NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
434530 |
2jx8   |
15550 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2jx8
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 770
_Distance_constraint_stats_list.Viol_count 977
_Distance_constraint_stats_list.Viol_total 721.925
_Distance_constraint_stats_list.Viol_max 0.647
_Distance_constraint_stats_list.Viol_rms 0.0176
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0023
_Distance_constraint_stats_list.Viol_average_violations_only 0.0369
_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 6 LEU 7.197 0.647 6 7 "[ * *+ - 1 * .* * 2]"
1 7 PRO 0.752 0.083 5 0 "[ . 1 . 2]"
1 8 GLU 0.639 0.083 5 0 "[ . 1 . 2]"
1 9 GLU 1.574 0.076 16 0 "[ . 1 . 2]"
1 10 LEU 3.060 0.076 16 0 "[ . 1 . 2]"
1 11 VAL 3.036 0.459 17 0 "[ . 1 . 2]"
1 12 HIS 0.736 0.063 5 0 "[ . 1 . 2]"
1 13 ALA 1.321 0.136 9 0 "[ . 1 . 2]"
1 14 GLY 0.989 0.074 17 0 "[ . 1 . 2]"
1 15 TRP 1.318 0.045 16 0 "[ . 1 . 2]"
1 16 GLU 0.009 0.009 14 0 "[ . 1 . 2]"
1 17 LYS 0.004 0.002 2 0 "[ . 1 . 2]"
1 18 CYS 0.052 0.011 2 0 "[ . 1 . 2]"
1 19 TRP 1.602 0.085 3 0 "[ . 1 . 2]"
1 20 SER 1.241 0.082 8 0 "[ . 1 . 2]"
1 21 ARG 0.147 0.018 13 0 "[ . 1 . 2]"
1 22 ARG 1.363 0.073 12 0 "[ . 1 . 2]"
1 23 GLU 2.992 0.073 12 0 "[ . 1 . 2]"
1 24 ASN 1.797 0.059 12 0 "[ . 1 . 2]"
1 25 ARG 3.081 0.082 8 0 "[ . 1 . 2]"
1 26 PRO 3.043 0.085 3 0 "[ . 1 . 2]"
1 27 TYR 1.335 0.058 6 0 "[ . 1 . 2]"
1 28 TYR 1.451 0.070 12 0 "[ . 1 . 2]"
1 29 PHE 0.120 0.019 9 0 "[ . 1 . 2]"
1 30 ASN 2.314 0.086 19 0 "[ . 1 . 2]"
1 31 ARG 0.679 0.035 8 0 "[ . 1 . 2]"
1 32 PHE 0.619 0.053 10 0 "[ . 1 . 2]"
1 33 THR 0.025 0.010 15 0 "[ . 1 . 2]"
1 34 ASN 0.642 0.090 9 0 "[ . 1 . 2]"
1 35 GLN 1.292 0.078 12 0 "[ . 1 . 2]"
1 36 SER 0.438 0.046 2 0 "[ . 1 . 2]"
1 37 LEU 0.929 0.070 12 0 "[ . 1 . 2]"
1 38 TRP 4.124 0.121 20 0 "[ . 1 . 2]"
1 39 GLU 0.510 0.030 20 0 "[ . 1 . 2]"
1 40 MET 1.552 0.057 10 0 "[ . 1 . 2]"
1 41 PRO 0.990 0.070 16 0 "[ . 1 . 2]"
1 42 VAL 0.031 0.012 12 0 "[ . 1 . 2]"
1 43 LEU 0.352 0.136 9 0 "[ . 1 . 2]"
1 44 GLY 0.011 0.011 1 0 "[ . 1 . 2]"
1 45 GLN 0.321 0.045 12 0 "[ . 1 . 2]"
1 46 HIS 0.054 0.046 9 0 "[ . 1 . 2]"
1 47 ASP 0.593 0.074 8 0 "[ . 1 . 2]"
1 48 VAL 0.448 0.092 1 0 "[ . 1 . 2]"
1 49 ILE 0.387 0.093 4 0 "[ . 1 . 2]"
1 50 SER 0.035 0.030 18 0 "[ . 1 . 2]"
1 51 ASP 0.046 0.030 18 0 "[ . 1 . 2]"
1 52 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 6 LEU H 1 6 LEU HA 2.650 . 3.500 2.669 2.244 2.978 . 0 0 "[ . 1 . 2]" 1
2 1 6 LEU H 1 6 LEU HB2 2.650 . 3.500 2.755 2.085 3.526 0.026 16 0 "[ . 1 . 2]" 1
3 1 6 LEU H 1 6 LEU HB3 2.650 . 3.500 3.731 3.339 4.147 0.647 6 7 "[ * *+ - 1 * .* * 2]" 1
4 1 6 LEU H 1 6 LEU MD1 3.650 . 5.500 3.860 2.109 4.868 . 0 0 "[ . 1 . 2]" 1
5 1 6 LEU H 1 6 LEU HG 2.650 . 3.500 2.993 1.911 3.852 0.352 8 0 "[ . 1 . 2]" 1
6 1 6 LEU H 1 11 VAL MG2 3.650 . 5.500 5.151 4.507 5.959 0.459 17 0 "[ . 1 . 2]" 1
7 1 6 LEU HA 1 6 LEU HB3 2.650 . 3.500 2.595 2.491 2.735 . 0 0 "[ . 1 . 2]" 1
8 1 6 LEU HA 1 6 LEU MD1 3.650 . 5.500 3.748 3.465 3.858 . 0 0 "[ . 1 . 2]" 1
9 1 6 LEU HA 1 6 LEU MD2 2.900 . 4.000 2.209 1.820 3.246 . 0 0 "[ . 1 . 2]" 1
10 1 6 LEU HA 1 6 LEU HG 2.650 . 3.500 2.637 2.192 2.979 . 0 0 "[ . 1 . 2]" 1
11 1 6 LEU HA 1 7 PRO HD2 2.650 . 3.500 2.069 1.998 2.403 . 0 0 "[ . 1 . 2]" 1
12 1 6 LEU HA 1 7 PRO HD3 2.650 . 3.500 2.517 2.173 2.813 . 0 0 "[ . 1 . 2]" 1
13 1 6 LEU HA 1 7 PRO HG2 3.400 . 5.000 4.254 4.201 4.489 . 0 0 "[ . 1 . 2]" 1
14 1 6 LEU HA 1 7 PRO HG3 3.400 . 5.000 4.470 4.311 4.666 . 0 0 "[ . 1 . 2]" 1
15 1 6 LEU HA 1 10 LEU MD1 3.650 . 5.500 2.259 1.857 3.275 . 0 0 "[ . 1 . 2]" 1
16 1 6 LEU HB2 1 7 PRO HD2 3.400 . 5.000 4.748 3.911 4.922 . 0 0 "[ . 1 . 2]" 1
17 1 6 LEU HB2 1 7 PRO HD3 3.400 . 5.000 4.967 4.758 5.019 0.019 6 0 "[ . 1 . 2]" 1
18 1 6 LEU HB2 1 10 LEU MD1 4.150 . 6.500 4.491 4.120 4.915 . 0 0 "[ . 1 . 2]" 1
19 1 6 LEU HB2 1 11 VAL MG2 3.650 . 5.500 3.595 2.738 4.446 . 0 0 "[ . 1 . 2]" 1
20 1 6 LEU HB3 1 7 PRO HD2 3.400 . 5.000 3.919 2.382 4.467 . 0 0 "[ . 1 . 2]" 1
21 1 6 LEU HB3 1 7 PRO HD3 3.400 . 5.000 4.718 3.676 4.968 . 0 0 "[ . 1 . 2]" 1
22 1 6 LEU HB3 1 10 LEU MD1 4.150 . 6.500 3.592 2.647 4.122 . 0 0 "[ . 1 . 2]" 1
23 1 6 LEU HB3 1 11 VAL MG2 3.650 . 5.500 2.719 2.336 3.163 . 0 0 "[ . 1 . 2]" 1
24 1 6 LEU MD1 1 15 TRP HB2 3.650 . 5.500 4.019 3.475 4.437 . 0 0 "[ . 1 . 2]" 1
25 1 6 LEU MD1 1 15 TRP HB3 3.650 . 5.500 3.402 2.694 3.801 . 0 0 "[ . 1 . 2]" 1
26 1 6 LEU MD1 1 16 GLU HA 3.650 . 5.500 2.523 2.046 3.407 . 0 0 "[ . 1 . 2]" 1
27 1 6 LEU MD1 1 17 LYS H 3.650 . 5.500 2.255 1.838 2.784 . 0 0 "[ . 1 . 2]" 1
28 1 6 LEU MD1 1 28 TYR QD 3.900 . 6.000 2.755 2.150 3.166 . 0 0 "[ . 1 . 2]" 1
29 1 6 LEU MD1 1 28 TYR QE 3.900 . 6.000 2.654 1.891 3.191 . 0 0 "[ . 1 . 2]" 1
30 1 6 LEU MD2 1 7 PRO HD2 3.650 . 5.500 3.145 2.737 3.389 . 0 0 "[ . 1 . 2]" 1
31 1 6 LEU MD2 1 7 PRO HD3 3.650 . 5.500 4.118 3.646 4.365 . 0 0 "[ . 1 . 2]" 1
32 1 6 LEU MD2 1 10 LEU HB2 3.650 . 5.500 2.393 1.858 3.008 . 0 0 "[ . 1 . 2]" 1
33 1 6 LEU MD2 1 10 LEU HB3 3.650 . 5.500 2.176 1.849 2.464 . 0 0 "[ . 1 . 2]" 1
34 1 6 LEU MD2 1 15 TRP HB2 3.650 . 5.500 2.869 2.481 3.721 . 0 0 "[ . 1 . 2]" 1
35 1 6 LEU MD2 1 15 TRP HB3 3.650 . 5.500 2.436 2.077 3.283 . 0 0 "[ . 1 . 2]" 1
36 1 6 LEU MD2 1 28 TYR QD 3.900 . 6.000 2.468 1.859 3.085 . 0 0 "[ . 1 . 2]" 1
37 1 6 LEU MD2 1 28 TYR QE 3.900 . 6.000 2.533 2.003 3.165 . 0 0 "[ . 1 . 2]" 1
38 1 6 LEU MD2 1 40 MET HG2 4.150 . 6.500 2.652 1.916 3.415 . 0 0 "[ . 1 . 2]" 1
39 1 6 LEU MD2 1 40 MET HG3 4.150 . 6.500 3.940 2.978 4.657 . 0 0 "[ . 1 . 2]" 1
40 1 7 PRO HA 1 8 GLU H 2.300 . 2.800 2.453 2.365 2.494 . 0 0 "[ . 1 . 2]" 1
41 1 7 PRO HA 1 9 GLU H 3.400 . 5.000 4.205 4.064 4.501 . 0 0 "[ . 1 . 2]" 1
42 1 7 PRO HB3 1 8 GLU H 2.650 . 3.500 3.530 3.503 3.583 0.083 5 0 "[ . 1 . 2]" 1
43 1 7 PRO HD2 1 10 LEU MD1 3.650 . 5.500 1.901 1.773 2.170 0.027 5 0 "[ . 1 . 2]" 1
44 1 7 PRO HD2 1 10 LEU HG 3.900 . 6.000 2.782 2.237 3.479 . 0 0 "[ . 1 . 2]" 1
45 1 7 PRO HD3 1 10 LEU MD1 3.650 . 5.500 3.069 2.718 3.439 . 0 0 "[ . 1 . 2]" 1
46 1 7 PRO HG2 1 10 LEU MD1 3.650 . 5.500 3.357 2.326 3.782 . 0 0 "[ . 1 . 2]" 1
47 1 7 PRO HG2 1 10 LEU HG 3.400 . 5.000 2.846 2.214 3.585 . 0 0 "[ . 1 . 2]" 1
48 1 7 PRO HG3 1 10 LEU MD1 3.650 . 5.500 3.765 2.608 4.349 . 0 0 "[ . 1 . 2]" 1
49 1 7 PRO HG3 1 10 LEU HG 3.400 . 5.000 4.123 3.570 4.895 . 0 0 "[ . 1 . 2]" 1
50 1 8 GLU H 1 8 GLU HA 2.650 . 3.500 2.799 2.797 2.805 . 0 0 "[ . 1 . 2]" 1
51 1 8 GLU H 1 8 GLU HB2 2.300 . 2.800 2.150 1.947 2.575 . 0 0 "[ . 1 . 2]" 1
52 1 8 GLU H 1 8 GLU HB3 2.650 . 3.500 2.917 2.316 3.519 0.019 20 0 "[ . 1 . 2]" 1
53 1 8 GLU H 1 8 GLU QG 3.550 . 5.300 3.706 2.416 4.008 . 0 0 "[ . 1 . 2]" 1
54 1 8 GLU H 1 9 GLU H 2.650 . 3.500 2.832 2.813 2.922 . 0 0 "[ . 1 . 2]" 1
55 1 8 GLU HA 1 8 GLU HB2 2.650 . 3.500 2.680 2.386 3.021 . 0 0 "[ . 1 . 2]" 1
56 1 8 GLU HA 1 8 GLU HB3 2.650 . 3.500 2.944 2.589 3.038 . 0 0 "[ . 1 . 2]" 1
57 1 8 GLU HA 1 8 GLU QG 2.800 . 3.800 2.298 2.010 2.783 . 0 0 "[ . 1 . 2]" 1
58 1 8 GLU HA 1 9 GLU H 3.400 . 5.000 3.527 3.481 3.580 . 0 0 "[ . 1 . 2]" 1
59 1 8 GLU HA 1 11 VAL H 2.650 . 3.500 3.416 3.279 3.507 0.007 16 0 "[ . 1 . 2]" 1
60 1 8 GLU HA 1 11 VAL HB 2.650 . 3.500 2.218 2.097 2.457 . 0 0 "[ . 1 . 2]" 1
61 1 8 GLU HA 1 11 VAL MG1 3.650 . 5.500 3.463 3.303 3.751 . 0 0 "[ . 1 . 2]" 1
62 1 8 GLU HA 1 11 VAL MG2 3.650 . 5.500 2.735 2.062 3.236 . 0 0 "[ . 1 . 2]" 1
63 1 8 GLU HA 1 12 HIS H 3.400 . 5.000 3.917 3.695 4.124 . 0 0 "[ . 1 . 2]" 1
64 1 8 GLU QG 1 11 VAL MG1 4.300 . 6.800 3.832 3.342 4.601 . 0 0 "[ . 1 . 2]" 1
65 1 8 GLU QG 1 12 HIS HD2 3.550 . 5.300 3.562 1.861 4.403 . 0 0 "[ . 1 . 2]" 1
66 1 9 GLU H 1 9 GLU HA 2.650 . 3.500 2.831 2.794 2.837 . 0 0 "[ . 1 . 2]" 1
67 1 9 GLU H 1 9 GLU QB 2.800 . 3.800 2.133 1.922 2.362 . 0 0 "[ . 1 . 2]" 1
68 1 9 GLU H 1 9 GLU QG 2.800 . 3.800 2.679 1.970 3.474 . 0 0 "[ . 1 . 2]" 1
69 1 9 GLU H 1 10 LEU H 2.650 . 3.500 2.848 2.784 2.910 . 0 0 "[ . 1 . 2]" 1
70 1 9 GLU HA 1 9 GLU QG 2.800 . 3.800 2.324 1.997 3.299 . 0 0 "[ . 1 . 2]" 1
71 1 9 GLU HA 1 10 LEU H 2.650 . 3.500 3.567 3.541 3.576 0.076 16 0 "[ . 1 . 2]" 1
72 1 9 GLU HA 1 12 HIS QB 2.800 . 3.800 3.147 2.924 3.390 . 0 0 "[ . 1 . 2]" 1
73 1 9 GLU HA 1 13 ALA H 3.400 . 5.000 4.999 4.895 5.040 0.040 18 0 "[ . 1 . 2]" 1
