NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
439363 |
2k6b   |
15864 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2k6b
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 558
_Distance_constraint_stats_list.Viol_count 530
_Distance_constraint_stats_list.Viol_total 411.448
_Distance_constraint_stats_list.Viol_max 0.173
_Distance_constraint_stats_list.Viol_rms 0.0108
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0018
_Distance_constraint_stats_list.Viol_average_violations_only 0.0388
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 SER 0.039 0.039 5 0 "[ . 1 . 2]"
1 3 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 4 ASP 0.016 0.016 17 0 "[ . 1 . 2]"
1 5 GLU 0.039 0.039 5 0 "[ . 1 . 2]"
1 6 GLU 0.044 0.027 11 0 "[ . 1 . 2]"
1 7 LEU 0.016 0.016 17 0 "[ . 1 . 2]"
1 8 GLU 0.498 0.076 9 0 "[ . 1 . 2]"
1 9 ALA 0.023 0.023 2 0 "[ . 1 . 2]"
1 10 LEU 0.044 0.027 11 0 "[ . 1 . 2]"
1 11 ARG 0.378 0.147 17 0 "[ . 1 . 2]"
1 12 ARG 0.769 0.129 5 0 "[ . 1 . 2]"
1 13 GLN 0.058 0.058 8 0 "[ . 1 . 2]"
1 14 ARG 0.114 0.059 6 0 "[ . 1 . 2]"
1 15 LEU 0.361 0.091 5 0 "[ . 1 . 2]"
1 16 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 17 GLU 0.114 0.059 6 0 "[ . 1 . 2]"
1 18 LEU 0.401 0.140 10 0 "[ . 1 . 2]"
1 19 GLN 0.560 0.092 18 0 "[ . 1 . 2]"
1 20 ALA 0.277 0.140 10 0 "[ . 1 . 2]"
1 21 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 26 GLY 0.040 0.040 4 0 "[ . 1 . 2]"
1 27 ASP 0.269 0.111 5 0 "[ . 1 . 2]"
1 28 ALA 0.040 0.040 4 0 "[ . 1 . 2]"
1 29 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 GLN 0.269 0.111 5 0 "[ . 1 . 2]"
1 31 GLN 0.428 0.115 12 0 "[ . 1 . 2]"
1 32 GLU 0.189 0.054 5 0 "[ . 1 . 2]"
1 33 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 LYS 1.156 0.131 15 0 "[ . 1 . 2]"
1 35 HIS 0.164 0.054 5 0 "[ . 1 . 2]"
1 36 ARG 0.025 0.018 8 0 "[ . 1 . 2]"
1 37 GLU 1.105 0.131 15 0 "[ . 1 . 2]"
1 38 ALA 0.382 0.099 12 0 "[ . 1 . 2]"
1 41 ARG 0.040 0.040 20 0 "[ . 1 . 2]"
1 42 ASN 0.712 0.099 12 0 "[ . 1 . 2]"
1 43 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 ILE 0.989 0.105 5 0 "[ . 1 . 2]"
1 45 LEU 0.519 0.122 9 0 "[ . 1 . 2]"
1 46 ALA 0.262 0.057 5 0 "[ . 1 . 2]"
1 47 GLN 0.404 0.114 3 0 "[ . 1 . 2]"
1 48 VAL 1.166 0.122 9 0 "[ . 1 . 2]"
1 49 LEU 1.021 0.135 8 0 "[ . 1 . 2]"
1 50 ASP 0.082 0.030 18 0 "[ . 1 . 2]"
1 51 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 SER 0.597 0.068 14 0 "[ . 1 . 2]"
1 53 ALA 0.192 0.042 14 0 "[ . 1 . 2]"
1 54 ARG 1.222 0.135 8 0 "[ . 1 . 2]"
1 55 ALA 0.020 0.010 18 0 "[ . 1 . 2]"
1 56 ARG 1.103 0.089 17 0 "[ . 1 . 2]"
1 57 LEU 0.505 0.099 16 0 "[ . 1 . 2]"
1 58 SER 0.020 0.010 18 0 "[ . 1 . 2]"
1 59 ASN 0.023 0.020 11 0 "[ . 1 . 2]"
1 60 LEU 0.639 0.099 16 0 "[ . 1 . 2]"
1 61 ALA 0.381 0.053 10 0 "[ . 1 . 2]"
1 62 LEU 0.747 0.118 1 0 "[ . 1 . 2]"
1 63 VAL 0.045 0.025 4 0 "[ . 1 . 2]"
1 64 LYS 0.005 0.005 9 0 "[ . 1 . 2]"
1 65 PRO 0.194 0.041 8 0 "[ . 1 . 2]"
1 66 GLU 0.431 0.050 4 0 "[ . 1 . 2]"
1 67 LYS 0.596 0.092 20 0 "[ . 1 . 2]"
1 68 THR 1.011 0.087 10 0 "[ . 1 . 2]"
1 69 LYS 0.494 0.090 3 0 "[ . 1 . 2]"
1 70 ALA 0.014 0.014 20 0 "[ . 1 . 2]"
1 71 VAL 0.087 0.066 14 0 "[ . 1 . 2]"
1 72 GLU 1.022 0.087 10 0 "[ . 1 . 2]"
1 73 ASN 0.014 0.014 20 0 "[ . 1 . 2]"
1 74 TYR 0.297 0.080 1 0 "[ . 1 . 2]"
1 75 LEU 0.637 0.077 19 0 "[ . 1 . 2]"
1 76 ILE 0.963 0.105 5 0 "[ . 1 . 2]"
1 77 GLN 0.275 0.075 17 0 "[ . 1 . 2]"
1 78 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 79 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 ARG 0.049 0.047 17 0 "[ . 1 . 2]"
1 81 TYR 0.143 0.048 13 0 "[ . 1 . 2]"
1 82 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 GLN 0.021 0.021 5 0 "[ . 1 . 2]"
1 84 LEU 1.885 0.114 8 0 "[ . 1 . 2]"
1 85 SER 0.436 0.101 13 0 "[ . 1 . 2]"
1 86 GLU 0.287 0.053 20 0 "[ . 1 . 2]"
1 87 LYS 0.319 0.114 3 0 "[ . 1 . 2]"
1 88 VAL 0.054 0.035 12 0 "[ . 1 . 2]"
1 89 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 GLU 0.836 0.068 14 0 "[ . 1 . 2]"
1 91 GLN 0.147 0.044 6 0 "[ . 1 . 2]"
1 92 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 LEU 0.359 0.095 15 0 "[ . 1 . 2]"
1 94 ILE 0.852 0.091 16 0 "[ . 1 . 2]"
1 95 GLU 0.293 0.091 16 0 "[ . 1 . 2]"
1 96 ILE 0.404 0.095 15 0 "[ . 1 . 2]"
1 97 LEU 0.369 0.069 19 0 "[ . 1 . 2]"
1 98 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 LYS 0.408 0.083 15 0 "[ . 1 . 2]"
1 100 VAL 0.804 0.091 13 0 "[ . 1 . 2]"
1 101 SER 0.246 0.060 13 0 "[ . 1 . 2]"
1 102 GLN 0.059 0.034 3 0 "[ . 1 . 2]"
1 103 GLN 0.543 0.152 11 0 "[ . 1 . 2]"
1 104 THR 0.347 0.091 13 0 "[ . 1 . 2]"
1 105 GLU 0.431 0.083 15 0 "[ . 1 . 2]"
1 106 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 107 THR 1.095 0.173 2 0 "[ . 1 . 2]"
1 108 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 110 VAL 0.235 0.048 11 0 "[ . 1 . 2]"
1 111 LYS 0.235 0.048 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 74 TYR QD 1 75 LEU MD2 3.650 . 5.500 2.542 2.022 3.045 . 0 0 "[ . 1 . 2]" 1
2 1 56 ARG HD3 1 94 ILE MD 3.650 . 5.500 4.272 2.361 5.520 0.020 12 0 "[ . 1 . 2]" 1
3 1 56 ARG HD2 1 94 ILE MD 3.650 . 5.500 4.331 2.854 5.567 0.067 12 0 "[ . 1 . 2]" 1
4 1 91 GLN QG 1 94 ILE MD 3.650 . 5.500 4.256 3.034 5.526 0.026 4 0 "[ . 1 . 2]" 1
5 1 48 VAL QG 1 49 LEU HB2 3.650 . 5.500 4.092 3.446 4.678 . 0 0 "[ . 1 . 2]" 1
6 1 47 GLN HG2 1 48 VAL QG 3.650 . 5.500 4.718 2.984 5.554 0.054 1 0 "[ . 1 . 2]" 1
7 1 77 GLN QG 1 81 TYR QE 3.650 . 5.500 3.770 2.150 4.803 . 0 0 "[ . 1 . 2]" 1
8 1 67 LYS QD 1 101 SER HA 3.650 . 5.500 3.608 1.911 4.201 . 0 0 "[ . 1 . 2]" 1
9 1 42 ASN HA 1 46 ALA MB 3.650 . 5.500 4.221 3.448 4.623 . 0 0 "[ . 1 . 2]" 1
10 1 48 VAL QG 1 76 ILE HA 3.650 . 5.500 4.498 3.872 4.963 . 0 0 "[ . 1 . 2]" 1
11 1 74 TYR HB3 1 96 ILE MG 3.650 . 5.500 2.811 2.437 3.149 . 0 0 "[ . 1 . 2]" 1
12 1 44 ILE MG 1 47 GLN QB 3.650 . 5.500 4.536 4.136 5.523 0.023 5 0 "[ . 1 . 2]" 1
13 1 94 ILE MG 1 95 GLU QG 3.650 . 5.500 4.809 3.681 5.591 0.091 16 0 "[ . 1 . 2]" 1
14 1 74 TYR QD 1 96 ILE MD 3.650 . 4.500 2.380 2.000 2.869 . 0 0 "[ . 1 . 2]" 1
15 1 74 TYR HB3 1 74 TYR QD . . 3.500 2.353 2.254 2.467 . 0 0 "[ . 1 . 2]" 1
16 1 74 TYR QD 1 100 VAL MG1 3.650 . 5.500 3.750 3.230 4.320 . 0 0 "[ . 1 . 2]" 1
17 1 74 TYR QD 1 96 ILE MG 3.650 . 4.500 2.177 1.826 2.605 . 0 0 "[ . 1 . 2]" 1
18 1 74 TYR QE 1 96 ILE MD 3.650 . 4.500 2.644 2.045 3.475 . 0 0 "[ . 1 . 2]" 1
19 1 74 TYR QE 1 96 ILE MG 3.650 . 5.500 3.040 2.539 3.396 . 0 0 "[ . 1 . 2]" 1
20 1 64 LYS HA 1 64 LYS QG 3.650 . 4.500 2.848 2.367 3.405 . 0 0 "[ . 1 . 2]" 1
21 1 53 ALA MB 1 89 SER HA 3.650 . 5.500 2.905 2.366 3.511 . 0 0 "[ . 1 . 2]" 1
22 1 48 VAL QG 1 49 LEU HA 3.650 . 5.500 3.482 3.269 3.789 . 0 0 "[ . 1 . 2]" 1
23 1 49 LEU HA 1 53 ALA MB 3.650 . 5.500 3.020 2.730 3.409 . 0 0 "[ . 1 . 2]" 1
24 1 84 LEU HA 1 84 LEU MD1 3.650 . 5.500 2.411 1.895 3.998 . 0 0 "[ . 1 . 2]" 1
25 1 59 ASN HA 1 62 LEU MD1 3.650 . 5.500 2.963 2.214 5.520 0.020 11 0 "[ . 1 . 2]" 1
26 1 26 GLY QA 1 27 ASP HA 3.650 . 5.500 4.015 3.892 4.374 . 0 0 "[ . 1 . 2]" 1
27 1 42 ASN HA 1 45 LEU MD1 3.650 . 4.500 2.831 2.082 3.696 . 0 0 "[ . 1 . 2]" 1
28 1 73 ASN HA 1 76 ILE MG 3.650 . 5.500 4.058 3.735 4.369 . 0 0 "[ . 1 . 2]" 1
29 1 25 PRO HA 1 25 PRO QG 3.650 . 5.500 3.280 2.777 3.557 . 0 0 "[ . 1 . 2]" 1
30 1 48 VAL HA 1 84 LEU MD2 3.650 . 5.500 4.503 2.576 5.577 0.077 9 0 "[ . 1 . 2]" 1
31 1 100 VAL MG1 1 104 THR HA 3.650 . 5.500 3.175 1.891 5.591 0.091 13 0 "[ . 1 . 2]" 1
32 1 70 ALA HA 1 100 VAL MG1 3.650 . 5.500 4.196 3.846 4.581 . 0 0 "[ . 1 . 2]" 1
33 1 62 LEU HA 1 63 VAL MG1 3.650 . 5.500 4.780 4.510 5.050 . 0 0 "[ . 1 . 2]" 1
34 1 48 VAL QG 1 79 ALA HA 3.650 . 5.500 3.230 2.508 3.883 . 0 0 "[ . 1 . 2]" 1
35 1 66 GLU HA 1 69 LYS QE 3.650 . 5.500 3.002 1.964 4.310 . 0 0 "[ . 1 . 2]" 1
36 1 57 LEU HA 1 97 LEU MD1 3.650 . 5.500 5.328 4.546 5.569 0.069 19 0 "[ . 1 . 2]" 1
37 1 91 GLN HA 1 94 ILE MD 3.650 . 4.500 2.592 2.001 3.610 . 0 0 "[ . 1 . 2]" 1
38 1 82 GLY QA 1 83 GLN QG 3.650 . 5.500 4.174 3.896 4.438 . 0 0 "[ . 1 . 2]" 1
39 1 57 LEU HA 1 57 LEU MD2 3.650 . 5.500 3.697 2.253 3.926 . 0 0 "[ . 1 . 2]" 1
40 1 98 LYS HA 1 98 LYS QG 3.650 . 4.500 2.726 2.365 3.371 . 0 0 "[ . 1 . 2]" 1
41 1 69 LYS HA 1 69 LYS QE 3.650 . 5.500 4.376 2.747 5.590 0.090 3 0 "[ . 1 . 2]" 1
42 1 93 LEU HA 1 93 LEU MD1 3.650 . 4.500 2.155 2.112 2.211 . 0 0 "[ . 1 . 2]" 1
43 1 69 LYS HA 1 69 LYS QG 3.150 . 4.500 2.875 2.303 3.385 . 0 0 "[ . 1 . 2]" 1
44 1 80 ARG HA 1 80 ARG QD 3.650 . 5.500 3.295 2.023 4.262 . 0 0 "[ . 1 . 2]" 1
45 1 84 LEU MD1 1 85 SER HB2 3.650 . 5.500 5.350 4.644 5.601 0.101 13 0 "[ . 1 . 2]" 1
46 1 45 LEU HA 1 49 LEU MD1 3.650 . 5.500 3.703 3.301 4.340 . 0 0 "[ . 1 . 2]" 1
47 1 45 LEU HA 1 48 VAL QG 3.650 . 4.500 2.697 1.971 3.636 . 0 0 "[ . 1 . 2]" 1
48 1 45 LEU HA 1 45 LEU MD1 3.650 . 5.500 3.828 3.231 3.876 . 0 0 "[ . 1 . 2]" 1
49 1 76 ILE MG 1 77 GLN HA 3.650 . 5.500 3.325 3.092 3.503 . 0 0 "[ . 1 . 2]" 1
50 1 75 LEU HA 1 75 LEU MD1 3.650 . 4.500 2.014 1.972 2.076 . 0 0 "[ . 1 . 2]" 1
51 1 44 ILE HA 1 47 GLN QB 3.650 . 5.500 3.175 2.658 4.322 . 0 0 "[ . 1 . 2]" 1
52 1 71 VAL MG1 1 97 LEU HA 3.650 . 5.500 2.318 2.137 2.756 . 0 0 "[ . 1 . 2]" 1
53 1 45 LEU MD2 1 72 GLU HA 3.650 . 4.500 2.817 2.056 3.156 . 0 0 "[ . 1 . 2]" 1
54 1 71 VAL MG2 1 72 GLU HA 3.650 . 5.500 3.424 3.255 3.573 . 0 0 "[ . 1 . 2]" 1
55 1 53 ALA MB 1 90 GLU HA 3.650 . 5.500 2.784 2.057 3.246 . 0 0 "[ . 1 . 2]" 1
56 1 94 ILE HA 1 94 ILE MD 3.650 . 4.500 3.685 2.246 3.873 . 0 0 "[ . 1 . 2]" 1
57 1 94 ILE HA 1 97 LEU QB 3.650 . 4.500 2.194 1.992 2.320 . 0 0 "[ . 1 . 2]" 1
58 1 93 LEU MD2 1 94 ILE HA 3.650 . 5.500 4.737 4.356 4.906 . 0 0 "[ . 1 . 2]" 1
59 1 76 ILE HA 1 79 ALA MB 3.650 . 5.500 3.028 2.598 3.538 . 0 0 "[ . 1 . 2]" 1
60 1 44 ILE MG 1 76 ILE HA 3.650 . 5.500 4.713 4.350 5.449 . 0 0 "[ . 1 . 2]" 1
61 1 96 ILE HA 1 96 ILE MD 3.650 . 5.500 3.536 2.206 3.893 . 0 0 "[ . 1 . 2]" 1
62 1 81 TYR HB2 1 83 GLN QG 3.650 . 5.500 2.530 2.018 3.313 . 0 0 "[ . 1 . 2]" 1
63 1 74 TYR HB2 1 100 VAL MG1 3.650 . 5.500 3.202 2.690 3.585 . 0 0 "[ . 1 . 2]" 1
64 1 46 ALA MB 1 54 ARG HD3 3.650 . 5.500 4.090 3.240 5.519 0.019 9 0 "[ . 1 . 2]" 1
65 1 74 TYR HB3 1 100 VAL MG1 3.650 . 5.500 3.792 3.373 4.521 . 0 0 "[ . 1 . 2]" 1
66 1 64 LYS QE 1 97 LEU MD1 3.650 . 5.500 4.595 2.112 5.505 0.005 9 0 "[ . 1 . 2]" 1
67 1 34 LYS HA 1 34 LYS QE 3.650 . 5.500 3.627 1.872 4.352 . 0 0 "[ . 1 . 2]" 1
68 1 99 LYS QE 1 100 VAL MG1 3.650 . 5.500 4.559 2.751 5.556 0.056 4 0 "[ . 1 . 2]" 1
69 1 34 LYS QB 1 34 LYS QE 3.650 . 5.500 3.260 1.941 3.885 . 0 0 "[ . 1 . 2]" 1
70 1 70 ALA MB 1 73 ASN HB3 3.650 . 5.500 4.321 3.870 4.716 . 0 0 "[ . 1 . 2]" 1
71 1 94 ILE MG 1 98 LYS QE 3.650 . 5.500 2.975 1.944 5.139 . 0 0 "[ . 1 . 2]" 1
72 1 42 ASN HB2 1 46 ALA MB 3.650 . 5.500 5.252 4.386 5.557 0.057 5 0 "[ . 1 . 2]" 1
73 1 68 THR MG 1 72 GLU HG2 3.650 . 5.500 3.640 3.241 4.059 . 0 0 "[ . 1 . 2]" 1
74 1 61 ALA MB 1 65 PRO HB3 3.650 . 5.500 3.829 3.054 4.421 . 0 0 "[ . 1 . 2]" 1
75 1 51 GLN HA 1 51 GLN QG 3.650 . 4.500 2.546 2.329 3.094 . 0 0 "[ . 1 . 2]" 1
76 1 28 ALA HA 1 31 GLN QG 3.650 . 5.500 4.002 2.854 5.236 . 0 0 "[ . 1 . 2]" 1
77 1 8 GLU QG 1 12 ARG HD2 3.650 . 5.500 4.011 2.149 5.547 0.047 3 0 "[ . 1 . 2]" 1
78 1 46 ALA MB 1 47 GLN HG3 3.650 . 5.500 4.681 3.186 5.504 0.004 17 0 "[ . 1 . 2]" 1
79 1 14 ARG QD 1 17 GLU HG3 3.900 . 6.000 4.859 2.405 6.059 0.059 6 0 "[ . 1 . 2]" 1
80 1 66 GLU HG3 1 69 LYS QE 3.650 . 5.500 4.869 3.563 5.550 0.050 4 0 "[ . 1 . 2]" 1
81 1 48 VAL HB 1 84 LEU MD1 3.650 . 5.500 3.750 2.115 5.527 0.027 15 0 "[ . 1 . 2]" 1
82 1 71 VAL HB 1 97 LEU MD1 3.650 . 5.500 4.559 4.244 4.819 . 0 0 "[ . 1 . 2]" 1
83 1 48 VAL HB 1 84 LEU MD2 3.650 . 5.500 3.980 2.044 5.524 0.024 9 0 "[ . 1 . 2]" 1
84 1 71 VAL HB 1 75 LEU MD2 3.650 . 5.500 2.654 2.372 3.004 . 0 0 "[ . 1 . 2]" 1
85 1 45 LEU MD2 1 72 GLU HB2 3.650 . 5.500 4.690 4.014 5.315 . 0 0 "[ . 1 . 2]" 1
86 1 68 THR MG 1 72 GLU HB2 3.650 . 5.500 4.171 3.921 4.414 . 0 0 "[ . 1 . 2]" 1
87 1 90 GLU HG3 1 94 ILE MD 3.650 . 5.500 5.414 4.495 5.537 0.037 6 0 "[ . 1 . 2]" 1
88 1 27 ASP HA 1 30 GLN QB 3.650 . 5.500 3.502 2.391 4.754 . 0 0 "[ . 1 . 2]" 1
89 1 48 VAL QG 1 75 LEU HB3 3.650 . 5.500 2.619 1.996 3.203 . 0 0 "[ . 1 . 2]" 1
90 1 32 GLU QB 1 36 ARG QD 3.650 . 5.500 4.484 2.888 5.518 0.018 8 0 "[ . 1 . 2]" 1
91 1 66 GLU QB 1 67 LYS HE2 3.650 . 5.500 5.029 3.252 5.539 0.039 18 0 "[ . 1 . 2]" 1
92 1 57 LEU MD2 1 72 GLU HG3 3.650 . 5.500 3.204 2.149 5.317 . 0 0 "[ . 1 . 2]" 1
93 1 84 LEU MD1 1 88 VAL HB 3.650 . 5.500 4.617 3.300 5.535 0.035 12 0 "[ . 1 . 2]" 1
94 1 45 LEU MD1 1 72 GLU HG3 3.650 . 5.500 4.279 3.440 5.501 0.001 4 0 "[ . 1 . 2]" 1
95 1 2 SER HA 1 5 GLU QB 3.650 . 5.500 3.734 2.087 4.820 . 0 0 "[ . 1 . 2]" 1
96 1 97 LEU MD1 1 100 VAL HB 3.650 . 5.500 4.900 3.620 5.292 . 0 0 "[ . 1 . 2]" 1
97 1 75 LEU HB3 1 84 LEU MD2 3.650 . 5.500 5.187 4.377 5.577 0.077 19 0 "[ . 1 . 2]" 1
98 1 71 VAL MG1 1 100 VAL HB 3.650 . 5.500 3.854 2.626 4.138 . 0 0 "[ . 1 . 2]" 1
99 1 68 THR MG 1 72 GLU HG3 3.650 . 5.500 2.506 2.208 2.949 . 0 0 "[ . 1 . 2]" 1
100 1 104 THR MG 1 105 GLU HB2 3.650 . 5.500 4.424 2.476 5.555 0.055 1 0 "[ . 1 . 2]" 1
101 1 3 ALA HA 1 6 GLU QB 3.650 . 5.500 3.345 2.423 4.399 . 0 0 "[ . 1 . 2]" 1
102 1 48 VAL QG 1 75 LEU HG 3.650 . 5.500 3.101 2.586 3.597 . 0 0 "[ . 1 . 2]" 1
103 1 83 GLN QB 1 84 LEU MD2 3.650 . 5.500 3.491 2.141 5.521 0.021 5 0 "[ . 1 . 2]" 1
104 1 104 THR MG 1 105 GLU HB3 3.650 . 5.500 4.182 3.011 5.567 0.067 15 0 "[ . 1 . 2]" 1
105 1 53 ALA MB 1 54 ARG HB2 3.650 . 5.500 4.445 3.896 4.820 . 0 0 "[ . 1 . 2]" 1
106 1 93 LEU MD1 1 96 ILE HB 3.650 . 5.500 2.691 2.296 3.253 . 0 0 "[ . 1 . 2]" 1
107 1 69 LYS QB 1 69 LYS QE 3.650 . 5.500 2.383 1.907 3.541 . 0 0 "[ . 1 . 2]" 1
108 1 98 LYS QB 1 98 LYS QE 3.650 . 5.500 2.914 1.875 3.852 . 0 0 "[ . 1 . 2]" 1
109 1 62 LEU HB2 1 63 VAL MG1 3.650 . 5.500 3.488 2.951 4.581 . 0 0 "[ . 1 . 2]" 1
110 1 62 LEU HB2 1 63 VAL MG2 3.650 . 5.500 4.408 3.763 5.438 . 0 0 "[ . 1 . 2]" 1
111 1 48 VAL QG 1 49 LEU HG 3.650 . 5.500 2.622 1.962 3.372 . 0 0 "[ . 1 . 2]" 1
112 1 99 LYS QB 1 100 VAL MG1 3.650 . 5.500 3.335 2.556 5.489 . 0 0 "[ . 1 . 2]" 1
113 1 49 LEU HG 1 53 ALA MB 3.650 . 5.500 4.326 4.120 4.571 . 0 0 "[ . 1 . 2]" 1
114 1 44 ILE HB 1 79 ALA MB 3.650 . 5.500 2.781 1.911 4.578 . 0 0 "[ . 1 . 2]" 1
115 1 71 VAL MG1 1 93 LEU HG 3.650 . 5.500 3.797 3.373 4.345 . 0 0 "[ . 1 . 2]" 1
116 1 60 LEU HB3 1 71 VAL MG2 3.650 . 5.500 4.616 4.222 5.480 . 0 0 "[ . 1 . 2]" 1
117 1 63 VAL MG2 1 64 LYS QD 3.650 . 5.500 3.691 2.029 4.918 . 0 0 "[ . 1 . 2]" 1
118 1 49 LEU QD 1 57 LEU HB2 3.650 . 5.500 3.104 2.454 4.586 . 0 0 "[ . 1 . 2]" 1
119 1 62 LEU HB3 1 63 VAL MG1 3.650 . 5.500 3.763 2.962 5.142 . 0 0 "[ . 1 . 2]" 1
120 1 70 ALA MB 1 71 VAL MG1 3.650 . 5.500 3.138 2.989 3.257 . 0 0 "[ . 1 . 2]" 1
121 1 70 ALA MB 1 100 VAL MG1 3.650 . 5.500 2.546 1.952 2.854 . 0 0 "[ . 1 . 2]" 1
122 1 13 GLN HG3 1 16 ALA MB 3.650 . 5.500 4.080 3.495 5.343 . 0 0 "[ . 1 . 2]" 1
123 1 61 ALA MB 1 65 PRO HA 3.650 . 5.500 3.701 3.364 3.939 . 0 0 "[ . 1 . 2]" 1
124 1 55 ALA MB 1 58 SER HB3 3.650 . 5.500 4.826 3.983 5.510 0.010 18 0 "[ . 1 . 2]" 1
125 1 58 SER HA 1 61 ALA MB 3.650 . 5.500 2.611 2.170 2.955 . 0 0 "[ . 1 . 2]" 1
126 1 61 ALA MB 1 68 THR MG 3.650 . 5.500 2.036 1.913 2.328 . 0 0 "[ . 1 . 2]" 1
127 1 26 GLY QA 1 28 ALA MB 3.650 . 5.500 4.653 3.812 5.540 0.040 4 0 "[ . 1 . 2]" 1
128 1 49 LEU HB2 1 57 LEU MD2 3.650 . 5.500 4.621 4.165 5.151 . 0 0 "[ . 1 . 2]" 1
129 1 61 ALA MB 1 62 LEU MD1 3.650 . 5.500 3.970 2.152 5.206 . 0 0 "[ . 1 . 2]" 1
130 1 63 VAL MG1 1 64 LYS QG 3.650 . 5.500 4.308 2.322 4.983 . 0 0 "[ . 1 . 2]" 1
131 1 63 VAL MG2 1 64 LYS QG 3.650 . 5.500 2.512 1.997 3.820 . 0 0 "[ . 1 . 2]" 1
132 1 44 ILE MG 1 79 ALA MB 3.650 . 5.500 3.403 2.669 5.094 . 0 0 "[ . 1 . 2]" 1
133 1 41 ARG QG 1 76 ILE MG 3.650 . 5.500 3.965 2.894 5.487 . 0 0 "[ . 1 . 2]" 1
134 1 49 LEU MD2 1 53 ALA MB 3.650 . 5.500 2.157 1.928 2.616 . 0 0 "[ . 1 . 2]" 1
135 1 53 ALA MB 1 93 LEU MD1 3.650 . 5.500 3.432 3.028 3.815 . 0 0 "[ . 1 . 2]" 1
136 1 49 LEU MD1 1 53 ALA MB 3.650 . 5.500 3.128 2.835 3.457 . 0 0 "[ . 1 . 2]" 1
137 1 45 LEU HB2 1 48 VAL QG 3.650 . 5.500 4.991 4.425 5.622 0.122 9 0 "[ . 1 . 2]" 1
138 1 48 VAL QG 1 75 LEU HB2 3.650 . 5.500 3.934 3.368 4.485 . 0 0 "[ . 1 . 2]" 1
139 1 61 ALA HA 1 68 THR MG 3.650 . 4.500 2.807 2.293 3.244 . 0 0 "[ . 1 . 2]" 1
140 1 44 ILE HG12 1 76 ILE MG 3.650 . 5.500 4.401 4.214 4.623 . 0 0 "[ . 1 . 2]" 1
141 1 63 VAL MG2 1 64 LYS QE 3.650 . 5.500 4.283 2.469 5.188 . 0 0 "[ . 1 . 2]" 1
