NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
575390 |
2md9   |
19479 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2md9
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 1418
_Distance_constraint_stats_list.Viol_count 4495
_Distance_constraint_stats_list.Viol_total 4488.437
_Distance_constraint_stats_list.Viol_max 0.131
_Distance_constraint_stats_list.Viol_rms 0.0202
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0079
_Distance_constraint_stats_list.Viol_average_violations_only 0.0499
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 VAL 0.480 0.089 15 0 "[ . 1 . 2]"
1 3 THR 0.763 0.086 11 0 "[ . 1 . 2]"
1 4 GLU 1.520 0.089 15 0 "[ . 1 . 2]"
1 5 ALA 2.496 0.086 11 0 "[ . 1 . 2]"
1 6 GLN 1.717 0.081 9 0 "[ . 1 . 2]"
1 7 TYR 7.811 0.115 1 0 "[ . 1 . 2]"
1 8 VAL 8.732 0.115 1 0 "[ . 1 . 2]"
1 9 ALA 4.211 0.086 15 0 "[ . 1 . 2]"
1 10 PRO 1.742 0.077 15 0 "[ . 1 . 2]"
1 11 THR 3.060 0.098 19 0 "[ . 1 . 2]"
1 12 ASN 6.627 0.098 19 0 "[ . 1 . 2]"
1 13 ALA 0.200 0.057 17 0 "[ . 1 . 2]"
1 14 VAL 6.740 0.104 14 0 "[ . 1 . 2]"
1 15 GLU 6.284 0.082 4 0 "[ . 1 . 2]"
1 16 SER 5.366 0.104 14 0 "[ . 1 . 2]"
1 17 LYS 7.159 0.115 1 0 "[ . 1 . 2]"
1 18 LEU 8.194 0.115 1 0 "[ . 1 . 2]"
1 19 ALA 1.931 0.067 14 0 "[ . 1 . 2]"
1 20 GLU 5.783 0.100 20 0 "[ . 1 . 2]"
1 21 ILE 3.141 0.100 20 0 "[ . 1 . 2]"
1 22 TRP 7.690 0.085 2 0 "[ . 1 . 2]"
1 23 GLU 4.857 0.088 10 0 "[ . 1 . 2]"
1 24 ARG 4.839 0.091 13 0 "[ . 1 . 2]"
1 25 VAL 6.391 0.102 11 0 "[ . 1 . 2]"
1 26 LEU 5.955 0.097 5 0 "[ . 1 . 2]"
1 27 GLY 1.753 0.075 8 0 "[ . 1 . 2]"
1 28 VAL 4.325 0.097 5 0 "[ . 1 . 2]"
1 29 SER 2.046 0.081 20 0 "[ . 1 . 2]"
1 30 GLY 3.145 0.084 16 0 "[ . 1 . 2]"
1 31 ILE 4.511 0.085 17 0 "[ . 1 . 2]"
1 32 GLY 2.628 0.075 5 0 "[ . 1 . 2]"
1 33 ILE 6.188 0.087 7 0 "[ . 1 . 2]"
1 34 LEU 9.136 0.087 7 0 "[ . 1 . 2]"
1 35 ASP 3.206 0.083 15 0 "[ . 1 . 2]"
1 36 ASN 2.488 0.077 4 0 "[ . 1 . 2]"
1 37 PHE 10.576 0.108 7 0 "[ . 1 . 2]"
1 38 PHE 6.650 0.108 7 0 "[ . 1 . 2]"
1 39 GLN 3.518 0.079 9 0 "[ . 1 . 2]"
1 40 ILE 4.689 0.079 9 0 "[ . 1 . 2]"
1 41 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 GLY 1.222 0.070 18 0 "[ . 1 . 2]"
1 43 HIS 5.608 0.077 7 0 "[ . 1 . 2]"
1 44 ALA 0.203 0.047 17 0 "[ . 1 . 2]"
1 45 LEU 2.855 0.071 7 0 "[ . 1 . 2]"
1 46 LYS 10.488 0.103 3 0 "[ . 1 . 2]"
1 47 ALA 3.718 0.096 5 0 "[ . 1 . 2]"
1 48 MET 4.317 0.110 11 0 "[ . 1 . 2]"
1 49 ALA 2.103 0.090 20 0 "[ . 1 . 2]"
1 50 VAL 7.658 0.110 11 0 "[ . 1 . 2]"
1 51 ALA 1.972 0.087 6 0 "[ . 1 . 2]"
1 52 ALA 3.677 0.068 9 0 "[ . 1 . 2]"
1 53 GLN 7.163 0.092 17 0 "[ . 1 . 2]"
1 54 VAL 8.431 0.131 1 0 "[ . 1 . 2]"
1 55 HIS 7.461 0.076 10 0 "[ . 1 . 2]"
1 56 ARG 11.054 0.131 1 0 "[ . 1 . 2]"
1 57 GLU 6.011 0.076 1 0 "[ . 1 . 2]"
1 58 TYR 8.378 0.105 18 0 "[ . 1 . 2]"
1 59 GLN 4.076 0.072 4 0 "[ . 1 . 2]"
1 60 VAL 8.741 0.109 5 0 "[ . 1 . 2]"
1 61 GLU 2.898 0.082 8 0 "[ . 1 . 2]"
1 62 LEU 4.076 0.108 13 0 "[ . 1 . 2]"
1 63 PRO 3.749 0.072 4 0 "[ . 1 . 2]"
1 64 LEU 4.022 0.096 1 0 "[ . 1 . 2]"
1 65 LYS 4.142 0.083 16 0 "[ . 1 . 2]"
1 66 VAL 6.629 0.090 1 0 "[ . 1 . 2]"
1 67 LEU 11.224 0.106 9 0 "[ . 1 . 2]"
1 68 PHE 10.360 0.083 14 0 "[ . 1 . 2]"
1 69 ALA 4.872 0.096 1 0 "[ . 1 . 2]"
1 70 GLN 5.765 0.086 12 0 "[ . 1 . 2]"
1 71 PRO 0.707 0.062 14 0 "[ . 1 . 2]"
1 72 THR 6.712 0.090 5 0 "[ . 1 . 2]"
1 73 ILE 9.343 0.094 20 0 "[ . 1 . 2]"
1 74 LYS 6.665 0.090 5 0 "[ . 1 . 2]"
1 75 ALA 7.156 0.098 2 0 "[ . 1 . 2]"
1 76 LEU 10.474 0.094 20 0 "[ . 1 . 2]"
1 77 ALA 4.380 0.101 17 0 "[ . 1 . 2]"
1 78 GLN 3.919 0.096 13 0 "[ . 1 . 2]"
1 79 TYR 12.729 0.108 13 0 "[ . 1 . 2]"
1 80 VAL 10.521 0.099 11 0 "[ . 1 . 2]"
1 81 ALA 4.495 0.096 20 0 "[ . 1 . 2]"
1 82 THR 3.765 0.095 18 0 "[ . 1 . 2]"
1 83 ARG 6.584 0.081 13 0 "[ . 1 . 2]"
1 84 SER 3.686 0.088 3 0 "[ . 1 . 2]"
1 85 HIS 0.143 0.069 4 0 "[ . 1 . 2]"
1 86 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 VAL HA 1 3 THR H . . 3.210 2.492 2.117 3.287 0.077 10 0 "[ . 1 . 2]" 1
2 1 2 VAL HB 1 3 THR H . . 4.180 3.239 2.093 4.255 0.075 18 0 "[ . 1 . 2]" 1
3 1 2 VAL QG 1 3 THR H . . 3.840 2.695 1.998 3.441 . 0 0 "[ . 1 . 2]" 1
4 1 2 VAL QG 1 4 GLU H . . 4.990 3.983 2.477 5.079 0.089 15 0 "[ . 1 . 2]" 1
5 1 2 VAL MG1 1 3 THR H . . 4.570 3.236 2.059 3.821 . 0 0 "[ . 1 . 2]" 1
6 1 2 VAL MG2 1 3 THR H . . 4.570 3.401 2.009 4.260 . 0 0 "[ . 1 . 2]" 1
7 1 3 THR H 1 3 THR HB . . 3.950 3.175 2.395 3.795 . 0 0 "[ . 1 . 2]" 1
8 1 3 THR H 1 3 THR MG . . 3.800 3.310 2.311 3.862 0.062 20 0 "[ . 1 . 2]" 1
9 1 3 THR HA 1 4 GLU H . . 3.020 2.404 2.106 2.821 . 0 0 "[ . 1 . 2]" 1
10 1 3 THR HA 1 5 ALA H . . 4.310 3.618 3.026 4.371 0.061 13 0 "[ . 1 . 2]" 1
11 1 3 THR MG 1 4 GLU H . . 4.400 3.613 2.391 4.380 . 0 0 "[ . 1 . 2]" 1
12 1 3 THR MG 1 5 ALA H . . 4.790 3.799 1.815 4.876 0.086 11 0 "[ . 1 . 2]" 1
13 1 4 GLU H 1 4 GLU HB2 . . 3.790 2.808 2.018 3.843 0.053 16 0 "[ . 1 . 2]" 1
14 1 4 GLU H 1 4 GLU QB . . 3.100 2.603 1.998 3.182 0.082 11 0 "[ . 1 . 2]" 1
15 1 4 GLU H 1 4 GLU HB3 . . 3.790 3.379 2.335 3.851 0.061 5 0 "[ . 1 . 2]" 1
16 1 4 GLU H 1 4 GLU QG . . 4.100 3.391 1.984 4.184 0.084 13 0 "[ . 1 . 2]" 1
17 1 4 GLU H 1 5 ALA H . . 3.190 2.534 1.892 2.965 . 0 0 "[ . 1 . 2]" 1
18 1 4 GLU H 1 5 ALA MB . . 5.000 3.980 3.401 4.540 . 0 0 "[ . 1 . 2]" 1
19 1 4 GLU HA 1 5 ALA H . . 3.390 3.131 2.377 3.452 0.062 18 0 "[ . 1 . 2]" 1
20 1 4 GLU HB2 1 5 ALA H . . 4.460 4.096 3.046 4.524 0.064 13 0 "[ . 1 . 2]" 1
21 1 4 GLU HB3 1 5 ALA H . . 4.460 4.056 3.016 4.522 0.062 16 0 "[ . 1 . 2]" 1
22 1 4 GLU QG 1 5 ALA H . . 4.690 4.399 3.222 4.766 0.076 5 0 "[ . 1 . 2]" 1
23 1 5 ALA H 1 5 ALA MB . . 2.690 2.253 2.136 2.529 . 0 0 "[ . 1 . 2]" 1
24 1 5 ALA H 1 34 LEU QB . . 5.100 4.459 3.289 5.079 . 0 0 "[ . 1 . 2]" 1
25 1 5 ALA H 1 34 LEU MD2 . . 5.500 4.985 4.042 5.531 0.031 2 0 "[ . 1 . 2]" 1
26 1 5 ALA HA 1 6 GLN H . . 3.200 2.415 2.035 3.268 0.068 17 0 "[ . 1 . 2]" 1
27 1 5 ALA MB 1 6 GLN H . . 3.110 2.749 2.224 3.182 0.072 6 0 "[ . 1 . 2]" 1
28 1 5 ALA MB 1 7 TYR H . . 5.500 5.526 5.335 5.578 0.078 12 0 "[ . 1 . 2]" 1
29 1 6 GLN H 1 6 GLN QB . . 2.780 2.381 2.074 2.664 . 0 0 "[ . 1 . 2]" 1
30 1 6 GLN H 1 6 GLN QG . . 4.120 3.092 1.970 4.145 0.025 14 0 "[ . 1 . 2]" 1
31 1 6 GLN H 1 8 VAL QG . . 4.550 4.258 3.647 4.626 0.076 18 0 "[ . 1 . 2]" 1
32 1 6 GLN HA 1 7 TYR H . . 2.590 2.384 2.205 2.611 0.021 8 0 "[ . 1 . 2]" 1
33 1 6 GLN QB 1 7 TYR H . . 3.550 2.814 2.123 3.625 0.075 11 0 "[ . 1 . 2]" 1
34 1 6 GLN HB2 1 7 TYR H . . 4.150 3.454 2.405 4.155 0.005 19 0 "[ . 1 . 2]" 1
35 1 6 GLN HB3 1 7 TYR H . . 4.150 3.349 2.140 4.125 . 0 0 "[ . 1 . 2]" 1
36 1 6 GLN QG 1 7 TYR H . . 3.830 3.324 2.150 3.911 0.081 9 0 "[ . 1 . 2]" 1
37 1 7 TYR H 1 7 TYR HB2 . . 2.950 2.659 2.445 2.855 . 0 0 "[ . 1 . 2]" 1
38 1 7 TYR H 1 7 TYR HB3 . . 2.950 2.357 2.173 2.575 . 0 0 "[ . 1 . 2]" 1
39 1 7 TYR H 1 7 TYR QD . . 4.310 4.191 4.044 4.314 0.004 17 0 "[ . 1 . 2]" 1
40 1 7 TYR H 1 8 VAL H . . 4.690 4.596 4.495 4.701 0.011 4 0 "[ . 1 . 2]" 1
41 1 7 TYR H 1 8 VAL QG . . 4.540 4.531 4.341 4.631 0.091 5 0 "[ . 1 . 2]" 1
42 1 7 TYR H 1 34 LEU HG . . 5.500 5.413 5.093 5.559 0.059 15 0 "[ . 1 . 2]" 1
43 1 7 TYR HA 1 7 TYR QD . . 3.040 2.603 2.306 3.098 0.058 6 0 "[ . 1 . 2]" 1
44 1 7 TYR HA 1 8 VAL H . . 2.650 2.164 2.068 2.258 . 0 0 "[ . 1 . 2]" 1
45 1 7 TYR QB 1 8 VAL H . . 3.800 3.727 3.586 3.822 0.022 11 0 "[ . 1 . 2]" 1
46 1 7 TYR HB2 1 8 VAL H . . 4.660 4.065 3.880 4.210 . 0 0 "[ . 1 . 2]" 1
47 1 7 TYR HB3 1 8 VAL H . . 4.660 4.335 4.215 4.468 . 0 0 "[ . 1 . 2]" 1
48 1 7 TYR QD 1 8 VAL H . . 3.690 2.726 2.184 3.397 . 0 0 "[ . 1 . 2]" 1
49 1 7 TYR QD 1 8 VAL HA . . 4.140 4.098 3.629 4.208 0.068 20 0 "[ . 1 . 2]" 1
50 1 7 TYR QD 1 8 VAL QG . . 4.380 4.454 4.340 4.495 0.115 1 0 "[ . 1 . 2]" 1
51 1 7 TYR QD 1 9 ALA H . . 4.500 4.388 4.064 4.565 0.065 4 0 "[ . 1 . 2]" 1
52 1 7 TYR QD 1 9 ALA HA . . 4.470 4.379 4.014 4.550 0.080 5 0 "[ . 1 . 2]" 1
53 1 7 TYR QD 1 9 ALA MB . . 4.890 4.564 4.276 4.833 . 0 0 "[ . 1 . 2]" 1
54 1 7 TYR QD 1 31 ILE HA . . 4.650 4.425 4.018 4.716 0.066 13 0 "[ . 1 . 2]" 1
55 1 7 TYR QD 1 32 GLY H . . 3.670 3.083 2.505 3.512 . 0 0 "[ . 1 . 2]" 1
56 1 7 TYR QD 1 32 GLY QA . . 3.310 2.293 1.934 2.778 . 0 0 "[ . 1 . 2]" 1
57 1 7 TYR QE 1 9 ALA H . . 3.710 3.738 3.318 3.784 0.074 11 0 "[ . 1 . 2]" 1
58 1 7 TYR QE 1 9 ALA HA . . 3.490 2.837 2.287 3.352 . 0 0 "[ . 1 . 2]" 1
59 1 7 TYR QE 1 9 ALA MB . . 3.370 3.099 2.626 3.346 . 0 0 "[ . 1 . 2]" 1
60 1 7 TYR QE 1 30 GLY H . . 5.500 5.462 5.097 5.574 0.074 20 0 "[ . 1 . 2]" 1
61 1 7 TYR QE 1 30 GLY HA2 . . 3.930 3.684 3.394 3.832 . 0 0 "[ . 1 . 2]" 1
62 1 7 TYR QE 1 30 GLY HA3 . . 4.410 3.963 3.629 4.332 . 0 0 "[ . 1 . 2]" 1
63 1 7 TYR QE 1 31 ILE H . . 4.810 4.132 3.678 4.637 . 0 0 "[ . 1 . 2]" 1
64 1 7 TYR QE 1 31 ILE HA . . 4.800 3.946 3.140 4.319 . 0 0 "[ . 1 . 2]" 1
65 1 7 TYR QE 1 32 GLY H . . 3.920 3.392 2.786 3.819 . 0 0 "[ . 1 . 2]" 1
66 1 7 TYR QE 1 32 GLY HA2 . . 3.800 2.700 2.267 3.203 . 0 0 "[ . 1 . 2]" 1
67 1 7 TYR QE 1 32 GLY QA . . 3.140 2.535 2.222 2.830 . 0 0 "[ . 1 . 2]" 1
68 1 7 TYR QE 1 32 GLY HA3 . . 3.800 3.136 2.689 3.584 . 0 0 "[ . 1 . 2]" 1
69 1 7 TYR QE 1 33 ILE H . . 5.150 4.921 4.352 5.211 0.061 9 0 "[ . 1 . 2]" 1
70 1 8 VAL H 1 8 VAL HB . . 3.210 2.821 2.620 2.902 . 0 0 "[ . 1 . 2]" 1
71 1 8 VAL H 1 8 VAL QG . . 3.160 3.064 2.995 3.136 . 0 0 "[ . 1 . 2]" 1
72 1 8 VAL H 1 9 ALA H . . 4.130 3.990 3.899 4.119 . 0 0 "[ . 1 . 2]" 1
73 1 8 VAL H 1 32 GLY H . . 4.690 4.747 4.710 4.765 0.075 5 0 "[ . 1 . 2]" 1
74 1 8 VAL H 1 32 GLY QA . . 3.270 2.537 2.389 2.652 . 0 0 "[ . 1 . 2]" 1
75 1 8 VAL H 1 33 ILE H . . 3.680 3.447 3.237 3.697 0.017 16 0 "[ . 1 . 2]" 1
76 1 8 VAL H 1 34 LEU H . . 4.110 3.843 3.629 4.021 . 0 0 "[ . 1 . 2]" 1
77 1 8 VAL H 1 34 LEU QB . . 5.170 5.227 5.178 5.248 0.078 2 0 "[ . 1 . 2]" 1
78 1 8 VAL H 1 34 LEU MD2 . . 4.080 2.745 2.547 2.964 . 0 0 "[ . 1 . 2]" 1
79 1 8 VAL H 1 34 LEU HG . . 4.640 4.612 4.435 4.697 0.057 14 0 "[ . 1 . 2]" 1
80 1 8 VAL HA 1 9 ALA H . . 2.400 2.144 2.097 2.194 . 0 0 "[ . 1 . 2]" 1
81 1 8 VAL HB 1 9 ALA H . . 4.340 4.348 4.299 4.381 0.041 4 0 "[ . 1 . 2]" 1
82 1 8 VAL HB 1 33 ILE H . . 3.530 3.534 3.374 3.595 0.065 2 0 "[ . 1 . 2]" 1
83 1 8 VAL HB 1 34 LEU H . . 4.030 4.081 4.008 4.096 0.066 4 0 "[ . 1 . 2]" 1
84 1 8 VAL QG 1 9 ALA H . . 2.860 2.913 2.820 2.946 0.086 15 0 "[ . 1 . 2]" 1
85 1 8 VAL QG 1 33 ILE H . . 5.500 3.763 3.602 3.887 . 0 0 "[ . 1 . 2]" 1
86 1 9 ALA H 1 9 ALA MB . . 2.570 2.149 2.025 2.219 . 0 0 "[ . 1 . 2]" 1
87 1 9 ALA HA 1 32 GLY H . . 5.300 5.067 4.753 5.352 0.052 3 0 "[ . 1 . 2]" 1
88 1 9 ALA HA 1 33 ILE H . . 4.210 4.014 3.762 4.249 0.039 8 0 "[ . 1 . 2]" 1
89 1 9 ALA MB 1 11 THR H . . 5.500 5.520 5.364 5.577 0.077 15 0 "[ . 1 . 2]" 1
90 1 10 PRO HA 1 11 THR H . . 2.760 2.252 2.139 2.354 . 0 0 "[ . 1 . 2]" 1
91 1 10 PRO HA 1 12 ASN H . . 3.850 3.839 3.618 3.913 0.063 15 0 "[ . 1 . 2]" 1
92 1 10 PRO QB 1 11 THR H . . 3.610 3.001 2.629 3.376 . 0 0 "[ . 1 . 2]" 1
93 1 10 PRO QB 1 12 ASN H . . 3.360 3.285 2.930 3.437 0.077 15 0 "[ . 1 . 2]" 1
94 1 10 PRO QB 1 16 SER H . . 3.150 2.803 2.614 2.952 . 0 0 "[ . 1 . 2]" 1
95 1 10 PRO QG 1 16 SER H . . 4.040 4.011 3.781 4.108 0.068 6 0 "[ . 1 . 2]" 1
96 1 10 PRO HG2 1 16 SER H . . 4.620 4.580 4.275 4.676 0.056 8 0 "[ . 1 . 2]" 1
97 1 10 PRO HG3 1 16 SER H . . 4.620 4.437 4.214 4.603 . 0 0 "[ . 1 . 2]" 1
98 1 11 THR H 1 11 THR HB . . 4.000 3.491 2.868 3.872 . 0 0 "[ . 1 . 2]" 1
99 1 11 THR H 1 11 THR MG . . 3.230 2.652 1.930 3.090 . 0 0 "[ . 1 . 2]" 1
100 1 11 THR H 1 12 ASN H . . 2.660 1.988 1.721 2.185 . 0 0 "[ . 1 . 2]" 1
101 1 11 THR H 1 12 ASN HA . . 4.780 4.742 4.548 4.847 0.067 17 0 "[ . 1 . 2]" 1
102 1 11 THR H 1 15 GLU H . . 5.500 5.300 4.977 5.549 0.049 1 0 "[ . 1 . 2]" 1
103 1 11 THR H 1 15 GLU HB2 . . 3.610 3.080 2.735 3.403 . 0 0 "[ . 1 . 2]" 1
104 1 11 THR H 1 15 GLU HB3 . . 4.180 4.030 3.650 4.235 0.055 1 0 "[ . 1 . 2]" 1
105 1 11 THR H 1 16 SER H . . 5.420 5.049 4.626 5.427 0.007 17 0 "[ . 1 . 2]" 1
106 1 11 THR H 1 33 ILE MD . . 4.740 4.310 3.817 4.772 0.032 6 0 "[ . 1 . 2]" 1
107 1 11 THR H 1 33 ILE MG . . 3.580 3.069 2.799 3.394 . 0 0 "[ . 1 . 2]" 1
108 1 11 THR HA 1 12 ASN H . . 3.460 3.444 3.339 3.522 0.062 12 0 "[ . 1 . 2]" 1
109 1 11 THR HB 1 12 ASN H . . 4.400 4.235 3.739 4.451 0.051 5 0 "[ . 1 . 2]" 1
110 1 11 THR MG 1 12 ASN H . . 4.090 3.768 2.743 4.188 0.098 19 0 "[ . 1 . 2]" 1
111 1 12 ASN H 1 12 ASN HB2 . . 3.860 2.896 2.452 3.440 . 0 0 "[ . 1 . 2]" 1
112 1 12 ASN H 1 12 ASN QB . . 3.370 2.530 2.266 2.782 . 0 0 "[ . 1 . 2]" 1
113 1 12 ASN H 1 12 ASN HB3 . . 3.860 3.029 2.484 3.876 0.016 6 0 "[ . 1 . 2]" 1
114 1 12 ASN H 1 14 VAL H . . 5.000 4.885 4.592 5.059 0.059 1 0 "[ . 1 . 2]" 1
115 1 12 ASN H 1 15 GLU H . . 3.940 3.892 3.659 4.004 0.064 19 0 "[ . 1 . 2]" 1
116 1 12 ASN H 1 15 GLU HA . . 5.500 5.453 5.274 5.551 0.051 17 0 "[ . 1 . 2]" 1
117 1 12 ASN H 1 15 GLU HB2 . . 2.910 2.660 2.336 2.822 . 0 0 "[ . 1 . 2]" 1
118 1 12 ASN H 1 15 GLU HB3 . . 4.170 4.131 3.684 4.228 0.058 4 0 "[ . 1 . 2]" 1
119 1 12 ASN H 1 15 GLU HG2 . . 4.280 4.284 3.984 4.357 0.077 12 0 "[ . 1 . 2]" 1
120 1 12 ASN H 1 15 GLU HG3 . . 4.000 2.759 2.350 2.991 . 0 0 "[ . 1 . 2]" 1
121 1 12 ASN H 1 16 SER H . . 4.250 4.045 3.758 4.293 0.043 16 0 "[ . 1 . 2]" 1
122 1 12 ASN H 1 16 SER QB . . 4.710 4.550 3.980 4.782 0.072 18 0 "[ . 1 . 2]" 1
123 1 12 ASN H 1 33 ILE MG . . 4.750 4.272 4.054 4.506 . 0 0 "[ . 1 . 2]" 1
124 1 12 ASN HA 1 14 VAL H . . 4.530 4.181 3.958 4.319 . 0 0 "[ . 1 . 2]" 1
125 1 12 ASN QB 1 14 VAL H . . 3.640 3.045 2.467 3.699 0.059 13 0 "[ . 1 . 2]" 1
126 1 12 ASN HB2 1 14 VAL H . . 4.390 4.236 3.133 4.462 0.072 7 0 "[ . 1 . 2]" 1
127 1 12 ASN HB2 1 15 GLU H . . 4.910 4.073 2.720 4.861 . 0 0 "[ . 1 . 2]" 1
128 1 12 ASN HB3 1 14 VAL H . . 4.390 3.165 2.483 3.955 . 0 0 "[ . 1 . 2]" 1
129 1 12 ASN HB3 1 15 GLU H . . 4.910 3.076 1.898 4.459 . 0 0 "[ . 1 . 2]" 1
130 1 13 ALA HA 1 16 SER H . . 3.910 3.603 3.156 3.961 0.051 10 0 "[ . 1 . 2]" 1
131 1 13 ALA MB 1 14 VAL H . . 3.020 2.840 2.595 3.077 0.057 17 0 "[ . 1 . 2]" 1
132 1 13 ALA MB 1 15 GLU H . . 5.220 4.775 4.640 4.990 . 0 0 "[ . 1 . 2]" 1
133 1 14 VAL H 1 14 VAL HB . . 2.840 2.470 2.202 2.598 . 0 0 "[ . 1 . 2]" 1
134 1 14 VAL H 1 14 VAL MG1 . . 3.850 3.774 3.657 3.837 . 0 0 "[ . 1 . 2]" 1
135 1 14 VAL H 1 14 VAL QG . . 2.630 2.204 2.026 2.440 . 0 0 "[ . 1 . 2]" 1
136 1 14 VAL H 1 14 VAL MG2 . . 3.850 2.220 2.035 2.472 . 0 0 "[ . 1 . 2]" 1
137 1 14 VAL H 1 15 GLU H . . 2.740 2.525 2.276 2.721 . 0 0 "[ . 1 . 2]" 1