74 1 9 GLU QB 1 43 LEU QB 4.200 . 6.600 2.651 1.814 3.427 . 0 0 "[ . 1 . 2]" 1
75 1 9 GLU QB 1 43 LEU MD1 3.800 . 5.800 3.024 1.786 3.814 0.014 14 0 "[ . 1 . 2]" 1
76 1 9 GLU QB 1 43 LEU MD2 3.800 . 5.800 3.566 2.392 4.182 . 0 0 "[ . 1 . 2]" 1
77 1 9 GLU QG 1 10 LEU H 3.550 . 5.300 4.087 1.870 4.436 . 0 0 "[ . 1 . 2]" 1
78 1 9 GLU QG 1 43 LEU MD1 4.300 . 6.800 4.144 2.161 4.918 . 0 0 "[ . 1 . 2]" 1
79 1 10 LEU H 1 10 LEU HA 2.650 . 3.500 2.908 2.897 2.939 . 0 0 "[ . 1 . 2]" 1
80 1 10 LEU H 1 10 LEU HB2 2.300 . 2.800 2.231 2.139 2.316 . 0 0 "[ . 1 . 2]" 1
81 1 10 LEU H 1 10 LEU HB3 2.650 . 3.500 3.510 3.481 3.525 0.025 6 0 "[ . 1 . 2]" 1
82 1 10 LEU H 1 10 LEU MD1 3.650 . 5.500 3.615 3.387 3.752 . 0 0 "[ . 1 . 2]" 1
83 1 10 LEU H 1 10 LEU MD2 3.650 . 5.500 3.468 3.134 3.787 . 0 0 "[ . 1 . 2]" 1
84 1 10 LEU H 1 10 LEU HG 2.650 . 3.500 2.395 2.164 2.659 . 0 0 "[ . 1 . 2]" 1
85 1 10 LEU H 1 11 VAL H 2.300 . 2.800 2.553 2.465 2.622 . 0 0 "[ . 1 . 2]" 1
86 1 10 LEU HA 1 10 LEU HB2 2.650 . 3.500 3.025 3.008 3.034 . 0 0 "[ . 1 . 2]" 1
87 1 10 LEU HA 1 10 LEU MD1 3.650 . 5.500 3.741 3.674 3.805 . 0 0 "[ . 1 . 2]" 1
88 1 10 LEU HA 1 10 LEU MD2 2.900 . 4.000 1.913 1.821 2.042 . 0 0 "[ . 1 . 2]" 1
89 1 10 LEU HA 1 10 LEU HG 3.400 . 5.000 2.918 2.661 3.128 . 0 0 "[ . 1 . 2]" 1
90 1 10 LEU HA 1 11 VAL H 2.650 . 3.500 3.556 3.541 3.569 0.069 15 0 "[ . 1 . 2]" 1
91 1 10 LEU HA 1 13 ALA H 2.650 . 3.500 3.341 3.225 3.471 . 0 0 "[ . 1 . 2]" 1
92 1 10 LEU HA 1 13 ALA MB 3.650 . 5.500 2.705 2.327 3.194 . 0 0 "[ . 1 . 2]" 1
93 1 10 LEU HA 1 15 TRP HD1 2.650 . 3.500 2.939 2.795 3.141 . 0 0 "[ . 1 . 2]" 1
94 1 10 LEU HA 1 43 LEU MD1 3.650 . 5.500 2.604 1.875 4.465 . 0 0 "[ . 1 . 2]" 1
95 1 10 LEU HA 1 43 LEU MD2 4.150 . 6.500 4.103 2.744 4.823 . 0 0 "[ . 1 . 2]" 1
96 1 10 LEU HB2 1 11 VAL H 2.650 . 3.500 2.553 2.375 2.672 . 0 0 "[ . 1 . 2]" 1
97 1 10 LEU HB2 1 15 TRP HB2 3.400 . 5.000 3.903 3.654 4.061 . 0 0 "[ . 1 . 2]" 1
98 1 10 LEU HB2 1 15 TRP HB3 3.400 . 5.000 4.867 4.453 5.009 0.009 12 0 "[ . 1 . 2]" 1
99 1 10 LEU HB2 1 15 TRP HD1 3.400 . 5.000 4.921 4.801 5.018 0.018 3 0 "[ . 1 . 2]" 1
100 1 10 LEU HB3 1 11 VAL H 2.650 . 3.500 3.455 3.312 3.516 0.016 11 0 "[ . 1 . 2]" 1
101 1 10 LEU HB3 1 15 TRP HB2 3.400 . 5.000 2.366 2.107 2.691 . 0 0 "[ . 1 . 2]" 1
102 1 10 LEU HB3 1 15 TRP HB3 3.400 . 5.000 3.313 2.975 3.570 . 0 0 "[ . 1 . 2]" 1
103 1 10 LEU HB3 1 15 TRP HD1 2.650 . 3.500 3.441 3.298 3.515 0.015 20 0 "[ . 1 . 2]" 1
104 1 10 LEU MD1 1 15 TRP HB2 3.650 . 5.500 3.935 3.305 4.357 . 0 0 "[ . 1 . 2]" 1
105 1 10 LEU MD1 1 15 TRP HB3 3.650 . 5.500 3.937 3.304 4.442 . 0 0 "[ . 1 . 2]" 1
106 1 10 LEU MD1 1 40 MET HA 4.150 . 6.500 3.603 3.323 3.827 . 0 0 "[ . 1 . 2]" 1
107 1 10 LEU MD1 1 40 MET HG2 3.650 . 5.500 3.248 2.875 3.547 . 0 0 "[ . 1 . 2]" 1
108 1 10 LEU MD1 1 40 MET HG3 3.650 . 5.500 4.237 3.871 4.631 . 0 0 "[ . 1 . 2]" 1
109 1 10 LEU MD1 1 41 PRO HD2 4.150 . 6.500 1.917 1.788 2.246 0.012 7 0 "[ . 1 . 2]" 1
110 1 10 LEU MD1 1 41 PRO HD3 3.650 . 5.500 3.412 3.105 3.773 . 0 0 "[ . 1 . 2]" 1
111 1 10 LEU MD2 1 13 ALA MB 4.400 . 7.000 3.237 3.010 3.679 . 0 0 "[ . 1 . 2]" 1
112 1 10 LEU MD2 1 15 TRP HD1 3.650 . 5.500 2.731 2.402 3.029 . 0 0 "[ . 1 . 2]" 1
113 1 10 LEU MD2 1 41 PRO HB2 3.650 . 5.500 2.906 2.483 3.311 . 0 0 "[ . 1 . 2]" 1
114 1 10 LEU MD2 1 41 PRO HB3 3.650 . 5.500 4.108 3.765 4.464 . 0 0 "[ . 1 . 2]" 1
115 1 10 LEU MD2 1 41 PRO HG2 3.650 . 5.500 1.954 1.730 2.318 0.070 16 0 "[ . 1 . 2]" 1
116 1 10 LEU MD2 1 41 PRO HG3 3.650 . 5.500 3.367 3.079 3.721 . 0 0 "[ . 1 . 2]" 1
117 1 10 LEU MD2 1 42 VAL HA 3.650 . 5.500 3.265 2.848 3.717 . 0 0 "[ . 1 . 2]" 1
118 1 10 LEU MD2 1 43 LEU H 3.650 . 5.500 4.099 3.766 4.440 . 0 0 "[ . 1 . 2]" 1
119 1 10 LEU MD2 1 43 LEU HA 3.650 . 5.500 4.159 3.761 4.442 . 0 0 "[ . 1 . 2]" 1
120 1 10 LEU MD2 1 43 LEU QB 4.300 . 6.800 2.402 1.885 3.108 . 0 0 "[ . 1 . 2]" 1
121 1 10 LEU MD2 1 43 LEU MD1 3.900 . 6.000 2.273 1.759 4.004 0.041 17 0 "[ . 1 . 2]" 1
122 1 10 LEU MD2 1 43 LEU HG 3.650 . 5.500 3.507 2.036 4.108 . 0 0 "[ . 1 . 2]" 1
123 1 10 LEU HG 1 43 LEU MD1 4.150 . 6.500 3.745 2.402 5.465 . 0 0 "[ . 1 . 2]" 1
124 1 11 VAL H 1 11 VAL HA 2.650 . 3.500 2.821 2.796 2.844 . 0 0 "[ . 1 . 2]" 1
125 1 11 VAL H 1 11 VAL HB 2.300 . 2.800 2.395 2.239 2.574 . 0 0 "[ . 1 . 2]" 1
126 1 11 VAL H 1 11 VAL MG2 2.900 . 4.000 2.116 1.850 2.309 . 0 0 "[ . 1 . 2]" 1
127 1 11 VAL H 1 12 HIS H 2.650 . 3.500 2.769 2.686 2.850 . 0 0 "[ . 1 . 2]" 1
128 1 11 VAL HA 1 11 VAL MG1 2.900 . 4.000 2.411 2.254 2.524 . 0 0 "[ . 1 . 2]" 1
129 1 11 VAL HA 1 11 VAL MG2 2.900 . 4.000 2.267 2.129 2.416 . 0 0 "[ . 1 . 2]" 1
130 1 11 VAL HA 1 12 HIS H 2.650 . 3.500 3.537 3.503 3.563 0.063 5 0 "[ . 1 . 2]" 1
131 1 11 VAL HA 1 14 GLY H 3.400 . 5.000 3.616 3.357 4.206 . 0 0 "[ . 1 . 2]" 1
132 1 11 VAL HA 1 15 TRP H 2.650 . 3.500 3.308 3.049 3.521 0.021 12 0 "[ . 1 . 2]" 1
133 1 11 VAL HB 1 12 HIS H 2.650 . 3.500 2.654 2.437 2.889 . 0 0 "[ . 1 . 2]" 1
134 1 11 VAL MG1 1 12 HIS H 3.650 . 5.500 3.441 2.974 3.736 . 0 0 "[ . 1 . 2]" 1
135 1 11 VAL MG1 1 12 HIS HA 3.650 . 5.500 3.563 3.147 3.889 . 0 0 "[ . 1 . 2]" 1
136 1 11 VAL MG1 1 12 HIS QB 4.300 . 6.800 4.449 3.964 4.851 . 0 0 "[ . 1 . 2]" 1
137 1 11 VAL MG1 1 12 HIS HD2 3.650 . 5.500 3.771 2.958 4.408 . 0 0 "[ . 1 . 2]" 1
138 1 11 VAL MG2 1 15 TRP H 4.150 . 6.500 4.818 4.664 5.083 . 0 0 "[ . 1 . 2]" 1
139 1 12 HIS H 1 12 HIS HA 2.650 . 3.500 2.867 2.844 2.871 . 0 0 "[ . 1 . 2]" 1
140 1 12 HIS H 1 12 HIS QB 2.800 . 3.800 1.946 1.920 2.024 . 0 0 "[ . 1 . 2]" 1
141 1 12 HIS H 1 13 ALA H 2.650 . 3.500 2.685 2.631 2.745 . 0 0 "[ . 1 . 2]" 1
142 1 12 HIS HA 1 12 HIS HD2 2.650 . 3.500 2.601 1.943 3.498 . 0 0 "[ . 1 . 2]" 1
143 1 12 HIS QB 1 12 HIS HD2 3.550 . 5.300 3.089 2.775 3.317 . 0 0 "[ . 1 . 2]" 1
144 1 12 HIS QB 1 13 ALA H 2.800 . 3.800 2.623 2.485 2.826 . 0 0 "[ . 1 . 2]" 1
145 1 13 ALA H 1 13 ALA HA 2.650 . 3.500 2.871 2.865 2.894 . 0 0 "[ . 1 . 2]" 1
146 1 13 ALA H 1 13 ALA MB 2.900 . 4.000 1.969 1.910 2.128 . 0 0 "[ . 1 . 2]" 1
147 1 13 ALA H 1 14 GLY H 2.650 . 3.500 2.721 2.574 3.051 . 0 0 "[ . 1 . 2]" 1
148 1 13 ALA HA 1 14 GLY H 2.650 . 3.500 3.542 3.504 3.574 0.074 17 0 "[ . 1 . 2]" 1
149 1 13 ALA HA 1 32 PHE QD 3.650 . 5.500 4.714 3.633 5.239 . 0 0 "[ . 1 . 2]" 1
150 1 13 ALA MB 1 14 GLY H 3.650 . 5.500 2.520 1.862 2.877 . 0 0 "[ . 1 . 2]" 1
151 1 13 ALA MB 1 15 TRP H 3.650 . 5.500 3.205 2.744 3.385 . 0 0 "[ . 1 . 2]" 1
152 1 13 ALA MB 1 15 TRP HD1 2.900 . 4.000 1.891 1.755 2.206 0.045 16 0 "[ . 1 . 2]" 1
153 1 13 ALA MB 1 30 ASN HD21 4.150 . 6.500 3.933 3.399 4.858 . 0 0 "[ . 1 . 2]" 1
154 1 13 ALA MB 1 30 ASN HD22 3.650 . 5.500 2.621 2.081 3.351 . 0 0 "[ . 1 . 2]" 1
155 1 13 ALA MB 1 43 LEU MD1 3.900 . 6.000 2.395 1.664 3.589 0.136 9 0 "[ . 1 . 2]" 1
156 1 13 ALA MB 1 43 LEU MD2 3.900 . 6.000 3.181 1.932 3.934 . 0 0 "[ . 1 . 2]" 1
157 1 14 GLY H 1 14 GLY HA2 2.300 . 2.800 2.560 2.455 2.761 . 0 0 "[ . 1 . 2]" 1
158 1 14 GLY H 1 14 GLY HA3 2.650 . 3.500 2.980 2.914 2.993 . 0 0 "[ . 1 . 2]" 1
159 1 14 GLY HA2 1 15 TRP H 2.650 . 3.500 3.008 2.873 3.294 . 0 0 "[ . 1 . 2]" 1
160 1 14 GLY HA2 1 32 PHE QD 3.650 . 5.500 4.109 3.564 4.908 . 0 0 "[ . 1 . 2]" 1
161 1 14 GLY HA3 1 15 TRP H 3.400 . 5.000 3.498 3.309 3.553 . 0 0 "[ . 1 . 2]" 1
162 1 14 GLY HA3 1 30 ASN HD21 3.400 . 5.000 4.084 3.805 4.505 . 0 0 "[ . 1 . 2]" 1
163 1 14 GLY HA3 1 30 ASN HD22 2.650 . 3.500 3.431 3.155 3.527 0.027 2 0 "[ . 1 . 2]" 1
164 1 14 GLY HA3 1 32 PHE QD 3.650 . 5.500 3.114 2.674 3.868 . 0 0 "[ . 1 . 2]" 1
165 1 15 TRP H 1 15 TRP HA 2.650 . 3.500 2.950 2.861 2.962 . 0 0 "[ . 1 . 2]" 1
166 1 15 TRP H 1 15 TRP HB2 2.300 . 2.800 2.188 2.159 2.253 . 0 0 "[ . 1 . 2]" 1
167 1 15 TRP H 1 15 TRP HB3 2.650 . 3.500 3.511 3.497 3.531 0.031 16 0 "[ . 1 . 2]" 1
168 1 15 TRP H 1 15 TRP HD1 2.650 . 3.500 2.762 2.546 2.981 . 0 0 "[ . 1 . 2]" 1
169 1 15 TRP HA 1 15 TRP HB2 2.650 . 3.500 3.020 3.015 3.029 . 0 0 "[ . 1 . 2]" 1
170 1 15 TRP HA 1 15 TRP HB3 2.650 . 3.500 2.596 2.562 2.616 . 0 0 "[ . 1 . 2]" 1
171 1 15 TRP HA 1 15 TRP HE3 2.650 . 3.500 2.974 2.767 3.085 . 0 0 "[ . 1 . 2]" 1
172 1 15 TRP HA 1 16 GLU H 2.300 . 2.800 2.355 2.253 2.445 . 0 0 "[ . 1 . 2]" 1
173 1 15 TRP HA 1 30 ASN HA 2.650 . 3.500 2.108 1.916 2.214 . 0 0 "[ . 1 . 2]" 1
