NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
545755 |
2rsm   |
11491 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2rsm
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 1404
_Distance_constraint_stats_list.Viol_count 2279
_Distance_constraint_stats_list.Viol_total 2399.556
_Distance_constraint_stats_list.Viol_max 0.153
_Distance_constraint_stats_list.Viol_rms 0.0156
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0043
_Distance_constraint_stats_list.Viol_average_violations_only 0.0526
_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 9 TRP 0.975 0.066 9 0 "[ . 1 . 2]"
1 10 GLY 0.504 0.066 9 0 "[ . 1 . 2]"
1 11 LEU 1.084 0.089 11 0 "[ . 1 . 2]"
1 12 ARG 3.233 0.091 1 0 "[ . 1 . 2]"
1 13 LEU 3.565 0.091 1 0 "[ . 1 . 2]"
1 14 GLN 2.716 0.084 20 0 "[ . 1 . 2]"
1 15 GLU 1.555 0.092 3 0 "[ . 1 . 2]"
1 16 LYS 3.015 0.088 4 0 "[ . 1 . 2]"
1 17 PRO 1.698 0.085 13 0 "[ . 1 . 2]"
1 18 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 19 LEU 0.350 0.056 14 0 "[ . 1 . 2]"
1 20 LEU 1.460 0.068 20 0 "[ . 1 . 2]"
1 21 PHE 1.464 0.059 19 0 "[ . 1 . 2]"
1 22 PRO 1.077 0.055 15 0 "[ . 1 . 2]"
1 23 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 MET 0.309 0.065 8 0 "[ . 1 . 2]"
1 25 ALA 1.593 0.084 2 0 "[ . 1 . 2]"
1 26 ALA 2.676 0.085 9 0 "[ . 1 . 2]"
1 27 SER 1.083 0.085 9 0 "[ . 1 . 2]"
1 28 THR 0.414 0.079 6 0 "[ . 1 . 2]"
1 29 VAL 0.500 0.079 6 0 "[ . 1 . 2]"
1 30 GLN 0.330 0.074 3 0 "[ . 1 . 2]"
1 31 VAL 3.253 0.102 11 0 "[ . 1 . 2]"
1 32 ALA 1.990 0.102 11 0 "[ . 1 . 2]"
1 33 GLY 0.483 0.083 15 0 "[ . 1 . 2]"
1 34 ARG 1.631 0.088 4 0 "[ . 1 . 2]"
1 35 LYS 1.635 0.093 9 0 "[ . 1 . 2]"
1 36 ASP 2.454 0.093 9 0 "[ . 1 . 2]"
1 37 TYR 6.038 0.092 18 0 "[ . 1 . 2]"
1 38 PRO 2.475 0.084 14 0 "[ . 1 . 2]"
1 39 ALA 1.364 0.074 9 0 "[ . 1 . 2]"
1 40 LEU 2.824 0.086 11 0 "[ . 1 . 2]"
1 41 LEU 4.336 0.094 7 0 "[ . 1 . 2]"
1 42 PRO 2.375 0.094 14 0 "[ . 1 . 2]"
1 43 LEU 7.050 0.153 16 0 "[ . 1 . 2]"
1 44 ASN 4.506 0.084 17 0 "[ . 1 . 2]"
1 45 GLU 0.580 0.063 2 0 "[ . 1 . 2]"
1 46 SER 0.867 0.082 16 0 "[ . 1 . 2]"
1 47 GLU 2.921 0.082 16 0 "[ . 1 . 2]"
1 48 LEU 4.602 0.084 17 0 "[ . 1 . 2]"
1 49 GLU 1.489 0.099 19 0 "[ . 1 . 2]"
1 50 GLU 1.412 0.082 3 0 "[ . 1 . 2]"
1 51 GLN 1.815 0.106 17 0 "[ . 1 . 2]"
1 52 PHE 2.260 0.082 3 0 "[ . 1 . 2]"
1 53 VAL 2.121 0.075 4 0 "[ . 1 . 2]"
1 54 LYS 1.914 0.094 7 0 "[ . 1 . 2]"
1 55 GLY 0.514 0.094 7 0 "[ . 1 . 2]"
1 57 GLY 0.569 0.078 8 0 "[ . 1 . 2]"
1 58 PRO 0.574 0.078 8 0 "[ . 1 . 2]"
1 59 GLY 0.005 0.005 3 0 "[ . 1 . 2]"
1 65 LYS 0.216 0.083 20 0 "[ . 1 . 2]"
1 66 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 ASN 0.540 0.062 12 0 "[ . 1 . 2]"
1 69 CYS 1.217 0.075 6 0 "[ . 1 . 2]"
1 70 VAL 2.354 0.116 11 0 "[ . 1 . 2]"
1 71 VAL 1.849 0.128 6 0 "[ . 1 . 2]"
1 72 LEU 3.235 0.090 2 0 "[ . 1 . 2]"
1 73 LYS 4.396 0.102 19 0 "[ . 1 . 2]"
1 74 HIS 5.535 0.083 2 0 "[ . 1 . 2]"
1 75 VAL 4.745 0.099 19 0 "[ . 1 . 2]"
1 76 PRO 4.057 0.079 2 0 "[ . 1 . 2]"
1 77 SER 2.939 0.090 1 0 "[ . 1 . 2]"
1 78 GLY 2.772 0.077 4 0 "[ . 1 . 2]"
1 79 ILE 2.596 0.075 7 0 "[ . 1 . 2]"
1 80 VAL 2.967 0.102 19 0 "[ . 1 . 2]"
1 81 VAL 7.988 0.121 16 0 "[ . 1 . 2]"
1 82 LYS 2.303 0.128 6 0 "[ . 1 . 2]"
1 83 CYS 3.071 0.114 18 0 "[ . 1 . 2]"
1 84 HIS 0.824 0.075 6 0 "[ . 1 . 2]"
1 85 GLN 2.868 0.089 2 0 "[ . 1 . 2]"
1 86 THR 2.066 0.097 9 0 "[ . 1 . 2]"
1 87 ARG 1.121 0.087 17 0 "[ . 1 . 2]"
1 88 SER 1.893 0.071 6 0 "[ . 1 . 2]"
1 89 VAL 1.228 0.079 11 0 "[ . 1 . 2]"
1 90 ASP 0.278 0.072 4 0 "[ . 1 . 2]"
1 91 GLN 4.423 0.094 13 0 "[ . 1 . 2]"
1 92 ASN 0.851 0.059 2 0 "[ . 1 . 2]"
1 93 ARG 1.635 0.093 12 0 "[ . 1 . 2]"
1 94 LYS 2.974 0.095 1 0 "[ . 1 . 2]"
1 95 ILE 5.058 0.097 9 0 "[ . 1 . 2]"
1 96 ALA 4.875 0.121 16 0 "[ . 1 . 2]"
1 97 ARG 2.498 0.103 5 0 "[ . 1 . 2]"
1 98 LYS 2.617 0.083 9 0 "[ . 1 . 2]"
1 99 VAL 4.665 0.078 11 0 "[ . 1 . 2]"
1 100 LEU 3.098 0.088 5 0 "[ . 1 . 2]"
1 101 GLN 4.371 0.086 12 0 "[ . 1 . 2]"
1 102 GLU 2.816 0.069 9 0 "[ . 1 . 2]"
1 103 LYS 7.205 0.103 17 0 "[ . 1 . 2]"
1 104 VAL 1.257 0.075 7 0 "[ . 1 . 2]"
1 105 ASP 2.448 0.079 2 0 "[ . 1 . 2]"
1 106 VAL 4.514 0.097 18 0 "[ . 1 . 2]"
1 107 PHE 3.912 0.097 18 0 "[ . 1 . 2]"
1 108 TYR 1.855 0.094 7 0 "[ . 1 . 2]"
1 109 ASN 3.523 0.092 2 0 "[ . 1 . 2]"
1 110 SER 1.500 0.092 2 0 "[ . 1 . 2]"
1 111 GLY 0.360 0.075 14 0 "[ . 1 . 2]"
1 112 PRO 0.075 0.028 11 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 9 TRP H 1 9 TRP HB2 . . 4.040 3.424 2.244 3.956 . 0 0 "[ . 1 . 2]" 1
2 1 9 TRP H 1 9 TRP QB . . 3.350 2.835 2.165 3.249 . 0 0 "[ . 1 . 2]" 1
3 1 9 TRP H 1 9 TRP HB3 . . 4.040 3.242 2.235 3.782 . 0 0 "[ . 1 . 2]" 1
4 1 9 TRP H 1 9 TRP HD1 . . 4.420 3.174 2.201 4.482 0.062 17 0 "[ . 1 . 2]" 1
5 1 9 TRP HA 1 9 TRP HD1 . . 4.650 4.404 4.280 4.636 . 0 0 "[ . 1 . 2]" 1
6 1 9 TRP HA 1 9 TRP HE3 . . 4.420 3.903 2.360 4.479 0.059 18 0 "[ . 1 . 2]" 1
7 1 9 TRP QB 1 9 TRP HD1 . . 3.380 2.595 2.397 2.751 . 0 0 "[ . 1 . 2]" 1
8 1 9 TRP QB 1 9 TRP HE3 . . 3.570 2.661 2.436 2.992 . 0 0 "[ . 1 . 2]" 1
9 1 9 TRP QB 1 10 GLY H . . 4.110 2.348 2.079 3.442 . 0 0 "[ . 1 . 2]" 1
10 1 9 TRP HB2 1 10 GLY H . . 4.880 2.650 2.092 3.972 . 0 0 "[ . 1 . 2]" 1
11 1 9 TRP HB3 1 10 GLY H . . 4.880 3.421 2.128 3.884 . 0 0 "[ . 1 . 2]" 1
12 1 9 TRP HE3 1 10 GLY QA . . 4.880 3.559 2.497 4.946 0.066 9 0 "[ . 1 . 2]" 1
13 1 10 GLY QA 1 11 LEU H . . 3.090 2.298 2.223 2.357 . 0 0 "[ . 1 . 2]" 1
14 1 10 GLY QA 1 11 LEU QB . . 4.490 4.104 3.821 4.295 . 0 0 "[ . 1 . 2]" 1
15 1 10 GLY QA 1 11 LEU HG . . 5.070 4.430 3.696 5.131 0.061 7 0 "[ . 1 . 2]" 1
16 1 11 LEU H 1 11 LEU QB . . 2.980 2.568 2.079 3.069 0.089 11 0 "[ . 1 . 2]" 1
17 1 11 LEU H 1 11 LEU HG . . 4.540 3.516 2.378 4.105 . 0 0 "[ . 1 . 2]" 1
18 1 11 LEU H 1 12 ARG H . . 4.610 4.394 2.944 4.649 0.039 17 0 "[ . 1 . 2]" 1
19 1 11 LEU HA 1 11 LEU QB . . 2.620 2.442 2.366 2.571 . 0 0 "[ . 1 . 2]" 1
20 1 11 LEU HA 1 11 LEU HG . . 3.240 2.649 2.330 3.010 . 0 0 "[ . 1 . 2]" 1
21 1 11 LEU HA 1 12 ARG H . . 3.090 2.502 2.168 2.814 . 0 0 "[ . 1 . 2]" 1
22 1 11 LEU QB 1 12 ARG H . . 3.640 2.432 2.036 3.726 0.086 14 0 "[ . 1 . 2]" 1
23 1 11 LEU HB2 1 12 ARG H . . 4.180 3.704 3.326 4.157 . 0 0 "[ . 1 . 2]" 1
24 1 11 LEU HB3 1 12 ARG H . . 4.180 2.484 2.055 4.208 0.028 14 0 "[ . 1 . 2]" 1
25 1 11 LEU HG 1 12 ARG H . . 4.640 4.344 3.610 4.705 0.065 14 0 "[ . 1 . 2]" 1
26 1 12 ARG H 1 12 ARG HB2 . . 3.900 3.433 2.341 3.967 0.067 13 0 "[ . 1 . 2]" 1
27 1 12 ARG H 1 12 ARG QB . . 3.330 2.799 2.229 3.249 . 0 0 "[ . 1 . 2]" 1
28 1 12 ARG H 1 12 ARG HB3 . . 3.900 2.997 2.518 3.449 . 0 0 "[ . 1 . 2]" 1
29 1 12 ARG H 1 12 ARG QG . . 4.950 3.960 3.480 4.417 . 0 0 "[ . 1 . 2]" 1
30 1 12 ARG H 1 13 LEU QD . . 4.840 3.808 2.638 4.587 . 0 0 "[ . 1 . 2]" 1
31 1 12 ARG HA 1 12 ARG QD . . 4.020 3.310 2.060 4.084 0.064 15 0 "[ . 1 . 2]" 1
32 1 12 ARG HA 1 12 ARG QG . . 3.810 3.011 2.262 3.559 . 0 0 "[ . 1 . 2]" 1
33 1 12 ARG HA 1 13 LEU H . . 2.710 2.358 2.169 2.538 . 0 0 "[ . 1 . 2]" 1
34 1 12 ARG QB 1 13 LEU H . . 4.080 3.263 2.447 4.029 . 0 0 "[ . 1 . 2]" 1
35 1 12 ARG QB 1 13 LEU QD . . 4.770 4.430 4.056 4.861 0.091 1 0 "[ . 1 . 2]" 1
36 1 12 ARG HB2 1 12 ARG QD . . 3.450 3.159 2.409 3.539 0.089 18 0 "[ . 1 . 2]" 1
37 1 12 ARG HB3 1 12 ARG QD . . 3.450 2.952 2.234 3.524 0.074 8 0 "[ . 1 . 2]" 1
38 1 12 ARG QD 1 13 LEU QD . . 4.500 4.300 3.926 4.584 0.084 8 0 "[ . 1 . 2]" 1
39 1 12 ARG QG 1 13 LEU H . . 3.160 3.015 1.878 3.236 0.076 5 0 "[ . 1 . 2]" 1
40 1 12 ARG QG 1 14 GLN HE21 . . 4.670 3.557 2.283 4.749 0.079 5 0 "[ . 1 . 2]" 1
41 1 13 LEU H 1 13 LEU QB . . 3.060 2.515 2.291 2.843 . 0 0 "[ . 1 . 2]" 1
42 1 13 LEU H 1 13 LEU QD . . 4.420 3.085 2.311 3.860 . 0 0 "[ . 1 . 2]" 1
43 1 13 LEU H 1 14 GLN QB . . 4.660 4.668 4.292 4.741 0.081 14 0 "[ . 1 . 2]" 1
44 1 13 LEU H 1 14 GLN HE21 . . 4.480 4.209 3.623 4.541 0.061 5 0 "[ . 1 . 2]" 1
45 1 13 LEU HA 1 13 LEU MD1 . . 3.200 2.222 2.106 2.489 . 0 0 "[ . 1 . 2]" 1
46 1 13 LEU HA 1 13 LEU QD . . 2.540 2.068 1.989 2.167 . 0 0 "[ . 1 . 2]" 1
47 1 13 LEU HA 1 13 LEU MD2 . . 3.200 2.666 2.160 3.244 0.044 2 0 "[ . 1 . 2]" 1
48 1 13 LEU HA 1 14 GLN H . . 2.880 2.430 2.244 2.691 . 0 0 "[ . 1 . 2]" 1
49 1 13 LEU HA 1 14 GLN HE21 . . 5.010 4.089 2.845 5.058 0.048 15 0 "[ . 1 . 2]" 1
50 1 13 LEU HA 1 14 GLN HE22 . . 5.500 3.823 2.743 5.574 0.074 20 0 "[ . 1 . 2]" 1
51 1 13 LEU QB 1 14 GLN H . . 4.000 2.755 2.279 3.367 . 0 0 "[ . 1 . 2]" 1
52 1 13 LEU QB 1 14 GLN HE22 . . 5.500 5.177 4.741 5.582 0.082 13 0 "[ . 1 . 2]" 1
53 1 13 LEU QD 1 14 GLN H . . 4.380 2.694 1.702 3.547 . 0 0 "[ . 1 . 2]" 1
54 1 13 LEU MD1 1 14 GLN H . . 5.420 2.732 1.705 3.633 . 0 0 "[ . 1 . 2]" 1
55 1 13 LEU MD2 1 14 GLN H . . 5.420 4.330 3.446 4.953 . 0 0 "[ . 1 . 2]" 1
56 1 14 GLN H 1 14 GLN HB2 . . 4.080 3.803 2.851 4.132 0.052 8 0 "[ . 1 . 2]" 1
57 1 14 GLN H 1 14 GLN QB . . 3.570 3.215 2.612 3.449 . 0 0 "[ . 1 . 2]" 1
58 1 14 GLN H 1 14 GLN HB3 . . 4.080 3.490 3.034 3.768 . 0 0 "[ . 1 . 2]" 1
59 1 14 GLN H 1 14 GLN QG . . 4.330 3.517 2.818 4.392 0.062 7 0 "[ . 1 . 2]" 1
60 1 14 GLN HA 1 14 GLN HE21 . . 5.280 3.807 1.737 4.776 . 0 0 "[ . 1 . 2]" 1
61 1 14 GLN HA 1 14 GLN HE22 . . 5.500 4.903 3.385 5.379 . 0 0 "[ . 1 . 2]" 1
62 1 14 GLN HA 1 14 GLN QG . . 3.900 3.334 2.338 3.603 . 0 0 "[ . 1 . 2]" 1
63 1 14 GLN HA 1 15 GLU H . . 2.940 2.540 2.019 2.896 . 0 0 "[ . 1 . 2]" 1
64 1 14 GLN QB 1 14 GLN HE21 . . 4.200 2.215 1.773 2.688 . 0 0 "[ . 1 . 2]" 1
65 1 14 GLN QB 1 14 GLN HE22 . . 4.620 3.521 3.260 3.841 . 0 0 "[ . 1 . 2]" 1
66 1 14 GLN QB 1 15 GLU H . . 4.480 2.643 1.958 4.081 . 0 0 "[ . 1 . 2]" 1
67 1 14 GLN HE22 1 14 GLN QG . . 3.570 3.493 3.427 3.590 0.020 11 0 "[ . 1 . 2]" 1
68 1 14 GLN QG 1 15 GLU H . . 4.710 3.270 2.267 4.128 . 0 0 "[ . 1 . 2]" 1
69 1 14 GLN QG 1 15 GLU HA . . 4.550 4.120 3.433 4.634 0.084 20 0 "[ . 1 . 2]" 1
70 1 15 GLU H 1 15 GLU HB2 . . 3.830 3.019 2.343 3.708 . 0 0 "[ . 1 . 2]" 1
71 1 15 GLU H 1 15 GLU QB . . 3.200 2.639 2.299 2.949 . 0 0 "[ . 1 . 2]" 1
72 1 15 GLU H 1 15 GLU HB3 . . 3.830 3.201 2.499 3.731 . 0 0 "[ . 1 . 2]" 1
73 1 15 GLU H 1 15 GLU QG . . 4.390 3.666 1.885 4.414 0.024 8 0 "[ . 1 . 2]" 1
74 1 15 GLU HA 1 15 GLU HG2 . . 3.850 3.139 2.389 3.855 0.005 19 0 "[ . 1 . 2]" 1
75 1 15 GLU HA 1 15 GLU QG . . 3.150 2.773 2.287 3.242 0.092 3 0 "[ . 1 . 2]" 1
76 1 15 GLU HA 1 15 GLU HG3 . . 3.850 3.402 2.331 3.920 0.070 16 0 "[ . 1 . 2]" 1
77 1 15 GLU HA 1 16 LYS H . . 2.610 2.587 2.280 2.675 0.065 11 0 "[ . 1 . 2]" 1
78 1 15 GLU QB 1 15 GLU QG . . 2.340 2.022 1.956 2.124 . 0 0 "[ . 1 . 2]" 1
79 1 15 GLU QB 1 16 LYS H . . 3.370 2.551 1.963 3.405 0.035 14 0 "[ . 1 . 2]" 1
80 1 15 GLU HB2 1 16 LYS H . . 4.030 3.457 1.973 3.939 . 0 0 "[ . 1 . 2]" 1
81 1 15 GLU HB3 1 16 LYS H . . 4.030 2.890 2.075 3.940 . 0 0 "[ . 1 . 2]" 1
82 1 15 GLU QG 1 16 LYS H . . 4.130 3.019 1.672 3.803 . 0 0 "[ . 1 . 2]" 1
83 1 16 LYS H 1 16 LYS HB2 . . 3.790 2.677 2.178 3.857 0.067 4 0 "[ . 1 . 2]" 1
84 1 16 LYS H 1 16 LYS QB . . 2.980 2.440 2.156 2.876 . 0 0 "[ . 1 . 2]" 1
85 1 16 LYS H 1 16 LYS HB3 . . 3.790 3.400 2.272 3.849 0.059 14 0 "[ . 1 . 2]" 1
86 1 16 LYS H 1 16 LYS QE . . 5.300 3.732 1.754 5.300 0.000 16 0 "[ . 1 . 2]" 1
87 1 16 LYS H 1 16 LYS HG2 . . 4.780 3.814 2.040 4.850 0.070 11 0 "[ . 1 . 2]" 1
88 1 16 LYS H 1 16 LYS QG . . 4.100 3.264 2.026 4.114 0.014 13 0 "[ . 1 . 2]" 1
89 1 16 LYS H 1 16 LYS HG3 . . 4.780 3.876 2.106 4.838 0.058 13 0 "[ . 1 . 2]" 1
90 1 16 LYS H 1 17 PRO HD2 . . 4.870 4.850 4.621 4.918 0.048 4 0 "[ . 1 . 2]" 1
91 1 16 LYS H 1 17 PRO HD3 . . 5.210 5.000 4.351 5.225 0.015 18 0 "[ . 1 . 2]" 1
92 1 16 LYS HA 1 16 LYS QD . . 4.170 3.469 2.092 4.258 0.088 4 0 "[ . 1 . 2]" 1
93 1 16 LYS HA 1 16 LYS HG2 . . 4.060 3.297 2.354 3.817 . 0 0 "[ . 1 . 2]" 1
94 1 16 LYS HA 1 16 LYS HG3 . . 4.060 3.001 2.211 3.978 . 0 0 "[ . 1 . 2]" 1
95 1 16 LYS HA 1 17 PRO HD2 . . 2.850 2.507 2.210 2.896 0.046 4 0 "[ . 1 . 2]" 1
96 1 16 LYS HA 1 17 PRO HD3 . . 2.820 2.404 2.238 2.490 . 0 0 "[ . 1 . 2]" 1
97 1 16 LYS HA 1 17 PRO QG . . 4.520 4.133 3.956 4.282 . 0 0 "[ . 1 . 2]" 1
98 1 16 LYS QB 1 17 PRO HD2 . . 3.230 2.319 2.019 3.315 0.085 13 0 "[ . 1 . 2]" 1
99 1 16 LYS QB 1 17 PRO HD3 . . 4.000 3.550 2.799 4.076 0.076 13 0 "[ . 1 . 2]" 1
100 1 16 LYS HB2 1 17 PRO HD2 . . 4.090 3.558 2.029 4.138 0.048 14 0 "[ . 1 . 2]" 1
101 1 16 LYS HB3 1 17 PRO HD2 . . 4.090 2.604 2.130 3.980 . 0 0 "[ . 1 . 2]" 1
102 1 16 LYS QD 1 17 PRO HD2 . . 4.310 4.180 2.782 4.390 0.080 2 0 "[ . 1 . 2]" 1
103 1 16 LYS QD 1 17 PRO HD3 . . 5.500 5.069 3.608 5.565 0.065 19 0 "[ . 1 . 2]" 1
104 1 16 LYS QG 1 17 PRO HD2 . . 4.380 3.080 1.967 4.423 0.043 3 0 "[ . 1 . 2]" 1
105 1 16 LYS HG2 1 17 PRO HD2 . . 5.020 3.735 2.398 5.009 . 0 0 "[ . 1 . 2]" 1
106 1 16 LYS HG3 1 17 PRO HD2 . . 5.020 3.557 2.090 4.972 . 0 0 "[ . 1 . 2]" 1
107 1 17 PRO HA 1 18 ALA H . . 2.550 2.378 2.251 2.536 . 0 0 "[ . 1 . 2]" 1
108 1 17 PRO HA 1 18 ALA MB . . 4.440 4.023 3.884 4.187 . 0 0 "[ . 1 . 2]" 1
109 1 17 PRO QB 1 18 ALA H . . 3.960 2.778 2.407 3.841 . 0 0 "[ . 1 . 2]" 1
110 1 17 PRO HB2 1 18 ALA H . . 4.510 2.879 2.448 4.178 . 0 0 "[ . 1 . 2]" 1
111 1 17 PRO HB3 1 18 ALA H . . 4.510 3.720 3.475 4.481 . 0 0 "[ . 1 . 2]" 1
112 1 18 ALA H 1 18 ALA MB . . 2.860 2.345 2.212 2.644 . 0 0 "[ . 1 . 2]" 1
113 1 19 LEU H 1 19 LEU QB . . 3.510 2.706 2.160 3.232 . 0 0 "[ . 1 . 2]" 1
114 1 19 LEU HA 1 19 LEU QD . . 3.450 2.731 2.056 3.441 . 0 0 "[ . 1 . 2]" 1
115 1 19 LEU HA 1 20 LEU H . . 2.560 2.492 2.177 2.596 0.036 8 0 "[ . 1 . 2]" 1
116 1 19 LEU HA 1 20 LEU HG . . 4.460 3.912 3.502 4.516 0.056 14 0 "[ . 1 . 2]" 1
117 1 19 LEU QD 1 20 LEU H . . 4.400 3.131 2.028 3.720 . 0 0 "[ . 1 . 2]" 1
118 1 20 LEU H 1 20 LEU HB2 . . 3.710 3.508 2.444 3.778 0.068 20 0 "[ . 1 . 2]" 1
119 1 20 LEU H 1 20 LEU QB . . 3.190 2.927 2.408 3.186 . 0 0 "[ . 1 . 2]" 1
120 1 20 LEU H 1 20 LEU HB3 . . 3.710 3.307 2.640 3.733 0.023 16 0 "[ . 1 . 2]" 1
121 1 20 LEU H 1 20 LEU QD . . 4.540 2.736 1.914 3.448 . 0 0 "[ . 1 . 2]" 1
122 1 20 LEU H 1 20 LEU HG . . 2.830 2.431 2.035 2.887 0.057 4 0 "[ . 1 . 2]" 1
123 1 20 LEU HA 1 21 PHE H . . 2.630 2.529 2.326 2.634 0.004 7 0 "[ . 1 . 2]" 1
124 1 20 LEU HA 1 21 PHE QB . . 4.710 4.352 4.266 4.508 . 0 0 "[ . 1 . 2]" 1
125 1 20 LEU QB 1 21 PHE H . . 3.330 2.266 2.173 2.551 . 0 0 "[ . 1 . 2]" 1
126 1 20 LEU QB 1 21 PHE QD . . 4.390 4.300 4.145 4.434 0.044 3 0 "[ . 1 . 2]" 1
127 1 20 LEU HB2 1 21 PHE H . . 3.920 2.523 2.190 3.703 . 0 0 "[ . 1 . 2]" 1
128 1 20 LEU HB3 1 21 PHE H . . 3.920 3.419 2.265 3.774 . 0 0 "[ . 1 . 2]" 1
129 1 20 LEU QD 1 21 PHE H . . 3.930 3.125 2.829 3.680 . 0 0 "[ . 1 . 2]" 1