138 1 14 VAL H 1 15 GLU HA . . 5.410 5.194 5.012 5.372 . 0 0 "[ . 1 . 2]" 1
139 1 14 VAL H 1 15 GLU HG2 . . 4.660 4.635 4.233 4.731 0.071 15 0 "[ . 1 . 2]" 1
140 1 14 VAL H 1 15 GLU HG3 . . 4.800 3.944 3.396 4.861 0.061 2 0 "[ . 1 . 2]" 1
141 1 14 VAL H 1 16 SER H . . 3.870 3.906 3.692 3.939 0.069 5 0 "[ . 1 . 2]" 1
142 1 14 VAL H 1 16 SER QB . . 5.050 4.655 4.226 4.960 . 0 0 "[ . 1 . 2]" 1
143 1 14 VAL H 1 17 LYS QG . . 4.970 4.892 4.659 5.034 0.064 7 0 "[ . 1 . 2]" 1
144 1 14 VAL H 1 77 ALA MB . . 5.090 4.854 4.496 5.147 0.057 5 0 "[ . 1 . 2]" 1
145 1 14 VAL HA 1 17 LYS H . . 3.520 3.462 3.145 3.580 0.060 18 0 "[ . 1 . 2]" 1
146 1 14 VAL HA 1 18 LEU H . . 4.680 4.389 3.971 4.662 . 0 0 "[ . 1 . 2]" 1
147 1 14 VAL HB 1 15 GLU H . . 3.050 2.492 2.206 2.826 . 0 0 "[ . 1 . 2]" 1
148 1 14 VAL QG 1 15 GLU H . . 3.300 3.145 2.959 3.375 0.075 8 0 "[ . 1 . 2]" 1
149 1 14 VAL QG 1 16 SER H . . 4.480 4.549 4.459 4.584 0.104 14 0 "[ . 1 . 2]" 1
150 1 14 VAL QG 1 17 LYS H . . 4.650 4.357 4.194 4.490 . 0 0 "[ . 1 . 2]" 1
151 1 14 VAL QG 1 18 LEU H . . 4.190 4.040 3.798 4.277 0.087 11 0 "[ . 1 . 2]" 1
152 1 14 VAL QG 1 58 TYR QD . . 4.200 4.016 3.594 4.275 0.075 2 0 "[ . 1 . 2]" 1
153 1 14 VAL QG 1 58 TYR QE . . 3.300 2.912 2.435 3.395 0.095 8 0 "[ . 1 . 2]" 1
154 1 14 VAL QG 1 81 ALA H . . 3.700 3.494 3.213 3.796 0.096 20 0 "[ . 1 . 2]" 1
155 1 14 VAL QG 1 82 THR H . . 5.440 5.343 5.102 5.535 0.095 18 0 "[ . 1 . 2]" 1
156 1 14 VAL MG1 1 15 GLU H . . 3.840 3.370 3.073 3.699 . 0 0 "[ . 1 . 2]" 1
157 1 14 VAL MG1 1 16 SER H . . 5.380 4.958 4.821 5.061 . 0 0 "[ . 1 . 2]" 1
158 1 14 VAL MG2 1 15 GLU H . . 3.840 3.793 3.587 3.909 0.069 15 0 "[ . 1 . 2]" 1
159 1 14 VAL MG2 1 16 SER H . . 5.380 5.298 5.213 5.440 0.060 7 0 "[ . 1 . 2]" 1
160 1 15 GLU H 1 15 GLU HB2 . . 3.240 2.771 2.609 2.884 . 0 0 "[ . 1 . 2]" 1
161 1 15 GLU H 1 15 GLU HB3 . . 3.750 3.600 3.521 3.686 . 0 0 "[ . 1 . 2]" 1
162 1 15 GLU H 1 15 GLU HG2 . . 2.910 2.482 2.117 2.812 . 0 0 "[ . 1 . 2]" 1
163 1 15 GLU H 1 15 GLU HG3 . . 3.270 2.128 1.772 2.943 . 0 0 "[ . 1 . 2]" 1
164 1 15 GLU H 1 16 SER QB . . 4.660 4.361 4.099 4.559 . 0 0 "[ . 1 . 2]" 1
165 1 15 GLU H 1 17 LYS H . . 4.420 4.323 4.080 4.482 0.062 12 0 "[ . 1 . 2]" 1
166 1 15 GLU H 1 17 LYS QG . . 5.300 5.370 5.341 5.382 0.082 4 0 "[ . 1 . 2]" 1
167 1 15 GLU H 1 77 ALA MB . . 3.580 3.370 3.229 3.562 . 0 0 "[ . 1 . 2]" 1
168 1 15 GLU HA 1 17 LYS H . . 4.570 4.490 4.183 4.629 0.059 5 0 "[ . 1 . 2]" 1
169 1 15 GLU HA 1 18 LEU H . . 3.780 3.700 3.566 3.829 0.049 14 0 "[ . 1 . 2]" 1
170 1 15 GLU HA 1 19 ALA H . . 4.260 4.038 3.819 4.288 0.028 7 0 "[ . 1 . 2]" 1
171 1 15 GLU HA 1 77 ALA H . . 5.180 4.869 4.655 5.109 . 0 0 "[ . 1 . 2]" 1
172 1 15 GLU HB2 1 16 SER H . . 3.070 2.652 2.394 2.996 . 0 0 "[ . 1 . 2]" 1
173 1 15 GLU HB3 1 16 SER H . . 5.040 3.872 3.642 4.124 . 0 0 "[ . 1 . 2]" 1
174 1 15 GLU HG2 1 16 SER H . . 4.550 4.518 4.308 4.610 0.060 19 0 "[ . 1 . 2]" 1
175 1 15 GLU HG2 1 77 ALA H . . 5.360 5.149 4.782 5.420 0.060 2 0 "[ . 1 . 2]" 1
176 1 16 SER H 1 16 SER QB . . 2.650 2.182 2.079 2.346 . 0 0 "[ . 1 . 2]" 1
177 1 16 SER H 1 17 LYS H . . 2.970 2.822 2.717 2.929 . 0 0 "[ . 1 . 2]" 1
178 1 16 SER H 1 17 LYS QG . . 5.130 4.407 4.217 4.556 . 0 0 "[ . 1 . 2]" 1
179 1 16 SER H 1 18 LEU H . . 4.820 4.473 4.206 4.748 . 0 0 "[ . 1 . 2]" 1
180 1 16 SER H 1 18 LEU QD . . 5.440 4.753 4.549 5.047 . 0 0 "[ . 1 . 2]" 1
181 1 16 SER H 1 19 ALA MB . . 5.080 4.646 4.376 4.849 . 0 0 "[ . 1 . 2]" 1
182 1 16 SER H 1 77 ALA MB . . 5.500 5.086 4.899 5.291 . 0 0 "[ . 1 . 2]" 1
183 1 16 SER HA 1 17 LYS H . . 3.550 3.598 3.578 3.608 0.058 15 0 "[ . 1 . 2]" 1
184 1 16 SER QB 1 17 LYS H . . 2.910 2.663 2.432 2.971 0.061 9 0 "[ . 1 . 2]" 1
185 1 17 LYS H 1 17 LYS HB2 . . 2.780 2.474 2.312 2.651 . 0 0 "[ . 1 . 2]" 1
186 1 17 LYS H 1 17 LYS QD . . 4.710 3.861 3.158 4.417 . 0 0 "[ . 1 . 2]" 1
187 1 17 LYS H 1 17 LYS HE2 . . 5.200 4.660 3.769 5.263 0.063 17 0 "[ . 1 . 2]" 1
188 1 17 LYS H 1 17 LYS QE . . 4.410 4.127 3.523 4.488 0.078 9 0 "[ . 1 . 2]" 1
189 1 17 LYS H 1 17 LYS HE3 . . 5.200 4.756 3.873 5.269 0.069 20 0 "[ . 1 . 2]" 1
190 1 17 LYS H 1 17 LYS HG2 . . 3.790 2.379 2.046 3.267 . 0 0 "[ . 1 . 2]" 1
191 1 17 LYS H 1 17 LYS QG . . 3.320 2.221 2.032 2.446 . 0 0 "[ . 1 . 2]" 1
192 1 17 LYS H 1 17 LYS HG3 . . 3.790 3.273 2.189 3.709 . 0 0 "[ . 1 . 2]" 1
193 1 17 LYS H 1 18 LEU H . . 2.930 2.823 2.419 2.990 0.060 3 0 "[ . 1 . 2]" 1
194 1 17 LYS H 1 18 LEU QD . . 4.030 3.970 3.560 4.145 0.115 1 0 "[ . 1 . 2]" 1
195 1 17 LYS HA 1 19 ALA H . . 4.730 4.514 4.331 4.737 0.007 16 0 "[ . 1 . 2]" 1
196 1 17 LYS HA 1 20 GLU H . . 3.710 3.574 3.294 3.764 0.054 8 0 "[ . 1 . 2]" 1
197 1 17 LYS HA 1 21 ILE H . . 4.970 4.549 3.981 4.966 . 0 0 "[ . 1 . 2]" 1
198 1 17 LYS HB2 1 18 LEU H . . 3.120 2.518 2.271 2.752 . 0 0 "[ . 1 . 2]" 1
199 1 17 LYS HB2 1 19 ALA H . . 5.020 5.034 4.870 5.076 0.056 1 0 "[ . 1 . 2]" 1
200 1 17 LYS HB2 1 58 TYR QE . . 3.860 3.475 2.998 3.757 . 0 0 "[ . 1 . 2]" 1
201 1 17 LYS QG 1 18 LEU H . . 4.050 4.054 3.897 4.119 0.069 14 0 "[ . 1 . 2]" 1
202 1 18 LEU H 1 18 LEU HB2 . . 2.740 2.393 2.185 2.517 . 0 0 "[ . 1 . 2]" 1
203 1 18 LEU H 1 18 LEU MD1 . . 4.530 2.297 1.960 2.977 . 0 0 "[ . 1 . 2]" 1
204 1 18 LEU H 1 18 LEU QD . . 3.010 2.269 1.955 2.866 . 0 0 "[ . 1 . 2]" 1
205 1 18 LEU H 1 18 LEU MD2 . . 4.530 3.988 3.664 4.163 . 0 0 "[ . 1 . 2]" 1
206 1 18 LEU H 1 18 LEU HG . . 3.110 2.966 2.168 3.187 0.077 19 0 "[ . 1 . 2]" 1
207 1 18 LEU H 1 19 ALA H . . 2.910 2.774 2.540 2.954 0.044 15 0 "[ . 1 . 2]" 1
208 1 18 LEU H 1 19 ALA HA . . 5.500 5.368 5.201 5.514 0.014 15 0 "[ . 1 . 2]" 1
209 1 18 LEU H 1 19 ALA MB . . 5.500 4.406 4.208 4.566 . 0 0 "[ . 1 . 2]" 1
210 1 18 LEU H 1 20 GLU H . . 4.300 4.178 3.977 4.315 0.015 4 0 "[ . 1 . 2]" 1
211 1 18 LEU H 1 20 GLU QG . . 5.340 5.265 4.387 5.420 0.080 15 0 "[ . 1 . 2]" 1
212 1 18 LEU H 1 58 TYR QE . . 4.780 4.548 4.076 4.823 0.043 2 0 "[ . 1 . 2]" 1
213 1 18 LEU H 1 73 ILE MD . . 4.720 4.184 4.003 4.465 . 0 0 "[ . 1 . 2]" 1
214 1 18 LEU H 1 77 ALA MB . . 5.500 4.735 4.407 5.061 . 0 0 "[ . 1 . 2]" 1
215 1 18 LEU HA 1 20 GLU H . . 4.010 4.059 3.788 4.082 0.072 6 0 "[ . 1 . 2]" 1
216 1 18 LEU HA 1 21 ILE H . . 3.440 3.305 3.089 3.514 0.074 19 0 "[ . 1 . 2]" 1
217 1 18 LEU HA 1 22 TRP H . . 4.470 4.263 3.853 4.530 0.060 11 0 "[ . 1 . 2]" 1
218 1 18 LEU HA 1 22 TRP HD1 . . 4.810 4.280 3.682 4.856 0.046 16 0 "[ . 1 . 2]" 1
219 1 18 LEU HA 1 58 TYR QE . . 4.460 4.151 3.682 4.522 0.062 15 0 "[ . 1 . 2]" 1
220 1 18 LEU HB2 1 19 ALA H . . 3.140 2.699 2.553 2.879 . 0 0 "[ . 1 . 2]" 1
221 1 18 LEU HB2 1 20 GLU H . . 4.950 4.999 4.955 5.014 0.064 19 0 "[ . 1 . 2]" 1
222 1 18 LEU HB3 1 19 ALA H . . 3.960 3.589 3.381 3.724 . 0 0 "[ . 1 . 2]" 1
223 1 18 LEU HB3 1 20 GLU H . . 5.500 5.342 5.172 5.485 . 0 0 "[ . 1 . 2]" 1
224 1 18 LEU QD 1 19 ALA H . . 4.520 3.936 3.667 4.082 . 0 0 "[ . 1 . 2]" 1
225 1 18 LEU QD 1 20 GLU H . . 5.440 5.315 5.222 5.405 . 0 0 "[ . 1 . 2]" 1
226 1 18 LEU QD 1 58 TYR QE . . 2.880 2.705 2.327 2.985 0.105 18 0 "[ . 1 . 2]" 1
227 1 18 LEU QD 1 76 LEU H . . 4.280 4.050 3.691 4.333 0.053 1 0 "[ . 1 . 2]" 1
228 1 18 LEU QD 1 77 ALA H . . 3.100 2.826 2.525 3.201 0.101 17 0 "[ . 1 . 2]" 1
229 1 18 LEU QD 1 78 GLN H . . 4.600 4.562 4.378 4.691 0.091 14 0 "[ . 1 . 2]" 1
230 1 18 LEU QD 1 79 TYR H . . 5.180 5.088 4.855 5.263 0.083 1 0 "[ . 1 . 2]" 1
231 1 18 LEU QD 1 80 VAL H . . 4.310 4.114 3.825 4.366 0.056 6 0 "[ . 1 . 2]" 1
232 1 18 LEU HG 1 58 TYR QD . . 5.460 4.950 4.514 5.405 . 0 0 "[ . 1 . 2]" 1
233 1 18 LEU HG 1 58 TYR QE . . 4.320 3.470 3.170 3.780 . 0 0 "[ . 1 . 2]" 1
234 1 19 ALA H 1 19 ALA MB . . 2.540 2.213 2.172 2.250 . 0 0 "[ . 1 . 2]" 1
235 1 19 ALA H 1 20 GLU H . . 2.960 2.721 2.613 2.846 . 0 0 "[ . 1 . 2]" 1
236 1 19 ALA H 1 20 GLU QG . . 4.990 4.441 4.157 4.707 . 0 0 "[ . 1 . 2]" 1
237 1 19 ALA H 1 21 ILE H . . 4.800 4.381 4.148 4.509 . 0 0 "[ . 1 . 2]" 1
238 1 19 ALA H 1 22 TRP H . . 5.120 4.900 4.760 5.124 0.004 9 0 "[ . 1 . 2]" 1
239 1 19 ALA H 1 22 TRP HB2 . . 5.500 5.234 4.957 5.491 . 0 0 "[ . 1 . 2]" 1
240 1 19 ALA H 1 73 ILE MD . . 3.370 2.788 2.626 2.930 . 0 0 "[ . 1 . 2]" 1
241 1 19 ALA H 1 73 ILE HG12 . . 5.500 5.540 5.387 5.562 0.062 8 0 "[ . 1 . 2]" 1
242 1 19 ALA H 1 73 ILE HG13 . . 4.680 4.247 4.131 4.459 . 0 0 "[ . 1 . 2]" 1
243 1 19 ALA H 1 73 ILE MG . . 3.340 3.273 2.994 3.407 0.067 14 0 "[ . 1 . 2]" 1
244 1 19 ALA HA 1 22 TRP HD1 . . 5.420 4.524 4.165 4.820 . 0 0 "[ . 1 . 2]" 1
245 1 19 ALA MB 1 20 GLU H . . 2.870 2.724 2.602 2.905 0.035 8 0 "[ . 1 . 2]" 1
246 1 19 ALA MB 1 21 ILE H . . 5.120 4.704 4.537 4.810 . 0 0 "[ . 1 . 2]" 1
247 1 19 ALA MB 1 22 TRP H . . 5.070 4.655 4.467 4.849 . 0 0 "[ . 1 . 2]" 1
248 1 20 GLU H 1 20 GLU QB . . 2.580 2.496 2.274 2.664 0.084 19 0 "[ . 1 . 2]" 1
249 1 20 GLU H 1 20 GLU HG2 . . 3.420 3.078 2.130 3.486 0.066 9 0 "[ . 1 . 2]" 1
250 1 20 GLU H 1 20 GLU QG . . 2.930 2.437 2.090 2.736 . 0 0 "[ . 1 . 2]" 1
251 1 20 GLU H 1 20 GLU HG3 . . 3.420 2.776 2.222 3.468 0.048 2 0 "[ . 1 . 2]" 1
252 1 20 GLU H 1 21 ILE H . . 2.940 2.615 2.423 2.771 . 0 0 "[ . 1 . 2]" 1
253 1 20 GLU H 1 21 ILE MD . . 5.500 4.939 4.093 5.316 . 0 0 "[ . 1 . 2]" 1
254 1 20 GLU H 1 21 ILE QG . . 4.260 4.154 3.752 4.317 0.057 10 0 "[ . 1 . 2]" 1
255 1 20 GLU H 1 22 TRP H . . 4.300 4.037 3.930 4.134 . 0 0 "[ . 1 . 2]" 1
256 1 20 GLU H 1 22 TRP HB2 . . 5.040 5.016 4.829 5.100 0.060 11 0 "[ . 1 . 2]" 1
257 1 20 GLU H 1 23 GLU H . . 5.090 4.898 4.674 5.139 0.049 10 0 "[ . 1 . 2]" 1
258 1 20 GLU H 1 23 GLU QG . . 5.290 5.060 4.820 5.269 . 0 0 "[ . 1 . 2]" 1
259 1 20 GLU H 1 73 ILE MD . . 4.570 4.519 4.424 4.620 0.050 6 0 "[ . 1 . 2]" 1
260 1 20 GLU H 1 73 ILE MG . . 5.460 5.472 5.237 5.539 0.079 14 0 "[ . 1 . 2]" 1
261 1 20 GLU QB 1 21 ILE H . . 3.010 2.623 2.338 3.110 0.100 20 0 "[ . 1 . 2]" 1
262 1 20 GLU QB 1 22 TRP H . . 5.090 4.684 4.509 4.952 . 0 0 "[ . 1 . 2]" 1
263 1 20 GLU QG 1 21 ILE H . . 4.470 3.902 1.981 4.264 . 0 0 "[ . 1 . 2]" 1
264 1 21 ILE H 1 21 ILE HB . . 2.730 2.497 2.292 2.679 . 0 0 "[ . 1 . 2]" 1
265 1 21 ILE H 1 21 ILE MD . . 3.720 3.225 2.597 3.638 . 0 0 "[ . 1 . 2]" 1
266 1 21 ILE H 1 21 ILE HG12 . . 3.580 2.820 2.049 3.622 0.042 18 0 "[ . 1 . 2]" 1
267 1 21 ILE H 1 21 ILE QG . . 2.710 2.141 2.037 2.270 . 0 0 "[ . 1 . 2]" 1
268 1 21 ILE H 1 21 ILE HG13 . . 3.580 2.905 2.088 3.639 0.059 16 0 "[ . 1 . 2]" 1
269 1 21 ILE H 1 22 TRP H . . 3.150 2.731 2.595 2.926 . 0 0 "[ . 1 . 2]" 1
270 1 21 ILE H 1 22 TRP HB2 . . 5.040 4.737 4.485 4.900 . 0 0 "[ . 1 . 2]" 1
271 1 21 ILE H 1 22 TRP HD1 . . 4.790 4.554 4.284 4.829 0.039 19 0 "[ . 1 . 2]" 1
272 1 21 ILE H 1 23 GLU H . . 4.360 4.285 4.134 4.393 0.033 4 0 "[ . 1 . 2]" 1
273 1 21 ILE H 1 24 ARG QG . . 4.790 4.597 4.231 4.857 0.067 4 0 "[ . 1 . 2]" 1
274 1 21 ILE H 1 50 VAL QG . . 5.440 5.307 4.985 5.530 0.090 20 0 "[ . 1 . 2]" 1
275 1 21 ILE HA 1 22 TRP HD1 . . 5.500 5.101 4.894 5.282 . 0 0 "[ . 1 . 2]" 1
276 1 21 ILE HA 1 24 ARG H . . 3.520 3.415 3.040 3.579 0.059 6 0 "[ . 1 . 2]" 1
277 1 21 ILE HB 1 22 TRP H . . 3.020 2.847 2.677 3.025 0.005 17 0 "[ . 1 . 2]" 1
278 1 21 ILE HB 1 22 TRP HD1 . . 3.820 3.078 2.591 3.331 . 0 0 "[ . 1 . 2]" 1
279 1 21 ILE MD 1 22 TRP H . . 4.770 4.724 4.509 4.823 0.053 10 0 "[ . 1 . 2]" 1
280 1 21 ILE QG 1 22 TRP H . . 4.240 4.153 3.892 4.287 0.047 17 0 "[ . 1 . 2]" 1
281 1 21 ILE MG 1 22 TRP H . . 3.750 3.612 3.404 3.768 0.018 4 0 "[ . 1 . 2]" 1
282 1 21 ILE MG 1 22 TRP HD1 . . 3.320 3.278 2.848 3.400 0.080 9 0 "[ . 1 . 2]" 1
283 1 22 TRP H 1 22 TRP HB2 . . 2.910 2.295 2.197 2.393 . 0 0 "[ . 1 . 2]" 1
284 1 22 TRP H 1 22 TRP HD1 . . 3.070 2.576 2.434 2.780 . 0 0 "[ . 1 . 2]" 1
285 1 22 TRP H 1 22 TRP HE1 . . 5.140 4.956 4.749 5.185 0.045 4 0 "[ . 1 . 2]" 1
286 1 22 TRP H 1 22 TRP HE3 . . 5.500 5.526 5.461 5.552 0.052 5 0 "[ . 1 . 2]" 1
287 1 22 TRP H 1 23 GLU H . . 3.180 2.714 2.631 2.856 . 0 0 "[ . 1 . 2]" 1
288 1 22 TRP H 1 24 ARG H . . 4.360 4.202 3.975 4.400 0.040 13 0 "[ . 1 . 2]" 1
289 1 22 TRP H 1 24 ARG QG . . 5.010 4.956 4.488 5.092 0.082 7 0 "[ . 1 . 2]" 1
290 1 22 TRP H 1 26 LEU QD . . 5.440 5.284 4.836 5.525 0.085 2 0 "[ . 1 . 2]" 1
291 1 22 TRP H 1 50 VAL QG . . 4.490 4.118 3.916 4.380 . 0 0 "[ . 1 . 2]" 1
292 1 22 TRP H 1 73 ILE MD . . 4.270 3.758 3.563 4.019 . 0 0 "[ . 1 . 2]" 1
293 1 22 TRP HA 1 22 TRP HD1 . . 3.520 2.739 2.544 2.904 . 0 0 "[ . 1 . 2]" 1
294 1 22 TRP HA 1 22 TRP HE3 . . 5.000 4.785 4.670 4.852 . 0 0 "[ . 1 . 2]" 1
295 1 22 TRP HA 1 25 VAL H . . 3.730 3.457 3.324 3.708 . 0 0 "[ . 1 . 2]" 1
296 1 22 TRP HA 1 26 LEU H . . 3.940 3.725 3.407 3.979 0.039 6 0 "[ . 1 . 2]" 1
297 1 22 TRP HA 1 37 PHE QE . . 4.240 3.916 3.469 4.323 0.083 8 0 "[ . 1 . 2]" 1
298 1 22 TRP HB2 1 23 GLU H . . 3.230 2.757 2.634 2.912 . 0 0 "[ . 1 . 2]" 1
299 1 22 TRP HB3 1 22 TRP HE3 . . 3.230 2.536 2.463 2.631 . 0 0 "[ . 1 . 2]" 1
300 1 22 TRP HB3 1 25 VAL H . . 5.500 5.226 5.020 5.536 0.036 13 0 "[ . 1 . 2]" 1
301 1 22 TRP HB3 1 26 LEU H . . 4.880 4.568 4.394 4.794 . 0 0 "[ . 1 . 2]" 1
302 1 22 TRP HD1 1 23 GLU H . . 4.870 4.920 4.897 4.930 0.060 4 0 "[ . 1 . 2]" 1
303 1 22 TRP HD1 1 50 VAL MG1 . . 4.030 2.538 2.242 2.888 . 0 0 "[ . 1 . 2]" 1
304 1 22 TRP HD1 1 50 VAL QG . . 3.190 2.498 2.223 2.830 . 0 0 "[ . 1 . 2]" 1
305 1 22 TRP HD1 1 50 VAL MG2 . . 4.030 3.843 3.294 4.106 0.076 15 0 "[ . 1 . 2]" 1
306 1 22 TRP HE1 1 50 VAL QG . . 4.180 2.538 2.226 2.823 . 0 0 "[ . 1 . 2]" 1
307 1 22 TRP HE1 1 76 LEU MD2 . . 4.990 4.799 4.557 5.027 0.037 17 0 "[ . 1 . 2]" 1
308 1 22 TRP HE3 1 26 LEU QD . . 3.570 2.829 2.360 3.358 . 0 0 "[ . 1 . 2]" 1
309 1 22 TRP HE3 1 31 ILE MD . . 3.210 2.376 2.103 2.931 . 0 0 "[ . 1 . 2]" 1
310 1 22 TRP HE3 1 31 ILE MG . . 3.100 2.345 2.128 2.833 . 0 0 "[ . 1 . 2]" 1
311 1 22 TRP HE3 1 37 PHE QD . . 4.370 3.392 3.043 3.891 . 0 0 "[ . 1 . 2]" 1
312 1 22 TRP HE3 1 40 ILE MD . . 3.210 2.589 2.282 2.857 . 0 0 "[ . 1 . 2]" 1
313 1 22 TRP HE3 1 73 ILE MD . . 3.840 3.729 3.373 3.885 0.045 10 0 "[ . 1 . 2]" 1
314 1 22 TRP HE3 1 73 ILE HG12 . . 4.470 3.675 3.482 3.979 . 0 0 "[ . 1 . 2]" 1
315 1 22 TRP HH2 1 36 ASN HA . . 4.610 4.104 3.701 4.593 . 0 0 "[ . 1 . 2]" 1
316 1 22 TRP HH2 1 37 PHE H . . 3.530 2.837 2.611 3.004 . 0 0 "[ . 1 . 2]" 1
317 1 22 TRP HH2 1 37 PHE HA . . 4.310 3.899 3.654 4.133 . 0 0 "[ . 1 . 2]" 1
318 1 22 TRP HH2 1 37 PHE HB2 . . 3.580 2.545 2.305 2.708 . 0 0 "[ . 1 . 2]" 1
319 1 22 TRP HH2 1 37 PHE HB3 . . 4.210 3.935 3.759 4.113 . 0 0 "[ . 1 . 2]" 1
320 1 22 TRP HH2 1 37 PHE QD . . 4.200 3.995 3.439 4.248 0.048 14 0 "[ . 1 . 2]" 1
321 1 22 TRP HH2 1 40 ILE MD . . 4.440 4.171 4.006 4.393 . 0 0 "[ . 1 . 2]" 1
