2]" 1
2270 1 91 ARG HA 1 104 SER H . . 5.130 4.754 4.428 5.140 0.010 9 0 "[ . 1 . 2]" 1
2271 1 91 ARG QB 1 92 LEU H . . 4.110 3.062 2.457 3.229 . 0 0 "[ . 1 . 2]" 1
2272 1 91 ARG QB 1 103 TYR QD . . 4.230 3.121 2.338 3.887 . 0 0 "[ . 1 . 2]" 1
2273 1 91 ARG QB 1 104 SER H . . 3.980 3.749 3.445 3.937 . 0 0 "[ . 1 . 2]" 1
2274 1 91 ARG QB 1 106 VAL H . . 5.100 3.981 3.711 4.263 . 0 0 "[ . 1 . 2]" 1
2275 1 91 ARG QB 1 106 VAL HA . . 4.420 3.031 2.815 3.553 . 0 0 "[ . 1 . 2]" 1
2276 1 91 ARG QB 1 106 VAL QG . . 4.330 2.865 2.104 4.323 . 0 0 "[ . 1 . 2]" 1
2277 1 91 ARG HB2 1 91 ARG HE . . 4.900 3.235 2.270 4.620 . 0 0 "[ . 1 . 2]" 1
2278 1 91 ARG HB2 1 92 LEU H . . 4.950 3.186 2.486 3.472 . 0 0 "[ . 1 . 2]" 1
2279 1 91 ARG HB2 1 103 TYR QD . . 4.860 3.190 2.364 4.103 . 0 0 "[ . 1 . 2]" 1
2280 1 91 ARG HB3 1 91 ARG HE . . 4.900 3.733 2.496 4.924 0.024 19 0 "[ . 1 . 2]" 1
2281 1 91 ARG HB3 1 92 LEU H . . 4.950 4.089 3.033 4.352 . 0 0 "[ . 1 . 2]" 1
2282 1 91 ARG HB3 1 103 TYR QD . . 4.860 4.536 2.821 4.941 0.081 18 0 "[ . 1 . 2]" 1
2283 1 91 ARG QD 1 103 TYR QE . . 4.830 3.612 2.217 4.285 . 0 0 "[ . 1 . 2]" 1
2284 1 91 ARG QD 1 106 VAL QG . . 4.940 3.639 2.769 4.972 0.032 9 0 "[ . 1 . 2]" 1
2285 1 91 ARG HD2 1 103 TYR QD . . 5.060 4.154 1.995 5.054 . 0 0 "[ . 1 . 2]" 1
2286 1 91 ARG HD3 1 103 TYR QD . . 5.060 4.148 1.995 4.968 . 0 0 "[ . 1 . 2]" 1
2287 1 91 ARG HE 1 91 ARG HG2 . . 4.020 3.545 2.341 3.966 . 0 0 "[ . 1 . 2]" 1
2288 1 91 ARG HE 1 91 ARG HG3 . . 4.020 2.764 2.209 3.879 . 0 0 "[ . 1 . 2]" 1
2289 1 91 ARG HE 1 103 TYR QD . . 4.600 2.595 1.896 4.578 . 0 0 "[ . 1 . 2]" 1
2290 1 91 ARG HE 1 103 TYR QE . . 4.080 2.862 1.897 4.204 0.124 9 0 "[ . 1 . 2]" 1
2291 1 91 ARG QG 1 92 LEU H . . 4.450 4.034 2.532 4.458 0.008 3 0 "[ . 1 . 2]" 1
2292 1 91 ARG QG 1 103 TYR QD . . 4.020 3.312 2.380 4.085 0.065 3 0 "[ . 1 . 2]" 1
2293 1 91 ARG HG2 1 92 LEU H . . 5.150 4.864 3.804 5.194 0.044 12 0 "[ . 1 . 2]" 1
2294 1 91 ARG HG3 1 92 LEU H . . 5.150 4.339 2.571 5.192 0.042 3 0 "[ . 1 . 2]" 1
2295 1 92 LEU H 1 92 LEU HB2 . . 3.960 2.998 2.899 3.321 . 0 0 "[ . 1 . 2]" 1
2296 1 92 LEU H 1 92 LEU HB3 . . 3.830 2.336 2.268 2.616 . 0 0 "[ . 1 . 2]" 1
2297 1 92 LEU H 1 92 LEU MD1 . . 4.760 4.250 4.195 4.307 . 0 0 "[ . 1 . 2]" 1
2298 1 92 LEU H 1 92 LEU QD . . 4.050 3.802 3.760 3.941 . 0 0 "[ . 1 . 2]" 1
2299 1 92 LEU H 1 92 LEU MD2 . . 4.760 4.288 4.183 4.576 . 0 0 "[ . 1 . 2]" 1
2300 1 92 LEU H 1 93 LYS H . . 4.730 4.435 4.027 4.513 . 0 0 "[ . 1 . 2]" 1
2301 1 92 LEU H 1 104 SER H . . 3.980 3.343 2.847 3.654 . 0 0 "[ . 1 . 2]" 1
2302 1 92 LEU H 1 104 SER HB3 . . 4.150 3.069 2.735 3.293 . 0 0 "[ . 1 . 2]" 1
2303 1 92 LEU H 1 104 SER HG . . 3.630 2.613 2.384 3.023 . 0 0 "[ . 1 . 2]" 1
2304 1 92 LEU H 1 107 VAL MG2 . . 5.250 4.459 4.125 4.897 . 0 0 "[ . 1 . 2]" 1
2305 1 92 LEU HA 1 92 LEU QD . . 4.240 2.128 1.973 2.288 . 0 0 "[ . 1 . 2]" 1
2306 1 92 LEU HA 1 93 LYS H . . 3.020 2.152 2.139 2.164 . 0 0 "[ . 1 . 2]" 1
2307 1 92 LEU HB2 1 92 LEU MD1 . . 3.410 2.382 2.294 2.490 . 0 0 "[ . 1 . 2]" 1
2308 1 92 LEU HB2 1 92 LEU QD . . 2.980 2.099 2.032 2.159 . 0 0 "[ . 1 . 2]" 1
2309 1 92 LEU HB2 1 92 LEU MD2 . . 3.410 2.338 2.215 2.443 . 0 0 "[ . 1 . 2]" 1
2310 1 92 LEU HB2 1 93 LYS H . . 4.590 4.110 3.976 4.326 . 0 0 "[ . 1 . 2]" 1
2311 1 92 LEU HB2 1 104 SER HB2 . . 4.780 4.709 4.577 4.822 0.042 9 0 "[ . 1 . 2]" 1
2312 1 92 LEU HB2 1 104 SER HB3 . . 4.190 3.898 3.728 4.091 . 0 0 "[ . 1 . 2]" 1
2313 1 92 LEU HB2 1 107 VAL MG2 . . 5.020 4.881 4.619 5.031 0.011 9 0 "[ . 1 . 2]" 1
2314 1 92 LEU HB3 1 92 LEU MD1 . . 3.290 3.185 3.177 3.196 . 0 0 "[ . 1 . 2]" 1
2315 1 92 LEU HB3 1 92 LEU MD2 . . 3.290 2.320 2.193 2.457 . 0 0 "[ . 1 . 2]" 1
2316 1 92 LEU HB3 1 93 LYS H . . 4.350 4.322 4.263 4.460 0.110 9 0 "[ . 1 . 2]" 1