130 1 21 PHE H 1 21 PHE HB2 . . 3.770 2.960 2.216 3.695 . 0 0 "[ . 1 . 2]" 1
131 1 21 PHE H 1 21 PHE QB . . 2.990 2.649 2.193 3.049 0.059 19 0 "[ . 1 . 2]" 1
132 1 21 PHE H 1 21 PHE HB3 . . 3.770 3.419 3.022 3.709 . 0 0 "[ . 1 . 2]" 1
133 1 21 PHE H 1 21 PHE QD . . 3.770 2.780 2.250 3.045 . 0 0 "[ . 1 . 2]" 1
134 1 21 PHE H 1 22 PRO HD2 . . 4.880 4.909 4.884 4.922 0.042 9 0 "[ . 1 . 2]" 1
135 1 21 PHE H 1 22 PRO HD3 . . 5.220 5.017 4.894 5.113 . 0 0 "[ . 1 . 2]" 1
136 1 21 PHE HA 1 21 PHE QD . . 3.850 3.352 2.907 3.782 . 0 0 "[ . 1 . 2]" 1
137 1 21 PHE HA 1 22 PRO HD2 . . 3.080 2.583 2.505 2.630 . 0 0 "[ . 1 . 2]" 1
138 1 21 PHE HA 1 22 PRO HD3 . . 2.970 2.366 2.259 2.420 . 0 0 "[ . 1 . 2]" 1
139 1 21 PHE QB 1 22 PRO HD2 . . 3.450 2.212 2.145 2.295 . 0 0 "[ . 1 . 2]" 1
140 1 21 PHE QB 1 22 PRO HD3 . . 3.980 3.441 3.346 3.526 . 0 0 "[ . 1 . 2]" 1
141 1 21 PHE QB 1 22 PRO QG . . 4.130 3.800 3.737 3.898 . 0 0 "[ . 1 . 2]" 1
142 1 21 PHE HB2 1 22 PRO HD2 . . 4.040 3.097 2.175 3.890 . 0 0 "[ . 1 . 2]" 1
143 1 21 PHE HB2 1 22 PRO HD3 . . 4.720 4.224 3.535 4.775 0.055 15 0 "[ . 1 . 2]" 1
144 1 21 PHE HB3 1 22 PRO HD2 . . 4.040 2.762 2.184 3.459 . 0 0 "[ . 1 . 2]" 1
145 1 21 PHE HB3 1 22 PRO HD3 . . 4.720 3.875 3.552 4.260 . 0 0 "[ . 1 . 2]" 1
146 1 21 PHE QD 1 22 PRO HD2 . . 4.270 3.256 2.459 3.991 . 0 0 "[ . 1 . 2]" 1
147 1 21 PHE QD 1 22 PRO HD3 . . 4.990 4.319 3.623 4.993 0.003 4 0 "[ . 1 . 2]" 1
148 1 22 PRO QG 1 23 GLY H . . 5.500 3.997 3.407 4.219 . 0 0 "[ . 1 . 2]" 1
149 1 24 MET H 1 24 MET HB2 . . 3.960 3.018 2.421 3.644 . 0 0 "[ . 1 . 2]" 1
150 1 24 MET H 1 24 MET QB . . 3.340 2.586 2.387 2.780 . 0 0 "[ . 1 . 2]" 1
151 1 24 MET H 1 24 MET HB3 . . 3.960 3.106 2.576 3.850 . 0 0 "[ . 1 . 2]" 1
152 1 24 MET H 1 24 MET QG . . 4.240 3.412 1.983 4.305 0.065 8 0 "[ . 1 . 2]" 1
153 1 24 MET HA 1 24 MET ME . . 4.550 4.261 3.847 4.604 0.054 12 0 "[ . 1 . 2]" 1
154 1 24 MET HA 1 24 MET QG . . 3.560 2.657 2.301 3.379 . 0 0 "[ . 1 . 2]" 1
155 1 24 MET HA 1 25 ALA H . . 3.410 2.381 2.160 2.611 . 0 0 "[ . 1 . 2]" 1
156 1 24 MET QB 1 25 ALA H . . 4.170 3.068 2.282 3.837 . 0 0 "[ . 1 . 2]" 1
157 1 25 ALA H 1 26 ALA HA . . 4.140 4.097 3.941 4.212 0.072 15 0 "[ . 1 . 2]" 1
158 1 25 ALA H 1 26 ALA MB . . 3.970 3.994 3.554 4.054 0.084 2 0 "[ . 1 . 2]" 1
159 1 26 ALA H 1 26 ALA MB . . 3.330 2.304 2.193 2.634 . 0 0 "[ . 1 . 2]" 1
160 1 26 ALA MB 1 27 SER H . . 4.760 2.411 2.021 2.838 . 0 0 "[ . 1 . 2]" 1
161 1 26 ALA MB 1 27 SER HB2 . . 4.720 4.572 4.128 4.804 0.084 8 0 "[ . 1 . 2]" 1
162 1 26 ALA MB 1 27 SER HB3 . . 4.720 4.541 3.881 4.805 0.085 9 0 "[ . 1 . 2]" 1
163 1 28 THR HA 1 28 THR MG . . 3.200 2.545 2.155 3.264 0.064 5 0 "[ . 1 . 2]" 1
164 1 28 THR HA 1 29 VAL H . . 2.820 2.528 2.226 2.867 0.047 10 0 "[ . 1 . 2]" 1
165 1 28 THR HA 1 29 VAL QG . . 4.140 3.428 3.103 4.219 0.079 6 0 "[ . 1 . 2]" 1
166 1 28 THR HB 1 29 VAL H . . 4.100 3.044 1.926 4.084 . 0 0 "[ . 1 . 2]" 1
167 1 28 THR MG 1 29 VAL H . . 4.080 3.070 1.970 3.742 . 0 0 "[ . 1 . 2]" 1
168 1 29 VAL H 1 29 VAL HB . . 3.760 3.317 2.230 3.820 0.060 9 0 "[ . 1 . 2]" 1
169 1 29 VAL H 1 29 VAL MG1 . . 3.990 2.826 2.184 3.869 . 0 0 "[ . 1 . 2]" 1
170 1 29 VAL H 1 29 VAL QG . . 3.010 2.079 1.814 2.671 . 0 0 "[ . 1 . 2]" 1
171 1 29 VAL H 1 29 VAL MG2 . . 3.990 2.291 1.876 3.694 . 0 0 "[ . 1 . 2]" 1
172 1 29 VAL H 1 30 GLN H . . 4.680 4.523 4.177 4.680 . 0 0 "[ . 1 . 2]" 1
173 1 29 VAL HA 1 29 VAL QG . . 2.900 2.256 2.142 2.334 . 0 0 "[ . 1 . 2]" 1
174 1 29 VAL HA 1 30 GLN H . . 2.820 2.445 2.206 2.874 0.054 5 0 "[ . 1 . 2]" 1
175 1 29 VAL HA 1 30 GLN QG . . 4.450 3.797 3.423 4.524 0.074 3 0 "[ . 1 . 2]" 1
176 1 29 VAL HB 1 30 GLN H . . 4.170 2.876 1.791 4.070 . 0 0 "[ . 1 . 2]" 1
177 1 29 VAL QG 1 30 GLN H . . 3.800 2.881 2.170 3.570 . 0 0 "[ . 1 . 2]" 1
178 1 29 VAL MG1 1 30 GLN H . . 4.370 3.410 2.180 3.929 . 0 0 "[ . 1 . 2]" 1
179 1 29 VAL MG2 1 30 GLN H . . 4.370 3.443 2.189 4.209 . 0 0 "[ . 1 . 2]" 1
180 1 30 GLN H 1 30 GLN QB . . 3.450 2.624 2.156 3.169 . 0 0 "[ . 1 . 2]" 1
181 1 30 GLN H 1 30 GLN QG . . 3.930 2.687 1.994 3.331 . 0 0 "[ . 1 . 2]" 1
182 1 30 GLN H 1 31 VAL H . . 4.710 4.463 4.328 4.719 0.009 18 0 "[ . 1 . 2]" 1
183 1 30 GLN HA 1 30 GLN QG . . 3.540 2.869 2.283 3.564 0.024 3 0 "[ . 1 . 2]" 1
184 1 30 GLN HA 1 31 VAL H . . 2.660 2.502 2.146 2.718 0.058 10 0 "[ . 1 . 2]" 1
185 1 30 GLN HA 1 31 VAL QG . . 4.530 3.410 3.056 3.677 . 0 0 "[ . 1 . 2]" 1
186 1 30 GLN QB 1 31 VAL H . . 4.220 2.359 1.877 3.080 . 0 0 "[ . 1 . 2]" 1
187 1 30 GLN QG 1 31 VAL H . . 4.290 3.839 2.954 4.256 . 0 0 "[ . 1 . 2]" 1
188 1 31 VAL H 1 31 VAL HB . . 3.620 2.970 2.343 3.674 0.054 9 0 "[ . 1 . 2]" 1
189 1 31 VAL H 1 31 VAL MG1 . . 3.620 3.176 1.923 3.708 0.088 18 0 "[ . 1 . 2]" 1
190 1 31 VAL H 1 31 VAL QG . . 3.170 1.927 1.794 2.113 . 0 0 "[ . 1 . 2]" 1
191 1 31 VAL H 1 31 VAL MG2 . . 3.620 1.985 1.818 2.146 . 0 0 "[ . 1 . 2]" 1
192 1 31 VAL H 1 32 ALA H . . 4.730 4.577 4.314 4.702 . 0 0 "[ . 1 . 2]" 1
193 1 31 VAL HA 1 31 VAL MG1 . . 3.360 2.349 2.193 2.470 . 0 0 "[ . 1 . 2]" 1
194 1 31 VAL HA 1 31 VAL QG . . 2.940 2.221 2.106 2.322 . 0 0 "[ . 1 . 2]" 1
195 1 31 VAL HA 1 31 VAL MG2 . . 3.360 2.840 2.427 3.282 . 0 0 "[ . 1 . 2]" 1
196 1 31 VAL HA 1 32 ALA H . . 2.920 2.424 2.137 2.815 . 0 0 "[ . 1 . 2]" 1
197 1 31 VAL HA 1 32 ALA MB . . 4.020 3.967 3.806 4.095 0.075 11 0 "[ . 1 . 2]" 1
198 1 31 VAL HB 1 32 ALA H . . 3.900 3.138 2.043 3.961 0.061 2 0 "[ . 1 . 2]" 1
199 1 31 VAL HB 1 32 ALA HA . . 4.680 4.676 4.310 4.750 0.070 4 0 "[ . 1 . 2]" 1
200 1 31 VAL QG 1 32 ALA H . . 3.780 2.548 1.887 3.341 . 0 0 "[ . 1 . 2]" 1
201 1 31 VAL QG 1 32 ALA HA . . 3.970 3.927 3.365 4.072 0.102 11 0 "[ . 1 . 2]" 1
202 1 31 VAL QG 1 33 GLY QA . . 4.600 4.266 2.819 4.674 0.074 16 0 "[ . 1 . 2]" 1
203 1 32 ALA H 1 32 ALA MB . . 3.200 2.417 2.121 2.828 . 0 0 "[ . 1 . 2]" 1
204 1 32 ALA HA 1 33 GLY H . . 3.510 2.592 2.280 3.524 0.014 15 0 "[ . 1 . 2]" 1
205 1 32 ALA MB 1 33 GLY H . . 4.450 2.407 1.930 3.072 . 0 0 "[ . 1 . 2]" 1
206 1 32 ALA MB 1 33 GLY QA . . 3.990 3.757 3.478 4.073 0.083 15 0 "[ . 1 . 2]" 1
207 1 33 GLY QA 1 34 ARG H . . 3.250 2.317 2.124 2.636 . 0 0 "[ . 1 . 2]" 1
208 1 33 GLY QA 1 34 ARG QG . . 4.460 3.812 3.270 4.537 0.077 17 0 "[ . 1 . 2]" 1
209 1 34 ARG H 1 34 ARG HB2 . . 3.950 2.927 2.208 3.981 0.031 6 0 "[ . 1 . 2]" 1
210 1 34 ARG H 1 34 ARG HB3 . . 3.950 3.661 3.435 3.874 . 0 0 "[ . 1 . 2]" 1
211 1 34 ARG HA 1 34 ARG QD . . 4.590 3.468 2.020 4.543 . 0 0 "[ . 1 . 2]" 1
212 1 34 ARG HA 1 34 ARG QG . . 3.700 2.810 2.193 3.524 . 0 0 "[ . 1 . 2]" 1
213 1 34 ARG QB 1 34 ARG QD . . 3.350 2.303 2.120 2.790 . 0 0 "[ . 1 . 2]" 1
214 1 34 ARG QB 1 37 TYR H . . 5.340 4.790 3.451 5.415 0.075 16 0 "[ . 1 . 2]" 1
215 1 34 ARG QB 1 37 TYR HB3 . . 5.340 5.108 4.387 5.417 0.077 12 0 "[ . 1 . 2]" 1
216 1 34 ARG QB 1 37 TYR QE . . 4.620 2.618 2.141 4.294 . 0 0 "[ . 1 . 2]" 1
217 1 34 ARG HB2 1 34 ARG QD . . 3.820 2.823 2.237 3.430 . 0 0 "[ . 1 . 2]" 1
218 1 34 ARG HB3 1 34 ARG QD . . 3.820 2.708 2.170 3.360 . 0 0 "[ . 1 . 2]" 1
219 1 34 ARG QD 1 37 TYR QD . . 4.820 4.041 2.410 4.908 0.088 4 0 "[ . 1 . 2]" 1
220 1 34 ARG QD 1 37 TYR QE . . 4.970 4.127 1.983 5.045 0.075 17 0 "[ . 1 . 2]" 1
221 1 34 ARG QG 1 37 TYR QD . . 4.750 4.309 2.833 4.833 0.083 9 0 "[ . 1 . 2]" 1
222 1 35 LYS H 1 35 LYS QG . . 4.640 3.682 2.645 4.284 . 0 0 "[ . 1 . 2]" 1
223 1 35 LYS HA 1 35 LYS QE . . 4.760 4.339 1.973 4.803 0.043 6 0 "[ . 1 . 2]" 1
224 1 35 LYS HA 1 35 LYS QG . . 3.510 2.438 2.147 3.398 . 0 0 "[ . 1 . 2]" 1
225 1 35 LYS HA 1 36 ASP H . . 3.030 2.702 2.263 3.104 0.074 1 0 "[ . 1 . 2]" 1
226 1 35 LYS HA 1 36 ASP QB . . 4.660 4.620 4.413 4.753 0.093 9 0 "[ . 1 . 2]" 1
227 1 35 LYS HA 1 37 TYR H . . 4.100 3.800 3.294 4.160 0.060 17 0 "[ . 1 . 2]" 1
228 1 35 LYS HA 1 37 TYR QD . . 4.480 3.685 3.028 4.543 0.063 12 0 "[ . 1 . 2]" 1
229 1 35 LYS QB 1 36 ASP H . . 4.010 3.112 2.034 3.976 . 0 0 "[ . 1 . 2]" 1
230 1 35 LYS QG 1 36 ASP H . . 4.690 3.630 1.797 4.753 0.063 4 0 "[ . 1 . 2]" 1
231 1 35 LYS QG 1 37 TYR QD . . 5.480 5.105 4.468 5.557 0.077 4 0 "[ . 1 . 2]" 1
232 1 35 LYS QG 1 37 TYR QE . . 4.560 4.032 3.095 4.651 0.091 6 0 "[ . 1 . 2]" 1
233 1 36 ASP H 1 36 ASP HB2 . . 4.140 2.922 2.074 3.401 . 0 0 "[ . 1 . 2]" 1
234 1 36 ASP H 1 36 ASP QB . . 3.310 2.762 2.057 3.212 . 0 0 "[ . 1 . 2]" 1
235 1 36 ASP H 1 36 ASP HB3 . . 4.140 3.533 2.738 4.030 . 0 0 "[ . 1 . 2]" 1
236 1 36 ASP H 1 37 TYR H . . 3.540 2.849 1.777 3.584 0.044 12 0 "[ . 1 . 2]" 1
237 1 36 ASP HA 1 37 TYR H . . 3.500 2.803 2.304 3.553 0.053 12 0 "[ . 1 . 2]" 1
238 1 36 ASP HB2 1 37 TYR H . . 4.600 4.355 3.349 4.603 0.003 16 0 "[ . 1 . 2]" 1
239 1 36 ASP HB2 1 37 TYR QD . . 5.500 5.380 4.876 5.584 0.084 1 0 "[ . 1 . 2]" 1
240 1 36 ASP HB3 1 37 TYR H . . 4.600 4.165 2.500 4.449 . 0 0 "[ . 1 . 2]" 1
241 1 36 ASP HB3 1 37 TYR QD . . 5.500 5.257 3.814 5.592 0.092 18 0 "[ . 1 . 2]" 1
242 1 37 TYR H 1 37 TYR HB2 . . 3.280 3.185 2.987 3.336 0.056 8 0 "[ . 1 . 2]" 1
243 1 37 TYR H 1 37 TYR HB3 . . 3.540 3.474 3.280 3.583 0.043 4 0 "[ . 1 . 2]" 1
244 1 37 TYR H 1 37 TYR QD . . 3.520 2.654 2.310 2.957 . 0 0 "[ . 1 . 2]" 1
245 1 37 TYR H 1 37 TYR QE . . 4.940 3.907 3.617 4.150 . 0 0 "[ . 1 . 2]" 1
246 1 37 TYR H 1 38 PRO HD2 . . 4.280 2.254 1.933 2.620 . 0 0 "[ . 1 . 2]" 1
247 1 37 TYR H 1 38 PRO QD . . 3.690 2.223 1.918 2.562 . 0 0 "[ . 1 . 2]" 1
248 1 37 TYR H 1 38 PRO HD3 . . 4.280 3.413 3.209 3.648 . 0 0 "[ . 1 . 2]" 1
249 1 37 TYR HB2 1 38 PRO HD2 . . 4.080 3.039 2.921 3.226 . 0 0 "[ . 1 . 2]" 1
250 1 37 TYR HB2 1 38 PRO QD . . 3.490 2.140 2.023 2.318 . 0 0 "[ . 1 . 2]" 1
251 1 37 TYR HB2 1 38 PRO HD3 . . 4.080 2.188 2.056 2.386 . 0 0 "[ . 1 . 2]" 1
252 1 37 TYR HB2 1 38 PRO QG . . 5.060 4.172 4.052 4.339 . 0 0 "[ . 1 . 2]" 1
253 1 37 TYR HB3 1 38 PRO HD2 . . 4.200 4.259 4.250 4.267 0.067 5 0 "[ . 1 . 2]" 1
254 1 37 TYR HB3 1 38 PRO HD3 . . 4.200 3.842 3.721 3.989 . 0 0 "[ . 1 . 2]" 1
255 1 37 TYR QD 1 38 PRO HD2 . . 4.430 3.209 2.430 3.488 . 0 0 "[ . 1 . 2]" 1
256 1 37 TYR QD 1 38 PRO QD . . 3.790 2.412 1.953 2.685 . 0 0 "[ . 1 . 2]" 1
257 1 37 TYR QD 1 38 PRO HD3 . . 4.430 2.500 2.058 2.814 . 0 0 "[ . 1 . 2]" 1
258 1 37 TYR QD 1 38 PRO QG . . 4.820 4.028 3.435 4.290 . 0 0 "[ . 1 . 2]" 1
259 1 37 TYR QE 1 38 PRO QG . . 5.500 5.392 4.636 5.584 0.084 14 0 "[ . 1 . 2]" 1
260 1 38 PRO HA 1 39 ALA H . . 2.750 2.262 2.139 2.692 . 0 0 "[ . 1 . 2]" 1
261 1 38 PRO HA 1 39 ALA MB . . 4.790 4.053 3.856 4.218 . 0 0 "[ . 1 . 2]" 1
262 1 38 PRO QB 1 39 ALA H . . 3.710 3.271 2.255 3.774 0.064 4 0 "[ . 1 . 2]" 1
263 1 38 PRO HB2 1 39 ALA H . . 4.400 3.489 2.283 4.114 . 0 0 "[ . 1 . 2]" 1
264 1 38 PRO HB3 1 39 ALA H . . 4.400 4.029 3.422 4.421 0.021 15 0 "[ . 1 . 2]" 1
265 1 38 PRO QD 1 39 ALA H . . 4.960 4.842 4.568 4.974 0.014 1 0 "[ . 1 . 2]" 1
266 1 38 PRO QG 1 39 ALA H . . 4.790 4.539 3.798 4.821 0.031 14 0 "[ . 1 . 2]" 1
267 1 39 ALA H 1 39 ALA MB . . 2.930 2.617 2.209 2.901 . 0 0 "[ . 1 . 2]" 1
268 1 39 ALA HA 1 40 LEU H . . 2.780 2.373 2.057 2.763 . 0 0 "[ . 1 . 2]" 1
269 1 39 ALA HA 1 40 LEU MD2 . . 4.720 4.646 4.185 4.794 0.074 9 0 "[ . 1 . 2]" 1
270 1 39 ALA HA 1 40 LEU HG . . 4.620 4.255 3.677 4.675 0.055 11 0 "[ . 1 . 2]" 1
271 1 39 ALA MB 1 40 LEU H . . 2.950 2.451 1.938 3.018 0.068 8 0 "[ . 1 . 2]" 1
272 1 40 LEU H 1 40 LEU HB2 . . 4.080 3.025 2.368 3.563 . 0 0 "[ . 1 . 2]" 1
273 1 40 LEU H 1 40 LEU QB . . 3.240 2.892 2.338 3.326 0.086 11 0 "[ . 1 . 2]" 1
274 1 40 LEU H 1 40 LEU HB3 . . 4.080 3.815 3.570 4.044 . 0 0 "[ . 1 . 2]" 1
275 1 40 LEU H 1 40 LEU MD2 . . 4.290 3.118 2.636 4.182 . 0 0 "[ . 1 . 2]" 1
276 1 40 LEU H 1 40 LEU HG . . 3.430 2.694 2.096 3.481 0.051 13 0 "[ . 1 . 2]" 1
277 1 40 LEU H 1 41 LEU H . . 4.190 3.497 2.536 4.256 0.066 8 0 "[ . 1 . 2]" 1
278 1 40 LEU HA 1 40 LEU MD2 . . 2.960 2.126 2.052 2.204 . 0 0 "[ . 1 . 2]" 1
279 1 40 LEU HA 1 40 LEU HG . . 3.580 3.148 2.891 3.306 . 0 0 "[ . 1 . 2]" 1
280 1 40 LEU HA 1 41 LEU H . . 2.970 2.319 2.069 2.589 . 0 0 "[ . 1 . 2]" 1
281 1 40 LEU QB 1 41 LEU H . . 3.790 3.771 3.476 3.867 0.077 2 0 "[ . 1 . 2]" 1
282 1 40 LEU HB2 1 41 LEU H . . 4.540 4.424 4.288 4.536 . 0 0 "[ . 1 . 2]" 1
283 1 40 LEU HB3 1 41 LEU H . . 4.540 4.113 3.643 4.387 . 0 0 "[ . 1 . 2]" 1
284 1 40 LEU MD2 1 41 LEU H . . 4.480 4.016 3.644 4.310 . 0 0 "[ . 1 . 2]" 1
285 1 40 LEU MD2 1 101 GLN QB . . 4.450 3.541 2.096 4.533 0.083 13 0 "[ . 1 . 2]" 1
286 1 40 LEU MD2 1 102 GLU H . . 4.850 3.966 3.153 4.889 0.039 15 0 "[ . 1 . 2]" 1
287 1 40 LEU MD2 1 102 GLU HA . . 3.660 2.606 2.014 3.574 . 0 0 "[ . 1 . 2]" 1
288 1 40 LEU MD2 1 102 GLU QB . . 4.440 3.541 2.086 4.394 . 0 0 "[ . 1 . 2]" 1
289 1 40 LEU MD2 1 102 GLU QG . . 3.980 2.908 2.008 3.995 0.015 14 0 "[ . 1 . 2]" 1
290 1 40 LEU HG 1 41 LEU H . . 5.460 5.134 4.962 5.336 . 0 0 "[ . 1 . 2]" 1
291 1 41 LEU H 1 41 LEU HB2 . . 3.800 2.907 2.186 3.694 . 0 0 "[ . 1 . 2]" 1
292 1 41 LEU H 1 41 LEU QB . . 3.050 2.419 2.165 2.595 . 0 0 "[ . 1 . 2]" 1
293 1 41 LEU H 1 41 LEU HB3 . . 3.800 3.160 2.334 3.675 . 0 0 "[ . 1 . 2]" 1
294 1 41 LEU H 1 41 LEU MD1 . . 5.100 3.738 3.385 4.173 . 0 0 "[ . 1 . 2]" 1
295 1 41 LEU H 1 41 LEU QD . . 4.020 2.875 2.065 3.318 . 0 0 "[ . 1 . 2]" 1
296 1 41 LEU H 1 41 LEU MD2 . . 5.100 3.082 2.075 3.875 . 0 0 "[ . 1 . 2]" 1
297 1 41 LEU H 1 41 LEU HG . . 3.800 2.626 2.054 3.869 0.069 15 0 "[ . 1 . 2]" 1
298 1 41 LEU HA 1 41 LEU QD . . 3.530 2.647 2.071 3.474 . 0 0 "[ . 1 . 2]" 1
299 1 41 LEU HA 1 42 PRO HD2 . . 3.270 2.511 2.316 2.804 . 0 0 "[ . 1 . 2]" 1
300 1 41 LEU HA 1 42 PRO HD3 . . 3.270 2.333 2.189 2.490 . 0 0 "[ . 1 . 2]" 1
301 1 41 LEU HA 1 42 PRO QG . . 4.400 4.093 4.008 4.177 . 0 0 "[ . 1 . 2]" 1
302 1 41 LEU QB 1 42 PRO QD . . 3.210 2.247 2.043 2.453 . 0 0 "[ . 1 . 2]" 1
303 1 41 LEU QB 1 105 ASP HA . . 4.600 3.573 2.378 4.671 0.071 9 0 "[ . 1 . 2]" 1
304 1 41 LEU HB2 1 42 PRO HD2 . . 4.740 3.219 2.081 4.036 . 0 0 "[ . 1 . 2]" 1
305 1 41 LEU HB2 1 42 PRO HD3 . . 4.740 4.296 3.407 4.806 0.066 6 0 "[ . 1 . 2]" 1
306 1 41 LEU HB3 1 42 PRO HD2 . . 4.740 2.836 2.209 3.697 . 0 0 "[ . 1 . 2]" 1
307 1 41 LEU HB3 1 42 PRO HD3 . . 4.740 3.947 3.383 4.634 . 0 0 "[ . 1 . 2]" 1
308 1 41 LEU QD 1 42 PRO QB . . 5.210 4.735 4.292 5.066 . 0 0 "[ . 1 . 2]" 1
309 1 41 LEU QD 1 42 PRO QD . . 3.150 2.692 2.022 3.242 0.092 11 0 "[ . 1 . 2]" 1
310 1 41 LEU QD 1 42 PRO QG . . 3.890 3.827 3.395 3.984 0.094 14 0 "[ . 1 . 2]" 1
311 1 41 LEU QD 1 105 ASP HA . . 3.490 2.276 1.970 2.928 . 0 0 "[ . 1 . 2]" 1
312 1 41 LEU QD 1 105 ASP QB . . 4.230 3.420 2.420 4.288 0.058 1 0 "[ . 1 . 2]" 1
313 1 41 LEU QD 1 108 TYR H . . 4.480 3.923 3.467 4.574 0.094 7 0 "[ . 1 . 2]" 1
