NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
386191 |
1l6n   |
5316 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1l6n
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 949
_Distance_constraint_stats_list.Viol_count 1597
_Distance_constraint_stats_list.Viol_total 1733.485
_Distance_constraint_stats_list.Viol_max 1.845
_Distance_constraint_stats_list.Viol_rms 0.0515
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0046
_Distance_constraint_stats_list.Viol_average_violations_only 0.0543
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 6 SER 0.048 0.008 9 0 "[ . 1 . 2]"
1 7 VAL 0.193 0.011 9 0 "[ . 1 . 2]"
1 8 LEU 0.113 0.024 9 0 "[ . 1 . 2]"
1 9 SER 1.927 0.071 18 0 "[ . 1 . 2]"
1 10 GLY 1.011 0.064 18 0 "[ . 1 . 2]"
1 11 GLY 0.390 0.037 15 0 "[ . 1 . 2]"
1 12 GLU 1.164 0.093 15 0 "[ . 1 . 2]"
1 13 LEU 1.870 0.075 4 0 "[ . 1 . 2]"
1 14 ASP 1.481 0.064 18 0 "[ . 1 . 2]"
1 15 LYS 0.271 0.037 15 0 "[ . 1 . 2]"
1 16 TRP 1.153 0.064 18 0 "[ . 1 . 2]"
1 17 GLU 0.825 0.075 4 0 "[ . 1 . 2]"
1 18 LYS 0.651 0.059 7 0 "[ . 1 . 2]"
1 19 ILE 0.852 0.080 19 0 "[ . 1 . 2]"
1 20 ARG 0.883 0.065 19 0 "[ . 1 . 2]"
1 21 LEU 0.470 0.107 14 0 "[ . 1 . 2]"
1 22 ARG 0.507 0.093 11 0 "[ . 1 . 2]"
1 23 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 GLY 2.273 0.144 16 0 "[ . 1 . 2]"
1 25 GLY 2.835 0.144 16 0 "[ . 1 . 2]"
1 26 LYS 0.054 0.031 11 0 "[ . 1 . 2]"
1 27 LYS 1.065 0.113 14 0 "[ . 1 . 2]"
1 28 GLN 0.346 0.071 19 0 "[ . 1 . 2]"
1 29 TYR 0.695 0.080 19 0 "[ . 1 . 2]"
1 30 LYS 0.174 0.050 15 0 "[ . 1 . 2]"
1 31 LEU 0.041 0.019 1 0 "[ . 1 . 2]"
1 32 LYS 0.203 0.039 14 0 "[ . 1 . 2]"
1 33 HIS 0.007 0.007 1 0 "[ . 1 . 2]"
1 34 ILE 1.098 0.064 18 0 "[ . 1 . 2]"
1 35 VAL 0.206 0.039 14 0 "[ . 1 . 2]"
1 36 TRP 0.013 0.008 19 0 "[ . 1 . 2]"
1 37 ALA 0.070 0.025 19 0 "[ . 1 . 2]"
1 38 SER 0.161 0.013 20 0 "[ . 1 . 2]"
1 39 ARG 0.105 0.010 18 0 "[ . 1 . 2]"
1 40 GLU 0.004 0.004 18 0 "[ . 1 . 2]"
1 41 LEU 0.063 0.025 19 0 "[ . 1 . 2]"
1 42 GLU 0.043 0.013 10 0 "[ . 1 . 2]"
1 43 ARG 0.085 0.010 18 0 "[ . 1 . 2]"
1 44 PHE 0.004 0.004 18 0 "[ . 1 . 2]"
1 45 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 47 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 PRO 2.499 0.099 13 0 "[ . 1 . 2]"