322 1 22 TRP HH2 1 71 PRO HA . . 4.820 3.934 3.682 4.150 . 0 0 "[ . 1 . 2]" 1
323 1 22 TRP HH2 1 72 THR H . . 4.510 3.670 3.475 3.903 . 0 0 "[ . 1 . 2]" 1
324 1 22 TRP HH2 1 72 THR HA . . 3.280 2.189 2.063 2.391 . 0 0 "[ . 1 . 2]" 1
325 1 22 TRP HH2 1 72 THR MG . . 4.290 3.818 3.629 4.051 . 0 0 "[ . 1 . 2]" 1
326 1 22 TRP HH2 1 73 ILE H . . 4.200 3.076 2.899 3.324 . 0 0 "[ . 1 . 2]" 1
327 1 22 TRP HH2 1 73 ILE MD . . 4.650 4.213 3.956 4.420 . 0 0 "[ . 1 . 2]" 1
328 1 22 TRP HH2 1 73 ILE HG12 . . 4.740 3.647 3.402 3.953 . 0 0 "[ . 1 . 2]" 1
329 1 22 TRP HH2 1 76 LEU MD1 . . 4.830 4.182 4.018 4.345 . 0 0 "[ . 1 . 2]" 1
330 1 22 TRP HZ2 1 37 PHE H . . 5.080 4.982 4.771 5.139 0.059 20 0 "[ . 1 . 2]" 1
331 1 22 TRP HZ2 1 37 PHE HB2 . . 4.030 3.547 3.324 3.778 . 0 0 "[ . 1 . 2]" 1
332 1 22 TRP HZ2 1 37 PHE HB3 . . 5.180 4.956 4.700 5.171 . 0 0 "[ . 1 . 2]" 1
333 1 22 TRP HZ2 1 37 PHE QD . . 4.310 4.100 3.463 4.364 0.054 15 0 "[ . 1 . 2]" 1
334 1 22 TRP HZ2 1 50 VAL QG . . 4.740 4.422 3.953 4.794 0.054 6 0 "[ . 1 . 2]" 1
335 1 22 TRP HZ2 1 67 LEU MD1 . . 4.430 4.037 2.880 4.494 0.064 3 0 "[ . 1 . 2]" 1
336 1 22 TRP HZ2 1 67 LEU QD . . 3.700 3.414 2.820 3.760 0.060 19 0 "[ . 1 . 2]" 1
337 1 22 TRP HZ2 1 67 LEU MD2 . . 4.430 3.804 3.332 4.107 . 0 0 "[ . 1 . 2]" 1
338 1 22 TRP HZ2 1 71 PRO HA . . 4.500 4.181 3.902 4.415 . 0 0 "[ . 1 . 2]" 1
339 1 22 TRP HZ2 1 72 THR H . . 4.760 4.024 3.754 4.271 . 0 0 "[ . 1 . 2]" 1
340 1 22 TRP HZ2 1 72 THR HA . . 4.280 4.010 3.822 4.277 . 0 0 "[ . 1 . 2]" 1
341 1 22 TRP HZ2 1 73 ILE H . . 5.150 4.062 3.750 4.374 . 0 0 "[ . 1 . 2]" 1
342 1 22 TRP HZ2 1 73 ILE HA . . 4.290 3.450 3.142 3.663 . 0 0 "[ . 1 . 2]" 1
343 1 22 TRP HZ2 1 73 ILE MD . . 4.690 3.211 3.022 3.518 . 0 0 "[ . 1 . 2]" 1
344 1 22 TRP HZ2 1 73 ILE HG12 . . 4.920 3.959 3.713 4.299 . 0 0 "[ . 1 . 2]" 1
345 1 22 TRP HZ2 1 76 LEU H . . 4.960 4.838 4.702 4.994 0.034 9 0 "[ . 1 . 2]" 1
346 1 22 TRP HZ2 1 76 LEU HB2 . . 4.470 4.177 3.996 4.408 . 0 0 "[ . 1 . 2]" 1
347 1 22 TRP HZ2 1 76 LEU HB3 . . 5.180 4.919 4.776 5.076 . 0 0 "[ . 1 . 2]" 1
348 1 22 TRP HZ2 1 76 LEU MD1 . . 3.160 2.140 2.054 2.268 . 0 0 "[ . 1 . 2]" 1
349 1 22 TRP HZ2 1 76 LEU MD2 . . 3.670 3.546 3.372 3.724 0.054 15 0 "[ . 1 . 2]" 1
350 1 22 TRP HZ2 1 76 LEU HG . . 4.590 2.648 2.519 2.920 . 0 0 "[ . 1 . 2]" 1
351 1 22 TRP HZ3 1 26 LEU QD . . 4.610 4.043 3.623 4.538 . 0 0 "[ . 1 . 2]" 1
352 1 22 TRP HZ3 1 31 ILE MD . . 4.170 3.869 3.447 4.206 0.036 19 0 "[ . 1 . 2]" 1
353 1 22 TRP HZ3 1 31 ILE MG . . 3.920 3.303 2.889 3.988 0.068 20 0 "[ . 1 . 2]" 1
354 1 22 TRP HZ3 1 37 PHE H . . 4.120 3.198 3.020 3.487 . 0 0 "[ . 1 . 2]" 1
355 1 22 TRP HZ3 1 37 PHE HA . . 3.680 2.796 2.544 2.983 . 0 0 "[ . 1 . 2]" 1
356 1 22 TRP HZ3 1 37 PHE HB2 . . 4.010 3.256 2.978 3.575 . 0 0 "[ . 1 . 2]" 1
357 1 22 TRP HZ3 1 37 PHE QD . . 4.430 3.681 3.373 4.046 . 0 0 "[ . 1 . 2]" 1
358 1 22 TRP HZ3 1 40 ILE MD . . 3.490 2.282 2.131 2.484 . 0 0 "[ . 1 . 2]" 1
359 1 22 TRP HZ3 1 40 ILE HG13 . . 4.620 4.586 4.410 4.685 0.065 4 0 "[ . 1 . 2]" 1
360 1 22 TRP HZ3 1 72 THR HA . . 4.270 3.710 3.508 3.936 . 0 0 "[ . 1 . 2]" 1
361 1 22 TRP HZ3 1 73 ILE H . . 4.840 3.948 3.698 4.173 . 0 0 "[ . 1 . 2]" 1
362 1 22 TRP HZ3 1 73 ILE MD . . 4.520 4.452 4.070 4.594 0.074 8 0 "[ . 1 . 2]" 1
363 1 23 GLU H 1 23 GLU HB2 . . 2.980 2.456 2.203 2.703 . 0 0 "[ . 1 . 2]" 1
364 1 23 GLU H 1 23 GLU QG . . 2.970 2.274 1.996 2.539 . 0 0 "[ . 1 . 2]" 1
365 1 23 GLU H 1 24 ARG H . . 3.060 2.731 2.583 2.884 . 0 0 "[ . 1 . 2]" 1
366 1 23 GLU H 1 24 ARG QG . . 4.110 4.112 3.808 4.184 0.074 3 0 "[ . 1 . 2]" 1
367 1 23 GLU H 1 25 VAL H . . 4.930 4.258 4.114 4.482 . 0 0 "[ . 1 . 2]" 1
368 1 23 GLU H 1 26 LEU QD . . 5.190 4.742 4.195 5.113 . 0 0 "[ . 1 . 2]" 1
369 1 23 GLU HA 1 26 LEU H . . 4.360 3.862 3.588 4.077 . 0 0 "[ . 1 . 2]" 1
370 1 23 GLU HA 1 27 GLY H . . 3.520 3.428 2.865 3.587 0.067 5 0 "[ . 1 . 2]" 1
371 1 23 GLU HA 1 28 VAL H . . 3.210 2.689 2.383 2.835 . 0 0 "[ . 1 . 2]" 1
372 1 23 GLU HA 1 29 SER H . . 5.500 5.421 5.189 5.565 0.065 10 0 "[ . 1 . 2]" 1
373 1 23 GLU HA 1 30 GLY H . . 5.500 5.473 5.006 5.567 0.067 10 0 "[ . 1 . 2]" 1
374 1 23 GLU HB2 1 24 ARG H . . 3.200 2.740 2.430 2.972 . 0 0 "[ . 1 . 2]" 1
375 1 23 GLU HB2 1 25 VAL H . . 5.270 5.137 4.814 5.333 0.063 7 0 "[ . 1 . 2]" 1
376 1 23 GLU HB3 1 28 VAL H . . 4.230 3.972 3.331 4.268 0.038 16 0 "[ . 1 . 2]" 1
377 1 23 GLU HB3 1 29 SER H . . 5.500 5.490 5.367 5.555 0.055 9 0 "[ . 1 . 2]" 1
378 1 23 GLU QG 1 24 ARG H . . 4.290 4.169 4.003 4.318 0.028 14 0 "[ . 1 . 2]" 1
379 1 23 GLU QG 1 28 VAL H . . 4.510 4.037 3.746 4.598 0.088 10 0 "[ . 1 . 2]" 1
380 1 23 GLU QG 1 30 GLY H . . 3.910 3.026 2.457 3.528 . 0 0 "[ . 1 . 2]" 1
381 1 23 GLU HG2 1 28 VAL H . . 5.380 4.189 3.845 5.202 . 0 0 "[ . 1 . 2]" 1
382 1 23 GLU HG2 1 30 GLY H . . 4.780 3.181 2.523 4.408 . 0 0 "[ . 1 . 2]" 1
383 1 23 GLU HG2 1 31 ILE H . . 4.300 3.798 3.285 4.301 0.001 10 0 "[ . 1 . 2]" 1
384 1 23 GLU HG3 1 28 VAL H . . 5.380 5.367 5.122 5.446 0.066 19 0 "[ . 1 . 2]" 1
385 1 23 GLU HG3 1 30 GLY H . . 4.780 3.905 3.377 4.209 . 0 0 "[ . 1 . 2]" 1
386 1 23 GLU HG3 1 31 ILE H . . 4.300 3.808 3.436 4.369 0.069 10 0 "[ . 1 . 2]" 1
387 1 24 ARG H 1 24 ARG HA . . 2.920 2.873 2.803 2.936 0.016 16 0 "[ . 1 . 2]" 1
388 1 24 ARG H 1 24 ARG QB . . 2.720 2.583 2.400 2.782 0.062 13 0 "[ . 1 . 2]" 1
389 1 24 ARG H 1 24 ARG QD . . 3.980 3.775 2.955 4.064 0.084 5 0 "[ . 1 . 2]" 1
390 1 24 ARG H 1 24 ARG QG . . 3.120 2.092 1.887 2.318 . 0 0 "[ . 1 . 2]" 1
391 1 24 ARG H 1 25 VAL H . . 2.910 2.704 2.538 2.856 . 0 0 "[ . 1 . 2]" 1
392 1 24 ARG H 1 25 VAL QG . . 4.070 4.049 3.620 4.157 0.087 13 0 "[ . 1 . 2]" 1
393 1 24 ARG H 1 28 VAL H . . 5.500 5.503 5.266 5.571 0.071 16 0 "[ . 1 . 2]" 1
394 1 24 ARG QB 1 25 VAL H . . 3.190 2.847 2.503 3.281 0.091 13 0 "[ . 1 . 2]" 1
395 1 24 ARG QD 1 25 VAL H . . 5.500 5.121 4.409 5.553 0.053 18 0 "[ . 1 . 2]" 1
396 1 24 ARG QG 1 25 VAL H . . 4.070 3.968 2.289 4.148 0.078 2 0 "[ . 1 . 2]" 1
397 1 25 VAL H 1 25 VAL HB . . 3.540 2.646 2.364 3.598 0.058 15 0 "[ . 1 . 2]" 1
398 1 25 VAL H 1 25 VAL QG . . 2.690 2.324 2.011 2.558 . 0 0 "[ . 1 . 2]" 1
399 1 25 VAL H 1 26 LEU H . . 2.950 2.466 2.063 2.750 . 0 0 "[ . 1 . 2]" 1
400 1 25 VAL H 1 26 LEU HA . . 5.210 5.133 4.843 5.275 0.065 13 0 "[ . 1 . 2]" 1
401 1 25 VAL H 1 26 LEU MD1 . . 5.500 5.141 4.693 5.552 0.052 13 0 "[ . 1 . 2]" 1
402 1 25 VAL H 1 26 LEU MD2 . . 5.500 5.298 4.973 5.557 0.057 12 0 "[ . 1 . 2]" 1
403 1 25 VAL H 1 26 LEU HG . . 5.500 4.297 3.925 4.651 . 0 0 "[ . 1 . 2]" 1
404 1 25 VAL H 1 27 GLY H . . 3.980 3.661 3.270 3.867 . 0 0 "[ . 1 . 2]" 1
405 1 25 VAL H 1 27 GLY QA . . 5.120 5.108 4.791 5.194 0.074 11 0 "[ . 1 . 2]" 1
406 1 25 VAL HA 1 27 GLY H . . 5.290 4.435 4.249 4.907 . 0 0 "[ . 1 . 2]" 1
407 1 25 VAL HB 1 26 LEU H . . 3.050 2.569 2.320 3.122 0.072 18 0 "[ . 1 . 2]" 1
408 1 25 VAL HB 1 37 PHE QE . . 4.810 3.877 3.663 4.307 . 0 0 "[ . 1 . 2]" 1
409 1 25 VAL QG 1 26 LEU H . . 3.610 3.061 1.956 3.367 . 0 0 "[ . 1 . 2]" 1
410 1 25 VAL QG 1 37 PHE QE . . 3.810 3.403 2.662 3.853 0.043 6 0 "[ . 1 . 2]" 1
411 1 25 VAL QG 1 37 PHE HZ . . 3.960 3.401 3.073 3.729 . 0 0 "[ . 1 . 2]" 1
412 1 25 VAL QG 1 47 ALA H . . 5.150 4.900 4.465 5.233 0.083 15 0 "[ . 1 . 2]" 1
413 1 25 VAL QG 1 49 ALA H . . 4.220 4.108 3.762 4.310 0.090 20 0 "[ . 1 . 2]" 1
414 1 25 VAL QG 1 50 VAL H . . 3.330 3.136 2.825 3.406 0.076 20 0 "[ . 1 . 2]" 1
415 1 25 VAL QG 1 51 ALA H . . 5.380 4.830 4.607 5.079 . 0 0 "[ . 1 . 2]" 1
416 1 25 VAL MG1 1 26 LEU H . . 4.260 3.474 3.096 4.049 . 0 0 "[ . 1 . 2]" 1
417 1 25 VAL MG1 1 27 GLY H . . 5.500 5.088 4.861 5.557 0.057 18 0 "[ . 1 . 2]" 1
418 1 25 VAL MG1 1 37 PHE QE . . 4.410 3.727 3.121 4.502 0.092 18 0 "[ . 1 . 2]" 1
419 1 25 VAL MG2 1 26 LEU H . . 4.260 3.646 1.960 3.956 . 0 0 "[ . 1 . 2]" 1
420 1 25 VAL MG2 1 27 GLY H . . 5.500 5.207 4.202 5.539 0.039 10 0 "[ . 1 . 2]" 1
421 1 25 VAL MG2 1 37 PHE QE . . 4.410 4.318 2.681 4.512 0.102 11 0 "[ . 1 . 2]" 1
422 1 26 LEU H 1 26 LEU HB2 . . 2.900 2.432 2.362 2.528 . 0 0 "[ . 1 . 2]" 1
423 1 26 LEU H 1 26 LEU HB3 . . 3.710 3.591 3.563 3.641 . 0 0 "[ . 1 . 2]" 1
424 1 26 LEU H 1 26 LEU MD1 . . 3.930 3.556 3.422 3.704 . 0 0 "[ . 1 . 2]" 1
425 1 26 LEU H 1 26 LEU QD . . 3.420 3.117 3.031 3.219 . 0 0 "[ . 1 . 2]" 1
426 1 26 LEU H 1 26 LEU MD2 . . 3.930 3.456 3.276 3.638 . 0 0 "[ . 1 . 2]" 1
427 1 26 LEU H 1 26 LEU HG . . 2.980 2.306 2.165 2.506 . 0 0 "[ . 1 . 2]" 1
428 1 26 LEU H 1 27 GLY H . . 2.950 2.586 2.382 2.738 . 0 0 "[ . 1 . 2]" 1
429 1 26 LEU H 1 27 GLY QA . . 4.490 4.441 4.258 4.565 0.075 8 0 "[ . 1 . 2]" 1
430 1 26 LEU H 1 28 VAL H . . 4.300 4.205 4.037 4.348 0.048 7 0 "[ . 1 . 2]" 1
431 1 26 LEU H 1 28 VAL QG . . 5.390 4.138 3.752 4.794 . 0 0 "[ . 1 . 2]" 1
432 1 26 LEU H 1 37 PHE QE . . 5.320 4.872 4.352 5.378 0.058 4 0 "[ . 1 . 2]" 1
433 1 26 LEU H 1 50 VAL QG . . 5.440 4.587 4.225 4.906 . 0 0 "[ . 1 . 2]" 1
434 1 26 LEU HB2 1 27 GLY H . . 3.550 3.029 2.629 3.269 . 0 0 "[ . 1 . 2]" 1
435 1 26 LEU HB2 1 28 VAL H . . 3.160 3.019 2.676 3.159 . 0 0 "[ . 1 . 2]" 1
436 1 26 LEU HB3 1 27 GLY H . . 4.170 3.982 3.688 4.190 0.020 2 0 "[ . 1 . 2]" 1
437 1 26 LEU HB3 1 28 VAL H . . 4.050 3.882 3.316 4.088 0.038 11 0 "[ . 1 . 2]" 1
438 1 26 LEU QD 1 28 VAL H . . 4.440 4.384 4.015 4.537 0.097 5 0 "[ . 1 . 2]" 1
439 1 26 LEU QD 1 37 PHE H . . 5.360 5.193 4.935 5.457 0.097 11 0 "[ . 1 . 2]" 1
440 1 26 LEU QD 1 37 PHE QD . . 3.590 2.529 2.265 2.867 . 0 0 "[ . 1 . 2]" 1
441 1 26 LEU QD 1 37 PHE QE . . 3.220 2.505 2.310 2.882 . 0 0 "[ . 1 . 2]" 1
442 1 26 LEU QD 1 37 PHE HZ . . 3.840 3.028 2.668 3.394 . 0 0 "[ . 1 . 2]" 1
443 1 26 LEU QD 1 38 PHE H . . 5.440 5.283 4.943 5.525 0.085 11 0 "[ . 1 . 2]" 1
444 1 26 LEU QD 1 40 ILE H . . 4.790 4.263 3.934 4.570 . 0 0 "[ . 1 . 2]" 1
445 1 26 LEU QD 1 42 GLY H . . 3.590 2.903 2.584 3.541 . 0 0 "[ . 1 . 2]" 1
446 1 26 LEU QD 1 43 HIS H . . 4.410 3.919 3.700 4.133 . 0 0 "[ . 1 . 2]" 1
447 1 26 LEU QD 1 46 LYS H . . 5.440 5.351 4.965 5.519 0.079 3 0 "[ . 1 . 2]" 1
448 1 26 LEU QD 1 47 ALA H . . 5.210 5.223 4.935 5.306 0.096 5 0 "[ . 1 . 2]" 1
449 1 26 LEU MD1 1 27 GLY H . . 4.970 4.827 4.520 5.016 0.046 2 0 "[ . 1 . 2]" 1
450 1 26 LEU MD1 1 28 VAL H . . 5.500 4.610 4.205 4.802 . 0 0 "[ . 1 . 2]" 1
451 1 26 LEU MD1 1 37 PHE QE . . 3.680 2.914 2.572 3.298 . 0 0 "[ . 1 . 2]" 1
452 1 26 LEU MD1 1 37 PHE HZ . . 4.780 4.478 4.000 4.853 0.073 5 0 "[ . 1 . 2]" 1
453 1 26 LEU MD1 1 42 GLY H . . 4.350 3.863 3.331 4.420 0.070 18 0 "[ . 1 . 2]" 1
454 1 26 LEU MD2 1 27 GLY H . . 4.970 4.832 4.719 4.911 . 0 0 "[ . 1 . 2]" 1
455 1 26 LEU MD2 1 28 VAL H . . 5.500 5.492 5.087 5.587 0.087 10 0 "[ . 1 . 2]" 1
456 1 26 LEU MD2 1 37 PHE QE . . 3.680 2.750 2.494 3.180 . 0 0 "[ . 1 . 2]" 1
457 1 26 LEU MD2 1 37 PHE HZ . . 4.780 3.080 2.710 3.474 . 0 0 "[ . 1 . 2]" 1
458 1 26 LEU MD2 1 42 GLY H . . 4.350 3.031 2.623 3.851 . 0 0 "[ . 1 . 2]" 1
459 1 26 LEU HG 1 27 GLY H . . 4.550 4.526 4.334 4.596 0.046 20 0 "[ . 1 . 2]" 1
460 1 26 LEU HG 1 28 VAL H . . 5.500 5.407 5.156 5.550 0.050 15 0 "[ . 1 . 2]" 1
461 1 27 GLY H 1 27 GLY QA . . 2.710 2.186 2.156 2.232 . 0 0 "[ . 1 . 2]" 1
462 1 27 GLY H 1 28 VAL H . . 2.910 2.478 2.377 2.608 . 0 0 "[ . 1 . 2]" 1
463 1 27 GLY H 1 28 VAL HA . . 5.340 5.171 5.058 5.277 . 0 0 "[ . 1 . 2]" 1
464 1 27 GLY H 1 28 VAL QG . . 4.350 3.574 3.334 3.881 . 0 0 "[ . 1 . 2]" 1
465 1 27 GLY QA 1 28 VAL H . . 3.170 2.822 2.694 2.948 . 0 0 "[ . 1 . 2]" 1
466 1 28 VAL H 1 28 VAL MG1 . . 4.030 3.084 2.496 4.027 . 0 0 "[ . 1 . 2]" 1
467 1 28 VAL H 1 28 VAL QG . . 2.900 2.261 1.898 2.624 . 0 0 "[ . 1 . 2]" 1
468 1 28 VAL H 1 28 VAL MG2 . . 4.030 2.335 1.967 2.659 . 0 0 "[ . 1 . 2]" 1
469 1 28 VAL H 1 29 SER H . . 4.760 4.459 4.322 4.557 . 0 0 "[ . 1 . 2]" 1
470 1 28 VAL H 1 29 SER HA . . 5.160 4.815 4.610 5.212 0.052 17 0 "[ . 1 . 2]" 1
471 1 28 VAL H 1 29 SER QB . . 5.500 5.153 4.901 5.420 . 0 0 "[ . 1 . 2]" 1
472 1 28 VAL H 1 31 ILE MD . . 4.600 4.415 3.881 4.666 0.066 10 0 "[ . 1 . 2]" 1
473 1 28 VAL H 1 31 ILE HG12 . . 5.500 5.407 5.134 5.552 0.052 6 0 "[ . 1 . 2]" 1
474 1 28 VAL HA 1 29 SER H . . 2.670 2.620 2.556 2.714 0.044 19 0 "[ . 1 . 2]" 1
475 1 28 VAL HB 1 29 SER H . . 3.170 2.451 2.146 3.225 0.055 19 0 "[ . 1 . 2]" 1
476 1 28 VAL QG 1 29 SER H . . 3.400 2.822 1.777 3.132 . 0 0 "[ . 1 . 2]" 1
477 1 28 VAL QG 1 30 GLY H . . 4.950 4.391 3.644 5.034 0.084 16 0 "[ . 1 . 2]" 1
478 1 29 SER H 1 29 SER QB . . 3.020 2.797 2.464 3.101 0.081 20 0 "[ . 1 . 2]" 1
479 1 29 SER H 1 30 GLY H . . 4.220 4.152 3.689 4.282 0.062 1 0 "[ . 1 . 2]" 1
480 1 29 SER H 1 30 GLY HA3 . . 5.000 4.764 4.458 5.042 0.042 18 0 "[ . 1 . 2]" 1
481 1 29 SER H 1 31 ILE MD . . 5.060 4.727 3.925 5.000 . 0 0 "[ . 1 . 2]" 1
482 1 29 SER H 1 31 ILE HG12 . . 5.500 5.157 4.849 5.474 . 0 0 "[ . 1 . 2]" 1
483 1 29 SER HA 1 30 GLY H . . 2.890 2.175 2.112 2.259 . 0 0 "[ . 1 . 2]" 1
484 1 29 SER HA 1 31 ILE H . . 4.530 4.114 3.617 4.577 0.047 6 0 "[ . 1 . 2]" 1
485 1 30 GLY H 1 30 GLY HA2 . . 2.600 2.431 2.305 2.595 . 0 0 "[ . 1 . 2]" 1
486 1 30 GLY H 1 31 ILE H . . 2.900 2.308 1.846 2.752 . 0 0 "[ . 1 . 2]" 1
487 1 30 GLY H 1 31 ILE HB . . 4.580 4.336 3.986 4.642 0.062 18 0 "[ . 1 . 2]" 1
488 1 30 GLY H 1 31 ILE MD . . 4.310 4.329 4.082 4.390 0.080 20 0 "[ . 1 . 2]" 1
489 1 30 GLY H 1 31 ILE HG12 . . 4.160 3.277 3.000 3.609 . 0 0 "[ . 1 . 2]" 1
490 1 30 GLY HA2 1 31 ILE H . . 3.230 2.691 2.372 3.061 . 0 0 "[ . 1 . 2]" 1
491 1 31 ILE H 1 31 ILE HB . . 2.790 2.360 2.143 2.554 . 0 0 "[ . 1 . 2]" 1
492 1 31 ILE H 1 31 ILE MD . . 3.540 3.537 3.320 3.625 0.085 17 0 "[ . 1 . 2]" 1
493 1 31 ILE H 1 31 ILE HG12 . . 2.920 2.452 2.305 2.701 . 0 0 "[ . 1 . 2]" 1
494 1 31 ILE H 1 31 ILE MG . . 3.860 3.745 3.579 3.826 . 0 0 "[ . 1 . 2]" 1
495 1 31 ILE H 1 32 GLY H . . 4.690 4.533 4.441 4.663 . 0 0 "[ . 1 . 2]" 1
496 1 31 ILE HA 1 32 GLY H . . 2.570 2.210 2.094 2.314 . 0 0 "[ . 1 . 2]" 1
497 1 31 ILE HB 1 32 GLY H . . 4.380 4.316 4.066 4.427 0.047 20 0 "[ . 1 . 2]" 1
498 1 31 ILE MD 1 32 GLY H . . 3.900 3.788 3.431 3.970 0.070 3 0 "[ . 1 . 2]" 1
499 1 31 ILE HG12 1 32 GLY H . . 5.280 5.193 4.960 5.328 0.048 18 0 "[ . 1 . 2]" 1
500 1 31 ILE MG 1 32 GLY H . . 3.060 2.828 2.432 3.088 0.028 19 0 "[ . 1 . 2]" 1
501 1 31 ILE MG 1 34 LEU H . . 5.500 5.518 5.329 5.580 0.080 15 0 "[ . 1 . 2]" 1
502 1 31 ILE MG 1 35 ASP H . . 4.520 4.297 4.073 4.588 0.068 5 0 "[ . 1 . 2]" 1
503 1 32 GLY H 1 34 LEU H . . 5.050 4.770 4.564 4.973 . 0 0 "[ . 1 . 2]" 1
504 1 32 GLY H 1 34 LEU MD2 . . 4.320 4.099 3.843 4.359 0.039 10 0 "[ . 1 . 2]" 1