142 1 71 VAL MG1 1 100 VAL MG1 3.650 . 4.500 2.568 2.010 3.098 . 0 0 "[ . 1 . 2]" 1
143 1 88 VAL MG1 1 92 GLY QA 3.650 . 5.500 2.368 1.909 3.861 . 0 0 "[ . 1 . 2]" 1
144 1 47 GLN QB 1 48 VAL QG 3.650 . 5.500 3.217 2.660 4.689 . 0 0 "[ . 1 . 2]" 1
145 1 4 ASP HA 1 7 LEU MD1 3.650 . 5.500 4.585 3.066 5.516 0.016 17 0 "[ . 1 . 2]" 1
146 1 57 LEU MD1 1 68 THR MG 3.650 . 5.500 2.123 2.020 2.639 . 0 0 "[ . 1 . 2]" 1
147 1 53 ALA HA 1 93 LEU MD2 3.650 . 4.500 3.005 2.717 3.389 . 0 0 "[ . 1 . 2]" 1
148 1 49 LEU HA 1 88 VAL MG2 3.650 . 5.500 3.807 3.379 4.767 . 0 0 "[ . 1 . 2]" 1
149 1 53 ALA MB 1 93 LEU MD2 3.650 . 5.500 2.308 2.089 2.705 . 0 0 "[ . 1 . 2]" 1
150 1 18 LEU MD1 1 20 ALA MB 3.650 . 5.500 4.036 2.040 5.640 0.140 10 0 "[ . 1 . 2]" 1
151 1 56 ARG QB 1 93 LEU MD2 3.650 . 5.500 2.389 1.921 3.122 . 0 0 "[ . 1 . 2]" 1
152 1 6 GLU QB 1 10 LEU MD1 3.650 . 5.500 4.576 3.129 5.527 0.027 11 0 "[ . 1 . 2]" 1
153 1 94 ILE MG 1 95 GLU QB 3.650 . 5.500 4.553 4.087 4.974 . 0 0 "[ . 1 . 2]" 1
154 1 76 ILE MG 1 80 ARG QD 3.650 . 5.500 3.988 2.283 5.547 0.047 17 0 "[ . 1 . 2]" 1
155 1 45 LEU MD1 1 72 GLU HB2 3.650 . 5.500 4.342 3.442 5.354 . 0 0 "[ . 1 . 2]" 1
156 1 67 LYS HE2 1 97 LEU MD1 3.650 . 5.500 4.378 3.098 5.512 0.012 16 0 "[ . 1 . 2]" 1
157 1 67 LYS HE3 1 97 LEU MD1 3.650 . 5.500 4.292 3.630 5.284 . 0 0 "[ . 1 . 2]" 1
158 1 48 VAL HB 1 75 LEU MD1 3.650 . 5.500 3.403 2.507 4.047 . 0 0 "[ . 1 . 2]" 1
159 1 48 VAL QG 1 75 LEU MD1 3.650 . 5.500 2.012 1.803 2.488 . 0 0 "[ . 1 . 2]" 1
160 1 100 VAL MG1 1 101 SER HA 3.650 . 5.500 5.452 4.468 5.560 0.060 13 0 "[ . 1 . 2]" 1
161 1 99 LYS HG3 1 100 VAL MG1 3.650 . 5.500 4.539 2.362 5.515 0.015 10 0 "[ . 1 . 2]" 1
162 1 45 LEU MD2 1 75 LEU MD2 3.650 . 5.500 3.767 3.186 4.575 . 0 0 "[ . 1 . 2]" 1
163 1 96 ILE MD 1 96 ILE MG 3.650 . 4.500 2.005 1.979 2.051 . 0 0 "[ . 1 . 2]" 1
164 1 93 LEU HG 1 96 ILE MD 3.650 . 5.500 4.963 4.315 5.595 0.095 15 0 "[ . 1 . 2]" 1
165 1 92 GLY QA 1 95 GLU QB 3.650 . 5.500 2.741 2.342 3.249 . 0 0 "[ . 1 . 2]" 1
166 1 91 GLN QG 1 92 GLY QA 3.650 . 5.500 4.387 3.029 5.458 . 0 0 "[ . 1 . 2]" 1
167 1 90 GLU HB2 1 94 ILE MD 3.650 . 5.500 3.935 3.633 5.055 . 0 0 "[ . 1 . 2]" 1
168 1 54 ARG HD3 1 57 LEU MD2 3.650 . 5.500 4.559 3.765 5.506 0.006 2 0 "[ . 1 . 2]" 1
169 1 79 ALA HA 1 84 LEU QB 3.650 . 5.500 3.458 1.995 5.399 . 0 0 "[ . 1 . 2]" 1
170 1 72 GLU HA 1 75 LEU HB3 3.650 . 5.500 4.608 4.047 4.917 . 0 0 "[ . 1 . 2]" 1
171 1 42 ASN HA 1 45 LEU HB2 3.650 . 5.500 2.714 1.948 3.746 . 0 0 "[ . 1 . 2]" 1
172 1 42 ASN HA 1 45 LEU HB3 3.650 . 5.500 4.332 3.570 5.473 . 0 0 "[ . 1 . 2]" 1
173 1 27 ASP QB 1 30 GLN QB 3.650 . 5.500 5.059 4.281 5.611 0.111 5 0 "[ . 1 . 2]" 1
174 1 27 ASP QB 1 30 GLN QG 3.650 . 5.500 4.543 3.300 5.447 . 0 0 "[ . 1 . 2]" 1
175 1 24 ASP HB3 1 25 PRO HD3 3.650 . 5.500 4.377 3.550 5.099 . 0 0 "[ . 1 . 2]" 1
176 1 50 ASP HB3 1 87 LYS QG 3.650 . 5.500 4.894 3.739 5.530 0.030 18 0 "[ . 1 . 2]" 1
177 1 50 ASP HB2 1 87 LYS QG 3.650 . 5.500 3.512 2.150 4.289 . 0 0 "[ . 1 . 2]" 1
178 1 71 VAL HA 1 74 TYR HB3 3.650 . 5.500 2.547 2.319 2.837 . 0 0 "[ . 1 . 2]" 1
179 1 74 TYR HB2 1 75 LEU MD2 3.650 . 5.500 4.285 4.105 4.506 . 0 0 "[ . 1 . 2]" 1
180 1 74 TYR HB3 1 75 LEU MD2 3.650 . 5.500 2.762 2.551 3.006 . 0 0 "[ . 1 . 2]" 1
181 1 78 MET HA 1 81 TYR HB2 3.650 . 5.500 3.260 2.557 4.032 . 0 0 "[ . 1 . 2]" 1
182 1 42 ASN HB2 1 45 LEU MD1 3.650 . 5.500 4.572 3.519 5.504 0.004 13 0 "[ . 1 . 2]" 1
183 1 72 GLU HB3 1 73 ASN HB2 3.650 . 5.500 5.072 4.734 5.480 . 0 0 "[ . 1 . 2]" 1
184 1 45 LEU MD1 1 72 GLU HG2 3.650 . 5.500 2.881 2.080 4.093 . 0 0 "[ . 1 . 2]" 1
185 1 72 GLU HA 1 72 GLU HG2 3.650 . 5.500 2.518 2.395 2.635 . 0 0 "[ . 1 . 2]" 1
186 1 68 THR HB 1 72 GLU HG3 3.650 . 5.500 4.477 4.112 4.788 . 0 0 "[ . 1 . 2]" 1
187 1 69 LYS HA 1 72 GLU HG3 3.650 . 5.500 3.602 3.026 4.148 . 0 0 "[ . 1 . 2]" 1
188 1 71 VAL MG2 1 72 GLU HG3 3.650 . 4.500 2.859 2.457 3.218 . 0 0 "[ . 1 . 2]" 1
189 1 69 LYS HA 1 72 GLU HG2 3.650 . 5.500 4.956 4.313 5.509 0.009 15 0 "[ . 1 . 2]" 1
190 1 57 LEU MD1 1 68 THR HB 3.900 . 6.000 4.422 4.154 5.016 . 0 0 "[ . 1 . 2]" 1
191 1 68 THR HB 1 72 GLU HB2 3.650 . 5.500 5.537 5.508 5.587 0.087 10 0 "[ . 1 . 2]" 1
192 1 68 THR HA 1 71 VAL MG2 3.650 . 5.500 2.112 1.839 2.309 . 0 0 "[ . 1 . 2]" 1
193 1 61 ALA MB 1 68 THR HA 3.650 . 5.500 4.865 4.550 5.217 . 0 0 "[ . 1 . 2]" 1
194 1 47 GLN HG3 1 48 VAL QG 3.650 . 5.500 4.558 2.232 5.559 0.059 19 0 "[ . 1 . 2]" 1
195 1 76 ILE MG 1 77 GLN QG 3.650 . 5.500 3.965 2.806 5.433 . 0 0 "[ . 1 . 2]" 1
196 1 63 VAL HB 1 64 LYS QG 3.650 . 5.500 3.475 2.857 4.391 . 0 0 "[ . 1 . 2]" 1
197 1 61 ALA HA 1 68 THR HA 3.650 . 5.500 4.890 4.378 5.221 . 0 0 "[ . 1 . 2]" 1
198 1 65 PRO HA 1 68 THR HA 3.650 . 5.000 4.780 4.470 5.030 0.030 10 0 "[ . 1 . 2]" 1
199 1 77 GLN QG 1 81 TYR QD 3.650 . 5.500 4.935 2.699 5.548 0.048 13 0 "[ . 1 . 2]" 1
200 1 87 LYS HB3 1 87 LYS QE 3.650 . 5.500 3.850 2.038 4.546 . 0 0 "[ . 1 . 2]" 1
201 1 71 VAL HA 1 74 TYR QD 3.650 . 5.500 4.124 3.544 4.454 . 0 0 "[ . 1 . 2]" 1
202 1 65 PRO HA 1 68 THR MG 3.650 . 5.500 3.537 3.254 3.862 . 0 0 "[ . 1 . 2]" 1
203 1 65 PRO HA 1 65 PRO HD3 3.650 . 5.500 3.671 3.429 3.883 . 0 0 "[ . 1 . 2]" 1
204 1 74 TYR HB2 1 74 TYR QD . . 3.500 2.505 2.330 2.749 . 0 0 "[ . 1 . 2]" 1
205 1 74 TYR HA 1 74 TYR QD 3.650 . 4.500 2.648 2.171 3.048 . 0 0 "[ . 1 . 2]" 1
206 1 74 TYR QD 1 77 GLN QB 3.650 . 4.500 4.139 3.506 4.575 0.075 17 0 "[ . 1 . 2]" 1
207 1 71 VAL HB 1 100 VAL MG1 3.650 . 5.500 4.397 3.799 5.134 . 0 0 "[ . 1 . 2]" 1
208 1 70 ALA MB 1 100 VAL HB 3.650 . 5.500 2.299 1.927 3.459 . 0 0 "[ . 1 . 2]" 1
209 1 94 ILE HA 1 94 ILE HG12 3.650 . 4.500 2.601 2.485 3.306 . 0 0 "[ . 1 . 2]" 1
210 1 44 ILE HA 1 48 VAL QG 3.650 . 5.500 3.619 2.723 4.331 . 0 0 "[ . 1 . 2]" 1
211 1 2 SER HB3 1 5 GLU QG 3.650 . 5.500 4.056 2.841 5.304 . 0 0 "[ . 1 . 2]" 1
212 1 56 ARG QB 1 56 ARG HD2 3.650 . 5.500 2.965 2.244 3.449 . 0 0 "[ . 1 . 2]" 1
213 1 52 SER HB2 1 55 ALA MB 3.650 . 5.500 4.871 4.356 5.218 . 0 0 "[ . 1 . 2]" 1
214 1 74 TYR HA 1 100 VAL MG1 3.650 . 5.500 5.224 4.713 5.580 0.080 1 0 "[ . 1 . 2]" 1
215 1 57 LEU MD1 1 58 SER HA 3.650 . 5.500 4.810 3.775 5.068 . 0 0 "[ . 1 . 2]" 1
216 1 74 TYR HA 1 77 GLN QG 3.650 . 4.500 3.544 1.969 4.502 0.002 20 0 "[ . 1 . 2]" 1
217 1 90 GLU HA 1 93 LEU MD2 3.650 . 5.500 3.525 3.168 3.808 . 0 0 "[ . 1 . 2]" 1
218 1 72 GLU HA 1 75 LEU MD1 3.650 . 5.500 5.425 5.234 5.567 0.067 16 0 "[ . 1 . 2]" 1
219 1 49 LEU HA 1 49 LEU MD2 3.650 . 5.500 2.100 1.977 2.198 . 0 0 "[ . 1 . 2]" 1
220 1 65 PRO QG 1 66 GLU HA 3.650 . 5.500 4.906 4.152 5.541 0.041 8 0 "[ . 1 . 2]" 1
221 1 90 GLU HA 1 93 LEU MD1 3.900 . 6.000 5.202 4.866 5.417 . 0 0 "[ . 1 . 2]" 1
222 1 72 GLU HA 1 75 LEU HB2 3.650 . 5.500 2.964 2.554 3.243 . 0 0 "[ . 1 . 2]" 1
223 1 49 LEU HG 1 93 LEU MD1 3.650 . 5.500 4.349 3.937 4.723 . 0 0 "[ . 1 . 2]" 1
224 1 57 LEU MD2 1 72 GLU HG2 3.650 . 5.500 2.647 1.914 4.830 . 0 0 "[ . 1 . 2]" 1
225 1 57 LEU MD2 1 71 VAL HB 3.650 . 5.500 4.824 3.001 5.506 0.006 1 0 "[ . 1 . 2]" 1
226 1 41 ARG QG 1 45 LEU MD1 3.650 . 5.500 3.693 2.049 5.154 . 0 0 "[ . 1 . 2]" 1
227 1 44 ILE HG12 1 45 LEU MD1 3.650 . 5.500 4.591 2.699 4.951 . 0 0 "[ . 1 . 2]" 1
228 1 79 ALA HA 1 84 LEU MD1 3.650 . 5.500 4.553 3.673 5.317 . 0 0 "[ . 1 . 2]" 1
229 1 48 VAL HA 1 84 LEU MD1 3.650 . 5.500 3.317 1.774 5.190 0.026 19 0 "[ . 1 . 2]" 1
230 1 84 LEU MD1 1 86 GLU HB3 3.650 . 5.500 5.076 3.177 5.553 0.053 20 0 "[ . 1 . 2]" 1
231 1 63 VAL HA 1 64 LYS QG 3.650 . 5.500 4.435 4.074 5.041 . 0 0 "[ . 1 . 2]" 1
232 1 56 ARG HA 1 60 LEU MD2 3.650 . 5.500 4.532 3.404 5.543 0.043 5 0 "[ . 1 . 2]" 1
233 1 60 LEU MD1 1 67 LYS HA 3.900 . 6.000 5.255 4.232 6.013 0.013 15 0 "[ . 1 . 2]" 1
234 1 60 LEU MD1 1 64 LYS QE 3.650 . 5.500 4.274 2.670 5.281 . 0 0 "[ . 1 . 2]" 1
235 1 57 LEU MD1 1 71 VAL HA 3.650 . 5.500 5.386 5.186 5.566 0.066 14 0 "[ . 1 . 2]" 1
236 1 57 LEU MD1 1 71 VAL HB 3.650 . 5.500 3.866 3.634 4.197 . 0 0 "[ . 1 . 2]" 1
237 1 81 TYR HA 1 81 TYR QE 3.650 . 5.500 4.472 4.317 4.646 . 0 0 "[ . 1 . 2]" 1
238 1 68 THR HA 1 71 VAL MG1 3.650 . 5.500 3.866 3.674 4.088 . 0 0 "[ . 1 . 2]" 1
239 1 67 LYS HB2 1 71 VAL MG1 3.650 . 5.500 4.536 4.261 5.298 . 0 0 "[ . 1 . 2]" 1
240 1 47 GLN HA 1 87 LYS QE 3.650 . 5.500 4.015 2.324 5.614 0.114 3 0 "[ . 1 . 2]" 1
241 1 45 LEU MD2 1 76 ILE HA 3.650 . 5.500 3.622 2.710 5.101 . 0 0 "[ . 1 . 2]" 1
242 1 45 LEU MD2 1 72 GLU HG2 3.650 . 5.500 3.475 2.290 4.205 . 0 0 "[ . 1 . 2]" 1
243 1 42 ASN HA 1 45 LEU MD2 3.650 . 5.500 4.897 3.952 5.545 0.045 9 0 "[ . 1 . 2]" 1
244 1 45 LEU MD2 1 49 LEU HB2 3.650 . 5.500 4.801 3.962 5.508 0.008 5 0 "[ . 1 . 2]" 1
245 1 105 GLU HA 1 105 GLU QG 3.650 . 4.500 2.946 2.369 3.532 . 0 0 "[ . 1 . 2]" 1
246 1 111 LYS HA 1 111 LYS QD 3.650 . 5.500 3.632 2.111 4.277 . 0 0 "[ . 1 . 2]" 1
247 1 73 ASN HA 1 76 ILE QG 3.650 . 5.500 3.223 2.627 3.828 . 0 0 "[ . 1 . 2]" 1
248 1 110 VAL MG2 1 111 LYS HA 3.650 . 5.500 4.750 3.584 5.548 0.048 11 0 "[ . 1 . 2]" 1
249 1 60 LEU HA 1 63 VAL MG1 3.650 . 4.500 3.656 1.892 4.095 . 0 0 "[ . 1 . 2]" 1
250 1 57 LEU HB3 1 68 THR MG 3.650 . 5.500 4.543 3.577 4.979 . 0 0 "[ . 1 . 2]" 1
251 1 48 VAL QG 1 84 LEU HG 3.650 . 5.500 2.616 1.729 4.026 0.071 1 0 "[ . 1 . 2]" 1
252 1 71 VAL MG2 1 72 GLU HB3 3.650 . 5.500 4.822 4.561 4.991 . 0 0 "[ . 1 . 2]" 1
253 1 60 LEU HB2 1 71 VAL MG2 3.650 . 5.500 4.760 3.959 5.468 . 0 0 "[ . 1 . 2]" 1
254 1 37 GLU QB 1 38 ALA HA 3.650 . 5.500 3.870 3.612 4.368 . 0 0 "[ . 1 . 2]" 1
255 1 53 ALA HA 1 90 GLU HG3 3.650 . 5.500 3.480 2.850 3.951 . 0 0 "[ . 1 . 2]" 1
256 1 53 ALA HA 1 56 ARG HG2 3.650 . 5.500 3.918 3.556 4.425 . 0 0 "[ . 1 . 2]" 1
257 1 49 LEU MD2 1 53 ALA HA 3.650 . 5.500 4.433 3.985 5.068 . 0 0 "[ . 1 . 2]" 1
258 1 47 GLN HA 1 48 VAL QG 3.650 . 5.500 4.581 4.352 4.934 . 0 0 "[ . 1 . 2]" 1
259 1 74 TYR QE 1 100 VAL MG1 3.650 . 5.500 4.700 4.003 5.354 . 0 0 "[ . 1 . 2]" 1
260 1 67 LYS HA 1 100 VAL MG1 3.650 . 5.500 5.072 4.282 5.533 0.033 11 0 "[ . 1 . 2]" 1
261 1 64 LYS HA 1 65 PRO QG 3.650 . 4.500 3.855 3.708 3.985 . 0 0 "[ . 1 . 2]" 1
262 1 63 VAL MG2 1 64 LYS HB3 3.650 . 5.500 4.179 3.009 4.750 . 0 0 "[ . 1 . 2]" 1
263 1 50 ASP HA 1 87 LYS HB3 3.650 . 5.500 3.022 2.149 3.937 . 0 0 "[ . 1 . 2]" 1
264 1 50 ASP HA 1 87 LYS QE 3.650 . 5.500 3.869 1.977 5.177 . 0 0 "[ . 1 . 2]" 1
265 1 50 ASP HA 1 51 GLN HA 3.650 . 5.500 4.287 4.151 4.363 . 0 0 "[ . 1 . 2]" 1
266 1 53 ALA MB 1 93 LEU HG 3.650 . 5.500 4.577 4.391 4.963 . 0 0 "[ . 1 . 2]" 1
267 1 24 ASP HA 1 25 PRO QG 3.650 . 5.500 3.842 3.610 4.202 . 0 0 "[ . 1 . 2]" 1
268 1 74 TYR HB2 1 96 ILE MG 3.650 . 5.500 3.620 3.104 3.976 . 0 0 "[ . 1 . 2]" 1
269 1 71 VAL HA 1 96 ILE MG 3.650 . 5.500 2.880 2.518 3.401 . 0 0 "[ . 1 . 2]" 1
270 1 96 ILE MG 1 97 LEU HA 3.650 . 5.500 3.542 3.278 3.748 . 0 0 "[ . 1 . 2]" 1
271 1 93 LEU HA 1 96 ILE MG 3.650 . 5.500 4.088 3.870 4.524 . 0 0 "[ . 1 . 2]" 1
272 1 71 VAL HB 1 96 ILE MG 3.650 . 5.500 2.896 2.578 3.227 . 0 0 "[ . 1 . 2]" 1
273 1 93 LEU HG 1 96 ILE MG 3.650 . 5.500 4.935 4.346 5.508 0.008 5 0 "[ . 1 . 2]" 1
274 1 44 ILE MG 1 48 VAL QG 3.650 . 5.500 4.113 3.299 4.930 . 0 0 "[ . 1 . 2]" 1
275 1 91 GLN HA 1 94 ILE MG 3.650 . 4.500 3.898 3.524 4.138 . 0 0 "[ . 1 . 2]" 1
276 1 25 PRO HA 1 25 PRO HD2 3.650 . 5.500 3.959 3.852 4.099 . 0 0 "[ . 1 . 2]" 1
277 1 25 PRO HA 1 25 PRO HD3 3.650 . 5.500 3.836 3.489 4.055 . 0 0 "[ . 1 . 2]" 1
278 1 24 ASP HB3 1 25 PRO HD2 3.650 . 5.500 4.312 3.502 4.972 . 0 0 "[ . 1 . 2]" 1
279 1 24 ASP HB2 1 25 PRO HD3 3.650 . 5.500 3.715 2.513 4.880 . 0 0 "[ . 1 . 2]" 1
280 1 24 ASP HB2 1 25 PRO HD2 3.650 . 5.500 3.260 2.035 4.655 . 0 0 "[ . 1 . 2]" 1
281 1 25 PRO HB3 1 25 PRO HD2 3.650 . 5.500 3.887 3.811 3.962 . 0 0 "[ . 1 . 2]" 1
282 1 25 PRO HB3 1 25 PRO HD3 3.650 . 4.500 3.660 2.947 4.076 . 0 0 "[ . 1 . 2]" 1
283 1 65 PRO HB3 1 65 PRO HD2 3.650 . 5.500 3.881 3.850 3.916 . 0 0 "[ . 1 . 2]" 1
284 1 64 LYS QG 1 65 PRO HD2 3.650 . 5.500 4.600 3.948 5.307 . 0 0 "[ . 1 . 2]" 1
285 1 64 LYS QG 1 65 PRO HD3 3.900 . 6.000 4.654 4.099 5.130 . 0 0 "[ . 1 . 2]" 1
286 1 64 LYS HB3 1 65 PRO HD3 3.650 . 5.500 4.607 4.253 5.031 . 0 0 "[ . 1 . 2]" 1
287 1 64 LYS HB3 1 65 PRO HD2 3.650 . 5.500 4.141 3.440 5.079 . 0 0 "[ . 1 . 2]" 1
288 1 65 PRO HA 1 65 PRO HD2 3.650 . 5.500 4.006 3.892 4.097 . 0 0 "[ . 1 . 2]" 1
289 1 81 TYR HA 1 81 TYR QD 3.150 . 4.500 2.476 2.029 3.084 . 0 0 "[ . 1 . 2]" 1
290 1 89 SER HA 1 89 SER HB3 2.650 . 2.800 2.420 2.354 2.483 . 0 0 "[ . 1 . 2]" 1
291 1 89 SER HA 1 89 SER HB2 2.650 . 3.500 2.900 2.504 3.039 . 0 0 "[ . 1 . 2]" 1
292 1 64 LYS HA 1 65 PRO HD2 2.650 . 3.500 2.251 1.927 2.700 . 0 0 "[ . 1 . 2]" 1
293 1 64 LYS HA 1 65 PRO HD3 3.150 . 4.500 2.338 1.992 2.897 . 0 0 "[ . 1 . 2]" 1
294 1 24 ASP HA 1 25 PRO HD3 2.650 . 2.800 2.074 1.869 2.543 . 0 0 "[ . 1 . 2]" 1
295 1 24 ASP HA 1 25 PRO HD2 2.650 . 3.500 2.751 2.125 3.412 . 0 0 "[ . 1 . 2]" 1
296 1 49 LEU HA 1 49 LEU MD1 3.150 . 4.500 3.875 3.833 3.922 . 0 0 "[ . 1 . 2]" 1
297 1 81 TYR HA 1 81 TYR HB2 2.650 . 3.500 3.023 3.007 3.035 . 0 0 "[ . 1 . 2]" 1
298 1 81 TYR HA 1 81 TYR HB3 2.650 . 3.500 2.506 2.450 2.613 . 0 0 "[ . 1 . 2]" 1
299 1 50 ASP HA 1 50 ASP HB2 2.650 . 3.500 2.500 2.430 2.612 . 0 0 "[ . 1 . 2]" 1
300 1 50 ASP HA 1 50 ASP HB3 2.650 . 3.500 3.033 3.015 3.049 . 0 0 "[ . 1 . 2]" 1
301 1 84 LEU HA 1 84 LEU MD2 3.150 . 4.500 3.041 2.067 4.001 . 0 0 "[ . 1 . 2]" 1
302 1 59 ASN HA 1 59 ASN HB3 2.650 . 3.500 2.888 2.506 3.040 . 0 0 "[ . 1 . 2]" 1
303 1 59 ASN HA 1 59 ASN HB2 2.650 . 3.500 2.628 2.381 3.033 . 0 0 "[ . 1 . 2]" 1
304 1 35 HIS HA 1 35 HIS HB3 2.650 . 3.500 3.032 3.006 3.050 . 0 0 "[ . 1 . 2]" 1
305 1 35 HIS HA 1 35 HIS HB2 2.650 . 2.800 2.497 2.436 2.612 . 0 0 "[ . 1 . 2]" 1
306 1 86 GLU HA 1 86 GLU QG 3.150 . 4.500 2.767 2.370 3.195 . 0 0 "[ . 1 . 2]" 1
307 1 42 ASN HA 1 42 ASN HB2 2.650 . 3.500 2.531 2.413 3.020 . 0 0 "[ . 1 . 2]" 1
308 1 73 ASN HA 1 76 ILE HB 3.150 . 3.500 2.875 2.449 3.434 . 0 0 "[ . 1 . 2]" 1
309 1 108 THR HA 1 108 THR HB 2.650 . 3.500 2.952 2.426 3.055 . 0 0 "[ . 1 . 2]" 1
310 1 25 PRO HA 1 25 PRO HB3 2.650 . 3.500 2.296 2.261 2.348 . 0 0 "[ . 1 . 2]" 1
311 1 48 VAL HA 1 48 VAL HB 2.650 . 3.500 2.738 2.411 3.058 . 0 0 "[ . 1 . 2]" 1
312 1 85 SER HA 1 85 SER HB2 2.650 . 3.300 2.929 2.521 3.048 . 0 0 "[ . 1 . 2]" 1
313 1 85 SER HA 1 85 SER HB3 2.650 . 3.500 2.561 2.393 3.052 . 0 0 "[ . 1 . 2]" 1
314 1 48 VAL HA 1 87 LYS HA 3.150 . 4.500 3.211 2.651 3.501 . 0 0 "[ . 1 . 2]" 1
315 1 63 VAL HA 1 63 VAL HB 2.650 . 3.500 2.488 2.438 2.534 . 0 0 "[ . 1 . 2]" 1
316 1 65 PRO HA 1 65 PRO QG 3.150 . 4.500 3.250 2.938 3.510 . 0 0 "[ . 1 . 2]" 1
317 1 63 VAL HA 1 63 VAL MG1 3.150 . 4.500 2.403 2.268 3.233 . 0 0 "[ . 1 . 2]" 1
318 1 104 THR HA 1 104 THR MG 3.150 . 4.500 2.425 2.277 3.245 . 0 0 "[ . 1 . 2]" 1
319 1 61 ALA HA 1 65 PRO HA 3.150 . 4.500 2.480 2.202 2.814 . 0 0 "[ . 1 . 2]" 1
320 1 105 GLU HA 1 105 GLU HB3 2.650 . 3.500 2.683 2.340 3.044 . 0 0 "[ . 1 . 2]" 1
321 1 52 SER HA 1 52 SER HB2 2.650 . 3.500 2.851 2.507 3.040 . 0 0 "[ . 1 . 2]" 1
322 1 83 GLN HA 1 83 GLN QG 3.150 . 3.500 2.823 2.350 3.366 . 0 0 "[ . 1 . 2]" 1
323 1 43 SER HA 1 43 SER HB3 2.650 . 2.800 2.422 2.354 2.498 . 0 0 "[ . 1 . 2]" 1
324 1 47 GLN HA 1 47 GLN HG2 3.150 . 4.500 3.132 2.432 3.771 . 0 0 "[ . 1 . 2]" 1
325 1 19 GLN HA 1 19 GLN HG2 2.300 . 2.800 2.698 2.463 2.892 0.092 18 0 "[ . 1 . 2]" 1
326 1 21 LYS HA 1 21 LYS HB3 2.650 . 3.500 2.616 2.352 3.041 . 0 0 "[ . 1 . 2]" 1
327 1 47 GLN HA 1 47 GLN QB 2.650 . 2.800 2.325 2.161 2.425 . 0 0 "[ . 1 . 2]" 1
328 1 70 ALA HA 1 73 ASN HB3 3.150 . 4.500 2.949 2.441 3.375 . 0 0 "[ . 1 . 2]" 1
329 1 70 ALA HA 1 73 ASN HB2 3.150 . 4.500 3.578 2.976 4.514 0.014 20 0 "[ . 1 . 2]" 1
330 1 107 THR HA 1 107 THR HB 2.300 . 2.800 2.671 2.369 2.973 0.173 2 0 "[ . 1 . 2]" 1
331 1 13 GLN HA 1 13 GLN HG3 2.650 . 3.500 2.638 2.501 3.558 0.058 8 0 "[ . 1 . 2]" 1
332 1 58 SER HA 1 58 SER HB2 2.650 . 3.500 2.779 2.469 3.023 . 0 0 "[ . 1 . 2]" 1
333 1 32 GLU HA 1 35 HIS HB2 3.150 . 4.500 3.090 2.208 3.755 . 0 0 "[ . 1 . 2]" 1
334 1 32 GLU HA 1 35 HIS HB3 . . 2.800 2.579 2.029 2.854 0.054 5 0 "[ . 1 . 2]" 1
335 1 67 LYS HA 1 67 LYS HE2 3.150 . 4.500 3.813 2.980 4.580 0.080 12 0 "[ . 1 . 2]" 1
336 1 67 LYS HA 1 67 LYS HE3 3.150 . 4.500 2.656 2.073 4.532 0.032 16 0 "[ . 1 . 2]" 1
337 1 10 LEU HA 1 10 LEU HB3 2.550 . 3.300 2.914 2.472 3.037 . 0 0 "[ . 1 . 2]" 1
338 1 15 LEU HA 1 15 LEU HB2 2.300 . 2.800 2.588 2.427 2.891 0.091 5 0 "[ . 1 . 2]" 1