2317 1 92 LEU HB3 1 104 SER H . . 4.900 3.891 3.573 4.094 . 0 0 "[ . 1 . 2]" 1
2318 1 92 LEU HB3 1 104 SER HB3 . . 4.330 2.171 1.991 2.394 . 0 0 "[ . 1 . 2]" 1
2319 1 92 LEU QD 1 93 LYS H . . 3.330 2.189 1.867 2.617 . 0 0 "[ . 1 . 2]" 1
2320 1 92 LEU QD 1 93 LYS HA . . 5.440 3.831 3.686 3.984 . 0 0 "[ . 1 . 2]" 1
2321 1 92 LEU QD 1 104 SER HA . . 5.440 5.090 4.925 5.421 . 0 0 "[ . 1 . 2]" 1
2322 1 92 LEU QD 1 104 SER HB3 . . 4.020 3.220 3.063 3.546 . 0 0 "[ . 1 . 2]" 1
2323 1 92 LEU MD1 1 94 VAL MG1 . . 3.270 2.592 2.337 2.802 . 0 0 "[ . 1 . 2]" 1
2324 1 92 LEU MD2 1 94 VAL MG1 . . 3.270 3.136 2.964 3.308 0.038 9 0 "[ . 1 . 2]" 1
2325 1 92 LEU HG 1 93 LYS H . . 4.040 3.479 3.250 3.973 . 0 0 "[ . 1 . 2]" 1
2326 1 93 LYS H 1 93 LYS HB2 . . 3.910 2.886 2.553 3.381 . 0 0 "[ . 1 . 2]" 1
2327 1 93 LYS H 1 93 LYS HB3 . . 3.800 2.687 2.417 2.891 . 0 0 "[ . 1 . 2]" 1
2328 1 93 LYS H 1 93 LYS QG . . 4.730 4.069 3.736 4.186 . 0 0 "[ . 1 . 2]" 1
2329 1 93 LYS H 1 94 VAL H . . 4.520 4.497 4.469 4.533 0.013 13 0 "[ . 1 . 2]" 1
2330 1 93 LYS H 1 94 VAL MG1 . . 5.300 3.991 3.852 4.232 . 0 0 "[ . 1 . 2]" 1
2331 1 93 LYS H 1 103 TYR QD . . 5.500 5.152 4.882 5.469 . 0 0 "[ . 1 . 2]" 1
2332 1 93 LYS H 1 103 TYR QE . . 5.500 5.460 4.865 5.590 0.090 9 0 "[ . 1 . 2]" 1
2333 1 93 LYS HA 1 94 VAL H . . 3.010 2.265 2.207 2.329 . 0 0 "[ . 1 . 2]" 1
2334 1 93 LYS HA 1 102 GLU H . . 4.900 4.722 4.370 4.908 0.008 18 0 "[ . 1 . 2]" 1
2335 1 93 LYS HA 1 103 TYR H . . 5.370 4.983 4.773 5.210 . 0 0 "[ . 1 . 2]" 1
2336 1 93 LYS HA 1 103 TYR HA . . 3.700 2.396 2.197 2.608 . 0 0 "[ . 1 . 2]" 1
2337 1 93 LYS HA 1 103 TYR QD . . 4.180 3.843 3.615 4.199 0.019 20 0 "[ . 1 . 2]" 1
2338 1 93 LYS HA 1 104 SER H . . 4.280 3.316 3.157 3.511 . 0 0 "[ . 1 . 2]" 1
2339 1 93 LYS HB2 1 94 VAL H . . 4.230 4.050 3.720 4.194 . 0 0 "[ . 1 . 2]" 1
2340 1 93 LYS HB2 1 103 TYR QD . . 4.100 3.243 2.778 3.617 . 0 0 "[ . 1 . 2]" 1
2341 1 93 LYS HB2 1 103 TYR QE . . 3.630 2.963 2.677 3.252 . 0 0 "[ . 1 . 2]" 1
2342 1 93 LYS HB3 1 94 VAL H . . 4.170 3.772 3.429 4.190 0.020 6 0 "[ . 1 . 2]" 1
2343 1 93 LYS HB3 1 103 TYR QD . . 5.030 4.800 4.478 4.994 . 0 0 "[ . 1 . 2]" 1
2344 1 93 LYS HB3 1 103 TYR QE . . 4.320 4.221 4.001 4.413 0.093 18 0 "[ . 1 . 2]" 1
2345 1 93 LYS QD 1 94 VAL H . . 4.600 3.835 1.813 4.434 . 0 0 "[ . 1 . 2]" 1
2346 1 93 LYS QD 1 101 TYR QD . . 5.170 4.246 2.098 4.782 . 0 0 "[ . 1 . 2]" 1
2347 1 93 LYS QD 1 103 TYR QE . . 3.520 2.907 1.823 3.678 0.158 20 0 "[ . 1 . 2]" 1
2348 1 93 LYS HE2 1 93 LYS HG2 . . 4.150 2.703 2.144 3.930 . 0 0 "[ . 1 . 2]" 1
2349 1 93 LYS HE2 1 93 LYS HG3 . . 4.150 3.394 2.522 3.839 . 0 0 "[ . 1 . 2]" 1
2350 1 93 LYS HE2 1 94 VAL H . . 4.900 4.142 3.278 4.598 . 0 0 "[ . 1 . 2]" 1
2351 1 93 LYS HE2 1 95 THR MG . . 4.390 4.047 3.588 4.300 . 0 0 "[ . 1 . 2]" 1
2352 1 93 LYS HE2 1 101 TYR HB2 . . 4.090 2.718 2.031 3.323 . 0 0 "[ . 1 . 2]" 1
2353 1 93 LYS HE2 1 101 TYR HB3 . . 4.100 3.675 3.068 4.107 0.007 3 0 "[ . 1 . 2]" 1
2354 1 93 LYS HE2 1 101 TYR QD . . 4.070 3.649 2.727 4.062 . 0 0 "[ . 1 . 2]" 1
2355 1 93 LYS HE2 1 102 GLU H . . 5.360 4.626 3.705 5.238 . 0 0 "[ . 1 . 2]" 1
2356 1 93 LYS HE2 1 103 TYR QE . . 5.090 4.502 3.823 4.921 . 0 0 "[ . 1 . 2]" 1
2357 1 93 LYS HE3 1 93 LYS HG2 . . 4.060 2.747 2.232 3.676 . 0 0 "[ . 1 . 2]" 1
2358 1 93 LYS HE3 1 93 LYS QG . . 3.570 2.413 2.156 3.251 . 0 0 "[ . 1 . 2]" 1
2359 1 93 LYS HE3 1 93 LYS HG3 . . 4.060 2.708 2.455 3.623 . 0 0 "[ . 1 . 2]" 1
2360 1 93 LYS HE3 1 95 THR MG . . 5.160 4.932 4.415 5.170 0.010 15 0 "[ . 1 . 2]" 1
2361 1 93 LYS HE3 1 101 TYR HB2 . . 4.190 2.828 2.003 3.288 . 0 0 "[ . 1 . 2]" 1
2362 1 93 LYS HE3 1 101 TYR HB3 . . 4.500 4.133 3.613 4.526 0.026 16 0 "[ . 1 . 2]" 1
2363 1 93 LYS HE3 1 101 TYR QD . . 3.720 2.588 2.153 2.944 . 0 0 "[ . 1 . 2]" 1