314 1 41 LEU QD 1 108 TYR QB . . 3.670 2.288 1.954 3.129 . 0 0 "[ . 1 . 2]" 1
315 1 41 LEU QD 1 108 TYR QD . . 3.790 2.622 2.061 3.707 . 0 0 "[ . 1 . 2]" 1
316 1 41 LEU QD 1 109 ASN H . . 4.690 4.024 3.438 4.519 . 0 0 "[ . 1 . 2]" 1
317 1 41 LEU QD 1 109 ASN QD . . 4.090 3.505 2.813 4.148 0.058 8 0 "[ . 1 . 2]" 1
318 1 41 LEU MD1 1 108 TYR QD . . 4.560 3.014 2.204 4.137 . 0 0 "[ . 1 . 2]" 1
319 1 41 LEU MD1 1 108 TYR QE . . 5.500 3.721 2.332 4.769 . 0 0 "[ . 1 . 2]" 1
320 1 41 LEU MD2 1 108 TYR QD . . 4.560 3.605 2.106 4.636 0.076 18 0 "[ . 1 . 2]" 1
321 1 41 LEU MD2 1 108 TYR QE . . 5.500 4.816 3.313 5.587 0.087 20 0 "[ . 1 . 2]" 1
322 1 41 LEU HG 1 105 ASP H . . 5.500 4.945 3.837 5.562 0.062 20 0 "[ . 1 . 2]" 1
323 1 41 LEU HG 1 105 ASP HA . . 4.830 2.942 2.245 3.458 . 0 0 "[ . 1 . 2]" 1
324 1 41 LEU HG 1 109 ASN QD . . 5.290 4.631 3.276 5.360 0.070 8 0 "[ . 1 . 2]" 1
325 1 42 PRO HA 1 43 LEU H . . 2.780 2.266 2.057 2.502 . 0 0 "[ . 1 . 2]" 1
326 1 42 PRO HA 1 43 LEU QB . . 4.680 4.165 3.820 4.352 . 0 0 "[ . 1 . 2]" 1
327 1 42 PRO HA 1 101 GLN HE21 . . 3.670 2.769 2.318 3.632 . 0 0 "[ . 1 . 2]" 1
328 1 42 PRO HA 1 101 GLN HE22 . . 3.710 2.983 2.147 3.767 0.057 14 0 "[ . 1 . 2]" 1
329 1 42 PRO HA 1 101 GLN QG . . 5.330 4.454 3.451 5.386 0.056 13 0 "[ . 1 . 2]" 1
330 1 42 PRO QB 1 43 LEU H . . 3.540 3.068 2.356 3.617 0.077 17 0 "[ . 1 . 2]" 1
331 1 42 PRO QB 1 43 LEU QD . . 5.280 4.885 4.243 5.368 0.088 13 0 "[ . 1 . 2]" 1
332 1 42 PRO HB2 1 43 LEU H . . 4.230 3.250 2.395 3.946 . 0 0 "[ . 1 . 2]" 1
333 1 42 PRO HB3 1 43 LEU H . . 4.230 3.831 3.439 4.279 0.049 13 0 "[ . 1 . 2]" 1
334 1 42 PRO QG 1 43 LEU H . . 4.980 4.499 3.895 4.864 . 0 0 "[ . 1 . 2]" 1
335 1 43 LEU H 1 43 LEU QB . . 3.410 2.625 2.251 3.229 . 0 0 "[ . 1 . 2]" 1
336 1 43 LEU H 1 43 LEU MD1 . . 4.610 3.942 2.308 4.525 . 0 0 "[ . 1 . 2]" 1
337 1 43 LEU H 1 43 LEU QD . . 3.700 3.408 2.300 3.802 0.102 7 0 "[ . 1 . 2]" 1
338 1 43 LEU H 1 43 LEU MD2 . . 4.610 3.966 3.183 4.437 . 0 0 "[ . 1 . 2]" 1
339 1 43 LEU H 1 43 LEU HG . . 4.000 3.235 2.729 3.693 . 0 0 "[ . 1 . 2]" 1
340 1 43 LEU H 1 44 ASN H . . 4.650 4.376 4.056 4.689 0.039 10 0 "[ . 1 . 2]" 1
341 1 43 LEU H 1 101 GLN HE21 . . 4.170 3.053 1.894 4.212 0.042 16 0 "[ . 1 . 2]" 1
342 1 43 LEU H 1 101 GLN HE22 . . 4.370 3.156 2.218 4.409 0.039 16 0 "[ . 1 . 2]" 1
343 1 43 LEU H 1 101 GLN QG . . 4.530 4.274 3.301 4.599 0.069 2 0 "[ . 1 . 2]" 1
344 1 43 LEU HA 1 43 LEU QD . . 2.790 2.351 1.997 2.943 0.153 16 0 "[ . 1 . 2]" 1
345 1 43 LEU HA 1 44 ASN H . . 3.040 2.203 2.073 2.333 . 0 0 "[ . 1 . 2]" 1
346 1 43 LEU HA 1 44 ASN HB2 . . 4.520 4.452 4.117 4.578 0.058 4 0 "[ . 1 . 2]" 1
347 1 43 LEU HA 1 44 ASN HB3 . . 5.500 4.595 4.423 4.826 . 0 0 "[ . 1 . 2]" 1
348 1 43 LEU QB 1 44 ASN H . . 3.830 3.033 2.300 3.677 . 0 0 "[ . 1 . 2]" 1
349 1 43 LEU QB 1 101 GLN HA . . 4.870 4.221 3.114 4.945 0.075 3 0 "[ . 1 . 2]" 1
350 1 43 LEU QB 1 101 GLN HB2 . . 5.500 4.207 2.758 5.569 0.069 6 0 "[ . 1 . 2]" 1
351 1 43 LEU QB 1 101 GLN QB . . 4.850 3.980 2.726 4.912 0.062 6 0 "[ . 1 . 2]" 1
352 1 43 LEU QB 1 101 GLN HB3 . . 5.500 5.227 4.128 5.575 0.075 2 0 "[ . 1 . 2]" 1
353 1 43 LEU QB 1 101 GLN HG2 . . 4.910 4.410 2.407 4.994 0.084 2 0 "[ . 1 . 2]" 1
354 1 43 LEU QB 1 101 GLN QG . . 4.200 3.173 2.383 3.833 . 0 0 "[ . 1 . 2]" 1
355 1 43 LEU QB 1 101 GLN HG3 . . 4.910 3.400 2.416 4.976 0.066 13 0 "[ . 1 . 2]" 1
356 1 43 LEU QD 1 44 ASN H . . 3.630 3.000 2.202 3.536 . 0 0 "[ . 1 . 2]" 1
357 1 43 LEU QD 1 44 ASN HB2 . . 5.440 5.053 4.335 5.504 0.064 6 0 "[ . 1 . 2]" 1
358 1 43 LEU QD 1 97 ARG HA . . 4.560 4.158 3.078 4.659 0.099 4 0 "[ . 1 . 2]" 1
359 1 43 LEU QD 1 97 ARG QD . . 4.760 4.296 1.966 4.863 0.103 5 0 "[ . 1 . 2]" 1
360 1 43 LEU QD 1 97 ARG QG . . 4.170 3.651 2.479 4.264 0.094 6 0 "[ . 1 . 2]" 1
361 1 43 LEU QD 1 101 GLN H . . 3.960 3.259 2.803 3.705 . 0 0 "[ . 1 . 2]" 1
362 1 43 LEU QD 1 101 GLN HA . . 3.380 2.218 1.966 3.111 . 0 0 "[ . 1 . 2]" 1
363 1 43 LEU QD 1 101 GLN QB . . 4.070 2.488 2.038 3.583 . 0 0 "[ . 1 . 2]" 1
364 1 43 LEU QD 1 101 GLN HE21 . . 4.170 3.543 3.076 4.188 0.018 19 0 "[ . 1 . 2]" 1
365 1 43 LEU QD 1 101 GLN HE22 . . 4.400 4.068 3.309 4.483 0.083 11 0 "[ . 1 . 2]" 1
366 1 43 LEU QD 1 101 GLN QG . . 3.540 2.449 1.990 3.447 . 0 0 "[ . 1 . 2]" 1
367 1 43 LEU QD 1 102 GLU H . . 5.440 4.854 4.449 5.256 . 0 0 "[ . 1 . 2]" 1
368 1 43 LEU MD1 1 44 ASN H . . 4.870 3.887 2.206 4.941 0.071 9 0 "[ . 1 . 2]" 1
369 1 43 LEU MD1 1 101 GLN HE21 . . 4.740 4.162 3.309 4.822 0.082 18 0 "[ . 1 . 2]" 1
370 1 43 LEU MD1 1 101 GLN HE22 . . 5.230 4.566 3.538 5.295 0.065 7 0 "[ . 1 . 2]" 1
371 1 43 LEU MD2 1 44 ASN H . . 4.870 3.726 2.642 4.919 0.049 7 0 "[ . 1 . 2]" 1
372 1 43 LEU MD2 1 101 GLN HE21 . . 4.740 4.057 3.112 4.812 0.072 13 0 "[ . 1 . 2]" 1
373 1 43 LEU MD2 1 101 GLN HE22 . . 5.230 4.856 3.739 5.316 0.086 12 0 "[ . 1 . 2]" 1
374 1 43 LEU HG 1 101 GLN HA . . 4.590 3.790 2.188 4.656 0.066 7 0 "[ . 1 . 2]" 1
375 1 43 LEU HG 1 101 GLN HE21 . . 4.110 3.083 2.286 3.851 . 0 0 "[ . 1 . 2]" 1
376 1 43 LEU HG 1 101 GLN HE22 . . 4.490 3.839 2.479 4.130 . 0 0 "[ . 1 . 2]" 1
377 1 43 LEU HG 1 101 GLN QG . . 4.530 2.613 2.001 4.426 . 0 0 "[ . 1 . 2]" 1
378 1 44 ASN H 1 44 ASN HB2 . . 3.590 2.778 2.389 3.108 . 0 0 "[ . 1 . 2]" 1
379 1 44 ASN H 1 44 ASN HB3 . . 3.590 2.530 2.343 2.817 . 0 0 "[ . 1 . 2]" 1
380 1 44 ASN H 1 44 ASN HD21 . . 5.380 4.860 4.564 5.062 . 0 0 "[ . 1 . 2]" 1
381 1 44 ASN H 1 47 GLU HB3 . . 5.020 4.120 3.795 4.713 . 0 0 "[ . 1 . 2]" 1
382 1 44 ASN H 1 48 LEU MD2 . . 5.050 3.601 3.124 4.217 . 0 0 "[ . 1 . 2]" 1
383 1 44 ASN HB2 1 44 ASN HD21 . . 3.490 2.791 2.570 3.512 0.022 16 0 "[ . 1 . 2]" 1
384 1 44 ASN HB2 1 44 ASN HD22 . . 3.960 3.730 3.482 4.017 0.057 16 0 "[ . 1 . 2]" 1
385 1 44 ASN HB2 1 45 GLU H . . 4.700 4.513 4.383 4.599 . 0 0 "[ . 1 . 2]" 1
386 1 44 ASN HB2 1 47 GLU H . . 5.000 4.801 4.387 5.064 0.064 19 0 "[ . 1 . 2]" 1
387 1 44 ASN HB2 1 47 GLU HB2 . . 4.730 3.956 3.539 4.773 0.043 15 0 "[ . 1 . 2]" 1
388 1 44 ASN HB2 1 47 GLU HB3 . . 4.190 4.178 3.742 4.251 0.061 9 0 "[ . 1 . 2]" 1
389 1 44 ASN HB2 1 47 GLU QG . . 5.040 4.947 4.519 5.113 0.073 17 0 "[ . 1 . 2]" 1
390 1 44 ASN HB2 1 48 LEU MD2 . . 5.210 5.234 4.976 5.289 0.079 5 0 "[ . 1 . 2]" 1
391 1 44 ASN HB3 1 44 ASN HD21 . . 3.290 2.452 2.369 2.565 . 0 0 "[ . 1 . 2]" 1
392 1 44 ASN HB3 1 44 ASN HD22 . . 4.050 3.631 3.574 3.686 . 0 0 "[ . 1 . 2]" 1
393 1 44 ASN HB3 1 45 GLU H . . 4.600 4.420 4.267 4.500 . 0 0 "[ . 1 . 2]" 1
394 1 44 ASN HB3 1 46 SER H . . 4.380 4.174 3.753 4.424 0.044 1 0 "[ . 1 . 2]" 1
395 1 44 ASN HB3 1 47 GLU H . . 3.650 3.376 2.929 3.685 0.035 19 0 "[ . 1 . 2]" 1
396 1 44 ASN HB3 1 47 GLU HA . . 5.500 4.909 4.619 5.363 . 0 0 "[ . 1 . 2]" 1
397 1 44 ASN HB3 1 47 GLU HB2 . . 4.330 2.591 2.112 3.608 . 0 0 "[ . 1 . 2]" 1
398 1 44 ASN HB3 1 47 GLU HB3 . . 3.920 2.474 2.175 2.583 . 0 0 "[ . 1 . 2]" 1
399 1 44 ASN HB3 1 47 GLU QG . . 4.290 3.753 3.374 3.976 . 0 0 "[ . 1 . 2]" 1
400 1 44 ASN HB3 1 48 LEU MD2 . . 4.150 3.947 3.675 4.168 0.018 16 0 "[ . 1 . 2]" 1
401 1 44 ASN HD21 1 46 SER H . . 4.940 4.496 2.802 4.990 0.050 1 0 "[ . 1 . 2]" 1
402 1 44 ASN HD21 1 46 SER QB . . 4.930 3.881 2.867 4.498 . 0 0 "[ . 1 . 2]" 1
403 1 44 ASN HD21 1 47 GLU HB2 . . 4.690 2.171 1.627 2.414 . 0 0 "[ . 1 . 2]" 1
404 1 44 ASN HD21 1 47 GLU QG . . 4.280 3.476 3.156 3.904 . 0 0 "[ . 1 . 2]" 1
405 1 44 ASN HD21 1 48 LEU MD2 . . 5.500 5.530 5.000 5.584 0.084 17 0 "[ . 1 . 2]" 1
406 1 44 ASN HD22 1 46 SER QB . . 4.510 2.592 2.004 3.391 . 0 0 "[ . 1 . 2]" 1
407 1 44 ASN HD22 1 47 GLU QG . . 4.990 4.596 4.102 4.974 . 0 0 "[ . 1 . 2]" 1
408 1 45 GLU H 1 45 GLU HB2 . . 3.780 3.596 3.518 3.672 . 0 0 "[ . 1 . 2]" 1
409 1 45 GLU H 1 45 GLU QB . . 3.320 2.483 2.225 2.752 . 0 0 "[ . 1 . 2]" 1
410 1 45 GLU H 1 45 GLU HB3 . . 3.780 2.534 2.249 2.850 . 0 0 "[ . 1 . 2]" 1
411 1 45 GLU H 1 45 GLU HG2 . . 4.010 2.381 1.810 3.448 . 0 0 "[ . 1 . 2]" 1
412 1 45 GLU H 1 45 GLU QG . . 3.440 2.297 1.786 2.685 . 0 0 "[ . 1 . 2]" 1
413 1 45 GLU H 1 45 GLU HG3 . . 4.010 3.423 2.548 3.925 . 0 0 "[ . 1 . 2]" 1
414 1 45 GLU H 1 46 SER H . . 4.030 2.808 2.634 2.983 . 0 0 "[ . 1 . 2]" 1
415 1 45 GLU HA 1 47 GLU H . . 4.300 3.650 3.385 4.023 . 0 0 "[ . 1 . 2]" 1
416 1 45 GLU HA 1 48 LEU H . . 4.320 3.905 3.328 4.373 0.053 16 0 "[ . 1 . 2]" 1
417 1 45 GLU HA 1 48 LEU HB2 . . 5.140 3.750 2.756 4.256 . 0 0 "[ . 1 . 2]" 1
418 1 45 GLU HA 1 48 LEU QB . . 4.500 3.627 2.725 4.074 . 0 0 "[ . 1 . 2]" 1
419 1 45 GLU HA 1 48 LEU HB3 . . 5.140 4.887 4.307 5.203 0.063 2 0 "[ . 1 . 2]" 1
420 1 45 GLU HA 1 48 LEU MD1 . . 3.420 2.723 2.123 3.461 0.041 19 0 "[ . 1 . 2]" 1
421 1 45 GLU HA 1 48 LEU MD2 . . 4.420 3.681 3.201 4.449 0.029 19 0 "[ . 1 . 2]" 1
422 1 45 GLU HA 1 48 LEU HG . . 4.350 2.358 2.097 2.890 . 0 0 "[ . 1 . 2]" 1
423 1 45 GLU QB 1 46 SER H . . 3.860 3.740 3.531 3.887 0.027 10 0 "[ . 1 . 2]" 1
424 1 45 GLU HB2 1 46 SER H . . 4.410 4.148 3.762 4.460 0.050 17 0 "[ . 1 . 2]" 1
425 1 45 GLU HB3 1 46 SER H . . 4.410 4.266 4.053 4.464 0.054 16 0 "[ . 1 . 2]" 1
426 1 45 GLU QG 1 46 SER H . . 4.710 2.702 2.341 3.095 . 0 0 "[ . 1 . 2]" 1
427 1 46 SER H 1 46 SER QB . . 3.370 2.393 2.074 2.567 . 0 0 "[ . 1 . 2]" 1
428 1 46 SER H 1 47 GLU H . . 3.520 2.606 2.220 2.843 . 0 0 "[ . 1 . 2]" 1
429 1 46 SER H 1 48 LEU H . . 4.690 4.324 3.912 4.658 . 0 0 "[ . 1 . 2]" 1
430 1 46 SER QB 1 47 GLU H . . 4.370 3.408 3.089 3.641 . 0 0 "[ . 1 . 2]" 1
431 1 46 SER QB 1 47 GLU HB2 . . 4.190 3.963 3.633 4.256 0.066 13 0 "[ . 1 . 2]" 1
432 1 46 SER QB 1 47 GLU HB3 . . 5.500 5.076 4.592 5.349 . 0 0 "[ . 1 . 2]" 1
433 1 46 SER QB 1 47 GLU QG . . 5.500 5.377 4.828 5.582 0.082 16 0 "[ . 1 . 2]" 1
434 1 46 SER QB 1 48 LEU H . . 5.240 4.806 4.544 5.026 . 0 0 "[ . 1 . 2]" 1
435 1 47 GLU H 1 47 GLU HB2 . . 3.690 2.644 2.192 3.110 . 0 0 "[ . 1 . 2]" 1
436 1 47 GLU H 1 47 GLU HB3 . . 3.170 2.638 2.409 2.895 . 0 0 "[ . 1 . 2]" 1
437 1 47 GLU H 1 47 GLU QG . . 4.420 4.092 3.911 4.226 . 0 0 "[ . 1 . 2]" 1
438 1 47 GLU H 1 48 LEU H . . 3.230 2.268 1.918 2.512 . 0 0 "[ . 1 . 2]" 1
439 1 47 GLU H 1 48 LEU MD1 . . 4.950 4.702 4.248 5.028 0.078 7 0 "[ . 1 . 2]" 1
440 1 47 GLU H 1 48 LEU HG . . 3.980 3.210 2.705 3.615 . 0 0 "[ . 1 . 2]" 1
441 1 47 GLU HA 1 47 GLU QG . . 3.350 2.596 2.254 3.059 . 0 0 "[ . 1 . 2]" 1
442 1 47 GLU HB3 1 48 LEU H . . 4.220 3.695 3.136 4.179 . 0 0 "[ . 1 . 2]" 1
443 1 47 GLU QG 1 48 LEU H . . 4.600 4.593 4.321 4.671 0.071 14 0 "[ . 1 . 2]" 1
444 1 48 LEU H 1 48 LEU HB2 . . 3.940 2.717 2.526 2.920 . 0 0 "[ . 1 . 2]" 1
445 1 48 LEU H 1 48 LEU QB . . 3.230 2.654 2.474 2.827 . 0 0 "[ . 1 . 2]" 1
446 1 48 LEU H 1 48 LEU HB3 . . 3.940 3.730 3.544 3.824 . 0 0 "[ . 1 . 2]" 1
447 1 48 LEU H 1 48 LEU MD1 . . 4.150 4.011 3.795 4.220 0.070 14 0 "[ . 1 . 2]" 1
448 1 48 LEU H 1 48 LEU MD2 . . 3.500 3.056 2.572 3.434 . 0 0 "[ . 1 . 2]" 1
449 1 48 LEU H 1 48 LEU HG . . 3.350 2.577 2.214 2.932 . 0 0 "[ . 1 . 2]" 1
450 1 48 LEU H 1 49 GLU H . . 4.710 4.525 4.247 4.663 . 0 0 "[ . 1 . 2]" 1
451 1 48 LEU HA 1 48 LEU MD2 . . 3.420 2.351 2.156 2.613 . 0 0 "[ . 1 . 2]" 1
452 1 48 LEU HA 1 49 GLU H . . 3.230 2.404 2.141 2.643 . 0 0 "[ . 1 . 2]" 1
453 1 48 LEU HA 1 74 HIS HA . . 4.520 4.009 2.790 4.567 0.047 3 0 "[ . 1 . 2]" 1
454 1 48 LEU HA 1 75 VAL H . . 4.300 3.665 2.887 4.225 . 0 0 "[ . 1 . 2]" 1
455 1 48 LEU HA 1 75 VAL MG2 . . 4.280 3.119 2.197 4.060 . 0 0 "[ . 1 . 2]" 1
456 1 48 LEU QB 1 48 LEU MD1 . . 3.240 2.082 2.030 2.120 . 0 0 "[ . 1 . 2]" 1
457 1 48 LEU QB 1 49 GLU H . . 3.650 2.465 2.018 3.382 . 0 0 "[ . 1 . 2]" 1
458 1 48 LEU HB2 1 49 GLU H . . 4.190 3.426 3.035 4.235 0.045 15 0 "[ . 1 . 2]" 1
459 1 48 LEU HB3 1 49 GLU H . . 4.190 2.534 2.047 3.556 . 0 0 "[ . 1 . 2]" 1
460 1 48 LEU MD1 1 74 HIS HA . . 4.430 3.963 2.682 4.491 0.061 2 0 "[ . 1 . 2]" 1
461 1 48 LEU MD1 1 74 HIS QB . . 5.100 4.695 3.825 5.179 0.079 8 0 "[ . 1 . 2]" 1
462 1 48 LEU MD2 1 74 HIS HA . . 3.510 2.878 2.221 3.445 . 0 0 "[ . 1 . 2]" 1
463 1 48 LEU MD2 1 74 HIS HB2 . . 5.490 4.462 3.636 5.114 . 0 0 "[ . 1 . 2]" 1
464 1 48 LEU MD2 1 74 HIS QB . . 4.770 4.159 3.469 4.610 . 0 0 "[ . 1 . 2]" 1
465 1 48 LEU MD2 1 74 HIS HB3 . . 5.490 4.985 4.386 5.437 . 0 0 "[ . 1 . 2]" 1
466 1 48 LEU MD2 1 74 HIS HD2 . . 3.290 2.273 2.047 2.797 . 0 0 "[ . 1 . 2]" 1
467 1 48 LEU MD2 1 75 VAL H . . 3.910 3.373 2.512 3.967 0.057 13 0 "[ . 1 . 2]" 1
468 1 48 LEU HG 1 74 HIS HD2 . . 5.000 4.812 4.203 5.067 0.067 2 0 "[ . 1 . 2]" 1
469 1 49 GLU H 1 49 GLU HB2 . . 3.950 2.808 2.308 3.908 . 0 0 "[ . 1 . 2]" 1
470 1 49 GLU H 1 49 GLU QB . . 3.430 2.609 2.281 3.124 . 0 0 "[ . 1 . 2]" 1
471 1 49 GLU H 1 49 GLU HB3 . . 3.950 3.592 3.088 3.835 . 0 0 "[ . 1 . 2]" 1
472 1 49 GLU H 1 49 GLU HG2 . . 4.260 3.442 2.288 4.303 0.043 20 0 "[ . 1 . 2]" 1
473 1 49 GLU H 1 49 GLU QG . . 3.730 2.818 2.243 3.395 . 0 0 "[ . 1 . 2]" 1
474 1 49 GLU H 1 49 GLU HG3 . . 4.260 3.313 2.382 4.320 0.060 13 0 "[ . 1 . 2]" 1
475 1 49 GLU H 1 50 GLU HA . . 5.030 4.798 4.476 5.088 0.058 3 0 "[ . 1 . 2]" 1
476 1 49 GLU H 1 73 LYS QD . . 4.710 3.984 3.001 4.765 0.055 15 0 "[ . 1 . 2]" 1
477 1 49 GLU H 1 74 HIS HA . . 4.740 4.406 3.701 4.799 0.059 4 0 "[ . 1 . 2]" 1
478 1 49 GLU H 1 75 VAL H . . 4.720 4.462 3.700 4.774 0.054 19 0 "[ . 1 . 2]" 1
479 1 49 GLU H 1 75 VAL MG2 . . 3.700 3.240 2.280 3.758 0.058 14 0 "[ . 1 . 2]" 1
480 1 49 GLU HA 1 49 GLU HG2 . . 4.120 2.883 2.303 3.853 . 0 0 "[ . 1 . 2]" 1
481 1 49 GLU HA 1 49 GLU HG3 . . 4.120 3.426 2.909 3.943 . 0 0 "[ . 1 . 2]" 1
482 1 49 GLU HA 1 50 GLU H . . 3.110 2.240 2.112 2.442 . 0 0 "[ . 1 . 2]" 1
483 1 49 GLU HA 1 75 VAL MG2 . . 5.000 4.656 3.758 5.077 0.077 18 0 "[ . 1 . 2]" 1
484 1 49 GLU QB 1 75 VAL MG2 . . 3.640 3.061 2.224 3.739 0.099 19 0 "[ . 1 . 2]" 1
485 1 49 GLU HB2 1 50 GLU H . . 4.600 4.012 2.748 4.657 0.057 2 0 "[ . 1 . 2]" 1
486 1 49 GLU HB3 1 50 GLU H . . 4.600 3.608 2.583 4.220 . 0 0 "[ . 1 . 2]" 1
487 1 49 GLU QG 1 50 GLU H . . 4.710 4.241 3.666 4.792 0.082 10 0 "[ . 1 . 2]" 1
488 1 49 GLU QG 1 75 VAL MG2 . . 3.270 2.247 1.999 2.634 . 0 0 "[ . 1 . 2]" 1
489 1 49 GLU HG2 1 75 VAL MG2 . . 3.840 3.080 2.151 3.890 0.050 19 0 "[ . 1 . 2]" 1
490 1 49 GLU HG3 1 75 VAL MG2 . . 3.840 2.611 2.086 3.902 0.062 6 0 "[ . 1 . 2]" 1
491 1 50 GLU H 1 50 GLU HB2 . . 4.080 3.689 2.234 3.962 . 0 0 "[ . 1 . 2]" 1
492 1 50 GLU H 1 50 GLU HB3 . . 4.080 3.006 2.581 3.516 . 0 0 "[ . 1 . 2]" 1
493 1 50 GLU H 1 50 GLU HG2 . . 4.330 2.735 2.137 3.833 . 0 0 "[ . 1 . 2]" 1
494 1 50 GLU H 1 50 GLU QG . . 3.790 2.583 2.096 3.461 . 0 0 "[ . 1 . 2]" 1
495 1 50 GLU H 1 50 GLU HG3 . . 4.330 3.534 2.470 4.352 0.022 6 0 "[ . 1 . 2]" 1