339 1 56 ARG HA 1 59 ASN HB3 3.150 . 4.500 3.287 2.204 4.503 0.003 4 0 "[ . 1 . 2]" 1
340 1 37 GLU HA 1 37 GLU HG2 2.300 . 2.800 2.712 2.474 2.858 0.058 5 0 "[ . 1 . 2]" 1
341 1 67 LYS HA 1 67 LYS HB2 2.650 . 3.500 3.018 2.961 3.031 . 0 0 "[ . 1 . 2]" 1
342 1 14 ARG HA 1 14 ARG QB 2.300 . 2.800 2.408 2.315 2.539 . 0 0 "[ . 1 . 2]" 1
343 1 8 GLU HA 1 8 GLU QB 2.300 . 2.800 2.369 2.155 2.514 . 0 0 "[ . 1 . 2]" 1
344 1 13 GLN HA 1 13 GLN QB 2.300 . 2.800 2.358 2.301 2.395 . 0 0 "[ . 1 . 2]" 1
345 1 62 LEU HA 1 62 LEU HG 2.650 . 3.500 2.940 2.496 3.211 . 0 0 "[ . 1 . 2]" 1
346 1 34 LYS HA 1 34 LYS HG3 2.650 . 3.500 3.020 2.794 3.157 . 0 0 "[ . 1 . 2]" 1
347 1 10 LEU HA 1 10 LEU MD2 3.150 . 4.500 3.110 1.965 3.901 . 0 0 "[ . 1 . 2]" 1
348 1 18 LEU HA 1 18 LEU MD2 2.650 . 3.500 2.430 2.020 3.624 0.124 8 0 "[ . 1 . 2]" 1
349 1 28 ALA HA 1 28 ALA MB 2.300 . 2.800 2.129 2.114 2.145 . 0 0 "[ . 1 . 2]" 1
350 1 56 ARG HA 1 56 ARG HD2 2.650 . 3.500 2.716 1.940 3.547 0.047 9 0 "[ . 1 . 2]" 1
351 1 34 LYS HA 1 34 LYS QB 2.300 . 2.800 2.374 2.310 2.470 . 0 0 "[ . 1 . 2]" 1
352 1 34 LYS HA 1 34 LYS QD 2.650 . 3.500 2.131 1.908 2.951 . 0 0 "[ . 1 . 2]" 1
353 1 31 GLN HA 1 34 LYS HG2 3.150 . 4.500 4.400 3.928 4.615 0.115 12 0 "[ . 1 . 2]" 1
354 1 68 THR HA 1 68 THR MG 3.150 . 4.500 2.270 2.205 2.364 . 0 0 "[ . 1 . 2]" 1
355 1 46 ALA HA 1 54 ARG HD2 3.150 . 4.500 3.608 2.230 4.416 . 0 0 "[ . 1 . 2]" 1
356 1 38 ALA HA 1 42 ASN HB2 3.150 . 4.500 4.310 3.385 4.599 0.099 12 0 "[ . 1 . 2]" 1
357 1 99 LYS HA 1 99 LYS HG2 3.150 . 4.500 3.059 2.493 4.271 . 0 0 "[ . 1 . 2]" 1
358 1 33 ALA HA 1 33 ALA MB 2.300 . 2.800 2.138 2.129 2.145 . 0 0 "[ . 1 . 2]" 1
359 1 60 LEU HA 1 60 LEU MD1 3.150 . 4.500 2.483 1.988 3.701 . 0 0 "[ . 1 . 2]" 1
360 1 60 LEU HA 1 63 VAL MG2 3.150 . 4.500 2.258 1.902 4.525 0.025 4 0 "[ . 1 . 2]" 1
361 1 12 ARG HA 1 15 LEU HB3 3.150 . 4.500 2.957 1.973 4.250 . 0 0 "[ . 1 . 2]" 1
362 1 12 ARG HA 1 15 LEU HB2 3.150 . 4.500 2.983 2.464 3.744 . 0 0 "[ . 1 . 2]" 1
363 1 91 GLN HA 1 94 ILE HB . . 2.800 2.578 2.118 2.844 0.044 6 0 "[ . 1 . 2]" 1
364 1 57 LEU HA 1 57 LEU MD1 3.150 . 4.500 2.187 1.975 4.005 . 0 0 "[ . 1 . 2]" 1
365 1 93 LEU HA 1 96 ILE MD 3.150 . 4.500 2.703 2.108 3.779 . 0 0 "[ . 1 . 2]" 1
366 1 91 GLN HA 1 91 GLN QG 3.150 . 4.500 2.844 2.370 3.531 . 0 0 "[ . 1 . 2]" 1
367 1 12 ARG HA 1 12 ARG HB2 2.550 . 3.300 2.967 2.518 3.029 . 0 0 "[ . 1 . 2]" 1
368 1 11 ARG HA 1 11 ARG QG 3.150 . 4.500 2.480 2.323 2.671 . 0 0 "[ . 1 . 2]" 1
369 1 69 LYS HA 1 69 LYS QB 2.300 . 2.800 2.307 2.156 2.492 . 0 0 "[ . 1 . 2]" 1
370 1 80 ARG HA 1 80 ARG HB2 2.650 . 3.500 2.607 2.411 2.997 . 0 0 "[ . 1 . 2]" 1
371 1 80 ARG HA 1 80 ARG HB3 2.650 . 3.500 2.924 2.563 3.033 . 0 0 "[ . 1 . 2]" 1
372 1 2 SER HB3 1 5 GLU QB 3.150 . 4.500 2.786 1.868 4.539 0.039 5 0 "[ . 1 . 2]" 1
373 1 51 GLN HA 1 51 GLN HB2 2.650 . 3.500 2.562 2.410 2.997 . 0 0 "[ . 1 . 2]" 1
374 1 53 ALA HA 1 90 GLU HA 3.150 . 4.500 2.802 2.247 3.174 . 0 0 "[ . 1 . 2]" 1
375 1 80 ARG HA 1 80 ARG QG 3.150 . 4.500 2.584 2.265 2.953 . 0 0 "[ . 1 . 2]" 1
376 1 101 SER HA 1 101 SER HB2 2.550 . 3.300 2.807 2.407 3.030 . 0 0 "[ . 1 . 2]" 1
377 1 45 LEU HA 1 45 LEU MD2 3.150 . 4.500 2.151 2.019 3.683 . 0 0 "[ . 1 . 2]" 1
378 1 77 GLN HA 1 77 GLN QG 3.150 . 4.500 2.691 2.342 3.333 . 0 0 "[ . 1 . 2]" 1
379 1 100 VAL HA 1 100 VAL HB 2.650 . 3.500 2.451 2.384 3.066 . 0 0 "[ . 1 . 2]" 1
380 1 75 LEU HA 1 75 LEU MD2 3.150 . 4.500 2.749 2.508 3.103 . 0 0 "[ . 1 . 2]" 1
381 1 100 VAL HA 1 100 VAL MG1 2.650 . 3.500 2.391 2.220 2.464 . 0 0 "[ . 1 . 2]" 1
382 1 44 ILE HA 1 44 ILE MD 3.150 . 4.500 4.184 3.653 4.233 . 0 0 "[ . 1 . 2]" 1
383 1 54 ARG HA 1 54 ARG HD2 3.150 . 4.500 2.741 1.971 4.525 0.025 13 0 "[ . 1 . 2]" 1
384 1 54 ARG HA 1 54 ARG HB3 2.650 . 3.500 2.692 2.514 3.009 . 0 0 "[ . 1 . 2]" 1
385 1 44 ILE HA 1 44 ILE HG13 3.150 . 4.500 3.789 3.714 4.278 . 0 0 "[ . 1 . 2]" 1
386 1 44 ILE HA 1 44 ILE HG12 3.150 . 4.500 3.795 3.682 3.930 . 0 0 "[ . 1 . 2]" 1
387 1 44 ILE HA 1 44 ILE MG 3.150 . 4.500 2.348 2.267 2.478 . 0 0 "[ . 1 . 2]" 1
388 1 97 LEU HA 1 97 LEU MD1 3.150 . 4.500 2.112 2.028 2.194 . 0 0 "[ . 1 . 2]" 1
389 1 97 LEU HA 1 100 VAL MG1 3.150 . 4.500 3.730 3.140 4.497 . 0 0 "[ . 1 . 2]" 1
390 1 94 ILE HA 1 97 LEU MD1 3.150 . 4.500 4.476 4.275 4.546 0.046 3 0 "[ . 1 . 2]" 1
391 1 71 VAL HA 1 71 VAL MG2 3.150 . 4.500 3.226 3.206 3.249 . 0 0 "[ . 1 . 2]" 1
392 1 71 VAL HA 1 100 VAL MG1 3.150 . 4.500 2.831 2.363 3.564 . 0 0 "[ . 1 . 2]" 1
393 1 94 ILE HA 1 94 ILE MG 3.150 . 4.500 2.495 2.314 2.576 . 0 0 "[ . 1 . 2]" 1
394 1 76 ILE HA 1 76 ILE MG 3.150 . 4.500 2.502 2.391 2.607 . 0 0 "[ . 1 . 2]" 1
395 1 14 ARG QB 1 14 ARG QD 2.650 . 3.500 2.343 2.059 2.872 . 0 0 "[ . 1 . 2]" 1
396 1 67 LYS QD 1 67 LYS HE3 2.300 . 2.800 2.322 2.119 2.450 . 0 0 "[ . 1 . 2]" 1
397 1 11 ARG HA 1 11 ARG QD 3.150 . 4.500 4.041 3.948 4.266 . 0 0 "[ . 1 . 2]" 1
398 1 14 ARG HA 1 14 ARG QD 3.150 . 4.500 2.959 1.970 4.193 . 0 0 "[ . 1 . 2]" 1
399 1 80 ARG HB2 1 80 ARG QD 3.150 . 4.500 2.653 2.272 3.467 . 0 0 "[ . 1 . 2]" 1
400 1 99 LYS HD2 1 99 LYS QE 2.650 . 2.800 2.318 2.169 2.383 . 0 0 "[ . 1 . 2]" 1
401 1 69 LYS QE 1 69 LYS QG 3.150 . 4.500 2.347 2.110 2.773 . 0 0 "[ . 1 . 2]" 1
402 1 81 TYR HB3 1 83 GLN QG 3.150 . 4.500 2.981 2.106 4.235 . 0 0 "[ . 1 . 2]" 1
403 1 56 ARG HA 1 59 ASN HB2 3.150 . 4.500 3.304 2.552 4.436 . 0 0 "[ . 1 . 2]" 1
404 1 4 ASP HA 1 4 ASP HB3 2.650 . 3.500 2.749 2.442 3.045 . 0 0 "[ . 1 . 2]" 1
405 1 17 GLU HA 1 17 GLU HG2 2.650 . 3.500 2.861 2.382 3.156 . 0 0 "[ . 1 . 2]" 1
406 1 103 GLN HA 1 103 GLN HG3 2.650 . 3.500 3.158 2.374 3.652 0.152 11 0 "[ . 1 . 2]" 1
407 1 34 LYS QD 1 37 GLU HG3 3.150 . 4.500 3.299 2.202 4.381 . 0 0 "[ . 1 . 2]" 1
408 1 95 GLU QB 1 95 GLU QG 2.300 . 2.800 2.023 1.968 2.087 . 0 0 "[ . 1 . 2]" 1
409 1 95 GLU HA 1 95 GLU QG 3.150 . 4.500 2.727 2.347 3.311 . 0 0 "[ . 1 . 2]" 1
410 1 102 GLN HA 1 102 GLN QG 3.150 . 4.500 2.717 2.423 3.367 . 0 0 "[ . 1 . 2]" 1
411 1 103 GLN QB 1 103 GLN HG2 2.300 . 2.800 2.298 2.144 2.365 . 0 0 "[ . 1 . 2]" 1
412 1 32 GLU HA 1 32 GLU QG 2.650 . 3.500 2.624 2.358 3.327 . 0 0 "[ . 1 . 2]" 1
413 1 13 GLN HA 1 13 GLN HG2 2.650 . 3.500 3.114 2.372 3.359 . 0 0 "[ . 1 . 2]" 1
414 1 102 GLN QB 1 102 GLN QG 2.300 . 2.800 2.049 1.978 2.090 . 0 0 "[ . 1 . 2]" 1
415 1 69 LYS HA 1 72 GLU HB2 3.150 . 4.500 2.639 2.269 3.217 . 0 0 "[ . 1 . 2]" 1
416 1 72 GLU HB2 1 73 ASN HB2 3.150 . 4.500 4.242 3.993 4.454 . 0 0 "[ . 1 . 2]" 1
417 1 86 GLU HB2 1 86 GLU QG 2.650 . 3.500 2.261 2.144 2.392 . 0 0 "[ . 1 . 2]" 1
418 1 25 PRO HB3 1 25 PRO QG 2.300 . 2.800 2.203 2.173 2.258 . 0 0 "[ . 1 . 2]" 1
419 1 103 GLN QB 1 103 GLN HG3 2.300 . 2.800 2.335 2.118 2.482 . 0 0 "[ . 1 . 2]" 1
420 1 99 LYS QE 1 105 GLU HB2 3.150 . 4.500 3.630 1.924 4.583 0.083 15 0 "[ . 1 . 2]" 1
421 1 19 GLN QB 1 19 GLN HG2 2.300 . 2.800 2.351 2.297 2.399 . 0 0 "[ . 1 . 2]" 1
422 1 37 GLU HA 1 37 GLU QB 2.300 . 2.800 2.398 2.340 2.442 . 0 0 "[ . 1 . 2]" 1
423 1 102 GLN HA 1 102 GLN QB 2.650 . 3.500 2.353 2.158 2.455 . 0 0 "[ . 1 . 2]" 1
424 1 94 ILE HB 1 94 ILE MD 3.150 . 4.500 2.512 2.412 3.261 . 0 0 "[ . 1 . 2]" 1
425 1 67 LYS HE3 1 100 VAL HB 3.150 . 4.500 3.892 3.206 4.549 0.049 16 0 "[ . 1 . 2]" 1
426 1 66 GLU QB 1 66 GLU HG3 2.300 . 2.800 2.322 2.129 2.435 . 0 0 "[ . 1 . 2]" 1
427 1 72 GLU HB2 1 72 GLU HG3 2.300 . 2.800 2.377 2.291 2.429 . 0 0 "[ . 1 . 2]" 1
428 1 94 ILE HB 1 94 ILE HG13 2.300 . 2.800 2.485 2.415 2.519 . 0 0 "[ . 1 . 2]" 1
429 1 74 TYR HA 1 77 GLN QB 3.150 . 4.500 2.946 2.553 4.020 . 0 0 "[ . 1 . 2]" 1
430 1 90 GLU HA 1 90 GLU HG2 3.150 . 4.500 2.562 2.424 2.681 . 0 0 "[ . 1 . 2]" 1
431 1 66 GLU QB 1 67 LYS QD 3.150 . 4.500 2.935 2.396 4.517 0.017 12 0 "[ . 1 . 2]" 1
432 1 77 GLN HA 1 77 GLN QB 2.650 . 3.500 2.371 2.174 2.534 . 0 0 "[ . 1 . 2]" 1
433 1 32 GLU HA 1 32 GLU QB 2.300 . 2.800 2.367 2.171 2.463 . 0 0 "[ . 1 . 2]" 1
434 1 34 LYS HA 1 37 GLU QB 2.300 . 2.800 2.523 1.929 2.858 0.058 7 0 "[ . 1 . 2]" 1
435 1 45 LEU MD2 1 75 LEU HG 3.150 . 4.500 3.422 2.723 4.299 . 0 0 "[ . 1 . 2]" 1
436 1 103 GLN HA 1 103 GLN QB 2.650 . 3.500 2.340 2.159 2.425 . 0 0 "[ . 1 . 2]" 1
437 1 53 ALA HA 1 90 GLU HB3 3.150 . 4.500 4.282 3.829 4.542 0.042 14 0 "[ . 1 . 2]" 1
438 1 28 ALA HA 1 31 GLN QB 3.150 . 4.500 2.796 1.993 3.422 . 0 0 "[ . 1 . 2]" 1
439 1 29 ALA HA 1 32 GLU QB 3.150 . 4.500 2.895 2.079 3.699 . 0 0 "[ . 1 . 2]" 1
440 1 53 ALA MB 1 93 LEU HB3 3.150 . 4.500 3.274 2.824 3.667 . 0 0 "[ . 1 . 2]" 1
441 1 49 LEU MD1 1 75 LEU HG 3.150 . 4.500 2.905 2.234 3.501 . 0 0 "[ . 1 . 2]" 1
442 1 96 ILE HB 1 96 ILE MD 3.150 . 4.500 2.581 2.368 3.237 . 0 0 "[ . 1 . 2]" 1
443 1 93 LEU HA 1 96 ILE HB 3.150 . 4.500 2.767 2.516 3.220 . 0 0 "[ . 1 . 2]" 1
444 1 90 GLU HB2 1 90 GLU HG2 2.650 . 3.500 2.983 2.841 3.022 . 0 0 "[ . 1 . 2]" 1
445 1 11 ARG HB2 1 11 ARG QD 2.300 . 2.800 2.422 2.277 2.815 0.015 7 0 "[ . 1 . 2]" 1
446 1 90 GLU HB2 1 90 GLU HG3 2.300 . 2.800 2.400 2.149 2.490 . 0 0 "[ . 1 . 2]" 1
447 1 11 ARG HB2 1 11 ARG QG 2.650 . 3.500 2.343 2.285 2.376 . 0 0 "[ . 1 . 2]" 1
448 1 67 LYS HB3 1 67 LYS QD 2.650 . 3.500 2.970 2.250 3.493 . 0 0 "[ . 1 . 2]" 1
449 1 11 ARG HA 1 11 ARG HB2 2.300 . 2.800 2.497 2.374 2.947 0.147 17 0 "[ . 1 . 2]" 1
450 1 56 ARG HA 1 56 ARG QB 2.300 . 2.800 2.420 2.361 2.499 . 0 0 "[ . 1 . 2]" 1
451 1 53 ALA HA 1 56 ARG QB 3.150 . 4.500 2.376 2.229 2.694 . 0 0 "[ . 1 . 2]" 1
452 1 33 ALA HA 1 36 ARG QB 3.150 . 4.500 2.899 2.216 4.042 . 0 0 "[ . 1 . 2]" 1
453 1 57 LEU HB3 1 57 LEU MD2 3.150 . 4.500 2.396 2.231 3.189 . 0 0 "[ . 1 . 2]" 1
454 1 9 ALA HA 1 12 ARG HB2 2.650 . 3.500 2.865 2.258 3.523 0.023 2 0 "[ . 1 . 2]" 1
455 1 61 ALA MB 1 62 LEU HB2 3.150 . 4.500 4.440 3.791 4.553 0.053 10 0 "[ . 1 . 2]" 1
456 1 99 LYS QB 1 99 LYS HD2 2.650 . 3.500 2.722 2.187 3.337 . 0 0 "[ . 1 . 2]" 1
457 1 54 ARG HB3 1 54 ARG HG3 2.300 . 2.800 2.530 2.405 2.880 0.080 8 0 "[ . 1 . 2]" 1
458 1 34 LYS QB 1 34 LYS HG2 2.650 . 2.800 2.163 2.099 2.182 . 0 0 "[ . 1 . 2]" 1
459 1 57 LEU MD1 1 60 LEU HB2 3.150 . 4.500 3.490 2.093 4.599 0.099 16 0 "[ . 1 . 2]" 1
460 1 59 ASN HA 1 62 LEU HB2 3.150 . 4.500 3.285 2.654 3.812 . 0 0 "[ . 1 . 2]" 1
461 1 96 ILE HA 1 99 LYS QB 3.150 . 4.500 3.133 2.242 4.542 0.042 5 0 "[ . 1 . 2]" 1
462 1 41 ARG HA 1 41 ARG QB 2.300 . 2.800 2.387 2.319 2.491 . 0 0 "[ . 1 . 2]" 1
463 1 45 LEU HA 1 45 LEU HG 2.650 . 3.500 3.103 2.550 3.302 . 0 0 "[ . 1 . 2]" 1
464 1 60 LEU HA 1 60 LEU HB2 2.650 . 3.500 2.794 2.445 2.999 . 0 0 "[ . 1 . 2]" 1
465 1 4 ASP HA 1 7 LEU HB3 3.150 . 4.500 2.788 2.141 3.454 . 0 0 "[ . 1 . 2]" 1
466 1 11 ARG HB3 1 11 ARG QD 2.300 . 2.800 2.469 2.257 2.833 0.033 6 0 "[ . 1 . 2]" 1
467 1 60 LEU HB2 1 68 THR MG 3.150 . 4.500 4.061 3.236 4.561 0.061 17 0 "[ . 1 . 2]" 1
468 1 11 ARG HB3 1 11 ARG QG 2.300 . 2.800 2.341 2.282 2.409 . 0 0 "[ . 1 . 2]" 1
469 1 11 ARG HA 1 11 ARG HB3 2.650 . 3.500 2.968 2.514 3.030 . 0 0 "[ . 1 . 2]" 1
470 1 56 ARG HG3 1 93 LEU MD2 3.150 . 4.500 3.367 2.593 4.512 0.012 18 0 "[ . 1 . 2]" 1
471 1 60 LEU MD1 1 67 LYS HB2 3.150 . 4.500 2.884 1.959 3.721 . 0 0 "[ . 1 . 2]" 1
472 1 15 LEU HB2 1 15 LEU MD1 2.650 . 3.500 2.545 2.212 3.230 . 0 0 "[ . 1 . 2]" 1
473 1 44 ILE HB 1 44 ILE HG13 2.650 . 3.500 2.461 2.340 2.502 . 0 0 "[ . 1 . 2]" 1
474 1 97 LEU QB 1 97 LEU MD1 2.650 . 3.500 2.288 2.265 2.313 . 0 0 "[ . 1 . 2]" 1
475 1 64 LYS HB3 1 64 LYS QG 2.300 . 2.800 2.360 2.162 2.468 . 0 0 "[ . 1 . 2]" 1
476 1 60 LEU HA 1 60 LEU HB3 2.650 . 3.500 2.762 2.373 3.003 . 0 0 "[ . 1 . 2]" 1
477 1 94 ILE HG13 1 94 ILE MG 3.150 . 4.500 3.122 2.275 3.226 . 0 0 "[ . 1 . 2]" 1
478 1 34 LYS QB 1 34 LYS QD 2.650 . 3.500 2.429 2.171 2.803 . 0 0 "[ . 1 . 2]" 1
479 1 34 LYS QD 1 37 GLU QB 3.150 . 4.500 2.807 2.190 3.898 . 0 0 "[ . 1 . 2]" 1
480 1 56 ARG HA 1 56 ARG HG3 2.300 . 2.800 2.812 2.567 2.889 0.089 17 0 "[ . 1 . 2]" 1
481 1 7 LEU HB2 1 7 LEU MD2 2.650 . 3.500 2.533 2.344 3.224 . 0 0 "[ . 1 . 2]" 1
482 1 14 ARG HA 1 14 ARG QG 2.650 . 3.500 2.665 2.348 3.035 . 0 0 "[ . 1 . 2]" 1
483 1 54 ARG HA 1 54 ARG HG3 3.150 . 4.500 3.098 2.250 3.786 . 0 0 "[ . 1 . 2]" 1
484 1 12 ARG HA 1 12 ARG HB3 2.300 . 2.800 2.568 2.442 2.929 0.129 5 0 "[ . 1 . 2]" 1
485 1 80 ARG HB3 1 80 ARG QD 2.650 . 3.500 2.686 2.212 3.501 0.001 1 0 "[ . 1 . 2]" 1
486 1 80 ARG HB3 1 80 ARG QG 2.650 . 3.500 2.305 2.154 2.525 . 0 0 "[ . 1 . 2]" 1
487 1 69 LYS HA 1 69 LYS QD 3.150 . 4.500 3.861 1.953 4.539 0.039 13 0 "[ . 1 . 2]" 1
488 1 49 LEU HB2 1 54 ARG HD2 2.650 . 3.500 2.593 1.929 3.487 . 0 0 "[ . 1 . 2]" 1
489 1 87 LYS QE 1 87 LYS QG 2.300 . 2.800 2.273 2.129 2.373 . 0 0 "[ . 1 . 2]" 1
490 1 87 LYS HB3 1 87 LYS QG 2.300 . 2.800 2.283 2.147 2.381 . 0 0 "[ . 1 . 2]" 1
491 1 21 LYS HB3 1 21 LYS HG3 2.650 . 3.500 2.875 2.446 3.022 . 0 0 "[ . 1 . 2]" 1
492 1 34 LYS HG3 1 37 GLU QB 3.150 . 4.500 3.837 3.303 4.322 . 0 0 "[ . 1 . 2]" 1
493 1 48 VAL HA 1 84 LEU HG 3.150 . 4.500 4.055 2.273 4.614 0.114 8 0 "[ . 1 . 2]" 1
494 1 43 SER HA 1 46 ALA MB 3.150 . 4.500 2.950 1.971 3.908 . 0 0 "[ . 1 . 2]" 1
495 1 41 ARG HA 1 41 ARG QG 3.150 . 4.500 2.500 2.295 2.968 . 0 0 "[ . 1 . 2]" 1
496 1 67 LYS HA 1 67 LYS QG 2.650 . 3.500 3.059 2.436 3.261 . 0 0 "[ . 1 . 2]" 1
497 1 35 HIS HA 1 38 ALA MB 3.150 . 4.500 2.919 2.201 3.857 . 0 0 "[ . 1 . 2]" 1
498 1 30 GLN HA 1 33 ALA MB 3.150 . 4.500 2.635 2.138 3.328 . 0 0 "[ . 1 . 2]" 1
499 1 87 LYS HA 1 87 LYS QG 2.650 . 3.500 2.559 2.378 2.993 . 0 0 "[ . 1 . 2]" 1
500 1 50 ASP HA 1 87 LYS QG 3.150 . 4.500 3.276 2.153 4.215 . 0 0 "[ . 1 . 2]" 1
501 1 34 LYS QD 1 34 LYS HG3 2.300 . 2.800 2.319 2.168 2.462 . 0 0 "[ . 1 . 2]" 1
502 1 41 ARG QG 1 76 ILE QG 3.150 . 4.500 3.408 2.276 4.540 0.040 20 0 "[ . 1 . 2]" 1
503 1 107 THR HA 1 107 THR MG 3.150 . 4.500 2.660 2.168 3.255 . 0 0 "[ . 1 . 2]" 1
504 1 44 ILE HG12 1 44 ILE MG 3.150 . 4.500 2.497 2.407 3.201 . 0 0 "[ . 1 . 2]" 1
505 1 44 ILE HG12 1 76 ILE HA 3.150 . 4.500 4.494 3.967 4.605 0.105 5 0 "[ . 1 . 2]" 1
506 1 44 ILE HG12 1 76 ILE QG 3.150 . 4.500 3.905 3.435 4.544 0.044 2 0 "[ . 1 . 2]" 1
507 1 96 ILE HA 1 96 ILE HG12 3.150 . 4.500 2.694 2.512 3.249 . 0 0 "[ . 1 . 2]" 1
508 1 62 LEU HB2 1 62 LEU MD1 3.150 . 3.500 2.342 2.216 2.401 . 0 0 "[ . 1 . 2]" 1
509 1 88 VAL HA 1 88 VAL MG2 2.650 . 3.500 2.429 2.247 2.499 . 0 0 "[ . 1 . 2]" 1
510 1 75 LEU HB3 1 75 LEU MD2 3.150 . 4.500 3.223 3.200 3.233 . 0 0 "[ . 1 . 2]" 1
511 1 7 LEU HB3 1 7 LEU MD1 2.650 . 3.500 2.883 2.344 3.213 . 0 0 "[ . 1 . 2]" 1
512 1 15 LEU HB2 1 15 LEU MD2 2.650 . 3.500 2.646 2.339 3.223 . 0 0 "[ . 1 . 2]" 1
513 1 15 LEU HA 1 15 LEU MD2 2.900 . 4.000 3.095 2.005 3.908 . 0 0 "[ . 1 . 2]" 1
514 1 49 LEU MD2 1 54 ARG HD2 3.150 . 4.500 4.530 4.335 4.635 0.135 8 0 "[ . 1 . 2]" 1
515 1 75 LEU HB3 1 75 LEU MD1 3.150 . 4.500 2.402 2.337 2.519 . 0 0 "[ . 1 . 2]" 1
516 1 45 LEU HB3 1 45 LEU MD2 3.150 . 4.500 2.385 2.212 2.442 . 0 0 "[ . 1 . 2]" 1
517 1 41 ARG HA 1 44 ILE MD 3.150 . 4.500 3.103 2.293 4.237 . 0 0 "[ . 1 . 2]" 1
518 1 79 ALA MB 1 84 LEU MD2 3.150 . 4.500 2.966 2.087 3.646 . 0 0 "[ . 1 . 2]" 1
519 1 94 ILE MD 1 94 ILE MG 3.150 . 4.500 2.012 1.956 2.152 . 0 0 "[ . 1 . 2]" 1
520 1 49 LEU HB2 1 54 ARG HD3 2.650 . 3.500 2.611 2.085 3.597 0.097 6 0 "[ . 1 . 2]" 1
521 1 67 LYS HB3 1 67 LYS HE2 3.150 . 4.500 3.392 2.094 4.592 0.092 20 0 "[ . 1 . 2]" 1
522 1 67 LYS HB3 1 67 LYS HE3 3.150 . 4.500 2.920 2.242 4.550 0.050 12 0 "[ . 1 . 2]" 1
523 1 71 VAL HA 1 74 TYR HB2 3.150 . 4.500 3.110 2.644 3.481 . 0 0 "[ . 1 . 2]" 1
524 1 56 ARG HG2 1 90 GLU HG2 3.150 . 4.500 3.360 2.666 4.297 . 0 0 "[ . 1 . 2]" 1
525 1 72 GLU HA 1 72 GLU HG3 3.150 . 4.500 3.092 3.002 3.196 . 0 0 "[ . 1 . 2]" 1
526 1 49 LEU MD2 1 88 VAL HB 3.150 . 4.500 2.161 1.879 3.324 . 0 0 "[ . 1 . 2]" 1
527 1 8 GLU QB 1 12 ARG HD2 3.150 . 4.500 3.979 2.543 4.576 0.076 9 0 "[ . 1 . 2]" 1
528 1 94 ILE HA 1 94 ILE HG13 3.150 . 4.500 2.979 2.797 3.860 . 0 0 "[ . 1 . 2]" 1
529 1 44 ILE HG13 1 45 LEU HA 3.150 . 4.500 3.541 3.101 4.589 0.089 2 0 "[ . 1 . 2]" 1
530 1 52 SER HB3 1 90 GLU HG2 3.150 . 4.500 3.918 3.192 4.539 0.039 4 0 "[ . 1 . 2]" 1
531 1 52 SER HB2 1 90 GLU HG2 3.150 . 4.500 3.326 2.508 4.508 0.008 16 0 "[ . 1 . 2]" 1
532 1 52 SER HB2 1 90 GLU HB2 3.150 . 4.500 4.364 1.946 4.568 0.068 14 0 "[ . 1 . 2]" 1
533 1 90 GLU HA 1 90 GLU HG3 3.150 . 4.500 3.063 2.826 3.251 . 0 0 "[ . 1 . 2]" 1
534 1 97 LEU HA 1 97 LEU HG 3.150 . 4.500 3.066 2.966 3.148 . 0 0 "[ . 1 . 2]" 1
535 1 66 GLU HA 1 66 GLU QB 2.300 . 2.800 2.372 2.251 2.473 . 0 0 "[ . 1 . 2]" 1
536 1 66 GLU HA 1 69 LYS QB 3.150 . 4.500 3.575 2.578 4.360 . 0 0 "[ . 1 . 2]" 1