1 49 GLY 2.400 0.099 13 0 "[ . 1 . 2]"
1 50 LEU 0.146 0.016 11 0 "[ . 1 . 2]"
1 51 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 GLU 4.011 0.193 3 0 "[ . 1 . 2]"
1 53 THR 4.009 0.193 3 0 "[ . 1 . 2]"
1 54 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 GLU 0.176 0.022 13 0 "[ . 1 . 2]"
1 56 GLY 0.061 0.026 13 0 "[ . 1 . 2]"
1 57 CYS 0.007 0.004 9 0 "[ . 1 . 2]"
1 58 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 GLN 0.043 0.022 13 0 "[ . 1 . 2]"
1 60 ILE 0.974 0.046 14 0 "[ . 1 . 2]"
1 61 LEU 0.894 0.037 14 0 "[ . 1 . 2]"
1 62 GLY 0.102 0.024 11 0 "[ . 1 . 2]"
1 63 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 LEU 0.776 0.046 14 0 "[ . 1 . 2]"
1 65 GLN 2.652 0.110 4 0 "[ . 1 . 2]"
1 66 PRO 0.997 0.073 15 0 "[ . 1 . 2]"
1 67 SER 3.043 0.124 11 0 "[ . 1 . 2]"
1 68 LEU 4.933 0.134 11 0 "[ . 1 . 2]"
1 69 GLN 2.396 0.073 18 0 "[ . 1 . 2]"
1 70 THR 4.653 0.163 8 0 "[ . 1 . 2]"
1 71 GLY 5.007 0.213 13 0 "[ . 1 . 2]"
1 72 SER 10.092 0.213 13 0 "[ . 1 . 2]"
1 73 GLU 2.399 0.110 8 0 "[ . 1 . 2]"
1 74 GLU 0.550 0.070 11 0 "[ . 1 . 2]"
1 75 LEU 2.093 0.140 13 0 "[ . 1 . 2]"
1 76 ARG 0.337 0.085 10 0 "[ . 1 . 2]"
1 77 SER 2.336 0.110 8 0 "[ . 1 . 2]"
1 78 LEU 0.586 0.070 11 0 "[ . 1 . 2]"
1 79 TYR 0.802 0.075 11 0 "[ . 1 . 2]"
1 80 ASN 0.890 0.092 3 0 "[ . 1 . 2]"
1 81 THR 0.108 0.037 9 0 "[ . 1 . 2]"
1 82 ILE 0.219 0.052 20 0 "[ . 1 . 2]"
1 83 ALA 1.147 0.052 20 0 "[ . 1 . 2]"
1 84 VAL 0.318 0.051 16 0 "[ . 1 . 2]"
1 85 LEU 0.130 0.029 5 0 "[ . 1 . 2]"
1 86 TYR 0.469 0.053 20 0 "[ . 1 . 2]"
1 87 CYS 0.451 0.055 20 0 "[ . 1 . 2]"
1 88 VAL 0.072 0.051 16 0 "[ . 1 . 2]"
1 89 HIS 0.018 0.010 6 0 "[ . 1 . 2]"
1 90 GLN 0.226 0.053 20 0 "[ . 1 . 2]"
1 91 ARG 0.064 0.031 17 0 "[ . 1 . 2]"
1 92 ILE 0.401 0.132 16 0 "[ . 1 . 2]"
1 93 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 VAL 0.126 0.057 3 0 "[ . 1 . 2]"
1 95 LYS 0.248 0.057 3 0 "[ . 1 . 2]"
1 96 ASP 35.368 1.845 2 14 "[*+**** * * * **- **]"
1 97 THR 0.776 0.065 19 0 "[ . 1 . 2]"
1 98 LYS 0.528 0.073 15 0 "[ . 1 . 2]"
1 99 GLU 35.475 1.845 2 14 "[*+**** * * * **- **]"
1 100 ALA 0.175 0.036 20 0 "[ . 1 . 2]"
1 101 LEU 0.593 0.063 15 0 "[ . 1 . 2]"