174 1 15 TRP HA 1 30 ASN HB2 3.400 . 5.000 3.952 3.648 4.100 . 0 0 "[ . 1 . 2]" 1
175 1 15 TRP HA 1 30 ASN HB3 3.400 . 5.000 4.853 4.531 5.013 0.013 14 0 "[ . 1 . 2]" 1
176 1 15 TRP HA 1 31 ARG H 2.650 . 3.500 3.513 3.477 3.535 0.035 8 0 "[ . 1 . 2]" 1
177 1 15 TRP HB2 1 15 TRP HD1 2.650 . 3.500 2.586 2.554 2.605 . 0 0 "[ . 1 . 2]" 1
178 1 15 TRP HB3 1 15 TRP HE3 2.650 . 3.500 2.728 2.687 2.811 . 0 0 "[ . 1 . 2]" 1
179 1 15 TRP HE1 1 30 ASN HD21 3.400 . 5.000 4.032 3.619 4.835 . 0 0 "[ . 1 . 2]" 1
180 1 15 TRP HE1 1 30 ASN HD22 3.400 . 5.000 3.250 2.896 3.717 . 0 0 "[ . 1 . 2]" 1
181 1 15 TRP HE3 1 16 GLU H 2.650 . 3.500 3.070 2.879 3.414 . 0 0 "[ . 1 . 2]" 1
182 1 15 TRP HE3 1 28 TYR HA 3.400 . 5.000 3.845 3.716 4.154 . 0 0 "[ . 1 . 2]" 1
183 1 15 TRP HE3 1 28 TYR HB2 2.650 . 3.500 3.520 3.511 3.528 0.028 6 0 "[ . 1 . 2]" 1
184 1 15 TRP HE3 1 28 TYR HB3 2.650 . 3.500 2.065 1.947 2.311 . 0 0 "[ . 1 . 2]" 1
185 1 15 TRP HE3 1 28 TYR QD 3.650 . 5.500 3.487 3.229 3.905 . 0 0 "[ . 1 . 2]" 1
186 1 15 TRP HE3 1 29 PHE H 2.650 . 3.500 3.432 2.994 3.514 0.014 15 0 "[ . 1 . 2]" 1
187 1 15 TRP HE3 1 29 PHE HA 3.400 . 5.000 4.244 3.819 4.423 . 0 0 "[ . 1 . 2]" 1
188 1 15 TRP HE3 1 30 ASN HB2 3.400 . 5.000 3.723 3.529 3.881 . 0 0 "[ . 1 . 2]" 1
189 1 15 TRP HH2 1 30 ASN HB2 3.400 . 5.000 3.465 3.163 3.638 . 0 0 "[ . 1 . 2]" 1
190 1 15 TRP HH2 1 35 GLN HB3 3.400 . 5.000 2.433 2.056 2.865 . 0 0 "[ . 1 . 2]" 1
191 1 15 TRP HH2 1 35 GLN HG2 3.400 . 5.000 3.256 2.797 4.587 . 0 0 "[ . 1 . 2]" 1
192 1 15 TRP HH2 1 37 LEU MD1 3.650 . 5.500 1.951 1.801 2.213 . 0 0 "[ . 1 . 2]" 1
193 1 15 TRP HH2 1 37 LEU MD2 3.650 . 5.500 2.927 2.731 3.115 . 0 0 "[ . 1 . 2]" 1
194 1 15 TRP HH2 1 37 LEU HG 2.650 . 3.500 1.969 1.868 2.338 . 0 0 "[ . 1 . 2]" 1
195 1 15 TRP HZ2 1 30 ASN HB2 3.400 . 5.000 3.695 3.391 4.064 . 0 0 "[ . 1 . 2]" 1
196 1 15 TRP HZ2 1 30 ASN HD21 3.400 . 5.000 4.719 4.484 5.013 0.013 17 0 "[ . 1 . 2]" 1
197 1 15 TRP HZ2 1 30 ASN HD22 3.400 . 5.000 4.715 4.445 4.976 . 0 0 "[ . 1 . 2]" 1
198 1 15 TRP HZ2 1 37 LEU MD1 3.650 . 5.500 3.049 2.922 3.192 . 0 0 "[ . 1 . 2]" 1
199 1 15 TRP HZ2 1 41 PRO HB3 3.400 . 5.000 3.829 3.488 4.213 . 0 0 "[ . 1 . 2]" 1
200 1 15 TRP HZ2 1 41 PRO HG2 3.400 . 5.000 4.882 4.602 5.013 0.013 17 0 "[ . 1 . 2]" 1
201 1 15 TRP HZ2 1 41 PRO HG3 3.400 . 5.000 4.142 3.922 4.337 . 0 0 "[ . 1 . 2]" 1
202 1 15 TRP HZ3 1 28 TYR HB2 3.400 . 5.000 2.926 2.680 3.165 . 0 0 "[ . 1 . 2]" 1
203 1 15 TRP HZ3 1 28 TYR HB3 3.400 . 5.000 2.821 2.550 3.281 . 0 0 "[ . 1 . 2]" 1
204 1 15 TRP HZ3 1 29 PHE HA 3.400 . 5.000 3.706 3.321 3.919 . 0 0 "[ . 1 . 2]" 1
205 1 15 TRP HZ3 1 30 ASN H 2.650 . 3.500 3.381 3.026 3.513 0.013 6 0 "[ . 1 . 2]" 1
206 1 15 TRP HZ3 1 30 ASN HB2 3.400 . 5.000 3.474 3.172 3.701 . 0 0 "[ . 1 . 2]" 1
207 1 15 TRP HZ3 1 35 GLN HB3 3.400 . 5.000 3.246 3.016 3.534 . 0 0 "[ . 1 . 2]" 1
208 1 15 TRP HZ3 1 36 SER HA 3.400 . 5.000 3.875 3.594 4.176 . 0 0 "[ . 1 . 2]" 1
209 1 15 TRP HZ3 1 37 LEU H 3.400 . 5.000 2.428 2.248 2.744 . 0 0 "[ . 1 . 2]" 1
210 1 15 TRP HZ3 1 37 LEU MD1 3.650 . 5.500 2.686 2.318 3.039 . 0 0 "[ . 1 . 2]" 1
211 1 15 TRP HZ3 1 37 LEU MD2 3.650 . 5.500 3.898 3.669 4.092 . 0 0 "[ . 1 . 2]" 1
212 1 15 TRP HZ3 1 37 LEU HG 2.650 . 3.500 2.170 1.894 2.405 . 0 0 "[ . 1 . 2]" 1
213 1 16 GLU H 1 16 GLU HA 2.650 . 3.500 2.947 2.926 2.990 . 0 0 "[ . 1 . 2]" 1
214 1 16 GLU H 1 16 GLU QB 2.800 . 3.800 3.125 2.690 3.279 . 0 0 "[ . 1 . 2]" 1
215 1 16 GLU H 1 16 GLU HG3 2.650 . 3.500 2.688 2.023 3.509 0.009 14 0 "[ . 1 . 2]" 1
216 1 16 GLU H 1 30 ASN HA 3.400 . 5.000 3.751 3.535 3.938 . 0 0 "[ . 1 . 2]" 1
217 1 16 GLU HA 1 16 GLU HG2 3.400 . 5.000 3.565 2.402 4.209 . 0 0 "[ . 1 . 2]" 1
218 1 16 GLU HA 1 16 GLU HG3 3.400 . 5.000 3.591 3.422 3.958 . 0 0 "[ . 1 . 2]" 1
219 1 16 GLU HA 1 17 LYS H 2.300 . 2.800 2.228 2.210 2.309 . 0 0 "[ . 1 . 2]" 1
220 1 16 GLU QB 1 17 LYS H 2.800 . 3.800 3.279 2.914 3.406 . 0 0 "[ . 1 . 2]" 1
221 1 16 GLU QB 1 29 PHE HB3 4.050 . 6.300 4.297 3.224 4.870 . 0 0 "[ . 1 . 2]" 1
222 1 16 GLU QB 1 29 PHE QD 4.300 . 6.800 4.148 2.862 4.761 . 0 0 "[ . 1 . 2]" 1
223 1 16 GLU HG3 1 29 PHE QD 3.650 . 5.500 3.271 2.621 4.183 . 0 0 "[ . 1 . 2]" 1
224 1 17 LYS H 1 17 LYS HA 2.650 . 3.500 2.922 2.900 2.981 . 0 0 "[ . 1 . 2]" 1
225 1 17 LYS H 1 17 LYS HB2 2.650 . 3.500 2.199 2.035 2.427 . 0 0 "[ . 1 . 2]" 1
226 1 17 LYS H 1 17 LYS HB3 2.650 . 3.500 2.776 2.471 2.973 . 0 0 "[ . 1 . 2]" 1
227 1 17 LYS HA 1 17 LYS HB2 2.650 . 3.500 2.665 2.514 2.762 . 0 0 "[ . 1 . 2]" 1
228 1 17 LYS HA 1 17 LYS HB3 2.650 . 3.500 2.991 2.943 3.035 . 0 0 "[ . 1 . 2]" 1
229 1 17 LYS HA 1 17 LYS QD 3.550 . 5.300 3.902 3.174 4.028 . 0 0 "[ . 1 . 2]" 1
230 1 17 LYS HA 1 17 LYS QE 3.550 . 5.300 4.303 3.791 4.742 . 0 0 "[ . 1 . 2]" 1
231 1 17 LYS HA 1 17 LYS HG2 2.650 . 3.500 2.436 2.002 2.951 . 0 0 "[ . 1 . 2]" 1
232 1 17 LYS HA 1 17 LYS HG3 3.400 . 5.000 2.667 2.307 3.321 . 0 0 "[ . 1 . 2]" 1
233 1 17 LYS HA 1 18 CYS H 2.300 . 2.800 2.225 2.211 2.245 . 0 0 "[ . 1 . 2]" 1
234 1 17 LYS HA 1 28 TYR HA 2.650 . 3.500 2.660 2.368 3.039 . 0 0 "[ . 1 . 2]" 1
235 1 17 LYS HA 1 29 PHE H 3.400 . 5.000 3.871 3.625 4.148 . 0 0 "[ . 1 . 2]" 1
236 1 17 LYS HB2 1 17 LYS QD 2.800 . 3.800 2.643 2.260 3.157 . 0 0 "[ . 1 . 2]" 1
237 1 17 LYS HB2 1 17 LYS QE 3.550 . 5.300 4.098 3.754 4.356 . 0 0 "[ . 1 . 2]" 1
238 1 17 LYS HB2 1 17 LYS HG2 2.650 . 3.500 2.988 2.745 3.035 . 0 0 "[ . 1 . 2]" 1
239 1 17 LYS HB2 1 17 LYS HG3 2.650 . 3.500 2.359 2.252 2.495 . 0 0 "[ . 1 . 2]" 1
240 1 17 LYS HB2 1 18 CYS H 3.400 . 5.000 4.490 4.300 4.617 . 0 0 "[ . 1 . 2]" 1
241 1 17 LYS HB3 1 17 LYS QD 3.550 . 5.300 2.182 1.926 2.669 . 0 0 "[ . 1 . 2]" 1
242 1 17 LYS HB3 1 17 LYS QE 3.550 . 5.300 3.704 2.845 4.134 . 0 0 "[ . 1 . 2]" 1
243 1 17 LYS HB3 1 17 LYS HG2 2.650 . 3.500 2.626 2.444 2.950 . 0 0 "[ . 1 . 2]" 1
244 1 17 LYS HB3 1 17 LYS HG3 2.650 . 3.500 2.985 2.741 3.033 . 0 0 "[ . 1 . 2]" 1
245 1 17 LYS HB3 1 18 CYS H 3.400 . 5.000 3.983 3.762 4.250 . 0 0 "[ . 1 . 2]" 1
246 1 17 LYS QD 1 28 TYR QE 3.800 . 5.800 4.082 3.080 4.814 . 0 0 "[ . 1 . 2]" 1
247 1 17 LYS QE 1 17 LYS HG2 3.550 . 5.300 2.278 1.952 3.170 . 0 0 "[ . 1 . 2]" 1
248 1 17 LYS QE 1 17 LYS HG3 3.550 . 5.300 2.660 2.099 3.252 . 0 0 "[ . 1 . 2]" 1
249 1 17 LYS QE 1 26 PRO HB2 3.550 . 5.300 2.544 1.804 3.271 . 0 0 "[ . 1 . 2]" 1
250 1 17 LYS QE 1 26 PRO HG2 3.550 . 5.300 3.789 3.416 4.392 . 0 0 "[ . 1 . 2]" 1
251 1 17 LYS QE 1 26 PRO HG3 3.550 . 5.300 4.131 3.666 4.510 . 0 0 "[ . 1 . 2]" 1
252 1 17 LYS QE 1 28 TYR QE 3.800 . 5.800 4.248 3.475 4.815 . 0 0 "[ . 1 . 2]" 1
253 1 17 LYS HG2 1 18 CYS H 2.650 . 3.500 2.924 2.596 3.252 . 0 0 "[ . 1 . 2]" 1
254 1 17 LYS HG2 1 26 PRO HB2 3.400 . 5.000 3.575 3.170 4.164 . 0 0 "[ . 1 . 2]" 1
255 1 17 LYS HG2 1 27 TYR H 3.400 . 5.000 3.440 3.105 3.970 . 0 0 "[ . 1 . 2]" 1
256 1 17 LYS HG2 1 28 TYR HA 3.400 . 5.000 4.502 3.737 4.999 . 0 0 "[ . 1 . 2]" 1
257 1 17 LYS HG3 1 18 CYS H 3.400 . 5.000 4.066 3.119 4.746 . 0 0 "[ . 1 . 2]" 1
258 1 17 LYS HG3 1 26 PRO HB2 3.400 . 5.000 4.609 3.663 5.002 0.002 2 0 "[ . 1 . 2]" 1
259 1 17 LYS HG3 1 28 TYR QE 3.650 . 5.500 3.198 2.575 4.006 . 0 0 "[ . 1 . 2]" 1
260 1 18 CYS H 1 18 CYS HB2 2.650 . 3.500 2.661 2.457 2.793 . 0 0 "[ . 1 . 2]" 1
261 1 18 CYS H 1 18 CYS HB3 3.400 . 5.000 3.789 3.508 3.889 . 0 0 "[ . 1 . 2]" 1
262 1 18 CYS H 1 27 TYR H 2.650 . 3.500 2.774 2.556 3.118 . 0 0 "[ . 1 . 2]" 1
263 1 18 CYS H 1 27 TYR QD 4.150 . 6.500 3.903 3.710 4.200 . 0 0 "[ . 1 . 2]" 1
264 1 18 CYS H 1 28 TYR HA 3.400 . 5.000 3.538 3.380 3.674 . 0 0 "[ . 1 . 2]" 1
265 1 18 CYS H 1 28 TYR QD 3.650 . 5.500 5.239 5.077 5.285 . 0 0 "[ . 1 . 2]" 1
266 1 18 CYS HA 1 18 CYS HB2 2.650 . 3.500 3.023 2.947 3.038 . 0 0 "[ . 1 . 2]" 1
267 1 18 CYS HA 1 18 CYS HB3 2.650 . 3.500 2.550 2.443 2.755 . 0 0 "[ . 1 . 2]" 1
268 1 18 CYS HA 1 19 TRP H 2.300 . 2.800 2.609 2.496 2.769 . 0 0 "[ . 1 . 2]" 1
269 1 18 CYS HB2 1 19 TRP H 2.650 . 3.500 3.470 3.349 3.511 0.011 2 0 "[ . 1 . 2]" 1
270 1 18 CYS HB2 1 27 TYR H 3.400 . 5.000 4.545 4.331 4.831 . 0 0 "[ . 1 . 2]" 1
271 1 18 CYS HB2 1 27 TYR QD 3.650 . 5.500 4.276 4.024 4.665 . 0 0 "[ . 1 . 2]" 1
272 1 18 CYS HB2 1 27 TYR QE 3.650 . 5.500 3.024 2.729 3.427 . 0 0 "[ . 1 . 2]" 1