2364 1 93 LYS HE3 1 101 TYR QE . . 4.440 4.066 3.063 4.452 0.012 20 0 "[ . 1 . 2]" 1
2365 1 93 LYS HE3 1 102 GLU H . . 4.810 4.526 3.112 4.842 0.032 6 0 "[ . 1 . 2]" 1
2366 1 93 LYS HE3 1 103 TYR QE . . 3.880 3.064 2.246 3.504 . 0 0 "[ . 1 . 2]" 1
2367 1 93 LYS QG 1 94 VAL H . . 3.490 2.149 1.873 2.953 . 0 0 "[ . 1 . 2]" 1
2368 1 93 LYS QG 1 101 TYR HB2 . . 4.620 3.507 3.176 4.462 . 0 0 "[ . 1 . 2]" 1
2369 1 93 LYS QG 1 102 GLU H . . 4.490 3.687 3.191 4.516 0.026 13 0 "[ . 1 . 2]" 1
2370 1 93 LYS QG 1 103 TYR QD . . 4.550 3.097 2.710 4.135 . 0 0 "[ . 1 . 2]" 1
2371 1 93 LYS QG 1 103 TYR QE . . 3.800 2.809 2.330 3.830 0.030 6 0 "[ . 1 . 2]" 1
2372 1 93 LYS HG2 1 94 VAL H . . 3.980 2.255 1.882 3.731 . 0 0 "[ . 1 . 2]" 1
2373 1 93 LYS HG2 1 101 TYR QD . . 4.450 4.221 3.881 4.452 0.002 6 0 "[ . 1 . 2]" 1
2374 1 93 LYS HG2 1 103 TYR QE . . 4.360 4.063 2.856 4.395 0.035 6 0 "[ . 1 . 2]" 1
2375 1 93 LYS HG3 1 94 VAL H . . 3.980 3.323 2.156 4.142 0.162 16 0 "[ . 1 . 2]" 1
2376 1 93 LYS HG3 1 101 TYR QD . . 4.450 4.061 3.291 4.453 0.003 13 0 "[ . 1 . 2]" 1
2377 1 93 LYS HG3 1 103 TYR QE . . 4.360 2.882 2.452 4.216 . 0 0 "[ . 1 . 2]" 1
2378 1 94 VAL H 1 94 VAL HB . . 4.000 3.932 3.872 3.968 . 0 0 "[ . 1 . 2]" 1
2379 1 94 VAL H 1 94 VAL MG1 . . 3.220 2.683 2.500 2.781 . 0 0 "[ . 1 . 2]" 1
2380 1 94 VAL H 1 94 VAL MG2 . . 3.370 2.540 2.416 2.630 . 0 0 "[ . 1 . 2]" 1
2381 1 94 VAL H 1 101 TYR HA . . 4.770 4.588 4.498 4.701 . 0 0 "[ . 1 . 2]" 1
2382 1 94 VAL H 1 101 TYR HB2 . . 4.610 4.053 3.872 4.207 . 0 0 "[ . 1 . 2]" 1
2383 1 94 VAL H 1 101 TYR HB3 . . 5.500 5.496 5.401 5.536 0.036 7 0 "[ . 1 . 2]" 1
2384 1 94 VAL H 1 101 TYR QD . . 5.500 4.991 4.480 5.327 . 0 0 "[ . 1 . 2]" 1
2385 1 94 VAL H 1 102 GLU H . . 3.510 2.927 2.693 3.063 . 0 0 "[ . 1 . 2]" 1
2386 1 94 VAL H 1 102 GLU HB2 . . 4.840 4.415 4.134 4.651 . 0 0 "[ . 1 . 2]" 1
2387 1 94 VAL H 1 103 TYR HA . . 3.900 3.642 3.528 3.827 . 0 0 "[ . 1 . 2]" 1
2388 1 94 VAL H 1 103 TYR QD . . 5.240 4.947 4.539 5.127 . 0 0 "[ . 1 . 2]" 1
2389 1 94 VAL H 1 103 TYR QE . . 5.500 5.449 4.996 5.580 0.080 7 0 "[ . 1 . 2]" 1
2390 1 94 VAL H 1 104 SER H . . 5.430 5.138 4.913 5.247 . 0 0 "[ . 1 . 2]" 1
2391 1 94 VAL HA 1 94 VAL MG1 . . 3.350 2.519 2.466 2.581 . 0 0 "[ . 1 . 2]" 1
2392 1 94 VAL HA 1 94 VAL MG2 . . 3.250 3.165 3.151 3.184 . 0 0 "[ . 1 . 2]" 1
2393 1 94 VAL HA 1 95 THR H . . 3.030 2.231 2.193 2.298 . 0 0 "[ . 1 . 2]" 1
2394 1 94 VAL HB 1 95 THR H . . 3.470 2.944 2.779 3.093 . 0 0 "[ . 1 . 2]" 1
2395 1 94 VAL HB 1 95 THR HA . . 4.870 4.741 4.611 4.859 . 0 0 "[ . 1 . 2]" 1
2396 1 94 VAL HB 1 102 GLU H . . 5.220 4.993 4.782 5.236 0.016 17 0 "[ . 1 . 2]" 1
2397 1 94 VAL MG1 1 104 SER H . . 4.960 4.730 4.497 4.906 . 0 0 "[ . 1 . 2]" 1
2398 1 94 VAL MG2 1 95 THR H . . 3.400 3.326 3.060 3.436 0.036 18 0 "[ . 1 . 2]" 1
2399 1 94 VAL MG2 1 95 THR HA . . 4.840 3.333 3.210 3.450 . 0 0 "[ . 1 . 2]" 1
2400 1 94 VAL MG2 1 95 THR HB . . 5.500 5.244 5.080 5.339 . 0 0 "[ . 1 . 2]" 1
2401 1 94 VAL MG2 1 96 SER H . . 4.570 3.731 3.447 3.965 . 0 0 "[ . 1 . 2]" 1
2402 1 94 VAL MG2 1 101 TYR HA . . 4.770 3.125 2.997 3.293 . 0 0 "[ . 1 . 2]" 1
2403 1 94 VAL MG2 1 102 GLU H . . 3.750 2.480 2.305 2.849 . 0 0 "[ . 1 . 2]" 1
2404 1 94 VAL MG2 1 103 TYR HA . . 4.940 4.617 4.258 4.946 0.006 20 0 "[ . 1 . 2]" 1
2405 1 95 THR H 1 95 THR HB . . 3.440 2.794 2.658 2.863 . 0 0 "[ . 1 . 2]" 1
2406 1 95 THR H 1 95 THR MG . . 3.980 3.914 3.858 3.946 . 0 0 "[ . 1 . 2]" 1
2407 1 95 THR H 1 96 SER H . . 4.410 4.098 3.963 4.185 . 0 0 "[ . 1 . 2]" 1
2408 1 95 THR H 1 101 TYR HA . . 5.430 4.556 4.436 4.670 . 0 0 "[ . 1 . 2]" 1
2409 1 95 THR HA 1 95 THR MG . . 3.120 2.361 2.269 2.448 . 0 0 "[ . 1 . 2]" 1
2410 1 95 THR HA 1 96 SER H . . 2.900 2.148 2.141 2.169 . 0 0 "[ . 1 . 2]" 1
2411 1 95 THR HA 1 96 SER QB . . 4.260 4.173 4.137 4.355 0.095 17 0 "[ . 1 . 2]" 1