505 1 32 GLY H 1 35 ASP H . . 4.340 3.641 3.410 4.001 . 0 0 "[ . 1 . 2]" 1
506 1 32 GLY H 1 35 ASP HB2 . . 4.320 2.748 1.854 4.233 . 0 0 "[ . 1 . 2]" 1
507 1 32 GLY H 1 35 ASP QB . . 3.650 2.404 1.840 3.718 0.068 5 0 "[ . 1 . 2]" 1
508 1 32 GLY H 1 35 ASP HB3 . . 4.320 3.107 2.095 4.160 . 0 0 "[ . 1 . 2]" 1
509 1 32 GLY QA 1 34 LEU H . . 3.750 3.182 3.000 3.349 . 0 0 "[ . 1 . 2]" 1
510 1 32 GLY QA 1 35 ASP H . . 4.410 3.395 3.107 3.764 . 0 0 "[ . 1 . 2]" 1
511 1 32 GLY HA2 1 33 ILE H . . 3.120 2.504 2.298 2.671 . 0 0 "[ . 1 . 2]" 1
512 1 32 GLY HA2 1 34 LEU H . . 4.360 4.259 3.977 4.429 0.069 5 0 "[ . 1 . 2]" 1
513 1 32 GLY HA3 1 33 ILE H . . 3.120 2.644 2.342 2.860 . 0 0 "[ . 1 . 2]" 1
514 1 32 GLY HA3 1 34 LEU H . . 4.360 3.286 3.104 3.468 . 0 0 "[ . 1 . 2]" 1
515 1 33 ILE H 1 33 ILE HB . . 3.680 3.622 3.560 3.727 0.047 15 0 "[ . 1 . 2]" 1
516 1 33 ILE H 1 33 ILE MD . . 5.500 3.728 3.487 3.856 . 0 0 "[ . 1 . 2]" 1
517 1 33 ILE H 1 33 ILE MG . . 2.840 2.245 2.070 2.471 . 0 0 "[ . 1 . 2]" 1
518 1 33 ILE H 1 34 LEU H . . 3.200 2.489 2.209 2.598 . 0 0 "[ . 1 . 2]" 1
519 1 33 ILE H 1 34 LEU HA . . 5.220 5.222 5.014 5.286 0.066 3 0 "[ . 1 . 2]" 1
520 1 33 ILE H 1 34 LEU MD1 . . 2.950 2.678 2.295 2.889 . 0 0 "[ . 1 . 2]" 1
521 1 33 ILE H 1 34 LEU MD2 . . 3.660 3.717 3.467 3.747 0.087 7 0 "[ . 1 . 2]" 1
522 1 33 ILE H 1 35 ASP H . . 4.230 4.046 3.851 4.246 0.016 9 0 "[ . 1 . 2]" 1
523 1 33 ILE H 1 73 ILE HB . . 4.600 4.616 4.509 4.667 0.067 20 0 "[ . 1 . 2]" 1
524 1 33 ILE H 1 74 LYS H . . 5.500 5.548 5.468 5.566 0.066 8 0 "[ . 1 . 2]" 1
525 1 33 ILE HA 1 35 ASP H . . 4.140 4.092 3.848 4.214 0.074 15 0 "[ . 1 . 2]" 1
526 1 33 ILE HA 1 73 ILE H . . 3.840 3.750 3.477 3.899 0.059 12 0 "[ . 1 . 2]" 1
527 1 33 ILE HA 1 74 LYS H . . 3.580 2.909 2.712 3.006 . 0 0 "[ . 1 . 2]" 1
528 1 33 ILE MD 1 34 LEU H . . 4.200 4.204 4.079 4.279 0.079 5 0 "[ . 1 . 2]" 1
529 1 33 ILE MG 1 34 LEU H . . 4.230 4.017 3.952 4.120 . 0 0 "[ . 1 . 2]" 1
530 1 33 ILE MG 1 35 ASP H . . 5.370 5.295 5.164 5.446 0.076 15 0 "[ . 1 . 2]" 1
531 1 34 LEU H 1 34 LEU QB . . 3.060 2.904 2.797 3.008 . 0 0 "[ . 1 . 2]" 1
532 1 34 LEU H 1 34 LEU MD2 . . 3.270 2.199 2.069 2.434 . 0 0 "[ . 1 . 2]" 1
533 1 34 LEU H 1 34 LEU HG . . 3.790 3.804 3.676 3.849 0.059 5 0 "[ . 1 . 2]" 1
534 1 34 LEU H 1 35 ASP H . . 2.710 2.431 2.286 2.634 . 0 0 "[ . 1 . 2]" 1
535 1 34 LEU H 1 35 ASP QB . . 4.240 4.098 3.816 4.320 0.080 5 0 "[ . 1 . 2]" 1
536 1 34 LEU H 1 72 THR MG . . 4.430 4.093 3.901 4.330 . 0 0 "[ . 1 . 2]" 1
537 1 34 LEU H 1 73 ILE HB . . 5.500 4.826 4.614 5.105 . 0 0 "[ . 1 . 2]" 1
538 1 34 LEU H 1 74 LYS H . . 5.430 5.033 4.862 5.291 . 0 0 "[ . 1 . 2]" 1
539 1 34 LEU QB 1 35 ASP H . . 4.010 3.984 3.922 4.054 0.044 15 0 "[ . 1 . 2]" 1
540 1 34 LEU QB 1 36 ASN H . . 5.500 5.473 5.244 5.571 0.071 4 0 "[ . 1 . 2]" 1
541 1 34 LEU MD1 1 35 ASP H . . 4.170 3.796 3.632 3.970 . 0 0 "[ . 1 . 2]" 1
542 1 34 LEU MD2 1 35 ASP H . . 3.940 2.523 2.345 2.674 . 0 0 "[ . 1 . 2]" 1
543 1 34 LEU HG 1 35 ASP H . . 5.020 5.035 4.926 5.079 0.059 11 0 "[ . 1 . 2]" 1
544 1 35 ASP H 1 35 ASP HB2 . . 3.360 2.610 2.097 3.443 0.083 15 0 "[ . 1 . 2]" 1
545 1 35 ASP H 1 35 ASP QB . . 2.810 2.253 2.073 2.760 . 0 0 "[ . 1 . 2]" 1
546 1 35 ASP H 1 35 ASP HB3 . . 3.360 2.945 2.227 3.429 0.069 18 0 "[ . 1 . 2]" 1
547 1 35 ASP H 1 36 ASN H . . 4.480 4.472 4.342 4.535 0.055 2 0 "[ . 1 . 2]" 1
548 1 35 ASP H 1 72 THR HA . . 4.850 4.726 4.330 4.910 0.060 16 0 "[ . 1 . 2]" 1
549 1 35 ASP H 1 72 THR MG . . 4.200 3.220 2.886 3.568 . 0 0 "[ . 1 . 2]" 1
550 1 35 ASP H 1 73 ILE H . . 4.920 4.253 3.828 4.636 . 0 0 "[ . 1 . 2]" 1
551 1 35 ASP HA 1 36 ASN H . . 2.570 2.115 1.964 2.191 . 0 0 "[ . 1 . 2]" 1
552 1 35 ASP QB 1 36 ASN H . . 4.070 3.435 3.009 3.900 . 0 0 "[ . 1 . 2]" 1
553 1 36 ASN H 1 36 ASN QB . . 2.640 2.232 2.084 2.464 . 0 0 "[ . 1 . 2]" 1
554 1 36 ASN H 1 37 PHE H . . 4.560 4.428 4.268 4.564 0.004 7 0 "[ . 1 . 2]" 1
555 1 36 ASN H 1 39 GLN H . . 4.560 4.577 4.362 4.630 0.070 4 0 "[ . 1 . 2]" 1
556 1 36 ASN H 1 39 GLN HB2 . . 4.560 4.273 3.417 4.544 . 0 0 "[ . 1 . 2]" 1
557 1 36 ASN H 1 39 GLN QB . . 3.960 3.228 2.819 3.437 . 0 0 "[ . 1 . 2]" 1
558 1 36 ASN H 1 39 GLN HB3 . . 4.560 3.346 3.002 3.565 . 0 0 "[ . 1 . 2]" 1
559 1 36 ASN H 1 40 ILE MD . . 4.010 3.812 3.438 4.063 0.053 5 0 "[ . 1 . 2]" 1
560 1 36 ASN H 1 72 THR HA . . 5.500 5.496 5.363 5.561 0.061 6 0 "[ . 1 . 2]" 1
561 1 36 ASN H 1 72 THR MG . . 4.060 3.928 3.596 4.137 0.077 4 0 "[ . 1 . 2]" 1
562 1 36 ASN HA 1 37 PHE H . . 2.810 2.177 2.071 2.297 . 0 0 "[ . 1 . 2]" 1
563 1 36 ASN HA 1 38 PHE H . . 4.320 4.128 3.955 4.275 . 0 0 "[ . 1 . 2]" 1
564 1 36 ASN HA 1 39 GLN H . . 5.060 4.390 4.235 4.625 . 0 0 "[ . 1 . 2]" 1
565 1 36 ASN QB 1 39 GLN H . . 3.500 2.474 2.194 2.942 . 0 0 "[ . 1 . 2]" 1
566 1 36 ASN QB 1 40 ILE H . . 4.850 4.095 3.796 4.572 . 0 0 "[ . 1 . 2]" 1
567 1 37 PHE H 1 37 PHE HB2 . . 3.060 2.388 2.295 2.519 . 0 0 "[ . 1 . 2]" 1
568 1 37 PHE H 1 37 PHE HB3 . . 3.280 2.555 2.466 2.696 . 0 0 "[ . 1 . 2]" 1
569 1 37 PHE H 1 37 PHE QD . . 4.360 4.162 4.111 4.234 . 0 0 "[ . 1 . 2]" 1
570 1 37 PHE H 1 38 PHE H . . 3.650 3.074 2.965 3.166 . 0 0 "[ . 1 . 2]" 1
571 1 37 PHE H 1 38 PHE QD . . 4.850 4.829 4.310 4.918 0.068 15 0 "[ . 1 . 2]" 1
572 1 37 PHE H 1 39 GLN H . . 4.520 4.321 4.241 4.449 . 0 0 "[ . 1 . 2]" 1
573 1 37 PHE H 1 40 ILE HB . . 5.500 5.525 5.296 5.571 0.071 8 0 "[ . 1 . 2]" 1
574 1 37 PHE H 1 40 ILE MD . . 4.640 3.542 3.310 3.767 . 0 0 "[ . 1 . 2]" 1
575 1 37 PHE H 1 40 ILE HG13 . . 5.230 4.972 4.756 5.221 . 0 0 "[ . 1 . 2]" 1
576 1 37 PHE H 1 71 PRO HB2 . . 4.050 2.449 2.108 2.667 . 0 0 "[ . 1 . 2]" 1
577 1 37 PHE H 1 71 PRO QG . . 4.380 3.703 3.302 3.963 . 0 0 "[ . 1 . 2]" 1
578 1 37 PHE H 1 72 THR HA . . 4.140 3.570 3.443 3.718 . 0 0 "[ . 1 . 2]" 1
579 1 37 PHE H 1 72 THR MG . . 4.000 3.849 3.640 4.024 0.024 6 0 "[ . 1 . 2]" 1
580 1 37 PHE HA 1 37 PHE QD . . 3.370 2.791 2.596 2.975 . 0 0 "[ . 1 . 2]" 1
581 1 37 PHE HA 1 37 PHE QE . . 4.700 4.693 4.539 4.765 0.065 5 0 "[ . 1 . 2]" 1
582 1 37 PHE HA 1 39 GLN H . . 4.450 4.400 4.184 4.496 0.046 4 0 "[ . 1 . 2]" 1
583 1 37 PHE HA 1 40 ILE H . . 4.530 3.729 3.524 3.931 . 0 0 "[ . 1 . 2]" 1
584 1 37 PHE HA 1 42 GLY H . . 5.290 4.551 4.183 4.922 . 0 0 "[ . 1 . 2]" 1
585 1 37 PHE HB2 1 38 PHE H . . 3.960 3.898 3.787 3.994 0.034 8 0 "[ . 1 . 2]" 1
586 1 37 PHE HB3 1 38 PHE H . . 3.380 2.586 2.462 2.723 . 0 0 "[ . 1 . 2]" 1
587 1 37 PHE HB3 1 38 PHE QD . . 4.290 3.927 3.368 4.252 . 0 0 "[ . 1 . 2]" 1
588 1 37 PHE HB3 1 38 PHE QE . . 4.710 4.317 3.820 4.761 0.051 7 0 "[ . 1 . 2]" 1
589 1 37 PHE HB3 1 39 GLN H . . 4.970 4.978 4.892 5.024 0.054 17 0 "[ . 1 . 2]" 1
590 1 37 PHE HB3 1 72 THR H . . 5.500 5.558 5.548 5.567 0.067 16 0 "[ . 1 . 2]" 1
591 1 37 PHE QD 1 38 PHE H . . 4.210 3.353 3.166 3.475 . 0 0 "[ . 1 . 2]" 1
592 1 37 PHE QD 1 38 PHE HA . . 4.120 3.453 3.220 3.680 . 0 0 "[ . 1 . 2]" 1
593 1 37 PHE QD 1 38 PHE QD . . 4.090 3.336 2.921 3.740 . 0 0 "[ . 1 . 2]" 1
594 1 37 PHE QD 1 38 PHE QE . . 4.090 3.433 2.938 4.032 . 0 0 "[ . 1 . 2]" 1
595 1 37 PHE QD 1 39 GLN H . . 5.500 5.472 5.333 5.556 0.056 9 0 "[ . 1 . 2]" 1
596 1 37 PHE QD 1 40 ILE MD . . 4.230 3.678 3.399 4.007 . 0 0 "[ . 1 . 2]" 1
597 1 37 PHE QD 1 42 GLY HA3 . . 4.060 3.410 3.198 3.703 . 0 0 "[ . 1 . 2]" 1
598 1 37 PHE QD 1 47 ALA MB . . 4.040 3.501 3.167 3.961 . 0 0 "[ . 1 . 2]" 1
599 1 37 PHE QD 1 50 VAL QG . . 4.280 3.573 3.313 3.890 . 0 0 "[ . 1 . 2]" 1
600 1 37 PHE QD 1 67 LEU QD . . 4.060 3.027 2.809 3.411 . 0 0 "[ . 1 . 2]" 1
601 1 37 PHE QD 1 71 PRO HB3 . . 4.070 4.062 3.709 4.132 0.062 14 0 "[ . 1 . 2]" 1
602 1 37 PHE QE 1 38 PHE H . . 5.500 5.495 5.307 5.564 0.064 1 0 "[ . 1 . 2]" 1
603 1 37 PHE QE 1 38 PHE QD . . 4.540 4.105 3.650 4.623 0.083 7 0 "[ . 1 . 2]" 1
604 1 37 PHE QE 1 38 PHE QE . . 4.280 3.643 2.930 4.388 0.108 7 0 "[ . 1 . 2]" 1
605 1 37 PHE QE 1 42 GLY H . . 5.120 4.955 4.671 5.177 0.057 6 0 "[ . 1 . 2]" 1
606 1 37 PHE QE 1 42 GLY HA2 . . 4.660 3.896 3.669 4.158 . 0 0 "[ . 1 . 2]" 1
607 1 37 PHE QE 1 42 GLY HA3 . . 3.980 3.057 2.907 3.310 . 0 0 "[ . 1 . 2]" 1
608 1 37 PHE QE 1 43 HIS H . . 3.570 2.988 2.797 3.605 0.035 2 0 "[ . 1 . 2]" 1
609 1 37 PHE QE 1 43 HIS HA . . 4.290 4.033 3.505 4.363 0.073 11 0 "[ . 1 . 2]" 1
610 1 37 PHE QE 1 46 LYS H . . 4.520 4.461 4.238 4.594 0.074 7 0 "[ . 1 . 2]" 1
611 1 37 PHE QE 1 46 LYS HB2 . . 4.120 2.862 2.452 3.228 . 0 0 "[ . 1 . 2]" 1
612 1 37 PHE QE 1 46 LYS QB . . 3.560 2.748 2.398 3.039 . 0 0 "[ . 1 . 2]" 1
613 1 37 PHE QE 1 46 LYS HB3 . . 4.120 3.608 3.264 4.013 . 0 0 "[ . 1 . 2]" 1
614 1 37 PHE QE 1 47 ALA H . . 3.640 2.796 2.505 2.995 . 0 0 "[ . 1 . 2]" 1
615 1 37 PHE QE 1 47 ALA HA . . 3.640 3.144 2.899 3.432 . 0 0 "[ . 1 . 2]" 1
616 1 37 PHE QE 1 47 ALA MB . . 3.200 2.396 2.191 2.642 . 0 0 "[ . 1 . 2]" 1
617 1 37 PHE QE 1 48 MET H . . 5.250 5.182 5.013 5.307 0.057 12 0 "[ . 1 . 2]" 1
618 1 37 PHE QE 1 50 VAL H . . 5.390 5.052 4.753 5.442 0.052 20 0 "[ . 1 . 2]" 1
619 1 37 PHE QE 1 50 VAL QG . . 3.190 2.224 2.059 2.762 . 0 0 "[ . 1 . 2]" 1
620 1 37 PHE QE 1 67 LEU QD . . 4.190 3.365 3.013 3.607 . 0 0 "[ . 1 . 2]" 1
621 1 37 PHE HZ 1 42 GLY HA2 . . 4.710 4.171 3.707 4.658 . 0 0 "[ . 1 . 2]" 1
622 1 37 PHE HZ 1 46 LYS HA . . 4.310 4.086 3.863 4.358 0.048 7 0 "[ . 1 . 2]" 1
623 1 37 PHE HZ 1 46 LYS HB2 . . 3.890 2.413 2.155 2.657 . 0 0 "[ . 1 . 2]" 1
624 1 37 PHE HZ 1 46 LYS QB . . 3.320 2.143 1.933 2.355 . 0 0 "[ . 1 . 2]" 1
625 1 37 PHE HZ 1 46 LYS HB3 . . 3.890 2.429 2.170 2.829 . 0 0 "[ . 1 . 2]" 1
626 1 37 PHE HZ 1 47 ALA H . . 3.880 3.231 2.812 3.701 . 0 0 "[ . 1 . 2]" 1
627 1 37 PHE HZ 1 47 ALA HA . . 3.620 2.788 2.457 3.038 . 0 0 "[ . 1 . 2]" 1
628 1 37 PHE HZ 1 47 ALA MB . . 4.020 3.626 3.208 3.975 . 0 0 "[ . 1 . 2]" 1
629 1 37 PHE HZ 1 50 VAL H . . 5.120 4.557 4.230 5.104 . 0 0 "[ . 1 . 2]" 1
630 1 37 PHE HZ 1 50 VAL QG . . 3.550 2.607 2.345 3.138 . 0 0 "[ . 1 . 2]" 1
631 1 37 PHE HZ 1 67 LEU QD . . 4.490 4.094 3.553 4.446 . 0 0 "[ . 1 . 2]" 1
632 1 38 PHE H 1 38 PHE HB2 . . 3.780 2.514 2.442 2.599 . 0 0 "[ . 1 . 2]" 1
633 1 38 PHE H 1 38 PHE QB . . 3.020 2.469 2.402 2.544 . 0 0 "[ . 1 . 2]" 1
634 1 38 PHE H 1 38 PHE HB3 . . 3.780 3.605 3.563 3.655 . 0 0 "[ . 1 . 2]" 1
635 1 38 PHE H 1 38 PHE QD . . 3.210 2.781 2.328 2.952 . 0 0 "[ . 1 . 2]" 1
636 1 38 PHE H 1 38 PHE QE . . 4.490 4.399 4.291 4.553 0.063 14 0 "[ . 1 . 2]" 1
637 1 38 PHE H 1 39 GLN H . . 2.900 2.659 2.561 2.805 . 0 0 "[ . 1 . 2]" 1
638 1 38 PHE H 1 39 GLN HA . . 5.310 5.265 5.158 5.361 0.051 11 0 "[ . 1 . 2]" 1
639 1 38 PHE H 1 39 GLN HB2 . . 5.500 4.879 4.585 5.031 . 0 0 "[ . 1 . 2]" 1
640 1 38 PHE H 1 39 GLN QB . . 4.750 4.389 4.240 4.497 . 0 0 "[ . 1 . 2]" 1
641 1 38 PHE H 1 39 GLN HB3 . . 5.500 4.993 4.622 5.285 . 0 0 "[ . 1 . 2]" 1
642 1 38 PHE H 1 40 ILE H . . 4.100 4.133 4.008 4.160 0.060 13 0 "[ . 1 . 2]" 1
643 1 38 PHE H 1 40 ILE HB . . 5.430 5.358 5.167 5.480 0.050 18 0 "[ . 1 . 2]" 1
644 1 38 PHE H 1 40 ILE MD . . 4.850 4.719 4.561 4.907 0.057 18 0 "[ . 1 . 2]" 1
645 1 38 PHE H 1 40 ILE HG13 . . 5.500 5.405 5.135 5.553 0.053 16 0 "[ . 1 . 2]" 1
646 1 38 PHE H 1 71 PRO HB2 . . 4.420 2.801 2.625 3.040 . 0 0 "[ . 1 . 2]" 1
647 1 38 PHE H 1 71 PRO QG . . 4.620 3.776 3.568 3.957 . 0 0 "[ . 1 . 2]" 1
648 1 38 PHE HA 1 38 PHE QD . . 3.260 2.527 2.347 2.840 . 0 0 "[ . 1 . 2]" 1
649 1 38 PHE HA 1 38 PHE QE . . 4.620 4.549 4.426 4.672 0.052 12 0 "[ . 1 . 2]" 1
650 1 38 PHE HA 1 40 ILE H . . 4.950 4.154 3.883 4.394 . 0 0 "[ . 1 . 2]" 1
651 1 38 PHE HA 1 42 GLY H . . 3.590 3.007 2.665 3.383 . 0 0 "[ . 1 . 2]" 1
652 1 38 PHE QB 1 39 GLN H . . 3.490 2.900 2.652 3.122 . 0 0 "[ . 1 . 2]" 1
653 1 38 PHE HB2 1 39 GLN H . . 4.190 2.982 2.718 3.228 . 0 0 "[ . 1 . 2]" 1
654 1 38 PHE HB3 1 39 GLN H . . 4.190 3.964 3.693 4.147 . 0 0 "[ . 1 . 2]" 1
655 1 38 PHE QD 1 39 GLN H . . 4.450 4.428 4.242 4.513 0.063 10 0 "[ . 1 . 2]" 1
656 1 38 PHE QD 1 43 HIS HA . . 3.410 2.494 2.209 3.013 . 0 0 "[ . 1 . 2]" 1
657 1 38 PHE QD 1 43 HIS QB . . 5.020 4.073 3.773 4.544 . 0 0 "[ . 1 . 2]" 1
658 1 38 PHE QD 1 47 ALA MB . . 5.170 4.776 4.220 5.252 0.082 12 0 "[ . 1 . 2]" 1
659 1 38 PHE QD 1 68 PHE HA . . 4.380 4.410 4.256 4.451 0.071 5 0 "[ . 1 . 2]" 1
660 1 38 PHE QD 1 71 PRO HB2 . . 3.750 3.096 2.628 3.382 . 0 0 "[ . 1 . 2]" 1
661 1 38 PHE QD 1 71 PRO HB3 . . 3.650 3.099 2.794 3.345 . 0 0 "[ . 1 . 2]" 1
662 1 38 PHE QD 1 71 PRO HD2 . . 5.500 5.021 4.752 5.310 . 0 0 "[ . 1 . 2]" 1
663 1 38 PHE QD 1 71 PRO HG2 . . 4.210 3.514 3.077 3.770 . 0 0 "[ . 1 . 2]" 1
664 1 38 PHE QD 1 71 PRO QG . . 3.650 2.321 2.113 2.629 . 0 0 "[ . 1 . 2]" 1
665 1 38 PHE QD 1 71 PRO HG3 . . 4.210 2.357 2.152 2.684 . 0 0 "[ . 1 . 2]" 1
666 1 38 PHE QE 1 43 HIS H . . 5.500 4.771 4.243 5.577 0.077 7 0 "[ . 1 . 2]" 1
667 1 38 PHE QE 1 43 HIS HA . . 3.810 3.055 2.673 3.514 . 0 0 "[ . 1 . 2]" 1
668 1 38 PHE QE 1 44 ALA MB . . 5.040 4.065 3.563 4.712 . 0 0 "[ . 1 . 2]" 1
669 1 38 PHE QE 1 47 ALA MB . . 4.090 3.307 2.462 4.130 0.040 12 0 "[ . 1 . 2]" 1
670 1 38 PHE QE 1 67 LEU QD . . 4.230 3.643 3.110 4.336 0.106 9 0 "[ . 1 . 2]" 1
671 1 38 PHE QE 1 68 PHE H . . 4.740 4.760 4.548 4.823 0.083 14 0 "[ . 1 . 2]" 1
672 1 38 PHE QE 1 68 PHE HA . . 3.390 2.078 2.009 2.137 . 0 0 "[ . 1 . 2]" 1
673 1 38 PHE QE 1 68 PHE HB2 . . 4.270 3.403 3.069 3.760 . 0 0 "[ . 1 . 2]" 1
674 1 38 PHE QE 1 70 GLN H . . 5.500 5.402 5.208 5.567 0.067 2 0 "[ . 1 . 2]" 1
675 1 38 PHE QE 1 71 PRO HB2 . . 4.520 3.648 3.423 4.137 . 0 0 "[ . 1 . 2]" 1
676 1 38 PHE QE 1 71 PRO HB3 . . 4.120 2.369 2.129 2.904 . 0 0 "[ . 1 . 2]" 1
677 1 38 PHE QE 1 71 PRO HG2 . . 4.870 4.254 3.927 4.606 . 0 0 "[ . 1 . 2]" 1
678 1 38 PHE QE 1 71 PRO QG . . 4.250 2.648 2.326 3.110 . 0 0 "[ . 1 . 2]" 1
679 1 38 PHE QE 1 71 PRO HG3 . . 4.870 2.676 2.343 3.164 . 0 0 "[ . 1 . 2]" 1
680 1 38 PHE HZ 1 47 ALA MB . . 4.800 3.687 2.969 4.647 . 0 0 "[ . 1 . 2]" 1
681 1 38 PHE HZ 1 67 LEU QB . . 5.130 4.312 3.563 5.101 . 0 0 "[ . 1 . 2]" 1
682 1 38 PHE HZ 1 67 LEU QD . . 4.600 3.383 2.628 4.586 . 0 0 "[ . 1 . 2]" 1
683 1 38 PHE HZ 1 68 PHE H . . 5.150 4.394 4.025 4.768 . 0 0 "[ . 1 . 2]" 1
684 1 38 PHE HZ 1 68 PHE HA . . 4.530 2.528 2.201 3.215 . 0 0 "[ . 1 . 2]" 1
685 1 38 PHE HZ 1 68 PHE QD . . 4.990 4.633 3.982 5.050 0.060 2 0 "[ . 1 . 2]" 1
686 1 39 GLN H 1 39 GLN HB2 . . 3.450 2.472 2.150 2.647 . 0 0 "[ . 1 . 2]" 1
687 1 39 GLN H 1 39 GLN QB . . 2.880 2.218 2.089 2.296 . 0 0 "[ . 1 . 2]" 1
688 1 39 GLN H 1 39 GLN HB3 . . 3.450 2.538 2.303 2.841 . 0 0 "[ . 1 . 2]" 1