496 1 50 GLU H 1 72 LEU MD1 . . 4.990 4.137 3.416 4.906 . 0 0 "[ . 1 . 2]" 1
497 1 50 GLU HA 1 51 GLN H . . 3.310 2.391 2.235 2.594 . 0 0 "[ . 1 . 2]" 1
498 1 50 GLU HA 1 51 GLN QG . . 5.500 4.006 3.398 5.577 0.077 7 0 "[ . 1 . 2]" 1
499 1 50 GLU HA 1 72 LEU MD1 . . 4.200 2.723 2.249 3.289 . 0 0 "[ . 1 . 2]" 1
500 1 50 GLU QB 1 51 GLN H . . 3.930 2.542 2.182 3.073 . 0 0 "[ . 1 . 2]" 1
501 1 50 GLU QB 1 72 LEU MD1 . . 4.230 2.451 1.927 4.100 . 0 0 "[ . 1 . 2]" 1
502 1 50 GLU HB2 1 51 GLN H . . 4.710 2.635 2.200 4.103 . 0 0 "[ . 1 . 2]" 1
503 1 50 GLU HB3 1 51 GLN H . . 4.710 3.846 2.961 4.228 . 0 0 "[ . 1 . 2]" 1
504 1 50 GLU QG 1 52 PHE QE . . 4.940 3.482 2.817 4.225 . 0 0 "[ . 1 . 2]" 1
505 1 50 GLU QG 1 52 PHE HZ . . 3.920 3.393 2.445 4.002 0.082 3 0 "[ . 1 . 2]" 1
506 1 50 GLU HG2 1 52 PHE HZ . . 4.570 4.251 2.867 4.634 0.064 13 0 "[ . 1 . 2]" 1
507 1 50 GLU HG3 1 52 PHE HZ . . 4.570 3.673 2.537 4.612 0.042 15 0 "[ . 1 . 2]" 1
508 1 51 GLN H 1 51 GLN QB . . 3.570 2.711 2.411 3.378 . 0 0 "[ . 1 . 2]" 1
509 1 51 GLN H 1 51 GLN QG . . 4.210 3.373 2.891 4.256 0.046 20 0 "[ . 1 . 2]" 1
510 1 51 GLN H 1 71 VAL H . . 4.340 3.501 2.782 4.221 . 0 0 "[ . 1 . 2]" 1
511 1 51 GLN H 1 71 VAL QG . . 4.650 3.481 2.230 4.568 . 0 0 "[ . 1 . 2]" 1
512 1 51 GLN H 1 72 LEU HA . . 4.300 3.758 3.327 4.246 . 0 0 "[ . 1 . 2]" 1
513 1 51 GLN H 1 72 LEU MD1 . . 4.520 4.245 3.661 4.581 0.061 14 0 "[ . 1 . 2]" 1
514 1 51 GLN HA 1 51 GLN QG . . 3.840 2.565 2.314 3.554 . 0 0 "[ . 1 . 2]" 1
515 1 51 GLN HA 1 52 PHE H . . 3.230 2.350 1.961 2.635 . 0 0 "[ . 1 . 2]" 1
516 1 51 GLN HA 1 52 PHE QD . . 4.410 3.509 2.929 4.456 0.046 15 0 "[ . 1 . 2]" 1
517 1 51 GLN QB 1 51 GLN QE . . 3.820 2.963 1.922 3.605 . 0 0 "[ . 1 . 2]" 1
518 1 51 GLN QB 1 52 PHE H . . 3.520 2.683 2.044 3.598 0.078 7 0 "[ . 1 . 2]" 1
519 1 51 GLN QB 1 71 VAL H . . 4.730 3.938 3.047 4.649 . 0 0 "[ . 1 . 2]" 1
520 1 51 GLN QB 1 72 LEU HA . . 5.270 4.953 3.953 5.331 0.061 2 0 "[ . 1 . 2]" 1
521 1 51 GLN HB2 1 52 PHE H . . 4.130 3.706 2.522 4.198 0.068 9 0 "[ . 1 . 2]" 1
522 1 51 GLN HB3 1 52 PHE H . . 4.130 2.816 2.063 3.969 . 0 0 "[ . 1 . 2]" 1
523 1 51 GLN QE 1 71 VAL QG . . 3.890 3.309 2.041 3.996 0.106 17 0 "[ . 1 . 2]" 1
524 1 51 GLN QG 1 52 PHE H . . 4.280 3.842 2.561 4.349 0.069 17 0 "[ . 1 . 2]" 1
525 1 51 GLN QG 1 71 VAL QG . . 4.360 3.509 1.952 4.421 0.061 9 0 "[ . 1 . 2]" 1
526 1 52 PHE H 1 52 PHE HB2 . . 4.140 2.652 2.422 2.845 . 0 0 "[ . 1 . 2]" 1
527 1 52 PHE H 1 52 PHE QB . . 3.530 2.601 2.388 2.773 . 0 0 "[ . 1 . 2]" 1
528 1 52 PHE H 1 52 PHE HB3 . . 4.140 3.754 3.577 3.840 . 0 0 "[ . 1 . 2]" 1
529 1 52 PHE H 1 52 PHE QD . . 4.090 2.810 2.290 3.156 . 0 0 "[ . 1 . 2]" 1
530 1 52 PHE H 1 53 VAL H . . 4.680 4.432 4.040 4.661 . 0 0 "[ . 1 . 2]" 1
531 1 52 PHE H 1 53 VAL MG2 . . 5.010 4.583 4.006 4.944 . 0 0 "[ . 1 . 2]" 1
532 1 52 PHE HA 1 52 PHE QD . . 4.120 2.860 2.466 3.123 . 0 0 "[ . 1 . 2]" 1
533 1 52 PHE HA 1 53 VAL H . . 3.380 2.321 2.153 2.501 . 0 0 "[ . 1 . 2]" 1
534 1 52 PHE HA 1 70 VAL HA . . 4.350 3.503 2.179 4.367 0.017 6 0 "[ . 1 . 2]" 1
535 1 52 PHE HA 1 71 VAL H . . 4.600 4.051 2.871 4.653 0.053 17 0 "[ . 1 . 2]" 1
536 1 52 PHE QB 1 53 VAL H . . 3.730 2.936 2.379 3.586 . 0 0 "[ . 1 . 2]" 1
537 1 52 PHE HB2 1 53 VAL H . . 4.280 3.934 3.377 4.342 0.062 10 0 "[ . 1 . 2]" 1
538 1 52 PHE HB3 1 53 VAL H . . 4.280 3.039 2.416 3.822 . 0 0 "[ . 1 . 2]" 1
539 1 52 PHE QD 1 53 VAL H . . 4.730 4.229 3.707 4.794 0.064 10 0 "[ . 1 . 2]" 1
540 1 52 PHE QD 1 70 VAL MG1 . . 5.160 4.408 2.518 5.234 0.074 7 0 "[ . 1 . 2]" 1
541 1 52 PHE QD 1 70 VAL MG2 . . 4.580 3.699 2.128 4.629 0.049 7 0 "[ . 1 . 2]" 1
542 1 52 PHE QD 1 89 VAL MG1 . . 5.500 4.509 3.678 5.373 . 0 0 "[ . 1 . 2]" 1
543 1 52 PHE QD 1 89 VAL MG2 . . 4.290 2.675 2.218 3.553 . 0 0 "[ . 1 . 2]" 1
544 1 52 PHE QE 1 70 VAL MG1 . . 5.500 4.619 2.788 5.572 0.072 4 0 "[ . 1 . 2]" 1
545 1 52 PHE QE 1 89 VAL MG1 . . 4.920 4.088 3.091 4.730 . 0 0 "[ . 1 . 2]" 1
546 1 52 PHE QE 1 89 VAL MG2 . . 4.610 2.729 2.133 3.473 . 0 0 "[ . 1 . 2]" 1
547 1 53 VAL H 1 53 VAL HB . . 4.020 2.591 2.400 2.907 . 0 0 "[ . 1 . 2]" 1
548 1 53 VAL H 1 53 VAL MG1 . . 3.860 3.848 3.764 3.935 0.075 4 0 "[ . 1 . 2]" 1
549 1 53 VAL H 1 53 VAL MG2 . . 4.000 2.565 2.167 3.142 . 0 0 "[ . 1 . 2]" 1
550 1 53 VAL H 1 54 LYS H . . 4.860 4.319 3.810 4.653 . 0 0 "[ . 1 . 2]" 1
551 1 53 VAL H 1 69 CYS H . . 5.080 4.668 3.465 5.149 0.069 17 0 "[ . 1 . 2]" 1
552 1 53 VAL H 1 70 VAL HA . . 4.440 3.936 3.165 4.489 0.049 4 0 "[ . 1 . 2]" 1
553 1 53 VAL HA 1 53 VAL MG1 . . 3.750 2.392 2.251 2.481 . 0 0 "[ . 1 . 2]" 1
554 1 53 VAL HA 1 53 VAL MG2 . . 3.350 2.443 2.317 2.682 . 0 0 "[ . 1 . 2]" 1
555 1 53 VAL HB 1 54 LYS H . . 4.190 4.163 3.799 4.262 0.072 19 0 "[ . 1 . 2]" 1
556 1 53 VAL HB 1 69 CYS QB . . 4.640 2.595 2.058 4.108 . 0 0 "[ . 1 . 2]" 1
557 1 53 VAL MG1 1 54 LYS H . . 4.330 2.781 2.115 3.204 . 0 0 "[ . 1 . 2]" 1
558 1 53 VAL MG1 1 69 CYS H . . 4.970 4.390 3.377 5.032 0.062 10 0 "[ . 1 . 2]" 1
559 1 53 VAL MG1 1 69 CYS HB2 . . 4.570 3.426 2.198 4.609 0.039 17 0 "[ . 1 . 2]" 1
560 1 53 VAL MG1 1 69 CYS QB . . 3.770 2.915 2.043 3.837 0.067 18 0 "[ . 1 . 2]" 1
561 1 53 VAL MG1 1 69 CYS HB3 . . 4.570 3.562 2.428 4.637 0.067 18 0 "[ . 1 . 2]" 1
562 1 54 LYS H 1 54 LYS HB2 . . 3.960 2.741 2.373 3.898 . 0 0 "[ . 1 . 2]" 1
563 1 54 LYS H 1 54 LYS QB . . 3.340 2.585 2.287 3.393 0.053 10 0 "[ . 1 . 2]" 1
564 1 54 LYS H 1 54 LYS HB3 . . 3.960 3.503 2.662 3.895 . 0 0 "[ . 1 . 2]" 1
565 1 54 LYS H 1 54 LYS QG . . 4.060 3.303 2.465 4.134 0.074 3 0 "[ . 1 . 2]" 1
566 1 54 LYS HA 1 54 LYS QD . . 3.990 3.595 2.266 4.068 0.078 10 0 "[ . 1 . 2]" 1
567 1 54 LYS HA 1 54 LYS HG2 . . 4.060 2.837 2.265 3.844 . 0 0 "[ . 1 . 2]" 1
568 1 54 LYS HA 1 54 LYS QG . . 3.540 2.531 2.158 3.412 . 0 0 "[ . 1 . 2]" 1
569 1 54 LYS HA 1 54 LYS HG3 . . 4.060 3.163 2.271 4.127 0.067 17 0 "[ . 1 . 2]" 1
570 1 54 LYS QB 1 55 GLY H . . 4.390 3.266 2.212 4.031 . 0 0 "[ . 1 . 2]" 1
571 1 54 LYS QB 1 55 GLY QA . . 4.190 4.027 3.636 4.284 0.094 7 0 "[ . 1 . 2]" 1
572 1 54 LYS HB2 1 54 LYS QE . . 4.590 3.367 2.110 4.639 0.049 9 0 "[ . 1 . 2]" 1
573 1 54 LYS HB3 1 54 LYS QE . . 4.590 3.322 2.112 4.543 . 0 0 "[ . 1 . 2]" 1
574 1 57 GLY QA 1 58 PRO QD . . 2.650 2.085 2.001 2.171 . 0 0 "[ . 1 . 2]" 1
575 1 57 GLY HA2 1 58 PRO QD . . 3.320 2.385 2.078 2.543 . 0 0 "[ . 1 . 2]" 1
576 1 57 GLY HA2 1 58 PRO QG . . 4.400 4.340 3.991 4.478 0.078 8 0 "[ . 1 . 2]" 1
577 1 57 GLY HA3 1 58 PRO QD . . 3.320 2.363 2.101 2.842 . 0 0 "[ . 1 . 2]" 1
578 1 57 GLY HA3 1 58 PRO QG . . 4.400 4.205 3.979 4.469 0.069 12 0 "[ . 1 . 2]" 1
579 1 58 PRO QB 1 59 GLY H . . 4.090 3.267 2.367 4.095 0.005 3 0 "[ . 1 . 2]" 1
580 1 65 LYS HA 1 65 LYS QD . . 3.510 2.899 2.160 3.593 0.083 20 0 "[ . 1 . 2]" 1
581 1 65 LYS HA 1 65 LYS HG2 . . 3.900 3.256 2.179 3.829 . 0 0 "[ . 1 . 2]" 1
582 1 65 LYS HA 1 65 LYS HG3 . . 3.900 3.072 2.236 3.896 . 0 0 "[ . 1 . 2]" 1
583 1 65 LYS HB2 1 65 LYS QE . . 4.880 4.022 2.195 4.643 . 0 0 "[ . 1 . 2]" 1
584 1 65 LYS HB3 1 65 LYS QE . . 4.880 4.120 3.051 4.586 . 0 0 "[ . 1 . 2]" 1
585 1 66 THR HA 1 66 THR MG . . 3.380 2.404 2.152 3.274 . 0 0 "[ . 1 . 2]" 1
586 1 68 ASN QB 1 92 ASN QD . . 3.890 2.787 2.175 3.491 . 0 0 "[ . 1 . 2]" 1
587 1 68 ASN HB2 1 92 ASN HD21 . . 5.230 3.916 2.407 5.289 0.059 2 0 "[ . 1 . 2]" 1
588 1 68 ASN HB2 1 92 ASN HD22 . . 5.230 3.783 2.538 5.228 . 0 0 "[ . 1 . 2]" 1
589 1 68 ASN HB3 1 92 ASN HD21 . . 5.230 3.741 2.571 5.279 0.049 6 0 "[ . 1 . 2]" 1
590 1 68 ASN HB3 1 92 ASN HD22 . . 5.230 3.787 2.501 5.283 0.053 6 0 "[ . 1 . 2]" 1
591 1 68 ASN QD 1 87 ARG HA . . 3.880 3.203 2.371 3.941 0.061 17 0 "[ . 1 . 2]" 1
592 1 68 ASN HD21 1 87 ARG HA . . 4.530 3.449 2.462 4.428 . 0 0 "[ . 1 . 2]" 1
593 1 68 ASN HD22 1 87 ARG HA . . 4.530 4.015 2.988 4.592 0.062 12 0 "[ . 1 . 2]" 1
594 1 69 CYS H 1 69 CYS HB2 . . 4.020 2.863 2.221 3.902 . 0 0 "[ . 1 . 2]" 1
595 1 69 CYS H 1 69 CYS HB3 . . 4.020 3.271 2.520 3.971 . 0 0 "[ . 1 . 2]" 1
596 1 69 CYS H 1 70 VAL H . . 4.560 4.399 3.739 4.620 0.060 11 0 "[ . 1 . 2]" 1
597 1 69 CYS HA 1 70 VAL H . . 3.340 2.282 2.125 2.410 . 0 0 "[ . 1 . 2]" 1
598 1 69 CYS HA 1 84 HIS HB2 . . 4.850 3.403 2.173 4.797 . 0 0 "[ . 1 . 2]" 1
599 1 69 CYS HA 1 84 HIS QB . . 4.260 2.441 1.977 3.657 . 0 0 "[ . 1 . 2]" 1
600 1 69 CYS HA 1 84 HIS HB3 . . 4.850 2.824 1.991 4.541 . 0 0 "[ . 1 . 2]" 1
601 1 69 CYS QB 1 70 VAL H . . 4.020 3.223 2.562 3.910 . 0 0 "[ . 1 . 2]" 1
602 1 69 CYS QB 1 84 HIS QB . . 4.170 3.415 2.711 4.245 0.075 6 0 "[ . 1 . 2]" 1
603 1 69 CYS HB2 1 70 VAL H . . 4.630 3.968 2.775 4.425 . 0 0 "[ . 1 . 2]" 1
604 1 69 CYS HB3 1 70 VAL H . . 4.630 3.538 2.614 4.382 . 0 0 "[ . 1 . 2]" 1
605 1 70 VAL H 1 70 VAL HB . . 3.780 2.582 2.347 2.984 . 0 0 "[ . 1 . 2]" 1
606 1 70 VAL H 1 70 VAL MG1 . . 4.400 3.826 3.655 3.970 . 0 0 "[ . 1 . 2]" 1
607 1 70 VAL H 1 70 VAL MG2 . . 4.020 2.921 2.603 3.245 . 0 0 "[ . 1 . 2]" 1
608 1 70 VAL H 1 83 CYS H . . 4.410 3.564 2.934 4.117 . 0 0 "[ . 1 . 2]" 1
609 1 70 VAL H 1 83 CYS QB . . 5.340 4.743 3.700 5.411 0.071 15 0 "[ . 1 . 2]" 1
610 1 70 VAL HA 1 70 VAL MG1 . . 3.520 2.498 2.198 2.839 . 0 0 "[ . 1 . 2]" 1
611 1 70 VAL HA 1 70 VAL MG2 . . 3.670 2.352 2.192 2.720 . 0 0 "[ . 1 . 2]" 1
612 1 70 VAL HA 1 71 VAL H . . 3.270 2.288 2.175 2.413 . 0 0 "[ . 1 . 2]" 1
613 1 70 VAL HB 1 71 VAL H . . 5.100 4.111 3.384 4.514 . 0 0 "[ . 1 . 2]" 1
614 1 70 VAL HB 1 83 CYS H . . 4.590 3.995 3.485 4.412 . 0 0 "[ . 1 . 2]" 1
615 1 70 VAL HB 1 83 CYS QB . . 4.650 4.207 3.311 4.716 0.066 10 0 "[ . 1 . 2]" 1
616 1 70 VAL HB 1 96 ALA MB . . 3.730 3.374 2.825 3.800 0.070 2 0 "[ . 1 . 2]" 1
617 1 70 VAL MG1 1 71 VAL H . . 3.770 2.521 1.878 3.144 . 0 0 "[ . 1 . 2]" 1
618 1 70 VAL MG1 1 93 ARG HA . . 3.590 2.354 2.001 2.914 . 0 0 "[ . 1 . 2]" 1
619 1 70 VAL MG1 1 96 ALA H . . 5.000 4.340 3.828 4.998 . 0 0 "[ . 1 . 2]" 1
620 1 70 VAL MG1 1 96 ALA MB . . 3.280 2.673 2.157 3.396 0.116 11 0 "[ . 1 . 2]" 1
621 1 70 VAL MG2 1 71 VAL H . . 4.340 3.946 3.723 4.144 . 0 0 "[ . 1 . 2]" 1
622 1 70 VAL MG2 1 83 CYS H . . 5.500 5.260 4.895 5.551 0.051 1 0 "[ . 1 . 2]" 1
623 1 70 VAL MG2 1 89 VAL HA . . 3.100 2.831 2.339 3.165 0.065 11 0 "[ . 1 . 2]" 1
624 1 70 VAL MG2 1 92 ASN HB2 . . 3.900 2.229 2.077 2.714 . 0 0 "[ . 1 . 2]" 1
625 1 70 VAL MG2 1 92 ASN HB3 . . 3.850 2.457 2.242 2.817 . 0 0 "[ . 1 . 2]" 1
626 1 70 VAL MG2 1 92 ASN QD . . 4.800 2.697 2.215 3.201 . 0 0 "[ . 1 . 2]" 1
627 1 70 VAL MG2 1 93 ARG H . . 4.190 3.317 2.465 3.773 . 0 0 "[ . 1 . 2]" 1
628 1 70 VAL MG2 1 93 ARG HA . . 3.940 3.624 2.476 4.013 0.073 20 0 "[ . 1 . 2]" 1
629 1 70 VAL MG2 1 93 ARG HG2 . . 4.520 3.737 3.032 4.351 . 0 0 "[ . 1 . 2]" 1
630 1 70 VAL MG2 1 93 ARG QG . . 3.810 2.998 2.437 3.645 . 0 0 "[ . 1 . 2]" 1
631 1 70 VAL MG2 1 93 ARG HG3 . . 4.520 3.240 2.491 4.613 0.093 12 0 "[ . 1 . 2]" 1
632 1 70 VAL MG2 1 96 ALA MB . . 4.490 4.252 3.811 4.560 0.070 5 0 "[ . 1 . 2]" 1
633 1 71 VAL H 1 71 VAL HB . . 4.060 3.193 2.561 3.872 . 0 0 "[ . 1 . 2]" 1
634 1 71 VAL H 1 71 VAL MG1 . . 4.300 3.019 2.192 3.952 . 0 0 "[ . 1 . 2]" 1
635 1 71 VAL H 1 71 VAL QG . . 3.730 2.427 2.115 2.872 . 0 0 "[ . 1 . 2]" 1
636 1 71 VAL H 1 71 VAL MG2 . . 4.300 3.184 2.164 4.009 . 0 0 "[ . 1 . 2]" 1
637 1 71 VAL H 1 72 LEU H . . 4.910 4.241 3.751 4.476 . 0 0 "[ . 1 . 2]" 1
638 1 71 VAL HA 1 71 VAL MG1 . . 3.460 2.745 2.196 3.305 . 0 0 "[ . 1 . 2]" 1
639 1 71 VAL HA 1 71 VAL MG2 . . 3.460 2.605 2.222 3.272 . 0 0 "[ . 1 . 2]" 1
640 1 71 VAL HA 1 72 LEU H . . 3.160 2.210 2.065 2.365 . 0 0 "[ . 1 . 2]" 1
641 1 71 VAL HA 1 81 VAL H . . 5.140 4.512 4.107 4.873 . 0 0 "[ . 1 . 2]" 1
642 1 71 VAL HA 1 81 VAL MG1 . . 4.720 4.393 3.969 4.791 0.071 20 0 "[ . 1 . 2]" 1
643 1 71 VAL HA 1 82 LYS HA . . 3.900 2.428 2.068 2.874 . 0 0 "[ . 1 . 2]" 1
644 1 71 VAL HA 1 82 LYS QG . . 4.730 3.657 2.643 4.792 0.062 10 0 "[ . 1 . 2]" 1
645 1 71 VAL HA 1 83 CYS H . . 4.130 3.543 3.004 4.147 0.017 7 0 "[ . 1 . 2]" 1
646 1 71 VAL HB 1 72 LEU H . . 4.400 3.923 2.601 4.437 0.037 7 0 "[ . 1 . 2]" 1
647 1 71 VAL QG 1 72 LEU H . . 3.860 2.829 2.250 3.525 . 0 0 "[ . 1 . 2]" 1
648 1 71 VAL QG 1 72 LEU HA . . 4.600 3.823 3.442 4.262 . 0 0 "[ . 1 . 2]" 1
649 1 71 VAL QG 1 81 VAL H . . 4.680 3.632 2.986 4.782 0.102 18 0 "[ . 1 . 2]" 1
650 1 71 VAL QG 1 82 LYS HA . . 4.080 2.867 2.141 3.402 . 0 0 "[ . 1 . 2]" 1
651 1 71 VAL QG 1 82 LYS QB . . 3.900 2.924 1.864 3.943 0.043 8 0 "[ . 1 . 2]" 1
652 1 71 VAL QG 1 82 LYS QD . . 3.940 3.088 1.872 3.953 0.013 16 0 "[ . 1 . 2]" 1
653 1 71 VAL QG 1 82 LYS QG . . 3.140 2.428 1.863 3.268 0.128 6 0 "[ . 1 . 2]" 1
654 1 71 VAL QG 1 83 CYS H . . 4.770 4.201 3.282 4.849 0.079 20 0 "[ . 1 . 2]" 1
655 1 71 VAL MG1 1 72 LEU H . . 4.400 3.611 2.584 4.279 . 0 0 "[ . 1 . 2]" 1
656 1 71 VAL MG2 1 72 LEU H . . 4.400 3.391 2.270 4.446 0.046 7 0 "[ . 1 . 2]" 1
657 1 72 LEU H 1 72 LEU HB2 . . 3.950 3.037 2.621 3.417 . 0 0 "[ . 1 . 2]" 1
658 1 72 LEU H 1 72 LEU QB . . 3.460 2.515 2.310 2.705 . 0 0 "[ . 1 . 2]" 1
659 1 72 LEU H 1 72 LEU HB3 . . 3.950 2.706 2.566 3.115 . 0 0 "[ . 1 . 2]" 1
660 1 72 LEU H 1 73 LYS H . . 5.000 4.409 4.268 4.642 . 0 0 "[ . 1 . 2]" 1
661 1 72 LEU H 1 80 VAL HA . . 5.470 4.686 4.313 5.141 . 0 0 "[ . 1 . 2]" 1
662 1 72 LEU H 1 80 VAL MG1 . . 4.770 3.706 3.280 4.133 . 0 0 "[ . 1 . 2]" 1
663 1 72 LEU H 1 81 VAL H . . 3.880 3.031 2.711 3.487 . 0 0 "[ . 1 . 2]" 1
664 1 72 LEU H 1 81 VAL MG1 . . 3.900 3.294 2.961 3.705 . 0 0 "[ . 1 . 2]" 1
665 1 72 LEU H 1 82 LYS HA . . 4.200 3.702 3.157 4.209 0.009 4 0 "[ . 1 . 2]" 1
666 1 72 LEU H 1 83 CYS H . . 4.840 4.841 4.350 4.906 0.066 2 0 "[ . 1 . 2]" 1
667 1 72 LEU H 1 96 ALA MB . . 4.430 3.687 3.093 4.258 . 0 0 "[ . 1 . 2]" 1
668 1 72 LEU HA 1 72 LEU MD1 . . 3.280 2.237 2.085 2.540 . 0 0 "[ . 1 . 2]" 1
669 1 72 LEU HA 1 72 LEU MD2 . . 4.360 3.835 2.707 3.986 . 0 0 "[ . 1 . 2]" 1
670 1 72 LEU HA 1 73 LYS H . . 3.180 2.300 2.195 2.395 . 0 0 "[ . 1 . 2]" 1
671 1 72 LEU QB 1 73 LYS H . . 4.250 3.585 3.377 3.668 . 0 0 "[ . 1 . 2]" 1
672 1 72 LEU QB 1 96 ALA MB . . 3.750 2.242 2.033 2.618 . 0 0 "[ . 1 . 2]" 1
673 1 72 LEU HB2 1 73 LYS H . . 5.050 4.197 3.922 4.331 . 0 0 "[ . 1 . 2]" 1
674 1 72 LEU HB2 1 96 ALA MB . . 4.510 2.493 2.104 3.562 . 0 0 "[ . 1 . 2]" 1
675 1 72 LEU HB3 1 73 LYS H . . 5.050 3.905 3.527 4.091 . 0 0 "[ . 1 . 2]" 1
676 1 72 LEU HB3 1 96 ALA MB . . 4.510 2.680 2.262 3.242 . 0 0 "[ . 1 . 2]" 1
677 1 72 LEU MD1 1 73 LYS H . . 3.770 2.625 1.893 3.291 . 0 0 "[ . 1 . 2]" 1
678 1 72 LEU MD1 1 97 ARG HA . . 4.750 4.191 3.773 4.521 . 0 0 "[ . 1 . 2]" 1
679 1 72 LEU MD1 1 97 ARG QD . . 5.340 4.518 2.649 5.430 0.090 2 0 "[ . 1 . 2]" 1