537 1 8 GLU HA 1 8 GLU QG 3.150 . 4.500 2.759 2.360 3.523 . 0 0 "[ . 1 . 2]" 1
538 1 62 LEU HB3 1 62 LEU MD1 3.150 . 4.500 2.676 2.324 3.226 . 0 0 "[ . 1 . 2]" 1
539 1 49 LEU HB2 1 49 LEU MD1 3.150 . 4.500 2.305 2.221 2.381 . 0 0 "[ . 1 . 2]" 1
540 1 93 LEU HA 1 93 LEU HG 3.150 . 4.500 3.086 2.872 3.185 . 0 0 "[ . 1 . 2]" 1
541 1 18 LEU HA 1 18 LEU HB3 2.650 . 3.300 3.021 2.968 3.042 . 0 0 "[ . 1 . 2]" 1
542 1 106 LYS HA 1 106 LYS HG2 3.150 . 4.500 2.961 2.447 3.796 . 0 0 "[ . 1 . 2]" 1
543 1 102 GLN QB 1 103 GLN HA 3.150 . 4.500 4.258 3.943 4.534 0.034 3 0 "[ . 1 . 2]" 1
544 1 62 LEU HA 1 62 LEU MD1 3.150 . 4.500 3.396 2.039 3.871 . 0 0 "[ . 1 . 2]" 1
545 1 62 LEU HA 1 62 LEU HB3 2.300 . 2.800 2.578 2.431 2.918 0.118 1 0 "[ . 1 . 2]" 1
546 1 4 ASP HA 1 7 LEU HB2 3.150 . 4.500 3.406 2.640 3.978 . 0 0 "[ . 1 . 2]" 1
547 1 108 THR HA 1 108 THR MG 3.150 . 4.500 2.495 2.294 3.252 . 0 0 "[ . 1 . 2]" 1
548 1 49 LEU HA 1 49 LEU HG 3.150 . 4.500 3.117 2.986 3.262 . 0 0 "[ . 1 . 2]" 1
549 1 49 LEU HA 1 88 VAL HB 3.150 . 4.500 2.691 2.292 3.692 . 0 0 "[ . 1 . 2]" 1
550 1 52 SER HB2 1 53 ALA MB 3.150 . 4.500 4.128 3.701 4.535 0.035 13 0 "[ . 1 . 2]" 1
551 1 65 PRO HB3 1 65 PRO HD3 3.150 . 4.500 3.516 2.946 4.060 . 0 0 "[ . 1 . 2]" 1
552 1 57 LEU HB3 1 57 LEU MD1 3.150 . 4.500 3.077 2.346 3.199 . 0 0 "[ . 1 . 2]" 1
553 1 76 ILE HA 1 76 ILE QG 3.150 . 4.500 2.443 2.363 2.946 . 0 0 "[ . 1 . 2]" 1
554 1 51 GLN HA 1 51 GLN HB3 2.650 . 3.500 2.911 2.426 3.031 . 0 0 "[ . 1 . 2]" 1
555 1 34 LYS HA 1 34 LYS HG2 3.150 . 4.500 3.801 3.723 3.891 . 0 0 "[ . 1 . 2]" 1
556 1 5 GLU HA 1 5 GLU QG 3.150 . 4.500 2.564 2.385 3.083 . 0 0 "[ . 1 . 2]" 1
557 1 34 LYS HA 1 37 GLU HG2 2.900 . 4.000 3.580 2.526 4.131 0.131 15 0 "[ . 1 . 2]" 1
558 1 19 GLN HA 1 19 GLN HG3 3.150 . 4.500 2.939 2.440 3.695 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 927
_Distance_constraint_stats_list.Viol_count 1185
_Distance_constraint_stats_list.Viol_total 794.544
_Distance_constraint_stats_list.Viol_max 0.182
_Distance_constraint_stats_list.Viol_rms 0.0109
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0021
_Distance_constraint_stats_list.Viol_average_violations_only 0.0335
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 SER 0.022 0.012 15 0 "[ . 1 . 2]"
1 3 ALA 0.607 0.087 8 0 "[ . 1 . 2]"
1 4 ASP 1.082 0.094 4 0 "[ . 1 . 2]"
1 5 GLU 0.046 0.027 16 0 "[ . 1 . 2]"
1 6 GLU 0.480 0.087 8 0 "[ . 1 . 2]"
1 7 LEU 0.223 0.045 16 0 "[ . 1 . 2]"
1 8 GLU 0.543 0.041 3 0 "[ . 1 . 2]"
1 9 ALA 0.298 0.033 6 0 "[ . 1 . 2]"
1 10 LEU 0.668 0.059 9 0 "[ . 1 . 2]"
1 11 ARG 0.212 0.029 1 0 "[ . 1 . 2]"
1 12 ARG 0.337 0.063 3 0 "[ . 1 . 2]"
1 13 GLN 0.265 0.042 2 0 "[ . 1 . 2]"
1 14 ARG 0.521 0.059 9 0 "[ . 1 . 2]"
1 15 LEU 1.192 0.125 5 0 "[ . 1 . 2]"
1 16 ALA 1.594 0.092 1 0 "[ . 1 . 2]"
1 17 GLU 1.778 0.124 15 0 "[ . 1 . 2]"
1 18 LEU 1.516 0.134 2 0 "[ . 1 . 2]"
1 19 GLN 0.323 0.081 19 0 "[ . 1 . 2]"
1 20 ALA 0.846 0.134 2 0 "[ . 1 . 2]"
1 21 LYS 1.005 0.135 12 0 "[ . 1 . 2]"
1 22 HIS 0.131 0.042 14 0 "[ . 1 . 2]"
1 23 GLY 0.371 0.103 12 0 "[ . 1 . 2]"
1 24 ASP 0.055 0.036 1 0 "[ . 1 . 2]"
1 25 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 26 GLY 0.212 0.083 18 0 "[ . 1 . 2]"
1 27 ASP 0.309 0.082 4 0 "[ . 1 . 2]"
1 28 ALA 0.363 0.083 18 0 "[ . 1 . 2]"
1 29 ALA 0.567 0.082 4 0 "[ . 1 . 2]"
1 30 GLN 0.593 0.058 15 0 "[ . 1 . 2]"
1 31 GLN 0.181 0.064 19 0 "[ . 1 . 2]"
1 32 GLU 0.176 0.069 13 0 "[ . 1 . 2]"
1 33 ALA 0.372 0.058 11 0 "[ . 1 . 2]"
1 34 LYS 0.753 0.095 5 0 "[ . 1 . 2]"
1 35 HIS 0.157 0.069 13 0 "[ . 1 . 2]"
1 36 ARG 0.178 0.051 11 0 "[ . 1 . 2]"
1 37 GLU 0.753 0.095 5 0 "[ . 1 . 2]"
1 38 ALA 0.355 0.059 3 0 "[ . 1 . 2]"
1 39 GLU 0.586 0.059 15 0 "[ . 1 . 2]"
1 40 MET 0.481 0.059 15 0 "[ . 1 . 2]"
1 41 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 ASN 0.371 0.092 15 0 "[ . 1 . 2]"
1 43 SER 0.471 0.059 4 0 "[ . 1 . 2]"
1 44 ILE 0.026 0.016 16 0 "[ . 1 . 2]"
1 45 LEU 0.190 0.074 2 0 "[ . 1 . 2]"
1 46 ALA 0.900 0.092 15 0 "[ . 1 . 2]"
1 47 GLN 0.111 0.039 2 0 "[ . 1 . 2]"
1 48 VAL 1.442 0.147 8 0 "[ . 1 . 2]"
1 49 LEU 1.285 0.113 2 0 "[ . 1 . 2]"
1 50 ASP 2.298 0.147 8 0 "[ . 1 . 2]"
1 51 GLN 1.229 0.078 3 0 "[ . 1 . 2]"
1 52 SER 1.634 0.113 2 0 "[ . 1 . 2]"
1 53 ALA 0.075 0.073 16 0 "[ . 1 . 2]"
1 54 ARG 1.168 0.100 16 0 "[ . 1 . 2]"
1 55 ALA 0.444 0.100 16 0 "[ . 1 . 2]"
1 56 ARG 1.331 0.117 7 0 "[ . 1 . 2]"
1 57 LEU 0.254 0.066 16 0 "[ . 1 . 2]"
1 58 SER 0.994 0.085 10 0 "[ . 1 . 2]"
1 59 ASN 0.693 0.085 10 0 "[ . 1 . 2]"
1 60 LEU 1.093 0.093 11 0 "[ . 1 . 2]"
1 61 ALA 0.688 0.093 11 0 "[ . 1 . 2]"
1 62 LEU 0.164 0.071 4 0 "[ . 1 . 2]"
1 63 VAL 0.224 0.071 4 0 "[ . 1 . 2]"
1 64 LYS 1.094 0.151 5 0 "[ . 1 . 2]"
1 65 PRO 0.041 0.020 17 0 "[ . 1 . 2]"
1 66 GLU 0.771 0.151 5 0 "[ . 1 . 2]"
1 67 LYS 1.119 0.101 13 0 "[ . 1 . 2]"
1 68 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 LYS 0.048 0.038 17 0 "[ . 1 . 2]"
1 70 ALA 0.578 0.111 1 0 "[ . 1 . 2]"
1 71 VAL 0.540 0.083 16 0 "[ . 1 . 2]"
1 72 GLU 0.029 0.023 7 0 "[ . 1 . 2]"
1 73 ASN 1.390 0.080 15 0 "[ . 1 . 2]"
1 74 TYR 1.665 0.102 15 0 "[ . 1 . 2]"
1 75 LEU 0.398 0.069 16 0 "[ . 1 . 2]"
1 76 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 GLN 0.023 0.023 18 0 "[ . 1 . 2]"
1 78 MET 0.932 0.102 15 0 "[ . 1 . 2]"
1 79 ALA 0.361 0.069 16 0 "[ . 1 . 2]"
1 80 ARG 0.534 0.062 8 0 "[ . 1 . 2]"
1 81 TYR 0.929 0.075 19 0 "[ . 1 . 2]"
1 82 GLY 0.462 0.156 13 0 "[ . 1 . 2]"
1 83 GLN 0.170 0.036 13 0 "[ . 1 . 2]"
1 84 LEU 0.766 0.156 13 0 "[ . 1 . 2]"
1 85 SER 0.079 0.042 11 0 "[ . 1 . 2]"
1 86 GLU 1.334 0.145 17 0 "[ . 1 . 2]"
1 87 LYS 2.660 0.145 17 0 "[ . 1 . 2]"
1 88 VAL 0.168 0.080 17 0 "[ . 1 . 2]"
1 89 SER 0.076 0.040 1 0 "[ . 1 . 2]"
1 90 GLU 0.668 0.096 6 0 "[ . 1 . 2]"
1 91 GLN 0.089 0.056 17 0 "[ . 1 . 2]"
1 92 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 ILE 0.689 0.106 6 0 "[ . 1 . 2]"
1 95 GLU 0.240 0.106 6 0 "[ . 1 . 2]"
1 96 ILE 1.135 0.100 16 0 "[ . 1 . 2]"
1 97 LEU 0.601 0.083 16 0 "[ . 1 . 2]"
1 98 LYS 0.009 0.009 17 0 "[ . 1 . 2]"
1 99 LYS 0.936 0.182 16 0 "[ . 1 . 2]"
1 100 VAL 0.591 0.182 16 0 "[ . 1 . 2]"
1 101 SER 1.453 0.101 13 0 "[ . 1 . 2]"
1 102 GLN 0.710 0.071 12 0 "[ . 1 . 2]"
1 103 GLN 1.232 0.142 9 0 "[ . 1 . 2]"
1 104 THR 1.673 0.137 17 0 "[ . 1 . 2]"
1 105 GLU 0.747 0.109 9 0 "[ . 1 . 2]"
1 106 LYS 0.599 0.148 20 0 "[ . 1 . 2]"
1 107 THR 0.419 0.148 20 0 "[ . 1 . 2]"
1 108 THR 0.093 0.077 5 0 "[ . 1 . 2]"
1 109 THR 0.384 0.116 15 0 "[ . 1 . 2]"
1 110 VAL 0.154 0.067 13 0 "[ . 1 . 2]"
1 111 LYS 0.052 0.024 2 0 "[ . 1 . 2]"
1 112 PHE 0.013 0.013 20 0 "[ . 1 . 2]"
1 113 ASN 0.013 0.013 20 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 74 TYR HA 1 74 TYR QE 3.650 . 5.500 4.542 4.304 4.703 . 0 0 "[ . 1 . 2]" 2
2 1 74 TYR QD 1 75 LEU HA 3.650 . 5.500 3.724 3.298 4.462 . 0 0 "[ . 1 . 2]" 2
3 1 77 GLN HA 1 81 TYR QE 3.650 . 5.500 4.214 3.384 5.062 . 0 0 "[ . 1 . 2]" 2
4 1 71 VAL HB 1 74 TYR QD 3.650 . 5.500 4.886 4.400 5.366 . 0 0 "[ . 1 . 2]" 2
5 1 78 MET HB2 1 81 TYR QD 3.650 . 5.500 4.883 4.259 5.575 0.075 19 0 "[ . 1 . 2]" 2
6 1 74 TYR QE 1 78 MET HB2 3.150 . 4.500 3.774 3.119 4.602 0.102 15 0 "[ . 1 . 2]" 2
7 1 77 GLN QB 1 81 TYR QE 3.150 . 4.500 2.930 2.093 4.523 0.023 18 0 "[ . 1 . 2]" 2
8 1 74 TYR QE 1 105 GLU HB3 3.150 . 4.500 3.637 2.022 4.558 0.058 5 0 "[ . 1 . 2]" 2
9 1 74 TYR QD 1 96 ILE HG13 3.650 . 5.500 4.646 3.631 5.191 . 0 0 "[ . 1 . 2]" 2
10 1 74 TYR QE 1 96 ILE HG13 3.150 . 4.500 4.364 3.829 4.563 0.063 11 0 "[ . 1 . 2]" 2
11 1 80 ARG HB3 1 81 TYR QE 3.150 . 4.500 4.394 3.712 4.562 0.062 8 0 "[ . 1 . 2]" 2
12 1 74 TYR QD 1 96 ILE HB 3.150 . 4.500 4.535 4.293 4.600 0.100 16 0 "[ . 1 . 2]" 2
13 1 78 MET HA 1 81 TYR QD 3.650 . 5.500 2.662 1.972 3.732 . 0 0 "[ . 1 . 2]" 2
14 1 77 GLN QB 1 81 TYR QD 3.650 . 5.500 3.881 2.654 5.450 . 0 0 "[ . 1 . 2]" 2
15 1 80 ARG HB3 1 81 TYR QD 3.650 . 5.500 3.881 3.327 4.102 . 0 0 "[ . 1 . 2]" 2
16 1 80 ARG HB2 1 81 TYR QD 3.650 . 5.500 4.919 3.105 5.532 0.032 13 0 "[ . 1 . 2]" 2
17 1 74 TYR QE 1 78 MET HA 3.650 . 5.500 5.352 4.834 5.594 0.094 2 0 "[ . 1 . 2]" 2
18 1 2 SER H 1 5 GLU QB 3.650 . 5.500 3.846 2.091 5.170 . 0 0 "[ . 1 . 2]" 2
19 1 6 GLU QG 1 7 LEU H 3.650 . 5.500 3.568 2.224 4.307 . 0 0 "[ . 1 . 2]" 2
20 1 11 ARG H 1 11 ARG QD 3.650 . 5.500 4.345 3.864 4.670 . 0 0 "[ . 1 . 2]" 2
21 1 12 ARG H 1 12 ARG HD2 3.650 . 5.500 4.080 2.557 4.658 . 0 0 "[ . 1 . 2]" 2
22 1 12 ARG H 1 12 ARG HD3 3.650 . 5.500 4.325 2.647 5.493 . 0 0 "[ . 1 . 2]" 2
23 1 12 ARG H 1 13 GLN QB 3.650 . 5.500 4.378 4.085 4.602 . 0 0 "[ . 1 . 2]" 2
24 1 10 LEU MD2 1 14 ARG H 3.650 . 5.500 4.570 3.503 5.559 0.059 9 0 "[ . 1 . 2]" 2
25 1 14 ARG QD 1 15 LEU H 3.650 . 5.500 4.635 3.442 5.493 . 0 0 "[ . 1 . 2]" 2
26 1 14 ARG H 1 16 ALA H 3.650 . 5.500 4.112 3.851 4.323 . 0 0 "[ . 1 . 2]" 2
27 1 15 LEU MD1 1 16 ALA H 3.650 . 4.500 4.299 3.356 4.571 0.071 13 0 "[ . 1 . 2]" 2
28 1 16 ALA H 1 17 GLU HG2 3.650 . 5.500 4.428 3.899 5.525 0.025 20 0 "[ . 1 . 2]" 2
29 1 16 ALA H 1 17 GLU HG3 3.650 . 5.500 5.088 3.807 5.592 0.092 1 0 "[ . 1 . 2]" 2
30 1 18 LEU MD2 1 19 GLN H 3.650 . 5.500 4.251 3.370 4.736 . 0 0 "[ . 1 . 2]" 2
31 1 18 LEU H 1 18 LEU MD2 3.650 . 5.500 4.115 3.729 4.327 . 0 0 "[ . 1 . 2]" 2
32 1 18 LEU MD1 1 20 ALA H 3.650 . 5.500 4.014 2.124 5.007 . 0 0 "[ . 1 . 2]" 2
33 1 19 GLN HG3 1 20 ALA H 3.650 . 5.500 4.945 4.506 5.581 0.081 19 0 "[ . 1 . 2]" 2
34 1 21 LYS HA 1 23 GLY H 3.650 . 5.500 4.121 2.850 5.503 0.003 16 0 "[ . 1 . 2]" 2
35 1 22 HIS HB3 1 23 GLY H 3.650 . 5.500 4.145 3.003 4.518 . 0 0 "[ . 1 . 2]" 2
36 1 21 LYS HB3 1 23 GLY H 3.650 . 5.500 4.378 2.075 5.599 0.099 17 0 "[ . 1 . 2]" 2
37 1 23 GLY H 1 24 ASP HB3 3.650 . 5.500 4.352 3.010 5.536 0.036 1 0 "[ . 1 . 2]" 2
38 1 21 LYS HB2 1 23 GLY H 3.650 . 5.500 4.191 2.816 5.538 0.038 11 0 "[ . 1 . 2]" 2
39 1 21 LYS HG3 1 23 GLY H 3.650 . 5.500 4.488 3.032 5.603 0.103 12 0 "[ . 1 . 2]" 2
40 1 26 GLY H 1 28 ALA H 3.650 . 5.500 4.548 2.669 5.583 0.083 18 0 "[ . 1 . 2]" 2
41 1 24 ASP HA 1 26 GLY H 3.650 . 5.500 3.971 3.359 4.499 . 0 0 "[ . 1 . 2]" 2
42 1 28 ALA H 1 30 GLN QG 3.650 . 5.500 4.986 4.247 5.424 . 0 0 "[ . 1 . 2]" 2
43 1 2 SER HB2 1 6 GLU H 3.650 . 5.500 4.281 3.527 5.511 0.011 15 0 "[ . 1 . 2]" 2
44 1 76 ILE HA 1 80 ARG H 3.650 . 5.500 4.361 3.979 5.155 . 0 0 "[ . 1 . 2]" 2
45 1 80 ARG H 1 80 ARG QD 3.650 . 5.500 4.130 2.437 4.673 . 0 0 "[ . 1 . 2]" 2
46 1 54 ARG H 1 57 LEU H 3.650 . 5.500 4.603 4.426 5.059 . 0 0 "[ . 1 . 2]" 2
47 1 87 LYS H 1 87 LYS QE 3.650 . 5.500 4.282 3.108 5.280 . 0 0 "[ . 1 . 2]" 2
48 1 36 ARG H 1 36 ARG QD 3.650 . 5.500 3.885 2.287 4.644 . 0 0 "[ . 1 . 2]" 2
49 1 50 ASP HB2 1 87 LYS H 3.900 . 6.000 5.155 4.470 5.726 . 0 0 "[ . 1 . 2]" 2
50 1 35 HIS HA 1 37 GLU H 3.650 . 5.500 4.238 3.835 4.510 . 0 0 "[ . 1 . 2]" 2
51 1 34 LYS QD 1 37 GLU H 3.650 . 5.500 4.562 4.209 5.595 0.095 5 0 "[ . 1 . 2]" 2
52 1 35 HIS HA 1 39 GLU H 3.650 . 5.500 4.146 3.504 5.009 . 0 0 "[ . 1 . 2]" 2
53 1 43 SER H 1 44 ILE MG 3.650 . 5.500 4.536 4.198 5.113 . 0 0 "[ . 1 . 2]" 2
54 1 43 SER H 1 44 ILE HG12 3.650 . 5.500 4.491 4.065 5.120 . 0 0 "[ . 1 . 2]" 2
55 1 43 SER H 1 46 ALA MB 3.650 . 5.500 4.710 4.111 4.952 . 0 0 "[ . 1 . 2]" 2
56 1 45 LEU H 1 47 GLN H 3.650 . 5.500 4.041 3.869 4.227 . 0 0 "[ . 1 . 2]" 2
57 1 44 ILE HG12 1 45 LEU H 3.650 . 5.500 2.771 2.115 2.891 . 0 0 "[ . 1 . 2]" 2
58 1 44 ILE H 1 46 ALA H 3.650 . 5.500 4.125 3.753 4.371 . 0 0 "[ . 1 . 2]" 2
59 1 42 ASN HA 1 46 ALA H 3.650 . 5.500 3.846 3.022 4.261 . 0 0 "[ . 1 . 2]" 2
60 1 46 ALA H 1 48 VAL QG 3.650 . 5.500 4.632 4.207 5.194 . 0 0 "[ . 1 . 2]" 2
61 1 44 ILE MG 1 47 GLN H 3.650 . 5.500 5.198 4.994 5.392 . 0 0 "[ . 1 . 2]" 2
62 1 47 GLN H 1 48 VAL QG 3.650 . 5.500 3.598 3.325 3.930 . 0 0 "[ . 1 . 2]" 2
63 1 73 ASN H 1 73 ASN HD22 3.650 . 5.500 5.545 5.515 5.577 0.077 7 0 "[ . 1 . 2]" 2
64 1 45 LEU HA 1 48 VAL H 3.650 . 5.500 3.432 3.053 3.771 . 0 0 "[ . 1 . 2]" 2
65 1 46 ALA HA 1 48 VAL H 3.650 . 5.500 4.438 4.069 4.817 . 0 0 "[ . 1 . 2]" 2
66 1 44 ILE HA 1 48 VAL H 3.650 . 5.500 4.160 3.482 4.725 . 0 0 "[ . 1 . 2]" 2
67 1 44 ILE MG 1 48 VAL H 3.900 . 6.000 5.610 5.043 6.016 0.016 16 0 "[ . 1 . 2]" 2
68 1 47 GLN HG2 1 48 VAL H 3.650 . 5.500 4.237 2.825 5.056 . 0 0 "[ . 1 . 2]" 2
69 1 48 VAL QG 1 49 LEU H 3.650 . 5.500 2.793 2.185 3.287 . 0 0 "[ . 1 . 2]" 2
70 1 50 ASP H 1 88 VAL H 3.650 . 5.500 3.152 2.782 3.593 . 0 0 "[ . 1 . 2]" 2
71 1 50 ASP H 1 89 SER H 3.650 . 5.500 4.963 4.638 5.540 0.040 1 0 "[ . 1 . 2]" 2
72 1 50 ASP H 1 87 LYS HA 3.650 . 5.500 4.166 3.607 4.690 . 0 0 "[ . 1 . 2]" 2
73 1 50 ASP H 1 88 VAL MG2 3.650 . 5.500 4.713 4.467 5.211 . 0 0 "[ . 1 . 2]" 2
74 1 50 ASP H 1 87 LYS HB3 3.650 . 5.500 2.852 2.368 3.723 . 0 0 "[ . 1 . 2]" 2
75 1 51 GLN H 1 53 ALA H 3.650 . 5.500 4.278 4.041 4.511 . 0 0 "[ . 1 . 2]" 2
76 1 51 GLN H 1 87 LYS QG 3.650 . 5.500 4.939 3.638 5.524 0.024 4 0 "[ . 1 . 2]" 2
77 1 51 GLN H 1 87 LYS HB3 3.650 . 5.500 5.052 4.311 5.565 0.065 1 0 "[ . 1 . 2]" 2
78 1 91 GLN H 1 94 ILE MD 3.650 . 5.500 4.123 3.806 4.684 . 0 0 "[ . 1 . 2]" 2
79 1 88 VAL MG1 1 91 GLN H 3.650 . 5.500 5.335 4.846 5.556 0.056 17 0 "[ . 1 . 2]" 2
80 1 53 ALA MB 1 91 GLN H 3.900 . 6.000 5.111 4.654 5.601 . 0 0 "[ . 1 . 2]" 2
81 1 52 SER H 1 55 ALA MB 3.900 . 6.000 4.823 4.654 5.097 . 0 0 "[ . 1 . 2]" 2
82 1 91 GLN H 1 94 ILE H 3.650 . 5.500 4.657 4.560 4.769 . 0 0 "[ . 1 . 2]" 2
83 1 53 ALA H 1 55 ALA H 3.650 . 4.500 4.026 3.805 4.165 . 0 0 "[ . 1 . 2]" 2
84 1 50 ASP HA 1 53 ALA H 3.650 . 5.500 4.674 4.445 5.159 . 0 0 "[ . 1 . 2]" 2
85 1 53 ALA H 1 90 GLU HA 3.650 . 5.500 4.611 3.417 5.111 . 0 0 "[ . 1 . 2]" 2
86 1 49 LEU MD2 1 53 ALA H 3.650 . 5.500 4.945 4.635 5.371 . 0 0 "[ . 1 . 2]" 2
87 1 53 ALA H 1 93 LEU MD2 3.650 . 5.500 5.027 4.837 5.267 . 0 0 "[ . 1 . 2]" 2
88 1 49 LEU HB3 1 53 ALA H 3.650 . 5.500 4.270 4.136 4.509 . 0 0 "[ . 1 . 2]" 2
89 1 53 ALA H 1 56 ARG QB 3.650 . 5.500 4.580 4.345 4.916 . 0 0 "[ . 1 . 2]" 2
90 1 50 ASP HB2 1 53 ALA H 3.650 . 5.500 4.574 4.349 5.120 . 0 0 "[ . 1 . 2]" 2
91 1 50 ASP HB3 1 53 ALA H 3.650 . 5.500 2.935 2.629 3.640 . 0 0 "[ . 1 . 2]" 2
92 1 53 ALA H 1 90 GLU H 3.650 . 5.500 4.422 3.867 4.996 . 0 0 "[ . 1 . 2]" 2
93 1 52 SER HB2 1 54 ARG H 3.650 . 5.500 5.203 4.878 5.517 0.017 10 0 "[ . 1 . 2]" 2
94 1 49 LEU QD 1 54 ARG H 3.650 . 5.500 3.809 3.512 3.992 . 0 0 "[ . 1 . 2]" 2
95 1 54 ARG H 1 56 ARG H 3.650 . 5.500 4.062 3.920 4.245 . 0 0 "[ . 1 . 2]" 2
96 1 56 ARG H 1 56 ARG HD3 3.650 . 5.500 4.381 2.243 5.617 0.117 7 0 "[ . 1 . 2]" 2
97 1 56 ARG H 1 56 ARG HD2 3.650 . 5.500 4.580 2.892 5.587 0.087 17 0 "[ . 1 . 2]" 2
98 1 56 ARG H 1 93 LEU MD2 3.650 . 5.500 4.320 3.898 4.902 . 0 0 "[ . 1 . 2]" 2
99 1 52 SER HA 1 56 ARG H 3.650 . 5.500 4.164 3.892 4.517 . 0 0 "[ . 1 . 2]" 2
100 1 60 LEU H 1 63 VAL MG1 3.650 . 5.500 5.290 3.970 5.521 0.021 10 0 "[ . 1 . 2]" 2
101 1 61 ALA H 1 68 THR MG 3.650 . 5.500 3.362 3.113 3.753 . 0 0 "[ . 1 . 2]" 2
102 1 61 ALA H 1 63 VAL H 3.650 . 5.500 4.150 4.031 4.362 . 0 0 "[ . 1 . 2]" 2
103 1 61 ALA H 1 65 PRO HA 3.650 . 5.500 5.144 4.790 5.520 0.020 17 0 "[ . 1 . 2]" 2
104 1 62 LEU H 1 64 LYS H 3.650 . 5.500 4.245 3.849 4.651 . 0 0 "[ . 1 . 2]" 2
105 1 60 LEU HA 1 62 LEU H 3.650 . 5.500 3.913 3.762 4.195 . 0 0 "[ . 1 . 2]" 2
106 1 61 ALA HA 1 62 LEU H 3.650 . 5.500 3.448 3.411 3.504 . 0 0 "[ . 1 . 2]" 2
107 1 59 ASN HA 1 62 LEU H 3.650 . 5.500 3.605 3.193 4.015 . 0 0 "[ . 1 . 2]" 2
108 1 61 ALA MB 1 62 LEU H 3.650 . 5.500 2.778 2.541 2.931 . 0 0 "[ . 1 . 2]" 2
109 1 60 LEU MD1 1 62 LEU H 3.650 . 5.500 5.076 4.507 5.518 0.018 12 0 "[ . 1 . 2]" 2
110 1 61 ALA MB 1 63 VAL H 3.650 . 5.500 4.509 4.374 4.741 . 0 0 "[ . 1 . 2]" 2
111 1 62 LEU HB3 1 63 VAL H 3.650 . 4.500 3.696 2.440 4.168 . 0 0 "[ . 1 . 2]" 2
112 1 60 LEU MD1 1 63 VAL H 3.650 . 5.500 4.412 3.785 5.008 . 0 0 "[ . 1 . 2]" 2
113 1 61 ALA HA 1 63 VAL H 3.650 . 5.500 4.188 3.824 4.804 . 0 0 "[ . 1 . 2]" 2
114 1 60 LEU MD1 1 64 LYS H 3.650 . 5.500 3.501 2.692 4.425 . 0 0 "[ . 1 . 2]" 2
115 1 64 LYS H 1 64 LYS QE 3.650 . 5.500 5.018 3.302 5.537 0.037 1 0 "[ . 1 . 2]" 2
116 1 62 LEU HA 1 64 LYS H 3.650 . 5.500 5.058 4.633 5.319 . 0 0 "[ . 1 . 2]" 2
117 1 61 ALA HA 1 64 LYS H 3.650 . 5.500 3.979 3.658 4.332 . 0 0 "[ . 1 . 2]" 2
118 1 64 LYS HA 1 66 GLU H 3.650 . 5.500 3.480 3.151 3.701 . 0 0 "[ . 1 . 2]" 2
119 1 61 ALA HA 1 66 GLU H 3.900 . 6.000 5.644 5.345 6.011 0.011 17 0 "[ . 1 . 2]" 2
120 1 65 PRO HD3 1 66 GLU H 3.650 . 5.500 3.908 3.691 4.124 . 0 0 "[ . 1 . 2]" 2
121 1 64 LYS QG 1 66 GLU H 3.650 . 5.500 4.678 3.932 5.362 . 0 0 "[ . 1 . 2]" 2