689 1 39 GLN H 1 40 ILE H . . 2.880 2.488 2.355 2.617 . 0 0 "[ . 1 . 2]" 1
690 1 39 GLN H 1 40 ILE HA . . 5.180 5.162 5.028 5.235 0.055 7 0 "[ . 1 . 2]" 1
691 1 39 GLN H 1 40 ILE MD . . 4.410 4.445 4.220 4.489 0.079 9 0 "[ . 1 . 2]" 1
692 1 39 GLN H 1 40 ILE HG13 . . 4.380 3.954 3.665 4.294 . 0 0 "[ . 1 . 2]" 1
693 1 39 GLN H 1 41 GLY H . . 5.090 4.087 3.869 4.543 . 0 0 "[ . 1 . 2]" 1
694 1 39 GLN H 1 42 GLY H . . 5.320 4.838 4.496 5.166 . 0 0 "[ . 1 . 2]" 1
695 1 39 GLN QB 1 40 ILE H . . 3.900 2.800 2.652 3.082 . 0 0 "[ . 1 . 2]" 1
696 1 39 GLN HB2 1 40 ILE H . . 4.470 3.960 3.866 4.149 . 0 0 "[ . 1 . 2]" 1
697 1 39 GLN HB3 1 40 ILE H . . 4.470 2.865 2.701 3.228 . 0 0 "[ . 1 . 2]" 1
698 1 40 ILE H 1 40 ILE HB . . 3.550 2.483 2.373 2.559 . 0 0 "[ . 1 . 2]" 1
699 1 40 ILE H 1 40 ILE MD . . 3.190 3.195 3.054 3.268 0.078 11 0 "[ . 1 . 2]" 1
700 1 40 ILE H 1 40 ILE HG12 . . 3.840 3.584 3.423 3.882 0.042 7 0 "[ . 1 . 2]" 1
701 1 40 ILE H 1 40 ILE HG13 . . 3.080 2.161 2.004 2.507 . 0 0 "[ . 1 . 2]" 1
702 1 40 ILE H 1 41 GLY H . . 3.410 2.749 2.551 3.192 . 0 0 "[ . 1 . 2]" 1
703 1 40 ILE H 1 41 GLY QA . . 4.980 4.631 4.402 4.804 . 0 0 "[ . 1 . 2]" 1
704 1 40 ILE H 1 42 GLY H . . 3.960 3.619 3.364 3.994 0.034 5 0 "[ . 1 . 2]" 1
705 1 40 ILE HA 1 42 GLY H . . 5.280 4.726 4.369 5.015 . 0 0 "[ . 1 . 2]" 1
706 1 40 ILE HB 1 41 GLY H . . 5.130 3.513 2.785 4.224 . 0 0 "[ . 1 . 2]" 1
707 1 40 ILE HB 1 42 GLY H . . 4.670 3.222 2.989 3.572 . 0 0 "[ . 1 . 2]" 1
708 1 40 ILE MD 1 42 GLY H . . 5.500 4.674 4.410 5.024 . 0 0 "[ . 1 . 2]" 1
709 1 40 ILE MG 1 41 GLY H . . 5.010 4.125 3.637 4.402 . 0 0 "[ . 1 . 2]" 1
710 1 40 ILE MG 1 42 GLY H . . 4.980 4.090 3.799 4.450 . 0 0 "[ . 1 . 2]" 1
711 1 41 GLY H 1 42 GLY H . . 3.140 2.325 1.849 2.927 . 0 0 "[ . 1 . 2]" 1
712 1 42 GLY H 1 43 HIS H . . 4.690 4.654 4.603 4.699 0.009 20 0 "[ . 1 . 2]" 1
713 1 42 GLY H 1 46 LYS QB . . 5.340 5.235 4.880 5.398 0.058 18 0 "[ . 1 . 2]" 1
714 1 42 GLY HA2 1 43 HIS H . . 3.210 2.363 2.285 2.440 . 0 0 "[ . 1 . 2]" 1
715 1 42 GLY HA2 1 43 HIS HD2 . . 4.630 3.652 3.325 4.296 . 0 0 "[ . 1 . 2]" 1
716 1 42 GLY HA2 1 46 LYS H . . 4.960 4.972 4.708 5.022 0.062 20 0 "[ . 1 . 2]" 1
717 1 42 GLY HA2 1 47 ALA H . . 5.500 5.403 5.052 5.555 0.055 11 0 "[ . 1 . 2]" 1
718 1 43 HIS H 1 43 HIS HD2 . . 4.770 3.453 3.009 3.936 . 0 0 "[ . 1 . 2]" 1
719 1 43 HIS H 1 46 LYS H . . 3.750 3.091 2.941 3.204 . 0 0 "[ . 1 . 2]" 1
720 1 43 HIS H 1 46 LYS HA . . 4.760 4.792 4.564 4.828 0.068 2 0 "[ . 1 . 2]" 1
721 1 43 HIS H 1 46 LYS HB2 . . 3.790 2.070 1.902 2.278 . 0 0 "[ . 1 . 2]" 1
722 1 43 HIS H 1 46 LYS HB3 . . 3.790 3.687 3.522 3.799 0.009 7 0 "[ . 1 . 2]" 1
723 1 43 HIS H 1 46 LYS HG2 . . 4.270 2.745 2.174 4.338 0.068 20 0 "[ . 1 . 2]" 1
724 1 43 HIS H 1 46 LYS QG . . 3.710 2.558 2.126 3.558 . 0 0 "[ . 1 . 2]" 1
725 1 43 HIS H 1 46 LYS HG3 . . 4.270 3.177 2.861 3.781 . 0 0 "[ . 1 . 2]" 1
726 1 43 HIS H 1 47 ALA H . . 4.020 3.594 3.357 4.062 0.042 2 0 "[ . 1 . 2]" 1
727 1 43 HIS HA 1 43 HIS HD2 . . 4.720 4.444 4.329 4.608 . 0 0 "[ . 1 . 2]" 1
728 1 43 HIS QB 1 43 HIS HD2 . . 3.290 2.603 2.526 2.681 . 0 0 "[ . 1 . 2]" 1
729 1 43 HIS QB 1 45 LEU H . . 5.050 3.561 3.222 3.731 . 0 0 "[ . 1 . 2]" 1
730 1 43 HIS HB2 1 46 LYS H . . 5.100 4.554 4.426 4.658 . 0 0 "[ . 1 . 2]" 1
731 1 43 HIS HB3 1 46 LYS H . . 5.100 5.112 5.040 5.167 0.067 5 0 "[ . 1 . 2]" 1
732 1 43 HIS HD2 1 45 LEU QB . . 5.340 5.330 5.119 5.404 0.064 4 0 "[ . 1 . 2]" 1
733 1 43 HIS HD2 1 46 LYS H . . 5.500 4.903 4.623 5.172 . 0 0 "[ . 1 . 2]" 1
734 1 43 HIS HD2 1 46 LYS QE . . 4.380 3.610 2.508 4.422 0.042 10 0 "[ . 1 . 2]" 1
735 1 43 HIS HD2 1 46 LYS QG . . 4.990 3.262 2.994 4.660 . 0 0 "[ . 1 . 2]" 1
736 1 43 HIS HE1 1 45 LEU H . . 4.130 3.995 3.851 4.178 0.048 18 0 "[ . 1 . 2]" 1
737 1 43 HIS HE1 1 45 LEU HA . . 4.940 4.975 4.800 5.005 0.065 13 0 "[ . 1 . 2]" 1
738 1 43 HIS HE1 1 45 LEU HB2 . . 3.070 2.837 2.369 3.039 . 0 0 "[ . 1 . 2]" 1
739 1 43 HIS HE1 1 45 LEU QB . . 2.610 2.082 2.004 2.171 . 0 0 "[ . 1 . 2]" 1
740 1 43 HIS HE1 1 45 LEU HB3 . . 3.070 2.153 2.034 2.365 . 0 0 "[ . 1 . 2]" 1
741 1 43 HIS HE1 1 45 LEU MD1 . . 4.630 3.770 2.339 4.565 . 0 0 "[ . 1 . 2]" 1
742 1 43 HIS HE1 1 45 LEU QD . . 3.950 2.902 2.310 3.800 . 0 0 "[ . 1 . 2]" 1
743 1 43 HIS HE1 1 45 LEU MD2 . . 4.630 3.436 2.544 4.687 0.057 11 0 "[ . 1 . 2]" 1
744 1 43 HIS HE1 1 46 LYS H . . 3.460 3.464 3.363 3.524 0.064 7 0 "[ . 1 . 2]" 1
745 1 43 HIS HE1 1 46 LYS HA . . 4.960 5.010 4.893 5.029 0.069 9 0 "[ . 1 . 2]" 1
746 1 43 HIS HE1 1 46 LYS QD . . 3.830 3.244 2.714 3.874 0.044 20 0 "[ . 1 . 2]" 1
747 1 43 HIS HE1 1 46 LYS QE . . 3.710 3.049 2.315 3.494 . 0 0 "[ . 1 . 2]" 1
748 1 43 HIS HE1 1 46 LYS QG . . 3.220 3.196 3.002 3.286 0.066 17 0 "[ . 1 . 2]" 1
749 1 44 ALA HA 1 47 ALA H . . 3.600 3.500 3.311 3.647 0.047 17 0 "[ . 1 . 2]" 1
750 1 44 ALA HA 1 48 MET H . . 4.600 4.274 3.855 4.632 0.032 10 0 "[ . 1 . 2]" 1
751 1 44 ALA MB 1 45 LEU H . . 3.680 2.452 2.314 2.828 . 0 0 "[ . 1 . 2]" 1
752 1 44 ALA MB 1 47 ALA H . . 4.750 4.636 4.531 4.730 . 0 0 "[ . 1 . 2]" 1
753 1 44 ALA MB 1 48 MET H . . 5.050 4.777 4.431 5.082 0.032 6 0 "[ . 1 . 2]" 1
754 1 45 LEU H 1 45 LEU HB2 . . 3.830 2.194 2.096 2.261 . 0 0 "[ . 1 . 2]" 1
755 1 45 LEU H 1 45 LEU QB . . 3.160 2.144 2.066 2.185 . 0 0 "[ . 1 . 2]" 1
756 1 45 LEU H 1 45 LEU HB3 . . 3.830 3.060 2.781 3.405 . 0 0 "[ . 1 . 2]" 1
757 1 45 LEU H 1 45 LEU MD1 . . 5.080 3.825 2.846 4.451 . 0 0 "[ . 1 . 2]" 1
758 1 45 LEU H 1 45 LEU QD . . 4.380 3.478 2.805 3.787 . 0 0 "[ . 1 . 2]" 1
759 1 45 LEU H 1 45 LEU MD2 . . 5.080 4.206 3.329 4.451 . 0 0 "[ . 1 . 2]" 1
760 1 45 LEU H 1 46 LYS H . . 3.120 2.930 2.660 3.055 . 0 0 "[ . 1 . 2]" 1
761 1 45 LEU H 1 46 LYS QD . . 5.260 5.224 4.895 5.325 0.065 1 0 "[ . 1 . 2]" 1
762 1 45 LEU H 1 46 LYS QG . . 5.040 4.641 4.250 5.091 0.051 18 0 "[ . 1 . 2]" 1
763 1 45 LEU HA 1 47 ALA H . . 4.900 4.486 4.339 4.673 . 0 0 "[ . 1 . 2]" 1
764 1 45 LEU HA 1 48 MET H . . 3.950 3.633 3.484 3.869 . 0 0 "[ . 1 . 2]" 1
765 1 45 LEU QB 1 47 ALA H . . 5.280 4.699 4.571 4.821 . 0 0 "[ . 1 . 2]" 1
766 1 45 LEU HB2 1 46 LYS H . . 3.490 3.517 3.329 3.561 0.071 7 0 "[ . 1 . 2]" 1
767 1 45 LEU HB3 1 46 LYS H . . 3.490 2.637 2.324 3.263 . 0 0 "[ . 1 . 2]" 1
768 1 46 LYS H 1 46 LYS QB . . 3.230 2.560 2.280 2.667 . 0 0 "[ . 1 . 2]" 1
769 1 46 LYS H 1 46 LYS QD . . 2.930 2.980 2.838 3.013 0.083 20 0 "[ . 1 . 2]" 1
770 1 46 LYS H 1 46 LYS QE . . 4.590 4.222 3.890 4.444 . 0 0 "[ . 1 . 2]" 1
771 1 46 LYS H 1 46 LYS HG2 . . 4.110 2.455 2.155 3.891 . 0 0 "[ . 1 . 2]" 1
772 1 46 LYS H 1 46 LYS QG . . 3.250 2.300 2.141 2.614 . 0 0 "[ . 1 . 2]" 1
773 1 46 LYS H 1 46 LYS HG3 . . 4.110 3.658 2.398 4.020 . 0 0 "[ . 1 . 2]" 1
774 1 46 LYS H 1 47 ALA H . . 2.860 2.706 2.440 2.834 . 0 0 "[ . 1 . 2]" 1
775 1 46 LYS H 1 47 ALA MB . . 4.530 4.338 4.065 4.465 . 0 0 "[ . 1 . 2]" 1
776 1 46 LYS H 1 48 MET H . . 4.230 4.277 4.226 4.295 0.065 9 0 "[ . 1 . 2]" 1
777 1 46 LYS H 1 50 VAL QG . . 5.440 5.523 5.454 5.543 0.103 3 0 "[ . 1 . 2]" 1
778 1 46 LYS HA 1 49 ALA H . . 3.750 3.272 3.001 3.622 . 0 0 "[ . 1 . 2]" 1
779 1 46 LYS HA 1 50 VAL H . . 4.860 4.415 4.104 4.712 . 0 0 "[ . 1 . 2]" 1
780 1 46 LYS QB 1 47 ALA H . . 3.470 2.663 2.526 2.846 . 0 0 "[ . 1 . 2]" 1
781 1 46 LYS HB2 1 47 ALA H . . 3.970 2.722 2.576 2.930 . 0 0 "[ . 1 . 2]" 1
782 1 46 LYS HB3 1 47 ALA H . . 3.970 3.783 3.614 3.961 . 0 0 "[ . 1 . 2]" 1
783 1 46 LYS QG 1 47 ALA H . . 4.370 4.091 3.966 4.394 0.024 18 0 "[ . 1 . 2]" 1
784 1 47 ALA H 1 47 ALA MB . . 2.810 2.216 2.149 2.255 . 0 0 "[ . 1 . 2]" 1
785 1 47 ALA H 1 48 MET H . . 3.080 2.754 2.579 2.844 . 0 0 "[ . 1 . 2]" 1
786 1 47 ALA H 1 48 MET QB . . 5.120 4.839 4.602 5.189 0.069 14 0 "[ . 1 . 2]" 1
787 1 47 ALA H 1 48 MET ME . . 5.500 5.368 4.691 5.575 0.075 16 0 "[ . 1 . 2]" 1
788 1 47 ALA H 1 48 MET HG2 . . 5.500 5.088 4.455 5.568 0.068 9 0 "[ . 1 . 2]" 1
789 1 47 ALA H 1 48 MET QG . . 4.750 4.269 4.106 4.422 . 0 0 "[ . 1 . 2]" 1
790 1 47 ALA H 1 48 MET HG3 . . 5.500 4.878 4.229 5.554 0.054 4 0 "[ . 1 . 2]" 1
791 1 47 ALA H 1 49 ALA H . . 4.260 4.164 3.963 4.321 0.061 14 0 "[ . 1 . 2]" 1
792 1 47 ALA H 1 50 VAL H . . 5.030 4.877 4.718 4.997 . 0 0 "[ . 1 . 2]" 1
793 1 47 ALA H 1 50 VAL QG . . 4.480 4.127 3.939 4.413 . 0 0 "[ . 1 . 2]" 1
794 1 47 ALA H 1 67 LEU QD . . 5.080 4.478 4.085 5.019 . 0 0 "[ . 1 . 2]" 1
795 1 47 ALA HA 1 49 ALA H . . 4.450 4.405 4.115 4.505 0.055 6 0 "[ . 1 . 2]" 1
796 1 47 ALA HA 1 50 VAL H . . 3.700 3.453 3.231 3.673 . 0 0 "[ . 1 . 2]" 1
797 1 47 ALA HA 1 51 ALA H . . 4.760 4.258 4.042 4.511 . 0 0 "[ . 1 . 2]" 1
798 1 47 ALA MB 1 48 MET H . . 3.050 2.561 2.422 2.747 . 0 0 "[ . 1 . 2]" 1
799 1 47 ALA MB 1 49 ALA H . . 4.720 4.527 4.413 4.622 . 0 0 "[ . 1 . 2]" 1
800 1 47 ALA MB 1 50 VAL H . . 4.730 4.606 4.426 4.771 0.041 11 0 "[ . 1 . 2]" 1
801 1 47 ALA MB 1 51 ALA H . . 4.920 4.710 4.527 4.957 0.037 10 0 "[ . 1 . 2]" 1
802 1 48 MET H 1 48 MET QB . . 2.780 2.502 2.369 2.677 . 0 0 "[ . 1 . 2]" 1
803 1 48 MET H 1 48 MET ME . . 4.430 3.701 3.477 4.309 . 0 0 "[ . 1 . 2]" 1
804 1 48 MET H 1 48 MET HG2 . . 3.420 2.735 2.148 3.284 . 0 0 "[ . 1 . 2]" 1
805 1 48 MET H 1 48 MET HG3 . . 3.420 2.686 2.117 3.325 . 0 0 "[ . 1 . 2]" 1
806 1 48 MET H 1 49 ALA H . . 2.850 2.636 2.417 2.821 . 0 0 "[ . 1 . 2]" 1
807 1 48 MET H 1 49 ALA MB . . 4.450 4.320 4.054 4.501 0.051 7 0 "[ . 1 . 2]" 1
808 1 48 MET H 1 50 VAL QG . . 4.570 4.547 4.332 4.680 0.110 11 0 "[ . 1 . 2]" 1
809 1 48 MET HA 1 50 VAL H . . 5.090 4.276 4.083 4.558 . 0 0 "[ . 1 . 2]" 1
810 1 48 MET HA 1 51 ALA H . . 3.700 3.545 3.211 3.746 0.046 12 0 "[ . 1 . 2]" 1
811 1 48 MET HA 1 52 ALA H . . 4.640 4.295 4.078 4.563 . 0 0 "[ . 1 . 2]" 1
812 1 48 MET QB 1 49 ALA H . . 3.080 2.705 2.465 3.169 0.089 14 0 "[ . 1 . 2]" 1
813 1 48 MET QB 1 50 VAL H . . 5.020 4.797 4.626 4.953 . 0 0 "[ . 1 . 2]" 1
814 1 48 MET ME 1 49 ALA H . . 5.500 4.702 3.364 5.207 . 0 0 "[ . 1 . 2]" 1
815 1 48 MET QG 1 49 ALA H . . 4.170 3.922 1.759 4.227 0.057 20 0 "[ . 1 . 2]" 1
816 1 48 MET HG2 1 49 ALA H . . 4.850 4.592 3.178 4.904 0.054 2 0 "[ . 1 . 2]" 1
817 1 48 MET HG3 1 49 ALA H . . 4.850 4.350 1.768 4.790 . 0 0 "[ . 1 . 2]" 1
818 1 49 ALA H 1 49 ALA MB . . 2.580 2.242 2.181 2.310 . 0 0 "[ . 1 . 2]" 1
819 1 49 ALA H 1 50 VAL H . . 2.950 2.762 2.482 2.907 . 0 0 "[ . 1 . 2]" 1
820 1 49 ALA H 1 50 VAL HA . . 5.390 5.336 5.114 5.428 0.038 14 0 "[ . 1 . 2]" 1
821 1 49 ALA H 1 50 VAL HB . . 5.500 5.282 4.857 5.555 0.055 4 0 "[ . 1 . 2]" 1
822 1 49 ALA H 1 50 VAL QG . . 4.020 3.961 3.557 4.101 0.081 10 0 "[ . 1 . 2]" 1
823 1 49 ALA H 1 51 ALA H . . 4.650 4.377 4.039 4.533 . 0 0 "[ . 1 . 2]" 1
824 1 49 ALA H 1 52 ALA H . . 4.950 4.769 4.644 4.999 0.049 3 0 "[ . 1 . 2]" 1
825 1 49 ALA HA 1 51 ALA H . . 5.320 4.703 4.483 4.902 . 0 0 "[ . 1 . 2]" 1
826 1 49 ALA HA 1 52 ALA H . . 3.760 3.384 3.164 3.657 . 0 0 "[ . 1 . 2]" 1
827 1 49 ALA MB 1 50 VAL H . . 3.080 2.801 2.596 3.023 . 0 0 "[ . 1 . 2]" 1
828 1 50 VAL H 1 50 VAL HB . . 2.740 2.715 2.281 2.811 0.071 15 0 "[ . 1 . 2]" 1
829 1 50 VAL H 1 50 VAL QG . . 2.750 2.082 1.890 2.256 . 0 0 "[ . 1 . 2]" 1
830 1 50 VAL H 1 51 ALA H . . 2.930 2.584 2.396 2.727 . 0 0 "[ . 1 . 2]" 1
831 1 50 VAL H 1 51 ALA HA . . 5.340 5.204 5.012 5.325 . 0 0 "[ . 1 . 2]" 1
832 1 50 VAL H 1 52 ALA H . . 3.890 3.938 3.863 3.958 0.068 9 0 "[ . 1 . 2]" 1
833 1 50 VAL H 1 67 LEU MD1 . . 5.500 5.533 5.348 5.584 0.084 11 0 "[ . 1 . 2]" 1
834 1 50 VAL H 1 67 LEU MD2 . . 5.500 5.233 4.790 5.578 0.078 11 0 "[ . 1 . 2]" 1
835 1 50 VAL HA 1 52 ALA H . . 4.290 4.181 4.014 4.338 0.048 14 0 "[ . 1 . 2]" 1
836 1 50 VAL HA 1 53 GLN H . . 3.800 3.676 3.422 3.863 0.063 11 0 "[ . 1 . 2]" 1
837 1 50 VAL HA 1 54 VAL H . . 4.390 4.194 4.045 4.405 0.015 1 0 "[ . 1 . 2]" 1
838 1 50 VAL HB 1 51 ALA H . . 2.860 2.395 2.192 2.614 . 0 0 "[ . 1 . 2]" 1
839 1 50 VAL HB 1 52 ALA H . . 4.910 4.877 4.778 4.958 0.048 6 0 "[ . 1 . 2]" 1
840 1 50 VAL QG 1 51 ALA H . . 3.350 3.153 2.995 3.283 . 0 0 "[ . 1 . 2]" 1
841 1 50 VAL QG 1 52 ALA H . . 5.110 4.567 4.511 4.646 . 0 0 "[ . 1 . 2]" 1
842 1 50 VAL QG 1 53 GLN H . . 4.850 4.523 4.202 4.731 . 0 0 "[ . 1 . 2]" 1
843 1 50 VAL QG 1 54 VAL H . . 4.640 3.963 3.731 4.243 . 0 0 "[ . 1 . 2]" 1
844 1 50 VAL MG1 1 51 ALA H . . 3.830 3.633 3.167 3.897 0.067 8 0 "[ . 1 . 2]" 1
845 1 50 VAL MG2 1 51 ALA H . . 3.830 3.514 3.170 3.716 . 0 0 "[ . 1 . 2]" 1
846 1 51 ALA H 1 51 ALA MB . . 2.560 2.213 2.160 2.251 . 0 0 "[ . 1 . 2]" 1
847 1 51 ALA H 1 52 ALA H . . 2.950 2.868 2.788 2.989 0.039 11 0 "[ . 1 . 2]" 1
848 1 51 ALA H 1 52 ALA HA . . 5.500 5.442 5.384 5.513 0.013 4 0 "[ . 1 . 2]" 1
849 1 51 ALA H 1 53 GLN H . . 4.730 4.609 4.344 4.785 0.055 1 0 "[ . 1 . 2]" 1
850 1 51 ALA H 1 54 VAL H . . 4.960 4.786 4.657 4.946 . 0 0 "[ . 1 . 2]" 1
851 1 51 ALA H 1 54 VAL HB . . 5.070 4.539 4.042 4.906 . 0 0 "[ . 1 . 2]" 1
852 1 51 ALA H 1 54 VAL QG . . 4.380 4.344 4.046 4.451 0.071 18 0 "[ . 1 . 2]" 1
853 1 51 ALA H 1 67 LEU MD1 . . 5.500 5.334 5.057 5.511 0.011 12 0 "[ . 1 . 2]" 1
854 1 51 ALA H 1 67 LEU QD . . 4.290 4.000 3.660 4.377 0.087 6 0 "[ . 1 . 2]" 1
855 1 51 ALA H 1 67 LEU MD2 . . 5.500 4.140 3.734 4.611 . 0 0 "[ . 1 . 2]" 1
856 1 51 ALA HA 1 53 GLN H . . 4.660 4.568 4.217 4.713 0.053 5 0 "[ . 1 . 2]" 1
857 1 51 ALA HA 1 54 VAL H . . 3.510 3.464 3.296 3.561 0.051 15 0 "[ . 1 . 2]" 1
858 1 51 ALA HA 1 55 HIS H . . 3.820 3.618 3.415 3.819 . 0 0 "[ . 1 . 2]" 1
859 1 51 ALA HA 1 62 LEU H . . 4.760 4.532 4.217 4.816 0.056 2 0 "[ . 1 . 2]" 1
860 1 51 ALA MB 1 54 VAL H . . 4.900 4.658 4.537 4.779 . 0 0 "[ . 1 . 2]" 1
861 1 51 ALA MB 1 55 HIS H . . 4.450 4.264 4.093 4.480 0.030 17 0 "[ . 1 . 2]" 1
862 1 51 ALA MB 1 55 HIS HD2 . . 5.310 5.130 4.711 5.380 0.070 3 0 "[ . 1 . 2]" 1
863 1 51 ALA MB 1 62 LEU H . . 3.740 3.332 2.969 3.670 . 0 0 "[ . 1 . 2]" 1
864 1 52 ALA H 1 52 ALA HA . . 2.870 2.865 2.795 2.914 0.044 8 0 "[ . 1 . 2]" 1
865 1 52 ALA H 1 52 ALA MB . . 2.400 2.240 2.174 2.290 . 0 0 "[ . 1 . 2]" 1
866 1 52 ALA H 1 53 GLN H . . 2.930 2.710 2.557 2.907 . 0 0 "[ . 1 . 2]" 1
867 1 52 ALA H 1 53 GLN HG2 . . 5.030 4.834 4.215 5.090 0.060 4 0 "[ . 1 . 2]" 1
868 1 52 ALA H 1 53 GLN QG . . 4.390 4.147 3.876 4.288 . 0 0 "[ . 1 . 2]" 1
869 1 52 ALA H 1 53 GLN HG3 . . 5.030 4.628 4.020 5.098 0.068 18 0 "[ . 1 . 2]" 1
870 1 52 ALA H 1 54 VAL H . . 4.040 3.982 3.775 4.100 0.060 16 0 "[ . 1 . 2]" 1
871 1 52 ALA H 1 54 VAL HB . . 5.500 4.758 4.382 5.115 . 0 0 "[ . 1 . 2]" 1
872 1 52 ALA H 1 54 VAL QG . . 4.920 4.838 4.610 4.978 0.058 13 0 "[ . 1 . 2]" 1
873 1 52 ALA H 1 55 HIS HB3 . . 5.500 5.517 5.372 5.563 0.063 14 0 "[ . 1 . 2]" 1