680 1 72 LEU MD1 1 97 ARG HG2 . . 5.150 4.395 3.283 5.233 0.083 12 0 "[ . 1 . 2]" 1
681 1 72 LEU MD1 1 97 ARG QG . . 4.420 3.496 2.902 4.278 . 0 0 "[ . 1 . 2]" 1
682 1 72 LEU MD1 1 97 ARG HG3 . . 5.150 3.811 3.049 5.234 0.084 20 0 "[ . 1 . 2]" 1
683 1 72 LEU MD2 1 73 LYS H . . 4.110 4.129 3.981 4.198 0.088 3 0 "[ . 1 . 2]" 1
684 1 72 LEU MD2 1 93 ARG HA . . 5.500 4.496 3.504 5.032 . 0 0 "[ . 1 . 2]" 1
685 1 72 LEU MD2 1 96 ALA H . . 5.410 4.647 4.219 5.007 . 0 0 "[ . 1 . 2]" 1
686 1 72 LEU MD2 1 96 ALA HA . . 5.500 4.157 3.829 4.694 . 0 0 "[ . 1 . 2]" 1
687 1 72 LEU MD2 1 96 ALA MB . . 3.410 2.540 2.267 2.858 . 0 0 "[ . 1 . 2]" 1
688 1 72 LEU MD2 1 97 ARG H . . 4.450 3.013 2.717 3.182 . 0 0 "[ . 1 . 2]" 1
689 1 72 LEU MD2 1 97 ARG HA . . 3.650 2.155 1.975 3.131 . 0 0 "[ . 1 . 2]" 1
690 1 72 LEU MD2 1 97 ARG QB . . 3.690 3.018 2.175 3.517 . 0 0 "[ . 1 . 2]" 1
691 1 72 LEU MD2 1 97 ARG HG2 . . 4.350 3.120 2.106 4.383 0.033 11 0 "[ . 1 . 2]" 1
692 1 72 LEU MD2 1 97 ARG QG . . 3.790 2.473 1.965 3.599 . 0 0 "[ . 1 . 2]" 1
693 1 72 LEU MD2 1 97 ARG HG3 . . 4.350 2.772 2.163 4.123 . 0 0 "[ . 1 . 2]" 1
694 1 72 LEU HG 1 73 LYS H . . 4.270 2.600 2.286 4.072 . 0 0 "[ . 1 . 2]" 1
695 1 73 LYS H 1 73 LYS QB . . 3.570 2.836 2.440 3.161 . 0 0 "[ . 1 . 2]" 1
696 1 73 LYS H 1 73 LYS QD . . 4.730 4.016 3.758 4.411 . 0 0 "[ . 1 . 2]" 1
697 1 73 LYS H 1 73 LYS QG . . 4.860 3.339 2.366 4.299 . 0 0 "[ . 1 . 2]" 1
698 1 73 LYS HA 1 74 HIS H . . 3.240 2.246 2.141 2.356 . 0 0 "[ . 1 . 2]" 1
699 1 73 LYS HA 1 80 VAL HA . . 3.840 2.279 2.117 2.501 . 0 0 "[ . 1 . 2]" 1
700 1 73 LYS HA 1 80 VAL HB . . 5.500 5.114 4.712 5.463 . 0 0 "[ . 1 . 2]" 1
701 1 73 LYS HA 1 80 VAL MG1 . . 4.130 3.452 3.063 4.178 0.048 15 0 "[ . 1 . 2]" 1
702 1 73 LYS HA 1 80 VAL MG2 . . 3.690 3.251 2.483 3.778 0.088 4 0 "[ . 1 . 2]" 1
703 1 73 LYS HA 1 81 VAL H . . 4.050 3.631 3.315 3.877 . 0 0 "[ . 1 . 2]" 1
704 1 73 LYS HA 1 100 LEU MD1 . . 5.010 3.584 2.730 4.460 . 0 0 "[ . 1 . 2]" 1
705 1 73 LYS HA 1 100 LEU MD2 . . 4.710 3.059 2.484 3.726 . 0 0 "[ . 1 . 2]" 1
706 1 73 LYS QB 1 73 LYS QE . . 4.140 3.360 2.296 3.828 . 0 0 "[ . 1 . 2]" 1
707 1 73 LYS QB 1 74 HIS H . . 4.130 3.086 2.466 3.794 . 0 0 "[ . 1 . 2]" 1
708 1 73 LYS QB 1 80 VAL MG1 . . 3.690 2.351 2.171 2.550 . 0 0 "[ . 1 . 2]" 1
709 1 73 LYS QB 1 80 VAL MG2 . . 3.500 2.215 1.915 2.751 . 0 0 "[ . 1 . 2]" 1
710 1 73 LYS QB 1 81 VAL H . . 4.430 4.103 3.397 4.487 0.057 17 0 "[ . 1 . 2]" 1
711 1 73 LYS HB2 1 80 VAL MG2 . . 4.010 2.318 2.082 2.801 . 0 0 "[ . 1 . 2]" 1
712 1 73 LYS HB3 1 80 VAL MG2 . . 4.010 3.043 2.187 4.030 0.020 18 0 "[ . 1 . 2]" 1
713 1 73 LYS QD 1 74 HIS H . . 4.660 3.318 2.604 4.712 0.052 20 0 "[ . 1 . 2]" 1
714 1 73 LYS QD 1 75 VAL HA . . 4.070 2.965 2.476 4.135 0.065 20 0 "[ . 1 . 2]" 1
715 1 73 LYS QD 1 75 VAL MG2 . . 4.090 2.723 2.070 3.478 . 0 0 "[ . 1 . 2]" 1
716 1 73 LYS QD 1 78 GLY QA . . 5.180 3.853 2.469 4.745 . 0 0 "[ . 1 . 2]" 1
717 1 73 LYS QD 1 80 VAL MG2 . . 4.010 3.766 2.290 4.089 0.079 5 0 "[ . 1 . 2]" 1
718 1 73 LYS HD2 1 75 VAL HA . . 4.770 3.716 2.830 4.827 0.057 20 0 "[ . 1 . 2]" 1
719 1 73 LYS HD2 1 75 VAL MG2 . . 4.800 3.166 2.123 4.534 . 0 0 "[ . 1 . 2]" 1
720 1 73 LYS HD3 1 75 VAL HA . . 4.770 3.270 2.730 4.496 . 0 0 "[ . 1 . 2]" 1
721 1 73 LYS HD3 1 75 VAL MG2 . . 4.800 3.299 2.602 4.703 . 0 0 "[ . 1 . 2]" 1
722 1 73 LYS QE 1 73 LYS QG . . 3.490 2.352 2.078 2.680 . 0 0 "[ . 1 . 2]" 1
723 1 73 LYS QE 1 75 VAL H . . 5.320 4.343 3.362 5.192 . 0 0 "[ . 1 . 2]" 1
724 1 73 LYS QE 1 75 VAL HA . . 3.830 2.347 1.839 2.984 . 0 0 "[ . 1 . 2]" 1
725 1 73 LYS QE 1 75 VAL MG1 . . 5.050 3.728 3.164 4.761 . 0 0 "[ . 1 . 2]" 1
726 1 73 LYS QE 1 75 VAL MG2 . . 4.020 2.819 2.024 3.714 . 0 0 "[ . 1 . 2]" 1
727 1 73 LYS QE 1 78 GLY H . . 4.740 4.125 3.162 4.673 . 0 0 "[ . 1 . 2]" 1
728 1 73 LYS QE 1 78 GLY HA2 . . 4.540 3.006 2.274 3.405 . 0 0 "[ . 1 . 2]" 1
729 1 73 LYS QE 1 78 GLY QA . . 3.940 2.959 2.254 3.322 . 0 0 "[ . 1 . 2]" 1
730 1 73 LYS QE 1 78 GLY HA3 . . 4.540 4.468 3.705 4.617 0.077 4 0 "[ . 1 . 2]" 1
731 1 73 LYS QE 1 80 VAL MG2 . . 3.800 3.727 3.011 3.902 0.102 19 0 "[ . 1 . 2]" 1
732 1 73 LYS QG 1 74 HIS H . . 4.020 3.342 2.084 4.098 0.078 8 0 "[ . 1 . 2]" 1
733 1 73 LYS QG 1 75 VAL HA . . 4.740 4.466 3.978 4.802 0.062 11 0 "[ . 1 . 2]" 1
734 1 73 LYS HG2 1 75 VAL HA . . 5.500 5.030 4.257 5.558 0.058 20 0 "[ . 1 . 2]" 1
735 1 73 LYS HG3 1 75 VAL HA . . 5.500 5.167 4.074 5.542 0.042 12 0 "[ . 1 . 2]" 1
736 1 74 HIS H 1 74 HIS HB2 . . 3.780 2.556 2.342 2.765 . 0 0 "[ . 1 . 2]" 1
737 1 74 HIS H 1 74 HIS HB3 . . 3.780 2.874 2.754 3.002 . 0 0 "[ . 1 . 2]" 1
738 1 74 HIS H 1 79 ILE H . . 4.720 3.583 3.195 3.952 . 0 0 "[ . 1 . 2]" 1
739 1 74 HIS H 1 79 ILE HB . . 5.160 3.627 3.168 4.025 . 0 0 "[ . 1 . 2]" 1
740 1 74 HIS H 1 79 ILE MG . . 4.750 4.421 4.095 4.689 . 0 0 "[ . 1 . 2]" 1
741 1 74 HIS H 1 80 VAL HA . . 3.860 3.731 3.431 3.898 0.038 16 0 "[ . 1 . 2]" 1
742 1 74 HIS H 1 81 VAL H . . 5.500 5.519 5.191 5.568 0.068 1 0 "[ . 1 . 2]" 1
743 1 74 HIS H 1 100 LEU MD1 . . 3.700 3.228 2.480 3.768 0.068 14 0 "[ . 1 . 2]" 1
744 1 74 HIS H 1 100 LEU MD2 . . 3.970 3.149 2.811 3.537 . 0 0 "[ . 1 . 2]" 1
745 1 74 HIS HA 1 74 HIS HD2 . . 4.260 2.581 2.258 3.102 . 0 0 "[ . 1 . 2]" 1
746 1 74 HIS HA 1 75 VAL H . . 3.350 2.281 2.208 2.392 . 0 0 "[ . 1 . 2]" 1
747 1 74 HIS HA 1 75 VAL MG2 . . 4.330 3.841 3.586 4.071 . 0 0 "[ . 1 . 2]" 1
748 1 74 HIS HA 1 100 LEU MD2 . . 4.430 3.175 2.651 4.494 0.064 5 0 "[ . 1 . 2]" 1
749 1 74 HIS QB 1 77 SER QB . . 4.640 2.228 1.926 3.716 . 0 0 "[ . 1 . 2]" 1
750 1 74 HIS QB 1 78 GLY H . . 4.330 3.114 2.798 3.292 . 0 0 "[ . 1 . 2]" 1
751 1 74 HIS QB 1 79 ILE H . . 3.740 2.795 2.412 3.288 . 0 0 "[ . 1 . 2]" 1
752 1 74 HIS QB 1 79 ILE HB . . 4.100 2.807 2.441 3.498 . 0 0 "[ . 1 . 2]" 1
753 1 74 HIS QB 1 100 LEU MD1 . . 3.530 2.228 1.995 2.479 . 0 0 "[ . 1 . 2]" 1
754 1 74 HIS QB 1 100 LEU MD2 . . 3.630 2.427 2.132 3.422 . 0 0 "[ . 1 . 2]" 1
755 1 74 HIS QB 1 104 VAL MG1 . . 4.760 4.113 3.467 4.815 0.055 3 0 "[ . 1 . 2]" 1
756 1 74 HIS QB 1 104 VAL MG2 . . 3.530 2.635 2.160 3.185 . 0 0 "[ . 1 . 2]" 1
757 1 74 HIS HB2 1 77 SER H . . 4.510 4.505 4.380 4.566 0.056 17 0 "[ . 1 . 2]" 1
758 1 74 HIS HB2 1 78 GLY H . . 4.940 4.793 4.505 4.981 0.041 20 0 "[ . 1 . 2]" 1
759 1 74 HIS HB2 1 79 ILE H . . 4.330 3.836 3.368 4.391 0.061 11 0 "[ . 1 . 2]" 1
760 1 74 HIS HB2 1 79 ILE HB . . 4.860 3.053 2.566 3.921 . 0 0 "[ . 1 . 2]" 1
761 1 74 HIS HB2 1 100 LEU MD1 . . 4.410 2.251 2.018 2.510 . 0 0 "[ . 1 . 2]" 1
762 1 74 HIS HB2 1 104 VAL MG2 . . 4.060 2.793 2.239 3.431 . 0 0 "[ . 1 . 2]" 1
763 1 74 HIS HB3 1 77 SER H . . 4.510 2.825 2.675 2.979 . 0 0 "[ . 1 . 2]" 1
764 1 74 HIS HB3 1 78 GLY H . . 4.940 3.155 2.825 3.340 . 0 0 "[ . 1 . 2]" 1
765 1 74 HIS HB3 1 79 ILE H . . 4.330 2.873 2.462 3.401 . 0 0 "[ . 1 . 2]" 1
766 1 74 HIS HB3 1 79 ILE HB . . 4.860 3.312 3.027 3.932 . 0 0 "[ . 1 . 2]" 1
767 1 74 HIS HB3 1 100 LEU MD1 . . 4.410 3.580 3.134 3.841 . 0 0 "[ . 1 . 2]" 1
768 1 74 HIS HB3 1 104 VAL MG2 . . 4.060 3.262 2.841 3.803 . 0 0 "[ . 1 . 2]" 1
769 1 74 HIS HD1 1 76 PRO HA . . 5.410 5.248 5.030 5.382 . 0 0 "[ . 1 . 2]" 1
770 1 74 HIS HD1 1 76 PRO HB2 . . 4.490 4.182 3.996 4.350 . 0 0 "[ . 1 . 2]" 1
771 1 74 HIS HD1 1 76 PRO HB3 . . 5.100 5.132 4.926 5.165 0.065 11 0 "[ . 1 . 2]" 1
772 1 74 HIS HD1 1 77 SER H . . 3.220 2.579 2.169 2.741 . 0 0 "[ . 1 . 2]" 1
773 1 74 HIS HD1 1 77 SER HB2 . . 4.040 2.441 1.948 4.067 0.027 3 0 "[ . 1 . 2]" 1
774 1 74 HIS HD1 1 77 SER QB . . 3.550 2.333 1.889 3.154 . 0 0 "[ . 1 . 2]" 1
775 1 74 HIS HD1 1 77 SER HB3 . . 4.040 3.276 2.233 3.852 . 0 0 "[ . 1 . 2]" 1
776 1 74 HIS HD1 1 78 GLY H . . 4.330 4.335 3.944 4.390 0.060 20 0 "[ . 1 . 2]" 1
777 1 74 HIS HD1 1 104 VAL MG1 . . 4.370 3.202 2.687 3.862 . 0 0 "[ . 1 . 2]" 1
778 1 74 HIS HD1 1 104 VAL MG2 . . 4.160 3.108 2.759 3.790 . 0 0 "[ . 1 . 2]" 1
779 1 74 HIS HD1 1 108 TYR QE . . 4.620 3.669 2.919 4.520 . 0 0 "[ . 1 . 2]" 1
780 1 74 HIS HD2 1 75 VAL H . . 5.140 4.247 3.714 5.032 . 0 0 "[ . 1 . 2]" 1
781 1 74 HIS HD2 1 100 LEU MD1 . . 4.130 3.842 2.390 4.213 0.083 2 0 "[ . 1 . 2]" 1
782 1 74 HIS HD2 1 100 LEU MD2 . . 4.880 2.745 2.133 4.606 . 0 0 "[ . 1 . 2]" 1
783 1 74 HIS HD2 1 104 VAL MG1 . . 5.490 4.422 3.675 5.278 . 0 0 "[ . 1 . 2]" 1
784 1 74 HIS HE1 1 76 PRO HB2 . . 5.320 4.706 4.407 5.378 0.058 17 0 "[ . 1 . 2]" 1
785 1 74 HIS HE1 1 76 PRO HG2 . . 3.930 2.777 2.545 3.177 . 0 0 "[ . 1 . 2]" 1
786 1 74 HIS HE1 1 76 PRO HG3 . . 4.680 3.334 3.016 3.761 . 0 0 "[ . 1 . 2]" 1
787 1 74 HIS HE1 1 77 SER H . . 5.020 4.796 4.259 5.010 . 0 0 "[ . 1 . 2]" 1
788 1 74 HIS HE1 1 104 VAL MG1 . . 4.560 2.743 2.175 3.338 . 0 0 "[ . 1 . 2]" 1
789 1 74 HIS HE1 1 104 VAL MG2 . . 4.650 3.643 2.870 4.404 . 0 0 "[ . 1 . 2]" 1
790 1 74 HIS HE1 1 108 TYR QE . . 5.070 3.588 2.231 4.950 . 0 0 "[ . 1 . 2]" 1
791 1 75 VAL H 1 75 VAL HB . . 3.450 2.336 2.160 2.471 . 0 0 "[ . 1 . 2]" 1
792 1 75 VAL H 1 75 VAL MG2 . . 3.080 2.357 2.221 2.480 . 0 0 "[ . 1 . 2]" 1
793 1 75 VAL H 1 76 PRO QD . . 3.930 2.245 2.158 2.345 . 0 0 "[ . 1 . 2]" 1
794 1 75 VAL H 1 76 PRO HG2 . . 4.350 4.403 4.372 4.416 0.066 7 0 "[ . 1 . 2]" 1
795 1 75 VAL H 1 77 SER H . . 4.960 4.098 3.939 4.293 . 0 0 "[ . 1 . 2]" 1
796 1 75 VAL HA 1 75 VAL MG1 . . 3.300 2.523 2.414 2.697 . 0 0 "[ . 1 . 2]" 1
797 1 75 VAL HA 1 75 VAL MG2 . . 3.100 2.294 2.206 2.350 . 0 0 "[ . 1 . 2]" 1
798 1 75 VAL HA 1 78 GLY H . . 4.690 3.679 3.458 3.912 . 0 0 "[ . 1 . 2]" 1
799 1 75 VAL HB 1 76 PRO QD . . 3.680 2.117 2.013 2.243 . 0 0 "[ . 1 . 2]" 1
800 1 75 VAL HB 1 77 SER H . . 5.040 4.955 4.814 5.090 0.050 5 0 "[ . 1 . 2]" 1
801 1 75 VAL MG1 1 76 PRO HA . . 3.940 3.268 3.063 3.435 . 0 0 "[ . 1 . 2]" 1
802 1 75 VAL MG1 1 76 PRO HB2 . . 5.020 5.044 4.874 5.099 0.079 2 0 "[ . 1 . 2]" 1
803 1 75 VAL MG1 1 76 PRO QD . . 3.890 2.552 2.218 2.788 . 0 0 "[ . 1 . 2]" 1
804 1 75 VAL MG1 1 76 PRO HG2 . . 5.240 4.882 4.652 5.044 . 0 0 "[ . 1 . 2]" 1
805 1 75 VAL MG1 1 77 SER H . . 4.630 4.693 4.627 4.720 0.090 1 0 "[ . 1 . 2]" 1
806 1 76 PRO HB2 1 77 SER H . . 4.210 3.791 3.232 4.042 . 0 0 "[ . 1 . 2]" 1
807 1 76 PRO QD 1 77 SER H . . 4.580 3.103 2.867 3.268 . 0 0 "[ . 1 . 2]" 1
808 1 76 PRO HG2 1 77 SER H . . 3.750 2.769 2.338 2.949 . 0 0 "[ . 1 . 2]" 1
809 1 76 PRO HG2 1 78 GLY H . . 4.760 4.816 4.796 4.826 0.066 16 0 "[ . 1 . 2]" 1
810 1 76 PRO HG3 1 77 SER H . . 4.450 4.354 3.930 4.482 0.032 11 0 "[ . 1 . 2]" 1
811 1 77 SER H 1 77 SER HB2 . . 3.930 2.812 2.399 3.767 . 0 0 "[ . 1 . 2]" 1
812 1 77 SER H 1 77 SER QB . . 3.420 2.626 2.318 3.056 . 0 0 "[ . 1 . 2]" 1
813 1 77 SER H 1 77 SER HB3 . . 3.930 3.392 2.591 3.906 . 0 0 "[ . 1 . 2]" 1
814 1 77 SER H 1 78 GLY H . . 3.150 2.083 1.909 2.562 . 0 0 "[ . 1 . 2]" 1
815 1 77 SER H 1 78 GLY HA2 . . 5.130 4.304 4.087 4.817 . 0 0 "[ . 1 . 2]" 1
816 1 77 SER H 1 78 GLY QA . . 4.490 4.009 3.838 4.425 . 0 0 "[ . 1 . 2]" 1
817 1 77 SER H 1 78 GLY HA3 . . 5.130 4.786 4.621 5.160 0.030 1 0 "[ . 1 . 2]" 1
818 1 77 SER H 1 79 ILE H . . 4.420 4.000 3.703 4.398 . 0 0 "[ . 1 . 2]" 1
819 1 77 SER HA 1 79 ILE MD . . 5.140 4.652 4.247 5.159 0.019 13 0 "[ . 1 . 2]" 1
820 1 77 SER QB 1 79 ILE MD . . 3.830 2.740 2.070 3.405 . 0 0 "[ . 1 . 2]" 1
821 1 77 SER QB 1 79 ILE HG12 . . 4.540 3.968 3.297 4.605 0.065 18 0 "[ . 1 . 2]" 1
822 1 77 SER QB 1 79 ILE HG13 . . 4.230 2.511 2.110 3.045 . 0 0 "[ . 1 . 2]" 1
823 1 77 SER QB 1 108 TYR QE . . 4.390 3.505 2.259 4.470 0.080 13 0 "[ . 1 . 2]" 1
824 1 77 SER HB2 1 78 GLY H . . 4.460 3.717 3.137 4.198 . 0 0 "[ . 1 . 2]" 1
825 1 77 SER HB2 1 79 ILE H . . 4.280 3.372 2.608 4.345 0.065 20 0 "[ . 1 . 2]" 1
826 1 77 SER HB2 1 79 ILE MD . . 4.680 3.326 2.333 4.268 . 0 0 "[ . 1 . 2]" 1
827 1 77 SER HB2 1 79 ILE HG13 . . 4.940 3.236 2.145 4.319 . 0 0 "[ . 1 . 2]" 1
828 1 77 SER HB3 1 78 GLY H . . 4.460 3.937 3.181 4.481 0.021 3 0 "[ . 1 . 2]" 1
829 1 77 SER HB3 1 79 ILE H . . 4.280 3.266 2.585 4.351 0.071 3 0 "[ . 1 . 2]" 1
830 1 77 SER HB3 1 79 ILE MD . . 4.680 2.967 2.314 3.579 . 0 0 "[ . 1 . 2]" 1
831 1 77 SER HB3 1 79 ILE HG13 . . 4.940 2.760 2.275 3.720 . 0 0 "[ . 1 . 2]" 1
832 1 78 GLY H 1 79 ILE H . . 3.480 2.934 2.617 3.135 . 0 0 "[ . 1 . 2]" 1
833 1 78 GLY H 1 79 ILE HB . . 5.310 5.140 4.789 5.352 0.042 5 0 "[ . 1 . 2]" 1
834 1 78 GLY H 1 79 ILE HG13 . . 4.750 4.535 4.318 4.807 0.057 7 0 "[ . 1 . 2]" 1
835 1 79 ILE H 1 79 ILE HB . . 3.270 2.535 2.349 2.684 . 0 0 "[ . 1 . 2]" 1
836 1 79 ILE H 1 79 ILE MD . . 3.900 3.575 3.180 3.840 . 0 0 "[ . 1 . 2]" 1
837 1 79 ILE H 1 79 ILE HG12 . . 3.680 3.350 3.005 3.726 0.046 2 0 "[ . 1 . 2]" 1
838 1 79 ILE H 1 79 ILE HG13 . . 3.470 2.120 1.823 2.576 . 0 0 "[ . 1 . 2]" 1
839 1 79 ILE H 1 79 ILE MG . . 3.950 3.788 3.743 3.833 . 0 0 "[ . 1 . 2]" 1
840 1 79 ILE H 1 80 VAL H . . 4.620 4.605 4.462 4.677 0.057 20 0 "[ . 1 . 2]" 1
841 1 79 ILE HA 1 79 ILE MD . . 4.080 3.905 3.742 4.035 . 0 0 "[ . 1 . 2]" 1
842 1 79 ILE HA 1 79 ILE HG12 . . 3.540 2.628 2.319 2.981 . 0 0 "[ . 1 . 2]" 1
843 1 79 ILE HA 1 79 ILE HG13 . . 3.930 3.101 2.931 3.310 . 0 0 "[ . 1 . 2]" 1
844 1 79 ILE HA 1 79 ILE MG . . 3.500 2.445 2.285 2.567 . 0 0 "[ . 1 . 2]" 1
845 1 79 ILE HA 1 80 VAL H . . 2.970 2.236 2.172 2.320 . 0 0 "[ . 1 . 2]" 1
846 1 79 ILE HA 1 80 VAL HB . . 4.850 4.671 4.440 4.823 . 0 0 "[ . 1 . 2]" 1
847 1 79 ILE HA 1 80 VAL MG2 . . 4.080 3.520 3.389 3.833 . 0 0 "[ . 1 . 2]" 1
848 1 79 ILE HB 1 79 ILE MD . . 3.350 2.403 2.224 2.612 . 0 0 "[ . 1 . 2]" 1
849 1 79 ILE HB 1 80 VAL H . . 4.390 4.124 3.822 4.440 0.050 4 0 "[ . 1 . 2]" 1
850 1 79 ILE HB 1 100 LEU MD1 . . 4.290 2.475 2.182 3.084 . 0 0 "[ . 1 . 2]" 1
851 1 79 ILE MD 1 80 VAL H . . 5.460 5.123 4.765 5.412 . 0 0 "[ . 1 . 2]" 1
852 1 79 ILE MD 1 103 LYS HA . . 5.350 3.844 3.472 4.178 . 0 0 "[ . 1 . 2]" 1
853 1 79 ILE MD 1 103 LYS QB . . 3.660 2.233 2.028 2.715 . 0 0 "[ . 1 . 2]" 1
854 1 79 ILE MD 1 103 LYS QG . . 4.540 4.083 3.698 4.604 0.064 4 0 "[ . 1 . 2]" 1
855 1 79 ILE MD 1 104 VAL H . . 4.590 3.535 3.075 4.461 . 0 0 "[ . 1 . 2]" 1
856 1 79 ILE MD 1 104 VAL HA . . 3.630 2.484 2.115 3.590 . 0 0 "[ . 1 . 2]" 1
857 1 79 ILE MD 1 107 PHE H . . 4.130 3.919 3.694 4.141 0.011 11 0 "[ . 1 . 2]" 1
858 1 79 ILE MD 1 107 PHE HA . . 4.370 4.256 3.614 4.429 0.059 13 0 "[ . 1 . 2]" 1
859 1 79 ILE MD 1 107 PHE HB2 . . 3.450 2.240 2.077 2.458 . 0 0 "[ . 1 . 2]" 1
860 1 79 ILE MD 1 107 PHE HB3 . . 4.150 2.960 2.508 3.528 . 0 0 "[ . 1 . 2]" 1
861 1 79 ILE MD 1 107 PHE QD . . 3.940 2.648 2.067 3.120 . 0 0 "[ . 1 . 2]" 1
862 1 79 ILE MD 1 107 PHE QE . . 4.840 3.976 3.558 4.739 . 0 0 "[ . 1 . 2]" 1