122 1 64 LYS H 1 66 GLU H 3.650 . 5.500 5.139 4.885 5.462 . 0 0 "[ . 1 . 2]" 2
123 1 66 GLU H 1 69 LYS H 3.650 . 5.500 4.791 4.543 5.059 . 0 0 "[ . 1 . 2]" 2
124 1 66 GLU H 1 70 ALA H 4.150 . 6.500 6.233 5.960 6.562 0.062 6 0 "[ . 1 . 2]" 2
125 1 84 LEU H 1 84 LEU MD1 3.650 . 5.500 3.960 3.532 4.307 . 0 0 "[ . 1 . 2]" 2
126 1 68 THR H 1 70 ALA H 3.650 . 5.500 4.015 3.838 4.225 . 0 0 "[ . 1 . 2]" 2
127 1 66 GLU H 1 68 THR H 3.650 . 5.500 3.844 3.615 4.032 . 0 0 "[ . 1 . 2]" 2
128 1 61 ALA HA 1 68 THR H 3.650 . 5.500 4.368 4.093 4.636 . 0 0 "[ . 1 . 2]" 2
129 1 68 THR H 1 68 THR MG 3.650 . 5.500 3.652 3.592 3.756 . 0 0 "[ . 1 . 2]" 2
130 1 66 GLU QB 1 68 THR H 3.650 . 5.500 4.482 4.126 4.648 . 0 0 "[ . 1 . 2]" 2
131 1 68 THR H 1 97 LEU MD1 3.900 . 6.000 4.696 4.406 5.171 . 0 0 "[ . 1 . 2]" 2
132 1 68 THR H 1 71 VAL MG1 3.650 . 5.500 5.079 4.966 5.291 . 0 0 "[ . 1 . 2]" 2
133 1 69 LYS H 1 69 LYS QE 3.650 . 5.500 3.928 2.936 5.085 . 0 0 "[ . 1 . 2]" 2
134 1 68 THR MG 1 69 LYS H 3.650 . 5.500 3.597 3.372 3.823 . 0 0 "[ . 1 . 2]" 2
135 1 69 LYS H 1 69 LYS QG 3.650 . 5.500 2.698 1.968 4.027 . 0 0 "[ . 1 . 2]" 2
136 1 69 LYS H 1 72 GLU HG3 3.650 . 5.500 4.825 4.474 5.097 . 0 0 "[ . 1 . 2]" 2
137 1 69 LYS H 1 71 VAL MG2 3.650 . 5.500 4.431 4.306 4.528 . 0 0 "[ . 1 . 2]" 2
138 1 68 THR HA 1 70 ALA H 3.650 . 5.500 4.349 4.217 4.535 . 0 0 "[ . 1 . 2]" 2
139 1 69 LYS QE 1 70 ALA H 3.650 . 5.500 4.635 4.001 5.199 . 0 0 "[ . 1 . 2]" 2
140 1 70 ALA H 1 72 GLU HB2 3.650 . 5.500 5.045 4.710 5.405 . 0 0 "[ . 1 . 2]" 2
141 1 70 ALA H 1 100 VAL MG1 3.650 . 5.500 5.103 4.533 5.554 0.054 13 0 "[ . 1 . 2]" 2
142 1 70 ALA H 1 71 VAL MG1 3.650 . 5.500 4.492 4.344 4.618 . 0 0 "[ . 1 . 2]" 2
143 1 67 LYS QD 1 70 ALA H 3.900 . 6.000 5.110 4.297 5.951 . 0 0 "[ . 1 . 2]" 2
144 1 70 ALA H 1 72 GLU H 3.650 . 5.500 4.093 3.965 4.282 . 0 0 "[ . 1 . 2]" 2
145 1 70 ALA HA 1 72 GLU H 3.650 . 5.500 4.611 4.514 4.740 . 0 0 "[ . 1 . 2]" 2
146 1 72 GLU H 1 73 ASN HA 3.650 . 5.500 5.350 5.223 5.430 . 0 0 "[ . 1 . 2]" 2
147 1 70 ALA MB 1 72 GLU H 3.650 . 5.500 4.540 4.388 4.633 . 0 0 "[ . 1 . 2]" 2
148 1 68 THR MG 1 72 GLU H 3.650 . 5.500 4.020 3.749 4.350 . 0 0 "[ . 1 . 2]" 2
149 1 72 GLU H 1 73 ASN HB3 3.650 . 5.500 4.874 4.625 5.133 . 0 0 "[ . 1 . 2]" 2
150 1 73 ASN H 1 74 TYR HB3 3.650 . 5.500 4.998 4.775 5.191 . 0 0 "[ . 1 . 2]" 2
151 1 71 VAL HA 1 73 ASN H 3.650 . 5.500 4.411 4.269 4.678 . 0 0 "[ . 1 . 2]" 2
152 1 73 ASN H 1 74 TYR HB2 3.650 . 5.500 5.006 4.562 5.243 . 0 0 "[ . 1 . 2]" 2
153 1 45 LEU MD2 1 73 ASN H 3.650 . 5.500 5.238 4.874 5.574 0.074 2 0 "[ . 1 . 2]" 2
154 1 73 ASN H 1 76 ILE QG 3.650 . 5.500 4.568 4.199 4.851 . 0 0 "[ . 1 . 2]" 2
155 1 71 VAL HB 1 75 LEU H 3.650 . 5.500 4.616 4.383 4.890 . 0 0 "[ . 1 . 2]" 2
156 1 71 VAL HA 1 75 LEU H 3.650 . 5.500 3.901 3.656 4.065 . 0 0 "[ . 1 . 2]" 2
157 1 72 GLU HA 1 75 LEU H 3.650 . 5.500 3.514 3.301 3.768 . 0 0 "[ . 1 . 2]" 2
158 1 73 ASN HA 1 75 LEU H 3.650 . 5.500 4.673 4.468 4.968 . 0 0 "[ . 1 . 2]" 2
159 1 76 ILE H 1 79 ALA MB 3.650 . 5.500 4.750 4.537 4.974 . 0 0 "[ . 1 . 2]" 2
160 1 72 GLU HA 1 76 ILE H 3.650 . 5.500 4.088 3.728 4.614 . 0 0 "[ . 1 . 2]" 2
161 1 74 TYR HA 1 76 ILE H 3.650 . 5.500 4.459 4.289 4.618 . 0 0 "[ . 1 . 2]" 2
162 1 76 ILE QG 1 77 GLN H 3.650 . 5.500 3.992 3.684 4.119 . 0 0 "[ . 1 . 2]" 2
163 1 76 ILE H 1 78 MET H 3.650 . 5.500 4.169 4.023 4.338 . 0 0 "[ . 1 . 2]" 2
164 1 81 TYR H 1 81 TYR QD 3.650 . 5.500 2.937 2.143 3.335 . 0 0 "[ . 1 . 2]" 2
165 1 81 TYR H 1 83 GLN QG 3.650 . 5.500 4.307 3.613 5.018 . 0 0 "[ . 1 . 2]" 2
166 1 79 ALA MB 1 81 TYR H 3.650 . 5.500 4.469 4.295 4.587 . 0 0 "[ . 1 . 2]" 2
167 1 81 TYR H 1 83 GLN QB 3.650 . 5.500 5.057 4.399 5.536 0.036 13 0 "[ . 1 . 2]" 2
168 1 78 MET HB3 1 81 TYR H 3.650 . 5.500 5.475 5.045 5.551 0.051 17 0 "[ . 1 . 2]" 2
169 1 79 ALA HA 1 81 TYR H 3.650 . 5.500 4.132 3.745 4.402 . 0 0 "[ . 1 . 2]" 2
170 1 88 VAL H 1 89 SER H 3.650 . 5.500 4.387 4.195 4.577 . 0 0 "[ . 1 . 2]" 2
171 1 82 GLY H 1 83 GLN HA 3.650 . 5.500 5.090 4.806 5.223 . 0 0 "[ . 1 . 2]" 2
172 1 82 GLY H 1 83 GLN QG 3.650 . 5.500 3.937 3.535 4.319 . 0 0 "[ . 1 . 2]" 2
173 1 82 GLY H 1 83 GLN QB 3.650 . 5.500 4.544 4.194 4.947 . 0 0 "[ . 1 . 2]" 2
174 1 48 VAL HA 1 88 VAL H 3.650 . 5.500 3.768 3.472 4.069 . 0 0 "[ . 1 . 2]" 2
175 1 49 LEU HA 1 88 VAL H 3.650 . 5.500 2.842 2.509 3.153 . 0 0 "[ . 1 . 2]" 2
176 1 87 LYS QG 1 88 VAL H 3.650 . 5.500 4.071 3.672 4.587 . 0 0 "[ . 1 . 2]" 2
177 1 87 LYS HB3 1 88 VAL H 3.650 . 5.500 2.982 2.351 3.532 . 0 0 "[ . 1 . 2]" 2
178 1 49 LEU MD2 1 88 VAL H 3.650 . 5.500 3.734 3.329 4.098 . 0 0 "[ . 1 . 2]" 2
179 1 90 GLU H 1 90 GLU HG3 3.650 . 5.500 2.282 1.892 4.366 . 0 0 "[ . 1 . 2]" 2
180 1 88 VAL MG1 1 90 GLU H 3.900 . 6.000 5.082 4.612 5.278 . 0 0 "[ . 1 . 2]" 2
181 1 90 GLU H 1 94 ILE MD 3.650 . 5.500 5.522 5.468 5.596 0.096 6 0 "[ . 1 . 2]" 2
182 1 53 ALA MB 1 90 GLU H 3.650 . 5.500 3.393 2.909 3.855 . 0 0 "[ . 1 . 2]" 2
183 1 89 SER HB3 1 92 GLY H 3.650 . 5.500 4.361 3.819 4.882 . 0 0 "[ . 1 . 2]" 2
184 1 88 VAL MG1 1 92 GLY H 3.650 . 5.500 3.537 2.905 4.260 . 0 0 "[ . 1 . 2]" 2
185 1 91 GLN QG 1 92 GLY H 3.650 . 5.500 3.711 2.266 4.805 . 0 0 "[ . 1 . 2]" 2
186 1 93 LEU H 1 95 GLU H 3.650 . 5.500 4.015 3.765 4.160 . 0 0 "[ . 1 . 2]" 2
187 1 91 GLN H 1 93 LEU H 3.650 . 5.500 4.184 4.029 4.322 . 0 0 "[ . 1 . 2]" 2
188 1 92 GLY QA 1 95 GLU H 3.650 . 5.500 3.324 3.211 3.494 . 0 0 "[ . 1 . 2]" 2
189 1 94 ILE HG12 1 95 GLU H 3.650 . 5.500 4.980 3.728 5.177 . 0 0 "[ . 1 . 2]" 2
190 1 94 ILE MD 1 95 GLU H 3.650 . 5.500 4.766 4.431 4.935 . 0 0 "[ . 1 . 2]" 2
191 1 92 GLY QA 1 96 ILE H 3.650 . 5.500 4.192 3.899 4.523 . 0 0 "[ . 1 . 2]" 2
192 1 95 GLU QG 1 96 ILE H 3.650 . 5.500 3.845 2.931 4.385 . 0 0 "[ . 1 . 2]" 2
193 1 96 ILE HA 1 97 LEU H 3.650 . 5.500 3.498 3.477 3.539 . 0 0 "[ . 1 . 2]" 2
194 1 94 ILE HB 1 97 LEU H 3.900 . 6.000 5.424 5.242 5.559 . 0 0 "[ . 1 . 2]" 2
195 1 94 ILE HA 1 98 LYS H 3.650 . 5.500 3.994 3.777 4.438 . 0 0 "[ . 1 . 2]" 2
196 1 97 LEU MD1 1 98 LYS H 3.650 . 5.500 4.573 4.445 4.760 . 0 0 "[ . 1 . 2]" 2
197 1 94 ILE MG 1 98 LYS H 3.650 . 5.500 3.929 3.704 4.399 . 0 0 "[ . 1 . 2]" 2
198 1 96 ILE HA 1 100 VAL H 3.650 . 5.500 4.252 3.959 4.553 . 0 0 "[ . 1 . 2]" 2
199 1 71 VAL MG1 1 100 VAL H 3.650 . 5.500 4.103 3.777 4.785 . 0 0 "[ . 1 . 2]" 2
200 1 99 LYS HG2 1 100 VAL H 3.650 . 5.500 4.340 2.655 5.192 . 0 0 "[ . 1 . 2]" 2
201 1 97 LEU HA 1 101 SER H 3.650 . 5.500 4.261 3.943 4.837 . 0 0 "[ . 1 . 2]" 2
202 1 67 LYS HB3 1 101 SER H 3.650 . 5.500 5.514 5.303 5.601 0.101 13 0 "[ . 1 . 2]" 2
203 1 97 LEU HG 1 101 SER H 3.650 . 5.500 4.758 4.458 5.524 0.024 17 0 "[ . 1 . 2]" 2
204 1 98 LYS QG 1 101 SER H 3.900 . 6.000 5.552 4.988 6.009 0.009 17 0 "[ . 1 . 2]" 2
205 1 100 VAL H 1 102 GLN H 3.650 . 5.500 4.264 3.859 5.049 . 0 0 "[ . 1 . 2]" 2
206 1 99 LYS HA 1 104 THR H 3.900 . 6.000 5.231 4.214 6.137 0.137 17 0 "[ . 1 . 2]" 2
207 1 104 THR MG 1 105 GLU H 3.650 . 5.500 3.299 2.554 4.199 . 0 0 "[ . 1 . 2]" 2
208 1 105 GLU QG 1 106 LYS H 3.650 . 5.500 3.661 2.840 4.835 . 0 0 "[ . 1 . 2]" 2
209 1 111 LYS QB 1 112 PHE H 3.650 . 5.500 3.382 2.024 4.036 . 0 0 "[ . 1 . 2]" 2
210 1 112 PHE H 1 113 ASN H 3.650 . 5.500 3.315 1.787 4.516 0.013 20 0 "[ . 1 . 2]" 2
211 1 112 PHE HB2 1 113 ASN H 3.650 . 5.500 3.739 2.361 4.536 . 0 0 "[ . 1 . 2]" 2
212 1 113 ASN H 1 113 ASN HB2 3.650 . 5.500 3.257 2.496 3.902 . 0 0 "[ . 1 . 2]" 2
213 1 111 LYS H 1 111 LYS HG3 3.650 . 5.500 4.113 2.703 4.843 . 0 0 "[ . 1 . 2]" 2
214 1 111 LYS H 1 111 LYS QD 3.650 . 5.500 4.382 3.292 5.247 . 0 0 "[ . 1 . 2]" 2
215 1 110 VAL MG1 1 111 LYS H 3.650 . 5.500 3.545 2.216 4.290 . 0 0 "[ . 1 . 2]" 2
216 1 110 VAL MG2 1 111 LYS H 3.650 . 5.500 3.636 1.911 4.292 . 0 0 "[ . 1 . 2]" 2
217 1 110 VAL H 1 110 VAL MG1 3.650 . 5.500 3.092 1.922 4.089 . 0 0 "[ . 1 . 2]" 2
218 1 110 VAL H 1 110 VAL MG2 3.650 . 5.500 2.785 1.915 4.022 . 0 0 "[ . 1 . 2]" 2
219 1 109 THR MG 1 110 VAL H 3.650 . 5.500 3.093 2.110 3.946 . 0 0 "[ . 1 . 2]" 2
220 1 109 THR H 1 109 THR MG 3.650 . 5.500 3.458 1.944 4.002 . 0 0 "[ . 1 . 2]" 2
221 1 107 THR H 1 107 THR MG 3.650 . 5.500 2.959 1.907 3.810 . 0 0 "[ . 1 . 2]" 2
222 1 106 LYS HG3 1 107 THR H 3.650 . 5.500 4.580 1.840 5.648 0.148 20 0 "[ . 1 . 2]" 2
223 1 53 ALA H 1 89 SER HA 3.650 . 5.500 4.030 3.031 4.732 . 0 0 "[ . 1 . 2]" 2
224 1 28 ALA H 1 31 GLN QB 3.650 . 5.500 4.993 4.230 5.564 0.064 19 0 "[ . 1 . 2]" 2
225 1 26 GLY QA 1 28 ALA H 3.650 . 5.500 3.882 2.925 4.744 . 0 0 "[ . 1 . 2]" 2
226 1 49 LEU MD2 1 93 LEU H 3.650 . 5.500 4.584 3.962 5.070 . 0 0 "[ . 1 . 2]" 2
227 1 70 ALA H 1 100 VAL HB 3.900 . 6.000 5.385 4.885 6.111 0.111 1 0 "[ . 1 . 2]" 2
228 1 97 LEU H 1 98 LYS QG 3.650 . 5.500 4.378 4.129 4.664 . 0 0 "[ . 1 . 2]" 2
229 1 47 GLN HA 1 49 LEU H 3.650 . 5.500 4.547 4.152 4.868 . 0 0 "[ . 1 . 2]" 2
230 1 46 ALA HA 1 49 LEU H 3.650 . 5.500 3.819 3.518 4.157 . 0 0 "[ . 1 . 2]" 2
231 1 45 LEU HA 1 49 LEU H 3.650 . 5.500 3.557 2.943 3.881 . 0 0 "[ . 1 . 2]" 2
232 1 74 TYR QD 1 75 LEU H 3.650 . 5.500 3.680 3.246 4.082 . 0 0 "[ . 1 . 2]" 2
233 1 64 LYS QE 1 66 GLU H 3.650 . 5.500 5.263 4.400 5.651 0.151 5 0 "[ . 1 . 2]" 2
234 1 75 LEU HB2 1 76 ILE H 3.650 . 5.500 2.946 2.826 3.066 . 0 0 "[ . 1 . 2]" 2
235 1 46 ALA H 1 47 GLN QB 3.900 . 6.000 4.805 4.574 5.198 . 0 0 "[ . 1 . 2]" 2
236 1 46 ALA H 1 47 GLN HG2 3.650 . 5.500 4.581 4.044 5.539 0.039 2 0 "[ . 1 . 2]" 2
237 1 42 ASN HB2 1 46 ALA H 3.900 . 6.000 5.855 5.127 6.092 0.092 15 0 "[ . 1 . 2]" 2
238 1 46 ALA H 1 54 ARG HG2 3.900 . 6.000 5.801 4.971 6.058 0.058 12 0 "[ . 1 . 2]" 2
239 1 46 ALA H 1 54 ARG HD2 3.650 . 5.500 5.278 4.395 5.562 0.062 5 0 "[ . 1 . 2]" 2
240 1 44 ILE HG12 1 46 ALA H 3.650 . 5.500 5.280 4.881 5.492 . 0 0 "[ . 1 . 2]" 2
241 1 80 ARG QD 1 81 TYR H 3.650 . 5.500 4.726 3.755 5.415 . 0 0 "[ . 1 . 2]" 2
242 1 81 TYR H 1 81 TYR QE 3.900 . 6.000 4.622 4.411 4.749 . 0 0 "[ . 1 . 2]" 2
243 1 92 GLY H 1 93 LEU HB2 3.650 . 5.500 4.958 4.733 5.200 . 0 0 "[ . 1 . 2]" 2
244 1 90 GLU H 1 92 GLY H 3.650 . 5.500 4.145 3.807 4.549 . 0 0 "[ . 1 . 2]" 2
245 1 82 GLY H 1 84 LEU MD2 3.650 . 5.500 4.318 3.229 5.545 0.045 16 0 "[ . 1 . 2]" 2
246 1 79 ALA MB 1 82 GLY H 3.650 . 5.500 4.456 4.189 4.810 . 0 0 "[ . 1 . 2]" 2
247 1 82 GLY H 1 84 LEU QB 3.650 . 5.500 5.286 4.300 5.656 0.156 13 0 "[ . 1 . 2]" 2
248 1 3 ALA H 1 6 GLU QB 3.650 . 5.500 5.251 4.775 5.587 0.087 8 0 "[ . 1 . 2]" 2
249 1 3 ALA H 1 6 GLU QG 3.650 . 5.500 4.547 3.778 5.274 . 0 0 "[ . 1 . 2]" 2
250 1 53 ALA MB 1 88 VAL H 3.650 . 5.500 4.690 4.158 5.217 . 0 0 "[ . 1 . 2]" 2
251 1 18 LEU HB3 1 20 ALA H 3.650 . 5.500 3.754 2.487 4.938 . 0 0 "[ . 1 . 2]" 2
252 1 18 LEU HB2 1 20 ALA H 3.650 . 5.500 5.093 4.159 5.634 0.134 2 0 "[ . 1 . 2]" 2
253 1 74 TYR H 1 74 TYR QD 3.650 . 5.500 4.181 4.098 4.239 . 0 0 "[ . 1 . 2]" 2
254 1 69 LYS H 1 72 GLU HB2 3.650 . 5.500 4.998 4.803 5.379 . 0 0 "[ . 1 . 2]" 2
255 1 89 SER H 1 90 GLU H 3.650 . 5.500 4.486 4.382 4.603 . 0 0 "[ . 1 . 2]" 2
256 1 90 GLU H 1 93 LEU H 3.650 . 5.500 4.766 4.596 4.999 . 0 0 "[ . 1 . 2]" 2
257 1 49 LEU H 1 50 ASP H 3.650 . 5.500 4.345 4.277 4.455 . 0 0 "[ . 1 . 2]" 2
258 1 48 VAL HA 1 50 ASP H 3.650 . 5.500 5.565 5.513 5.647 0.147 8 0 "[ . 1 . 2]" 2
259 1 49 LEU H 1 75 LEU HG 3.650 . 5.500 5.280 4.706 5.516 0.016 2 0 "[ . 1 . 2]" 2
260 1 72 GLU H 1 74 TYR HB2 3.900 . 6.000 5.767 5.308 6.006 0.006 19 0 "[ . 1 . 2]" 2
261 1 72 GLU H 1 74 TYR HB3 3.900 . 6.000 5.209 5.019 5.495 . 0 0 "[ . 1 . 2]" 2
262 1 95 GLU H 1 96 ILE HA 3.650 . 5.500 5.253 5.169 5.362 . 0 0 "[ . 1 . 2]" 2
263 1 73 ASN HA 1 73 ASN HD21 3.650 . 5.500 3.208 1.854 4.455 . 0 0 "[ . 1 . 2]" 2
264 1 26 GLY H 1 29 ALA MB 3.650 . 5.500 3.831 2.664 5.009 . 0 0 "[ . 1 . 2]" 2
265 1 24 ASP HB2 1 26 GLY H 3.650 . 5.500 3.570 2.290 5.395 . 0 0 "[ . 1 . 2]" 2
266 1 21 LYS HG3 1 22 HIS H 3.650 . 5.500 4.159 1.758 5.495 0.042 14 0 "[ . 1 . 2]" 2
267 1 2 SER H 1 2 SER HB3 3.150 . 4.500 3.526 2.582 4.092 . 0 0 "[ . 1 . 2]" 2
268 1 2 SER H 1 2 SER HB2 3.150 . 4.500 2.846 2.320 3.739 . 0 0 "[ . 1 . 2]" 2
269 1 3 ALA H 1 4 ASP H 3.150 . 4.500 2.747 2.350 3.112 . 0 0 "[ . 1 . 2]" 2
270 1 3 ALA H 1 3 ALA MB 3.150 . 4.500 2.245 2.204 2.328 . 0 0 "[ . 1 . 2]" 2
271 1 2 SER HB2 1 3 ALA H 3.150 . 4.500 4.080 2.949 4.471 . 0 0 "[ . 1 . 2]" 2
272 1 2 SER HA 1 3 ALA H 2.650 . 3.500 2.506 2.107 3.512 0.012 15 0 "[ . 1 . 2]" 2
273 1 2 SER HB3 1 3 ALA H 3.650 . 5.500 3.843 2.445 4.582 . 0 0 "[ . 1 . 2]" 2
274 1 3 ALA HA 1 4 ASP H 2.650 . 3.500 3.516 3.477 3.544 0.044 4 0 "[ . 1 . 2]" 2
275 1 2 SER QB 1 4 ASP H 3.650 . 5.500 4.089 2.773 5.069 . 0 0 "[ . 1 . 2]" 2
276 1 3 ALA MB 1 4 ASP H 3.650 . 5.500 2.460 2.100 2.678 . 0 0 "[ . 1 . 2]" 2
277 1 4 ASP H 1 4 ASP HB3 2.650 . 3.500 2.871 2.452 3.594 0.094 4 0 "[ . 1 . 2]" 2
278 1 4 ASP H 1 4 ASP HB2 2.650 . 3.500 2.719 2.346 3.583 0.083 12 0 "[ . 1 . 2]" 2
279 1 4 ASP H 1 6 GLU H 3.150 . 4.500 4.170 3.817 4.354 . 0 0 "[ . 1 . 2]" 2
280 1 5 GLU H 1 6 GLU H 2.650 . 3.500 2.667 2.469 2.861 . 0 0 "[ . 1 . 2]" 2
281 1 5 GLU H 1 7 LEU H 3.150 . 4.500 3.977 3.674 4.309 . 0 0 "[ . 1 . 2]" 2
282 1 5 GLU H 1 5 GLU HA 2.650 . 3.500 2.818 2.750 2.867 . 0 0 "[ . 1 . 2]" 2
283 1 4 ASP HA 1 5 GLU H 2.650 . 3.500 3.464 3.373 3.527 0.027 16 0 "[ . 1 . 2]" 2
284 1 5 GLU H 1 5 GLU QG 3.150 . 4.500 3.530 2.271 4.040 . 0 0 "[ . 1 . 2]" 2
285 1 4 ASP HB2 1 5 GLU H 3.150 . 4.500 3.439 2.500 4.079 . 0 0 "[ . 1 . 2]" 2
286 1 4 ASP HB3 1 5 GLU H 3.150 . 4.500 3.166 2.307 3.934 . 0 0 "[ . 1 . 2]" 2
287 1 4 ASP HA 1 6 GLU H 3.650 . 5.500 4.554 4.115 4.872 . 0 0 "[ . 1 . 2]" 2
288 1 37 GLU H 1 37 GLU QB 2.650 . 3.500 2.343 2.056 2.538 . 0 0 "[ . 1 . 2]" 2
289 1 6 GLU H 1 6 GLU QG 3.150 . 4.500 2.223 1.988 2.571 . 0 0 "[ . 1 . 2]" 2
290 1 6 GLU H 1 7 LEU H 2.650 . 2.800 2.618 2.469 2.747 . 0 0 "[ . 1 . 2]" 2
291 1 4 ASP HA 1 7 LEU H 3.150 . 4.500 3.548 3.172 3.964 . 0 0 "[ . 1 . 2]" 2
292 1 6 GLU QB 1 7 LEU H 3.150 . 4.500 2.901 2.305 3.661 . 0 0 "[ . 1 . 2]" 2
293 1 7 LEU H 1 7 LEU MD2 3.150 . 4.500 4.192 3.984 4.283 . 0 0 "[ . 1 . 2]" 2
294 1 7 LEU HB2 1 8 GLU H 3.150 . 4.500 3.787 3.632 3.958 . 0 0 "[ . 1 . 2]" 2
295 1 8 GLU HA 1 9 ALA H 2.650 . 3.500 3.505 3.465 3.533 0.033 6 0 "[ . 1 . 2]" 2
296 1 8 GLU QB 1 9 ALA H 2.650 . 3.500 2.626 2.165 3.529 0.029 5 0 "[ . 1 . 2]" 2
297 1 9 ALA H 1 9 ALA MB 2.650 . 3.500 2.239 2.218 2.259 . 0 0 "[ . 1 . 2]" 2
298 1 8 GLU QG 1 9 ALA H 3.650 . 5.500 3.667 2.227 4.311 . 0 0 "[ . 1 . 2]" 2
299 1 10 LEU H 1 10 LEU MD2 3.150 . 4.500 4.034 3.216 4.318 . 0 0 "[ . 1 . 2]" 2
300 1 9 ALA MB 1 10 LEU H 3.150 . 4.500 2.463 2.197 2.681 . 0 0 "[ . 1 . 2]" 2
301 1 11 ARG H 1 11 ARG QG 3.650 . 5.500 3.799 2.248 3.996 . 0 0 "[ . 1 . 2]" 2
302 1 10 LEU HB3 1 11 ARG H 2.650 . 3.500 2.713 2.319 3.521 0.021 1 0 "[ . 1 . 2]" 2
303 1 11 ARG H 1 11 ARG HB3 3.150 . 4.500 2.605 2.258 3.595 . 0 0 "[ . 1 . 2]" 2
304 1 10 LEU MD1 1 11 ARG H 3.650 . 5.500 4.509 4.188 4.775 . 0 0 "[ . 1 . 2]" 2
305 1 10 LEU H 1 12 ARG H 3.650 . 5.500 4.147 3.904 4.325 . 0 0 "[ . 1 . 2]" 2
306 1 8 GLU HA 1 12 ARG H 3.150 . 4.500 3.979 3.374 4.530 0.030 8 0 "[ . 1 . 2]" 2
307 1 12 ARG H 1 12 ARG HB3 3.150 . 4.500 3.504 2.500 3.648 . 0 0 "[ . 1 . 2]" 2
308 1 13 GLN H 1 13 GLN HG3 3.150 . 4.500 4.453 4.348 4.512 0.012 2 0 "[ . 1 . 2]" 2
309 1 13 GLN H 1 13 GLN HG2 3.150 . 4.500 4.439 4.343 4.504 0.004 15 0 "[ . 1 . 2]" 2
310 1 12 ARG HB2 1 13 GLN H 2.650 . 3.500 2.813 2.309 3.517 0.017 5 0 "[ . 1 . 2]" 2
311 1 12 ARG HA 1 13 GLN H 3.150 . 4.500 3.510 3.459 3.569 . 0 0 "[ . 1 . 2]" 2
312 1 14 ARG H 1 15 LEU H 2.650 . 3.500 2.672 2.497 2.836 . 0 0 "[ . 1 . 2]" 2
313 1 14 ARG H 1 14 ARG QD 3.150 . 4.500 3.873 2.185 4.513 0.013 4 0 "[ . 1 . 2]" 2
314 1 13 GLN QB 1 14 ARG H 2.650 . 3.500 2.459 2.321 2.727 . 0 0 "[ . 1 . 2]" 2
315 1 14 ARG H 1 14 ARG QG 3.150 . 4.500 3.416 2.159 4.075 . 0 0 "[ . 1 . 2]" 2
316 1 11 ARG HA 1 14 ARG H 3.150 . 4.500 3.523 3.025 4.087 . 0 0 "[ . 1 . 2]" 2
317 1 13 GLN HG2 1 14 ARG H 3.150 . 4.500 3.725 3.326 4.524 0.024 8 0 "[ . 1 . 2]" 2
318 1 12 ARG HA 1 15 LEU H 2.650 . 3.500 3.375 2.947 3.563 0.063 3 0 "[ . 1 . 2]" 2
319 1 14 ARG QB 1 15 LEU H 3.150 . 4.500 2.676 2.480 2.936 . 0 0 "[ . 1 . 2]" 2
320 1 15 LEU H 1 15 LEU MD1 3.150 . 4.500 3.880 2.404 4.300 . 0 0 "[ . 1 . 2]" 2
321 1 94 ILE H 1 95 GLU H 3.150 . 4.500 2.650 2.584 2.730 . 0 0 "[ . 1 . 2]" 2
322 1 93 LEU H 1 94 ILE H 3.150 . 4.500 2.592 2.450 2.698 . 0 0 "[ . 1 . 2]" 2
323 1 94 ILE H 1 94 ILE HG12 3.150 . 4.500 3.380 1.947 3.701 . 0 0 "[ . 1 . 2]" 2