2412 1 95 THR HA 1 99 GLY H . . 5.500 5.534 5.495 5.571 0.071 9 0 "[ . 1 . 2]" 1
2413 1 95 THR HA 1 100 GLU HB3 . . 5.500 5.494 5.386 5.552 0.052 17 0 "[ . 1 . 2]" 1
2414 1 95 THR HA 1 101 TYR H . . 4.610 4.459 4.332 4.591 . 0 0 "[ . 1 . 2]" 1
2415 1 95 THR HA 1 101 TYR HA . . 3.590 2.088 1.990 2.253 . 0 0 "[ . 1 . 2]" 1
2416 1 95 THR HA 1 101 TYR HB2 . . 4.450 2.973 2.742 3.164 . 0 0 "[ . 1 . 2]" 1
2417 1 95 THR HA 1 101 TYR HB3 . . 4.240 2.411 2.081 2.657 . 0 0 "[ . 1 . 2]" 1
2418 1 95 THR HA 1 101 TYR QD . . 4.790 4.344 4.063 4.555 . 0 0 "[ . 1 . 2]" 1
2419 1 95 THR HA 1 102 GLU H . . 4.030 3.706 3.604 3.831 . 0 0 "[ . 1 . 2]" 1
2420 1 95 THR HB 1 96 SER H . . 4.470 4.313 4.229 4.407 . 0 0 "[ . 1 . 2]" 1
2421 1 95 THR MG 1 96 SER H . . 3.210 2.790 2.615 2.961 . 0 0 "[ . 1 . 2]" 1
2422 1 95 THR MG 1 96 SER QB . . 4.250 3.952 3.675 4.304 0.054 17 0 "[ . 1 . 2]" 1
2423 1 95 THR MG 1 99 GLY H . . 3.750 3.539 3.416 3.653 . 0 0 "[ . 1 . 2]" 1
2424 1 95 THR MG 1 99 GLY HA2 . . 3.600 3.195 3.083 3.286 . 0 0 "[ . 1 . 2]" 1
2425 1 95 THR MG 1 99 GLY HA3 . . 4.880 4.401 4.281 4.503 . 0 0 "[ . 1 . 2]" 1
2426 1 95 THR MG 1 100 GLU H . . 4.270 4.180 3.992 4.300 0.030 20 0 "[ . 1 . 2]" 1
2427 1 95 THR MG 1 100 GLU HA . . 4.750 4.419 4.251 4.573 . 0 0 "[ . 1 . 2]" 1
2428 1 95 THR MG 1 101 TYR H . . 4.690 4.459 4.323 4.628 . 0 0 "[ . 1 . 2]" 1
2429 1 95 THR MG 1 101 TYR HA . . 3.940 3.579 3.428 3.776 . 0 0 "[ . 1 . 2]" 1
2430 1 95 THR MG 1 101 TYR HB2 . . 3.960 3.433 3.201 3.838 . 0 0 "[ . 1 . 2]" 1
2431 1 95 THR MG 1 101 TYR HB3 . . 3.380 2.117 1.967 2.550 . 0 0 "[ . 1 . 2]" 1
2432 1 95 THR MG 1 101 TYR QD . . 3.990 3.074 2.694 3.784 . 0 0 "[ . 1 . 2]" 1
2433 1 95 THR MG 1 102 GLU H . . 5.290 5.129 4.989 5.310 0.020 10 0 "[ . 1 . 2]" 1
2434 1 96 SER H 1 96 SER HB2 . . 3.590 2.731 2.179 3.584 . 0 0 "[ . 1 . 2]" 1
2435 1 96 SER H 1 96 SER QB . . 3.060 2.192 2.159 2.380 . 0 0 "[ . 1 . 2]" 1
2436 1 96 SER H 1 96 SER HB3 . . 3.590 2.995 2.182 3.550 . 0 0 "[ . 1 . 2]" 1
2437 1 96 SER H 1 99 GLY H . . 4.470 4.199 4.035 4.422 . 0 0 "[ . 1 . 2]" 1
2438 1 96 SER H 1 100 GLU H . . 4.350 4.316 4.221 4.395 0.045 16 0 "[ . 1 . 2]" 1
2439 1 96 SER H 1 100 GLU HB2 . . 4.380 3.581 3.336 3.951 . 0 0 "[ . 1 . 2]" 1
2440 1 96 SER H 1 100 GLU HB3 . . 4.740 4.435 4.324 4.630 . 0 0 "[ . 1 . 2]" 1
2441 1 96 SER H 1 101 TYR HA . . 3.840 2.948 2.672 3.173 . 0 0 "[ . 1 . 2]" 1
2442 1 96 SER H 1 101 TYR HB2 . . 5.060 4.802 4.550 4.983 . 0 0 "[ . 1 . 2]" 1
2443 1 96 SER H 1 101 TYR HB3 . . 4.220 3.894 3.655 4.087 . 0 0 "[ . 1 . 2]" 1
2444 1 96 SER H 1 102 GLU H . . 5.410 4.938 4.671 5.173 . 0 0 "[ . 1 . 2]" 1
2445 1 96 SER HA 1 97 PRO HD2 . . 3.450 2.458 2.391 2.519 . 0 0 "[ . 1 . 2]" 1
2446 1 96 SER HA 1 97 PRO HG3 . . 4.560 4.507 4.465 4.547 . 0 0 "[ . 1 . 2]" 1
2447 1 96 SER QB 1 97 PRO HD2 . . 3.460 2.039 1.951 2.257 . 0 0 "[ . 1 . 2]" 1
2448 1 96 SER QB 1 97 PRO HD3 . . 4.220 3.370 3.252 3.569 . 0 0 "[ . 1 . 2]" 1
2449 1 96 SER QB 1 97 PRO HG2 . . 3.940 3.772 3.617 3.946 0.006 14 0 "[ . 1 . 2]" 1
2450 1 96 SER QB 1 99 GLY H . . 4.060 3.198 2.762 3.851 . 0 0 "[ . 1 . 2]" 1
2451 1 96 SER QB 1 100 GLU H . . 3.740 3.243 2.730 3.762 0.022 19 0 "[ . 1 . 2]" 1
2452 1 96 SER QB 1 100 GLU HB2 . . 3.610 2.307 2.063 2.881 . 0 0 "[ . 1 . 2]" 1
2453 1 96 SER QB 1 100 GLU HB3 . . 3.890 3.706 3.502 3.924 0.034 17 0 "[ . 1 . 2]" 1
2454 1 96 SER QB 1 100 GLU QG . . 4.380 3.928 3.568 4.387 0.007 6 0 "[ . 1 . 2]" 1
2455 1 96 SER HB2 1 100 GLU HB2 . . 4.210 2.784 2.078 3.989 . 0 0 "[ . 1 . 2]" 1
2456 1 96 SER HB3 1 100 GLU HB2 . . 4.210 3.169 2.320 3.827 . 0 0 "[ . 1 . 2]" 1
2457 1 97 PRO HA 1 99 GLY H . . 4.570 4.414 4.249 4.566 . 0 0 "[ . 1 . 2]" 1
2458 1 97 PRO HG2 1 99 GLY H . . 5.500 5.427 5.379 5.519 0.019 17 0 "[ . 1 . 2]" 1