874 1 52 ALA HA 1 54 VAL H . . 4.640 4.560 4.338 4.694 0.054 13 0 "[ . 1 . 2]" 1
875 1 52 ALA MB 1 53 GLN H . . 2.860 2.449 2.236 2.702 . 0 0 "[ . 1 . 2]" 1
876 1 52 ALA MB 1 54 VAL H . . 5.190 4.430 4.277 4.617 . 0 0 "[ . 1 . 2]" 1
877 1 53 GLN H 1 53 GLN HB2 . . 2.840 2.652 2.498 2.896 0.056 1 0 "[ . 1 . 2]" 1
878 1 53 GLN H 1 53 GLN HB3 . . 3.710 3.626 3.568 3.677 . 0 0 "[ . 1 . 2]" 1
879 1 53 GLN H 1 53 GLN HG2 . . 3.250 2.542 2.030 2.934 . 0 0 "[ . 1 . 2]" 1
880 1 53 GLN H 1 53 GLN HG3 . . 3.250 2.512 1.936 3.103 . 0 0 "[ . 1 . 2]" 1
881 1 53 GLN H 1 54 VAL H . . 2.890 2.521 2.344 2.648 . 0 0 "[ . 1 . 2]" 1
882 1 53 GLN H 1 54 VAL HA . . 5.150 5.159 5.018 5.213 0.063 8 0 "[ . 1 . 2]" 1
883 1 53 GLN H 1 54 VAL QG . . 4.340 4.164 3.842 4.432 0.092 17 0 "[ . 1 . 2]" 1
884 1 53 GLN H 1 55 HIS H . . 4.260 4.132 3.926 4.232 . 0 0 "[ . 1 . 2]" 1
885 1 53 GLN H 1 55 HIS HB3 . . 5.500 5.502 5.262 5.556 0.056 3 0 "[ . 1 . 2]" 1
886 1 53 GLN H 1 56 ARG QD . . 5.500 5.072 4.496 5.536 0.036 10 0 "[ . 1 . 2]" 1
887 1 53 GLN H 1 56 ARG HG2 . . 4.720 4.658 4.349 4.778 0.058 1 0 "[ . 1 . 2]" 1
888 1 53 GLN HA 1 55 HIS H . . 4.520 4.490 4.275 4.585 0.065 16 0 "[ . 1 . 2]" 1
889 1 53 GLN HA 1 56 ARG H . . 3.510 3.529 3.358 3.570 0.060 13 0 "[ . 1 . 2]" 1
890 1 53 GLN HA 1 57 GLU H . . 4.260 4.152 4.027 4.297 0.037 1 0 "[ . 1 . 2]" 1
891 1 53 GLN HB2 1 54 VAL H . . 3.300 2.710 2.536 2.962 . 0 0 "[ . 1 . 2]" 1
892 1 53 GLN HB2 1 55 HIS H . . 5.200 5.177 4.982 5.257 0.057 11 0 "[ . 1 . 2]" 1
893 1 53 GLN HB2 1 56 ARG H . . 5.500 5.519 5.428 5.564 0.064 10 0 "[ . 1 . 2]" 1
894 1 53 GLN HB2 1 57 GLU H . . 5.500 5.525 5.359 5.568 0.068 16 0 "[ . 1 . 2]" 1
895 1 53 GLN HB3 1 57 GLU H . . 5.290 5.027 4.884 5.264 . 0 0 "[ . 1 . 2]" 1
896 1 53 GLN QG 1 54 VAL H . . 3.950 3.841 3.543 3.985 0.035 16 0 "[ . 1 . 2]" 1
897 1 53 GLN HG2 1 54 VAL H . . 4.500 4.498 4.231 4.576 0.076 1 0 "[ . 1 . 2]" 1
898 1 53 GLN HG3 1 54 VAL H . . 4.500 4.206 3.691 4.561 0.061 18 0 "[ . 1 . 2]" 1
899 1 54 VAL H 1 54 VAL HB . . 2.690 2.203 1.949 2.302 . 0 0 "[ . 1 . 2]" 1
900 1 54 VAL H 1 54 VAL QG . . 2.640 2.429 2.272 2.730 0.090 17 0 "[ . 1 . 2]" 1
901 1 54 VAL H 1 55 HIS H . . 2.940 2.692 2.538 2.833 . 0 0 "[ . 1 . 2]" 1
902 1 54 VAL H 1 55 HIS HB3 . . 4.970 4.993 4.918 5.035 0.065 9 0 "[ . 1 . 2]" 1
903 1 54 VAL H 1 56 ARG H . . 4.400 4.040 3.956 4.230 . 0 0 "[ . 1 . 2]" 1
904 1 54 VAL H 1 57 GLU H . . 4.660 4.653 4.531 4.718 0.058 20 0 "[ . 1 . 2]" 1
905 1 54 VAL H 1 58 TYR H . . 5.500 5.572 5.564 5.585 0.085 1 0 "[ . 1 . 2]" 1
906 1 54 VAL HA 1 56 ARG H . . 4.750 4.249 4.098 4.369 . 0 0 "[ . 1 . 2]" 1
907 1 54 VAL HA 1 57 GLU H . . 3.620 3.336 3.118 3.451 . 0 0 "[ . 1 . 2]" 1
908 1 54 VAL HA 1 58 TYR H . . 3.980 3.239 3.130 3.301 . 0 0 "[ . 1 . 2]" 1
909 1 54 VAL HA 1 58 TYR QD . . 3.170 2.155 2.009 2.403 . 0 0 "[ . 1 . 2]" 1
910 1 54 VAL HA 1 58 TYR QE . . 3.970 3.042 2.707 3.287 . 0 0 "[ . 1 . 2]" 1
911 1 54 VAL HB 1 55 HIS H . . 3.770 2.775 2.562 3.632 . 0 0 "[ . 1 . 2]" 1
912 1 54 VAL HB 1 58 TYR QD . . 4.680 4.618 4.314 4.745 0.065 10 0 "[ . 1 . 2]" 1
913 1 54 VAL QG 1 55 HIS H . . 3.980 2.901 2.453 3.209 . 0 0 "[ . 1 . 2]" 1
914 1 54 VAL QG 1 56 ARG H . . 4.270 4.387 4.365 4.401 0.131 1 0 "[ . 1 . 2]" 1
915 1 54 VAL QG 1 57 GLU H . . 4.700 4.276 4.090 4.366 . 0 0 "[ . 1 . 2]" 1
916 1 54 VAL QG 1 58 TYR H . . 3.830 3.500 3.276 3.683 . 0 0 "[ . 1 . 2]" 1
917 1 54 VAL QG 1 58 TYR QD . . 2.770 2.505 2.229 2.737 . 0 0 "[ . 1 . 2]" 1
918 1 54 VAL QG 1 58 TYR QE . . 3.390 2.686 2.083 3.176 . 0 0 "[ . 1 . 2]" 1
919 1 54 VAL QG 1 59 GLN H . . 5.260 4.869 4.711 5.163 . 0 0 "[ . 1 . 2]" 1
920 1 54 VAL MG1 1 55 HIS H . . 4.620 2.974 2.466 3.361 . 0 0 "[ . 1 . 2]" 1
921 1 54 VAL MG1 1 57 GLU H . . 5.500 4.639 4.406 4.868 . 0 0 "[ . 1 . 2]" 1
922 1 54 VAL MG1 1 58 TYR QE . . 4.150 3.807 3.147 4.250 0.100 17 0 "[ . 1 . 2]" 1
923 1 54 VAL MG2 1 55 HIS H . . 4.620 4.091 3.953 4.396 . 0 0 "[ . 1 . 2]" 1
924 1 54 VAL MG2 1 57 GLU H . . 5.500 5.015 4.849 5.158 . 0 0 "[ . 1 . 2]" 1
925 1 54 VAL MG2 1 58 TYR QE . . 4.150 2.760 2.087 3.346 . 0 0 "[ . 1 . 2]" 1
926 1 55 HIS H 1 55 HIS HB2 . . 2.800 2.464 2.362 2.603 . 0 0 "[ . 1 . 2]" 1
927 1 55 HIS H 1 55 HIS HB3 . . 2.810 2.565 2.482 2.680 . 0 0 "[ . 1 . 2]" 1
928 1 55 HIS H 1 56 ARG H . . 2.990 2.618 2.562 2.662 . 0 0 "[ . 1 . 2]" 1
929 1 55 HIS H 1 56 ARG QB . . 4.820 4.870 4.776 4.896 0.076 10 0 "[ . 1 . 2]" 1
930 1 55 HIS H 1 56 ARG HG2 . . 4.550 4.503 4.224 4.607 0.057 5 0 "[ . 1 . 2]" 1
931 1 55 HIS H 1 60 VAL H . . 5.200 4.992 4.854 5.189 . 0 0 "[ . 1 . 2]" 1
932 1 55 HIS H 1 60 VAL QG . . 5.320 4.799 4.225 5.060 . 0 0 "[ . 1 . 2]" 1
933 1 55 HIS HA 1 56 ARG H . . 3.550 3.429 3.350 3.489 . 0 0 "[ . 1 . 2]" 1
934 1 55 HIS HA 1 57 GLU H . . 4.550 4.366 4.293 4.461 . 0 0 "[ . 1 . 2]" 1
935 1 55 HIS HA 1 58 TYR H . . 4.040 3.998 3.872 4.090 0.050 16 0 "[ . 1 . 2]" 1
936 1 55 HIS HA 1 58 TYR QD . . 5.030 4.906 4.585 5.036 0.006 13 0 "[ . 1 . 2]" 1
937 1 55 HIS HA 1 59 GLN H . . 3.950 3.845 3.689 4.002 0.052 10 0 "[ . 1 . 2]" 1
938 1 55 HIS HA 1 60 VAL H . . 2.670 2.277 2.135 2.456 . 0 0 "[ . 1 . 2]" 1
939 1 55 HIS HB2 1 55 HIS HD2 . . 3.240 2.843 2.665 2.988 . 0 0 "[ . 1 . 2]" 1
940 1 55 HIS HB2 1 56 ARG H . . 4.120 3.909 3.830 4.029 . 0 0 "[ . 1 . 2]" 1
941 1 55 HIS HB2 1 62 LEU H . . 4.400 3.183 2.783 3.689 . 0 0 "[ . 1 . 2]" 1
942 1 55 HIS HB3 1 55 HIS HD2 . . 3.920 3.112 2.955 3.266 . 0 0 "[ . 1 . 2]" 1
943 1 55 HIS HB3 1 56 ARG H . . 3.000 2.783 2.674 2.899 . 0 0 "[ . 1 . 2]" 1
944 1 55 HIS HB3 1 57 GLU H . . 5.160 5.144 5.038 5.215 0.055 16 0 "[ . 1 . 2]" 1
945 1 55 HIS HD2 1 61 GLU H . . 5.130 5.008 4.584 5.175 0.045 18 0 "[ . 1 . 2]" 1
946 1 55 HIS HD2 1 61 GLU HA . . 3.120 2.836 2.378 3.169 0.049 10 0 "[ . 1 . 2]" 1
947 1 55 HIS HD2 1 61 GLU QB . . 3.750 3.577 3.187 3.812 0.062 1 0 "[ . 1 . 2]" 1
948 1 55 HIS HD2 1 61 GLU QG . . 3.860 2.795 2.427 3.317 . 0 0 "[ . 1 . 2]" 1
949 1 55 HIS HD2 1 62 LEU H . . 4.550 4.066 3.539 4.608 0.058 14 0 "[ . 1 . 2]" 1
950 1 55 HIS HE1 1 59 GLN HA . . 4.150 4.081 3.933 4.199 0.049 5 0 "[ . 1 . 2]" 1
951 1 55 HIS HE1 1 59 GLN HB3 . . 4.920 4.973 4.820 4.990 0.070 20 0 "[ . 1 . 2]" 1
952 1 55 HIS HE1 1 61 GLU HA . . 4.410 4.348 4.059 4.482 0.072 20 0 "[ . 1 . 2]" 1
953 1 56 ARG H 1 56 ARG QB . . 2.540 2.602 2.579 2.615 0.075 1 0 "[ . 1 . 2]" 1
954 1 56 ARG H 1 56 ARG HG2 . . 3.410 2.403 2.136 2.563 . 0 0 "[ . 1 . 2]" 1
955 1 56 ARG H 1 56 ARG HG3 . . 3.690 3.546 3.286 3.734 0.044 11 0 "[ . 1 . 2]" 1
956 1 56 ARG H 1 57 GLU HB2 . . 4.620 4.623 4.381 4.672 0.052 18 0 "[ . 1 . 2]" 1
957 1 56 ARG H 1 60 VAL H . . 5.190 5.026 4.898 5.194 0.004 8 0 "[ . 1 . 2]" 1
958 1 56 ARG H 1 60 VAL QG . . 5.500 5.555 5.282 5.609 0.109 5 0 "[ . 1 . 2]" 1
959 1 56 ARG HA 1 59 GLN H . . 4.420 3.705 3.423 3.890 . 0 0 "[ . 1 . 2]" 1
960 1 56 ARG QD 1 57 GLU H . . 5.440 4.495 4.379 4.657 . 0 0 "[ . 1 . 2]" 1
961 1 56 ARG HG2 1 57 GLU H . . 2.820 2.859 2.736 2.889 0.069 9 0 "[ . 1 . 2]" 1
962 1 56 ARG HG3 1 57 GLU H . . 3.980 2.817 2.596 3.017 . 0 0 "[ . 1 . 2]" 1
963 1 56 ARG HG3 1 58 TYR H . . 5.360 5.213 5.007 5.391 0.031 15 0 "[ . 1 . 2]" 1
964 1 56 ARG HG3 1 59 GLN H . . 5.500 5.553 5.468 5.572 0.072 4 0 "[ . 1 . 2]" 1
965 1 57 GLU H 1 57 GLU HB2 . . 3.000 2.332 2.236 2.417 . 0 0 "[ . 1 . 2]" 1
966 1 57 GLU H 1 57 GLU QG . . 2.910 2.752 2.596 2.912 0.002 14 0 "[ . 1 . 2]" 1
967 1 57 GLU H 1 58 TYR H . . 2.920 2.506 2.421 2.600 . 0 0 "[ . 1 . 2]" 1
968 1 57 GLU H 1 58 TYR HB2 . . 4.790 4.715 4.572 4.836 0.046 17 0 "[ . 1 . 2]" 1
969 1 57 GLU H 1 58 TYR QD . . 4.230 3.615 3.319 3.911 . 0 0 "[ . 1 . 2]" 1
970 1 57 GLU H 1 59 GLN H . . 3.940 3.480 3.382 3.581 . 0 0 "[ . 1 . 2]" 1
971 1 57 GLU H 1 59 GLN HA . . 5.220 5.169 4.987 5.264 0.044 9 0 "[ . 1 . 2]" 1
972 1 57 GLU H 1 59 GLN QG . . 5.340 5.027 4.593 5.343 0.003 1 0 "[ . 1 . 2]" 1
973 1 57 GLU H 1 60 VAL H . . 5.020 5.087 5.079 5.096 0.076 1 0 "[ . 1 . 2]" 1
974 1 57 GLU H 1 60 VAL QG . . 5.370 5.355 5.132 5.440 0.070 5 0 "[ . 1 . 2]" 1
975 1 57 GLU HA 1 58 TYR QD . . 5.190 4.764 4.480 5.066 . 0 0 "[ . 1 . 2]" 1
976 1 57 GLU HA 1 59 GLN H . . 4.840 4.002 3.846 4.157 . 0 0 "[ . 1 . 2]" 1
977 1 57 GLU HB2 1 58 TYR H . . 3.260 2.556 2.363 2.853 . 0 0 "[ . 1 . 2]" 1
978 1 57 GLU HB2 1 58 TYR QD . . 3.370 2.419 2.203 2.755 . 0 0 "[ . 1 . 2]" 1
979 1 57 GLU HB2 1 58 TYR QE . . 3.400 3.181 2.694 3.456 0.056 7 0 "[ . 1 . 2]" 1
980 1 57 GLU HB2 1 59 GLN H . . 4.650 4.622 4.508 4.709 0.059 5 0 "[ . 1 . 2]" 1
981 1 57 GLU HB3 1 58 TYR H . . 3.460 3.360 3.151 3.511 0.051 20 0 "[ . 1 . 2]" 1
982 1 57 GLU HB3 1 58 TYR QD . . 3.570 3.338 2.810 3.616 0.046 11 0 "[ . 1 . 2]" 1
983 1 57 GLU HB3 1 58 TYR QE . . 3.790 3.614 3.058 3.843 0.053 15 0 "[ . 1 . 2]" 1
984 1 57 GLU HB3 1 59 GLN H . . 5.330 5.073 4.945 5.267 . 0 0 "[ . 1 . 2]" 1
985 1 57 GLU QG 1 58 TYR H . . 4.490 4.216 4.030 4.423 . 0 0 "[ . 1 . 2]" 1
986 1 57 GLU QG 1 58 TYR QD . . 5.340 4.336 4.024 4.795 . 0 0 "[ . 1 . 2]" 1
987 1 58 TYR H 1 58 TYR HB2 . . 3.060 2.401 2.306 2.496 . 0 0 "[ . 1 . 2]" 1
988 1 58 TYR H 1 58 TYR HB3 . . 3.630 3.602 3.522 3.658 0.028 17 0 "[ . 1 . 2]" 1
989 1 58 TYR H 1 58 TYR QD . . 3.290 2.065 1.856 2.229 . 0 0 "[ . 1 . 2]" 1
990 1 58 TYR H 1 58 TYR QE . . 4.470 4.248 4.039 4.451 . 0 0 "[ . 1 . 2]" 1
991 1 58 TYR H 1 59 GLN HA . . 4.830 4.664 4.464 4.793 . 0 0 "[ . 1 . 2]" 1
992 1 58 TYR H 1 59 GLN QG . . 5.120 4.477 4.261 4.649 . 0 0 "[ . 1 . 2]" 1
993 1 58 TYR H 1 60 VAL H . . 3.860 3.823 3.634 3.915 0.055 7 0 "[ . 1 . 2]" 1
994 1 58 TYR H 1 60 VAL QG . . 4.070 3.729 3.615 3.834 . 0 0 "[ . 1 . 2]" 1
995 1 58 TYR H 1 80 VAL MG1 . . 4.860 4.926 4.835 4.949 0.089 13 0 "[ . 1 . 2]" 1
996 1 58 TYR HA 1 58 TYR QD . . 3.240 3.157 2.917 3.301 0.061 19 0 "[ . 1 . 2]" 1
997 1 58 TYR HA 1 60 VAL H . . 4.860 4.759 4.633 4.897 0.037 9 0 "[ . 1 . 2]" 1
998 1 58 TYR HB2 1 59 GLN H . . 3.860 3.618 3.508 3.721 . 0 0 "[ . 1 . 2]" 1
999 1 58 TYR HB2 1 60 VAL H . . 3.500 3.277 3.129 3.372 . 0 0 "[ . 1 . 2]" 1
1000 1 58 TYR HB3 1 59 GLN H . . 4.350 4.331 4.200 4.403 0.053 8 0 "[ . 1 . 2]" 1
1001 1 58 TYR HB3 1 60 VAL H . . 4.110 4.140 3.974 4.173 0.063 20 0 "[ . 1 . 2]" 1
1002 1 58 TYR QD 1 59 GLN H . . 4.510 4.405 4.190 4.546 0.036 11 0 "[ . 1 . 2]" 1
1003 1 58 TYR QD 1 60 VAL H . . 5.090 4.980 4.699 5.120 0.030 13 0 "[ . 1 . 2]" 1
1004 1 58 TYR QD 1 60 VAL QG . . 3.600 3.564 3.449 3.682 0.082 3 0 "[ . 1 . 2]" 1
1005 1 58 TYR QD 1 80 VAL MG1 . . 3.270 2.364 2.093 2.652 . 0 0 "[ . 1 . 2]" 1
1006 1 58 TYR QD 1 84 SER QB . . 4.010 3.926 3.053 4.098 0.088 3 0 "[ . 1 . 2]" 1
1007 1 58 TYR QE 1 80 VAL MG1 . . 3.680 3.443 3.039 3.779 0.099 11 0 "[ . 1 . 2]" 1
1008 1 59 GLN H 1 59 GLN HA . . 2.570 2.288 2.243 2.323 . 0 0 "[ . 1 . 2]" 1
1009 1 59 GLN H 1 59 GLN HG2 . . 3.440 3.237 2.833 3.494 0.054 13 0 "[ . 1 . 2]" 1
1010 1 59 GLN H 1 59 GLN HG3 . . 3.440 2.793 2.433 3.094 . 0 0 "[ . 1 . 2]" 1
1011 1 59 GLN H 1 60 VAL H . . 3.040 2.812 2.705 2.974 . 0 0 "[ . 1 . 2]" 1
1012 1 59 GLN H 1 60 VAL HB . . 5.500 5.094 4.849 5.402 . 0 0 "[ . 1 . 2]" 1
1013 1 59 GLN H 1 60 VAL QG . . 4.290 3.849 3.646 4.048 . 0 0 "[ . 1 . 2]" 1
1014 1 59 GLN HA 1 60 VAL H . . 2.970 2.856 2.642 3.018 0.048 8 0 "[ . 1 . 2]" 1
1015 1 59 GLN HB2 1 60 VAL H . . 4.310 4.344 4.286 4.373 0.063 9 0 "[ . 1 . 2]" 1
1016 1 59 GLN QG 1 60 VAL H . . 4.880 4.516 4.358 4.701 . 0 0 "[ . 1 . 2]" 1
1017 1 60 VAL H 1 60 VAL HB . . 3.480 3.151 2.897 3.461 . 0 0 "[ . 1 . 2]" 1
1018 1 60 VAL H 1 60 VAL QG . . 2.950 2.132 2.058 2.260 . 0 0 "[ . 1 . 2]" 1
1019 1 60 VAL H 1 61 GLU H . . 4.280 4.305 4.156 4.340 0.060 1 0 "[ . 1 . 2]" 1
1020 1 60 VAL H 1 61 GLU QB . . 5.500 5.559 5.414 5.582 0.082 8 0 "[ . 1 . 2]" 1
1021 1 60 VAL H 1 80 VAL MG1 . . 4.950 4.974 4.772 5.032 0.082 13 0 "[ . 1 . 2]" 1
1022 1 60 VAL HA 1 61 GLU H . . 2.550 2.167 2.075 2.230 . 0 0 "[ . 1 . 2]" 1
1023 1 60 VAL HB 1 61 GLU H . . 4.650 4.292 4.118 4.454 . 0 0 "[ . 1 . 2]" 1
1024 1 60 VAL QG 1 61 GLU H . . 3.120 2.767 2.541 3.007 . 0 0 "[ . 1 . 2]" 1
1025 1 60 VAL QG 1 62 LEU H . . 4.900 4.256 3.708 4.805 . 0 0 "[ . 1 . 2]" 1
1026 1 60 VAL QG 1 83 ARG H . . 4.710 4.254 3.960 4.679 . 0 0 "[ . 1 . 2]" 1
1027 1 60 VAL QG 1 84 SER H . . 4.190 3.880 3.395 4.275 0.085 13 0 "[ . 1 . 2]" 1
1028 1 61 GLU H 1 61 GLU QB . . 2.760 2.199 2.080 2.271 . 0 0 "[ . 1 . 2]" 1
1029 1 61 GLU H 1 61 GLU QG . . 4.530 3.951 3.905 3.982 . 0 0 "[ . 1 . 2]" 1
1030 1 61 GLU HA 1 62 LEU H . . 2.510 2.205 2.157 2.339 . 0 0 "[ . 1 . 2]" 1
1031 1 61 GLU QB 1 62 LEU H . . 4.290 3.795 3.582 3.986 . 0 0 "[ . 1 . 2]" 1
1032 1 61 GLU QG 1 62 LEU H . . 3.740 2.759 2.342 3.230 . 0 0 "[ . 1 . 2]" 1
1033 1 61 GLU HG2 1 62 LEU H . . 4.540 2.950 2.389 3.574 . 0 0 "[ . 1 . 2]" 1
1034 1 61 GLU HG3 1 62 LEU H . . 4.540 3.459 2.657 4.587 0.047 4 0 "[ . 1 . 2]" 1
1035 1 62 LEU H 1 62 LEU HB2 . . 3.200 2.995 2.706 3.252 0.052 16 0 "[ . 1 . 2]" 1
1036 1 62 LEU H 1 62 LEU QB . . 2.780 2.518 2.276 2.687 . 0 0 "[ . 1 . 2]" 1
1037 1 62 LEU H 1 62 LEU HB3 . . 3.200 2.735 2.390 3.063 . 0 0 "[ . 1 . 2]" 1
1038 1 62 LEU H 1 62 LEU MD1 . . 4.700 4.462 4.243 4.729 0.029 15 0 "[ . 1 . 2]" 1
1039 1 62 LEU H 1 62 LEU QD . . 4.010 3.928 3.796 4.032 0.022 1 0 "[ . 1 . 2]" 1
1040 1 62 LEU H 1 62 LEU MD2 . . 4.700 4.387 4.104 4.610 . 0 0 "[ . 1 . 2]" 1
1041 1 62 LEU H 1 62 LEU HG . . 4.950 4.581 4.274 4.991 0.041 20 0 "[ . 1 . 2]" 1
1042 1 62 LEU H 1 63 PRO HD2 . . 4.490 4.438 4.185 4.560 0.070 12 0 "[ . 1 . 2]" 1
1043 1 62 LEU H 1 63 PRO HD3 . . 4.220 3.773 3.353 4.139 . 0 0 "[ . 1 . 2]" 1
1044 1 62 LEU HA 1 79 TYR QD . . 5.170 4.611 4.279 5.090 . 0 0 "[ . 1 . 2]" 1
1045 1 62 LEU HA 1 79 TYR QE . . 3.620 2.746 2.384 3.097 . 0 0 "[ . 1 . 2]" 1
1046 1 62 LEU QB 1 79 TYR QE . . 4.410 3.513 2.739 4.254 . 0 0 "[ . 1 . 2]" 1
1047 1 62 LEU QD 1 66 VAL H . . 4.290 3.660 3.236 4.357 0.067 18 0 "[ . 1 . 2]" 1
1048 1 62 LEU QD 1 67 LEU H . . 3.670 3.040 2.500 3.711 0.041 6 0 "[ . 1 . 2]" 1
1049 1 62 LEU QD 1 79 TYR QD . . 3.200 2.805 2.227 3.296 0.096 10 0 "[ . 1 . 2]" 1
1050 1 62 LEU QD 1 79 TYR QE . . 3.380 2.698 2.045 3.441 0.061 9 0 "[ . 1 . 2]" 1
1051 1 62 LEU MD1 1 67 LEU H . . 4.540 3.903 2.611 4.626 0.086 15 0 "[ . 1 . 2]" 1
1052 1 62 LEU MD1 1 79 TYR QD . . 4.030 3.177 2.303 4.138 0.108 13 0 "[ . 1 . 2]" 1
1053 1 62 LEU MD2 1 67 LEU H . . 4.540 3.823 2.510 4.628 0.088 11 0 "[ . 1 . 2]" 1
1054 1 62 LEU MD2 1 79 TYR QD . . 4.030 3.756 2.236 4.119 0.089 18 0 "[ . 1 . 2]" 1
1055 1 63 PRO HA 1 64 LEU H . . 2.730 2.237 2.141 2.310 . 0 0 "[ . 1 . 2]" 1