324 1 93 LEU HB2 1 94 ILE H 3.150 . 4.500 3.887 3.765 3.969 . 0 0 "[ . 1 . 2]" 2
325 1 94 ILE H 1 94 ILE MD 3.150 . 4.500 3.492 2.760 3.636 . 0 0 "[ . 1 . 2]" 2
326 1 12 ARG HA 1 16 ALA H 3.650 . 5.500 4.241 3.450 4.679 . 0 0 "[ . 1 . 2]" 2
327 1 16 ALA H 1 16 ALA MB 2.650 . 3.500 2.243 2.210 2.261 . 0 0 "[ . 1 . 2]" 2
328 1 15 LEU HB3 1 16 ALA H 2.650 . 3.500 2.852 2.458 3.516 0.016 5 0 "[ . 1 . 2]" 2
329 1 15 LEU HB2 1 16 ALA H 3.150 . 4.500 3.609 2.594 4.098 . 0 0 "[ . 1 . 2]" 2
330 1 16 ALA MB 1 17 GLU H 3.150 . 4.500 2.625 2.365 2.913 . 0 0 "[ . 1 . 2]" 2
331 1 17 GLU H 1 17 GLU HG3 3.150 . 4.500 3.109 1.911 3.664 . 0 0 "[ . 1 . 2]" 2
332 1 18 LEU HB2 1 19 GLN H 3.150 . 4.500 3.702 3.430 4.001 . 0 0 "[ . 1 . 2]" 2
333 1 18 LEU HB3 1 19 GLN H 2.650 . 3.500 2.583 2.131 3.045 . 0 0 "[ . 1 . 2]" 2
334 1 18 LEU H 1 18 LEU HB2 2.650 . 3.500 2.348 2.153 2.601 . 0 0 "[ . 1 . 2]" 2
335 1 17 GLU QB 1 18 LEU H 3.150 . 4.500 2.513 2.208 2.966 . 0 0 "[ . 1 . 2]" 2
336 1 17 GLU HG2 1 18 LEU H 3.150 . 4.500 4.317 3.993 4.624 0.124 15 0 "[ . 1 . 2]" 2
337 1 18 LEU H 1 18 LEU HG 3.650 . 5.500 4.494 4.264 4.635 . 0 0 "[ . 1 . 2]" 2
338 1 20 ALA H 1 20 ALA MB 3.150 . 4.500 2.515 2.172 3.037 . 0 0 "[ . 1 . 2]" 2
339 1 19 GLN QB 1 20 ALA H 3.150 . 4.500 3.289 2.216 3.998 . 0 0 "[ . 1 . 2]" 2
340 1 21 LYS H 1 22 HIS H 3.150 . 4.500 3.918 2.217 4.531 0.031 8 0 "[ . 1 . 2]" 2
341 1 20 ALA H 1 21 LYS H 3.150 . 4.500 3.889 2.531 4.549 0.049 12 0 "[ . 1 . 2]" 2
342 1 21 LYS H 1 21 LYS HB2 3.150 . 4.500 3.065 2.335 3.999 . 0 0 "[ . 1 . 2]" 2
343 1 21 LYS H 1 21 LYS HG3 3.150 . 4.500 3.679 2.239 4.537 0.037 11 0 "[ . 1 . 2]" 2
344 1 20 ALA MB 1 21 LYS H 3.150 . 4.500 3.124 1.927 3.641 . 0 0 "[ . 1 . 2]" 2
345 1 22 HIS H 1 22 HIS HB3 3.150 . 4.500 3.267 2.717 4.220 . 0 0 "[ . 1 . 2]" 2
346 1 22 HIS H 1 22 HIS HB2 3.150 . 4.500 3.273 2.323 4.051 . 0 0 "[ . 1 . 2]" 2
347 1 21 LYS HG2 1 22 HIS H 3.650 . 5.500 4.445 2.492 5.228 . 0 0 "[ . 1 . 2]" 2
348 1 21 LYS HB3 1 22 HIS H 3.150 . 4.500 3.691 2.197 4.501 0.001 9 0 "[ . 1 . 2]" 2
349 1 23 GLY H 1 23 GLY QA 2.650 . 3.500 2.307 2.177 2.498 . 0 0 "[ . 1 . 2]" 2
350 1 22 HIS HA 1 23 GLY H 3.150 . 4.500 2.716 1.998 3.436 . 0 0 "[ . 1 . 2]" 2
351 1 22 HIS HB2 1 23 GLY H 3.650 . 5.500 4.297 3.699 4.615 . 0 0 "[ . 1 . 2]" 2
352 1 22 HIS HA 1 24 ASP H 3.150 . 4.500 3.712 2.941 4.513 0.013 1 0 "[ . 1 . 2]" 2
353 1 23 GLY QA 1 24 ASP H 2.650 . 3.500 2.609 2.189 2.908 . 0 0 "[ . 1 . 2]" 2
354 1 24 ASP H 1 24 ASP HB2 3.150 . 4.500 3.494 2.695 4.010 . 0 0 "[ . 1 . 2]" 2
355 1 24 ASP H 1 24 ASP HB3 2.650 . 3.500 2.828 2.410 3.300 . 0 0 "[ . 1 . 2]" 2
356 1 106 LYS H 1 106 LYS HG2 3.150 . 4.500 3.707 2.167 4.514 0.014 10 0 "[ . 1 . 2]" 2
357 1 26 GLY H 1 27 ASP H 3.150 . 4.500 3.616 2.253 4.520 0.020 9 0 "[ . 1 . 2]" 2
358 1 25 PRO HD2 1 26 GLY H 3.150 . 4.500 2.965 2.492 4.053 . 0 0 "[ . 1 . 2]" 2
359 1 25 PRO HA 1 26 GLY H 3.150 . 4.500 3.274 2.836 3.607 . 0 0 "[ . 1 . 2]" 2
360 1 25 PRO HB2 1 26 GLY H 3.150 . 4.500 3.674 2.290 4.372 . 0 0 "[ . 1 . 2]" 2
361 1 25 PRO HB3 1 26 GLY H 3.650 . 5.500 4.432 3.768 4.724 . 0 0 "[ . 1 . 2]" 2
362 1 24 ASP HB3 1 26 GLY H 3.650 . 5.500 4.302 3.443 5.068 . 0 0 "[ . 1 . 2]" 2
363 1 27 ASP H 1 28 ALA H 3.150 . 4.500 2.860 2.031 4.203 . 0 0 "[ . 1 . 2]" 2
364 1 27 ASP H 1 27 ASP HA 2.650 . 3.500 2.686 2.222 2.941 . 0 0 "[ . 1 . 2]" 2
365 1 27 ASP H 1 27 ASP QB 2.650 . 3.500 2.504 2.247 3.049 . 0 0 "[ . 1 . 2]" 2
366 1 28 ALA H 1 28 ALA HA 2.650 . 3.500 2.814 2.772 2.850 . 0 0 "[ . 1 . 2]" 2
367 1 27 ASP HA 1 28 ALA H 2.650 . 3.500 3.477 3.282 3.524 0.024 19 0 "[ . 1 . 2]" 2
368 1 28 ALA H 1 28 ALA MB 3.150 . 4.500 2.242 2.170 2.279 . 0 0 "[ . 1 . 2]" 2
369 1 27 ASP QB 1 28 ALA H 3.150 . 4.500 2.628 2.007 3.785 . 0 0 "[ . 1 . 2]" 2
370 1 27 ASP HA 1 29 ALA H 3.150 . 4.500 4.244 3.663 4.582 0.082 4 0 "[ . 1 . 2]" 2
371 1 27 ASP HA 1 30 GLN H 3.650 . 5.500 3.630 3.193 4.131 . 0 0 "[ . 1 . 2]" 2
372 1 30 GLN H 1 30 GLN QG 3.150 . 4.500 2.262 2.071 2.430 . 0 0 "[ . 1 . 2]" 2
373 1 29 ALA MB 1 30 GLN H 2.650 . 3.500 2.589 2.206 3.000 . 0 0 "[ . 1 . 2]" 2
374 1 80 ARG H 1 81 TYR H 3.150 . 4.500 2.644 2.526 2.771 . 0 0 "[ . 1 . 2]" 2
375 1 80 ARG H 1 80 ARG HB2 2.650 . 3.500 2.406 2.197 2.620 . 0 0 "[ . 1 . 2]" 2
376 1 80 ARG H 1 80 ARG HB3 2.650 . 3.500 2.787 2.392 3.552 0.052 16 0 "[ . 1 . 2]" 2
377 1 80 ARG H 1 80 ARG QG 3.650 . 5.500 3.742 2.518 4.071 . 0 0 "[ . 1 . 2]" 2
378 1 79 ALA MB 1 80 ARG H 3.150 . 4.500 2.625 2.475 2.745 . 0 0 "[ . 1 . 2]" 2
379 1 37 GLU H 1 38 ALA H 2.650 . 3.500 2.674 2.451 2.925 . 0 0 "[ . 1 . 2]" 2
380 1 31 GLN H 1 31 GLN HA 2.650 . 3.500 2.826 2.777 2.860 . 0 0 "[ . 1 . 2]" 2
381 1 30 GLN HA 1 31 GLN H 2.650 . 3.500 3.483 3.407 3.516 0.016 11 0 "[ . 1 . 2]" 2
382 1 30 GLN QG 1 31 GLN H 3.150 . 4.500 3.388 2.260 4.231 . 0 0 "[ . 1 . 2]" 2
383 1 35 HIS H 1 36 ARG H 2.650 . 3.500 2.642 2.363 2.921 . 0 0 "[ . 1 . 2]" 2
384 1 35 HIS H 1 35 HIS HA 2.650 . 3.500 2.811 2.741 2.891 . 0 0 "[ . 1 . 2]" 2
385 1 34 LYS HA 1 35 HIS H 3.150 . 4.500 3.504 3.443 3.545 . 0 0 "[ . 1 . 2]" 2
386 1 35 HIS H 1 35 HIS HB2 2.650 . 3.500 2.500 2.094 2.712 . 0 0 "[ . 1 . 2]" 2
387 1 34 LYS QB 1 35 HIS H 3.150 . 4.500 2.633 2.397 2.925 . 0 0 "[ . 1 . 2]" 2
388 1 34 LYS HG3 1 35 HIS H 3.150 . 4.500 3.884 3.401 4.445 . 0 0 "[ . 1 . 2]" 2
389 1 31 GLN QG 1 32 GLU H 3.150 . 4.500 3.893 3.190 4.342 . 0 0 "[ . 1 . 2]" 2
390 1 32 GLU H 1 33 ALA H 2.650 . 2.800 2.654 2.450 2.810 0.010 4 0 "[ . 1 . 2]" 2
391 1 33 ALA H 1 33 ALA MB 2.650 . 3.500 2.241 2.217 2.272 . 0 0 "[ . 1 . 2]" 2
392 1 32 GLU QB 1 33 ALA H 3.150 . 4.500 2.619 2.138 3.629 . 0 0 "[ . 1 . 2]" 2
393 1 32 GLU QG 1 33 ALA H 3.650 . 5.500 3.794 2.409 4.563 . 0 0 "[ . 1 . 2]" 2
394 1 34 LYS H 1 35 HIS H 2.650 . 3.500 2.595 2.454 2.715 . 0 0 "[ . 1 . 2]" 2
395 1 34 LYS H 1 34 LYS QB 2.650 . 3.500 2.233 2.163 2.296 . 0 0 "[ . 1 . 2]" 2
396 1 33 ALA MB 1 34 LYS H 3.150 . 4.500 2.478 2.286 2.625 . 0 0 "[ . 1 . 2]" 2
397 1 34 LYS H 1 36 ARG H 3.150 . 4.500 4.103 3.925 4.389 . 0 0 "[ . 1 . 2]" 2
398 1 35 HIS HB3 1 36 ARG H 2.650 . 3.500 2.613 2.096 2.940 . 0 0 "[ . 1 . 2]" 2
399 1 36 ARG H 1 36 ARG HA 2.650 . 3.500 2.829 2.789 2.881 . 0 0 "[ . 1 . 2]" 2
400 1 57 LEU H 1 59 ASN H 3.150 . 4.500 4.116 3.797 4.349 . 0 0 "[ . 1 . 2]" 2
401 1 56 ARG H 1 57 LEU H 3.150 . 4.500 2.673 2.524 2.900 . 0 0 "[ . 1 . 2]" 2
402 1 87 LYS H 1 88 VAL H 3.650 . 5.500 4.452 4.241 4.531 . 0 0 "[ . 1 . 2]" 2
403 1 53 ALA HA 1 57 LEU H 3.150 . 4.500 3.924 3.739 4.188 . 0 0 "[ . 1 . 2]" 2
404 1 57 LEU H 1 93 LEU MD2 3.150 . 4.500 3.057 2.566 3.437 . 0 0 "[ . 1 . 2]" 2
405 1 86 GLU QG 1 87 LYS H 3.150 . 4.500 3.539 2.089 4.435 . 0 0 "[ . 1 . 2]" 2
406 1 48 VAL HA 1 87 LYS H 3.900 . 6.000 5.597 4.772 6.077 0.077 2 0 "[ . 1 . 2]" 2
407 1 35 HIS HA 1 36 ARG H 3.150 . 4.500 3.521 3.476 3.593 . 0 0 "[ . 1 . 2]" 2
408 1 87 LYS H 1 87 LYS HB3 2.650 . 3.500 3.557 3.531 3.605 0.105 12 0 "[ . 1 . 2]" 2
409 1 36 ARG H 1 36 ARG QG 3.150 . 4.500 2.845 2.116 4.014 . 0 0 "[ . 1 . 2]" 2
410 1 36 ARG H 1 37 GLU H . . 2.800 2.570 2.374 2.674 . 0 0 "[ . 1 . 2]" 2
411 1 34 LYS HA 1 37 GLU H 2.650 . 3.500 3.241 3.013 3.433 . 0 0 "[ . 1 . 2]" 2
412 1 3 ALA HA 1 6 GLU H 3.650 . 5.500 3.701 3.170 4.414 . 0 0 "[ . 1 . 2]" 2
413 1 36 ARG QB 1 37 GLU H 3.150 . 4.500 2.808 2.479 3.661 . 0 0 "[ . 1 . 2]" 2
414 1 6 GLU H 1 6 GLU QB 2.650 . 3.500 2.480 2.289 2.631 . 0 0 "[ . 1 . 2]" 2
415 1 37 GLU H 1 37 GLU HG3 3.150 . 4.500 3.388 2.284 4.412 . 0 0 "[ . 1 . 2]" 2
416 1 34 LYS HG3 1 37 GLU H 3.400 . 5.000 5.031 4.967 5.063 0.063 8 0 "[ . 1 . 2]" 2
417 1 35 HIS HA 1 38 ALA H 3.650 . 5.500 3.506 3.046 4.049 . 0 0 "[ . 1 . 2]" 2
418 1 37 GLU QB 1 38 ALA H 2.650 . 3.500 2.400 2.079 2.751 . 0 0 "[ . 1 . 2]" 2
419 1 38 ALA H 1 38 ALA MB 2.650 . 3.500 2.228 2.210 2.254 . 0 0 "[ . 1 . 2]" 2
420 1 37 GLU HG3 1 38 ALA H 3.650 . 5.500 4.601 4.066 5.135 . 0 0 "[ . 1 . 2]" 2
421 1 30 GLN HA 1 34 LYS H 3.150 . 4.500 4.032 3.539 4.396 . 0 0 "[ . 1 . 2]" 2
422 1 39 GLU H 1 39 GLU QG 3.150 . 4.500 2.853 2.040 4.051 . 0 0 "[ . 1 . 2]" 2
423 1 38 ALA MB 1 39 GLU H 3.150 . 4.500 2.445 2.208 2.717 . 0 0 "[ . 1 . 2]" 2
424 1 70 ALA H 1 71 VAL H 3.150 . 4.500 2.734 2.581 2.885 . 0 0 "[ . 1 . 2]" 2
425 1 71 VAL H 1 72 GLU H 3.150 . 4.500 2.696 2.585 2.814 . 0 0 "[ . 1 . 2]" 2
426 1 71 VAL H 1 71 VAL HB 2.900 . 4.000 3.713 3.679 3.740 . 0 0 "[ . 1 . 2]" 2
427 1 8 GLU H 1 8 GLU QG 3.150 . 4.500 3.167 2.103 4.034 . 0 0 "[ . 1 . 2]" 2
428 1 71 VAL H 1 97 LEU MD1 3.150 . 4.500 4.521 4.417 4.583 0.083 16 0 "[ . 1 . 2]" 2
429 1 71 VAL H 1 71 VAL MG1 3.150 . 4.500 2.355 2.250 2.418 . 0 0 "[ . 1 . 2]" 2
430 1 70 ALA MB 1 71 VAL H 3.150 . 4.500 2.451 2.283 2.583 . 0 0 "[ . 1 . 2]" 2
431 1 42 ASN H 1 42 ASN HB3 3.150 . 4.500 2.693 2.419 3.624 . 0 0 "[ . 1 . 2]" 2
432 1 108 THR H 1 108 THR MG 3.650 . 5.500 3.595 2.094 4.018 . 0 0 "[ . 1 . 2]" 2
433 1 83 GLN H 1 83 GLN QG 2.650 . 3.500 2.447 1.915 2.972 . 0 0 "[ . 1 . 2]" 2
434 1 83 GLN H 1 83 GLN QB 3.150 . 4.500 2.469 2.255 2.802 . 0 0 "[ . 1 . 2]" 2
435 1 82 GLY H 1 83 GLN H 2.650 . 3.500 2.494 2.168 2.685 . 0 0 "[ . 1 . 2]" 2
436 1 41 ARG HA 1 42 ASN H 3.150 . 4.500 3.515 3.438 3.563 . 0 0 "[ . 1 . 2]" 2
437 1 82 GLY QA 1 83 GLN H 2.650 . 3.500 2.747 2.499 2.902 . 0 0 "[ . 1 . 2]" 2
438 1 79 ALA HA 1 83 GLN H 3.150 . 4.500 3.819 3.171 4.455 . 0 0 "[ . 1 . 2]" 2
439 1 38 ALA HA 1 42 ASN H 3.150 . 4.500 3.880 2.751 4.200 . 0 0 "[ . 1 . 2]" 2
440 1 41 ARG QG 1 42 ASN H 3.150 . 4.500 3.960 3.494 4.388 . 0 0 "[ . 1 . 2]" 2
441 1 41 ARG QB 1 42 ASN H 3.150 . 4.500 2.504 2.221 2.873 . 0 0 "[ . 1 . 2]" 2
442 1 42 ASN H 1 45 LEU MD1 3.650 . 5.500 4.298 3.531 5.017 . 0 0 "[ . 1 . 2]" 2
443 1 43 SER H 1 44 ILE H 3.150 . 3.500 2.817 2.667 2.959 . 0 0 "[ . 1 . 2]" 2
444 1 42 ASN HA 1 43 SER H 3.150 . 4.500 3.532 3.451 3.584 . 0 0 "[ . 1 . 2]" 2
445 1 42 ASN HB2 1 43 SER H 3.150 . 4.500 3.811 2.849 4.136 . 0 0 "[ . 1 . 2]" 2
446 1 44 ILE H 1 44 ILE HA 2.650 . 3.500 2.837 2.784 2.866 . 0 0 "[ . 1 . 2]" 2
447 1 44 ILE H 1 44 ILE MG 3.150 . 4.500 2.384 2.206 2.757 . 0 0 "[ . 1 . 2]" 2
448 1 44 ILE H 1 44 ILE HG12 3.150 . 4.500 2.288 1.965 2.754 . 0 0 "[ . 1 . 2]" 2
449 1 44 ILE H 1 44 ILE HG13 2.900 . 4.000 3.353 3.093 3.870 . 0 0 "[ . 1 . 2]" 2
450 1 44 ILE H 1 44 ILE HB 3.150 . 4.500 3.717 3.664 3.759 . 0 0 "[ . 1 . 2]" 2
451 1 43 SER HB3 1 44 ILE H 3.150 . 4.500 3.791 3.562 4.132 . 0 0 "[ . 1 . 2]" 2
452 1 74 TYR H 1 74 TYR HB3 2.650 . 3.500 2.586 2.460 2.697 . 0 0 "[ . 1 . 2]" 2
453 1 74 TYR H 1 74 TYR HB2 2.650 . 3.500 2.492 2.288 2.702 . 0 0 "[ . 1 . 2]" 2
454 1 73 ASN HB2 1 74 TYR H 3.150 . 4.500 3.754 3.623 4.061 . 0 0 "[ . 1 . 2]" 2
455 1 73 ASN HB3 1 74 TYR H 3.150 . 4.500 2.504 2.354 2.801 . 0 0 "[ . 1 . 2]" 2
456 1 74 TYR H 1 75 LEU H 2.650 . 3.500 2.722 2.541 2.816 . 0 0 "[ . 1 . 2]" 2
457 1 54 ARG H 1 55 ALA H 3.150 . 4.500 2.642 2.515 2.754 . 0 0 "[ . 1 . 2]" 2
458 1 55 ALA H 1 55 ALA MB 2.650 . 3.500 2.243 2.222 2.273 . 0 0 "[ . 1 . 2]" 2
459 1 54 ARG HB2 1 55 ALA H 2.650 . 3.500 3.034 2.567 3.600 0.100 16 0 "[ . 1 . 2]" 2
460 1 71 VAL HA 1 74 TYR H 3.150 . 4.500 3.184 2.946 3.484 . 0 0 "[ . 1 . 2]" 2
461 1 73 ASN HA 1 74 TYR H 3.150 . 4.500 3.527 3.474 3.547 . 0 0 "[ . 1 . 2]" 2
462 1 43 SER HA 1 44 ILE H 3.150 . 4.500 3.580 3.501 3.625 . 0 0 "[ . 1 . 2]" 2
463 1 53 ALA HA 1 55 ALA H 3.150 . 4.500 4.323 4.065 4.501 0.001 16 0 "[ . 1 . 2]" 2
464 1 52 SER HA 1 55 ALA H 3.150 . 4.500 3.507 3.182 3.817 . 0 0 "[ . 1 . 2]" 2
465 1 45 LEU H 1 46 ALA H 3.150 . 4.500 2.669 2.365 2.832 . 0 0 "[ . 1 . 2]" 2
466 1 44 ILE H 1 45 LEU H 2.650 . 3.500 2.571 2.378 2.776 . 0 0 "[ . 1 . 2]" 2
467 1 42 ASN HA 1 45 LEU H 3.150 . 4.500 3.595 3.062 4.008 . 0 0 "[ . 1 . 2]" 2
468 1 45 LEU H 1 45 LEU HB3 2.900 . 4.000 3.611 3.572 3.694 . 0 0 "[ . 1 . 2]" 2
469 1 45 LEU H 1 45 LEU HB2 2.650 . 3.500 2.495 2.372 2.637 . 0 0 "[ . 1 . 2]" 2
470 1 45 LEU H 1 45 LEU MD1 3.150 . 4.500 3.595 1.978 3.819 . 0 0 "[ . 1 . 2]" 2
471 1 46 ALA H 1 47 GLN H 3.150 . 4.500 2.626 2.450 2.779 . 0 0 "[ . 1 . 2]" 2
472 1 46 ALA H 1 46 ALA HA 2.650 . 3.500 2.825 2.779 2.873 . 0 0 "[ . 1 . 2]" 2
473 1 46 ALA H 1 46 ALA MB 3.150 . 4.500 2.235 2.179 2.307 . 0 0 "[ . 1 . 2]" 2
474 1 45 LEU HB3 1 46 ALA H 3.150 . 4.500 3.672 3.392 3.868 . 0 0 "[ . 1 . 2]" 2
475 1 45 LEU HA 1 46 ALA H 3.150 . 4.500 3.520 3.459 3.573 . 0 0 "[ . 1 . 2]" 2
476 1 43 SER HA 1 46 ALA H 3.150 . 4.500 3.706 3.084 4.347 . 0 0 "[ . 1 . 2]" 2
477 1 45 LEU HB2 1 46 ALA H 3.150 . 4.500 2.695 2.306 2.949 . 0 0 "[ . 1 . 2]" 2
478 1 45 LEU MD1 1 46 ALA H 3.650 . 5.500 4.554 3.849 4.856 . 0 0 "[ . 1 . 2]" 2
479 1 47 GLN H 1 48 VAL H 3.150 . 3.500 2.295 2.124 2.524 . 0 0 "[ . 1 . 2]" 2
480 1 47 GLN H 1 49 LEU H 3.150 . 4.500 3.817 3.606 4.054 . 0 0 "[ . 1 . 2]" 2
481 1 46 ALA MB 1 47 GLN H 3.650 . 5.500 2.916 2.672 3.034 . 0 0 "[ . 1 . 2]" 2
482 1 47 GLN H 1 47 GLN HG2 3.150 . 4.500 2.704 1.986 3.633 . 0 0 "[ . 1 . 2]" 2
483 1 47 GLN H 1 47 GLN HG3 3.150 . 4.500 3.492 2.254 4.090 . 0 0 "[ . 1 . 2]" 2
484 1 47 GLN H 1 47 GLN QB 3.150 . 4.500 2.547 2.396 2.929 . 0 0 "[ . 1 . 2]" 2
485 1 46 ALA HA 1 47 GLN H 3.150 . 4.500 3.452 3.386 3.525 . 0 0 "[ . 1 . 2]" 2
486 1 44 ILE HA 1 47 GLN H 3.650 . 5.500 3.398 3.068 3.662 . 0 0 "[ . 1 . 2]" 2
487 1 47 GLN HA 1 48 VAL H 3.150 . 4.500 3.474 3.355 3.544 . 0 0 "[ . 1 . 2]" 2
488 1 48 VAL H 1 48 VAL QG 3.650 . 5.500 2.151 1.921 2.537 . 0 0 "[ . 1 . 2]" 2
489 1 47 GLN QB 1 48 VAL H 3.150 . 4.500 2.930 2.475 3.687 . 0 0 "[ . 1 . 2]" 2
490 1 48 VAL H 1 48 VAL HB 3.150 . 4.500 3.018 2.282 3.755 . 0 0 "[ . 1 . 2]" 2
491 1 48 VAL H 1 49 LEU HB2 3.400 . 5.000 4.631 4.359 4.871 . 0 0 "[ . 1 . 2]" 2
492 1 44 ILE HB 1 48 VAL H 3.650 . 5.500 4.916 4.461 5.509 0.009 4 0 "[ . 1 . 2]" 2
493 1 48 VAL H 1 49 LEU H 3.150 . 4.500 2.397 2.236 2.612 . 0 0 "[ . 1 . 2]" 2
494 1 49 LEU H 1 49 LEU HB2 2.650 . 3.500 2.443 2.341 2.528 . 0 0 "[ . 1 . 2]" 2
495 1 49 LEU H 1 49 LEU MD1 3.150 . 4.500 3.808 3.543 4.054 . 0 0 "[ . 1 . 2]" 2
496 1 49 LEU H 1 49 LEU HB3 3.150 . 4.500 3.619 3.552 3.690 . 0 0 "[ . 1 . 2]" 2
497 1 49 LEU H 1 49 LEU HG 3.150 . 4.500 2.738 2.489 3.145 . 0 0 "[ . 1 . 2]" 2
498 1 50 ASP H 1 51 GLN H 3.150 . 4.500 4.532 4.467 4.553 0.053 14 0 "[ . 1 . 2]" 2
499 1 49 LEU HA 1 50 ASP H 2.650 . 3.500 2.090 1.987 2.177 . 0 0 "[ . 1 . 2]" 2
500 1 50 ASP H 1 50 ASP HB2 3.150 . 4.500 2.559 2.423 2.678 . 0 0 "[ . 1 . 2]" 2
501 1 50 ASP H 1 50 ASP HB3 3.150 . 4.500 2.541 2.374 2.811 . 0 0 "[ . 1 . 2]" 2
502 1 50 ASP H 1 88 VAL HA 3.650 . 5.500 4.755 4.382 5.335 . 0 0 "[ . 1 . 2]" 2
503 1 49 LEU MD2 1 50 ASP H 3.650 . 5.500 3.586 3.271 3.869 . 0 0 "[ . 1 . 2]" 2
504 1 50 ASP H 1 53 ALA MB 3.650 . 5.500 2.680 2.488 2.885 . 0 0 "[ . 1 . 2]" 2
505 1 49 LEU HB2 1 50 ASP H 3.150 . 4.500 4.156 4.078 4.265 . 0 0 "[ . 1 . 2]" 2
506 1 49 LEU HB3 1 50 ASP H 3.150 . 4.500 3.256 3.118 3.448 . 0 0 "[ . 1 . 2]" 2
507 1 50 ASP H 1 88 VAL HB 3.150 . 4.500 3.764 3.385 4.580 0.080 17 0 "[ . 1 . 2]" 2
508 1 50 ASP HA 1 51 GLN H 2.650 . 3.500 2.366 2.203 2.764 . 0 0 "[ . 1 . 2]" 2
509 1 50 ASP HB3 1 51 GLN H 3.150 . 4.500 3.531 2.780 3.881 . 0 0 "[ . 1 . 2]" 2
510 1 50 ASP HB2 1 51 GLN H 3.150 . 4.500 3.813 3.641 3.982 . 0 0 "[ . 1 . 2]" 2
511 1 51 GLN H 1 51 GLN QG 3.150 . 4.500 3.622 1.954 4.057 . 0 0 "[ . 1 . 2]" 2
512 1 52 SER H 1 53 ALA H 3.150 . 4.500 2.498 2.304 2.677 . 0 0 "[ . 1 . 2]" 2
513 1 51 GLN H 1 52 SER H 3.150 . 4.500 2.824 2.664 2.996 . 0 0 "[ . 1 . 2]" 2
514 1 91 GLN H 1 92 GLY H 3.150 . 4.500 2.714 2.539 2.824 . 0 0 "[ . 1 . 2]" 2
515 1 90 GLU H 1 91 GLN H 3.150 . 4.500 2.727 2.532 2.884 . 0 0 "[ . 1 . 2]" 2
516 1 51 GLN QG 1 52 SER H 3.150 . 4.500 3.888 3.436 4.501 0.001 6 0 "[ . 1 . 2]" 2
517 1 91 GLN H 1 91 GLN QB 2.650 . 3.500 2.419 2.188 2.760 . 0 0 "[ . 1 . 2]" 2
518 1 51 GLN HB3 1 52 SER H 2.650 . 3.500 2.918 2.526 3.578 0.078 3 0 "[ . 1 . 2]" 2
519 1 50 ASP HB3 1 52 SER H 3.650 . 5.500 3.243 3.024 3.520 . 0 0 "[ . 1 . 2]" 2
520 1 90 GLU HA 1 91 GLN H 3.150 . 4.500 3.528 3.485 3.556 . 0 0 "[ . 1 . 2]" 2
521 1 52 SER H 1 52 SER HA 2.650 . 3.500 2.843 2.804 2.889 . 0 0 "[ . 1 . 2]" 2
522 1 89 SER HB3 1 91 GLN H 3.400 . 5.000 3.743 3.163 4.676 . 0 0 "[ . 1 . 2]" 2
523 1 50 ASP HA 1 52 SER H 3.650 . 5.500 4.340 4.150 4.954 . 0 0 "[ . 1 . 2]" 2
524 1 89 SER HA 1 91 GLN H 3.900 . 6.000 4.678 4.433 4.877 . 0 0 "[ . 1 . 2]" 2
525 1 91 GLN H 1 94 ILE HG13 3.650 . 5.500 4.826 4.507 5.195 . 0 0 "[ . 1 . 2]" 2
526 1 49 LEU HB3 1 52 SER H 3.900 . 6.000 6.062 6.022 6.113 0.113 2 0 "[ . 1 . 2]" 2