863 1 79 ILE MD 1 108 TYR H . . 5.440 5.234 4.741 5.515 0.075 7 0 "[ . 1 . 2]" 1
864 1 79 ILE HG12 1 80 VAL H . . 4.880 4.509 4.112 4.760 . 0 0 "[ . 1 . 2]" 1
865 1 79 ILE HG13 1 79 ILE MG . . 3.750 3.231 3.209 3.252 . 0 0 "[ . 1 . 2]" 1
866 1 79 ILE HG13 1 80 VAL H . . 5.170 5.130 5.018 5.221 0.051 5 0 "[ . 1 . 2]" 1
867 1 79 ILE MG 1 80 VAL H . . 3.250 2.600 2.251 3.113 . 0 0 "[ . 1 . 2]" 1
868 1 79 ILE MG 1 80 VAL HA . . 4.730 3.734 3.557 3.924 . 0 0 "[ . 1 . 2]" 1
869 1 79 ILE MG 1 100 LEU HA . . 4.470 3.924 3.526 4.534 0.064 11 0 "[ . 1 . 2]" 1
870 1 79 ILE MG 1 103 LYS H . . 5.090 4.781 4.398 5.112 0.022 7 0 "[ . 1 . 2]" 1
871 1 79 ILE MG 1 103 LYS HA . . 4.590 4.454 4.053 4.662 0.072 4 0 "[ . 1 . 2]" 1
872 1 79 ILE MG 1 103 LYS QB . . 3.440 2.143 1.957 2.413 . 0 0 "[ . 1 . 2]" 1
873 1 79 ILE MG 1 103 LYS QD . . 3.630 2.585 2.088 3.699 0.069 2 0 "[ . 1 . 2]" 1
874 1 79 ILE MG 1 103 LYS QE . . 4.180 3.634 2.189 4.223 0.043 2 0 "[ . 1 . 2]" 1
875 1 79 ILE MG 1 103 LYS HG2 . . 4.860 4.085 3.832 4.742 . 0 0 "[ . 1 . 2]" 1
876 1 79 ILE MG 1 103 LYS HG3 . . 4.860 3.696 2.570 4.646 . 0 0 "[ . 1 . 2]" 1
877 1 80 VAL H 1 80 VAL HB . . 3.330 2.701 2.427 2.844 . 0 0 "[ . 1 . 2]" 1
878 1 80 VAL H 1 80 VAL MG1 . . 4.120 3.906 3.773 3.956 . 0 0 "[ . 1 . 2]" 1
879 1 80 VAL H 1 80 VAL MG2 . . 3.370 2.709 2.496 2.863 . 0 0 "[ . 1 . 2]" 1
880 1 80 VAL H 1 81 VAL H . . 4.800 4.409 4.274 4.551 . 0 0 "[ . 1 . 2]" 1
881 1 80 VAL HA 1 80 VAL MG1 . . 3.450 2.367 2.299 2.496 . 0 0 "[ . 1 . 2]" 1
882 1 80 VAL HA 1 80 VAL MG2 . . 3.430 2.531 2.427 2.598 . 0 0 "[ . 1 . 2]" 1
883 1 80 VAL HA 1 81 VAL H . . 3.120 2.271 2.213 2.384 . 0 0 "[ . 1 . 2]" 1
884 1 80 VAL HA 1 81 VAL HB . . 4.960 4.363 4.243 4.515 . 0 0 "[ . 1 . 2]" 1
885 1 80 VAL HA 1 81 VAL MG1 . . 4.290 3.919 3.659 4.279 . 0 0 "[ . 1 . 2]" 1
886 1 80 VAL HB 1 81 VAL H . . 4.750 3.950 3.761 4.356 . 0 0 "[ . 1 . 2]" 1
887 1 80 VAL MG1 1 81 VAL H . . 3.290 2.448 2.239 2.858 . 0 0 "[ . 1 . 2]" 1
888 1 80 VAL MG2 1 81 VAL H . . 4.110 4.144 4.033 4.191 0.081 16 0 "[ . 1 . 2]" 1
889 1 81 VAL H 1 81 VAL HB . . 3.680 3.266 3.083 3.348 . 0 0 "[ . 1 . 2]" 1
890 1 81 VAL H 1 81 VAL MG1 . . 3.430 2.562 2.439 2.724 . 0 0 "[ . 1 . 2]" 1
891 1 81 VAL H 1 82 LYS H . . 4.620 4.346 4.238 4.427 . 0 0 "[ . 1 . 2]" 1
892 1 81 VAL H 1 96 ALA MB . . 5.500 5.304 4.788 5.561 0.061 15 0 "[ . 1 . 2]" 1
893 1 81 VAL HA 1 81 VAL MG1 . . 3.350 3.257 3.222 3.285 . 0 0 "[ . 1 . 2]" 1
894 1 81 VAL HA 1 82 LYS H . . 3.000 2.263 2.128 2.377 . 0 0 "[ . 1 . 2]" 1
895 1 81 VAL HA 1 82 LYS QB . . 4.530 4.304 3.782 4.603 0.073 6 0 "[ . 1 . 2]" 1
896 1 81 VAL HB 1 82 LYS H . . 4.080 4.103 3.975 4.142 0.062 9 0 "[ . 1 . 2]" 1
897 1 81 VAL MG1 1 82 LYS H . . 3.670 3.616 3.159 3.746 0.076 6 0 "[ . 1 . 2]" 1
898 1 81 VAL MG1 1 82 LYS HA . . 4.810 4.024 3.578 4.316 . 0 0 "[ . 1 . 2]" 1
899 1 81 VAL MG1 1 83 CYS H . . 4.520 4.373 3.916 4.606 0.086 7 0 "[ . 1 . 2]" 1
900 1 81 VAL MG1 1 83 CYS QB . . 4.020 3.929 3.268 4.134 0.114 18 0 "[ . 1 . 2]" 1
901 1 81 VAL MG1 1 96 ALA HA . . 3.810 3.270 2.617 3.865 0.055 16 0 "[ . 1 . 2]" 1
902 1 81 VAL MG1 1 96 ALA MB . . 3.090 2.951 2.338 3.211 0.121 16 0 "[ . 1 . 2]" 1
903 1 81 VAL MG1 1 99 VAL MG1 . . 2.480 2.170 1.991 2.490 0.010 16 0 "[ . 1 . 2]" 1
904 1 81 VAL MG1 1 100 LEU H . . 3.640 3.352 2.993 3.717 0.077 16 0 "[ . 1 . 2]" 1
905 1 81 VAL MG1 1 100 LEU HA . . 3.440 2.962 2.542 3.506 0.066 19 0 "[ . 1 . 2]" 1
906 1 81 VAL MG1 1 100 LEU QB . . 3.280 2.444 2.113 3.196 . 0 0 "[ . 1 . 2]" 1
907 1 81 VAL MG1 1 103 LYS HE2 . . 4.210 3.985 3.157 4.273 0.063 11 0 "[ . 1 . 2]" 1
908 1 81 VAL MG1 1 103 LYS QE . . 3.540 3.540 2.905 3.643 0.103 17 0 "[ . 1 . 2]" 1
909 1 81 VAL MG1 1 103 LYS HE3 . . 4.210 3.992 3.394 4.275 0.065 13 0 "[ . 1 . 2]" 1
910 1 81 VAL MG2 1 103 LYS QD . . 4.750 3.632 2.632 4.422 . 0 0 "[ . 1 . 2]" 1
911 1 81 VAL MG2 1 103 LYS QE . . 3.850 2.296 1.908 2.700 . 0 0 "[ . 1 . 2]" 1
912 1 82 LYS H 1 82 LYS HB2 . . 3.880 2.893 2.458 3.872 . 0 0 "[ . 1 . 2]" 1
913 1 82 LYS H 1 82 LYS QB . . 3.380 2.692 2.386 3.245 . 0 0 "[ . 1 . 2]" 1
914 1 82 LYS H 1 82 LYS HB3 . . 3.880 3.601 2.512 3.812 . 0 0 "[ . 1 . 2]" 1
915 1 82 LYS H 1 82 LYS QD . . 4.520 3.731 2.432 4.597 0.077 1 0 "[ . 1 . 2]" 1
916 1 82 LYS H 1 82 LYS HG2 . . 4.750 3.810 2.291 4.604 . 0 0 "[ . 1 . 2]" 1
917 1 82 LYS H 1 82 LYS QG . . 3.990 3.010 2.164 3.973 . 0 0 "[ . 1 . 2]" 1
918 1 82 LYS H 1 82 LYS HG3 . . 4.750 3.321 2.468 4.635 . 0 0 "[ . 1 . 2]" 1
919 1 82 LYS H 1 83 CYS H . . 4.630 4.238 4.057 4.462 . 0 0 "[ . 1 . 2]" 1
920 1 82 LYS HA 1 82 LYS QD . . 4.720 3.949 3.282 4.461 . 0 0 "[ . 1 . 2]" 1
921 1 82 LYS HA 1 83 CYS H . . 3.210 2.189 2.070 2.261 . 0 0 "[ . 1 . 2]" 1
922 1 82 LYS QB 1 82 LYS QE . . 4.470 2.883 2.076 3.761 . 0 0 "[ . 1 . 2]" 1
923 1 82 LYS QB 1 83 CYS H . . 3.940 3.381 2.925 3.955 0.015 5 0 "[ . 1 . 2]" 1
924 1 82 LYS HB2 1 82 LYS QE . . 5.110 3.251 2.096 4.518 . 0 0 "[ . 1 . 2]" 1
925 1 82 LYS HB3 1 82 LYS QE . . 5.110 3.546 2.255 4.319 . 0 0 "[ . 1 . 2]" 1
926 1 82 LYS QE 1 82 LYS HG2 . . 3.680 2.810 2.327 3.552 . 0 0 "[ . 1 . 2]" 1
927 1 82 LYS QE 1 82 LYS QG . . 3.220 2.416 2.081 2.835 . 0 0 "[ . 1 . 2]" 1
928 1 82 LYS QE 1 82 LYS HG3 . . 3.680 2.912 2.254 3.594 . 0 0 "[ . 1 . 2]" 1
929 1 82 LYS QG 1 83 CYS H . . 5.240 4.288 3.114 4.815 . 0 0 "[ . 1 . 2]" 1
930 1 83 CYS H 1 83 CYS QB . . 3.670 2.620 2.342 2.919 . 0 0 "[ . 1 . 2]" 1
931 1 83 CYS H 1 96 ALA MB . . 4.260 3.557 3.106 3.966 . 0 0 "[ . 1 . 2]" 1
932 1 83 CYS H 1 99 VAL MG1 . . 5.500 5.150 4.615 5.528 0.028 3 0 "[ . 1 . 2]" 1
933 1 83 CYS QB 1 95 ILE MG . . 4.230 2.717 2.195 3.679 . 0 0 "[ . 1 . 2]" 1
934 1 83 CYS QB 1 96 ALA H . . 4.120 3.684 2.830 4.173 0.053 7 0 "[ . 1 . 2]" 1
935 1 83 CYS QB 1 96 ALA HA . . 4.320 2.892 2.330 3.284 . 0 0 "[ . 1 . 2]" 1
936 1 83 CYS QB 1 96 ALA MB . . 3.510 2.616 2.139 3.544 0.034 6 0 "[ . 1 . 2]" 1
937 1 84 HIS HA 1 84 HIS HD2 . . 4.320 4.023 2.411 4.385 0.065 9 0 "[ . 1 . 2]" 1
938 1 84 HIS HA 1 86 THR H . . 4.870 4.053 3.452 4.610 . 0 0 "[ . 1 . 2]" 1
939 1 84 HIS HA 1 92 ASN HD21 . . 4.560 3.832 2.804 4.611 0.051 6 0 "[ . 1 . 2]" 1
940 1 84 HIS HA 1 92 ASN QD . . 4.000 3.236 2.290 3.882 . 0 0 "[ . 1 . 2]" 1
941 1 84 HIS HA 1 92 ASN HD22 . . 4.560 3.520 2.346 4.178 . 0 0 "[ . 1 . 2]" 1
942 1 85 GLN H 1 85 GLN HB2 . . 3.720 3.191 2.611 3.795 0.075 13 0 "[ . 1 . 2]" 1
943 1 85 GLN H 1 85 GLN QB . . 3.130 2.688 2.379 2.959 . 0 0 "[ . 1 . 2]" 1
944 1 85 GLN H 1 85 GLN HB3 . . 3.720 2.913 2.585 3.182 . 0 0 "[ . 1 . 2]" 1
945 1 85 GLN H 1 85 GLN HG2 . . 4.960 4.536 3.115 4.715 . 0 0 "[ . 1 . 2]" 1
946 1 85 GLN H 1 85 GLN QG . . 4.330 4.159 3.019 4.322 . 0 0 "[ . 1 . 2]" 1
947 1 85 GLN H 1 85 GLN HG3 . . 4.960 4.852 4.051 5.035 0.075 17 0 "[ . 1 . 2]" 1
948 1 85 GLN H 1 86 THR H . . 3.860 2.108 1.699 2.717 . 0 0 "[ . 1 . 2]" 1
949 1 85 GLN H 1 86 THR MG . . 4.570 4.160 3.354 4.616 0.046 19 0 "[ . 1 . 2]" 1
950 1 85 GLN H 1 92 ASN QD . . 5.000 3.015 2.259 3.727 . 0 0 "[ . 1 . 2]" 1
951 1 85 GLN H 1 95 ILE MD . . 4.470 3.821 3.100 4.530 0.060 15 0 "[ . 1 . 2]" 1
952 1 85 GLN HA 1 85 GLN HG2 . . 3.950 2.720 2.252 3.893 . 0 0 "[ . 1 . 2]" 1
953 1 85 GLN HA 1 85 GLN QG . . 3.400 2.429 2.222 3.289 . 0 0 "[ . 1 . 2]" 1
954 1 85 GLN HA 1 85 GLN HG3 . . 3.950 3.007 2.524 3.617 . 0 0 "[ . 1 . 2]" 1
955 1 85 GLN HA 1 95 ILE MD . . 5.370 4.565 4.240 4.986 . 0 0 "[ . 1 . 2]" 1
956 1 85 GLN QB 1 85 GLN QE . . 3.820 2.956 2.156 3.619 . 0 0 "[ . 1 . 2]" 1
957 1 85 GLN QB 1 86 THR H . . 3.530 2.531 1.890 3.588 0.058 13 0 "[ . 1 . 2]" 1
958 1 85 GLN QB 1 86 THR MG . . 3.660 2.686 2.291 3.739 0.079 13 0 "[ . 1 . 2]" 1
959 1 85 GLN QB 1 95 ILE MD . . 3.220 2.122 1.900 2.792 . 0 0 "[ . 1 . 2]" 1
960 1 85 GLN HB2 1 85 GLN HE22 . . 4.930 4.680 3.694 4.999 0.069 6 0 "[ . 1 . 2]" 1
961 1 85 GLN HB2 1 86 THR H . . 4.180 3.785 3.413 4.248 0.068 13 0 "[ . 1 . 2]" 1
962 1 85 GLN HB2 1 95 ILE MD . . 4.070 2.778 2.163 3.926 . 0 0 "[ . 1 . 2]" 1
963 1 85 GLN HB3 1 85 GLN HE22 . . 4.930 3.960 3.686 4.725 . 0 0 "[ . 1 . 2]" 1
964 1 85 GLN HB3 1 86 THR H . . 4.180 2.587 1.898 3.869 . 0 0 "[ . 1 . 2]" 1
965 1 85 GLN HB3 1 95 ILE MD . . 4.070 2.226 1.996 2.858 . 0 0 "[ . 1 . 2]" 1
966 1 85 GLN QE 1 86 THR H . . 5.290 4.696 3.310 5.360 0.070 10 0 "[ . 1 . 2]" 1
967 1 85 GLN QE 1 86 THR MG . . 4.050 2.749 2.020 4.123 0.073 11 0 "[ . 1 . 2]" 1
968 1 85 GLN QE 1 95 ILE MG . . 5.280 4.334 2.391 5.361 0.081 6 0 "[ . 1 . 2]" 1
969 1 85 GLN HE21 1 86 THR MG . . 4.710 3.123 2.046 4.775 0.065 11 0 "[ . 1 . 2]" 1
970 1 85 GLN HE21 1 95 ILE MD . . 4.260 3.198 2.257 4.323 0.063 6 0 "[ . 1 . 2]" 1
971 1 85 GLN HE22 1 86 THR MG . . 4.710 3.413 2.243 4.507 . 0 0 "[ . 1 . 2]" 1
972 1 85 GLN HE22 1 95 ILE MD . . 4.260 3.236 2.622 4.295 0.035 5 0 "[ . 1 . 2]" 1
973 1 85 GLN QG 1 86 THR H . . 4.560 3.908 2.862 4.606 0.046 1 0 "[ . 1 . 2]" 1
974 1 85 GLN QG 1 95 ILE MD . . 3.600 3.151 2.105 3.689 0.089 2 0 "[ . 1 . 2]" 1
975 1 85 GLN QG 1 95 ILE MG . . 4.410 4.080 2.673 4.487 0.077 12 0 "[ . 1 . 2]" 1
976 1 85 GLN HG2 1 86 THR MG . . 4.520 3.452 2.200 4.590 0.070 5 0 "[ . 1 . 2]" 1
977 1 85 GLN HG3 1 86 THR MG . . 4.520 4.192 2.205 4.598 0.078 10 0 "[ . 1 . 2]" 1
978 1 86 THR H 1 86 THR MG . . 3.530 2.622 1.907 3.049 . 0 0 "[ . 1 . 2]" 1
979 1 86 THR H 1 88 SER H . . 5.280 4.633 3.900 5.231 . 0 0 "[ . 1 . 2]" 1
980 1 86 THR H 1 92 ASN H . . 5.500 4.959 4.443 5.363 . 0 0 "[ . 1 . 2]" 1
981 1 86 THR H 1 92 ASN QD . . 4.290 2.958 2.307 3.791 . 0 0 "[ . 1 . 2]" 1
982 1 86 THR H 1 95 ILE MD . . 4.460 3.496 2.478 4.393 . 0 0 "[ . 1 . 2]" 1
983 1 86 THR HA 1 86 THR MG . . 3.580 2.562 2.240 3.285 . 0 0 "[ . 1 . 2]" 1
984 1 86 THR HA 1 88 SER H . . 4.730 4.121 3.828 4.396 . 0 0 "[ . 1 . 2]" 1
985 1 86 THR HB 1 88 SER H . . 4.130 2.917 2.202 4.192 0.062 3 0 "[ . 1 . 2]" 1
986 1 86 THR MG 1 88 SER H . . 4.440 3.850 2.041 4.369 . 0 0 "[ . 1 . 2]" 1
987 1 86 THR MG 1 91 GLN HB2 . . 4.280 3.581 2.125 4.354 0.074 7 0 "[ . 1 . 2]" 1
988 1 86 THR MG 1 91 GLN HB3 . . 4.500 2.971 2.106 3.614 . 0 0 "[ . 1 . 2]" 1
989 1 86 THR MG 1 91 GLN QE . . 4.680 3.288 2.115 4.758 0.078 2 0 "[ . 1 . 2]" 1
990 1 86 THR MG 1 91 GLN QG . . 4.680 3.303 2.140 4.380 . 0 0 "[ . 1 . 2]" 1
991 1 86 THR MG 1 92 ASN H . . 5.450 4.618 3.103 5.196 . 0 0 "[ . 1 . 2]" 1
992 1 86 THR MG 1 95 ILE MD . . 3.150 2.804 2.238 3.247 0.097 9 0 "[ . 1 . 2]" 1
993 1 86 THR MG 1 95 ILE QG . . 5.320 4.471 3.874 5.042 . 0 0 "[ . 1 . 2]" 1
994 1 87 ARG HA 1 87 ARG QD . . 3.870 3.718 2.596 3.957 0.087 17 0 "[ . 1 . 2]" 1
995 1 87 ARG HA 1 87 ARG QG . . 3.820 2.786 2.133 3.579 . 0 0 "[ . 1 . 2]" 1
996 1 87 ARG QB 1 87 ARG QD . . 3.290 2.369 2.038 2.709 . 0 0 "[ . 1 . 2]" 1
997 1 87 ARG QB 1 88 SER H . . 4.010 3.547 2.796 4.079 0.069 6 0 "[ . 1 . 2]" 1
998 1 87 ARG HB2 1 88 SER H . . 4.630 3.890 2.867 4.599 . 0 0 "[ . 1 . 2]" 1
999 1 87 ARG HB3 1 88 SER H . . 4.630 4.193 3.738 4.597 . 0 0 "[ . 1 . 2]" 1
1000 1 87 ARG QG 1 88 SER H . . 4.930 4.078 2.813 4.921 . 0 0 "[ . 1 . 2]" 1
1001 1 88 SER H 1 88 SER HB2 . . 3.620 2.388 2.054 3.394 . 0 0 "[ . 1 . 2]" 1
1002 1 88 SER H 1 88 SER QB . . 3.120 2.305 2.034 2.915 . 0 0 "[ . 1 . 2]" 1
1003 1 88 SER H 1 88 SER HB3 . . 3.620 3.388 2.282 3.625 0.005 9 0 "[ . 1 . 2]" 1
1004 1 88 SER H 1 91 GLN HB2 . . 4.430 3.998 3.104 4.494 0.064 20 0 "[ . 1 . 2]" 1
1005 1 88 SER H 1 91 GLN HB3 . . 5.060 4.596 3.641 5.119 0.059 12 0 "[ . 1 . 2]" 1
1006 1 88 SER H 1 91 GLN QG . . 5.500 5.020 4.082 5.571 0.071 6 0 "[ . 1 . 2]" 1
1007 1 88 SER QB 1 90 ASP QB . . 5.180 3.660 2.917 4.361 . 0 0 "[ . 1 . 2]" 1
1008 1 88 SER QB 1 91 GLN HB3 . . 3.780 3.231 2.320 3.595 . 0 0 "[ . 1 . 2]" 1
1009 1 88 SER QB 1 91 GLN QG . . 4.480 3.183 2.146 4.342 . 0 0 "[ . 1 . 2]" 1
1010 1 88 SER QB 1 92 ASN H . . 4.830 3.723 3.483 4.132 . 0 0 "[ . 1 . 2]" 1
1011 1 88 SER HB2 1 91 GLN H . . 4.010 3.103 2.314 3.976 . 0 0 "[ . 1 . 2]" 1
1012 1 88 SER HB2 1 91 GLN HB2 . . 4.070 2.394 2.001 3.594 . 0 0 "[ . 1 . 2]" 1
1013 1 88 SER HB2 1 91 GLN HB3 . . 4.550 3.484 2.359 4.612 0.062 10 0 "[ . 1 . 2]" 1
1014 1 88 SER HB3 1 91 GLN H . . 4.010 2.783 2.014 4.060 0.050 7 0 "[ . 1 . 2]" 1
1015 1 88 SER HB3 1 91 GLN HB2 . . 4.070 3.050 2.114 3.937 . 0 0 "[ . 1 . 2]" 1
1016 1 88 SER HB3 1 91 GLN HB3 . . 4.550 4.281 2.334 4.614 0.064 2 0 "[ . 1 . 2]" 1
1017 1 89 VAL HA 1 89 VAL MG1 . . 3.620 3.287 3.262 3.301 . 0 0 "[ . 1 . 2]" 1
1018 1 89 VAL HA 1 92 ASN H . . 3.960 3.417 3.160 3.675 . 0 0 "[ . 1 . 2]" 1
1019 1 89 VAL HA 1 92 ASN HB2 . . 3.910 2.531 2.328 2.765 . 0 0 "[ . 1 . 2]" 1
1020 1 89 VAL HA 1 92 ASN HB3 . . 4.610 4.166 3.984 4.388 . 0 0 "[ . 1 . 2]" 1
1021 1 89 VAL HA 1 92 ASN QD . . 3.950 3.025 2.220 4.002 0.052 5 0 "[ . 1 . 2]" 1
1022 1 89 VAL HA 1 93 ARG H . . 5.050 4.068 3.726 4.474 . 0 0 "[ . 1 . 2]" 1
1023 1 89 VAL HB 1 90 ASP H . . 4.470 4.003 3.859 4.229 . 0 0 "[ . 1 . 2]" 1
1024 1 89 VAL MG1 1 90 ASP HA . . 4.060 3.514 3.264 3.784 . 0 0 "[ . 1 . 2]" 1
1025 1 89 VAL MG1 1 93 ARG H . . 5.350 5.219 4.948 5.421 0.071 7 0 "[ . 1 . 2]" 1
1026 1 89 VAL MG1 1 93 ARG QD . . 4.500 3.982 3.275 4.576 0.076 6 0 "[ . 1 . 2]" 1
1027 1 89 VAL MG2 1 90 ASP H . . 4.170 3.635 3.363 3.817 . 0 0 "[ . 1 . 2]" 1
1028 1 89 VAL MG2 1 90 ASP HA . . 4.130 3.833 3.537 4.162 0.032 13 0 "[ . 1 . 2]" 1
1029 1 89 VAL MG2 1 93 ARG HD2 . . 4.590 3.654 2.473 4.669 0.079 11 0 "[ . 1 . 2]" 1
1030 1 89 VAL MG2 1 93 ARG QD . . 3.850 3.045 2.452 3.371 . 0 0 "[ . 1 . 2]" 1
1031 1 89 VAL MG2 1 93 ARG HD3 . . 4.590 3.716 2.983 4.651 0.061 16 0 "[ . 1 . 2]" 1
1032 1 89 VAL MG2 1 93 ARG QG . . 4.030 2.748 2.280 4.066 0.036 12 0 "[ . 1 . 2]" 1
1033 1 90 ASP H 1 90 ASP HB2 . . 3.970 2.891 2.174 3.610 . 0 0 "[ . 1 . 2]" 1
1034 1 90 ASP H 1 90 ASP HB3 . . 3.970 2.757 2.142 3.573 . 0 0 "[ . 1 . 2]" 1
1035 1 90 ASP HA 1 93 ARG H . . 4.630 3.637 3.110 3.991 . 0 0 "[ . 1 . 2]" 1
1036 1 90 ASP HA 1 93 ARG QB . . 3.690 3.020 2.290 3.744 0.054 12 0 "[ . 1 . 2]" 1
1037 1 90 ASP HA 1 93 ARG HD2 . . 4.740 3.711 2.160 4.792 0.052 4 0 "[ . 1 . 2]" 1
1038 1 90 ASP HA 1 93 ARG QD . . 4.120 2.878 1.879 4.192 0.072 4 0 "[ . 1 . 2]" 1
1039 1 90 ASP HA 1 93 ARG HD3 . . 4.740 3.213 1.923 4.628 . 0 0 "[ . 1 . 2]" 1
1040 1 90 ASP HA 1 93 ARG QG . . 4.030 3.214 2.096 3.776 . 0 0 "[ . 1 . 2]" 1
1041 1 90 ASP QB 1 91 GLN H . . 3.650 3.013 2.350 3.593 . 0 0 "[ . 1 . 2]" 1
1042 1 90 ASP HB2 1 91 GLN H . . 4.330 3.646 2.376 4.192 . 0 0 "[ . 1 . 2]" 1
1043 1 90 ASP HB3 1 91 GLN H . . 4.330 3.473 2.381 4.105 . 0 0 "[ . 1 . 2]" 1
1044 1 91 GLN H 1 91 GLN HB2 . . 3.580 2.272 2.134 2.453 . 0 0 "[ . 1 . 2]" 1
1045 1 91 GLN H 1 91 GLN HB3 . . 3.420 3.186 2.508 3.487 0.067 1 0 "[ . 1 . 2]" 1