273 1 18 CYS HB3 1 19 TRP H 2.650 . 3.500 2.234 1.961 2.505 . 0 0 "[ . 1 . 2]" 1
274 1 18 CYS HB3 1 27 TYR QE 3.650 . 5.500 3.305 2.898 3.771 . 0 0 "[ . 1 . 2]" 1
275 1 19 TRP H 1 19 TRP HA 2.650 . 3.500 3.002 2.995 3.007 . 0 0 "[ . 1 . 2]" 1
276 1 19 TRP H 1 19 TRP HB2 2.650 . 3.500 3.013 2.883 3.120 . 0 0 "[ . 1 . 2]" 1
277 1 19 TRP H 1 19 TRP HB3 2.650 . 3.500 2.384 2.297 2.441 . 0 0 "[ . 1 . 2]" 1
278 1 19 TRP H 1 27 TYR QE 3.650 . 5.500 3.412 3.170 3.634 . 0 0 "[ . 1 . 2]" 1
279 1 19 TRP HA 1 19 TRP HB2 2.650 . 3.500 2.420 2.392 2.442 . 0 0 "[ . 1 . 2]" 1
280 1 19 TRP HA 1 19 TRP HB3 2.650 . 3.500 3.033 3.027 3.037 . 0 0 "[ . 1 . 2]" 1
281 1 19 TRP HA 1 19 TRP HE3 2.650 . 3.500 3.209 3.047 3.344 . 0 0 "[ . 1 . 2]" 1
282 1 19 TRP HA 1 20 SER H 2.650 . 3.500 2.258 2.244 2.272 . 0 0 "[ . 1 . 2]" 1
283 1 19 TRP HA 1 26 PRO HA 2.650 . 3.500 1.850 1.831 1.864 . 0 0 "[ . 1 . 2]" 1
284 1 19 TRP HA 1 26 PRO HB2 3.400 . 5.000 4.347 4.302 4.380 . 0 0 "[ . 1 . 2]" 1
285 1 19 TRP HA 1 26 PRO HB3 3.400 . 5.000 3.335 3.290 3.367 . 0 0 "[ . 1 . 2]" 1
286 1 19 TRP HA 1 26 PRO HG3 3.400 . 5.000 5.065 5.052 5.085 0.085 3 0 "[ . 1 . 2]" 1
287 1 19 TRP HA 1 27 TYR H 3.400 . 5.000 3.737 3.645 3.826 . 0 0 "[ . 1 . 2]" 1
288 1 19 TRP HB2 1 19 TRP HD1 3.400 . 5.000 3.818 3.791 3.835 . 0 0 "[ . 1 . 2]" 1
289 1 19 TRP HB2 1 19 TRP HE3 2.650 . 3.500 2.603 2.568 2.656 . 0 0 "[ . 1 . 2]" 1
290 1 19 TRP HB2 1 20 SER H 3.400 . 5.000 4.494 4.434 4.533 . 0 0 "[ . 1 . 2]" 1
291 1 19 TRP HB2 1 26 PRO HA 3.400 . 5.000 3.701 3.618 3.785 . 0 0 "[ . 1 . 2]" 1
292 1 19 TRP HB3 1 19 TRP HD1 2.650 . 3.500 2.662 2.622 2.694 . 0 0 "[ . 1 . 2]" 1
293 1 19 TRP HB3 1 19 TRP HE3 3.400 . 5.000 4.134 4.106 4.168 . 0 0 "[ . 1 . 2]" 1
294 1 19 TRP HB3 1 20 SER H 3.400 . 5.000 4.491 4.469 4.517 . 0 0 "[ . 1 . 2]" 1
295 1 19 TRP HB3 1 26 PRO HA 3.400 . 5.000 4.768 4.717 4.814 . 0 0 "[ . 1 . 2]" 1
296 1 19 TRP HD1 1 21 ARG HA 2.650 . 3.500 3.440 3.235 3.517 0.017 13 0 "[ . 1 . 2]" 1
297 1 19 TRP HD1 1 21 ARG QB 3.550 . 5.300 4.419 3.975 4.665 . 0 0 "[ . 1 . 2]" 1
298 1 19 TRP HD1 1 21 ARG QD 3.550 . 5.300 4.152 2.782 4.675 . 0 0 "[ . 1 . 2]" 1
299 1 19 TRP HD1 1 21 ARG HG2 3.400 . 5.000 3.379 2.366 4.975 . 0 0 "[ . 1 . 2]" 1
300 1 19 TRP HD1 1 21 ARG HG3 3.400 . 5.000 3.495 2.619 4.813 . 0 0 "[ . 1 . 2]" 1
301 1 19 TRP HE1 1 21 ARG HA 2.650 . 3.500 2.740 2.329 2.954 . 0 0 "[ . 1 . 2]" 1
302 1 19 TRP HE1 1 24 ASN H 3.400 . 5.000 4.718 4.486 4.845 . 0 0 "[ . 1 . 2]" 1
303 1 19 TRP HE1 1 24 ASN HA 2.650 . 3.500 3.190 2.963 3.412 . 0 0 "[ . 1 . 2]" 1
304 1 19 TRP HE3 1 20 SER H 3.400 . 5.000 4.989 4.875 5.019 0.019 15 0 "[ . 1 . 2]" 1
305 1 19 TRP HE3 1 26 PRO HA 2.650 . 3.500 3.394 3.164 3.504 0.004 16 0 "[ . 1 . 2]" 1
306 1 19 TRP HE3 1 26 PRO HB3 3.400 . 5.000 2.743 2.506 2.901 . 0 0 "[ . 1 . 2]" 1
307 1 19 TRP HE3 1 26 PRO HG3 2.650 . 3.500 3.198 3.030 3.300 . 0 0 "[ . 1 . 2]" 1
308 1 19 TRP HH2 1 24 ASN HA 3.400 . 5.000 4.774 4.448 4.996 . 0 0 "[ . 1 . 2]" 1
309 1 19 TRP HH2 1 25 ARG HA 3.400 . 5.000 2.908 2.744 3.042 . 0 0 "[ . 1 . 2]" 1
310 1 19 TRP HH2 1 26 PRO HD3 3.400 . 5.000 3.890 3.577 4.135 . 0 0 "[ . 1 . 2]" 1
311 1 19 TRP HZ2 1 24 ASN HA 2.650 . 3.500 2.970 2.697 3.140 . 0 0 "[ . 1 . 2]" 1
312 1 19 TRP HZ2 1 24 ASN HB2 3.400 . 5.000 4.726 4.529 4.963 . 0 0 "[ . 1 . 2]" 1
313 1 19 TRP HZ2 1 24 ASN HB3 3.400 . 5.000 4.862 4.596 5.010 0.010 18 0 "[ . 1 . 2]" 1
314 1 19 TRP HZ2 1 25 ARG HA 3.400 . 5.000 3.816 3.619 4.089 . 0 0 "[ . 1 . 2]" 1
315 1 19 TRP HZ3 1 25 ARG HA 2.650 . 3.500 2.695 2.552 2.830 . 0 0 "[ . 1 . 2]" 1
316 1 19 TRP HZ3 1 26 PRO HD2 3.400 . 5.000 3.995 3.706 4.175 . 0 0 "[ . 1 . 2]" 1
317 1 19 TRP HZ3 1 26 PRO HD3 2.650 . 3.500 2.232 1.943 2.404 . 0 0 "[ . 1 . 2]" 1
318 1 19 TRP HZ3 1 26 PRO HG3 2.650 . 3.500 3.162 2.810 3.406 . 0 0 "[ . 1 . 2]" 1
319 1 20 SER H 1 20 SER HB2 2.650 . 3.500 2.256 2.014 2.660 . 0 0 "[ . 1 . 2]" 1
320 1 20 SER H 1 20 SER HB3 2.650 . 3.500 2.672 2.247 3.005 . 0 0 "[ . 1 . 2]" 1
321 1 20 SER H 1 25 ARG H 2.650 . 3.500 3.556 3.534 3.582 0.082 8 0 "[ . 1 . 2]" 1
322 1 20 SER H 1 26 PRO HA 2.650 . 3.500 2.922 2.838 2.987 . 0 0 "[ . 1 . 2]" 1
323 1 20 SER H 1 27 TYR QD 3.650 . 5.500 2.262 2.139 2.376 . 0 0 "[ . 1 . 2]" 1
324 1 20 SER H 1 27 TYR QE 3.650 . 5.500 2.248 2.131 2.460 . 0 0 "[ . 1 . 2]" 1
325 1 20 SER HA 1 20 SER HB2 2.650 . 3.500 2.613 2.407 2.775 . 0 0 "[ . 1 . 2]" 1
326 1 20 SER HA 1 20 SER HB3 2.650 . 3.500 3.005 2.934 3.037 . 0 0 "[ . 1 . 2]" 1
327 1 20 SER HA 1 21 ARG H 3.400 . 5.000 2.221 2.211 2.238 . 0 0 "[ . 1 . 2]" 1
328 1 20 SER HA 1 27 TYR QD 3.650 . 5.500 4.548 4.379 4.671 . 0 0 "[ . 1 . 2]" 1
329 1 20 SER HA 1 27 TYR QE 2.900 . 4.000 2.912 2.825 2.980 . 0 0 "[ . 1 . 2]" 1
330 1 20 SER HB2 1 23 GLU HB2 3.400 . 5.000 3.656 3.472 3.929 . 0 0 "[ . 1 . 2]" 1
331 1 20 SER HB2 1 23 GLU HB3 3.400 . 5.000 4.471 4.146 4.772 . 0 0 "[ . 1 . 2]" 1
332 1 20 SER HB2 1 27 TYR QD 3.650 . 5.500 2.888 2.642 3.298 . 0 0 "[ . 1 . 2]" 1
333 1 20 SER HB2 1 27 TYR QE 3.650 . 5.500 2.585 2.447 2.706 . 0 0 "[ . 1 . 2]" 1
334 1 20 SER HB2 1 38 TRP HH2 3.400 . 5.000 3.784 3.288 4.310 . 0 0 "[ . 1 . 2]" 1
335 1 20 SER HB2 1 38 TRP HZ3 3.400 . 5.000 2.898 2.594 3.524 . 0 0 "[ . 1 . 2]" 1
336 1 20 SER HB3 1 23 GLU HB2 3.400 . 5.000 2.324 2.082 2.627 . 0 0 "[ . 1 . 2]" 1
337 1 20 SER HB3 1 23 GLU HB3 3.900 . 6.000 3.123 2.920 3.368 . 0 0 "[ . 1 . 2]" 1
338 1 20 SER HB3 1 25 ARG H 2.650 . 3.500 3.348 3.238 3.508 0.008 20 0 "[ . 1 . 2]" 1
339 1 20 SER HB3 1 27 TYR QD 3.650 . 5.500 3.881 3.379 4.363 . 0 0 "[ . 1 . 2]" 1
340 1 20 SER HB3 1 27 TYR QE 3.650 . 5.500 3.935 3.448 4.161 . 0 0 "[ . 1 . 2]" 1
341 1 20 SER HB3 1 38 TRP HH2 3.400 . 5.000 3.565 3.042 4.162 . 0 0 "[ . 1 . 2]" 1
342 1 20 SER HB3 1 38 TRP HZ3 3.400 . 5.000 2.872 2.317 3.381 . 0 0 "[ . 1 . 2]" 1
343 1 21 ARG H 1 21 ARG QB 3.550 . 5.300 2.105 1.918 2.411 . 0 0 "[ . 1 . 2]" 1
344 1 21 ARG H 1 22 ARG H 3.400 . 5.000 2.601 2.480 2.744 . 0 0 "[ . 1 . 2]" 1
345 1 21 ARG HA 1 21 ARG QD 3.550 . 5.300 3.374 1.869 4.181 . 0 0 "[ . 1 . 2]" 1
346 1 21 ARG HA 1 21 ARG HG2 2.650 . 3.500 2.561 2.019 3.250 . 0 0 "[ . 1 . 2]" 1
347 1 21 ARG HA 1 21 ARG HG3 2.650 . 3.500 2.906 1.926 3.518 0.018 13 0 "[ . 1 . 2]" 1
348 1 21 ARG HA 1 22 ARG H 3.400 . 5.000 3.542 3.479 3.586 . 0 0 "[ . 1 . 2]" 1
349 1 21 ARG QB 1 22 ARG H 2.800 . 3.800 2.705 2.342 3.021 . 0 0 "[ . 1 . 2]" 1
350 1 22 ARG H 1 22 ARG HA 2.650 . 3.500 2.861 2.808 2.916 . 0 0 "[ . 1 . 2]" 1
351 1 22 ARG H 1 22 ARG HB2 2.650 . 3.500 2.067 1.942 2.377 . 0 0 "[ . 1 . 2]" 1
352 1 22 ARG H 1 22 ARG HB3 2.650 . 3.500 3.287 2.626 3.523 0.023 17 0 "[ . 1 . 2]" 1
353 1 22 ARG H 1 23 GLU H 2.650 . 3.500 2.753 2.576 2.888 . 0 0 "[ . 1 . 2]" 1
354 1 22 ARG HA 1 22 ARG HB2 2.650 . 3.500 2.905 2.587 3.030 . 0 0 "[ . 1 . 2]" 1
355 1 22 ARG HA 1 22 ARG HB3 2.650 . 3.500 2.768 2.527 3.019 . 0 0 "[ . 1 . 2]" 1
356 1 22 ARG HA 1 22 ARG HD2 3.400 . 5.000 4.361 3.953 4.680 . 0 0 "[ . 1 . 2]" 1
357 1 22 ARG HA 1 22 ARG HD3 3.400 . 5.000 4.397 3.657 4.738 . 0 0 "[ . 1 . 2]" 1
358 1 22 ARG HA 1 22 ARG HG2 2.650 . 3.500 2.573 1.979 3.001 . 0 0 "[ . 1 . 2]" 1
359 1 22 ARG HA 1 22 ARG HG3 2.650 . 3.500 2.485 1.980 3.240 . 0 0 "[ . 1 . 2]" 1
360 1 22 ARG HA 1 23 GLU H 2.650 . 3.500 3.566 3.556 3.573 0.073 12 0 "[ . 1 . 2]" 1
361 1 22 ARG HB2 1 22 ARG HD2 2.650 . 3.500 2.511 1.982 3.367 . 0 0 "[ . 1 . 2]" 1
362 1 22 ARG HB2 1 22 ARG HD3 2.650 . 3.500 3.067 2.615 3.474 . 0 0 "[ . 1 . 2]" 1
363 1 22 ARG HB2 1 23 GLU H 2.650 . 3.500 2.809 2.351 3.507 0.007 14 0 "[ . 1 . 2]" 1
364 1 22 ARG HB3 1 22 ARG HD2 2.650 . 3.500 3.132 2.729 3.500 0.000 11 0 "[ . 1 . 2]" 1
365 1 22 ARG HB3 1 22 ARG HD3 2.650 . 3.500 2.749 1.989 3.493 . 0 0 "[ . 1 . 2]" 1
366 1 22 ARG HB3 1 23 GLU H 2.650 . 3.500 2.858 2.223 3.438 . 0 0 "[ . 1 . 2]" 1
367 1 22 ARG HD2 1 22 ARG HG2 2.650 . 3.500 2.983 2.855 3.044 . 0 0 "[ . 1 . 2]" 1
368 1 22 ARG HD2 1 22 ARG HG3 2.650 . 3.500 2.535 2.274 2.880 . 0 0 "[ . 1 . 2]" 1
369 1 22 ARG HD3 1 22 ARG HG2 2.650 . 3.500 2.477 2.267 2.781 . 0 0 "[ . 1 . 2]" 1
370 1 22 ARG HD3 1 22 ARG HG3 2.650 . 3.500 2.979 2.838 3.040 . 0 0 "[ . 1 . 2]" 1
371 1 23 GLU H 1 23 GLU HA 2.650 . 3.500 2.931 2.926 2.952 . 0 0 "[ . 1 . 2]" 1
372 1 23 GLU H 1 23 GLU HB2 2.650 . 3.500 1.970 1.958 2.006 . 0 0 "[ . 1 . 2]" 1