1056 1 63 PRO HA 1 65 LYS H . . 4.140 4.057 3.906 4.204 0.064 17 0 "[ . 1 . 2]" 1
1057 1 63 PRO HA 1 66 VAL H . . 5.110 5.000 4.857 5.171 0.061 18 0 "[ . 1 . 2]" 1
1058 1 63 PRO HB2 1 64 LEU H . . 3.820 3.015 2.791 3.322 . 0 0 "[ . 1 . 2]" 1
1059 1 63 PRO HB2 1 65 LYS H . . 3.890 2.476 2.322 2.627 . 0 0 "[ . 1 . 2]" 1
1060 1 63 PRO HB2 1 66 VAL H . . 3.870 3.913 3.853 3.930 0.060 12 0 "[ . 1 . 2]" 1
1061 1 63 PRO HD2 1 65 LYS H . . 5.500 5.498 5.232 5.567 0.067 13 0 "[ . 1 . 2]" 1
1062 1 63 PRO HD2 1 66 VAL H . . 4.640 4.355 4.012 4.618 . 0 0 "[ . 1 . 2]" 1
1063 1 63 PRO HD2 1 67 LEU H . . 5.500 5.341 4.969 5.568 0.068 12 0 "[ . 1 . 2]" 1
1064 1 63 PRO HD2 1 79 TYR QE . . 3.510 3.426 3.087 3.578 0.068 18 0 "[ . 1 . 2]" 1
1065 1 63 PRO HD3 1 79 TYR QE . . 4.630 4.415 3.911 4.698 0.068 4 0 "[ . 1 . 2]" 1
1066 1 63 PRO QG 1 64 LEU H . . 4.690 4.417 4.269 4.602 . 0 0 "[ . 1 . 2]" 1
1067 1 63 PRO QG 1 65 LYS H . . 4.470 3.617 3.306 3.832 . 0 0 "[ . 1 . 2]" 1
1068 1 63 PRO QG 1 66 VAL H . . 3.820 3.151 2.848 3.327 . 0 0 "[ . 1 . 2]" 1
1069 1 63 PRO QG 1 67 LEU H . . 4.860 4.843 4.594 4.932 0.072 4 0 "[ . 1 . 2]" 1
1070 1 63 PRO QG 1 79 TYR QE . . 4.760 4.376 4.092 4.748 . 0 0 "[ . 1 . 2]" 1
1071 1 64 LEU H 1 64 LEU HB2 . . 2.870 2.127 2.051 2.321 . 0 0 "[ . 1 . 2]" 1
1072 1 64 LEU H 1 64 LEU HB3 . . 3.360 3.067 2.547 3.341 . 0 0 "[ . 1 . 2]" 1
1073 1 64 LEU H 1 64 LEU QD . . 4.350 3.503 3.104 3.768 . 0 0 "[ . 1 . 2]" 1
1074 1 64 LEU H 1 64 LEU HG . . 4.950 4.143 3.544 4.572 . 0 0 "[ . 1 . 2]" 1
1075 1 64 LEU H 1 65 LYS H . . 3.250 2.805 2.642 2.928 . 0 0 "[ . 1 . 2]" 1
1076 1 64 LEU H 1 65 LYS HA . . 5.360 5.349 5.206 5.422 0.062 7 0 "[ . 1 . 2]" 1
1077 1 64 LEU H 1 66 VAL H . . 4.640 4.535 4.356 4.704 0.064 18 0 "[ . 1 . 2]" 1
1078 1 64 LEU H 1 67 LEU H . . 4.900 4.962 4.950 4.973 0.073 5 0 "[ . 1 . 2]" 1
1079 1 64 LEU HA 1 66 VAL H . . 4.040 3.895 3.612 4.101 0.061 7 0 "[ . 1 . 2]" 1
1080 1 64 LEU HA 1 67 LEU H . . 3.490 3.112 2.882 3.469 . 0 0 "[ . 1 . 2]" 1
1081 1 64 LEU HA 1 68 PHE H . . 4.190 3.585 3.384 3.774 . 0 0 "[ . 1 . 2]" 1
1082 1 64 LEU HB2 1 65 LYS H . . 3.830 3.670 3.332 3.888 0.058 14 0 "[ . 1 . 2]" 1
1083 1 64 LEU HB3 1 68 PHE QD . . 4.040 3.981 3.401 4.118 0.078 17 0 "[ . 1 . 2]" 1
1084 1 64 LEU QD 1 65 LYS H . . 4.350 4.097 3.859 4.255 . 0 0 "[ . 1 . 2]" 1
1085 1 64 LEU QD 1 67 LEU H . . 4.390 3.941 3.492 4.432 0.042 17 0 "[ . 1 . 2]" 1
1086 1 64 LEU QD 1 68 PHE H . . 4.770 2.731 2.466 3.415 . 0 0 "[ . 1 . 2]" 1
1087 1 64 LEU QD 1 68 PHE QD . . 4.360 3.252 2.735 3.739 . 0 0 "[ . 1 . 2]" 1
1088 1 64 LEU QD 1 68 PHE QE . . 5.440 4.882 4.469 5.310 . 0 0 "[ . 1 . 2]" 1
1089 1 64 LEU QD 1 69 ALA H . . 5.140 4.703 4.390 5.236 0.096 1 0 "[ . 1 . 2]" 1
1090 1 64 LEU MD1 1 65 LYS H . . 5.050 4.700 4.064 5.115 0.065 6 0 "[ . 1 . 2]" 1
1091 1 64 LEU MD2 1 65 LYS H . . 5.050 4.604 4.122 4.940 . 0 0 "[ . 1 . 2]" 1
1092 1 64 LEU HG 1 68 PHE H . . 5.370 4.934 3.355 5.436 0.066 18 0 "[ . 1 . 2]" 1
1093 1 65 LYS H 1 65 LYS HB2 . . 3.590 3.293 2.323 3.632 0.042 4 0 "[ . 1 . 2]" 1
1094 1 65 LYS H 1 65 LYS QB . . 2.840 2.386 2.288 2.527 . 0 0 "[ . 1 . 2]" 1
1095 1 65 LYS H 1 65 LYS HB3 . . 3.590 2.719 2.317 3.622 0.032 7 0 "[ . 1 . 2]" 1
1096 1 65 LYS H 1 65 LYS QD . . 3.990 3.706 3.298 4.070 0.080 18 0 "[ . 1 . 2]" 1
1097 1 65 LYS H 1 65 LYS QE . . 4.780 4.384 3.025 4.848 0.068 3 0 "[ . 1 . 2]" 1
1098 1 65 LYS H 1 65 LYS QG . . 3.010 2.305 2.052 2.585 . 0 0 "[ . 1 . 2]" 1
1099 1 65 LYS H 1 66 VAL H . . 3.230 2.887 2.798 2.963 . 0 0 "[ . 1 . 2]" 1
1100 1 65 LYS H 1 66 VAL QG . . 4.590 4.151 4.024 4.327 . 0 0 "[ . 1 . 2]" 1
1101 1 65 LYS H 1 67 LEU H . . 4.410 4.290 4.150 4.459 0.049 17 0 "[ . 1 . 2]" 1
1102 1 65 LYS HA 1 67 LEU H . . 4.940 4.798 4.655 4.978 0.038 15 0 "[ . 1 . 2]" 1
1103 1 65 LYS HA 1 68 PHE H . . 4.230 4.076 3.955 4.217 . 0 0 "[ . 1 . 2]" 1
1104 1 65 LYS HA 1 68 PHE QD . . 4.010 2.118 1.969 2.371 . 0 0 "[ . 1 . 2]" 1
1105 1 65 LYS HA 1 69 ALA H . . 4.290 4.122 3.866 4.353 0.063 13 0 "[ . 1 . 2]" 1
1106 1 65 LYS QB 1 68 PHE QD . . 4.410 3.995 3.737 4.386 . 0 0 "[ . 1 . 2]" 1
1107 1 65 LYS QB 1 68 PHE QE . . 4.120 3.431 2.896 3.961 . 0 0 "[ . 1 . 2]" 1
1108 1 65 LYS QE 1 66 VAL H . . 5.500 4.991 4.384 5.559 0.059 5 0 "[ . 1 . 2]" 1
1109 1 65 LYS QG 1 66 VAL H . . 4.050 2.833 2.109 4.133 0.083 16 0 "[ . 1 . 2]" 1
1110 1 65 LYS QG 1 69 ALA H . . 5.500 5.498 5.343 5.583 0.083 16 0 "[ . 1 . 2]" 1
1111 1 66 VAL H 1 66 VAL HB . . 2.720 2.485 2.322 2.781 0.061 18 0 "[ . 1 . 2]" 1
1112 1 66 VAL H 1 66 VAL MG1 . . 3.970 3.794 3.725 3.914 . 0 0 "[ . 1 . 2]" 1
1113 1 66 VAL H 1 66 VAL QG . . 2.800 2.281 2.033 2.462 . 0 0 "[ . 1 . 2]" 1
1114 1 66 VAL H 1 66 VAL MG2 . . 3.970 2.300 2.041 2.498 . 0 0 "[ . 1 . 2]" 1
1115 1 66 VAL H 1 67 LEU H . . 2.730 2.260 2.124 2.462 . 0 0 "[ . 1 . 2]" 1
1116 1 66 VAL H 1 67 LEU HA . . 5.150 4.921 4.781 5.108 . 0 0 "[ . 1 . 2]" 1
1117 1 66 VAL H 1 68 PHE H . . 4.190 3.998 3.861 4.115 . 0 0 "[ . 1 . 2]" 1
1118 1 66 VAL H 1 68 PHE HB3 . . 5.500 5.541 5.360 5.567 0.067 18 0 "[ . 1 . 2]" 1
1119 1 66 VAL H 1 69 ALA H . . 4.750 4.441 4.323 4.523 . 0 0 "[ . 1 . 2]" 1
1120 1 66 VAL H 1 76 LEU MD2 . . 5.500 5.580 5.560 5.590 0.090 1 0 "[ . 1 . 2]" 1
1121 1 66 VAL HA 1 68 PHE H . . 4.820 4.539 4.368 4.660 . 0 0 "[ . 1 . 2]" 1
1122 1 66 VAL HA 1 69 ALA H . . 3.380 3.353 2.968 3.444 0.064 1 0 "[ . 1 . 2]" 1
1123 1 66 VAL HA 1 70 GLN H . . 4.050 3.701 3.309 3.877 . 0 0 "[ . 1 . 2]" 1
1124 1 66 VAL HB 1 67 LEU H . . 2.960 2.556 2.346 2.981 0.021 18 0 "[ . 1 . 2]" 1
1125 1 66 VAL HB 1 79 TYR QD . . 4.930 4.713 3.955 4.981 0.051 12 0 "[ . 1 . 2]" 1
1126 1 66 VAL HB 1 79 TYR QE . . 5.050 4.340 3.895 4.627 . 0 0 "[ . 1 . 2]" 1
1127 1 66 VAL QG 1 67 LEU H . . 3.780 3.244 3.107 3.476 . 0 0 "[ . 1 . 2]" 1
1128 1 66 VAL QG 1 69 ALA H . . 4.450 4.350 4.020 4.472 0.022 6 0 "[ . 1 . 2]" 1
1129 1 66 VAL QG 1 70 GLN H . . 4.060 3.847 3.428 3.978 . 0 0 "[ . 1 . 2]" 1
1130 1 66 VAL QG 1 79 TYR H . . 5.320 4.902 4.714 5.395 0.075 13 0 "[ . 1 . 2]" 1
1131 1 66 VAL QG 1 79 TYR QD . . 3.200 2.684 2.261 2.824 . 0 0 "[ . 1 . 2]" 1
1132 1 66 VAL QG 1 79 TYR QE . . 3.010 2.428 2.178 2.704 . 0 0 "[ . 1 . 2]" 1
1133 1 66 VAL MG1 1 67 LEU H . . 4.700 3.568 3.324 3.986 . 0 0 "[ . 1 . 2]" 1
1134 1 66 VAL MG1 1 68 PHE H . . 5.500 5.235 5.087 5.396 . 0 0 "[ . 1 . 2]" 1
1135 1 66 VAL MG1 1 69 ALA H . . 5.310 4.700 4.265 4.887 . 0 0 "[ . 1 . 2]" 1
1136 1 66 VAL MG1 1 70 GLN H . . 5.500 3.930 3.472 4.075 . 0 0 "[ . 1 . 2]" 1
1137 1 66 VAL MG1 1 79 TYR QD . . 4.180 2.822 2.383 2.938 . 0 0 "[ . 1 . 2]" 1
1138 1 66 VAL MG1 1 79 TYR QE . . 3.460 3.311 3.031 3.518 0.058 18 0 "[ . 1 . 2]" 1
1139 1 66 VAL MG2 1 67 LEU H . . 4.700 3.747 3.613 3.848 . 0 0 "[ . 1 . 2]" 1
1140 1 66 VAL MG2 1 68 PHE H . . 5.500 5.500 5.344 5.566 0.066 16 0 "[ . 1 . 2]" 1
1141 1 66 VAL MG2 1 69 ALA H . . 5.310 5.138 4.917 5.261 . 0 0 "[ . 1 . 2]" 1
1142 1 66 VAL MG2 1 70 GLN H . . 5.500 5.485 5.181 5.572 0.072 19 0 "[ . 1 . 2]" 1
1143 1 66 VAL MG2 1 79 TYR QD . . 4.180 3.384 2.813 3.796 . 0 0 "[ . 1 . 2]" 1
1144 1 66 VAL MG2 1 79 TYR QE . . 3.460 2.507 2.199 2.888 . 0 0 "[ . 1 . 2]" 1
1145 1 67 LEU H 1 67 LEU HB2 . . 3.240 2.113 2.033 2.194 . 0 0 "[ . 1 . 2]" 1
1146 1 67 LEU H 1 67 LEU QB . . 2.640 2.065 1.996 2.157 . 0 0 "[ . 1 . 2]" 1
1147 1 67 LEU H 1 67 LEU HB3 . . 3.240 2.939 2.690 3.299 0.059 12 0 "[ . 1 . 2]" 1
1148 1 67 LEU H 1 67 LEU MD1 . . 4.360 4.345 4.256 4.410 0.050 8 0 "[ . 1 . 2]" 1
1149 1 67 LEU H 1 67 LEU QD . . 3.730 3.367 2.868 3.638 . 0 0 "[ . 1 . 2]" 1
1150 1 67 LEU H 1 67 LEU MD2 . . 4.360 3.517 2.915 3.882 . 0 0 "[ . 1 . 2]" 1
1151 1 67 LEU H 1 68 PHE H . . 2.970 2.871 2.696 2.995 0.025 15 0 "[ . 1 . 2]" 1
1152 1 67 LEU H 1 68 PHE HA . . 5.460 5.459 5.355 5.515 0.055 15 0 "[ . 1 . 2]" 1
1153 1 67 LEU H 1 68 PHE HB3 . . 4.970 4.831 4.652 4.996 0.026 2 0 "[ . 1 . 2]" 1
1154 1 67 LEU H 1 69 ALA H . . 4.000 4.065 4.051 4.076 0.076 12 0 "[ . 1 . 2]" 1
1155 1 67 LEU H 1 70 GLN H . . 4.770 4.762 4.639 4.825 0.055 5 0 "[ . 1 . 2]" 1
1156 1 67 LEU H 1 76 LEU MD2 . . 4.280 4.194 4.066 4.342 0.062 6 0 "[ . 1 . 2]" 1
1157 1 67 LEU HA 1 69 ALA H . . 4.750 4.526 4.259 4.741 . 0 0 "[ . 1 . 2]" 1
1158 1 67 LEU HA 1 70 GLN H . . 3.960 3.921 3.766 4.013 0.053 7 0 "[ . 1 . 2]" 1
1159 1 67 LEU QB 1 68 PHE H . . 2.970 2.489 2.252 2.737 . 0 0 "[ . 1 . 2]" 1
1160 1 67 LEU QB 1 69 ALA H . . 5.340 4.573 4.448 4.736 . 0 0 "[ . 1 . 2]" 1
1161 1 67 LEU HB2 1 68 PHE H . . 3.490 3.475 3.210 3.551 0.061 13 0 "[ . 1 . 2]" 1
1162 1 67 LEU HB3 1 68 PHE H . . 3.490 2.562 2.278 2.893 . 0 0 "[ . 1 . 2]" 1
1163 1 67 LEU QD 1 68 PHE H . . 3.970 3.690 3.262 4.045 0.075 4 0 "[ . 1 . 2]" 1
1164 1 67 LEU QD 1 70 GLN H . . 4.750 4.673 4.560 4.816 0.066 6 0 "[ . 1 . 2]" 1
1165 1 67 LEU MD1 1 68 PHE H . . 4.670 3.874 3.343 4.472 . 0 0 "[ . 1 . 2]" 1
1166 1 67 LEU MD1 1 70 GLN H . . 5.500 5.084 4.874 5.406 . 0 0 "[ . 1 . 2]" 1
1167 1 67 LEU MD2 1 68 PHE H . . 4.670 4.706 4.546 4.749 0.079 1 0 "[ . 1 . 2]" 1
1168 1 67 LEU MD2 1 70 GLN H . . 5.500 5.467 5.154 5.571 0.071 14 0 "[ . 1 . 2]" 1
1169 1 68 PHE H 1 68 PHE HB3 . . 2.830 2.124 2.020 2.204 . 0 0 "[ . 1 . 2]" 1
1170 1 68 PHE H 1 68 PHE QD . . 3.470 2.971 2.693 3.289 . 0 0 "[ . 1 . 2]" 1
1171 1 68 PHE H 1 68 PHE QE . . 5.080 5.052 4.817 5.142 0.062 9 0 "[ . 1 . 2]" 1
1172 1 68 PHE H 1 69 ALA H . . 2.970 2.534 2.432 2.666 . 0 0 "[ . 1 . 2]" 1
1173 1 68 PHE H 1 69 ALA MB . . 4.230 4.285 4.203 4.313 0.083 18 0 "[ . 1 . 2]" 1
1174 1 68 PHE H 1 70 GLN H . . 4.140 4.106 4.008 4.189 0.049 13 0 "[ . 1 . 2]" 1
1175 1 68 PHE HA 1 68 PHE QD . . 3.960 3.527 3.425 3.629 . 0 0 "[ . 1 . 2]" 1
1176 1 68 PHE HB3 1 69 ALA H . . 3.690 3.596 3.482 3.690 . 0 0 "[ . 1 . 2]" 1
1177 1 68 PHE HB3 1 70 GLN H . . 5.500 5.567 5.555 5.575 0.075 5 0 "[ . 1 . 2]" 1
1178 1 68 PHE QD 1 69 ALA H . . 4.310 3.158 2.704 3.498 . 0 0 "[ . 1 . 2]" 1
1179 1 68 PHE QD 1 69 ALA HA . . 4.330 3.687 3.035 4.130 . 0 0 "[ . 1 . 2]" 1
1180 1 68 PHE QD 1 70 GLN H . . 5.230 5.191 4.942 5.283 0.053 7 0 "[ . 1 . 2]" 1
1181 1 68 PHE QE 1 69 ALA H . . 4.680 4.224 3.830 4.445 . 0 0 "[ . 1 . 2]" 1
1182 1 68 PHE QE 1 69 ALA HA . . 4.310 3.745 3.206 4.234 . 0 0 "[ . 1 . 2]" 1
1183 1 68 PHE HZ 1 69 ALA HA . . 4.750 4.566 4.097 4.799 0.049 6 0 "[ . 1 . 2]" 1
1184 1 68 PHE HZ 1 69 ALA MB . . 4.690 3.894 3.170 4.402 . 0 0 "[ . 1 . 2]" 1
1185 1 69 ALA H 1 69 ALA HA . . 2.940 2.905 2.865 2.942 0.002 12 0 "[ . 1 . 2]" 1
1186 1 69 ALA H 1 69 ALA MB . . 2.520 2.265 2.195 2.313 . 0 0 "[ . 1 . 2]" 1
1187 1 69 ALA H 1 70 GLN H . . 2.800 2.513 2.259 2.728 . 0 0 "[ . 1 . 2]" 1
1188 1 69 ALA H 1 70 GLN QB . . 5.340 4.964 4.728 5.108 . 0 0 "[ . 1 . 2]" 1
1189 1 69 ALA H 1 70 GLN QG . . 4.480 4.431 4.040 4.556 0.076 9 0 "[ . 1 . 2]" 1
1190 1 69 ALA H 1 71 PRO HD3 . . 4.690 4.283 4.039 4.595 . 0 0 "[ . 1 . 2]" 1
1191 1 69 ALA HA 1 70 GLN H . . 3.540 3.531 3.497 3.559 0.019 7 0 "[ . 1 . 2]" 1
1192 1 69 ALA MB 1 70 GLN H . . 2.970 2.687 2.502 2.888 . 0 0 "[ . 1 . 2]" 1
1193 1 70 GLN H 1 70 GLN QB . . 2.980 2.843 2.708 3.066 0.086 12 0 "[ . 1 . 2]" 1
1194 1 70 GLN H 1 70 GLN HG2 . . 3.730 3.711 2.460 3.797 0.067 19 0 "[ . 1 . 2]" 1
1195 1 70 GLN H 1 70 GLN QG . . 3.190 2.941 2.417 3.148 . 0 0 "[ . 1 . 2]" 1
1196 1 70 GLN H 1 70 GLN HG3 . . 3.730 3.131 2.904 3.547 . 0 0 "[ . 1 . 2]" 1
1197 1 70 GLN H 1 71 PRO HA . . 4.380 4.337 4.228 4.405 0.025 7 0 "[ . 1 . 2]" 1
1198 1 70 GLN H 1 71 PRO HB3 . . 5.220 4.826 4.661 5.004 . 0 0 "[ . 1 . 2]" 1
1199 1 70 GLN H 1 71 PRO HD2 . . 4.360 3.993 3.728 4.223 . 0 0 "[ . 1 . 2]" 1
1200 1 70 GLN H 1 71 PRO HD3 . . 3.490 3.045 2.804 3.362 . 0 0 "[ . 1 . 2]" 1
1201 1 70 GLN QB 1 72 THR H . . 4.180 3.618 3.429 4.041 . 0 0 "[ . 1 . 2]" 1
1202 1 70 GLN QB 1 75 ALA H . . 4.990 4.500 4.281 4.833 . 0 0 "[ . 1 . 2]" 1
1203 1 71 PRO HA 1 72 THR H . . 3.210 2.738 2.587 2.819 . 0 0 "[ . 1 . 2]" 1
1204 1 71 PRO HD2 1 72 THR H . . 4.680 4.457 4.235 4.664 . 0 0 "[ . 1 . 2]" 1
1205 1 72 THR H 1 72 THR HG1 . . 4.450 2.641 2.074 3.693 . 0 0 "[ . 1 . 2]" 1
1206 1 72 THR H 1 72 THR MG . . 3.790 3.695 3.507 3.839 0.049 16 0 "[ . 1 . 2]" 1
1207 1 72 THR H 1 73 ILE H . . 4.610 4.357 4.288 4.403 . 0 0 "[ . 1 . 2]" 1
1208 1 72 THR H 1 73 ILE HA . . 5.270 4.937 4.780 5.045 . 0 0 "[ . 1 . 2]" 1
1209 1 72 THR H 1 74 LYS H . . 5.480 5.335 5.195 5.505 0.025 13 0 "[ . 1 . 2]" 1
1210 1 72 THR H 1 75 ALA H . . 4.080 3.976 3.835 4.138 0.058 20 0 "[ . 1 . 2]" 1
1211 1 72 THR H 1 75 ALA HA . . 5.500 5.561 5.534 5.570 0.070 1 0 "[ . 1 . 2]" 1
1212 1 72 THR H 1 75 ALA MB . . 3.180 2.562 2.513 2.605 . 0 0 "[ . 1 . 2]" 1
1213 1 72 THR H 1 76 LEU H . . 4.020 3.978 3.692 4.080 0.060 14 0 "[ . 1 . 2]" 1
1214 1 72 THR H 1 76 LEU MD2 . . 4.570 3.098 2.872 3.229 . 0 0 "[ . 1 . 2]" 1
1215 1 72 THR H 1 76 LEU HG . . 4.090 3.391 3.034 3.565 . 0 0 "[ . 1 . 2]" 1
1216 1 72 THR HA 1 73 ILE H . . 3.150 2.195 2.125 2.275 . 0 0 "[ . 1 . 2]" 1
1217 1 72 THR HA 1 74 LYS H . . 4.220 4.183 3.973 4.282 0.062 13 0 "[ . 1 . 2]" 1
1218 1 72 THR HA 1 75 ALA H . . 5.030 4.621 4.543 4.704 . 0 0 "[ . 1 . 2]" 1
1219 1 72 THR HB 1 73 ILE H . . 3.640 3.080 2.834 3.218 . 0 0 "[ . 1 . 2]" 1
1220 1 72 THR HB 1 74 LYS H . . 3.320 2.641 2.291 2.967 . 0 0 "[ . 1 . 2]" 1
1221 1 72 THR HB 1 75 ALA H . . 3.910 2.595 2.414 2.814 . 0 0 "[ . 1 . 2]" 1
1222 1 72 THR HB 1 76 LEU H . . 5.210 4.672 4.530 4.860 . 0 0 "[ . 1 . 2]" 1
1223 1 72 THR HG1 1 74 LYS H . . 5.040 4.805 4.258 5.100 0.060 7 0 "[ . 1 . 2]" 1
1224 1 72 THR HG1 1 75 ALA H . . 3.740 3.289 2.796 3.756 0.016 4 0 "[ . 1 . 2]" 1
1225 1 72 THR HG1 1 76 LEU H . . 5.120 4.956 4.166 5.188 0.068 1 0 "[ . 1 . 2]" 1
1226 1 72 THR MG 1 73 ILE H . . 3.790 3.004 2.791 3.227 . 0 0 "[ . 1 . 2]" 1
1227 1 72 THR MG 1 74 LYS H . . 3.600 3.677 3.655 3.690 0.090 5 0 "[ . 1 . 2]" 1
1228 1 72 THR MG 1 75 ALA H . . 4.500 4.178 4.039 4.421 . 0 0 "[ . 1 . 2]" 1
1229 1 73 ILE H 1 73 ILE HB . . 3.200 2.281 2.104 2.367 . 0 0 "[ . 1 . 2]" 1
1230 1 73 ILE H 1 73 ILE MD . . 3.770 3.614 3.481 3.755 . 0 0 "[ . 1 . 2]" 1
1231 1 73 ILE H 1 73 ILE HG12 . . 3.440 2.451 2.283 2.638 . 0 0 "[ . 1 . 2]" 1
1232 1 73 ILE H 1 73 ILE HG13 . . 3.880 3.708 3.530 3.814 . 0 0 "[ . 1 . 2]" 1
1233 1 73 ILE H 1 73 ILE MG . . 3.870 3.733 3.650 3.781 . 0 0 "[ . 1 . 2]" 1
1234 1 73 ILE H 1 74 LYS H . . 3.330 2.805 2.640 2.892 . 0 0 "[ . 1 . 2]" 1
1235 1 73 ILE H 1 74 LYS HB3 . . 4.960 4.940 4.796 5.025 0.065 16 0 "[ . 1 . 2]" 1
1236 1 73 ILE H 1 75 ALA H . . 4.640 4.378 4.257 4.482 . 0 0 "[ . 1 . 2]" 1
1237 1 73 ILE H 1 75 ALA MB . . 5.030 5.045 4.947 5.102 0.072 17 0 "[ . 1 . 2]" 1