1046 1 91 GLN H 1 91 GLN QG . . 4.130 3.236 2.415 4.057 . 0 0 "[ . 1 . 2]" 1
1047 1 91 GLN H 1 92 ASN H . . 3.370 2.523 2.283 2.729 . 0 0 "[ . 1 . 2]" 1
1048 1 91 GLN H 1 92 ASN HB2 . . 4.730 4.607 4.296 4.786 0.056 7 0 "[ . 1 . 2]" 1
1049 1 91 GLN H 1 93 ARG H . . 4.920 3.967 3.533 4.234 . 0 0 "[ . 1 . 2]" 1
1050 1 91 GLN HA 1 91 GLN QE . . 4.890 4.110 2.849 4.835 . 0 0 "[ . 1 . 2]" 1
1051 1 91 GLN HA 1 91 GLN QG . . 3.430 2.415 2.113 2.902 . 0 0 "[ . 1 . 2]" 1
1052 1 91 GLN HA 1 94 LYS H . . 5.210 3.567 3.328 3.815 . 0 0 "[ . 1 . 2]" 1
1053 1 91 GLN HA 1 94 LYS QD . . 3.960 3.221 2.375 4.029 0.069 6 0 "[ . 1 . 2]" 1
1054 1 91 GLN HA 1 94 LYS QG . . 4.190 2.734 2.128 4.122 . 0 0 "[ . 1 . 2]" 1
1055 1 91 GLN HB2 1 92 ASN H . . 3.860 3.043 2.267 3.891 0.031 11 0 "[ . 1 . 2]" 1
1056 1 91 GLN HB3 1 92 ASN H . . 3.860 3.082 2.212 3.754 . 0 0 "[ . 1 . 2]" 1
1057 1 91 GLN HB3 1 94 LYS H . . 5.500 5.518 5.141 5.573 0.073 12 0 "[ . 1 . 2]" 1
1058 1 91 GLN QG 1 92 ASN H . . 4.600 4.198 3.842 4.571 . 0 0 "[ . 1 . 2]" 1
1059 1 91 GLN QG 1 95 ILE MD . . 5.140 4.050 2.273 5.234 0.094 13 0 "[ . 1 . 2]" 1
1060 1 92 ASN H 1 92 ASN HB2 . . 3.760 2.424 2.257 2.539 . 0 0 "[ . 1 . 2]" 1
1061 1 92 ASN H 1 92 ASN HB3 . . 3.880 3.613 3.448 3.675 . 0 0 "[ . 1 . 2]" 1
1062 1 92 ASN H 1 93 ARG H . . 3.860 2.746 2.339 2.928 . 0 0 "[ . 1 . 2]" 1
1063 1 92 ASN H 1 94 LYS H . . 5.100 4.540 4.029 4.854 . 0 0 "[ . 1 . 2]" 1
1064 1 92 ASN HB2 1 93 ARG H . . 4.300 2.949 2.628 3.178 . 0 0 "[ . 1 . 2]" 1
1065 1 92 ASN HB3 1 93 ARG H . . 4.590 3.725 3.114 3.940 . 0 0 "[ . 1 . 2]" 1
1066 1 93 ARG H 1 93 ARG QB . . 3.430 2.399 2.175 2.687 . 0 0 "[ . 1 . 2]" 1
1067 1 93 ARG H 1 93 ARG HG2 . . 4.120 3.607 2.292 4.094 . 0 0 "[ . 1 . 2]" 1
1068 1 93 ARG H 1 93 ARG HG3 . . 4.120 2.627 2.225 3.529 . 0 0 "[ . 1 . 2]" 1
1069 1 93 ARG H 1 94 LYS H . . 3.650 2.911 2.675 3.213 . 0 0 "[ . 1 . 2]" 1
1070 1 93 ARG H 1 95 ILE H . . 4.630 4.251 4.044 4.621 . 0 0 "[ . 1 . 2]" 1
1071 1 93 ARG HA 1 93 ARG QG . . 3.730 2.436 2.238 3.354 . 0 0 "[ . 1 . 2]" 1
1072 1 93 ARG HA 1 95 ILE H . . 5.020 4.472 4.222 4.838 . 0 0 "[ . 1 . 2]" 1
1073 1 93 ARG HA 1 96 ALA H . . 5.500 3.613 3.315 4.032 . 0 0 "[ . 1 . 2]" 1
1074 1 93 ARG HA 1 96 ALA MB . . 3.930 2.859 2.444 3.658 . 0 0 "[ . 1 . 2]" 1
1075 1 93 ARG HA 1 97 ARG H . . 4.840 4.103 3.833 4.636 . 0 0 "[ . 1 . 2]" 1
1076 1 93 ARG QB 1 94 LYS H . . 3.240 2.571 2.284 3.332 0.092 12 0 "[ . 1 . 2]" 1
1077 1 94 LYS H 1 94 LYS HB2 . . 3.920 3.326 2.418 3.752 . 0 0 "[ . 1 . 2]" 1
1078 1 94 LYS H 1 94 LYS HB3 . . 3.920 3.016 2.258 3.689 . 0 0 "[ . 1 . 2]" 1
1079 1 94 LYS H 1 94 LYS QD . . 4.640 3.786 2.560 4.559 . 0 0 "[ . 1 . 2]" 1
1080 1 94 LYS H 1 94 LYS QE . . 4.700 4.335 3.456 4.780 0.080 2 0 "[ . 1 . 2]" 1
1081 1 94 LYS H 1 94 LYS HG2 . . 4.110 2.516 1.878 3.695 . 0 0 "[ . 1 . 2]" 1
1082 1 94 LYS H 1 94 LYS HG3 . . 4.110 3.098 1.849 4.154 0.044 20 0 "[ . 1 . 2]" 1
1083 1 94 LYS H 1 95 ILE H . . 3.500 2.764 2.485 2.942 . 0 0 "[ . 1 . 2]" 1
1084 1 94 LYS HA 1 94 LYS QE . . 5.500 4.163 2.434 5.558 0.058 8 0 "[ . 1 . 2]" 1
1085 1 94 LYS HA 1 94 LYS QG . . 3.450 3.091 2.242 3.424 . 0 0 "[ . 1 . 2]" 1
1086 1 94 LYS HA 1 97 ARG H . . 4.470 3.377 3.173 3.624 . 0 0 "[ . 1 . 2]" 1
1087 1 94 LYS HA 1 97 ARG QD . . 5.340 3.655 2.366 5.271 . 0 0 "[ . 1 . 2]" 1
1088 1 94 LYS HA 1 98 LYS H . . 4.280 3.938 3.716 4.319 0.039 12 0 "[ . 1 . 2]" 1
1089 1 94 LYS QB 1 94 LYS QE . . 3.880 2.447 1.953 3.762 . 0 0 "[ . 1 . 2]" 1
1090 1 94 LYS QB 1 95 ILE HA . . 4.680 4.192 3.543 4.741 0.061 12 0 "[ . 1 . 2]" 1
1091 1 94 LYS HB2 1 94 LYS QE . . 4.450 3.031 1.987 4.471 0.021 8 0 "[ . 1 . 2]" 1
1092 1 94 LYS HB2 1 95 ILE H . . 4.190 3.430 2.176 4.239 0.049 5 0 "[ . 1 . 2]" 1
1093 1 94 LYS HB3 1 94 LYS QE . . 4.450 2.896 2.035 4.285 . 0 0 "[ . 1 . 2]" 1
1094 1 94 LYS HB3 1 95 ILE H . . 4.190 3.977 3.331 4.241 0.051 3 0 "[ . 1 . 2]" 1
1095 1 94 LYS QD 1 95 ILE H . . 5.500 4.574 3.994 5.356 . 0 0 "[ . 1 . 2]" 1
1096 1 94 LYS QG 1 95 ILE H . . 4.350 2.910 2.249 4.087 . 0 0 "[ . 1 . 2]" 1
1097 1 94 LYS QG 1 95 ILE HA . . 5.340 4.325 3.302 5.435 0.095 1 0 "[ . 1 . 2]" 1
1098 1 95 ILE H 1 95 ILE HB . . 3.260 2.479 2.298 2.668 . 0 0 "[ . 1 . 2]" 1
1099 1 95 ILE H 1 95 ILE MD . . 3.530 3.361 1.891 3.595 0.065 7 0 "[ . 1 . 2]" 1
1100 1 95 ILE H 1 95 ILE HG12 . . 3.770 3.505 3.152 3.833 0.063 9 0 "[ . 1 . 2]" 1
1101 1 95 ILE H 1 95 ILE QG . . 3.180 2.185 1.962 3.108 . 0 0 "[ . 1 . 2]" 1
1102 1 95 ILE H 1 95 ILE HG13 . . 3.770 2.213 1.975 3.286 . 0 0 "[ . 1 . 2]" 1
1103 1 95 ILE H 1 95 ILE MG . . 4.300 3.781 3.731 3.830 . 0 0 "[ . 1 . 2]" 1
1104 1 95 ILE H 1 98 LYS H . . 5.360 4.791 4.533 5.107 . 0 0 "[ . 1 . 2]" 1
1105 1 95 ILE HA 1 95 ILE MD . . 3.940 3.845 3.141 3.974 0.034 5 0 "[ . 1 . 2]" 1
1106 1 95 ILE HA 1 95 ILE HG12 . . 3.820 2.647 2.437 3.641 . 0 0 "[ . 1 . 2]" 1
1107 1 95 ILE HA 1 95 ILE HG13 . . 3.820 2.878 2.403 3.121 . 0 0 "[ . 1 . 2]" 1
1108 1 95 ILE HA 1 95 ILE MG . . 3.360 2.479 2.364 2.583 . 0 0 "[ . 1 . 2]" 1
1109 1 95 ILE HA 1 98 LYS H . . 4.180 3.594 3.326 3.776 . 0 0 "[ . 1 . 2]" 1
1110 1 95 ILE HA 1 98 LYS QB . . 5.080 3.546 2.526 4.609 . 0 0 "[ . 1 . 2]" 1
1111 1 95 ILE HA 1 98 LYS QD . . 4.470 3.931 2.410 4.536 0.066 5 0 "[ . 1 . 2]" 1
1112 1 95 ILE HA 1 98 LYS QG . . 5.000 3.109 2.035 4.464 . 0 0 "[ . 1 . 2]" 1
1113 1 95 ILE HA 1 99 VAL H . . 4.520 4.131 3.875 4.514 . 0 0 "[ . 1 . 2]" 1
1114 1 95 ILE HA 1 99 VAL HB . . 5.500 5.153 4.508 5.554 0.054 1 0 "[ . 1 . 2]" 1
1115 1 95 ILE HB 1 95 ILE MD . . 3.310 2.390 2.275 2.487 . 0 0 "[ . 1 . 2]" 1
1116 1 95 ILE HB 1 96 ALA H . . 3.370 2.581 2.361 2.797 . 0 0 "[ . 1 . 2]" 1
1117 1 95 ILE HB 1 96 ALA HA . . 4.760 4.416 4.139 4.535 . 0 0 "[ . 1 . 2]" 1
1118 1 95 ILE HB 1 96 ALA MB . . 3.930 3.988 3.855 4.011 0.081 11 0 "[ . 1 . 2]" 1
1119 1 95 ILE QG 1 95 ILE MG . . 2.950 2.293 2.025 2.397 . 0 0 "[ . 1 . 2]" 1
1120 1 95 ILE QG 1 96 ALA H . . 4.420 4.113 3.840 4.475 0.055 9 0 "[ . 1 . 2]" 1
1121 1 95 ILE HG12 1 95 ILE MG . . 3.590 2.351 2.140 2.467 . 0 0 "[ . 1 . 2]" 1
1122 1 95 ILE HG13 1 95 ILE MG . . 3.590 3.199 2.502 3.264 . 0 0 "[ . 1 . 2]" 1
1123 1 95 ILE MG 1 96 ALA H . . 3.950 3.386 3.118 3.711 . 0 0 "[ . 1 . 2]" 1
1124 1 95 ILE MG 1 96 ALA HA . . 4.170 3.504 3.287 3.756 . 0 0 "[ . 1 . 2]" 1
1125 1 95 ILE MG 1 96 ALA MB . . 4.210 4.055 3.732 4.297 0.087 6 0 "[ . 1 . 2]" 1
1126 1 95 ILE MG 1 98 LYS H . . 4.970 4.918 4.558 5.035 0.065 15 0 "[ . 1 . 2]" 1
1127 1 95 ILE MG 1 98 LYS QD . . 4.420 3.849 2.571 4.503 0.083 9 0 "[ . 1 . 2]" 1
1128 1 96 ALA H 1 96 ALA MB . . 3.040 2.211 2.178 2.273 . 0 0 "[ . 1 . 2]" 1
1129 1 96 ALA H 1 97 ARG H . . 3.800 2.769 2.539 2.915 . 0 0 "[ . 1 . 2]" 1
1130 1 96 ALA H 1 97 ARG QB . . 4.800 4.524 4.182 4.881 0.081 20 0 "[ . 1 . 2]" 1
1131 1 96 ALA H 1 98 LYS H . . 5.050 4.369 4.001 4.729 . 0 0 "[ . 1 . 2]" 1
1132 1 96 ALA H 1 99 VAL MG1 . . 4.270 4.254 4.003 4.334 0.064 8 0 "[ . 1 . 2]" 1
1133 1 96 ALA HA 1 98 LYS H . . 4.780 4.631 4.344 4.818 0.038 12 0 "[ . 1 . 2]" 1
1134 1 96 ALA HA 1 99 VAL H . . 4.040 3.686 3.547 3.837 . 0 0 "[ . 1 . 2]" 1
1135 1 96 ALA HA 1 99 VAL HB . . 4.210 4.265 4.217 4.278 0.068 9 0 "[ . 1 . 2]" 1
1136 1 96 ALA HA 1 99 VAL MG1 . . 3.850 2.079 1.983 2.156 . 0 0 "[ . 1 . 2]" 1
1137 1 96 ALA MB 1 97 ARG H . . 3.760 2.543 2.391 2.940 . 0 0 "[ . 1 . 2]" 1
1138 1 96 ALA MB 1 97 ARG HA . . 4.680 3.910 3.768 4.012 . 0 0 "[ . 1 . 2]" 1
1139 1 96 ALA MB 1 98 LYS H . . 4.870 4.697 4.420 4.931 0.061 7 0 "[ . 1 . 2]" 1
1140 1 96 ALA MB 1 99 VAL H . . 5.060 4.862 4.759 4.998 . 0 0 "[ . 1 . 2]" 1
1141 1 97 ARG H 1 97 ARG HB2 . . 3.680 2.335 2.034 3.642 . 0 0 "[ . 1 . 2]" 1
1142 1 97 ARG H 1 97 ARG HB3 . . 3.680 3.034 2.355 3.592 . 0 0 "[ . 1 . 2]" 1
1143 1 97 ARG H 1 97 ARG QD . . 4.610 4.224 3.682 4.681 0.071 4 0 "[ . 1 . 2]" 1
1144 1 97 ARG H 1 97 ARG QG . . 4.900 3.324 2.288 4.089 . 0 0 "[ . 1 . 2]" 1
1145 1 97 ARG H 1 98 LYS H . . 3.530 2.828 2.672 3.012 . 0 0 "[ . 1 . 2]" 1
1146 1 97 ARG H 1 99 VAL H . . 4.910 4.462 4.116 4.691 . 0 0 "[ . 1 . 2]" 1
1147 1 97 ARG HA 1 97 ARG HG2 . . 4.180 2.705 2.188 4.139 . 0 0 "[ . 1 . 2]" 1
1148 1 97 ARG HA 1 97 ARG QG . . 3.630 2.378 2.166 3.454 . 0 0 "[ . 1 . 2]" 1
1149 1 97 ARG HA 1 97 ARG HG3 . . 4.180 2.816 2.288 3.699 . 0 0 "[ . 1 . 2]" 1
1150 1 97 ARG HA 1 100 LEU H . . 4.390 3.536 3.321 3.790 . 0 0 "[ . 1 . 2]" 1
1151 1 97 ARG HA 1 100 LEU HB2 . . 4.740 3.542 2.874 4.042 . 0 0 "[ . 1 . 2]" 1
1152 1 97 ARG HA 1 100 LEU QB . . 3.970 2.642 2.323 3.029 . 0 0 "[ . 1 . 2]" 1
1153 1 97 ARG HA 1 100 LEU HB3 . . 4.740 2.761 2.385 3.211 . 0 0 "[ . 1 . 2]" 1
1154 1 97 ARG HA 1 101 GLN H . . 4.830 4.204 3.913 4.756 . 0 0 "[ . 1 . 2]" 1
1155 1 97 ARG QB 1 98 LYS H . . 3.630 2.611 2.389 3.692 0.062 20 0 "[ . 1 . 2]" 1
1156 1 98 LYS H 1 98 LYS HB2 . . 3.650 3.170 2.318 3.696 0.046 16 0 "[ . 1 . 2]" 1
1157 1 98 LYS H 1 98 LYS QB . . 2.950 2.396 2.179 2.700 . 0 0 "[ . 1 . 2]" 1
1158 1 98 LYS H 1 98 LYS HB3 . . 3.650 2.568 2.323 2.775 . 0 0 "[ . 1 . 2]" 1
1159 1 98 LYS H 1 98 LYS HG2 . . 4.680 3.931 3.393 4.506 . 0 0 "[ . 1 . 2]" 1
1160 1 98 LYS H 1 98 LYS QG . . 4.070 3.051 2.027 4.042 . 0 0 "[ . 1 . 2]" 1
1161 1 98 LYS H 1 98 LYS HG3 . . 4.680 3.301 2.043 4.590 . 0 0 "[ . 1 . 2]" 1
1162 1 98 LYS H 1 99 VAL H . . 3.360 2.913 2.741 3.033 . 0 0 "[ . 1 . 2]" 1
1163 1 98 LYS H 1 99 VAL MG1 . . 4.310 4.293 4.099 4.383 0.073 13 0 "[ . 1 . 2]" 1
1164 1 98 LYS H 1 100 LEU H . . 4.790 4.150 3.881 4.327 . 0 0 "[ . 1 . 2]" 1
1165 1 98 LYS HA 1 98 LYS QD . . 4.400 3.631 3.150 4.139 . 0 0 "[ . 1 . 2]" 1
1166 1 98 LYS HA 1 98 LYS QG . . 3.600 3.084 2.267 3.633 0.033 8 0 "[ . 1 . 2]" 1
1167 1 98 LYS HA 1 101 GLN H . . 4.310 3.494 3.091 3.912 . 0 0 "[ . 1 . 2]" 1
1168 1 98 LYS HA 1 101 GLN QB . . 3.900 2.873 2.459 3.543 . 0 0 "[ . 1 . 2]" 1
1169 1 98 LYS HA 1 101 GLN QG . . 5.340 4.652 3.594 5.194 . 0 0 "[ . 1 . 2]" 1
1170 1 98 LYS QB 1 98 LYS QE . . 4.580 3.148 1.975 3.868 . 0 0 "[ . 1 . 2]" 1
1171 1 98 LYS QD 1 99 VAL H . . 4.580 2.781 2.169 3.252 . 0 0 "[ . 1 . 2]" 1
1172 1 98 LYS QD 1 99 VAL HA . . 4.610 2.845 2.559 3.332 . 0 0 "[ . 1 . 2]" 1
1173 1 98 LYS QD 1 99 VAL MG2 . . 4.620 3.865 3.477 4.213 . 0 0 "[ . 1 . 2]" 1
1174 1 98 LYS QD 1 100 LEU H . . 4.890 4.841 4.518 4.970 0.080 5 0 "[ . 1 . 2]" 1
1175 1 98 LYS QD 1 102 GLU H . . 5.500 4.926 4.203 5.567 0.067 12 0 "[ . 1 . 2]" 1
1176 1 98 LYS QE 1 98 LYS QG . . 2.930 2.351 2.049 2.872 . 0 0 "[ . 1 . 2]" 1
1177 1 98 LYS QE 1 99 VAL H . . 5.500 4.512 3.415 5.397 . 0 0 "[ . 1 . 2]" 1
1178 1 98 LYS QG 1 99 VAL H . . 4.410 3.234 2.361 4.255 . 0 0 "[ . 1 . 2]" 1
1179 1 98 LYS QG 1 99 VAL HA . . 5.340 4.565 4.189 5.028 . 0 0 "[ . 1 . 2]" 1
1180 1 99 VAL H 1 99 VAL HB . . 3.140 2.454 2.272 2.698 . 0 0 "[ . 1 . 2]" 1
1181 1 99 VAL H 1 99 VAL MG1 . . 3.140 2.259 2.004 2.403 . 0 0 "[ . 1 . 2]" 1
1182 1 99 VAL H 1 99 VAL MG2 . . 3.920 3.780 3.674 3.846 . 0 0 "[ . 1 . 2]" 1
1183 1 99 VAL H 1 100 LEU H . . 3.480 2.726 2.498 2.911 . 0 0 "[ . 1 . 2]" 1
1184 1 99 VAL H 1 100 LEU HB2 . . 5.500 5.084 4.682 5.419 . 0 0 "[ . 1 . 2]" 1
1185 1 99 VAL H 1 100 LEU QB . . 4.810 4.494 4.322 4.654 . 0 0 "[ . 1 . 2]" 1
1186 1 99 VAL H 1 100 LEU HB3 . . 5.500 5.036 4.741 5.434 . 0 0 "[ . 1 . 2]" 1
1187 1 99 VAL H 1 101 GLN H . . 4.510 4.334 3.962 4.571 0.061 5 0 "[ . 1 . 2]" 1
1188 1 99 VAL HA 1 99 VAL MG1 . . 3.280 3.256 3.235 3.280 . 0 0 "[ . 1 . 2]" 1
1189 1 99 VAL HA 1 99 VAL MG2 . . 3.270 2.277 2.218 2.380 . 0 0 "[ . 1 . 2]" 1
1190 1 99 VAL HA 1 102 GLU H . . 4.080 3.394 3.056 3.642 . 0 0 "[ . 1 . 2]" 1
1191 1 99 VAL HA 1 102 GLU QB . . 4.200 3.397 2.857 4.240 0.040 18 0 "[ . 1 . 2]" 1
1192 1 99 VAL HA 1 102 GLU HG2 . . 4.550 3.582 2.340 4.612 0.062 4 0 "[ . 1 . 2]" 1
1193 1 99 VAL HA 1 102 GLU QG . . 3.690 2.489 2.229 3.061 . 0 0 "[ . 1 . 2]" 1
1194 1 99 VAL HA 1 102 GLU HG3 . . 4.550 2.749 2.247 3.448 . 0 0 "[ . 1 . 2]" 1
1195 1 99 VAL HA 1 103 LYS H . . 5.430 4.798 4.292 5.125 . 0 0 "[ . 1 . 2]" 1
1196 1 99 VAL HB 1 100 LEU H . . 4.100 4.092 3.956 4.165 0.065 18 0 "[ . 1 . 2]" 1
1197 1 99 VAL MG1 1 100 LEU H . . 4.040 2.500 2.262 2.704 . 0 0 "[ . 1 . 2]" 1
1198 1 99 VAL MG2 1 103 LYS H . . 4.640 4.547 4.114 4.713 0.073 9 0 "[ . 1 . 2]" 1
1199 1 99 VAL MG2 1 103 LYS QD . . 4.300 3.947 3.212 4.378 0.078 11 0 "[ . 1 . 2]" 1
1200 1 99 VAL MG2 1 103 LYS HE2 . . 4.050 2.529 1.949 3.758 . 0 0 "[ . 1 . 2]" 1
1201 1 99 VAL MG2 1 103 LYS QE . . 3.230 2.392 1.932 2.990 . 0 0 "[ . 1 . 2]" 1
1202 1 99 VAL MG2 1 103 LYS HE3 . . 4.050 3.566 2.286 4.120 0.070 1 0 "[ . 1 . 2]" 1
1203 1 99 VAL MG2 1 103 LYS HG2 . . 4.280 4.082 3.248 4.358 0.078 9 0 "[ . 1 . 2]" 1
1204 1 99 VAL MG2 1 103 LYS QG . . 3.480 3.222 2.946 3.445 . 0 0 "[ . 1 . 2]" 1
1205 1 99 VAL MG2 1 103 LYS HG3 . . 4.280 3.540 3.020 4.341 0.061 11 0 "[ . 1 . 2]" 1
1206 1 100 LEU H 1 100 LEU HB2 . . 3.490 2.538 2.203 2.804 . 0 0 "[ . 1 . 2]" 1
1207 1 100 LEU H 1 100 LEU HB3 . . 3.490 2.542 2.282 2.932 . 0 0 "[ . 1 . 2]" 1
1208 1 100 LEU H 1 100 LEU MD1 . . 4.630 4.209 4.108 4.333 . 0 0 "[ . 1 . 2]" 1
1209 1 100 LEU H 1 100 LEU MD2 . . 4.320 4.219 3.850 4.383 0.063 12 0 "[ . 1 . 2]" 1
1210 1 100 LEU H 1 101 GLN H . . 3.670 2.688 2.578 2.807 . 0 0 "[ . 1 . 2]" 1
1211 1 100 LEU H 1 102 GLU H . . 4.850 4.300 4.083 4.521 . 0 0 "[ . 1 . 2]" 1
1212 1 100 LEU HA 1 100 LEU MD1 . . 3.280 2.200 2.053 2.503 . 0 0 "[ . 1 . 2]" 1
1213 1 100 LEU HA 1 100 LEU MD2 . . 4.330 3.626 2.318 3.913 . 0 0 "[ . 1 . 2]" 1
1214 1 100 LEU HA 1 102 GLU H . . 4.760 4.293 3.858 4.587 . 0 0 "[ . 1 . 2]" 1
1215 1 100 LEU HA 1 103 LYS H . . 4.160 3.414 3.089 3.731 . 0 0 "[ . 1 . 2]" 1
1216 1 100 LEU HA 1 103 LYS QB . . 4.350 2.974 2.566 3.271 . 0 0 "[ . 1 . 2]" 1
1217 1 100 LEU HA 1 103 LYS QG . . 4.520 3.025 2.233 4.014 . 0 0 "[ . 1 . 2]" 1
1218 1 100 LEU HA 1 104 VAL H . . 4.560 4.248 4.072 4.609 0.049 15 0 "[ . 1 . 2]" 1
1219 1 100 LEU HA 1 104 VAL MG2 . . 4.830 3.984 3.648 4.506 . 0 0 "[ . 1 . 2]" 1
1220 1 100 LEU QB 1 101 GLN H . . 3.530 2.698 2.437 2.911 . 0 0 "[ . 1 . 2]" 1
1221 1 100 LEU HB2 1 101 GLN H . . 4.320 3.962 3.541 4.148 . 0 0 "[ . 1 . 2]" 1
1222 1 100 LEU HB3 1 101 GLN H . . 4.320 2.747 2.475 2.978 . 0 0 "[ . 1 . 2]" 1
1223 1 100 LEU MD1 1 103 LYS H . . 4.340 4.048 3.639 4.397 0.057 12 0 "[ . 1 . 2]" 1
1224 1 100 LEU MD1 1 103 LYS QB . . 3.620 2.514 2.068 2.933 . 0 0 "[ . 1 . 2]" 1
1225 1 100 LEU MD1 1 103 LYS QE . . 4.720 4.251 2.902 4.808 0.088 5 0 "[ . 1 . 2]" 1
1226 1 100 LEU MD1 1 104 VAL H . . 3.920 3.558 3.031 3.914 . 0 0 "[ . 1 . 2]" 1
1227 1 100 LEU MD1 1 104 VAL HB . . 4.640 4.352 3.279 4.715 0.075 7 0 "[ . 1 . 2]" 1