373 1 23 GLU H 1 23 GLU HB3 2.650 . 3.500 3.202 3.184 3.238 . 0 0 "[ . 1 . 2]" 1
374 1 23 GLU H 1 23 GLU HG2 2.650 . 3.500 3.522 3.506 3.532 0.032 19 0 "[ . 1 . 2]" 1
375 1 23 GLU H 1 23 GLU HG3 3.400 . 5.000 4.286 4.198 4.331 . 0 0 "[ . 1 . 2]" 1
376 1 23 GLU H 1 24 ASN H 2.650 . 3.500 2.442 2.348 2.459 . 0 0 "[ . 1 . 2]" 1
377 1 23 GLU HA 1 23 GLU HB2 2.650 . 3.500 2.884 2.877 2.902 . 0 0 "[ . 1 . 2]" 1
378 1 23 GLU HA 1 23 GLU HB3 2.650 . 3.500 2.833 2.811 2.840 . 0 0 "[ . 1 . 2]" 1
379 1 23 GLU HA 1 23 GLU HG2 2.650 . 3.500 2.514 2.370 2.605 . 0 0 "[ . 1 . 2]" 1
380 1 23 GLU HA 1 23 GLU HG3 2.650 . 3.500 3.506 3.500 3.513 0.013 1 0 "[ . 1 . 2]" 1
381 1 23 GLU HB2 1 24 ASN H 2.650 . 3.500 3.502 3.442 3.529 0.029 12 0 "[ . 1 . 2]" 1
382 1 23 GLU HB2 1 38 TRP HH2 3.400 . 5.000 2.587 1.905 3.050 . 0 0 "[ . 1 . 2]" 1
383 1 23 GLU HB3 1 24 ASN H 2.650 . 3.500 3.546 3.519 3.559 0.059 12 0 "[ . 1 . 2]" 1
384 1 23 GLU HG2 1 38 TRP HH2 2.650 . 3.500 2.973 2.758 3.289 . 0 0 "[ . 1 . 2]" 1
385 1 23 GLU HG2 1 38 TRP HZ2 3.400 . 5.000 3.805 3.363 4.203 . 0 0 "[ . 1 . 2]" 1
386 1 23 GLU HG3 1 38 TRP HH2 3.400 . 5.000 2.573 2.180 3.090 . 0 0 "[ . 1 . 2]" 1
387 1 23 GLU HG3 1 38 TRP HZ2 3.400 . 5.000 3.421 3.031 3.785 . 0 0 "[ . 1 . 2]" 1
388 1 24 ASN H 1 24 ASN HA 2.300 . 2.800 2.360 2.358 2.362 . 0 0 "[ . 1 . 2]" 1
389 1 24 ASN H 1 24 ASN HB2 2.650 . 3.500 3.089 3.068 3.105 . 0 0 "[ . 1 . 2]" 1
390 1 24 ASN H 1 24 ASN HB3 2.650 . 3.500 3.524 3.504 3.543 0.043 5 0 "[ . 1 . 2]" 1
391 1 24 ASN H 1 25 ARG H 2.650 . 3.500 2.816 2.776 2.858 . 0 0 "[ . 1 . 2]" 1
392 1 24 ASN HA 1 24 ASN HB2 2.650 . 3.500 2.483 2.468 2.496 . 0 0 "[ . 1 . 2]" 1
393 1 24 ASN HA 1 24 ASN HB3 2.650 . 3.500 3.035 3.033 3.037 . 0 0 "[ . 1 . 2]" 1
394 1 24 ASN HA 1 25 ARG H 2.300 . 2.800 2.778 2.726 2.822 0.022 10 0 "[ . 1 . 2]" 1
395 1 24 ASN HB2 1 24 ASN HD21 3.400 . 5.000 2.684 2.296 3.456 . 0 0 "[ . 1 . 2]" 1
396 1 24 ASN HB3 1 24 ASN HD21 2.650 . 3.500 2.981 2.252 3.558 0.058 20 0 "[ . 1 . 2]" 1
397 1 25 ARG H 1 25 ARG HB2 3.400 . 5.000 3.989 3.958 4.024 . 0 0 "[ . 1 . 2]" 1
398 1 25 ARG H 1 25 ARG HB3 2.650 . 3.500 3.526 3.499 3.546 0.046 11 0 "[ . 1 . 2]" 1
399 1 25 ARG H 1 25 ARG HG3 2.650 . 3.500 2.330 2.210 3.261 . 0 0 "[ . 1 . 2]" 1
400 1 25 ARG HA 1 25 ARG HB2 2.650 . 3.500 2.526 2.498 2.537 . 0 0 "[ . 1 . 2]" 1
401 1 25 ARG HA 1 25 ARG HB3 2.650 . 3.500 2.424 2.414 2.449 . 0 0 "[ . 1 . 2]" 1
402 1 25 ARG HA 1 25 ARG HD2 3.400 . 5.000 4.770 4.520 5.011 0.011 16 0 "[ . 1 . 2]" 1
403 1 25 ARG HA 1 25 ARG HD3 3.400 . 5.000 4.272 4.013 5.062 0.062 8 0 "[ . 1 . 2]" 1
404 1 25 ARG HA 1 25 ARG HG2 3.400 . 5.000 4.071 3.683 4.175 . 0 0 "[ . 1 . 2]" 1
405 1 25 ARG HA 1 25 ARG HG3 3.400 . 5.000 3.516 3.494 3.722 . 0 0 "[ . 1 . 2]" 1
406 1 25 ARG HA 1 26 PRO HD2 2.650 . 3.500 3.098 3.056 3.168 . 0 0 "[ . 1 . 2]" 1
407 1 25 ARG HA 1 26 PRO HD3 2.650 . 3.500 2.082 2.041 2.127 . 0 0 "[ . 1 . 2]" 1
408 1 25 ARG HB2 1 25 ARG HD2 3.400 . 5.000 3.125 2.337 3.413 . 0 0 "[ . 1 . 2]" 1
409 1 25 ARG HB2 1 25 ARG HD3 3.400 . 5.000 2.072 1.930 3.432 . 0 0 "[ . 1 . 2]" 1
410 1 25 ARG HB2 1 25 ARG HG3 2.650 . 3.500 2.871 2.467 2.963 . 0 0 "[ . 1 . 2]" 1
411 1 25 ARG HB2 1 26 PRO HD2 3.400 . 5.000 1.864 1.833 1.903 . 0 0 "[ . 1 . 2]" 1
412 1 25 ARG HB2 1 26 PRO HD3 3.400 . 5.000 2.633 2.513 2.688 . 0 0 "[ . 1 . 2]" 1
413 1 25 ARG HB3 1 25 ARG HD2 3.400 . 5.000 3.995 2.681 4.182 . 0 0 "[ . 1 . 2]" 1
414 1 25 ARG HB3 1 25 ARG HD3 3.400 . 5.000 3.231 2.869 3.400 . 0 0 "[ . 1 . 2]" 1
415 1 25 ARG HB3 1 26 PRO HD2 2.650 . 3.500 3.470 3.437 3.511 0.011 13 0 "[ . 1 . 2]" 1
416 1 25 ARG HB3 1 26 PRO HD3 2.650 . 3.500 3.553 3.540 3.561 0.061 5 0 "[ . 1 . 2]" 1
417 1 25 ARG HD2 1 25 ARG HG2 2.650 . 3.500 2.893 2.752 3.042 . 0 0 "[ . 1 . 2]" 1
418 1 25 ARG HD2 1 25 ARG HG3 2.650 . 3.500 2.300 2.262 2.686 . 0 0 "[ . 1 . 2]" 1
419 1 25 ARG HD3 1 25 ARG HG2 2.650 . 3.500 2.795 2.309 2.949 . 0 0 "[ . 1 . 2]" 1
420 1 25 ARG HD3 1 25 ARG HG3 2.650 . 3.500 2.901 2.766 3.040 . 0 0 "[ . 1 . 2]" 1
421 1 25 ARG HD3 1 38 TRP HE3 3.400 . 5.000 3.572 3.190 5.031 0.031 8 0 "[ . 1 . 2]" 1
422 1 25 ARG HD3 1 38 TRP HZ3 3.400 . 5.000 4.174 3.649 4.943 . 0 0 "[ . 1 . 2]" 1
423 1 25 ARG HG2 1 38 TRP HE3 3.400 . 5.000 4.990 4.853 5.034 0.034 9 0 "[ . 1 . 2]" 1
424 1 25 ARG HG2 1 38 TRP HZ3 3.400 . 5.000 4.413 3.826 4.846 . 0 0 "[ . 1 . 2]" 1
425 1 25 ARG HG3 1 38 TRP HE3 3.400 . 5.000 4.499 3.469 4.900 . 0 0 "[ . 1 . 2]" 1
426 1 25 ARG HG3 1 38 TRP HZ3 3.400 . 5.000 3.414 2.690 3.987 . 0 0 "[ . 1 . 2]" 1
427 1 26 PRO HA 1 27 TYR H 2.300 . 2.800 2.420 2.376 2.459 . 0 0 "[ . 1 . 2]" 1
428 1 26 PRO HB2 1 27 TYR H 2.650 . 3.500 2.721 2.666 2.791 . 0 0 "[ . 1 . 2]" 1
429 1 26 PRO HB3 1 27 TYR H 2.650 . 3.500 3.532 3.519 3.558 0.058 6 0 "[ . 1 . 2]" 1
430 1 27 TYR H 1 27 TYR HA 2.650 . 3.500 2.903 2.881 2.924 . 0 0 "[ . 1 . 2]" 1
431 1 27 TYR H 1 27 TYR HB3 3.400 . 5.000 3.370 3.318 3.404 . 0 0 "[ . 1 . 2]" 1
432 1 27 TYR H 1 27 TYR QD 2.900 . 4.000 2.232 2.138 2.295 . 0 0 "[ . 1 . 2]" 1
433 1 27 TYR HA 1 27 TYR HB2 2.650 . 3.500 2.446 2.430 2.465 . 0 0 "[ . 1 . 2]" 1
434 1 27 TYR HA 1 27 TYR HB3 2.650 . 3.500 2.503 2.484 2.519 . 0 0 "[ . 1 . 2]" 1
435 1 27 TYR HA 1 27 TYR QD 3.650 . 5.500 3.658 3.649 3.666 . 0 0 "[ . 1 . 2]" 1
436 1 27 TYR HA 1 28 TYR H 2.650 . 3.500 2.966 2.900 3.056 . 0 0 "[ . 1 . 2]" 1
437 1 27 TYR HA 1 38 TRP HA 2.650 . 3.500 2.741 2.611 2.921 . 0 0 "[ . 1 . 2]" 1
438 1 27 TYR HA 1 38 TRP HE3 2.650 . 3.500 3.533 3.514 3.554 0.054 3 0 "[ . 1 . 2]" 1
439 1 27 TYR HB2 1 28 TYR H 2.650 . 3.500 1.944 1.880 1.986 . 0 0 "[ . 1 . 2]" 1
440 1 27 TYR HB2 1 38 TRP HA 3.400 . 5.000 1.991 1.877 2.106 . 0 0 "[ . 1 . 2]" 1
441 1 27 TYR HB2 1 38 TRP HE3 3.400 . 5.000 2.433 2.217 2.623 . 0 0 "[ . 1 . 2]" 1
442 1 27 TYR HB2 1 38 TRP HZ3 3.400 . 5.000 3.624 3.389 3.817 . 0 0 "[ . 1 . 2]" 1
443 1 27 TYR HB3 1 28 TYR H 2.650 . 3.500 3.466 3.400 3.516 0.016 3 0 "[ . 1 . 2]" 1
444 1 27 TYR HB3 1 38 TRP HA 3.400 . 5.000 2.872 2.802 2.994 . 0 0 "[ . 1 . 2]" 1
445 1 27 TYR HB3 1 38 TRP HE3 3.400 . 5.000 1.854 1.840 1.882 . 0 0 "[ . 1 . 2]" 1
446 1 27 TYR HB3 1 38 TRP HZ3 3.400 . 5.000 2.602 2.434 2.721 . 0 0 "[ . 1 . 2]" 1
447 1 27 TYR QD 1 28 TYR H 3.650 . 5.500 2.146 1.973 2.311 . 0 0 "[ . 1 . 2]" 1
448 1 27 TYR QD 1 28 TYR HA 3.650 . 5.500 4.151 4.091 4.207 . 0 0 "[ . 1 . 2]" 1
449 1 27 TYR QD 1 29 PHE HB2 3.650 . 5.500 3.828 3.751 3.916 . 0 0 "[ . 1 . 2]" 1
450 1 27 TYR QD 1 29 PHE QD 4.400 . 7.000 4.920 4.633 5.143 . 0 0 "[ . 1 . 2]" 1
451 1 27 TYR QD 1 36 SER HA 3.650 . 5.500 3.331 3.191 3.479 . 0 0 "[ . 1 . 2]" 1
452 1 27 TYR QD 1 36 SER QB 3.800 . 5.800 3.573 3.222 3.708 . 0 0 "[ . 1 . 2]" 1
453 1 27 TYR QD 1 37 LEU H 3.650 . 5.500 3.462 3.391 3.514 . 0 0 "[ . 1 . 2]" 1
454 1 27 TYR QD 1 38 TRP HE3 3.650 . 5.500 3.859 3.742 3.978 . 0 0 "[ . 1 . 2]" 1
455 1 27 TYR QD 1 38 TRP HH2 3.650 . 5.500 4.769 4.596 4.863 . 0 0 "[ . 1 . 2]" 1
456 1 27 TYR QD 1 38 TRP HZ3 3.650 . 5.500 3.484 3.321 3.613 . 0 0 "[ . 1 . 2]" 1
457 1 27 TYR QE 1 29 PHE HB2 3.650 . 5.500 1.994 1.893 2.154 . 0 0 "[ . 1 . 2]" 1
458 1 27 TYR QE 1 29 PHE HB3 3.650 . 5.500 3.639 3.521 3.815 . 0 0 "[ . 1 . 2]" 1
459 1 27 TYR QE 1 29 PHE QD 3.900 . 6.000 3.093 2.558 3.561 . 0 0 "[ . 1 . 2]" 1
460 1 27 TYR QE 1 36 SER QB 3.800 . 5.800 3.063 2.582 3.293 . 0 0 "[ . 1 . 2]" 1
461 1 28 TYR H 1 28 TYR HB2 2.650 . 3.500 2.575 2.506 2.659 . 0 0 "[ . 1 . 2]" 1
462 1 28 TYR H 1 28 TYR QD 2.900 . 4.000 2.740 2.367 3.030 . 0 0 "[ . 1 . 2]" 1
463 1 28 TYR H 1 37 LEU H 2.650 . 3.500 3.532 3.511 3.570 0.070 12 0 "[ . 1 . 2]" 1
464 1 28 TYR H 1 37 LEU HB2 3.400 . 5.000 3.575 3.396 3.701 . 0 0 "[ . 1 . 2]" 1
465 1 28 TYR H 1 38 TRP HA 3.400 . 5.000 3.129 3.003 3.268 . 0 0 "[ . 1 . 2]" 1
466 1 28 TYR HA 1 28 TYR HB2 2.650 . 3.500 3.034 3.029 3.038 . 0 0 "[ . 1 . 2]" 1
467 1 28 TYR HA 1 28 TYR HB3 2.650 . 3.500 2.529 2.477 2.561 . 0 0 "[ . 1 . 2]" 1
468 1 28 TYR HA 1 28 TYR QD 2.900 . 4.000 2.952 2.714 3.106 . 0 0 "[ . 1 . 2]" 1
469 1 28 TYR HA 1 29 PHE H 2.300 . 2.800 2.228 2.212 2.279 . 0 0 "[ . 1 . 2]" 1
470 1 28 TYR HB2 1 28 TYR QD 2.900 . 4.000 2.452 2.367 2.535 . 0 0 "[ . 1 . 2]" 1
471 1 28 TYR HB2 1 37 LEU H 3.400 . 5.000 3.099 2.937 3.238 . 0 0 "[ . 1 . 2]" 1