2459 1 98 SER HA 1 98 SER QB . . 2.600 2.406 2.292 2.486 . 0 0 "[ . 1 . 2]" 1
2460 1 98 SER HA 1 100 GLU H . . 5.270 5.028 4.876 5.142 . 0 0 "[ . 1 . 2]" 1
2461 1 98 SER QB 1 99 GLY H . . 3.850 2.787 2.675 2.916 . 0 0 "[ . 1 . 2]" 1
2462 1 98 SER QB 1 100 GLU H . . 3.510 3.046 2.828 3.205 . 0 0 "[ . 1 . 2]" 1
2463 1 99 GLY H 1 100 GLU H . . 3.110 2.258 2.147 2.348 . 0 0 "[ . 1 . 2]" 1
2464 1 99 GLY H 1 100 GLU HB2 . . 4.560 4.077 3.987 4.206 . 0 0 "[ . 1 . 2]" 1
2465 1 99 GLY H 1 100 GLU HB3 . . 5.500 5.482 5.425 5.546 0.046 17 0 "[ . 1 . 2]" 1
2466 1 99 GLY H 1 100 GLU QG . . 4.620 4.311 3.968 4.649 0.029 5 0 "[ . 1 . 2]" 1
2467 1 100 GLU H 1 100 GLU HB2 . . 3.150 2.513 2.329 2.646 . 0 0 "[ . 1 . 2]" 1
2468 1 100 GLU H 1 100 GLU HB3 . . 3.620 3.587 3.569 3.594 . 0 0 "[ . 1 . 2]" 1
2469 1 100 GLU H 1 100 GLU QG . . 3.140 2.291 1.933 2.685 . 0 0 "[ . 1 . 2]" 1
2470 1 100 GLU HA 1 100 GLU QG . . 2.990 2.623 2.402 2.942 . 0 0 "[ . 1 . 2]" 1
2471 1 100 GLU HA 1 101 TYR H . . 2.610 2.300 2.243 2.372 . 0 0 "[ . 1 . 2]" 1
2472 1 100 GLU HA 1 101 TYR HA . . 4.780 4.495 4.473 4.516 . 0 0 "[ . 1 . 2]" 1
2473 1 100 GLU HA 1 101 TYR HB3 . . 5.500 4.398 4.236 4.472 . 0 0 "[ . 1 . 2]" 1
2474 1 100 GLU HA 1 101 TYR QD . . 3.890 3.244 2.947 3.536 . 0 0 "[ . 1 . 2]" 1
2475 1 100 GLU HA 1 101 TYR QE . . 4.960 4.561 4.289 4.784 . 0 0 "[ . 1 . 2]" 1
2476 1 100 GLU HB2 1 101 TYR H . . 3.950 3.827 3.698 3.974 0.024 7 0 "[ . 1 . 2]" 1
2477 1 100 GLU HB3 1 101 TYR H . . 3.200 2.691 2.504 2.856 . 0 0 "[ . 1 . 2]" 1
2478 1 100 GLU HB3 1 101 TYR HA . . 4.450 4.263 4.136 4.394 . 0 0 "[ . 1 . 2]" 1
2479 1 100 GLU QG 1 101 TYR H . . 4.640 4.148 3.856 4.373 . 0 0 "[ . 1 . 2]" 1
2480 1 101 TYR H 1 101 TYR HB2 . . 4.070 3.969 3.947 3.992 . 0 0 "[ . 1 . 2]" 1
2481 1 101 TYR H 1 101 TYR HB3 . . 3.940 3.420 3.312 3.480 . 0 0 "[ . 1 . 2]" 1
2482 1 101 TYR H 1 101 TYR QD . . 3.320 3.031 2.493 3.281 . 0 0 "[ . 1 . 2]" 1
2483 1 101 TYR H 1 101 TYR QE . . 4.570 4.426 4.260 4.536 . 0 0 "[ . 1 . 2]" 1
2484 1 101 TYR H 1 102 GLU H . . 4.600 4.322 4.244 4.386 . 0 0 "[ . 1 . 2]" 1
2485 1 101 TYR H 1 102 GLU HB2 . . 5.500 5.448 5.339 5.526 0.026 10 0 "[ . 1 . 2]" 1
2486 1 101 TYR H 1 102 GLU HG2 . . 4.910 4.098 3.849 4.408 . 0 0 "[ . 1 . 2]" 1
2487 1 101 TYR HA 1 101 TYR QD . . 3.930 3.737 3.723 3.742 . 0 0 "[ . 1 . 2]" 1
2488 1 101 TYR HA 1 102 GLU H . . 3.000 2.304 2.208 2.474 . 0 0 "[ . 1 . 2]" 1
2489 1 101 TYR HA 1 102 GLU HB2 . . 4.730 4.156 4.080 4.232 . 0 0 "[ . 1 . 2]" 1
2490 1 101 TYR HB2 1 102 GLU H . . 3.510 2.707 2.347 2.989 . 0 0 "[ . 1 . 2]" 1
2491 1 101 TYR HB3 1 102 GLU H . . 4.040 3.922 3.696 4.053 0.013 10 0 "[ . 1 . 2]" 1
2492 1 101 TYR QD 1 102 GLU H . . 3.830 3.608 3.121 3.859 0.029 5 0 "[ . 1 . 2]" 1
2493 1 101 TYR QD 1 102 GLU HA . . 4.030 3.552 3.322 3.698 . 0 0 "[ . 1 . 2]" 1
2494 1 101 TYR QD 1 103 TYR H . . 5.500 5.400 5.092 5.505 0.005 14 0 "[ . 1 . 2]" 1
2495 1 102 GLU H 1 102 GLU HB2 . . 3.780 2.667 2.500 2.876 . 0 0 "[ . 1 . 2]" 1
2496 1 102 GLU H 1 102 GLU HG2 . . 4.200 3.708 3.564 3.846 . 0 0 "[ . 1 . 2]" 1
2497 1 102 GLU H 1 102 GLU HG3 . . 4.860 4.652 4.417 4.902 0.042 6 0 "[ . 1 . 2]" 1
2498 1 102 GLU H 1 103 TYR H . . 4.540 4.383 4.356 4.431 . 0 0 "[ . 1 . 2]" 1
2499 1 102 GLU H 1 103 TYR HA . . 4.820 4.736 4.636 4.835 0.015 10 0 "[ . 1 . 2]" 1
2500 1 102 GLU HA 1 102 GLU HG2 . . 4.110 2.735 2.552 2.955 . 0 0 "[ . 1 . 2]" 1
2501 1 102 GLU HA 1 103 TYR H . . 3.330 2.600 2.385 2.656 . 0 0 "[ . 1 . 2]" 1
2502 1 102 GLU HA 1 103 TYR HA . . 4.840 4.492 4.401 4.534 . 0 0 "[ . 1 . 2]" 1
2503 1 102 GLU HA 1 103 TYR HB2 . . 4.680 4.271 4.190 4.370 . 0 0 "[ . 1 . 2]" 1
2504 1 102 GLU HA 1 103 TYR QD . . 4.750 3.292 2.808 3.710 . 0 0 "[ . 1 . 2]" 1
2505 1 102 GLU HB2 1 103 TYR H . . 4.260 3.526 3.388 3.855 . 0 0 "[ . 1 . 2]" 1