1238 1 73 ILE H 1 76 LEU H . . 4.920 4.925 4.818 4.966 0.046 15 0 "[ . 1 . 2]" 1
1239 1 73 ILE H 1 76 LEU HB2 . . 5.500 5.486 5.358 5.558 0.058 14 0 "[ . 1 . 2]" 1
1240 1 73 ILE H 1 76 LEU MD2 . . 5.500 5.581 5.565 5.594 0.094 20 0 "[ . 1 . 2]" 1
1241 1 73 ILE HA 1 75 ALA H . . 4.460 4.431 4.244 4.519 0.059 20 0 "[ . 1 . 2]" 1
1242 1 73 ILE HA 1 76 LEU H . . 3.550 3.432 3.282 3.592 0.042 13 0 "[ . 1 . 2]" 1
1243 1 73 ILE HA 1 77 ALA H . . 3.670 3.667 3.545 3.728 0.058 9 0 "[ . 1 . 2]" 1
1244 1 73 ILE HB 1 74 LYS H . . 3.260 2.688 2.524 2.828 . 0 0 "[ . 1 . 2]" 1
1245 1 73 ILE MD 1 74 LYS H . . 4.720 4.779 4.689 4.798 0.078 6 0 "[ . 1 . 2]" 1
1246 1 73 ILE HG12 1 74 LYS H . . 4.790 4.583 4.436 4.684 . 0 0 "[ . 1 . 2]" 1
1247 1 73 ILE HG13 1 74 LYS H . . 5.080 5.020 4.796 5.138 0.058 14 0 "[ . 1 . 2]" 1
1248 1 73 ILE MG 1 74 LYS H . . 3.540 3.072 2.866 3.238 . 0 0 "[ . 1 . 2]" 1
1249 1 73 ILE MG 1 75 ALA H . . 4.970 4.946 4.825 5.039 0.069 7 0 "[ . 1 . 2]" 1
1250 1 74 LYS H 1 74 LYS HB2 . . 2.820 2.505 2.295 2.650 . 0 0 "[ . 1 . 2]" 1
1251 1 74 LYS H 1 74 LYS HB3 . . 2.740 2.514 2.381 2.657 . 0 0 "[ . 1 . 2]" 1
1252 1 74 LYS H 1 74 LYS QG . . 4.680 3.987 3.890 4.041 . 0 0 "[ . 1 . 2]" 1
1253 1 74 LYS H 1 75 ALA H . . 3.190 2.872 2.797 2.965 . 0 0 "[ . 1 . 2]" 1
1254 1 74 LYS H 1 76 LEU H . . 4.620 4.440 4.325 4.576 . 0 0 "[ . 1 . 2]" 1
1255 1 74 LYS H 1 77 ALA H . . 4.860 4.773 4.684 4.854 . 0 0 "[ . 1 . 2]" 1
1256 1 74 LYS H 1 77 ALA MB . . 5.170 4.538 4.424 4.698 . 0 0 "[ . 1 . 2]" 1
1257 1 74 LYS HA 1 76 LEU H . . 4.870 4.655 4.466 4.924 0.054 17 0 "[ . 1 . 2]" 1
1258 1 74 LYS HB3 1 75 ALA H . . 3.150 2.546 2.231 2.829 . 0 0 "[ . 1 . 2]" 1
1259 1 74 LYS QE 1 75 ALA H . . 5.500 4.863 4.091 5.574 0.074 16 0 "[ . 1 . 2]" 1
1260 1 74 LYS QG 1 75 ALA H . . 3.710 3.451 3.286 3.627 . 0 0 "[ . 1 . 2]" 1
1261 1 74 LYS QG 1 77 ALA H . . 5.340 5.156 4.860 5.409 0.069 17 0 "[ . 1 . 2]" 1
1262 1 74 LYS HG2 1 75 ALA H . . 4.320 3.619 3.397 3.876 . 0 0 "[ . 1 . 2]" 1
1263 1 74 LYS HG3 1 75 ALA H . . 4.320 4.373 4.308 4.394 0.074 20 0 "[ . 1 . 2]" 1
1264 1 75 ALA H 1 75 ALA MB . . 2.510 2.261 2.202 2.333 . 0 0 "[ . 1 . 2]" 1
1265 1 75 ALA H 1 76 LEU H . . 2.900 2.820 2.685 2.909 0.009 13 0 "[ . 1 . 2]" 1
1266 1 75 ALA H 1 76 LEU HA . . 5.430 5.417 5.309 5.478 0.048 19 0 "[ . 1 . 2]" 1
1267 1 75 ALA H 1 76 LEU HB2 . . 5.500 5.140 5.032 5.214 . 0 0 "[ . 1 . 2]" 1
1268 1 75 ALA H 1 76 LEU HG . . 4.580 4.571 4.258 4.647 0.067 12 0 "[ . 1 . 2]" 1
1269 1 75 ALA H 1 77 ALA H . . 4.120 4.132 3.997 4.180 0.060 8 0 "[ . 1 . 2]" 1
1270 1 75 ALA HA 1 77 ALA H . . 4.620 4.578 4.470 4.661 0.041 20 0 "[ . 1 . 2]" 1
1271 1 75 ALA HA 1 78 GLN H . . 3.930 3.769 3.480 3.956 0.026 15 0 "[ . 1 . 2]" 1
1272 1 75 ALA HA 1 79 TYR H . . 4.080 4.015 3.892 4.120 0.040 6 0 "[ . 1 . 2]" 1
1273 1 75 ALA MB 1 76 LEU H . . 2.760 2.551 2.311 2.653 . 0 0 "[ . 1 . 2]" 1
1274 1 75 ALA MB 1 78 GLN H . . 4.970 4.808 4.571 4.935 . 0 0 "[ . 1 . 2]" 1
1275 1 75 ALA MB 1 79 TYR H . . 4.650 4.532 4.416 4.680 0.030 6 0 "[ . 1 . 2]" 1
1276 1 75 ALA MB 1 79 TYR QD . . 5.310 5.384 5.233 5.408 0.098 2 0 "[ . 1 . 2]" 1
1277 1 76 LEU H 1 76 LEU HB2 . . 2.840 2.574 2.485 2.709 . 0 0 "[ . 1 . 2]" 1
1278 1 76 LEU H 1 76 LEU MD1 . . 3.970 3.902 3.767 3.983 0.013 5 0 "[ . 1 . 2]" 1
1279 1 76 LEU H 1 76 LEU MD2 . . 3.510 2.672 2.499 2.778 . 0 0 "[ . 1 . 2]" 1
1280 1 76 LEU H 1 76 LEU HG . . 3.170 2.440 2.218 2.560 . 0 0 "[ . 1 . 2]" 1
1281 1 76 LEU H 1 77 ALA H . . 2.990 2.464 2.341 2.623 . 0 0 "[ . 1 . 2]" 1
1282 1 76 LEU H 1 78 GLN H . . 4.470 4.213 4.031 4.405 . 0 0 "[ . 1 . 2]" 1
1283 1 76 LEU H 1 79 TYR H . . 4.870 4.575 4.472 4.662 . 0 0 "[ . 1 . 2]" 1
1284 1 76 LEU H 1 79 TYR HB2 . . 5.500 5.459 5.298 5.552 0.052 19 0 "[ . 1 . 2]" 1
1285 1 76 LEU H 1 80 VAL H . . 5.500 5.582 5.578 5.587 0.087 18 0 "[ . 1 . 2]" 1
1286 1 76 LEU HA 1 79 TYR H . . 3.990 3.414 3.278 3.510 . 0 0 "[ . 1 . 2]" 1
1287 1 76 LEU HA 1 79 TYR QD . . 3.740 3.615 3.044 3.811 0.071 19 0 "[ . 1 . 2]" 1
1288 1 76 LEU HA 1 80 VAL H . . 3.800 3.519 3.404 3.687 . 0 0 "[ . 1 . 2]" 1
1289 1 76 LEU HB2 1 77 ALA H . . 3.320 2.593 2.489 2.737 . 0 0 "[ . 1 . 2]" 1
1290 1 76 LEU HB2 1 78 GLN H . . 5.420 5.222 5.050 5.379 . 0 0 "[ . 1 . 2]" 1
1291 1 76 LEU HB2 1 79 TYR H . . 5.500 5.504 5.374 5.550 0.050 9 0 "[ . 1 . 2]" 1
1292 1 76 LEU HB2 1 80 VAL H . . 5.500 5.268 5.187 5.360 . 0 0 "[ . 1 . 2]" 1
1293 1 76 LEU MD2 1 77 ALA H . . 4.370 4.443 4.432 4.452 0.082 15 0 "[ . 1 . 2]" 1
1294 1 76 LEU MD2 1 79 TYR H . . 5.230 4.932 4.831 5.052 . 0 0 "[ . 1 . 2]" 1
1295 1 76 LEU HG 1 77 ALA H . . 4.150 4.131 4.051 4.197 0.047 5 0 "[ . 1 . 2]" 1
1296 1 77 ALA H 1 77 ALA MB . . 2.580 2.257 2.212 2.298 . 0 0 "[ . 1 . 2]" 1
1297 1 77 ALA H 1 78 GLN H . . 2.970 2.857 2.737 2.985 0.015 6 0 "[ . 1 . 2]" 1
1298 1 77 ALA H 1 78 GLN QB . . 5.140 4.974 4.649 5.196 0.056 18 0 "[ . 1 . 2]" 1
1299 1 77 ALA H 1 78 GLN QG . . 5.340 4.372 4.129 4.560 . 0 0 "[ . 1 . 2]" 1
1300 1 77 ALA H 1 79 TYR H . . 4.130 4.140 4.009 4.196 0.066 3 0 "[ . 1 . 2]" 1
1301 1 77 ALA H 1 80 VAL H . . 4.710 4.639 4.525 4.721 0.011 2 0 "[ . 1 . 2]" 1
1302 1 77 ALA HA 1 79 TYR H . . 4.760 4.622 4.423 4.739 . 0 0 "[ . 1 . 2]" 1
1303 1 77 ALA HA 1 80 VAL H . . 3.920 3.817 3.630 3.960 0.040 6 0 "[ . 1 . 2]" 1
1304 1 77 ALA HA 1 81 ALA H . . 4.040 3.831 3.630 4.086 0.046 15 0 "[ . 1 . 2]" 1
1305 1 77 ALA MB 1 78 GLN H . . 2.950 2.452 2.322 2.694 . 0 0 "[ . 1 . 2]" 1
1306 1 77 ALA MB 1 79 TYR H . . 4.790 4.513 4.379 4.606 . 0 0 "[ . 1 . 2]" 1
1307 1 78 GLN H 1 78 GLN QB . . 2.600 2.441 2.299 2.657 0.057 18 0 "[ . 1 . 2]" 1
1308 1 78 GLN H 1 78 GLN HG2 . . 3.710 2.937 2.097 3.616 . 0 0 "[ . 1 . 2]" 1
1309 1 78 GLN H 1 78 GLN QG . . 3.090 2.231 2.051 2.391 . 0 0 "[ . 1 . 2]" 1
1310 1 78 GLN H 1 78 GLN HG3 . . 3.710 2.846 2.070 3.740 0.030 20 0 "[ . 1 . 2]" 1
1311 1 78 GLN H 1 79 TYR H . . 2.830 2.651 2.483 2.769 . 0 0 "[ . 1 . 2]" 1
1312 1 78 GLN H 1 79 TYR HB2 . . 5.240 5.159 5.003 5.297 0.057 2 0 "[ . 1 . 2]" 1
1313 1 78 GLN H 1 79 TYR HB3 . . 4.730 4.697 4.509 4.789 0.059 7 0 "[ . 1 . 2]" 1
1314 1 78 GLN H 1 80 VAL H . . 4.400 4.187 3.870 4.429 0.029 16 0 "[ . 1 . 2]" 1
1315 1 78 GLN H 1 80 VAL HB . . 5.500 5.445 5.206 5.563 0.063 6 0 "[ . 1 . 2]" 1
1316 1 78 GLN H 1 81 ALA H . . 4.630 4.573 4.456 4.691 0.061 10 0 "[ . 1 . 2]" 1
1317 1 78 GLN HA 1 81 ALA H . . 3.650 3.406 3.199 3.683 0.033 10 0 "[ . 1 . 2]" 1
1318 1 78 GLN QB 1 79 TYR H . . 3.510 3.197 2.466 3.583 0.073 18 0 "[ . 1 . 2]" 1
1319 1 78 GLN QB 1 80 VAL H . . 5.500 5.071 4.502 5.460 . 0 0 "[ . 1 . 2]" 1
1320 1 78 GLN QB 1 81 ALA H . . 5.210 4.920 4.773 5.155 . 0 0 "[ . 1 . 2]" 1
1321 1 78 GLN QB 1 82 THR H . . 4.910 4.692 4.391 4.983 0.073 11 0 "[ . 1 . 2]" 1
1322 1 78 GLN QG 1 79 TYR H . . 4.410 3.021 2.130 4.204 . 0 0 "[ . 1 . 2]" 1
1323 1 78 GLN QG 1 80 VAL H . . 5.340 4.966 4.420 5.436 0.096 13 0 "[ . 1 . 2]" 1
1324 1 78 GLN QG 1 81 ALA H . . 5.340 5.194 4.931 5.417 0.077 14 0 "[ . 1 . 2]" 1
1325 1 78 GLN HG2 1 79 TYR H . . 5.040 3.716 2.261 5.080 0.040 8 0 "[ . 1 . 2]" 1
1326 1 78 GLN HG3 1 79 TYR H . . 5.040 3.327 2.140 4.485 . 0 0 "[ . 1 . 2]" 1
1327 1 79 TYR H 1 79 TYR HB2 . . 2.950 2.658 2.525 2.785 . 0 0 "[ . 1 . 2]" 1
1328 1 79 TYR H 1 79 TYR HB3 . . 2.770 2.353 2.274 2.443 . 0 0 "[ . 1 . 2]" 1
1329 1 79 TYR H 1 79 TYR QD . . 4.270 4.146 4.081 4.208 . 0 0 "[ . 1 . 2]" 1
1330 1 79 TYR H 1 80 VAL H . . 2.960 2.611 2.478 2.739 . 0 0 "[ . 1 . 2]" 1
1331 1 79 TYR H 1 80 VAL HB . . 4.780 4.807 4.693 4.846 0.066 18 0 "[ . 1 . 2]" 1
1332 1 79 TYR H 1 80 VAL MG2 . . 5.490 4.408 4.262 4.575 . 0 0 "[ . 1 . 2]" 1
1333 1 79 TYR H 1 81 ALA H . . 4.060 4.034 3.789 4.124 0.064 17 0 "[ . 1 . 2]" 1
1334 1 79 TYR H 1 81 ALA MB . . 5.230 4.683 4.457 4.882 . 0 0 "[ . 1 . 2]" 1
1335 1 79 TYR H 1 82 THR MG . . 4.860 4.489 4.181 4.774 . 0 0 "[ . 1 . 2]" 1
1336 1 79 TYR HA 1 79 TYR QD . . 3.150 3.003 2.730 3.198 0.048 18 0 "[ . 1 . 2]" 1
1337 1 79 TYR HA 1 79 TYR QE . . 4.960 4.807 4.553 4.961 0.001 18 0 "[ . 1 . 2]" 1
1338 1 79 TYR HB3 1 80 VAL H . . 3.410 2.493 2.365 2.652 . 0 0 "[ . 1 . 2]" 1
1339 1 79 TYR HB3 1 81 ALA H . . 5.110 4.948 4.760 5.116 0.006 15 0 "[ . 1 . 2]" 1
1340 1 79 TYR QD 1 80 VAL H . . 3.480 2.986 2.739 3.210 . 0 0 "[ . 1 . 2]" 1
1341 1 79 TYR QD 1 80 VAL HB . . 5.180 4.226 3.979 4.337 . 0 0 "[ . 1 . 2]" 1
1342 1 79 TYR QD 1 80 VAL MG1 . . 4.690 4.379 4.208 4.593 . 0 0 "[ . 1 . 2]" 1
1343 1 79 TYR QD 1 80 VAL MG2 . . 2.900 2.127 2.024 2.197 . 0 0 "[ . 1 . 2]" 1
1344 1 79 TYR QD 1 81 ALA H . . 5.130 5.189 5.106 5.217 0.087 13 0 "[ . 1 . 2]" 1
1345 1 79 TYR QD 1 82 THR MG . . 4.550 4.087 3.496 4.444 . 0 0 "[ . 1 . 2]" 1
1346 1 79 TYR QD 1 83 ARG H . . 5.500 5.471 5.216 5.564 0.064 7 0 "[ . 1 . 2]" 1
1347 1 79 TYR QD 1 83 ARG QB . . 4.990 4.606 4.140 4.934 . 0 0 "[ . 1 . 2]" 1
1348 1 79 TYR QD 1 83 ARG HD2 . . 4.480 3.473 3.255 3.639 . 0 0 "[ . 1 . 2]" 1
1349 1 79 TYR QD 1 83 ARG QD . . 3.800 3.331 2.936 3.500 . 0 0 "[ . 1 . 2]" 1
1350 1 79 TYR QD 1 83 ARG HD3 . . 4.480 4.376 3.324 4.551 0.071 15 0 "[ . 1 . 2]" 1
1351 1 79 TYR QD 1 83 ARG QG . . 4.700 4.669 4.443 4.775 0.075 20 0 "[ . 1 . 2]" 1
1352 1 79 TYR QE 1 80 VAL H . . 5.380 5.178 4.828 5.402 0.022 11 0 "[ . 1 . 2]" 1
1353 1 79 TYR QE 1 80 VAL MG2 . . 3.270 3.260 2.860 3.364 0.094 4 0 "[ . 1 . 2]" 1
1354 1 79 TYR QE 1 82 THR MG . . 5.500 4.967 4.187 5.387 . 0 0 "[ . 1 . 2]" 1
1355 1 79 TYR QE 1 83 ARG HD2 . . 3.850 3.039 2.773 3.226 . 0 0 "[ . 1 . 2]" 1
1356 1 79 TYR QE 1 83 ARG HD3 . . 3.850 3.342 2.832 3.582 . 0 0 "[ . 1 . 2]" 1
1357 1 79 TYR QE 1 83 ARG QG . . 4.500 4.453 4.288 4.571 0.071 3 0 "[ . 1 . 2]" 1
1358 1 80 VAL H 1 80 VAL HB . . 2.730 2.431 2.326 2.545 . 0 0 "[ . 1 . 2]" 1
1359 1 80 VAL H 1 80 VAL MG1 . . 3.890 3.834 3.745 3.926 0.036 13 0 "[ . 1 . 2]" 1
1360 1 80 VAL H 1 80 VAL MG2 . . 2.710 2.434 2.277 2.563 . 0 0 "[ . 1 . 2]" 1
1361 1 80 VAL H 1 81 ALA H . . 2.900 2.624 2.438 2.756 . 0 0 "[ . 1 . 2]" 1
1362 1 80 VAL H 1 81 ALA MB . . 4.230 4.292 4.217 4.317 0.087 18 0 "[ . 1 . 2]" 1
1363 1 80 VAL H 1 82 THR H . . 4.490 4.351 4.173 4.518 0.028 18 0 "[ . 1 . 2]" 1
1364 1 80 VAL H 1 82 THR MG . . 4.780 4.543 4.227 4.741 . 0 0 "[ . 1 . 2]" 1
1365 1 80 VAL H 1 83 ARG H . . 5.040 4.997 4.782 5.096 0.056 4 0 "[ . 1 . 2]" 1
1366 1 80 VAL H 1 83 ARG QB . . 5.340 5.191 4.969 5.421 0.081 13 0 "[ . 1 . 2]" 1
1367 1 80 VAL H 1 83 ARG QD . . 5.340 4.909 4.253 5.253 . 0 0 "[ . 1 . 2]" 1
1368 1 80 VAL HA 1 82 THR H . . 4.900 4.523 4.152 4.714 . 0 0 "[ . 1 . 2]" 1
1369 1 80 VAL HA 1 83 ARG H . . 3.780 3.449 3.247 3.587 . 0 0 "[ . 1 . 2]" 1
1370 1 80 VAL HA 1 84 SER H . . 4.680 3.987 3.477 4.264 . 0 0 "[ . 1 . 2]" 1
1371 1 80 VAL HB 1 81 ALA H . . 2.940 2.778 2.634 2.974 0.034 4 0 "[ . 1 . 2]" 1
1372 1 80 VAL HB 1 82 THR H . . 5.500 5.370 5.247 5.485 . 0 0 "[ . 1 . 2]" 1
1373 1 80 VAL HB 1 83 ARG H . . 5.500 5.560 5.550 5.571 0.071 17 0 "[ . 1 . 2]" 1
1374 1 80 VAL MG1 1 81 ALA H . . 3.650 3.470 3.315 3.612 . 0 0 "[ . 1 . 2]" 1
1375 1 80 VAL MG1 1 82 THR H . . 5.290 5.193 5.032 5.357 0.067 13 0 "[ . 1 . 2]" 1
1376 1 80 VAL MG1 1 83 ARG H . . 4.780 4.502 4.306 4.800 0.020 16 0 "[ . 1 . 2]" 1
1377 1 80 VAL MG1 1 84 SER H . . 4.690 3.804 3.320 4.283 . 0 0 "[ . 1 . 2]" 1
1378 1 80 VAL MG2 1 81 ALA H . . 4.130 4.067 3.986 4.139 0.009 4 0 "[ . 1 . 2]" 1
1379 1 81 ALA H 1 81 ALA HA . . 2.940 2.816 2.763 2.896 . 0 0 "[ . 1 . 2]" 1
1380 1 81 ALA H 1 81 ALA MB . . 2.520 2.251 2.180 2.340 . 0 0 "[ . 1 . 2]" 1
1381 1 81 ALA H 1 82 THR H . . 3.030 2.900 2.774 2.995 . 0 0 "[ . 1 . 2]" 1
1382 1 81 ALA H 1 82 THR HB . . 5.300 5.181 4.856 5.365 0.065 20 0 "[ . 1 . 2]" 1
1383 1 81 ALA H 1 82 THR MG . . 4.430 4.373 4.074 4.502 0.072 6 0 "[ . 1 . 2]" 1
1384 1 81 ALA H 1 83 ARG H . . 4.210 4.129 3.976 4.214 0.004 6 0 "[ . 1 . 2]" 1
1385 1 81 ALA H 1 84 SER H . . 4.810 4.720 4.625 4.804 . 0 0 "[ . 1 . 2]" 1
1386 1 81 ALA HA 1 83 ARG H . . 4.230 4.095 3.823 4.280 0.050 20 0 "[ . 1 . 2]" 1
1387 1 81 ALA HA 1 84 SER H . . 3.900 3.451 3.136 3.888 . 0 0 "[ . 1 . 2]" 1
1388 1 81 ALA MB 1 82 THR H . . 2.930 2.542 2.356 2.747 . 0 0 "[ . 1 . 2]" 1
1389 1 82 THR H 1 82 THR HB . . 2.990 2.434 2.201 2.664 . 0 0 "[ . 1 . 2]" 1
1390 1 82 THR H 1 82 THR MG . . 3.130 2.329 2.143 2.582 . 0 0 "[ . 1 . 2]" 1
1391 1 82 THR H 1 83 ARG H . . 2.890 2.674 2.507 2.798 . 0 0 "[ . 1 . 2]" 1
1392 1 82 THR H 1 83 ARG QB . . 5.200 4.572 4.335 4.729 . 0 0 "[ . 1 . 2]" 1
1393 1 82 THR H 1 83 ARG QD . . 5.340 5.371 5.256 5.417 0.077 9 0 "[ . 1 . 2]" 1
1394 1 82 THR H 1 84 SER H . . 4.160 4.195 4.095 4.227 0.067 1 0 "[ . 1 . 2]" 1
1395 1 82 THR HA 1 83 ARG H . . 3.510 3.511 3.421 3.564 0.054 13 0 "[ . 1 . 2]" 1
1396 1 82 THR HA 1 84 SER H . . 4.740 4.470 4.169 4.784 0.044 11 0 "[ . 1 . 2]" 1
1397 1 82 THR MG 1 83 ARG H . . 3.760 2.747 2.393 3.080 . 0 0 "[ . 1 . 2]" 1
1398 1 82 THR MG 1 84 SER H . . 4.860 4.644 4.433 4.866 0.006 9 0 "[ . 1 . 2]" 1
1399 1 83 ARG H 1 83 ARG QB . . 3.150 2.277 2.175 2.447 . 0 0 "[ . 1 . 2]" 1
1400 1 83 ARG H 1 83 ARG HD2 . . 4.750 4.024 3.813 4.293 . 0 0 "[ . 1 . 2]" 1
1401 1 83 ARG H 1 83 ARG QD . . 3.940 3.765 3.608 3.999 0.059 9 0 "[ . 1 . 2]" 1
1402 1 83 ARG H 1 83 ARG HD3 . . 4.750 4.555 4.074 4.799 0.049 8 0 "[ . 1 . 2]" 1
1403 1 83 ARG H 1 83 ARG QG . . 3.150 2.806 2.501 3.111 . 0 0 "[ . 1 . 2]" 1
1404 1 83 ARG H 1 84 SER H . . 2.900 2.286 2.013 2.495 . 0 0 "[ . 1 . 2]" 1
1405 1 83 ARG H 1 84 SER HA . . 5.040 4.988 4.781 5.099 0.059 13 0 "[ . 1 . 2]" 1
1406 1 83 ARG H 1 84 SER QB . . 4.600 4.193 3.703 4.662 0.062 20 0 "[ . 1 . 2]" 1
1407 1 83 ARG QB 1 84 SER H . . 3.850 2.828 2.423 3.874 0.024 16 0 "[ . 1 . 2]" 1
1408 1 83 ARG HB2 1 84 SER H . . 4.460 2.984 2.499 4.516 0.056 16 0 "[ . 1 . 2]" 1
1409 1 83 ARG HB3 1 84 SER H . . 4.460 3.632 3.219 4.217 . 0 0 "[ . 1 . 2]" 1
1410 1 83 ARG HD2 1 84 SER H . . 5.500 5.441 5.184 5.565 0.065 20 0 "[ . 1 . 2]" 1
1411 1 83 ARG HD3 1 84 SER H . . 5.500 5.329 4.728 5.570 0.070 15 0 "[ . 1 . 2]" 1
1412 1 83 ARG QG 1 84 SER H . . 4.800 4.150 2.928 4.376 . 0 0 "[ . 1 . 2]" 1
1413 1 84 SER H 1 84 SER QB . . 3.090 2.349 2.062 2.757 . 0 0 "[ . 1 . 2]" 1
1414 1 84 SER H 1 85 HIS HA . . 5.390 5.076 4.195 5.436 0.046 8 0 "[ . 1 . 2]" 1
1415 1 84 SER H 1 85 HIS QB . . 4.990 4.600 4.293 5.059 0.069 4 0 "[ . 1 . 2]" 1
1416 1 85 HIS HA 1 86 HIS H . . 3.540 2.261 2.102 2.568 . 0 0 "[ . 1 . 2]" 1
1417 1 85 HIS QB 1 86 HIS H . . 4.320 3.253 2.204 4.069 . 0 0 "[ . 1 . 2]" 1
1418 1 86 HIS H 1 86 HIS QB . . 3.630 2.551 2.148 3.359 . 0 0 "[ . 1 . 2]" 1
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