472 1 28 TYR HB2 1 37 LEU HB2 3.400 . 5.000 1.981 1.918 2.037 . 0 0 "[ . 1 . 2]" 1
473 1 28 TYR HB2 1 37 LEU HB3 3.400 . 5.000 3.578 3.506 3.635 . 0 0 "[ . 1 . 2]" 1
474 1 28 TYR HB2 1 37 LEU MD1 4.150 . 6.500 3.498 3.280 3.608 . 0 0 "[ . 1 . 2]" 1
475 1 28 TYR HB2 1 41 PRO HB3 3.400 . 5.000 4.953 4.731 5.014 0.014 2 0 "[ . 1 . 2]" 1
476 1 28 TYR HB3 1 28 TYR QD 2.900 . 4.000 2.386 2.334 2.474 . 0 0 "[ . 1 . 2]" 1
477 1 28 TYR HB3 1 29 PHE H 2.650 . 3.500 3.380 3.110 3.519 0.019 9 0 "[ . 1 . 2]" 1
478 1 28 TYR HB3 1 37 LEU H 3.400 . 5.000 4.042 3.900 4.222 . 0 0 "[ . 1 . 2]" 1
479 1 28 TYR HB3 1 37 LEU HB2 3.400 . 5.000 3.367 3.329 3.439 . 0 0 "[ . 1 . 2]" 1
480 1 28 TYR HB3 1 37 LEU HB3 3.400 . 5.000 5.013 5.003 5.030 0.030 9 0 "[ . 1 . 2]" 1
481 1 28 TYR HB3 1 37 LEU MD1 4.150 . 6.500 3.858 3.593 4.110 . 0 0 "[ . 1 . 2]" 1
482 1 28 TYR HB3 1 41 PRO HB3 3.400 . 5.000 4.854 4.637 5.006 0.006 5 0 "[ . 1 . 2]" 1
483 1 28 TYR QD 1 29 PHE H 3.650 . 5.500 4.244 4.084 4.486 . 0 0 "[ . 1 . 2]" 1
484 1 28 TYR QD 1 38 TRP HA 3.650 . 5.500 3.299 2.988 3.529 . 0 0 "[ . 1 . 2]" 1
485 1 28 TYR QD 1 39 GLU H 3.650 . 5.500 2.624 2.434 2.942 . 0 0 "[ . 1 . 2]" 1
486 1 28 TYR QD 1 39 GLU HA 3.650 . 5.500 3.125 2.928 3.331 . 0 0 "[ . 1 . 2]" 1
487 1 28 TYR QD 1 40 MET HA 3.650 . 5.500 3.311 3.001 3.501 . 0 0 "[ . 1 . 2]" 1
488 1 28 TYR QD 1 40 MET HB2 3.650 . 5.500 5.260 5.204 5.292 . 0 0 "[ . 1 . 2]" 1
489 1 28 TYR QD 1 40 MET HG2 3.650 . 5.500 3.675 3.425 3.954 . 0 0 "[ . 1 . 2]" 1
490 1 28 TYR QD 1 41 PRO HD3 3.650 . 5.500 2.887 2.611 3.216 . 0 0 "[ . 1 . 2]" 1
491 1 28 TYR QE 1 39 GLU HA 3.650 . 5.500 1.966 1.864 2.255 . 0 0 "[ . 1 . 2]" 1
492 1 28 TYR QE 1 40 MET H 3.650 . 5.500 2.439 2.224 2.858 . 0 0 "[ . 1 . 2]" 1
493 1 28 TYR QE 1 40 MET HA 3.650 . 5.500 2.869 2.684 3.161 . 0 0 "[ . 1 . 2]" 1
494 1 28 TYR QE 1 40 MET HB2 3.650 . 5.500 3.814 3.647 3.950 . 0 0 "[ . 1 . 2]" 1
495 1 28 TYR QE 1 40 MET HG2 3.650 . 5.500 2.057 1.851 2.533 . 0 0 "[ . 1 . 2]" 1
496 1 29 PHE H 1 29 PHE HB2 2.650 . 3.500 3.177 3.051 3.331 . 0 0 "[ . 1 . 2]" 1
497 1 29 PHE H 1 29 PHE HB3 2.650 . 3.500 2.457 2.392 2.647 . 0 0 "[ . 1 . 2]" 1
498 1 29 PHE HA 1 29 PHE HB2 2.650 . 3.500 2.400 2.374 2.429 . 0 0 "[ . 1 . 2]" 1
499 1 29 PHE HA 1 29 PHE HB3 2.650 . 3.500 3.028 3.021 3.033 . 0 0 "[ . 1 . 2]" 1
500 1 29 PHE HA 1 29 PHE QD 3.650 . 5.500 2.664 2.249 3.044 . 0 0 "[ . 1 . 2]" 1
501 1 29 PHE HA 1 30 ASN H 2.300 . 2.800 2.221 2.209 2.238 . 0 0 "[ . 1 . 2]" 1
502 1 29 PHE HA 1 36 SER HA 2.650 . 3.500 2.302 2.099 2.444 . 0 0 "[ . 1 . 2]" 1
503 1 29 PHE HA 1 36 SER QB 4.050 . 6.300 3.694 3.524 3.853 . 0 0 "[ . 1 . 2]" 1
504 1 29 PHE HA 1 37 LEU H 3.400 . 5.000 3.517 3.248 3.643 . 0 0 "[ . 1 . 2]" 1
505 1 29 PHE HB2 1 30 ASN H 3.400 . 5.000 4.408 4.371 4.450 . 0 0 "[ . 1 . 2]" 1
506 1 29 PHE HB2 1 36 SER HA 3.400 . 5.000 3.722 3.333 3.948 . 0 0 "[ . 1 . 2]" 1
507 1 29 PHE HB3 1 29 PHE QD 2.900 . 4.000 2.352 2.301 2.463 . 0 0 "[ . 1 . 2]" 1
508 1 29 PHE HB3 1 30 ASN H 3.400 . 5.000 4.475 4.420 4.513 . 0 0 "[ . 1 . 2]" 1
509 1 29 PHE QD 1 36 SER HA 3.650 . 5.500 3.204 2.948 3.660 . 0 0 "[ . 1 . 2]" 1
510 1 29 PHE QD 1 36 SER QB 3.800 . 5.800 2.769 2.504 3.144 . 0 0 "[ . 1 . 2]" 1
511 1 29 PHE QE 1 31 ARG H 3.650 . 5.500 4.136 3.646 4.693 . 0 0 "[ . 1 . 2]" 1
512 1 29 PHE QE 1 31 ARG HA 2.900 . 4.000 2.510 1.874 3.264 . 0 0 "[ . 1 . 2]" 1
513 1 29 PHE QE 1 31 ARG HB2 3.650 . 5.500 3.403 2.898 3.842 . 0 0 "[ . 1 . 2]" 1
514 1 29 PHE QE 1 31 ARG HB3 3.650 . 5.500 3.044 2.451 3.554 . 0 0 "[ . 1 . 2]" 1
515 1 29 PHE QE 1 34 ASN HA 2.900 . 4.000 2.959 2.223 3.673 . 0 0 "[ . 1 . 2]" 1
516 1 29 PHE HZ 1 31 ARG HA 2.650 . 3.500 3.241 2.852 3.504 0.004 9 0 "[ . 1 . 2]" 1
517 1 29 PHE HZ 1 34 ASN HA 2.650 . 3.500 3.137 2.700 3.514 0.014 10 0 "[ . 1 . 2]" 1
518 1 30 ASN H 1 30 ASN HA 2.650 . 3.500 2.923 2.918 2.940 . 0 0 "[ . 1 . 2]" 1
519 1 30 ASN H 1 30 ASN HB2 2.650 . 3.500 2.191 2.097 2.260 . 0 0 "[ . 1 . 2]" 1
520 1 30 ASN H 1 30 ASN HB3 2.650 . 3.500 2.778 2.682 2.909 . 0 0 "[ . 1 . 2]" 1
521 1 30 ASN H 1 35 GLN H 2.650 . 3.500 3.464 3.344 3.523 0.023 12 0 "[ . 1 . 2]" 1
522 1 30 ASN H 1 35 GLN HB2 3.400 . 5.000 3.453 3.203 3.776 . 0 0 "[ . 1 . 2]" 1
523 1 30 ASN H 1 35 GLN HB3 3.400 . 5.000 2.916 2.586 3.319 . 0 0 "[ . 1 . 2]" 1
524 1 30 ASN H 1 36 SER HA 2.650 . 3.500 3.521 3.489 3.546 0.046 2 0 "[ . 1 . 2]" 1
525 1 30 ASN HA 1 30 ASN HB2 2.650 . 3.500 2.668 2.622 2.727 . 0 0 "[ . 1 . 2]" 1
526 1 30 ASN HA 1 30 ASN HB3 2.650 . 3.500 2.989 2.961 3.007 . 0 0 "[ . 1 . 2]" 1
527 1 30 ASN HA 1 31 ARG H 2.300 . 2.800 2.265 2.220 2.307 . 0 0 "[ . 1 . 2]" 1
528 1 30 ASN HA 1 32 PHE H 3.400 . 5.000 3.295 3.256 3.348 . 0 0 "[ . 1 . 2]" 1
529 1 30 ASN HB2 1 30 ASN HD21 2.650 . 3.500 2.959 2.797 3.340 . 0 0 "[ . 1 . 2]" 1
530 1 30 ASN HB2 1 31 ARG H 3.400 . 5.000 4.658 4.631 4.683 . 0 0 "[ . 1 . 2]" 1
531 1 30 ASN HB2 1 33 THR H 3.400 . 5.000 4.221 4.094 4.336 . 0 0 "[ . 1 . 2]" 1
532 1 30 ASN HB2 1 34 ASN H 3.400 . 5.000 5.019 4.994 5.041 0.041 4 0 "[ . 1 . 2]" 1
533 1 30 ASN HB2 1 35 GLN H 2.650 . 3.500 3.280 3.084 3.479 . 0 0 "[ . 1 . 2]" 1
534 1 30 ASN HB2 1 35 GLN HB2 3.400 . 5.000 2.395 2.059 2.868 . 0 0 "[ . 1 . 2]" 1
535 1 30 ASN HB2 1 35 GLN HB3 3.400 . 5.000 2.396 2.018 2.838 . 0 0 "[ . 1 . 2]" 1
536 1 30 ASN HB3 1 30 ASN HD21 2.650 . 3.500 3.185 2.247 3.586 0.086 19 0 "[ . 1 . 2]" 1
537 1 30 ASN HB3 1 30 ASN HD22 3.400 . 5.000 3.927 3.511 4.107 . 0 0 "[ . 1 . 2]" 1
538 1 30 ASN HB3 1 31 ARG H 3.400 . 5.000 4.265 4.139 4.321 . 0 0 "[ . 1 . 2]" 1
539 1 30 ASN HB3 1 33 THR H 3.400 . 5.000 2.683 2.404 2.878 . 0 0 "[ . 1 . 2]" 1
540 1 30 ASN HB3 1 34 ASN H 3.400 . 5.000 3.309 3.260 3.376 . 0 0 "[ . 1 . 2]" 1
541 1 30 ASN HB3 1 35 GLN H 2.650 . 3.500 1.993 1.864 2.381 . 0 0 "[ . 1 . 2]" 1
542 1 30 ASN HB3 1 35 GLN HB2 3.400 . 5.000 2.072 1.872 2.556 . 0 0 "[ . 1 . 2]" 1
543 1 30 ASN HB3 1 35 GLN HB3 3.400 . 5.000 3.105 2.975 3.427 . 0 0 "[ . 1 . 2]" 1
544 1 30 ASN HD22 1 33 THR MG 3.650 . 5.500 3.758 3.004 4.431 . 0 0 "[ . 1 . 2]" 1
545 1 31 ARG H 1 31 ARG HA 2.650 . 3.500 2.863 2.831 2.888 . 0 0 "[ . 1 . 2]" 1
546 1 31 ARG H 1 31 ARG HB2 2.650 . 3.500 3.517 3.507 3.525 0.025 17 0 "[ . 1 . 2]" 1
547 1 31 ARG H 1 31 ARG HB3 2.650 . 3.500 2.316 2.249 2.407 . 0 0 "[ . 1 . 2]" 1
548 1 31 ARG H 1 31 ARG HD3 3.400 . 5.000 3.669 3.147 4.073 . 0 0 "[ . 1 . 2]" 1
549 1 31 ARG H 1 31 ARG HG2 2.650 . 3.500 2.125 1.951 2.278 . 0 0 "[ . 1 . 2]" 1
550 1 31 ARG H 1 31 ARG HG3 2.650 . 3.500 3.451 3.340 3.509 0.009 10 0 "[ . 1 . 2]" 1
551 1 31 ARG H 1 32 PHE H 2.650 . 3.500 2.670 2.625 2.755 . 0 0 "[ . 1 . 2]" 1
552 1 31 ARG HA 1 31 ARG HB2 2.650 . 3.500 2.422 2.397 2.473 . 0 0 "[ . 1 . 2]" 1
553 1 31 ARG HA 1 31 ARG HB3 2.650 . 3.500 2.535 2.480 2.563 . 0 0 "[ . 1 . 2]" 1
554 1 31 ARG HA 1 31 ARG HD2 3.400 . 5.000 4.773 4.638 4.871 . 0 0 "[ . 1 . 2]" 1
555 1 31 ARG HA 1 31 ARG HD3 3.400 . 5.000 4.863 4.704 5.015 0.015 12 0 "[ . 1 . 2]" 1
556 1 31 ARG HA 1 31 ARG HG2 3.400 . 5.000 3.708 3.587 3.821 . 0 0 "[ . 1 . 2]" 1
557 1 31 ARG HA 1 31 ARG HG3 3.400 . 5.000 3.702 3.599 3.861 . 0 0 "[ . 1 . 2]" 1
558 1 31 ARG HA 1 32 PHE H 3.400 . 5.000 3.413 3.370 3.452 . 0 0 "[ . 1 . 2]" 1
559 1 31 ARG HA 1 34 ASN H 3.400 . 5.000 3.646 3.533 3.748 . 0 0 "[ . 1 . 2]" 1
560 1 31 ARG HA 1 34 ASN HA 3.400 . 5.000 3.524 3.394 3.684 . 0 0 "[ . 1 . 2]" 1
561 1 31 ARG HB2 1 31 ARG HD2 2.650 . 3.500 2.554 2.353 2.743 . 0 0 "[ . 1 . 2]" 1
562 1 31 ARG HB2 1 31 ARG HD3 2.650 . 3.500 3.207 2.814 3.513 0.013 1 0 "[ . 1 . 2]" 1
563 1 31 ARG HB2 1 32 PHE H 3.400 . 5.000 4.222 4.123 4.318 . 0 0 "[ . 1 . 2]" 1
564 1 31 ARG HB3 1 31 ARG HD2 2.650 . 3.500 2.944 2.589 3.327 . 0 0 "[ . 1 . 2]" 1
565 1 31 ARG HB3 1 31 ARG HD3 2.650 . 3.500 2.550 2.428 2.734 . 0 0 "[ . 1 . 2]" 1
566 1 31 ARG HB3 1 32 PHE H 3.400 . 5.000 4.107 4.046 4.193 . 0 0 "[ . 1 . 2]" 1
567 1 31 ARG HD2 1 31 ARG HG2 2.650 . 3.500 3.038 3.013 3.045 . 0 0 "[ . 1 . 2]" 1
568 1 31 ARG HD2 1 31 ARG HG3 2.650 . 3.500 2.508 2.403 2.643 . 0 0 "[ . 1 . 2]" 1
569 1 31 ARG HG2 1 32 PHE H 3.400 . 5.000 2.714 2.463 3.073 . 0 0 "[ . 1 . 2]" 1
570 1 31 ARG HG2 1 32 PHE QD 3.650 . 5.500 4.298 4.116 4.866 . 0 0 "[ . 1 . 2]" 1
571 1 31 ARG HG3 1 32 PHE H 3.400 . 5.000 3.065 2.781 3.349 . 0 0 "[ . 1 . 2]" 1