2506 1 102 GLU HB3 1 103 TYR H . . 3.490 2.044 1.934 2.502 . 0 0 "[ . 1 . 2]" 1
2507 1 102 GLU HB3 1 103 TYR HB2 . . 4.810 4.641 4.545 4.867 0.057 20 0 "[ . 1 . 2]" 1
2508 1 102 GLU HB3 1 103 TYR QD . . 5.500 4.864 4.450 5.307 . 0 0 "[ . 1 . 2]" 1
2509 1 102 GLU HG2 1 103 TYR H . . 4.580 4.381 4.244 4.584 0.004 6 0 "[ . 1 . 2]" 1
2510 1 103 TYR H 1 103 TYR HB2 . . 3.300 2.602 2.384 2.721 . 0 0 "[ . 1 . 2]" 1
2511 1 103 TYR H 1 103 TYR HB3 . . 3.780 3.698 3.527 3.799 0.019 16 0 "[ . 1 . 2]" 1
2512 1 103 TYR H 1 103 TYR QD . . 3.660 3.343 3.077 3.496 . 0 0 "[ . 1 . 2]" 1
2513 1 103 TYR H 1 103 TYR QE . . 5.500 5.474 5.273 5.552 0.052 17 0 "[ . 1 . 2]" 1
2514 1 103 TYR H 1 104 SER H . . 4.510 4.399 4.340 4.486 . 0 0 "[ . 1 . 2]" 1
2515 1 103 TYR HA 1 103 TYR QD . . 3.630 2.969 2.765 3.103 . 0 0 "[ . 1 . 2]" 1
2516 1 103 TYR HA 1 103 TYR QE . . 4.630 4.525 4.457 4.618 . 0 0 "[ . 1 . 2]" 1
2517 1 103 TYR HA 1 104 SER H . . 3.000 2.241 2.205 2.293 . 0 0 "[ . 1 . 2]" 1
2518 1 103 TYR HB2 1 104 SER H . . 4.260 4.133 4.016 4.233 . 0 0 "[ . 1 . 2]" 1
2519 1 103 TYR HB3 1 104 SER H . . 3.800 2.929 2.747 3.075 . 0 0 "[ . 1 . 2]" 1
2520 1 103 TYR HB3 1 104 SER HA . . 4.620 4.580 4.504 4.652 0.032 16 0 "[ . 1 . 2]" 1
2521 1 103 TYR QD 1 104 SER H . . 3.880 3.514 3.323 3.911 0.031 9 0 "[ . 1 . 2]" 1
2522 1 104 SER H 1 104 SER HB2 . . 4.020 3.622 3.599 3.653 . 0 0 "[ . 1 . 2]" 1
2523 1 104 SER H 1 104 SER HB3 . . 3.710 2.390 2.343 2.447 . 0 0 "[ . 1 . 2]" 1
2524 1 104 SER H 1 104 SER HG . . 4.350 4.036 3.873 4.091 . 0 0 "[ . 1 . 2]" 1
2525 1 104 SER HA 1 105 PRO HD2 . . 3.630 2.510 2.462 2.588 . 0 0 "[ . 1 . 2]" 1
2526 1 104 SER HA 1 105 PRO HD3 . . 3.470 2.347 2.324 2.390 . 0 0 "[ . 1 . 2]" 1
2527 1 104 SER HA 1 105 PRO QG . . 4.240 4.072 4.040 4.125 . 0 0 "[ . 1 . 2]" 1
2528 1 104 SER HB2 1 105 PRO HD2 . . 4.140 1.925 1.887 1.967 . 0 0 "[ . 1 . 2]" 1
2529 1 104 SER HB2 1 105 PRO QG . . 4.510 3.785 3.764 3.801 . 0 0 "[ . 1 . 2]" 1
2530 1 104 SER HB3 1 105 PRO HD2 . . 3.940 3.551 3.483 3.592 . 0 0 "[ . 1 . 2]" 1
2531 1 104 SER HB3 1 105 PRO HD3 . . 4.770 4.546 4.510 4.570 . 0 0 "[ . 1 . 2]" 1
2532 1 104 SER HG 1 105 PRO HD2 . . 4.370 2.681 2.225 2.904 . 0 0 "[ . 1 . 2]" 1
2533 1 104 SER HG 1 105 PRO HD3 . . 4.720 4.215 3.773 4.403 . 0 0 "[ . 1 . 2]" 1
2534 1 104 SER HG 1 106 VAL HA . . 5.040 4.708 4.456 4.854 . 0 0 "[ . 1 . 2]" 1
2535 1 105 PRO HA 1 106 VAL H . . 2.740 2.155 2.152 2.164 . 0 0 "[ . 1 . 2]" 1
2536 1 105 PRO HA 1 106 VAL QG . . 3.590 3.583 3.434 3.621 0.031 17 0 "[ . 1 . 2]" 1
2537 1 105 PRO HB2 1 106 VAL H . . 3.830 3.725 3.674 3.809 . 0 0 "[ . 1 . 2]" 1
2538 1 105 PRO HB3 1 106 VAL H . . 4.090 4.134 4.099 4.194 0.104 18 0 "[ . 1 . 2]" 1
2539 1 105 PRO QG 1 106 VAL H . . 4.710 4.719 4.705 4.737 0.027 18 0 "[ . 1 . 2]" 1
2540 1 105 PRO QG 1 106 VAL HA . . 5.500 5.478 5.422 5.528 0.028 3 0 "[ . 1 . 2]" 1
2541 1 106 VAL H 1 106 VAL HB . . 2.830 2.614 2.458 2.703 . 0 0 "[ . 1 . 2]" 1
2542 1 106 VAL H 1 106 VAL MG1 . . 3.810 3.129 1.999 3.782 . 0 0 "[ . 1 . 2]" 1
2543 1 106 VAL H 1 106 VAL QG . . 2.840 1.976 1.850 2.278 . 0 0 "[ . 1 . 2]" 1
2544 1 106 VAL H 1 106 VAL MG2 . . 3.810 2.629 1.854 3.777 . 0 0 "[ . 1 . 2]" 1
2545 1 106 VAL H 1 107 VAL H . . 4.680 4.587 4.541 4.627 . 0 0 "[ . 1 . 2]" 1
2546 1 106 VAL HA 1 106 VAL MG1 . . 3.280 2.712 2.320 3.202 . 0 0 "[ . 1 . 2]" 1
2547 1 106 VAL HA 1 106 VAL MG2 . . 3.280 2.392 2.251 2.435 . 0 0 "[ . 1 . 2]" 1
2548 1 106 VAL HA 1 107 VAL H . . 2.800 2.190 2.156 2.250 . 0 0 "[ . 1 . 2]" 1
2549 1 106 VAL HB 1 107 VAL H . . 4.420 4.066 3.974 4.160 . 0 0 "[ . 1 . 2]" 1
2550 1 106 VAL QG 1 107 VAL H . . 3.040 2.281 2.063 2.562 . 0 0 "[ . 1 . 2]" 1
2551 1 106 VAL QG 1 107 VAL HA . . 3.780 3.446 3.250 3.583 . 0 0 "[ . 1 . 2]" 1