1228 1 100 LEU MD2 1 101 GLN H . . 4.870 4.594 4.345 4.887 0.017 5 0 "[ . 1 . 2]" 1
1229 1 100 LEU HG 1 101 GLN H . . 4.710 4.022 3.400 4.763 0.053 8 0 "[ . 1 . 2]" 1
1230 1 100 LEU HG 1 104 VAL MG2 . . 4.000 2.632 2.009 4.066 0.066 14 0 "[ . 1 . 2]" 1
1231 1 101 GLN H 1 101 GLN HB2 . . 3.550 2.293 2.127 2.578 . 0 0 "[ . 1 . 2]" 1
1232 1 101 GLN H 1 101 GLN QB . . 3.060 2.172 2.050 2.341 . 0 0 "[ . 1 . 2]" 1
1233 1 101 GLN H 1 101 GLN HB3 . . 3.550 2.798 2.369 3.595 0.045 5 0 "[ . 1 . 2]" 1
1234 1 101 GLN H 1 101 GLN HG2 . . 4.840 4.422 3.547 4.667 . 0 0 "[ . 1 . 2]" 1
1235 1 101 GLN H 1 101 GLN QG . . 4.200 3.705 2.312 3.996 . 0 0 "[ . 1 . 2]" 1
1236 1 101 GLN H 1 101 GLN HG3 . . 4.840 4.023 2.343 4.516 . 0 0 "[ . 1 . 2]" 1
1237 1 101 GLN H 1 102 GLU H . . 3.640 2.848 2.640 3.061 . 0 0 "[ . 1 . 2]" 1
1238 1 101 GLN H 1 103 LYS H . . 5.030 4.218 3.970 4.596 . 0 0 "[ . 1 . 2]" 1
1239 1 101 GLN HA 1 101 GLN HE21 . . 4.960 4.664 3.940 4.953 . 0 0 "[ . 1 . 2]" 1
1240 1 101 GLN HA 1 101 GLN HG2 . . 4.190 3.098 2.325 3.873 . 0 0 "[ . 1 . 2]" 1
1241 1 101 GLN HA 1 101 GLN QG . . 3.480 2.346 2.169 3.154 . 0 0 "[ . 1 . 2]" 1
1242 1 101 GLN HA 1 101 GLN HG3 . . 4.190 2.496 2.205 3.341 . 0 0 "[ . 1 . 2]" 1
1243 1 101 GLN HA 1 103 LYS H . . 5.500 4.171 3.841 4.635 . 0 0 "[ . 1 . 2]" 1
1244 1 101 GLN HA 1 104 VAL H . . 4.260 3.353 3.193 3.596 . 0 0 "[ . 1 . 2]" 1
1245 1 101 GLN HA 1 104 VAL HB . . 3.880 2.662 2.332 2.860 . 0 0 "[ . 1 . 2]" 1
1246 1 101 GLN HA 1 104 VAL MG1 . . 4.730 4.048 3.592 4.299 . 0 0 "[ . 1 . 2]" 1
1247 1 101 GLN HA 1 104 VAL MG2 . . 4.410 3.348 2.375 3.723 . 0 0 "[ . 1 . 2]" 1
1248 1 101 GLN HA 1 105 ASP H . . 4.600 3.978 3.631 4.366 . 0 0 "[ . 1 . 2]" 1
1249 1 101 GLN QB 1 102 GLU H . . 4.120 2.697 2.492 3.165 . 0 0 "[ . 1 . 2]" 1
1250 1 101 GLN HB2 1 102 GLU H . . 4.740 3.726 2.913 4.151 . 0 0 "[ . 1 . 2]" 1
1251 1 101 GLN HB3 1 102 GLU H . . 4.740 2.868 2.537 3.815 . 0 0 "[ . 1 . 2]" 1
1252 1 101 GLN HE22 1 101 GLN HG2 . . 3.920 3.717 3.415 3.969 0.049 1 0 "[ . 1 . 2]" 1
1253 1 101 GLN HE22 1 101 GLN HG3 . . 3.920 3.658 3.476 3.989 0.069 6 0 "[ . 1 . 2]" 1
1254 1 102 GLU H 1 102 GLU HB2 . . 3.790 2.696 2.448 3.581 . 0 0 "[ . 1 . 2]" 1
1255 1 102 GLU H 1 102 GLU QB . . 3.110 2.586 2.410 2.817 . 0 0 "[ . 1 . 2]" 1
1256 1 102 GLU H 1 102 GLU HB3 . . 3.790 3.549 2.729 3.658 . 0 0 "[ . 1 . 2]" 1
1257 1 102 GLU H 1 102 GLU HG2 . . 3.710 2.622 1.783 3.553 . 0 0 "[ . 1 . 2]" 1
1258 1 102 GLU H 1 102 GLU QG . . 2.920 1.995 1.768 2.448 . 0 0 "[ . 1 . 2]" 1
1259 1 102 GLU H 1 102 GLU HG3 . . 3.710 2.569 1.917 3.610 . 0 0 "[ . 1 . 2]" 1
1260 1 102 GLU H 1 103 LYS H . . 3.490 2.638 2.314 2.764 . 0 0 "[ . 1 . 2]" 1
1261 1 102 GLU H 1 103 LYS QB . . 4.760 4.793 4.626 4.829 0.069 9 0 "[ . 1 . 2]" 1
1262 1 102 GLU H 1 103 LYS QG . . 4.410 4.133 3.518 4.475 0.065 1 0 "[ . 1 . 2]" 1
1263 1 102 GLU H 1 104 VAL H . . 5.060 4.220 4.023 4.422 . 0 0 "[ . 1 . 2]" 1
1264 1 102 GLU H 1 105 ASP QB . . 5.370 4.884 4.473 5.336 . 0 0 "[ . 1 . 2]" 1
1265 1 102 GLU HA 1 102 GLU HG2 . . 3.930 2.876 2.349 3.710 . 0 0 "[ . 1 . 2]" 1
1266 1 102 GLU HA 1 102 GLU QG . . 3.410 2.748 2.296 3.358 . 0 0 "[ . 1 . 2]" 1
1267 1 102 GLU HA 1 102 GLU HG3 . . 3.930 3.541 3.020 3.977 0.047 20 0 "[ . 1 . 2]" 1
1268 1 102 GLU HA 1 105 ASP H . . 3.890 3.711 3.377 3.939 0.049 20 0 "[ . 1 . 2]" 1
1269 1 102 GLU HA 1 105 ASP QB . . 3.680 2.849 2.443 3.166 . 0 0 "[ . 1 . 2]" 1
1270 1 102 GLU HA 1 106 VAL H . . 4.580 4.481 3.998 4.639 0.059 4 0 "[ . 1 . 2]" 1
1271 1 102 GLU QB 1 103 LYS H . . 3.510 2.747 2.237 3.578 0.068 18 0 "[ . 1 . 2]" 1
1272 1 102 GLU QB 1 105 ASP H . . 5.340 5.067 4.850 5.280 . 0 0 "[ . 1 . 2]" 1
1273 1 102 GLU QB 1 105 ASP QB . . 5.260 4.312 4.024 4.626 . 0 0 "[ . 1 . 2]" 1
1274 1 102 GLU HB2 1 103 LYS H . . 4.230 2.816 2.276 3.856 . 0 0 "[ . 1 . 2]" 1
1275 1 102 GLU HB3 1 103 LYS H . . 4.230 3.891 3.295 4.241 0.011 16 0 "[ . 1 . 2]" 1
1276 1 102 GLU HG2 1 103 LYS H . . 4.800 4.481 3.141 4.867 0.067 4 0 "[ . 1 . 2]" 1
1277 1 102 GLU HG3 1 103 LYS H . . 4.800 4.283 2.589 4.851 0.051 11 0 "[ . 1 . 2]" 1
1278 1 103 LYS H 1 103 LYS QB . . 3.350 2.531 2.414 2.750 . 0 0 "[ . 1 . 2]" 1
1279 1 103 LYS H 1 103 LYS HD2 . . 5.070 4.440 4.015 5.090 0.020 4 0 "[ . 1 . 2]" 1
1280 1 103 LYS H 1 103 LYS QD . . 4.370 3.920 2.866 4.433 0.063 4 0 "[ . 1 . 2]" 1
1281 1 103 LYS H 1 103 LYS HD3 . . 5.070 4.569 2.919 5.116 0.046 16 0 "[ . 1 . 2]" 1
1282 1 103 LYS H 1 103 LYS QE . . 5.330 4.396 3.570 4.983 . 0 0 "[ . 1 . 2]" 1
1283 1 103 LYS H 1 103 LYS HG2 . . 3.650 3.104 2.002 3.683 0.033 16 0 "[ . 1 . 2]" 1
1284 1 103 LYS H 1 103 LYS HG3 . . 3.650 2.715 1.931 3.696 0.046 7 0 "[ . 1 . 2]" 1
1285 1 103 LYS H 1 104 VAL H . . 3.590 2.518 2.205 2.762 . 0 0 "[ . 1 . 2]" 1
1286 1 103 LYS H 1 104 VAL MG2 . . 4.670 4.105 3.883 4.373 . 0 0 "[ . 1 . 2]" 1
1287 1 103 LYS H 1 105 ASP H . . 4.380 3.985 3.606 4.195 . 0 0 "[ . 1 . 2]" 1
1288 1 103 LYS H 1 105 ASP QB . . 5.500 4.664 4.142 5.032 . 0 0 "[ . 1 . 2]" 1
1289 1 103 LYS HA 1 103 LYS QD . . 3.960 3.517 2.105 4.028 0.068 9 0 "[ . 1 . 2]" 1
1290 1 103 LYS HA 1 103 LYS QG . . 3.520 2.563 2.186 3.253 . 0 0 "[ . 1 . 2]" 1
1291 1 103 LYS HA 1 105 ASP H . . 4.950 4.388 4.105 4.674 . 0 0 "[ . 1 . 2]" 1
1292 1 103 LYS HA 1 106 VAL H . . 4.820 3.820 3.484 4.232 . 0 0 "[ . 1 . 2]" 1
1293 1 103 LYS HA 1 106 VAL HB . . 4.850 4.023 2.647 4.903 0.053 6 0 "[ . 1 . 2]" 1
1294 1 103 LYS HA 1 106 VAL QG . . 3.530 2.793 2.106 3.580 0.050 12 0 "[ . 1 . 2]" 1
1295 1 103 LYS QB 1 106 VAL QG . . 5.040 4.137 3.542 4.950 . 0 0 "[ . 1 . 2]" 1
1296 1 103 LYS QB 1 107 PHE H . . 5.360 4.956 4.508 5.355 . 0 0 "[ . 1 . 2]" 1
1297 1 103 LYS QE 1 103 LYS QG . . 2.990 2.281 2.077 2.571 . 0 0 "[ . 1 . 2]" 1
1298 1 103 LYS QG 1 104 VAL H . . 4.180 4.009 3.666 4.242 0.062 4 0 "[ . 1 . 2]" 1
1299 1 103 LYS HG2 1 104 VAL H . . 5.010 4.735 3.836 5.051 0.041 12 0 "[ . 1 . 2]" 1
1300 1 103 LYS HG3 1 104 VAL H . . 5.010 4.422 3.988 5.062 0.052 7 0 "[ . 1 . 2]" 1
1301 1 104 VAL H 1 104 VAL HB . . 3.150 2.385 2.299 2.521 . 0 0 "[ . 1 . 2]" 1
1302 1 104 VAL H 1 104 VAL MG1 . . 3.880 3.760 3.726 3.817 . 0 0 "[ . 1 . 2]" 1
1303 1 104 VAL H 1 104 VAL MG2 . . 3.340 2.280 2.084 2.479 . 0 0 "[ . 1 . 2]" 1
1304 1 104 VAL H 1 105 ASP H . . 3.500 2.656 2.518 2.810 . 0 0 "[ . 1 . 2]" 1
1305 1 104 VAL H 1 105 ASP QB . . 4.660 4.300 4.004 4.553 . 0 0 "[ . 1 . 2]" 1
1306 1 104 VAL H 1 106 VAL H . . 5.130 4.651 4.366 4.889 . 0 0 "[ . 1 . 2]" 1
1307 1 104 VAL H 1 107 PHE HB3 . . 5.500 5.160 4.886 5.545 0.045 13 0 "[ . 1 . 2]" 1
1308 1 104 VAL HA 1 104 VAL MG1 . . 3.570 2.492 2.347 2.605 . 0 0 "[ . 1 . 2]" 1
1309 1 104 VAL HA 1 104 VAL MG2 . . 3.420 2.353 2.215 2.485 . 0 0 "[ . 1 . 2]" 1
1310 1 104 VAL HA 1 107 PHE H . . 3.840 3.309 3.013 3.693 . 0 0 "[ . 1 . 2]" 1
1311 1 104 VAL HA 1 107 PHE HB2 . . 4.090 3.000 2.487 3.499 . 0 0 "[ . 1 . 2]" 1
1312 1 104 VAL HA 1 107 PHE HB3 . . 3.720 2.475 2.260 3.122 . 0 0 "[ . 1 . 2]" 1
1313 1 104 VAL HA 1 107 PHE QD . . 4.610 4.186 3.709 4.647 0.037 13 0 "[ . 1 . 2]" 1
1314 1 104 VAL HA 1 108 TYR H . . 4.620 4.286 3.977 4.681 0.061 18 0 "[ . 1 . 2]" 1
1315 1 104 VAL HB 1 105 ASP H . . 3.690 2.886 2.307 3.135 . 0 0 "[ . 1 . 2]" 1
1316 1 104 VAL MG1 1 105 ASP H . . 4.280 3.569 3.147 3.847 . 0 0 "[ . 1 . 2]" 1
1317 1 104 VAL MG1 1 108 TYR H . . 4.560 4.174 3.872 4.506 . 0 0 "[ . 1 . 2]" 1
1318 1 104 VAL MG1 1 108 TYR QD . . 3.320 2.743 2.223 3.390 0.070 7 0 "[ . 1 . 2]" 1
1319 1 104 VAL MG1 1 108 TYR QE . . 3.230 2.413 2.055 2.885 . 0 0 "[ . 1 . 2]" 1
1320 1 104 VAL MG2 1 105 ASP H . . 4.370 4.074 3.786 4.214 . 0 0 "[ . 1 . 2]" 1
1321 1 104 VAL MG2 1 108 TYR QD . . 5.160 4.650 4.329 5.211 0.051 7 0 "[ . 1 . 2]" 1
1322 1 104 VAL MG2 1 108 TYR QE . . 4.440 4.151 3.819 4.514 0.074 17 0 "[ . 1 . 2]" 1
1323 1 105 ASP H 1 105 ASP QB . . 2.800 2.171 2.034 2.519 . 0 0 "[ . 1 . 2]" 1
1324 1 105 ASP H 1 106 VAL H . . 3.440 2.990 2.814 3.145 . 0 0 "[ . 1 . 2]" 1
1325 1 105 ASP H 1 106 VAL HB . . 5.500 5.221 4.611 5.539 0.039 10 0 "[ . 1 . 2]" 1
1326 1 105 ASP HA 1 107 PHE H . . 4.730 4.264 3.898 4.508 . 0 0 "[ . 1 . 2]" 1
1327 1 105 ASP HA 1 108 TYR QD . . 4.780 4.431 3.537 4.750 . 0 0 "[ . 1 . 2]" 1
1328 1 105 ASP HA 1 109 ASN H . . 4.430 4.239 3.804 4.490 0.060 4 0 "[ . 1 . 2]" 1
1329 1 105 ASP HA 1 109 ASN HD21 . . 4.680 4.082 3.302 4.726 0.046 7 0 "[ . 1 . 2]" 1
1330 1 105 ASP HA 1 109 ASN QD . . 3.960 3.515 3.085 3.898 . 0 0 "[ . 1 . 2]" 1
1331 1 105 ASP HA 1 109 ASN HD22 . . 4.680 4.073 3.349 4.746 0.066 4 0 "[ . 1 . 2]" 1
1332 1 105 ASP QB 1 106 VAL H . . 3.260 2.234 2.085 2.456 . 0 0 "[ . 1 . 2]" 1
1333 1 105 ASP QB 1 106 VAL HA . . 5.030 4.243 3.624 4.557 . 0 0 "[ . 1 . 2]" 1
1334 1 105 ASP QB 1 106 VAL QG . . 3.790 3.343 2.634 3.797 0.007 14 0 "[ . 1 . 2]" 1
1335 1 105 ASP QB 1 107 PHE H . . 4.370 4.422 4.350 4.449 0.079 2 0 "[ . 1 . 2]" 1
1336 1 106 VAL H 1 106 VAL HB . . 3.110 2.466 2.274 2.691 . 0 0 "[ . 1 . 2]" 1
1337 1 106 VAL H 1 106 VAL MG1 . . 3.840 2.884 2.065 3.800 . 0 0 "[ . 1 . 2]" 1
1338 1 106 VAL H 1 106 VAL QG . . 2.930 2.087 1.895 2.295 . 0 0 "[ . 1 . 2]" 1
1339 1 106 VAL H 1 106 VAL MG2 . . 3.840 2.976 1.900 3.805 . 0 0 "[ . 1 . 2]" 1
1340 1 106 VAL H 1 107 PHE H . . 3.080 2.803 2.686 2.877 . 0 0 "[ . 1 . 2]" 1
1341 1 106 VAL H 1 107 PHE HB2 . . 5.010 5.034 4.802 5.080 0.070 19 0 "[ . 1 . 2]" 1
1342 1 106 VAL H 1 108 TYR H . . 4.530 4.359 4.148 4.569 0.039 5 0 "[ . 1 . 2]" 1
1343 1 106 VAL H 1 109 ASN H . . 5.050 4.821 4.658 5.062 0.012 4 0 "[ . 1 . 2]" 1
1344 1 106 VAL H 1 109 ASN HD21 . . 4.560 4.156 3.606 4.619 0.059 2 0 "[ . 1 . 2]" 1
1345 1 106 VAL H 1 109 ASN QD . . 3.760 3.705 3.446 3.832 0.072 11 0 "[ . 1 . 2]" 1
1346 1 106 VAL H 1 109 ASN HD22 . . 4.560 4.308 3.622 4.636 0.076 9 0 "[ . 1 . 2]" 1
1347 1 106 VAL HA 1 106 VAL MG1 . . 3.500 2.894 2.320 3.275 . 0 0 "[ . 1 . 2]" 1
1348 1 106 VAL HA 1 106 VAL QG . . 2.990 2.217 2.077 2.333 . 0 0 "[ . 1 . 2]" 1
1349 1 106 VAL HA 1 106 VAL MG2 . . 3.500 2.351 2.234 2.503 . 0 0 "[ . 1 . 2]" 1
1350 1 106 VAL HA 1 109 ASN H . . 3.940 3.324 3.108 3.564 . 0 0 "[ . 1 . 2]" 1
1351 1 106 VAL HA 1 109 ASN QB . . 4.510 3.112 2.160 4.568 0.058 4 0 "[ . 1 . 2]" 1
1352 1 106 VAL HA 1 110 SER H . . 4.380 3.659 3.239 4.409 0.029 20 0 "[ . 1 . 2]" 1
1353 1 106 VAL HB 1 107 PHE H . . 4.160 3.653 2.810 4.218 0.058 16 0 "[ . 1 . 2]" 1
1354 1 106 VAL HB 1 110 SER QB . . 5.400 4.994 4.446 5.461 0.061 3 0 "[ . 1 . 2]" 1
1355 1 106 VAL QG 1 107 PHE H . . 3.500 2.959 2.384 3.597 0.097 18 0 "[ . 1 . 2]" 1
1356 1 106 VAL QG 1 107 PHE HA . . 3.960 3.524 3.270 4.003 0.043 12 0 "[ . 1 . 2]" 1
1357 1 106 VAL QG 1 109 ASN H . . 4.790 4.394 4.218 4.652 . 0 0 "[ . 1 . 2]" 1
1358 1 106 VAL QG 1 110 SER H . . 4.590 3.815 3.262 4.320 . 0 0 "[ . 1 . 2]" 1
1359 1 106 VAL QG 1 110 SER QB . . 3.480 2.542 2.056 2.949 . 0 0 "[ . 1 . 2]" 1
1360 1 106 VAL MG1 1 107 PHE H . . 3.990 3.122 2.410 4.006 0.016 18 0 "[ . 1 . 2]" 1
1361 1 106 VAL MG1 1 109 ASN H . . 5.430 5.056 4.569 5.468 0.038 14 0 "[ . 1 . 2]" 1
1362 1 106 VAL MG1 1 110 SER QB . . 4.510 3.486 2.063 4.559 0.049 19 0 "[ . 1 . 2]" 1
1363 1 106 VAL MG2 1 107 PHE H . . 3.990 3.992 3.786 4.074 0.084 11 0 "[ . 1 . 2]" 1
1364 1 106 VAL MG2 1 109 ASN H . . 5.430 4.886 4.540 5.428 . 0 0 "[ . 1 . 2]" 1
1365 1 106 VAL MG2 1 110 SER QB . . 4.510 3.388 2.266 4.598 0.088 9 0 "[ . 1 . 2]" 1
1366 1 107 PHE H 1 107 PHE HB2 . . 3.170 2.467 2.362 2.775 . 0 0 "[ . 1 . 2]" 1
1367 1 107 PHE H 1 107 PHE HB3 . . 3.960 2.593 2.426 2.744 . 0 0 "[ . 1 . 2]" 1
1368 1 107 PHE H 1 107 PHE QD . . 4.300 4.221 4.168 4.270 . 0 0 "[ . 1 . 2]" 1
1369 1 107 PHE H 1 108 TYR H . . 3.460 2.602 2.252 2.837 . 0 0 "[ . 1 . 2]" 1
1370 1 107 PHE H 1 109 ASN H . . 4.250 4.074 3.864 4.297 0.047 17 0 "[ . 1 . 2]" 1
1371 1 107 PHE H 1 109 ASN QD . . 5.340 4.847 4.308 5.267 . 0 0 "[ . 1 . 2]" 1
1372 1 107 PHE HA 1 107 PHE QD . . 3.630 2.976 2.542 3.197 . 0 0 "[ . 1 . 2]" 1
1373 1 107 PHE HA 1 107 PHE QE . . 4.800 4.679 4.444 4.870 0.070 12 0 "[ . 1 . 2]" 1
1374 1 107 PHE HA 1 109 ASN H . . 5.180 4.630 4.162 5.145 . 0 0 "[ . 1 . 2]" 1
1375 1 107 PHE HB2 1 108 TYR H . . 4.220 3.973 3.811 4.189 . 0 0 "[ . 1 . 2]" 1
1376 1 107 PHE HB3 1 108 TYR H . . 3.400 2.887 2.558 3.334 . 0 0 "[ . 1 . 2]" 1
1377 1 107 PHE HB3 1 108 TYR QE . . 4.900 4.154 3.673 4.838 . 0 0 "[ . 1 . 2]" 1
1378 1 107 PHE QD 1 108 TYR H . . 4.130 3.895 3.453 4.208 0.078 17 0 "[ . 1 . 2]" 1
1379 1 107 PHE QD 1 108 TYR HA . . 4.520 3.581 3.023 3.979 . 0 0 "[ . 1 . 2]" 1
1380 1 107 PHE QD 1 108 TYR QD . . 4.390 2.698 2.026 4.076 . 0 0 "[ . 1 . 2]" 1
1381 1 107 PHE QD 1 108 TYR QE . . 4.310 3.371 2.659 4.054 . 0 0 "[ . 1 . 2]" 1
1382 1 108 TYR H 1 108 TYR HB2 . . 3.630 2.264 2.143 2.442 . 0 0 "[ . 1 . 2]" 1
1383 1 108 TYR H 1 108 TYR QB . . 3.030 2.238 2.123 2.405 . 0 0 "[ . 1 . 2]" 1
1384 1 108 TYR H 1 108 TYR HB3 . . 3.630 3.525 3.437 3.645 0.015 11 0 "[ . 1 . 2]" 1
1385 1 108 TYR H 1 108 TYR QD . . 3.700 2.710 2.366 3.305 . 0 0 "[ . 1 . 2]" 1
1386 1 108 TYR H 1 108 TYR QE . . 5.330 4.943 4.528 5.299 . 0 0 "[ . 1 . 2]" 1
1387 1 108 TYR HA 1 108 TYR QD . . 3.370 2.819 2.272 3.105 . 0 0 "[ . 1 . 2]" 1
1388 1 108 TYR HA 1 108 TYR QE . . 4.620 4.510 4.289 4.669 0.049 9 0 "[ . 1 . 2]" 1
1389 1 108 TYR QB 1 109 ASN H . . 3.960 2.704 2.334 3.081 . 0 0 "[ . 1 . 2]" 1
1390 1 108 TYR QD 1 109 ASN H . . 4.550 4.514 4.382 4.608 0.058 16 0 "[ . 1 . 2]" 1
1391 1 109 ASN H 1 109 ASN QB . . 2.940 2.559 2.351 2.925 . 0 0 "[ . 1 . 2]" 1
1392 1 109 ASN H 1 109 ASN HD21 . . 4.440 3.216 2.169 3.862 . 0 0 "[ . 1 . 2]" 1
1393 1 109 ASN H 1 109 ASN QD . . 3.750 3.032 2.157 3.528 . 0 0 "[ . 1 . 2]" 1
1394 1 109 ASN H 1 109 ASN HD22 . . 4.440 3.886 3.567 4.232 . 0 0 "[ . 1 . 2]" 1
1395 1 109 ASN H 1 110 SER H . . 3.160 2.599 2.097 2.874 . 0 0 "[ . 1 . 2]" 1
1396 1 109 ASN H 1 110 SER QB . . 4.720 4.496 4.063 4.793 0.073 13 0 "[ . 1 . 2]" 1
1397 1 109 ASN QB 1 109 ASN HD22 . . 3.410 3.300 3.255 3.393 . 0 0 "[ . 1 . 2]" 1
1398 1 109 ASN QB 1 110 SER H . . 3.710 3.148 2.166 3.802 0.092 2 0 "[ . 1 . 2]" 1
1399 1 110 SER H 1 110 SER QB . . 3.190 2.544 2.151 2.913 . 0 0 "[ . 1 . 2]" 1
1400 1 110 SER HA 1 111 GLY H . . 3.570 2.615 2.172 3.526 . 0 0 "[ . 1 . 2]" 1
1401 1 110 SER QB 1 111 GLY H . . 3.940 3.237 1.959 4.015 0.075 14 0 "[ . 1 . 2]" 1
1402 1 111 GLY H 1 112 PRO QD . . 4.390 4.082 2.367 4.418 0.028 11 0 "[ . 1 . 2]" 1
1403 1 111 GLY QA 1 112 PRO QD . . 3.120 2.112 2.030 2.473 . 0 0 "[ . 1 . 2]" 1
1404 1 111 GLY QA 1 112 PRO QG . . 4.820 3.827 3.693 4.190 . 0 0 "[ . 1 . 2]" 1
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