572 1 31 ARG HG3 1 32 PHE QD 3.650 . 5.500 3.613 3.146 4.463 . 0 0 "[ . 1 . 2]" 1
573 1 32 PHE H 1 32 PHE HA 2.650 . 3.500 2.938 2.910 2.958 . 0 0 "[ . 1 . 2]" 1
574 1 32 PHE H 1 32 PHE HB2 2.300 . 2.800 2.155 2.105 2.205 . 0 0 "[ . 1 . 2]" 1
575 1 32 PHE H 1 32 PHE HB3 2.300 . 2.800 2.830 2.805 2.853 0.053 10 0 "[ . 1 . 2]" 1
576 1 32 PHE H 1 32 PHE QD 3.650 . 5.500 3.944 3.861 4.044 . 0 0 "[ . 1 . 2]" 1
577 1 32 PHE H 1 33 THR H 2.300 . 2.800 2.617 2.375 2.810 0.010 15 0 "[ . 1 . 2]" 1
578 1 32 PHE HA 1 32 PHE HB2 2.650 . 3.500 2.704 2.687 2.722 . 0 0 "[ . 1 . 2]" 1
579 1 32 PHE HA 1 32 PHE HB3 2.650 . 3.500 2.976 2.968 2.985 . 0 0 "[ . 1 . 2]" 1
580 1 32 PHE HA 1 32 PHE QD 2.900 . 4.000 2.713 2.140 2.995 . 0 0 "[ . 1 . 2]" 1
581 1 32 PHE HA 1 33 THR H 3.400 . 5.000 3.590 3.576 3.595 . 0 0 "[ . 1 . 2]" 1
582 1 32 PHE HB2 1 32 PHE QD 2.900 . 4.000 2.451 2.302 2.686 . 0 0 "[ . 1 . 2]" 1
583 1 32 PHE HB2 1 33 THR H 2.650 . 3.500 3.260 3.177 3.397 . 0 0 "[ . 1 . 2]" 1
584 1 32 PHE HB2 1 33 THR MG 3.650 . 5.500 4.096 3.627 4.444 . 0 0 "[ . 1 . 2]" 1
585 1 32 PHE HB3 1 33 THR H 2.650 . 3.500 2.186 1.932 2.494 . 0 0 "[ . 1 . 2]" 1
586 1 32 PHE HB3 1 33 THR MG 3.650 . 5.500 2.784 2.065 3.371 . 0 0 "[ . 1 . 2]" 1
587 1 33 THR H 1 33 THR HA 2.650 . 3.500 2.985 2.974 2.999 . 0 0 "[ . 1 . 2]" 1
588 1 33 THR H 1 33 THR MG 2.900 . 4.000 2.105 1.841 2.624 . 0 0 "[ . 1 . 2]" 1
589 1 33 THR H 1 34 ASN H 2.300 . 2.800 2.492 2.323 2.632 . 0 0 "[ . 1 . 2]" 1
590 1 33 THR H 1 35 GLN H 3.400 . 5.000 3.309 3.197 3.444 . 0 0 "[ . 1 . 2]" 1
591 1 33 THR HA 1 33 THR MG 2.900 . 4.000 2.803 2.339 3.185 . 0 0 "[ . 1 . 2]" 1
592 1 33 THR HA 1 34 ASN H 2.650 . 3.500 3.175 3.146 3.204 . 0 0 "[ . 1 . 2]" 1
593 1 33 THR MG 1 34 ASN H 3.650 . 5.500 3.509 2.861 4.157 . 0 0 "[ . 1 . 2]" 1
594 1 34 ASN H 1 34 ASN HA 2.300 . 2.800 2.361 2.357 2.363 . 0 0 "[ . 1 . 2]" 1
595 1 34 ASN H 1 34 ASN HB2 2.650 . 3.500 3.073 2.954 3.134 . 0 0 "[ . 1 . 2]" 1
596 1 34 ASN H 1 34 ASN HB3 2.650 . 3.500 3.490 3.404 3.590 0.090 9 0 "[ . 1 . 2]" 1
597 1 34 ASN H 1 35 GLN H 2.650 . 3.500 2.750 2.720 2.789 . 0 0 "[ . 1 . 2]" 1
598 1 34 ASN HA 1 34 ASN HB2 2.650 . 3.500 2.471 2.422 2.557 . 0 0 "[ . 1 . 2]" 1
599 1 34 ASN HA 1 34 ASN HB3 2.650 . 3.500 3.034 3.022 3.038 . 0 0 "[ . 1 . 2]" 1
600 1 34 ASN HA 1 35 GLN H 2.650 . 3.500 3.150 3.111 3.186 . 0 0 "[ . 1 . 2]" 1
601 1 34 ASN HB2 1 35 GLN H 3.400 . 5.000 4.490 4.380 4.548 . 0 0 "[ . 1 . 2]" 1
602 1 34 ASN HB3 1 34 ASN HD21 3.400 . 5.000 2.889 2.249 3.617 . 0 0 "[ . 1 . 2]" 1
603 1 34 ASN HB3 1 35 GLN H 3.400 . 5.000 3.819 3.759 3.880 . 0 0 "[ . 1 . 2]" 1
604 1 35 GLN H 1 35 GLN HA 2.650 . 3.500 2.860 2.851 2.894 . 0 0 "[ . 1 . 2]" 1
605 1 35 GLN H 1 35 GLN HB2 2.650 . 3.500 1.934 1.927 1.949 . 0 0 "[ . 1 . 2]" 1
606 1 35 GLN H 1 35 GLN HB3 2.650 . 3.500 3.167 3.142 3.262 . 0 0 "[ . 1 . 2]" 1
607 1 35 GLN H 1 35 GLN HG3 2.650 . 3.500 3.559 3.542 3.578 0.078 12 0 "[ . 1 . 2]" 1
608 1 35 GLN HA 1 35 GLN HB2 2.650 . 3.500 2.844 2.831 2.896 . 0 0 "[ . 1 . 2]" 1
609 1 35 GLN HA 1 35 GLN HB3 2.650 . 3.500 2.877 2.817 2.889 . 0 0 "[ . 1 . 2]" 1
610 1 35 GLN HA 1 35 GLN HG2 2.650 . 3.500 2.578 1.930 2.733 . 0 0 "[ . 1 . 2]" 1
611 1 35 GLN HA 1 35 GLN HG3 2.650 . 3.500 2.280 2.124 3.260 . 0 0 "[ . 1 . 2]" 1
612 1 35 GLN HA 1 36 SER H 2.300 . 2.800 2.372 2.350 2.409 . 0 0 "[ . 1 . 2]" 1
613 1 35 GLN HB2 1 35 GLN HG2 2.650 . 3.500 3.014 2.834 3.032 . 0 0 "[ . 1 . 2]" 1
614 1 35 GLN HB2 1 35 GLN HG3 2.650 . 3.500 2.534 2.244 2.612 . 0 0 "[ . 1 . 2]" 1
615 1 35 GLN HB3 1 35 GLN HG2 2.650 . 3.500 2.416 2.342 2.878 . 0 0 "[ . 1 . 2]" 1
616 1 35 GLN HB3 1 35 GLN HG3 2.650 . 3.500 3.007 2.826 3.025 . 0 0 "[ . 1 . 2]" 1
617 1 35 GLN HB3 1 36 SER H 2.650 . 3.500 3.065 2.821 3.144 . 0 0 "[ . 1 . 2]" 1
618 1 35 GLN HE21 1 35 GLN HG2 2.650 . 3.500 2.369 2.248 2.965 . 0 0 "[ . 1 . 2]" 1
619 1 35 GLN HE21 1 35 GLN HG3 2.650 . 3.500 3.089 2.394 3.500 . 0 0 "[ . 1 . 2]" 1
620 1 35 GLN HE21 1 37 LEU MD1 4.150 . 6.500 3.591 2.488 5.159 . 0 0 "[ . 1 . 2]" 1
621 1 35 GLN HE21 1 37 LEU MD2 3.650 . 5.500 3.088 2.323 4.284 . 0 0 "[ . 1 . 2]" 1
622 1 35 GLN HE22 1 37 LEU MD1 4.150 . 6.500 3.741 2.992 4.290 . 0 0 "[ . 1 . 2]" 1
623 1 35 GLN HE22 1 37 LEU MD2 3.650 . 5.500 3.971 1.802 4.368 . 0 0 "[ . 1 . 2]" 1
624 1 35 GLN HG2 1 37 LEU MD2 3.650 . 5.500 3.047 2.927 4.220 . 0 0 "[ . 1 . 2]" 1
625 1 35 GLN HG3 1 37 LEU MD2 3.650 . 5.500 4.447 4.415 4.472 . 0 0 "[ . 1 . 2]" 1
626 1 36 SER H 1 36 SER HA 2.650 . 3.500 2.976 2.967 2.989 . 0 0 "[ . 1 . 2]" 1
627 1 36 SER H 1 36 SER QB 2.800 . 3.800 3.157 2.966 3.241 . 0 0 "[ . 1 . 2]" 1
628 1 36 SER HA 1 37 LEU H 2.300 . 2.800 2.351 2.306 2.385 . 0 0 "[ . 1 . 2]" 1
629 1 36 SER QB 1 37 LEU H 3.550 . 5.300 3.843 3.772 3.927 . 0 0 "[ . 1 . 2]" 1
630 1 37 LEU H 1 37 LEU HB2 2.650 . 3.500 2.388 2.339 2.444 . 0 0 "[ . 1 . 2]" 1
631 1 37 LEU H 1 37 LEU HB3 3.400 . 5.000 3.570 3.551 3.591 . 0 0 "[ . 1 . 2]" 1
632 1 37 LEU H 1 37 LEU MD1 4.150 . 6.500 3.659 3.568 3.765 . 0 0 "[ . 1 . 2]" 1
633 1 37 LEU H 1 37 LEU MD2 4.150 . 6.500 3.180 3.052 3.256 . 0 0 "[ . 1 . 2]" 1
634 1 37 LEU HA 1 37 LEU HB2 2.650 . 3.500 3.037 3.035 3.038 . 0 0 "[ . 1 . 2]" 1
635 1 37 LEU HA 1 37 LEU HB3 2.650 . 3.500 2.468 2.442 2.490 . 0 0 "[ . 1 . 2]" 1
636 1 37 LEU HA 1 37 LEU MD1 3.650 . 5.500 3.751 3.698 3.798 . 0 0 "[ . 1 . 2]" 1
637 1 37 LEU HA 1 37 LEU MD2 2.900 . 4.000 1.929 1.840 2.010 . 0 0 "[ . 1 . 2]" 1
638 1 37 LEU HA 1 37 LEU HG 3.400 . 5.000 3.163 3.115 3.210 . 0 0 "[ . 1 . 2]" 1
639 1 37 LEU HA 1 38 TRP H 2.650 . 3.500 2.755 2.716 2.795 . 0 0 "[ . 1 . 2]" 1
640 1 37 LEU HA 1 38 TRP HD1 3.400 . 5.000 3.750 3.650 3.868 . 0 0 "[ . 1 . 2]" 1
641 1 37 LEU HB2 1 38 TRP H 2.650 . 3.500 2.947 2.895 3.027 . 0 0 "[ . 1 . 2]" 1
642 1 37 LEU HB2 1 39 GLU H 2.650 . 3.500 3.059 2.984 3.133 . 0 0 "[ . 1 . 2]" 1
643 1 37 LEU HB3 1 38 TRP H 2.650 . 3.500 1.971 1.912 2.044 . 0 0 "[ . 1 . 2]" 1
644 1 37 LEU MD1 1 38 TRP H 4.150 . 6.500 3.928 3.824 4.016 . 0 0 "[ . 1 . 2]" 1
645 1 37 LEU MD1 1 39 GLU H 3.650 . 5.500 3.947 3.857 4.001 . 0 0 "[ . 1 . 2]" 1
646 1 37 LEU MD1 1 41 PRO HA 3.650 . 5.500 3.140 3.040 3.266 . 0 0 "[ . 1 . 2]" 1
647 1 37 LEU MD1 1 41 PRO HB2 3.650 . 5.500 3.308 3.037 3.464 . 0 0 "[ . 1 . 2]" 1
648 1 37 LEU MD1 1 41 PRO HB3 3.650 . 5.500 1.922 1.781 2.039 0.019 5 0 "[ . 1 . 2]" 1
649 1 37 LEU MD1 1 41 PRO HG2 3.650 . 5.500 4.092 3.652 4.299 . 0 0 "[ . 1 . 2]" 1
650 1 37 LEU MD1 1 41 PRO HG3 3.650 . 5.500 2.865 2.318 3.123 . 0 0 "[ . 1 . 2]" 1
651 1 37 LEU MD2 1 38 TRP H 3.650 . 5.500 3.477 3.387 3.581 . 0 0 "[ . 1 . 2]" 1
652 1 37 LEU MD2 1 39 GLU H 3.650 . 5.500 4.517 4.490 4.550 . 0 0 "[ . 1 . 2]" 1
653 1 37 LEU MD2 1 41 PRO HA 4.150 . 6.500 5.353 5.277 5.372 . 0 0 "[ . 1 . 2]" 1
654 1 38 TRP H 1 38 TRP HA 2.650 . 3.500 2.992 2.991 2.993 . 0 0 "[ . 1 . 2]" 1
655 1 38 TRP H 1 38 TRP HB2 2.650 . 3.500 2.620 2.587 2.680 . 0 0 "[ . 1 . 2]" 1
656 1 38 TRP H 1 38 TRP HD1 2.650 . 3.500 3.537 3.518 3.551 0.051 3 0 "[ . 1 . 2]" 1
657 1 38 TRP H 1 39 GLU H 2.300 . 2.800 1.822 1.811 1.828 . 0 0 "[ . 1 . 2]" 1
658 1 38 TRP HA 1 38 TRP HB2 2.650 . 3.500 3.035 3.033 3.037 . 0 0 "[ . 1 . 2]" 1
659 1 38 TRP HA 1 38 TRP HB3 2.650 . 3.500 2.490 2.450 2.516 . 0 0 "[ . 1 . 2]" 1
660 1 38 TRP HA 1 38 TRP HD1 3.400 . 5.000 4.474 4.411 4.556 . 0 0 "[ . 1 . 2]" 1
661 1 38 TRP HA 1 38 TRP HE3 2.650 . 3.500 2.341 2.267 2.419 . 0 0 "[ . 1 . 2]" 1
662 1 38 TRP HA 1 39 GLU H 2.650 . 3.500 3.278 3.268 3.290 . 0 0 "[ . 1 . 2]" 1
663 1 38 TRP HB2 1 38 TRP HD1 2.650 . 3.500 2.503 2.499 2.507 . 0 0 "[ . 1 . 2]" 1
664 1 38 TRP HB2 1 38 TRP HE3 3.400 . 5.000 4.246 4.240 4.253 . 0 0 "[ . 1 . 2]" 1
665 1 38 TRP HB2 1 39 GLU H 2.650 . 3.500 3.522 3.509 3.530 0.030 20 0 "[ . 1 . 2]" 1
666 1 38 TRP HB2 1 39 GLU QG 4.050 . 6.300 4.524 4.098 5.156 . 0 0 "[ . 1 . 2]" 1
667 1 38 TRP HB3 1 38 TRP HD1 2.650 . 3.500 3.602 3.589 3.621 0.121 20 0 "[ . 1 . 2]" 1
668 1 38 TRP HB3 1 38 TRP HE3 2.650 . 3.500 2.952 2.917 2.986 . 0 0 "[ . 1 . 2]" 1
669 1 38 TRP HB3 1 39 GLU H 3.400 . 5.000 4.315 4.285 4.362 . 0 0 "[ . 1 . 2]" 1
670 1 38 TRP HB3 1 39 GLU QG 4.050 . 6.300 4.636 4.329 5.222 . 0 0 "[ . 1 . 2]" 1
671 1 39 GLU H 1 39 GLU HA 2.650 . 3.500 2.958 2.951 2.963 . 0 0 "[ . 1 . 2]" 1