2552 1 106 VAL QG 1 108 SER H . . 4.100 3.381 3.162 3.822 . 0 0 "[ . 1 . 2]" 1
2553 1 106 VAL QG 1 108 SER HA . . 4.150 3.847 3.728 4.023 . 0 0 "[ . 1 . 2]" 1
2554 1 106 VAL QG 1 108 SER HB2 . . 4.780 4.548 4.315 4.791 0.011 20 0 "[ . 1 . 2]" 1
2555 1 106 VAL QG 1 108 SER HB3 . . 4.180 3.394 3.287 3.643 . 0 0 "[ . 1 . 2]" 1
2556 1 106 VAL MG1 1 107 VAL H . . 4.290 2.938 2.071 4.013 . 0 0 "[ . 1 . 2]" 1
2557 1 106 VAL MG2 1 107 VAL H . . 4.290 3.276 2.086 3.983 . 0 0 "[ . 1 . 2]" 1
2558 1 107 VAL H 1 107 VAL HB . . 3.750 3.754 3.702 3.792 0.042 10 0 "[ . 1 . 2]" 1
2559 1 107 VAL H 1 107 VAL MG1 . . 3.420 3.060 2.896 3.279 . 0 0 "[ . 1 . 2]" 1
2560 1 107 VAL H 1 107 VAL MG2 . . 3.250 1.995 1.880 2.180 . 0 0 "[ . 1 . 2]" 1
2561 1 107 VAL H 1 108 SER H . . 4.310 4.050 3.951 4.229 . 0 0 "[ . 1 . 2]" 1
2562 1 107 VAL HA 1 107 VAL MG1 . . 3.120 2.239 2.076 2.351 . 0 0 "[ . 1 . 2]" 1
2563 1 107 VAL HA 1 107 VAL MG2 . . 3.280 3.184 3.177 3.196 . 0 0 "[ . 1 . 2]" 1
2564 1 107 VAL HA 1 108 SER H . . 2.570 2.173 2.140 2.180 . 0 0 "[ . 1 . 2]" 1
2565 1 107 VAL HA 1 108 SER HA . . 4.700 4.428 4.393 4.437 . 0 0 "[ . 1 . 2]" 1
2566 1 107 VAL HA 1 108 SER HB3 . . 4.770 4.503 4.392 4.689 . 0 0 "[ . 1 . 2]" 1
2567 1 107 VAL HB 1 108 SER H . . 3.820 3.749 3.473 3.790 . 0 0 "[ . 1 . 2]" 1
2568 1 107 VAL MG1 1 108 SER H . . 4.480 4.054 3.915 4.131 . 0 0 "[ . 1 . 2]" 1
2569 1 107 VAL MG2 1 108 SER H . . 4.250 4.195 4.150 4.257 0.007 1 0 "[ . 1 . 2]" 1
2570 1 108 SER H 1 108 SER HB2 . . 3.810 3.627 3.594 3.676 . 0 0 "[ . 1 . 2]" 1
2571 1 108 SER H 1 108 SER HB3 . . 3.230 2.504 2.354 2.674 . 0 0 "[ . 1 . 2]" 1
2572 1 108 SER H 1 109 VAL H . . 5.210 4.491 4.403 4.583 . 0 0 "[ . 1 . 2]" 1
2573 1 108 SER H 1 109 VAL HA . . 5.500 5.332 5.248 5.447 . 0 0 "[ . 1 . 2]" 1
2574 1 108 SER H 1 109 VAL MG1 . . 4.860 4.213 4.003 4.297 . 0 0 "[ . 1 . 2]" 1
2575 1 108 SER HA 1 109 VAL H . . 2.820 2.151 2.138 2.196 . 0 0 "[ . 1 . 2]" 1
2576 1 108 SER HA 1 109 VAL HA . . 4.660 4.405 4.393 4.435 . 0 0 "[ . 1 . 2]" 1
2577 1 108 SER HA 1 109 VAL MG1 . . 4.160 3.917 3.724 4.030 . 0 0 "[ . 1 . 2]" 1
2578 1 108 SER HA 1 109 VAL MG2 . . 4.100 3.548 3.453 3.765 . 0 0 "[ . 1 . 2]" 1
2579 1 108 SER HB2 1 109 VAL H . . 3.680 3.372 3.057 3.610 . 0 0 "[ . 1 . 2]" 1
2580 1 108 SER HB2 1 109 VAL MG1 . . 5.270 5.127 4.871 5.282 0.012 14 0 "[ . 1 . 2]" 1
2581 1 108 SER HB3 1 109 VAL H . . 4.540 4.358 4.147 4.503 . 0 0 "[ . 1 . 2]" 1
2582 1 108 SER HB3 1 109 VAL MG1 . . 5.500 5.420 5.293 5.514 0.014 12 0 "[ . 1 . 2]" 1
2583 1 109 VAL H 1 109 VAL HB . . 4.040 3.827 3.779 3.897 . 0 0 "[ . 1 . 2]" 1
2584 1 109 VAL H 1 109 VAL MG1 . . 3.780 3.131 2.848 3.234 . 0 0 "[ . 1 . 2]" 1
2585 1 109 VAL H 1 109 VAL MG2 . . 3.260 2.074 1.882 2.248 . 0 0 "[ . 1 . 2]" 1
2586 1 109 VAL H 1 110 ALA H . . 4.330 4.323 4.263 4.367 0.037 11 0 "[ . 1 . 2]" 1
2587 1 109 VAL H 1 110 ALA HA . . 4.860 4.747 4.681 4.824 . 0 0 "[ . 1 . 2]" 1
2588 1 109 VAL H 1 110 ALA MB . . 5.120 5.067 4.986 5.155 0.035 7 0 "[ . 1 . 2]" 1
2589 1 109 VAL HA 1 109 VAL MG1 . . 3.040 2.250 2.155 2.413 . 0 0 "[ . 1 . 2]" 1
2590 1 109 VAL HA 1 109 VAL MG2 . . 3.330 3.194 3.184 3.203 . 0 0 "[ . 1 . 2]" 1
2591 1 109 VAL HA 1 110 ALA H . . 2.630 2.179 2.149 2.229 . 0 0 "[ . 1 . 2]" 1
2592 1 109 VAL HA 1 110 ALA HA . . 4.840 4.381 4.377 4.387 . 0 0 "[ . 1 . 2]" 1
2593 1 109 VAL HA 1 110 ALA MB . . 4.040 3.955 3.914 3.984 . 0 0 "[ . 1 . 2]" 1
2594 1 109 VAL HB 1 110 ALA H . . 3.670 3.098 2.865 3.281 . 0 0 "[ . 1 . 2]" 1
2595 1 109 VAL MG1 1 110 ALA HA . . 5.500 5.551 5.498 5.591 0.091 7 0 "[ . 1 . 2]" 1
2596 1 109 VAL MG2 1 110 ALA H . . 4.080 3.964 3.761 4.104 0.024 2 0 "[ . 1 . 2]" 1
2597 1 109 VAL MG2 1 111 THR H . . 4.850 4.659 4.521 4.860 0.010 8 0 "[ . 1 . 2]" 1
2598 1 109 VAL MG2 1 111 THR HA . . 5.500 4.922 4.652 5.143 . 0 0 "[ . 1 . 2]" 1