527 1 53 ALA H 1 54 ARG H 3.150 . 4.500 2.503 2.360 2.629 . 0 0 "[ . 1 . 2]" 2
528 1 52 SER HB2 1 53 ALA H 3.150 . 4.500 3.013 2.633 3.467 . 0 0 "[ . 1 . 2]" 2
529 1 52 SER HA 1 53 ALA H 3.650 . 5.500 3.500 3.389 3.540 . 0 0 "[ . 1 . 2]" 2
530 1 53 ALA H 1 90 GLU HG2 3.150 . 4.500 3.980 3.476 4.573 0.073 16 0 "[ . 1 . 2]" 2
531 1 53 ALA H 1 53 ALA MB 3.150 . 4.500 2.237 2.211 2.262 . 0 0 "[ . 1 . 2]" 2
532 1 52 SER H 1 54 ARG H 3.150 . 4.500 3.943 3.819 4.283 . 0 0 "[ . 1 . 2]" 2
533 1 85 SER H 1 86 GLU H 2.650 . 3.500 2.204 1.791 3.542 0.042 11 0 "[ . 1 . 2]" 2
534 1 85 SER H 1 85 SER HB2 2.650 . 3.500 2.676 2.364 3.439 . 0 0 "[ . 1 . 2]" 2
535 1 54 ARG H 1 54 ARG HD2 3.650 . 5.500 4.053 3.667 4.433 . 0 0 "[ . 1 . 2]" 2
536 1 54 ARG H 1 54 ARG HB3 3.150 . 4.500 3.326 2.535 3.750 . 0 0 "[ . 1 . 2]" 2
537 1 54 ARG H 1 54 ARG HB2 3.150 . 4.500 2.400 2.242 2.620 . 0 0 "[ . 1 . 2]" 2
538 1 54 ARG H 1 54 ARG HG2 3.150 . 4.500 3.594 2.350 4.547 0.047 10 0 "[ . 1 . 2]" 2
539 1 53 ALA MB 1 54 ARG H 3.150 . 4.500 2.614 2.478 2.715 . 0 0 "[ . 1 . 2]" 2
540 1 84 LEU QB 1 85 SER H 3.150 . 4.500 3.226 2.329 3.980 . 0 0 "[ . 1 . 2]" 2
541 1 84 LEU MD1 1 85 SER H 3.650 . 5.500 3.377 2.537 4.112 . 0 0 "[ . 1 . 2]" 2
542 1 55 ALA H 1 56 ARG H 3.150 . 3.500 2.642 2.554 2.825 . 0 0 "[ . 1 . 2]" 2
543 1 56 ARG H 1 56 ARG HA 2.650 . 3.500 2.796 2.745 2.846 . 0 0 "[ . 1 . 2]" 2
544 1 56 ARG H 1 56 ARG HG3 3.150 . 4.500 4.394 4.129 4.500 . 0 0 "[ . 1 . 2]" 2
545 1 56 ARG H 1 56 ARG HG2 3.150 . 4.500 4.464 3.914 4.533 0.033 5 0 "[ . 1 . 2]" 2
546 1 55 ALA MB 1 56 ARG H 3.150 . 4.500 2.480 2.360 2.644 . 0 0 "[ . 1 . 2]" 2
547 1 56 ARG H 1 56 ARG QB 3.150 . 4.500 2.153 2.093 2.303 . 0 0 "[ . 1 . 2]" 2
548 1 56 ARG H 1 90 GLU HG2 3.150 . 4.500 4.004 3.228 4.570 0.070 16 0 "[ . 1 . 2]" 2
549 1 53 ALA HA 1 56 ARG H 3.150 . 4.500 3.239 3.084 3.426 . 0 0 "[ . 1 . 2]" 2
550 1 58 SER H 1 59 ASN H 3.150 . 4.500 2.629 2.463 2.771 . 0 0 "[ . 1 . 2]" 2
551 1 57 LEU H 1 58 SER H 3.150 . 4.500 2.682 2.527 2.856 . 0 0 "[ . 1 . 2]" 2
552 1 58 SER H 1 58 SER HB2 2.650 . 3.500 2.451 2.379 2.546 . 0 0 "[ . 1 . 2]" 2
553 1 57 LEU MD1 1 58 SER H 3.650 . 5.500 4.462 3.899 4.606 . 0 0 "[ . 1 . 2]" 2
554 1 57 LEU QB 1 58 SER H 3.150 . 4.500 2.598 2.279 3.633 . 0 0 "[ . 1 . 2]" 2
555 1 59 ASN H 1 61 ALA H 3.150 . 4.500 4.029 3.843 4.129 . 0 0 "[ . 1 . 2]" 2
556 1 99 LYS H 1 100 VAL H 3.150 . 4.500 2.703 2.411 2.870 . 0 0 "[ . 1 . 2]" 2
557 1 100 VAL H 1 101 SER H 2.650 . 3.500 2.534 2.316 2.767 . 0 0 "[ . 1 . 2]" 2
558 1 60 LEU H 1 61 ALA H 3.150 . 4.500 2.596 2.417 2.791 . 0 0 "[ . 1 . 2]" 2
559 1 59 ASN H 1 60 LEU H 3.150 . 3.500 2.673 2.469 2.933 . 0 0 "[ . 1 . 2]" 2
560 1 86 GLU H 1 87 LYS H 3.150 . 4.500 4.303 4.099 4.507 0.007 15 0 "[ . 1 . 2]" 2
561 1 86 GLU H 1 86 GLU QG 3.150 . 4.500 3.346 2.361 4.553 0.053 2 0 "[ . 1 . 2]" 2
562 1 86 GLU H 1 86 GLU HB2 2.650 . 3.500 2.840 2.369 3.553 0.053 11 0 "[ . 1 . 2]" 2
563 1 96 ILE HA 1 99 LYS H 3.150 . 4.500 3.444 3.206 3.900 . 0 0 "[ . 1 . 2]" 2
564 1 85 SER HB3 1 86 GLU H 3.150 . 4.500 3.812 2.519 4.409 . 0 0 "[ . 1 . 2]" 2
565 1 99 LYS H 1 99 LYS HA 2.650 . 3.500 2.807 2.749 2.855 . 0 0 "[ . 1 . 2]" 2
566 1 99 LYS H 1 100 VAL MG1 3.650 . 5.500 4.369 4.067 5.678 0.178 1 0 "[ . 1 . 2]" 2
567 1 84 LEU MD1 1 86 GLU H 3.650 . 5.500 3.518 2.485 4.868 . 0 0 "[ . 1 . 2]" 2
568 1 99 LYS H 1 99 LYS HG2 3.150 . 4.500 3.392 2.046 4.503 0.003 6 0 "[ . 1 . 2]" 2
569 1 84 LEU QB 1 86 GLU H 3.150 . 4.500 3.717 2.606 4.615 0.115 16 0 "[ . 1 . 2]" 2
570 1 59 ASN H 1 59 ASN QB 3.150 . 4.500 2.304 2.192 2.515 . 0 0 "[ . 1 . 2]" 2
571 1 99 LYS H 1 99 LYS HD2 3.150 . 4.500 4.292 3.603 4.612 0.112 17 0 "[ . 1 . 2]" 2
572 1 98 LYS QB 1 99 LYS H 3.150 . 4.500 2.639 2.263 3.595 . 0 0 "[ . 1 . 2]" 2
573 1 99 LYS H 1 99 LYS QB 2.650 . 3.500 2.448 2.064 2.836 . 0 0 "[ . 1 . 2]" 2
574 1 85 SER HA 1 86 GLU H 3.150 . 4.500 3.255 2.050 3.564 . 0 0 "[ . 1 . 2]" 2
575 1 59 ASN H 1 59 ASN HA 2.650 . 3.500 2.827 2.770 2.864 . 0 0 "[ . 1 . 2]" 2
576 1 58 SER HA 1 59 ASN H 3.150 . 4.500 3.505 3.443 3.559 . 0 0 "[ . 1 . 2]" 2
577 1 60 LEU H 1 60 LEU HA 2.650 . 3.500 2.806 2.756 2.843 . 0 0 "[ . 1 . 2]" 2
578 1 56 ARG HA 1 60 LEU H 3.650 . 5.500 4.293 3.857 4.917 . 0 0 "[ . 1 . 2]" 2
579 1 59 ASN HA 1 60 LEU H 3.150 . 4.500 3.526 3.432 3.592 . 0 0 "[ . 1 . 2]" 2
580 1 59 ASN QB 1 60 LEU H 3.150 . 4.500 2.567 2.239 2.842 . 0 0 "[ . 1 . 2]" 2
581 1 60 LEU H 1 60 LEU HB3 2.650 . 3.500 3.159 2.698 3.547 0.047 16 0 "[ . 1 . 2]" 2
582 1 60 LEU H 1 60 LEU HB2 2.650 . 3.500 2.360 2.101 3.557 0.057 17 0 "[ . 1 . 2]" 2
583 1 60 LEU H 1 60 LEU MD2 3.650 . 5.500 3.018 2.231 3.876 . 0 0 "[ . 1 . 2]" 2
584 1 60 LEU HA 1 61 ALA H 2.650 . 3.500 3.476 3.376 3.517 0.017 5 0 "[ . 1 . 2]" 2
585 1 58 SER HA 1 61 ALA H 2.650 . 3.500 3.390 3.080 3.546 0.046 6 0 "[ . 1 . 2]" 2
586 1 60 LEU MD1 1 61 ALA H 3.650 . 5.500 4.149 2.462 4.790 . 0 0 "[ . 1 . 2]" 2
587 1 61 ALA H 1 61 ALA MB 3.150 . 4.500 2.231 2.191 2.270 . 0 0 "[ . 1 . 2]" 2
588 1 60 LEU HB3 1 61 ALA H 2.900 . 4.000 3.178 2.510 4.070 0.070 11 0 "[ . 1 . 2]" 2
589 1 60 LEU HB2 1 61 ALA H 2.650 . 3.500 3.266 2.805 3.593 0.093 11 0 "[ . 1 . 2]" 2
590 1 61 ALA H 1 62 LEU H 3.650 . 5.500 2.659 2.520 2.809 . 0 0 "[ . 1 . 2]" 2
591 1 62 LEU H 1 63 VAL H 3.150 . 4.500 2.416 2.211 2.616 . 0 0 "[ . 1 . 2]" 2
592 1 62 LEU H 1 62 LEU HB3 3.150 . 4.500 3.427 2.365 3.684 . 0 0 "[ . 1 . 2]" 2
593 1 62 LEU H 1 62 LEU HB2 2.650 . 3.500 2.398 2.278 2.503 . 0 0 "[ . 1 . 2]" 2
594 1 62 LEU H 1 63 VAL MG2 3.650 . 5.500 3.922 3.434 5.571 0.071 4 0 "[ . 1 . 2]" 2
595 1 63 VAL H 1 64 LYS H 3.150 . 4.500 2.448 1.981 2.868 . 0 0 "[ . 1 . 2]" 2
596 1 63 VAL H 1 63 VAL MG2 3.150 . 4.500 2.280 1.982 3.908 . 0 0 "[ . 1 . 2]" 2
597 1 63 VAL H 1 63 VAL HB 3.150 . 4.500 3.699 3.060 3.868 . 0 0 "[ . 1 . 2]" 2
598 1 62 LEU HB2 1 63 VAL H 3.150 . 4.500 3.189 2.527 3.989 . 0 0 "[ . 1 . 2]" 2
599 1 62 LEU HA 1 63 VAL H 3.650 . 5.500 3.447 3.306 3.542 . 0 0 "[ . 1 . 2]" 2
600 1 60 LEU HA 1 63 VAL H 3.650 . 5.500 3.319 3.173 3.517 . 0 0 "[ . 1 . 2]" 2
601 1 64 LYS H 1 64 LYS QG 3.150 . 4.500 3.029 2.324 3.728 . 0 0 "[ . 1 . 2]" 2
602 1 64 LYS H 1 64 LYS HB2 3.150 . 4.500 3.333 2.864 4.069 . 0 0 "[ . 1 . 2]" 2
603 1 63 VAL HB 1 64 LYS H 3.150 . 4.500 3.716 3.439 4.072 . 0 0 "[ . 1 . 2]" 2
604 1 64 LYS H 1 64 LYS HB3 3.150 . 4.500 3.787 3.415 3.954 . 0 0 "[ . 1 . 2]" 2
605 1 64 LYS H 1 64 LYS QD 3.650 . 5.500 4.569 2.644 5.244 . 0 0 "[ . 1 . 2]" 2
606 1 63 VAL MG1 1 64 LYS H 3.150 . 4.500 3.855 2.124 4.126 . 0 0 "[ . 1 . 2]" 2
607 1 64 LYS H 1 65 PRO HD2 3.650 . 5.500 4.461 3.985 4.859 . 0 0 "[ . 1 . 2]" 2
608 1 63 VAL HA 1 64 LYS H 3.150 . 4.500 3.560 3.437 3.616 . 0 0 "[ . 1 . 2]" 2
609 1 60 LEU HA 1 64 LYS H 3.650 . 5.500 3.669 3.032 4.331 . 0 0 "[ . 1 . 2]" 2
610 1 65 PRO HB2 1 66 GLU H 3.150 . 4.500 3.344 2.651 3.887 . 0 0 "[ . 1 . 2]" 2
611 1 66 GLU H 1 66 GLU QB 2.650 . 3.500 2.452 2.123 2.756 . 0 0 "[ . 1 . 2]" 2
612 1 66 GLU H 1 66 GLU HG2 3.150 . 4.500 3.755 2.375 4.444 . 0 0 "[ . 1 . 2]" 2
613 1 66 GLU H 1 66 GLU HG3 3.150 . 4.500 3.314 1.844 4.538 0.038 3 0 "[ . 1 . 2]" 2
614 1 65 PRO HB3 1 66 GLU H 3.150 . 4.500 4.287 3.974 4.512 0.012 5 0 "[ . 1 . 2]" 2
615 1 65 PRO HA 1 66 GLU H 3.650 . 5.500 3.427 3.304 3.491 . 0 0 "[ . 1 . 2]" 2
616 1 65 PRO HD2 1 66 GLU H 3.650 . 5.500 2.766 2.429 3.063 . 0 0 "[ . 1 . 2]" 2
617 1 64 LYS HB3 1 66 GLU H 3.650 . 5.500 3.926 2.829 5.329 . 0 0 "[ . 1 . 2]" 2
618 1 66 GLU H 1 67 LYS H 3.150 . 4.500 2.619 2.306 2.882 . 0 0 "[ . 1 . 2]" 2
619 1 84 LEU H 1 85 SER H 3.150 . 4.500 4.209 3.799 4.509 0.009 2 0 "[ . 1 . 2]" 2
620 1 82 GLY H 1 84 LEU H 3.150 . 4.500 4.080 3.495 4.502 0.002 2 0 "[ . 1 . 2]" 2
621 1 83 GLN H 1 84 LEU H 3.150 . 3.500 2.456 2.223 2.928 . 0 0 "[ . 1 . 2]" 2
622 1 84 LEU H 1 84 LEU MD2 3.150 . 4.500 2.655 1.790 4.256 0.010 19 0 "[ . 1 . 2]" 2
623 1 67 LYS H 1 67 LYS QG 3.150 . 4.500 2.438 2.052 3.847 . 0 0 "[ . 1 . 2]" 2
624 1 84 LEU H 1 84 LEU QB 2.650 . 3.500 2.475 2.107 2.794 . 0 0 "[ . 1 . 2]" 2
625 1 82 GLY QA 1 84 LEU H 3.650 . 5.500 3.082 2.820 3.513 . 0 0 "[ . 1 . 2]" 2
626 1 67 LYS H 1 67 LYS HB2 2.650 . 3.500 2.623 2.270 2.806 . 0 0 "[ . 1 . 2]" 2
627 1 67 LYS H 1 67 LYS HB3 3.150 . 4.500 3.641 3.523 3.703 . 0 0 "[ . 1 . 2]" 2
628 1 66 GLU QB 1 67 LYS H 3.150 . 4.500 2.516 2.034 2.884 . 0 0 "[ . 1 . 2]" 2
629 1 83 GLN QG 1 84 LEU H 3.150 . 4.500 4.106 2.842 4.535 0.035 4 0 "[ . 1 . 2]" 2
630 1 83 GLN HA 1 84 LEU H 2.650 . 3.500 3.179 2.882 3.431 . 0 0 "[ . 1 . 2]" 2
631 1 68 THR H 1 69 LYS H 3.150 . 4.500 2.729 2.570 2.853 . 0 0 "[ . 1 . 2]" 2
632 1 68 THR H 1 68 THR HB 3.150 . 4.500 2.691 2.594 2.782 . 0 0 "[ . 1 . 2]" 2
633 1 68 THR H 1 68 THR HA 2.650 . 3.500 2.777 2.746 2.811 . 0 0 "[ . 1 . 2]" 2
634 1 65 PRO HA 1 68 THR H 3.650 . 5.500 3.082 2.863 3.348 . 0 0 "[ . 1 . 2]" 2
635 1 67 LYS QG 1 68 THR H 3.650 . 5.500 4.103 3.796 4.792 . 0 0 "[ . 1 . 2]" 2
636 1 67 LYS HB2 1 68 THR H 3.150 . 4.500 2.981 2.740 3.367 . 0 0 "[ . 1 . 2]" 2
637 1 67 LYS HB3 1 68 THR H 3.150 . 4.500 3.988 3.632 4.147 . 0 0 "[ . 1 . 2]" 2
638 1 69 LYS H 1 70 ALA H 3.150 . 4.500 2.659 2.580 2.779 . 0 0 "[ . 1 . 2]" 2
639 1 68 THR HB 1 69 LYS H 3.650 . 5.500 2.292 2.141 2.501 . 0 0 "[ . 1 . 2]" 2
640 1 68 THR HA 1 69 LYS H 3.150 . 4.500 3.566 3.530 3.609 . 0 0 "[ . 1 . 2]" 2
641 1 69 LYS H 1 69 LYS QD 3.150 . 4.500 3.965 2.334 4.538 0.038 17 0 "[ . 1 . 2]" 2
642 1 69 LYS H 1 69 LYS QB 3.150 . 4.500 2.410 2.108 2.650 . 0 0 "[ . 1 . 2]" 2
643 1 69 LYS HA 1 70 ALA H 3.650 . 5.500 3.483 3.421 3.557 . 0 0 "[ . 1 . 2]" 2
644 1 70 ALA H 1 70 ALA HA 2.650 . 3.500 2.818 2.787 2.842 . 0 0 "[ . 1 . 2]" 2
645 1 70 ALA H 1 70 ALA MB 3.150 . 4.500 2.238 2.201 2.266 . 0 0 "[ . 1 . 2]" 2
646 1 69 LYS QB 1 70 ALA H 3.150 . 4.500 2.946 2.260 3.631 . 0 0 "[ . 1 . 2]" 2
647 1 72 GLU H 1 73 ASN H 3.150 . 4.500 2.777 2.618 2.901 . 0 0 "[ . 1 . 2]" 2
648 1 71 VAL HA 1 72 GLU H 3.650 . 5.500 3.543 3.516 3.568 . 0 0 "[ . 1 . 2]" 2
649 1 69 LYS HA 1 72 GLU H 3.650 . 5.500 3.603 3.302 4.094 . 0 0 "[ . 1 . 2]" 2
650 1 72 GLU H 1 72 GLU HB2 3.150 . 4.500 2.465 2.416 2.514 . 0 0 "[ . 1 . 2]" 2
651 1 72 GLU H 1 72 GLU HG2 3.150 . 4.500 3.511 3.365 3.641 . 0 0 "[ . 1 . 2]" 2
652 1 72 GLU H 1 72 GLU HG3 3.150 . 4.500 2.405 2.269 2.530 . 0 0 "[ . 1 . 2]" 2
653 1 72 GLU H 1 72 GLU HB3 3.150 . 4.500 3.626 3.593 3.643 . 0 0 "[ . 1 . 2]" 2
654 1 71 VAL MG1 1 72 GLU H 3.150 . 4.500 4.053 3.981 4.123 . 0 0 "[ . 1 . 2]" 2
655 1 45 LEU MD2 1 72 GLU H 3.650 . 5.500 5.131 4.233 5.491 . 0 0 "[ . 1 . 2]" 2
656 1 73 ASN H 1 74 TYR H 3.150 . 4.500 2.685 2.489 2.751 . 0 0 "[ . 1 . 2]" 2
657 1 71 VAL H 1 73 ASN H 3.150 . 4.500 4.287 4.041 4.464 . 0 0 "[ . 1 . 2]" 2
658 1 73 ASN H 1 73 ASN HB2 3.150 . 4.500 2.346 2.194 2.556 . 0 0 "[ . 1 . 2]" 2
659 1 73 ASN H 1 73 ASN HB3 3.150 . 4.500 2.529 2.281 2.724 . 0 0 "[ . 1 . 2]" 2
660 1 72 GLU HG2 1 73 ASN H 3.650 . 5.500 4.965 4.867 5.062 . 0 0 "[ . 1 . 2]" 2
661 1 70 ALA HA 1 73 ASN H 3.150 . 4.500 3.722 3.471 4.020 . 0 0 "[ . 1 . 2]" 2
662 1 69 LYS HA 1 73 ASN H 3.150 . 4.500 3.848 3.455 4.329 . 0 0 "[ . 1 . 2]" 2
663 1 72 GLU HA 1 73 ASN H 3.650 . 5.500 3.552 3.519 3.584 . 0 0 "[ . 1 . 2]" 2
664 1 72 GLU HG3 1 73 ASN H 3.150 . 4.500 4.384 4.278 4.523 0.023 7 0 "[ . 1 . 2]" 2
665 1 72 GLU HB2 1 73 ASN H 3.150 . 4.500 2.543 2.303 2.781 . 0 0 "[ . 1 . 2]" 2
666 1 72 GLU HB3 1 73 ASN H 3.150 . 4.500 3.452 3.182 3.716 . 0 0 "[ . 1 . 2]" 2
667 1 75 LEU H 1 75 LEU HB3 3.150 . 4.500 3.621 3.564 3.697 . 0 0 "[ . 1 . 2]" 2
668 1 75 LEU H 1 75 LEU HB2 3.150 . 4.500 2.412 2.303 2.547 . 0 0 "[ . 1 . 2]" 2
669 1 75 LEU H 1 75 LEU MD2 3.150 . 4.500 2.325 2.193 2.427 . 0 0 "[ . 1 . 2]" 2
670 1 75 LEU H 1 75 LEU MD1 3.650 . 5.500 3.759 3.416 3.928 . 0 0 "[ . 1 . 2]" 2
671 1 74 TYR HB3 1 75 LEU H 3.150 . 4.500 2.551 2.378 2.782 . 0 0 "[ . 1 . 2]" 2
672 1 74 TYR HB2 1 75 LEU H 3.150 . 4.500 3.836 3.730 4.029 . 0 0 "[ . 1 . 2]" 2
673 1 74 TYR HA 1 75 LEU H 3.650 . 5.500 3.565 3.534 3.588 . 0 0 "[ . 1 . 2]" 2
674 1 76 ILE H 1 77 GLN H 3.150 . 4.500 2.754 2.660 2.879 . 0 0 "[ . 1 . 2]" 2
675 1 76 ILE H 1 76 ILE MG 3.150 . 4.500 3.800 3.782 3.838 . 0 0 "[ . 1 . 2]" 2
676 1 76 ILE H 1 76 ILE QG 3.650 . 5.500 2.152 1.919 2.323 . 0 0 "[ . 1 . 2]" 2
677 1 76 ILE H 1 76 ILE HB 3.150 . 4.500 2.547 2.452 2.694 . 0 0 "[ . 1 . 2]" 2
678 1 75 LEU HB3 1 76 ILE H 3.150 . 4.500 3.500 3.310 3.663 . 0 0 "[ . 1 . 2]" 2
679 1 75 LEU HA 1 76 ILE H 3.650 . 5.500 3.511 3.483 3.540 . 0 0 "[ . 1 . 2]" 2
680 1 73 ASN HA 1 76 ILE H 3.650 . 5.500 3.664 3.412 4.029 . 0 0 "[ . 1 . 2]" 2
681 1 77 GLN H 1 78 MET H 3.150 . 4.500 2.622 2.492 2.765 . 0 0 "[ . 1 . 2]" 2
682 1 77 GLN H 1 77 GLN HA 2.650 . 3.500 2.833 2.797 2.865 . 0 0 "[ . 1 . 2]" 2
683 1 76 ILE HA 1 77 GLN H 3.150 . 4.500 3.528 3.496 3.584 . 0 0 "[ . 1 . 2]" 2
684 1 73 ASN HA 1 77 GLN H 3.650 . 5.500 4.325 4.067 4.769 . 0 0 "[ . 1 . 2]" 2
685 1 76 ILE MG 1 77 GLN H 3.150 . 4.500 3.255 3.020 3.461 . 0 0 "[ . 1 . 2]" 2
686 1 76 ILE HB 1 77 GLN H 2.650 . 3.500 2.488 2.222 2.669 . 0 0 "[ . 1 . 2]" 2
687 1 77 GLN H 1 77 GLN QB 2.650 . 3.500 2.398 2.078 2.819 . 0 0 "[ . 1 . 2]" 2
688 1 77 GLN H 1 77 GLN QG 3.150 . 4.500 2.713 1.990 4.032 . 0 0 "[ . 1 . 2]" 2
689 1 78 MET H 1 79 ALA H 3.150 . 4.500 2.721 2.583 2.793 . 0 0 "[ . 1 . 2]" 2
690 1 78 MET H 1 78 MET HA 2.650 . 3.500 2.800 2.768 2.828 . 0 0 "[ . 1 . 2]" 2
691 1 77 GLN HA 1 78 MET H 3.150 . 4.500 3.521 3.487 3.557 . 0 0 "[ . 1 . 2]" 2
692 1 74 TYR HA 1 78 MET H 3.650 . 5.500 3.999 3.700 4.227 . 0 0 "[ . 1 . 2]" 2
693 1 77 GLN QB 1 78 MET H 2.650 . 3.500 2.495 2.242 3.381 . 0 0 "[ . 1 . 2]" 2
694 1 78 MET H 1 78 MET HB2 2.650 . 3.500 2.412 2.255 2.568 . 0 0 "[ . 1 . 2]" 2
695 1 81 TYR H 1 81 TYR HB3 3.150 . 4.500 3.651 3.585 3.695 . 0 0 "[ . 1 . 2]" 2
696 1 81 TYR H 1 81 TYR HB2 3.150 . 4.500 2.495 2.324 2.604 . 0 0 "[ . 1 . 2]" 2
697 1 80 ARG HB2 1 81 TYR H 3.150 . 4.500 3.736 2.699 4.132 . 0 0 "[ . 1 . 2]" 2
698 1 80 ARG HB3 1 81 TYR H 3.150 . 4.500 3.001 2.477 3.961 . 0 0 "[ . 1 . 2]" 2
699 1 78 MET HA 1 81 TYR H 3.150 . 4.500 3.549 3.066 3.808 . 0 0 "[ . 1 . 2]" 2
700 1 80 ARG HA 1 81 TYR H 3.150 . 4.500 3.488 3.329 3.554 . 0 0 "[ . 1 . 2]" 2
701 1 79 ALA H 1 79 ALA MB 3.150 . 4.500 2.236 2.212 2.264 . 0 0 "[ . 1 . 2]" 2
702 1 88 VAL HB 1 89 SER H 3.150 . 4.500 4.181 3.979 4.305 . 0 0 "[ . 1 . 2]" 2
703 1 77 GLN H 1 79 ALA H 3.150 . 4.500 4.143 3.975 4.257 . 0 0 "[ . 1 . 2]" 2
704 1 79 ALA H 1 80 ARG H 2.650 . 3.500 2.575 2.470 2.732 . 0 0 "[ . 1 . 2]" 2
705 1 89 SER H 1 89 SER HB3 3.150 . 4.500 3.347 2.646 3.626 . 0 0 "[ . 1 . 2]" 2
706 1 76 ILE HA 1 79 ALA H 3.650 . 5.500 3.842 3.547 4.272 . 0 0 "[ . 1 . 2]" 2
707 1 78 MET HB2 1 79 ALA H 3.150 . 4.500 3.743 2.909 4.122 . 0 0 "[ . 1 . 2]" 2
708 1 88 VAL MG1 1 89 SER H 3.150 . 4.500 2.840 2.452 3.209 . 0 0 "[ . 1 . 2]" 2
709 1 89 SER H 1 91 GLN H 3.650 . 5.500 5.031 4.429 5.274 . 0 0 "[ . 1 . 2]" 2
710 1 79 ALA HA 1 82 GLY H 3.150 . 4.500 3.504 3.058 4.208 . 0 0 "[ . 1 . 2]" 2
711 1 81 TYR HA 1 82 GLY H 3.150 . 4.500 3.334 3.113 3.582 . 0 0 "[ . 1 . 2]" 2
712 1 81 TYR HB2 1 82 GLY H 3.650 . 5.500 3.358 2.688 3.953 . 0 0 "[ . 1 . 2]" 2
713 1 81 TYR HB3 1 82 GLY H 3.650 . 5.500 4.111 3.692 4.382 . 0 0 "[ . 1 . 2]" 2
714 1 87 LYS HA 1 88 VAL H 3.150 . 4.500 2.145 2.046 2.300 . 0 0 "[ . 1 . 2]" 2
715 1 88 VAL H 1 88 VAL HB 3.650 . 5.500 2.484 2.387 2.536 . 0 0 "[ . 1 . 2]" 2
716 1 88 VAL H 1 88 VAL MG1 3.650 . 5.500 3.698 2.483 3.796 . 0 0 "[ . 1 . 2]" 2
717 1 90 GLU H 1 90 GLU HG2 3.150 . 4.500 3.422 3.017 4.390 . 0 0 "[ . 1 . 2]" 2
718 1 90 GLU H 1 90 GLU HB3 3.150 . 4.500 3.526 2.550 3.631 . 0 0 "[ . 1 . 2]" 2
719 1 90 GLU H 1 90 GLU HB2 3.150 . 4.500 2.484 2.343 2.647 . 0 0 "[ . 1 . 2]" 2
720 1 89 SER HB2 1 90 GLU H 3.150 . 4.500 2.963 2.090 3.513 . 0 0 "[ . 1 . 2]" 2
721 1 89 SER HB3 1 90 GLU H 3.150 . 4.500 2.588 1.941 3.648 . 0 0 "[ . 1 . 2]" 2
722 1 89 SER HA 1 90 GLU H 3.150 . 4.500 2.637 2.459 2.782 . 0 0 "[ . 1 . 2]" 2
723 1 92 GLY H 1 93 LEU H 3.150 . 4.500 2.543 2.337 2.752 . 0 0 "[ . 1 . 2]" 2
724 1 91 GLN HA 1 92 GLY H 3.150 . 4.500 3.496 3.368 3.556 . 0 0 "[ . 1 . 2]" 2
725 1 92 GLY H 1 92 GLY QA 2.650 . 3.500 2.204 2.184 2.233 . 0 0 "[ . 1 . 2]" 2
726 1 91 GLN QB 1 92 GLY H 3.150 . 4.500 2.895 2.320 3.692 . 0 0 "[ . 1 . 2]" 2
727 1 90 GLU HA 1 93 LEU H 3.150 . 4.500 3.432 3.134 3.692 . 0 0 "[ . 1 . 2]" 2
728 1 92 GLY QA 1 93 LEU H 3.650 . 5.500 2.682 2.610 2.756 . 0 0 "[ . 1 . 2]" 2