672 1 39 GLU H 1 39 GLU HB2 2.300 . 2.800 2.747 2.679 2.823 0.023 2 0 "[ . 1 . 2]" 1
673 1 39 GLU H 1 39 GLU HB3 2.650 . 3.500 3.417 3.257 3.513 0.013 5 0 "[ . 1 . 2]" 1
674 1 39 GLU H 1 39 GLU QG 3.550 . 5.300 4.016 3.884 4.165 . 0 0 "[ . 1 . 2]" 1
675 1 39 GLU HA 1 39 GLU HB2 2.650 . 3.500 2.852 2.784 2.904 . 0 0 "[ . 1 . 2]" 1
676 1 39 GLU HA 1 39 GLU HB3 2.650 . 3.500 2.874 2.819 2.936 . 0 0 "[ . 1 . 2]" 1
677 1 39 GLU HA 1 39 GLU QG 2.800 . 3.800 2.095 1.932 2.505 . 0 0 "[ . 1 . 2]" 1
678 1 39 GLU HA 1 40 MET H 2.300 . 2.800 2.307 2.282 2.336 . 0 0 "[ . 1 . 2]" 1
679 1 39 GLU QG 1 40 MET H 3.550 . 5.300 3.280 2.790 4.014 . 0 0 "[ . 1 . 2]" 1
680 1 40 MET H 1 40 MET HA 2.650 . 3.500 2.740 2.730 2.751 . 0 0 "[ . 1 . 2]" 1
681 1 40 MET H 1 40 MET HB2 2.300 . 2.800 2.007 1.976 2.102 . 0 0 "[ . 1 . 2]" 1
682 1 40 MET H 1 40 MET HG2 2.650 . 3.500 3.540 3.525 3.557 0.057 10 0 "[ . 1 . 2]" 1
683 1 40 MET HA 1 40 MET HB2 2.650 . 3.500 2.878 2.829 2.945 . 0 0 "[ . 1 . 2]" 1
684 1 40 MET HA 1 40 MET HB3 2.650 . 3.500 2.834 2.744 2.884 . 0 0 "[ . 1 . 2]" 1
685 1 40 MET HA 1 40 MET HG2 3.400 . 5.000 1.921 1.892 2.030 . 0 0 "[ . 1 . 2]" 1
686 1 40 MET HA 1 40 MET HG3 3.400 . 5.000 3.183 2.935 3.362 . 0 0 "[ . 1 . 2]" 1
687 1 40 MET HA 1 41 PRO HD2 2.650 . 3.500 2.298 2.160 2.375 . 0 0 "[ . 1 . 2]" 1
688 1 40 MET HA 1 41 PRO HD3 2.650 . 3.500 2.021 1.936 2.159 . 0 0 "[ . 1 . 2]" 1
689 1 40 MET HB2 1 40 MET HG2 2.650 . 3.500 2.853 2.707 2.987 . 0 0 "[ . 1 . 2]" 1
690 1 40 MET HB3 1 40 MET HG2 2.650 . 3.500 2.844 2.650 2.965 . 0 0 "[ . 1 . 2]" 1
691 1 40 MET HG2 1 41 PRO HD2 3.400 . 5.000 2.901 2.802 3.065 . 0 0 "[ . 1 . 2]" 1
692 1 40 MET HG2 1 41 PRO HD3 3.400 . 5.000 3.466 3.387 3.848 . 0 0 "[ . 1 . 2]" 1
693 1 40 MET HG3 1 41 PRO HD2 3.400 . 5.000 4.494 4.343 4.708 . 0 0 "[ . 1 . 2]" 1
694 1 40 MET HG3 1 41 PRO HD3 3.400 . 5.000 5.038 5.027 5.052 0.052 6 0 "[ . 1 . 2]" 1
695 1 41 PRO HA 1 42 VAL H 2.300 . 2.800 2.676 2.498 2.812 0.012 12 0 "[ . 1 . 2]" 1
696 1 41 PRO HB2 1 42 VAL H 2.650 . 3.500 2.178 1.907 2.581 . 0 0 "[ . 1 . 2]" 1
697 1 41 PRO HB3 1 42 VAL H 2.650 . 3.500 3.322 3.219 3.501 0.001 13 0 "[ . 1 . 2]" 1
698 1 42 VAL H 1 42 VAL HB 2.300 . 2.800 2.670 2.555 2.794 . 0 0 "[ . 1 . 2]" 1
699 1 42 VAL H 1 42 VAL MG2 2.900 . 4.000 2.529 2.287 2.774 . 0 0 "[ . 1 . 2]" 1
700 1 42 VAL H 1 43 LEU H 3.400 . 5.000 4.486 4.442 4.528 . 0 0 "[ . 1 . 2]" 1
701 1 42 VAL HA 1 42 VAL HB 2.650 . 3.500 3.031 3.027 3.038 . 0 0 "[ . 1 . 2]" 1
702 1 42 VAL HA 1 42 VAL MG1 2.900 . 4.000 2.188 2.117 2.287 . 0 0 "[ . 1 . 2]" 1
703 1 42 VAL HA 1 42 VAL MG2 2.900 . 4.000 2.424 2.344 2.514 . 0 0 "[ . 1 . 2]" 1
704 1 42 VAL HA 1 43 LEU H 2.300 . 2.800 2.530 2.440 2.650 . 0 0 "[ . 1 . 2]" 1
705 1 42 VAL HB 1 43 LEU H 2.650 . 3.500 3.377 3.065 3.506 0.006 12 0 "[ . 1 . 2]" 1
706 1 43 LEU H 1 43 LEU HA 2.650 . 3.500 2.955 2.890 2.981 . 0 0 "[ . 1 . 2]" 1
707 1 43 LEU H 1 43 LEU QB 2.450 . 3.100 2.671 2.526 2.875 . 0 0 "[ . 1 . 2]" 1
708 1 43 LEU HA 1 43 LEU MD1 3.650 . 5.500 3.213 2.023 3.696 . 0 0 "[ . 1 . 2]" 1
709 1 43 LEU HA 1 43 LEU MD2 2.900 . 4.000 2.796 1.848 3.365 . 0 0 "[ . 1 . 2]" 1
710 1 43 LEU HA 1 43 LEU HG 2.650 . 3.500 2.282 1.931 3.526 0.026 3 0 "[ . 1 . 2]" 1
711 1 43 LEU HA 1 44 GLY H 2.300 . 2.800 2.464 2.289 2.811 0.011 1 0 "[ . 1 . 2]" 1
712 1 43 LEU QB 1 44 GLY H 2.800 . 3.800 2.953 2.110 3.405 . 0 0 "[ . 1 . 2]" 1
713 1 43 LEU QB 1 44 GLY QA 4.200 . 6.600 3.751 3.454 4.011 . 0 0 "[ . 1 . 2]" 1
714 1 43 LEU MD2 1 44 GLY H 3.650 . 5.500 2.369 1.865 3.491 . 0 0 "[ . 1 . 2]" 1
715 1 44 GLY H 1 45 GLN H 2.650 . 3.500 2.692 1.999 3.340 . 0 0 "[ . 1 . 2]" 1
716 1 44 GLY QA 1 45 GLN H 2.800 . 3.800 2.602 2.206 2.941 . 0 0 "[ . 1 . 2]" 1
717 1 45 GLN H 1 45 GLN HA 2.650 . 3.500 2.878 2.759 2.971 . 0 0 "[ . 1 . 2]" 1
718 1 45 GLN H 1 45 GLN HB2 2.650 . 3.500 2.261 1.979 2.588 . 0 0 "[ . 1 . 2]" 1
719 1 45 GLN H 1 45 GLN HB3 2.650 . 3.500 3.491 3.351 3.545 0.045 12 0 "[ . 1 . 2]" 1
720 1 45 GLN H 1 45 GLN HG2 2.650 . 3.500 3.126 2.544 3.494 . 0 0 "[ . 1 . 2]" 1
721 1 45 GLN H 1 45 GLN HG3 2.650 . 3.500 2.667 1.919 3.473 . 0 0 "[ . 1 . 2]" 1
722 1 45 GLN HA 1 45 GLN HB2 2.650 . 3.500 3.011 2.935 3.037 . 0 0 "[ . 1 . 2]" 1
723 1 45 GLN HA 1 45 GLN HB3 2.650 . 3.500 2.576 2.398 2.776 . 0 0 "[ . 1 . 2]" 1
724 1 45 GLN HA 1 45 GLN HG2 2.650 . 3.500 2.268 1.950 3.319 . 0 0 "[ . 1 . 2]" 1
725 1 45 GLN HA 1 45 GLN HG3 2.650 . 3.500 3.301 2.575 3.502 0.002 11 0 "[ . 1 . 2]" 1
726 1 45 GLN HA 1 46 HIS H 2.650 . 3.500 2.755 2.212 3.508 0.008 1 0 "[ . 1 . 2]" 1
727 1 46 HIS H 1 46 HIS HB2 3.400 . 5.000 2.880 1.947 3.974 . 0 0 "[ . 1 . 2]" 1
728 1 46 HIS HA 1 46 HIS HB2 2.650 . 3.500 2.736 2.428 3.035 . 0 0 "[ . 1 . 2]" 1
729 1 46 HIS HA 1 46 HIS HB3 2.650 . 3.500 2.807 2.400 3.037 . 0 0 "[ . 1 . 2]" 1
730 1 46 HIS HA 1 46 HIS HD2 3.400 . 5.000 3.350 1.867 4.800 . 0 0 "[ . 1 . 2]" 1
731 1 46 HIS HA 1 47 ASP H 2.650 . 3.500 2.766 2.244 3.546 0.046 9 0 "[ . 1 . 2]" 1
732 1 46 HIS HB2 1 47 ASP H 3.400 . 5.000 4.017 2.138 4.691 . 0 0 "[ . 1 . 2]" 1
733 1 46 HIS HB3 1 46 HIS HD2 3.400 . 5.000 3.436 2.757 3.997 . 0 0 "[ . 1 . 2]" 1
734 1 47 ASP H 1 47 ASP HA 2.650 . 3.500 2.948 2.853 3.004 . 0 0 "[ . 1 . 2]" 1
735 1 47 ASP H 1 47 ASP HB2 2.650 . 3.500 2.489 2.052 3.574 0.074 8 0 "[ . 1 . 2]" 1
736 1 47 ASP H 1 47 ASP HB3 2.650 . 3.500 3.343 2.714 3.547 0.047 19 0 "[ . 1 . 2]" 1
737 1 47 ASP HA 1 47 ASP HB2 2.650 . 3.500 2.906 2.522 3.038 . 0 0 "[ . 1 . 2]" 1
738 1 47 ASP HA 1 47 ASP HB3 2.650 . 3.500 2.619 2.417 2.950 . 0 0 "[ . 1 . 2]" 1
739 1 47 ASP HA 1 48 VAL H 2.300 . 2.800 2.746 2.529 2.849 0.049 9 0 "[ . 1 . 2]" 1
740 1 47 ASP HB2 1 48 VAL H 2.650 . 3.500 3.181 1.917 3.542 0.042 9 0 "[ . 1 . 2]" 1
741 1 47 ASP HB3 1 48 VAL H 2.650 . 3.500 2.273 1.924 3.504 0.004 20 0 "[ . 1 . 2]" 1
742 1 48 VAL H 1 48 VAL HA 2.650 . 3.500 2.857 2.361 3.003 . 0 0 "[ . 1 . 2]" 1
743 1 48 VAL H 1 48 VAL HB 2.650 . 3.500 2.938 2.255 3.592 0.092 1 0 "[ . 1 . 2]" 1
744 1 48 VAL H 1 48 VAL MG2 2.900 . 4.000 2.327 1.852 2.806 . 0 0 "[ . 1 . 2]" 1
745 1 48 VAL HA 1 48 VAL HB 2.650 . 3.500 2.875 2.423 3.038 . 0 0 "[ . 1 . 2]" 1
746 1 48 VAL HA 1 48 VAL MG1 2.900 . 4.000 2.332 2.168 2.491 . 0 0 "[ . 1 . 2]" 1
747 1 48 VAL HA 1 48 VAL MG2 2.900 . 4.000 2.585 2.114 3.189 . 0 0 "[ . 1 . 2]" 1
748 1 48 VAL HA 1 49 ILE H 2.300 . 2.800 2.386 2.212 2.808 0.008 4 0 "[ . 1 . 2]" 1
749 1 48 VAL HB 1 49 ILE H 3.400 . 5.000 3.925 2.835 4.540 . 0 0 "[ . 1 . 2]" 1
750 1 48 VAL MG1 1 49 ILE H 3.650 . 5.500 3.350 1.899 4.198 . 0 0 "[ . 1 . 2]" 1
751 1 49 ILE H 1 49 ILE HB 2.650 . 3.500 3.052 2.335 3.593 0.093 4 0 "[ . 1 . 2]" 1
752 1 49 ILE H 1 49 ILE HG12 2.650 . 3.500 2.858 1.884 3.486 . 0 0 "[ . 1 . 2]" 1
753 1 49 ILE H 1 49 ILE HG13 2.650 . 3.500 2.240 1.880 3.460 . 0 0 "[ . 1 . 2]" 1
754 1 49 ILE HA 1 49 ILE HB 2.650 . 3.500 2.760 2.446 3.039 . 0 0 "[ . 1 . 2]" 1
755 1 49 ILE HA 1 49 ILE HG12 3.400 . 5.000 3.351 2.448 4.212 . 0 0 "[ . 1 . 2]" 1
756 1 49 ILE HA 1 49 ILE HG13 3.400 . 5.000 3.299 2.600 3.681 . 0 0 "[ . 1 . 2]" 1
757 1 49 ILE HA 1 50 SER H 2.300 . 2.800 2.383 2.209 2.802 0.002 17 0 "[ . 1 . 2]" 1
758 1 49 ILE HB 1 50 SER H 3.400 . 5.000 3.735 2.072 4.503 . 0 0 "[ . 1 . 2]" 1
759 1 49 ILE MG 1 50 SER H 3.650 . 5.500 3.560 2.299 4.304 . 0 0 "[ . 1 . 2]" 1
760 1 50 SER H 1 50 SER HA 2.650 . 3.500 2.895 2.364 3.002 . 0 0 "[ . 1 . 2]" 1
761 1 50 SER H 1 50 SER QB 3.550 . 5.300 2.588 1.997 3.265 . 0 0 "[ . 1 . 2]" 1
762 1 50 SER HA 1 51 ASP H 2.650 . 3.500 2.571 2.212 3.530 0.030 18 0 "[ . 1 . 2]" 1
763 1 50 SER QB 1 51 ASP H 3.550 . 5.300 3.439 1.818 4.074 . 0 0 "[ . 1 . 2]" 1
764 1 51 ASP H 1 51 ASP HA 2.650 . 3.500 2.700 2.362 2.999 . 0 0 "[ . 1 . 2]" 1
765 1 51 ASP H 1 51 ASP HB2 2.650 . 3.500 2.887 2.047 3.513 0.013 8 0 "[ . 1 . 2]" 1
766 1 51 ASP H 1 51 ASP HB3 3.400 . 5.000 3.520 2.580 4.074 . 0 0 "[ . 1 . 2]" 1
767 1 51 ASP HA 1 51 ASP HB2 2.650 . 3.500 2.820 2.448 3.037 . 0 0 "[ . 1 . 2]" 1
768 1 51 ASP HA 1 51 ASP HB3 2.650 . 3.500 2.778 2.396 3.037 . 0 0 "[ . 1 . 2]" 1
769 1 51 ASP HA 1 52 PRO HD2 2.650 . 3.500 2.241 1.994 2.506 . 0 0 "[ . 1 . 2]" 1
770 1 51 ASP HA 1 52 PRO HD3 2.650 . 3.500 2.634 2.172 3.222 . 0 0 "[ . 1 . 2]" 1
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