2599 1 110 ALA H 1 110 ALA MB . . 2.800 2.356 2.314 2.422 . 0 0 "[ . 1 . 2]" 1
2600 1 110 ALA H 1 111 THR H . . 4.630 4.431 4.364 4.496 . 0 0 "[ . 1 . 2]" 1
2601 1 110 ALA HA 1 111 THR H . . 2.860 2.149 2.142 2.169 . 0 0 "[ . 1 . 2]" 1
2602 1 110 ALA HA 1 111 THR MG . . 4.590 3.605 3.434 3.814 . 0 0 "[ . 1 . 2]" 1
2603 1 110 ALA MB 1 111 THR H . . 3.180 3.119 2.998 3.190 0.010 13 0 "[ . 1 . 2]" 1
2604 1 111 THR H 1 111 THR HG1 . . 3.760 3.560 3.249 3.741 . 0 0 "[ . 1 . 2]" 1
2605 1 111 THR H 1 111 THR MG . . 2.980 2.100 1.843 2.325 . 0 0 "[ . 1 . 2]" 1
2606 1 111 THR H 1 112 THR H . . 4.760 4.554 4.521 4.615 . 0 0 "[ . 1 . 2]" 1
2607 1 111 THR HA 1 111 THR MG . . 3.160 2.420 2.317 2.528 . 0 0 "[ . 1 . 2]" 1
2608 1 111 THR HA 1 112 THR H . . 2.920 2.607 2.490 2.662 . 0 0 "[ . 1 . 2]" 1
2609 1 111 THR HG1 1 111 THR MG . . 3.190 2.911 2.464 3.035 . 0 0 "[ . 1 . 2]" 1
2610 1 111 THR HG1 1 112 THR H . . 4.240 2.996 2.629 3.618 . 0 0 "[ . 1 . 2]" 1
2611 1 111 THR MG 1 112 THR H . . 4.000 3.650 3.536 3.857 . 0 0 "[ . 1 . 2]" 1
2612 1 112 THR H 1 112 THR HB . . 3.980 3.680 3.636 3.717 . 0 0 "[ . 1 . 2]" 1
2613 1 112 THR H 1 112 THR MG . . 3.070 2.581 2.325 2.845 . 0 0 "[ . 1 . 2]" 1
2614 1 112 THR H 1 113 ARG H . . 4.650 4.509 4.451 4.570 . 0 0 "[ . 1 . 2]" 1
2615 1 112 THR HA 1 112 THR MG . . 2.830 2.321 2.192 2.418 . 0 0 "[ . 1 . 2]" 1
2616 1 112 THR HA 1 113 ARG H . . 2.900 2.537 2.345 2.652 . 0 0 "[ . 1 . 2]" 1
2617 1 112 THR HA 1 113 ARG QB . . 4.670 4.459 4.306 4.780 0.110 10 0 "[ . 1 . 2]" 1
2618 1 112 THR HB 1 113 ARG H . . 2.950 2.132 1.906 2.527 . 0 0 "[ . 1 . 2]" 1
2619 1 112 THR HB 1 113 ARG HA . . 4.880 4.635 4.496 4.801 . 0 0 "[ . 1 . 2]" 1
2620 1 112 THR HB 1 113 ARG QB . . 4.610 4.502 3.967 4.622 0.012 16 0 "[ . 1 . 2]" 1
2621 1 112 THR HB 1 113 ARG HG2 . . 5.040 3.989 3.344 5.078 0.038 10 0 "[ . 1 . 2]" 1
2622 1 112 THR HB 1 113 ARG HG3 . . 5.040 4.182 3.209 5.110 0.070 14 0 "[ . 1 . 2]" 1
2623 1 112 THR MG 1 113 ARG H . . 3.830 3.585 3.398 3.766 . 0 0 "[ . 1 . 2]" 1
2624 1 112 THR MG 1 113 ARG QB . . 5.500 5.373 5.140 5.524 0.024 16 0 "[ . 1 . 2]" 1
2625 1 113 ARG H 1 113 ARG QB . . 3.050 2.617 2.346 2.943 . 0 0 "[ . 1 . 2]" 1
2626 1 113 ARG H 1 113 ARG QD . . 4.840 3.778 1.783 4.343 . 0 0 "[ . 1 . 2]" 1
2627 1 113 ARG H 1 113 ARG HG2 . . 3.760 2.482 1.907 3.315 . 0 0 "[ . 1 . 2]" 1
2628 1 113 ARG H 1 113 ARG QG . . 3.260 2.161 1.867 2.826 . 0 0 "[ . 1 . 2]" 1
2629 1 113 ARG H 1 113 ARG HG3 . . 3.760 2.824 1.899 3.756 . 0 0 "[ . 1 . 2]" 1
2630 1 113 ARG H 1 114 GLU H . . 4.700 4.589 4.486 4.624 . 0 0 "[ . 1 . 2]" 1
2631 1 113 ARG HA 1 113 ARG QD . . 4.630 4.117 3.606 4.525 . 0 0 "[ . 1 . 2]" 1
2632 1 113 ARG HA 1 113 ARG QG . . 3.470 3.262 2.372 3.439 . 0 0 "[ . 1 . 2]" 1
2633 1 113 ARG HA 1 114 GLU H . . 3.490 2.264 2.167 2.393 . 0 0 "[ . 1 . 2]" 1
2634 1 113 ARG HA 1 114 GLU HA . . 4.510 4.328 4.302 4.403 . 0 0 "[ . 1 . 2]" 1
2635 1 113 ARG HA 1 114 GLU QG . . 4.420 4.138 3.802 4.450 0.030 15 0 "[ . 1 . 2]" 1
2636 1 113 ARG QB 1 113 ARG QD . . 2.840 2.144 2.008 2.375 . 0 0 "[ . 1 . 2]" 1
2637 1 113 ARG QB 1 113 ARG QG . . 2.420 2.062 2.018 2.087 . 0 0 "[ . 1 . 2]" 1
2638 1 113 ARG QB 1 114 GLU H . . 3.720 2.772 2.424 3.091 . 0 0 "[ . 1 . 2]" 1
2639 1 113 ARG QD 1 113 ARG QG . . 2.350 2.055 1.991 2.090 . 0 0 "[ . 1 . 2]" 1
2640 1 113 ARG QD 1 114 GLU H . . 4.950 4.539 3.003 4.956 0.006 5 0 "[ . 1 . 2]" 1
2641 1 114 GLU H 1 114 GLU QB . . 3.600 2.486 2.154 2.764 . 0 0 "[ . 1 . 2]" 1
2642 1 114 GLU H 1 114 GLU QG . . 3.920 2.389 2.032 2.899 . 0 0 "[ . 1 . 2]" 1
2643 1 114 GLU HA 1 114 GLU HG2 . . 3.920 3.189 2.228 4.238 0.318 8 0 "[ . 1 . 2]" 1
2644 1 114 GLU HA 1 114 GLU HG3 . . 3.920 3.179 2.467 3.823 . 0 0 "[ . 1 . 2]" 1
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