729 1 93 LEU H 1 93 LEU HB3 2.650 . 3.500 2.503 2.443 2.577 . 0 0 "[ . 1 . 2]" 2
730 1 93 LEU H 1 93 LEU HB2 3.150 . 4.500 2.561 2.511 2.620 . 0 0 "[ . 1 . 2]" 2
731 1 93 LEU H 1 93 LEU HG 3.150 . 4.500 4.465 4.396 4.499 . 0 0 "[ . 1 . 2]" 2
732 1 93 LEU H 1 93 LEU MD2 3.150 . 4.500 4.273 4.231 4.335 . 0 0 "[ . 1 . 2]" 2
733 1 95 GLU H 1 96 ILE H 3.150 . 4.500 2.611 2.492 2.729 . 0 0 "[ . 1 . 2]" 2
734 1 95 GLU H 1 97 LEU H 3.650 . 5.500 3.933 3.850 4.116 . 0 0 "[ . 1 . 2]" 2
735 1 94 ILE HA 1 95 GLU H 3.650 . 5.500 3.499 3.459 3.560 . 0 0 "[ . 1 . 2]" 2
736 1 95 GLU H 1 95 GLU QG 3.150 . 4.500 3.207 2.038 4.045 . 0 0 "[ . 1 . 2]" 2
737 1 95 GLU H 1 95 GLU QB 2.650 . 3.500 2.324 2.051 2.540 . 0 0 "[ . 1 . 2]" 2
738 1 94 ILE HG13 1 95 GLU H 3.150 . 4.500 4.430 4.253 4.606 0.106 6 0 "[ . 1 . 2]" 2
739 1 95 GLU H 1 96 ILE HG13 3.650 . 5.500 4.571 4.152 5.526 0.026 19 0 "[ . 1 . 2]" 2
740 1 94 ILE MG 1 95 GLU H 3.650 . 5.500 3.503 3.253 3.607 . 0 0 "[ . 1 . 2]" 2
741 1 96 ILE H 1 97 LEU H 3.150 . 4.500 2.548 2.397 2.722 . 0 0 "[ . 1 . 2]" 2
742 1 93 LEU HA 1 96 ILE H 3.150 . 4.500 3.266 2.965 3.570 . 0 0 "[ . 1 . 2]" 2
743 1 96 ILE H 1 96 ILE MG 3.650 . 5.500 3.772 3.737 3.798 . 0 0 "[ . 1 . 2]" 2
744 1 96 ILE H 1 96 ILE MD 3.150 . 4.500 3.454 2.972 3.657 . 0 0 "[ . 1 . 2]" 2
745 1 96 ILE H 1 96 ILE HG12 3.150 . 4.500 3.164 1.961 3.670 . 0 0 "[ . 1 . 2]" 2
746 1 93 LEU HG 1 96 ILE H 3.900 . 6.000 5.066 4.543 5.570 . 0 0 "[ . 1 . 2]" 2
747 1 96 ILE H 1 96 ILE HG13 2.650 . 3.500 2.437 2.041 3.529 0.029 15 0 "[ . 1 . 2]" 2
748 1 96 ILE H 1 96 ILE HB 3.150 . 4.500 2.560 2.446 2.720 . 0 0 "[ . 1 . 2]" 2
749 1 95 GLU QB 1 96 ILE H 3.150 . 4.500 2.535 2.225 2.766 . 0 0 "[ . 1 . 2]" 2
750 1 97 LEU H 1 98 LYS H 3.150 . 4.500 2.752 2.659 2.891 . 0 0 "[ . 1 . 2]" 2
751 1 93 LEU HA 1 97 LEU H 3.150 . 4.500 4.046 3.901 4.270 . 0 0 "[ . 1 . 2]" 2
752 1 94 ILE HA 1 97 LEU H 3.650 . 5.500 3.157 2.982 3.322 . 0 0 "[ . 1 . 2]" 2
753 1 97 LEU H 1 97 LEU MD1 3.400 . 5.000 4.018 3.897 4.089 . 0 0 "[ . 1 . 2]" 2
754 1 71 VAL MG1 1 97 LEU H 3.900 . 6.000 3.419 3.185 3.642 . 0 0 "[ . 1 . 2]" 2
755 1 96 ILE HG12 1 97 LEU H 3.650 . 5.500 4.734 3.750 5.055 . 0 0 "[ . 1 . 2]" 2
756 1 96 ILE HB 1 97 LEU H 3.150 . 4.500 2.599 2.401 2.770 . 0 0 "[ . 1 . 2]" 2
757 1 97 LEU H 1 97 LEU HG 3.150 . 4.500 4.489 4.453 4.516 0.016 11 0 "[ . 1 . 2]" 2
758 1 97 LEU H 1 97 LEU QB 3.150 . 4.500 2.202 2.148 2.230 . 0 0 "[ . 1 . 2]" 2
759 1 97 LEU HA 1 98 LYS H 3.650 . 5.500 3.537 3.485 3.584 . 0 0 "[ . 1 . 2]" 2
760 1 95 GLU HA 1 98 LYS H 3.150 . 4.500 3.475 3.043 3.893 . 0 0 "[ . 1 . 2]" 2
761 1 98 LYS H 1 98 LYS QG 3.650 . 5.500 2.253 2.086 2.427 . 0 0 "[ . 1 . 2]" 2
762 1 98 LYS H 1 98 LYS QB 3.150 . 4.500 2.487 2.385 2.741 . 0 0 "[ . 1 . 2]" 2
763 1 97 LEU QB 1 98 LYS H 3.150 . 4.500 2.520 2.323 2.748 . 0 0 "[ . 1 . 2]" 2
764 1 97 LEU HG 1 98 LYS H 3.150 . 4.500 3.888 3.555 4.295 . 0 0 "[ . 1 . 2]" 2
765 1 100 VAL H 1 100 VAL HA 2.650 . 3.500 2.866 2.828 2.917 . 0 0 "[ . 1 . 2]" 2
766 1 97 LEU HA 1 100 VAL H 3.650 . 5.500 3.540 3.414 3.677 . 0 0 "[ . 1 . 2]" 2
767 1 99 LYS HA 1 100 VAL H 3.150 . 4.500 3.517 3.331 3.589 . 0 0 "[ . 1 . 2]" 2
768 1 100 VAL H 1 100 VAL MG1 3.150 . 4.500 2.359 2.091 3.806 . 0 0 "[ . 1 . 2]" 2
769 1 100 VAL H 1 100 VAL HB 3.400 . 5.000 3.665 2.881 3.793 . 0 0 "[ . 1 . 2]" 2
770 1 99 LYS QB 1 100 VAL H 3.150 . 4.500 2.782 2.185 3.821 . 0 0 "[ . 1 . 2]" 2
771 1 99 LYS HD3 1 100 VAL H 3.650 . 5.500 4.954 4.086 5.682 0.182 16 0 "[ . 1 . 2]" 2
772 1 101 SER H 1 103 GLN H 3.650 . 5.500 4.481 4.024 5.071 . 0 0 "[ . 1 . 2]" 2
773 1 99 LYS H 1 101 SER H 3.150 . 4.500 3.946 3.693 4.208 . 0 0 "[ . 1 . 2]" 2
774 1 101 SER H 1 101 SER HA 2.650 . 3.500 2.801 2.680 2.864 . 0 0 "[ . 1 . 2]" 2
775 1 99 LYS HA 1 101 SER H 3.650 . 5.500 4.118 3.594 4.418 . 0 0 "[ . 1 . 2]" 2
776 1 100 VAL MG1 1 101 SER H 3.150 . 4.500 4.091 3.938 4.219 . 0 0 "[ . 1 . 2]" 2
777 1 100 VAL HB 1 101 SER H 3.150 . 4.500 4.117 3.645 4.300 . 0 0 "[ . 1 . 2]" 2
778 1 102 GLN H 1 103 GLN H 3.150 . 3.500 2.563 2.159 2.954 . 0 0 "[ . 1 . 2]" 2
779 1 101 SER HB3 1 102 GLN H 3.150 . 4.500 3.526 2.434 4.340 . 0 0 "[ . 1 . 2]" 2
780 1 102 GLN H 1 102 GLN QB 2.650 . 3.500 2.446 2.144 2.954 . 0 0 "[ . 1 . 2]" 2
781 1 102 GLN H 1 102 GLN QG 3.150 . 4.500 2.947 2.137 4.042 . 0 0 "[ . 1 . 2]" 2
782 1 99 LYS HA 1 102 GLN H 3.650 . 5.500 3.828 3.149 4.986 . 0 0 "[ . 1 . 2]" 2
783 1 100 VAL HA 1 103 GLN H 3.150 . 4.500 3.684 3.110 4.518 0.018 2 0 "[ . 1 . 2]" 2
784 1 103 GLN H 1 103 GLN QB 2.650 . 3.500 2.821 2.442 3.428 . 0 0 "[ . 1 . 2]" 2
785 1 103 GLN H 1 103 GLN HG2 3.150 . 4.500 4.025 2.962 4.505 0.005 9 0 "[ . 1 . 2]" 2
786 1 103 GLN H 1 103 GLN HG3 3.150 . 4.500 3.250 2.618 4.642 0.142 9 0 "[ . 1 . 2]" 2
787 1 104 THR H 1 105 GLU H 2.650 . 3.500 2.575 1.799 3.555 0.055 7 0 "[ . 1 . 2]" 2
788 1 102 GLN H 1 104 THR H 3.650 . 5.500 4.942 3.552 5.571 0.071 12 0 "[ . 1 . 2]" 2
789 1 104 THR H 1 104 THR HB 2.650 . 3.500 3.150 2.722 3.625 0.125 9 0 "[ . 1 . 2]" 2
790 1 104 THR H 1 104 THR MG 3.650 . 5.500 3.838 2.092 4.031 . 0 0 "[ . 1 . 2]" 2
791 1 103 GLN HG3 1 104 THR H 3.150 . 4.500 4.230 3.884 4.555 0.055 13 0 "[ . 1 . 2]" 2
792 1 103 GLN QB 1 104 THR H 3.150 . 4.500 2.326 1.751 3.534 0.049 12 0 "[ . 1 . 2]" 2
793 1 105 GLU H 1 105 GLU QG 3.150 . 4.500 3.352 1.809 4.417 . 0 0 "[ . 1 . 2]" 2
794 1 105 GLU H 1 105 GLU HB2 3.150 . 4.500 3.443 2.598 4.153 . 0 0 "[ . 1 . 2]" 2
795 1 105 GLU H 1 105 GLU HB3 3.150 . 4.500 3.383 2.491 4.151 . 0 0 "[ . 1 . 2]" 2
796 1 112 PHE H 1 112 PHE HB3 3.150 . 4.500 3.255 2.571 3.669 . 0 0 "[ . 1 . 2]" 2
797 1 112 PHE H 1 112 PHE HB2 3.650 . 5.500 2.981 2.425 3.909 . 0 0 "[ . 1 . 2]" 2
798 1 105 GLU HB2 1 106 LYS H 3.150 . 4.500 3.691 2.107 4.516 0.016 20 0 "[ . 1 . 2]" 2
799 1 106 LYS H 1 106 LYS QB 3.150 . 4.500 2.789 2.202 3.523 . 0 0 "[ . 1 . 2]" 2
800 1 112 PHE HA 1 113 ASN H 3.150 . 4.500 2.775 2.010 3.556 . 0 0 "[ . 1 . 2]" 2
801 1 110 VAL HA 1 111 LYS H 2.650 . 3.500 2.663 1.999 3.524 0.024 2 0 "[ . 1 . 2]" 2
802 1 110 VAL HB 1 111 LYS H 3.650 . 5.500 3.658 2.107 4.445 . 0 0 "[ . 1 . 2]" 2
803 1 111 LYS H 1 111 LYS QB 3.650 . 5.500 2.605 2.233 3.463 . 0 0 "[ . 1 . 2]" 2
804 1 109 THR HB 1 110 VAL H 3.150 . 4.500 3.699 1.917 4.421 . 0 0 "[ . 1 . 2]" 2
805 1 110 VAL H 1 110 VAL HB 3.150 . 4.500 3.293 2.549 3.996 . 0 0 "[ . 1 . 2]" 2
806 1 109 THR H 1 109 THR HB 2.650 . 3.500 2.934 2.510 3.616 0.116 15 0 "[ . 1 . 2]" 2
807 1 106 LYS H 1 107 THR H 3.150 . 4.500 3.332 1.738 4.281 0.062 17 0 "[ . 1 . 2]" 2
808 1 107 THR H 1 107 THR HB 3.150 . 4.500 3.063 2.498 3.692 . 0 0 "[ . 1 . 2]" 2
809 1 64 LYS H 1 65 PRO HD3 3.650 . 5.500 3.494 3.062 4.076 . 0 0 "[ . 1 . 2]" 2
810 1 48 VAL HB 1 49 LEU H 3.650 . 5.500 3.316 2.576 4.206 . 0 0 "[ . 1 . 2]" 2
811 1 48 VAL HA 1 49 LEU H 3.650 . 5.500 3.480 3.312 3.548 . 0 0 "[ . 1 . 2]" 2
812 1 41 ARG QB 1 43 SER H 3.650 . 5.500 4.693 4.444 4.907 . 0 0 "[ . 1 . 2]" 2
813 1 73 ASN H 1 73 ASN HD21 3.150 . 4.500 4.292 4.169 4.416 . 0 0 "[ . 1 . 2]" 2
814 1 57 LEU HB2 1 58 SER H 3.150 . 4.500 3.779 2.744 4.149 . 0 0 "[ . 1 . 2]" 2
815 1 59 ASN HB3 1 59 ASN HD21 3.150 . 4.500 2.973 2.205 3.556 . 0 0 "[ . 1 . 2]" 2
816 1 70 ALA HA 1 73 ASN HD21 3.650 . 5.500 5.010 3.552 5.580 0.080 15 0 "[ . 1 . 2]" 2
817 1 21 LYS HA 1 22 HIS H 2.900 . 4.000 2.489 2.030 3.571 . 0 0 "[ . 1 . 2]" 2
818 1 75 LEU H 1 75 LEU HG 3.150 . 4.500 4.158 4.095 4.265 . 0 0 "[ . 1 . 2]" 2
819 1 75 LEU HB3 1 79 ALA H 3.150 . 4.500 4.488 4.334 4.569 0.069 16 0 "[ . 1 . 2]" 2
820 1 20 ALA H 1 20 ALA HA 2.650 . 3.500 2.698 2.174 2.965 . 0 0 "[ . 1 . 2]" 2
821 1 33 ALA HA 1 36 ARG H 2.650 . 3.500 3.439 3.106 3.551 0.051 11 0 "[ . 1 . 2]" 2
822 1 64 LYS HB2 1 67 LYS H 2.650 . 3.500 3.480 3.191 3.555 0.055 5 0 "[ . 1 . 2]" 2
823 1 83 GLN QB 1 84 LEU H 3.150 . 4.500 3.516 2.878 3.991 . 0 0 "[ . 1 . 2]" 2
824 1 37 GLU H 1 37 GLU HA 2.650 . 3.500 2.801 2.745 2.833 . 0 0 "[ . 1 . 2]" 2
825 1 32 GLU HA 1 35 HIS H 2.650 . 3.500 3.313 2.755 3.569 0.069 13 0 "[ . 1 . 2]" 2
826 1 50 ASP H 1 87 LYS QG 3.150 . 4.500 4.242 3.628 4.564 0.064 10 0 "[ . 1 . 2]" 2
827 1 4 ASP H 1 4 ASP HA 2.650 . 3.500 2.837 2.783 2.889 . 0 0 "[ . 1 . 2]" 2
828 1 5 GLU H 1 5 GLU QB 2.650 . 3.500 2.286 2.098 2.723 . 0 0 "[ . 1 . 2]" 2
829 1 6 GLU H 1 6 GLU HA 2.300 . 2.800 2.810 2.778 2.834 0.034 11 0 "[ . 1 . 2]" 2
830 1 7 LEU H 1 8 GLU H 2.650 . 3.500 2.655 2.472 2.857 . 0 0 "[ . 1 . 2]" 2
831 1 7 LEU H 1 7 LEU HA 2.300 . 2.800 2.808 2.763 2.845 0.045 16 0 "[ . 1 . 2]" 2
832 1 7 LEU H 1 7 LEU HB2 2.300 . 2.800 2.465 2.339 2.627 . 0 0 "[ . 1 . 2]" 2
833 1 7 LEU H 1 7 LEU HB3 2.300 . 2.800 2.520 2.387 2.616 . 0 0 "[ . 1 . 2]" 2
834 1 8 GLU H 1 9 ALA H 2.300 . 2.800 2.640 2.428 2.809 0.009 12 0 "[ . 1 . 2]" 2
835 1 8 GLU H 1 8 GLU HA 2.300 . 2.800 2.804 2.775 2.841 0.041 3 0 "[ . 1 . 2]" 2
836 1 8 GLU H 1 8 GLU QB 2.300 . 2.800 2.326 2.067 2.793 . 0 0 "[ . 1 . 2]" 2
837 1 7 LEU HB3 1 8 GLU H 2.650 . 3.500 2.502 2.289 2.767 . 0 0 "[ . 1 . 2]" 2
838 1 9 ALA H 1 10 LEU H 2.650 . 3.500 2.741 2.618 2.915 . 0 0 "[ . 1 . 2]" 2
839 1 9 ALA H 1 9 ALA HA 2.650 . 3.500 2.797 2.760 2.826 . 0 0 "[ . 1 . 2]" 2
840 1 10 LEU H 1 11 ARG H 2.300 . 2.800 2.656 2.470 2.783 . 0 0 "[ . 1 . 2]" 2
841 1 10 LEU H 1 10 LEU HA 2.300 . 2.800 2.803 2.771 2.842 0.042 19 0 "[ . 1 . 2]" 2
842 1 10 LEU H 1 10 LEU HB2 2.650 . 3.500 2.422 2.198 2.520 . 0 0 "[ . 1 . 2]" 2
843 1 10 LEU H 1 10 LEU HB3 2.650 . 3.500 2.739 2.440 3.550 0.050 1 0 "[ . 1 . 2]" 2
844 1 11 ARG H 1 11 ARG HA 2.300 . 2.800 2.803 2.769 2.829 0.029 1 0 "[ . 1 . 2]" 2
845 1 11 ARG H 1 11 ARG HB2 2.300 . 2.800 2.509 2.329 2.653 . 0 0 "[ . 1 . 2]" 2
846 1 12 ARG H 1 13 GLN H 2.650 . 3.500 2.650 2.394 2.784 . 0 0 "[ . 1 . 2]" 2
847 1 12 ARG H 1 12 ARG HA 2.650 . 3.500 2.823 2.770 2.880 . 0 0 "[ . 1 . 2]" 2
848 1 12 ARG H 1 12 ARG HB2 2.300 . 2.800 2.403 2.132 2.593 . 0 0 "[ . 1 . 2]" 2
849 1 11 ARG H 1 12 ARG H 2.300 . 2.800 2.687 2.507 2.802 0.002 15 0 "[ . 1 . 2]" 2
850 1 13 GLN H 1 13 GLN HA 2.300 . 2.800 2.804 2.766 2.842 0.042 2 0 "[ . 1 . 2]" 2
851 1 13 GLN H 1 13 GLN QB 2.650 . 3.500 2.234 2.169 2.299 . 0 0 "[ . 1 . 2]" 2
852 1 14 ARG H 1 14 ARG QB 2.650 . 3.500 2.287 2.143 2.564 . 0 0 "[ . 1 . 2]" 2
853 1 14 ARG H 1 14 ARG HA 2.300 . 2.800 2.804 2.757 2.836 0.036 11 0 "[ . 1 . 2]" 2
854 1 15 LEU H 1 16 ALA H 2.300 . 2.800 2.620 2.417 2.816 0.016 19 0 "[ . 1 . 2]" 2
855 1 15 LEU H 1 15 LEU HA 2.650 . 3.500 2.800 2.747 2.849 . 0 0 "[ . 1 . 2]" 2
856 1 15 LEU H 1 15 LEU HB2 2.650 . 3.500 2.324 1.972 2.564 . 0 0 "[ . 1 . 2]" 2
857 1 15 LEU H 1 15 LEU HB3 2.550 . 3.300 2.725 2.391 3.425 0.125 5 0 "[ . 1 . 2]" 2
858 1 94 ILE H 1 94 ILE HB 2.650 . 3.500 2.497 2.386 2.794 . 0 0 "[ . 1 . 2]" 2
859 1 16 ALA H 1 17 GLU H 2.300 . 2.800 2.535 2.400 2.683 . 0 0 "[ . 1 . 2]" 2
860 1 16 ALA H 1 16 ALA HA 2.300 . 2.800 2.824 2.805 2.850 0.050 19 0 "[ . 1 . 2]" 2
861 1 17 GLU H 1 18 LEU H 2.300 . 2.800 2.533 2.268 2.817 0.017 10 0 "[ . 1 . 2]" 2
862 1 17 GLU H 1 17 GLU HA 2.300 . 2.800 2.819 2.748 2.858 0.058 6 0 "[ . 1 . 2]" 2
863 1 17 GLU H 1 17 GLU HG2 2.650 . 3.500 2.433 2.014 3.171 . 0 0 "[ . 1 . 2]" 2
864 1 17 GLU H 1 17 GLU QB 2.650 . 3.500 2.455 2.294 2.609 . 0 0 "[ . 1 . 2]" 2
865 1 18 LEU H 1 19 GLN H 2.300 . 2.800 2.535 2.193 2.747 . 0 0 "[ . 1 . 2]" 2
866 1 18 LEU H 1 18 LEU HA 2.300 . 2.800 2.824 2.796 2.859 0.059 13 0 "[ . 1 . 2]" 2
867 1 18 LEU H 1 18 LEU HB3 2.300 . 2.800 2.579 2.401 2.781 . 0 0 "[ . 1 . 2]" 2
868 1 19 GLN H 1 20 ALA H 2.650 . 3.500 2.762 1.725 3.545 0.075 13 0 "[ . 1 . 2]" 2
869 1 19 GLN HA 1 20 ALA H 2.650 . 3.500 2.989 2.111 3.502 0.002 6 0 "[ . 1 . 2]" 2
870 1 20 ALA HA 1 21 LYS H 2.550 . 3.300 2.376 2.020 3.290 . 0 0 "[ . 1 . 2]" 2
871 1 21 LYS H 1 21 LYS HB3 2.650 . 3.500 2.994 2.459 3.635 0.135 12 0 "[ . 1 . 2]" 2
872 1 26 GLY H 1 26 GLY QA 2.650 . 3.500 2.241 2.154 2.400 . 0 0 "[ . 1 . 2]" 2
873 1 26 GLY QA 1 27 ASP H 2.650 . 3.500 2.355 2.038 2.850 . 0 0 "[ . 1 . 2]" 2
874 1 29 ALA H 1 30 GLN H 2.650 . 3.500 2.621 2.323 2.954 . 0 0 "[ . 1 . 2]" 2
875 1 28 ALA H 1 29 ALA H 2.300 . 2.800 2.639 2.367 2.801 0.001 20 0 "[ . 1 . 2]" 2
876 1 29 ALA H 1 29 ALA HA 2.300 . 2.800 2.813 2.742 2.858 0.058 10 0 "[ . 1 . 2]" 2
877 1 29 ALA H 1 29 ALA MB 2.650 . 3.500 2.243 2.200 2.292 . 0 0 "[ . 1 . 2]" 2
878 1 30 GLN H 1 31 GLN H 2.300 . 2.800 2.557 2.291 2.802 0.002 8 0 "[ . 1 . 2]" 2
879 1 30 GLN H 1 30 GLN HA 2.300 . 2.800 2.822 2.782 2.858 0.058 15 0 "[ . 1 . 2]" 2
880 1 30 GLN H 1 30 GLN QB 2.650 . 3.500 2.518 2.412 2.814 . 0 0 "[ . 1 . 2]" 2
881 1 80 ARG H 1 80 ARG HA 2.650 . 3.500 2.814 2.771 2.848 . 0 0 "[ . 1 . 2]" 2
882 1 31 GLN H 1 31 GLN QB 2.650 . 3.500 2.314 2.197 2.501 . 0 0 "[ . 1 . 2]" 2
883 1 35 HIS H 1 35 HIS HB3 2.650 . 3.500 2.567 2.414 2.782 . 0 0 "[ . 1 . 2]" 2
884 1 32 GLU H 1 32 GLU HA 2.650 . 3.500 2.818 2.777 2.864 . 0 0 "[ . 1 . 2]" 2
885 1 32 GLU H 1 32 GLU QB 2.650 . 3.500 2.337 2.199 2.600 . 0 0 "[ . 1 . 2]" 2
886 1 33 ALA H 1 33 ALA HA 2.300 . 2.800 2.803 2.762 2.858 0.058 11 0 "[ . 1 . 2]" 2
887 1 39 GLU H 1 39 GLU HA 2.650 . 2.800 2.789 2.754 2.846 0.046 19 0 "[ . 1 . 2]" 2
888 1 86 GLU HA 1 87 LYS H 2.300 . 2.800 2.513 2.330 2.891 0.091 8 0 "[ . 1 . 2]" 2
889 1 36 ARG H 1 36 ARG QB 2.650 . 3.500 2.382 2.180 2.617 . 0 0 "[ . 1 . 2]" 2
890 1 87 LYS H 1 87 LYS QG 2.650 . 3.500 2.694 2.125 3.576 0.076 15 0 "[ . 1 . 2]" 2
891 1 86 GLU HB2 1 87 LYS H 2.650 . 3.500 3.433 2.896 3.645 0.145 17 0 "[ . 1 . 2]" 2
892 1 38 ALA H 1 38 ALA HA 2.300 . 2.800 2.810 2.732 2.859 0.059 3 0 "[ . 1 . 2]" 2
893 1 39 GLU H 1 39 GLU QB 2.650 . 3.500 2.362 2.056 2.559 . 0 0 "[ . 1 . 2]" 2
894 1 39 GLU HA 1 40 MET H 2.650 . 3.500 3.524 3.496 3.559 0.059 15 0 "[ . 1 . 2]" 2
895 1 42 ASN H 1 42 ASN HA 2.300 . 2.800 2.796 2.758 2.822 0.022 6 0 "[ . 1 . 2]" 2
896 1 42 ASN H 1 42 ASN HB2 2.650 . 3.500 2.482 2.226 2.687 . 0 0 "[ . 1 . 2]" 2
897 1 108 THR H 1 108 THR HB 2.650 . 3.500 2.793 2.498 3.577 0.077 5 0 "[ . 1 . 2]" 2
898 1 43 SER H 1 43 SER HA 2.650 . 3.500 2.777 2.740 2.827 . 0 0 "[ . 1 . 2]" 2
899 1 43 SER H 1 43 SER HB3 2.650 . 3.500 3.282 2.633 3.559 0.059 4 0 "[ . 1 . 2]" 2
900 1 74 TYR H 1 74 TYR HA 2.650 . 3.500 2.806 2.767 2.857 . 0 0 "[ . 1 . 2]" 2
901 1 51 GLN H 1 51 GLN HB3 2.650 . 3.500 2.779 2.502 3.550 0.050 18 0 "[ . 1 . 2]" 2
902 1 52 SER H 1 52 SER HB2 2.650 . 3.500 2.943 2.472 3.545 0.045 6 0 "[ . 1 . 2]" 2
903 1 91 GLN H 1 91 GLN HA 2.650 . 3.500 2.799 2.772 2.834 . 0 0 "[ . 1 . 2]" 2
904 1 84 LEU HA 1 85 SER H 2.650 . 3.500 2.128 1.970 2.327 . 0 0 "[ . 1 . 2]" 2
905 1 58 SER H 1 58 SER HA 2.650 . 3.500 2.801 2.774 2.826 . 0 0 "[ . 1 . 2]" 2
906 1 58 SER H 1 58 SER HB3 2.650 . 3.500 3.084 2.469 3.544 0.044 6 0 "[ . 1 . 2]" 2
907 1 58 SER HB3 1 59 ASN H 2.650 . 3.500 3.203 2.533 3.585 0.085 10 0 "[ . 1 . 2]" 2
908 1 86 GLU H 1 86 GLU HA 2.650 . 3.500 2.822 2.219 2.939 . 0 0 "[ . 1 . 2]" 2
909 1 61 ALA H 1 61 ALA HA 2.650 . 3.500 2.809 2.773 2.844 . 0 0 "[ . 1 . 2]" 2
910 1 88 VAL HA 1 89 SER H 2.300 . 2.800 2.151 2.066 2.256 . 0 0 "[ . 1 . 2]" 2
911 1 82 GLY H 1 82 GLY QA 2.650 . 3.500 2.209 2.184 2.241 . 0 0 "[ . 1 . 2]" 2
912 1 101 SER H 1 101 SER HB3 2.650 . 3.500 3.161 2.410 3.585 0.085 2 0 "[ . 1 . 2]" 2
913 1 101 SER H 1 101 SER HB2 2.650 . 3.500 2.574 2.389 3.553 0.053 3 0 "[ . 1 . 2]" 2
914 1 102 GLN H 1 102 GLN HA 2.650 . 3.500 2.889 2.825 2.937 . 0 0 "[ . 1 . 2]" 2
915 1 103 GLN H 1 103 GLN HA 2.650 . 3.500 2.881 2.699 2.965 . 0 0 "[ . 1 . 2]" 2
916 1 102 GLN HA 1 103 GLN H 2.650 . 3.500 3.528 3.502 3.559 0.059 9 0 "[ . 1 . 2]" 2
917 1 104 THR H 1 104 THR HA 2.650 . 3.500 2.740 2.179 2.915 . 0 0 "[ . 1 . 2]" 2
918 1 104 THR HA 1 105 GLU H 2.650 . 3.500 3.195 2.049 3.560 0.060 13 0 "[ . 1 . 2]" 2
919 1 105 GLU HA 1 106 LYS H 2.550 . 3.300 2.447 1.972 3.409 0.109 9 0 "[ . 1 . 2]" 2
920 1 109 THR HA 1 110 VAL H 2.650 . 3.500 2.509 2.131 3.567 0.067 13 0 "[ . 1 . 2]" 2
921 1 108 THR HA 1 109 THR H 2.650 . 3.500 2.525 2.061 3.514 0.014 19 0 "[ . 1 . 2]" 2
922 1 107 THR H 1 107 THR HA 2.650 . 3.500 2.818 2.152 2.908 . 0 0 "[ . 1 . 2]" 2
923 1 103 GLN HA 1 104 THR H 2.650 . 3.500 3.123 1.984 3.540 0.040 9 0 "[ . 1 . 2]" 2
924 1 21 LYS H 1 21 LYS HA 2.900 . 4.000 2.831 2.200 2.920 . 0 0 "[ . 1 . 2]" 2
925 1 56 ARG HA 1 57 LEU H 2.650 . 3.500 3.512 3.496 3.566 0.066 16 0 "[ . 1 . 2]" 2
926 1 34 LYS H 1 34 LYS HA 2.650 . 3.500 2.826 2.786 2.881 . 0 0 "[ . 1 . 2]" 2
927 1 105 GLU H 1 105 GLU HA 2.650 . 3.500 2.781 2.314 2.918 . 0 0 "[ . 1 . 2]" 2
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