1 102 ASP 0.263 0.055 20 0 "[ . 1 . 2]"
1 103 LYS 0.660 0.041 16 0 "[ . 1 . 2]"
1 104 ILE 0.535 0.063 15 0 "[ . 1 . 2]"
1 105 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 106 GLU 0.070 0.024 19 0 "[ . 1 . 2]"
1 107 GLU 0.027 0.006 19 0 "[ . 1 . 2]"
1 108 GLN 0.032 0.004 8 0 "[ . 1 . 2]"
1 109 ASN 0.022 0.015 1 0 "[ . 1 . 2]"
1 110 LYS 0.017 0.013 1 0 "[ . 1 . 2]"
1 111 SER 0.304 0.026 1 0 "[ . 1 . 2]"
1 112 LYS 0.418 0.026 1 0 "[ . 1 . 2]"
1 113 LYS 0.355 0.018 13 0 "[ . 1 . 2]"
1 114 LYS 0.320 0.018 13 0 "[ . 1 . 2]"
1 115 ALA 0.268 0.039 18 0 "[ . 1 . 2]"
1 116 GLN 0.431 0.039 18 0 "[ . 1 . 2]"
1 117 GLN 0.693 0.062 11 0 "[ . 1 . 2]"
1 118 ALA 1.161 0.365 11 0 "[ . 1 . 2]"
1 119 ALA 0.745 0.193 11 0 "[ . 1 . 2]"
1 120 ALA 0.107 0.052 4 0 "[ . 1 . 2]"
1 121 ASP 0.313 0.062 11 0 "[ . 1 . 2]"
1 122 THR 1.669 0.365 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 10 GLY H 1 11 GLY H . . 2.900 2.892 2.866 2.908 0.008 7 0 "[ . 1 . 2]" 1
2 1 11 GLY H 1 12 GLU H . . 2.900 2.485 2.451 2.509 . 0 0 "[ . 1 . 2]" 1
3 1 12 GLU H 1 13 LEU H . . 2.900 2.715 2.666 2.738 . 0 0 "[ . 1 . 2]" 1
4 1 13 LEU H 1 14 ASP H . . 2.900 2.569 2.467 2.636 . 0 0 "[ . 1 . 2]" 1
5 1 14 ASP H 1 15 LYS H . . 2.900 2.687 2.591 2.720 . 0 0 "[ . 1 . 2]" 1
6 1 15 LYS H 1 16 TRP H . . 2.900 2.486 2.408 2.569 . 0 0 "[ . 1 . 2]" 1
7 1 16 TRP H 1 17 GLU H . . 2.900 2.839 2.657 2.928 0.028 12 0 "[ . 1 . 2]" 1
8 1 17 GLU H 1 18 LYS H . . 2.900 2.678 2.504 2.824 . 0 0 "[ . 1 . 2]" 1
9 1 18 LYS H 1 19 ILE H . . 3.300 3.039 2.447 3.315 0.015 15 0 "[ . 1 . 2]" 1
10 1 10 GLY H 1 12 GLU H . . 5.000 3.953 3.935 3.974 . 0 0 "[ . 1 . 2]" 1
11 1 11 GLY H 1 13 LEU H . . 5.000 4.017 3.952 4.079 . 0 0 "[ . 1 . 2]" 1
12 1 12 GLU H 1 14 ASP H . . 5.000 4.117 3.987 4.186 . 0 0 "[ . 1 . 2]" 1
13 1 13 LEU H 1 15 LYS H . . 5.000 3.950 3.918 3.993 . 0 0 "[ . 1 . 2]" 1
14 1 14 ASP H 1 16 TRP H . . 5.000 4.222 4.146 4.268 . 0 0 "[ . 1 . 2]" 1
15 1 15 LYS H 1 17 GLU H . . 5.000 4.190 3.775 4.436 . 0 0 "[ . 1 . 2]" 1
16 1 16 TRP H 1 18 LYS H . . 5.000 3.744 3.646 3.872 . 0 0 "[ . 1 . 2]" 1
17 1 17 GLU H 1 19 ILE H . . 5.000 4.651 3.994 4.988 . 0 0 "[ . 1 . 2]" 1
18 1 9 SER H 1 12 GLU H . . 5.000 3.783 3.672 3.830 . 0 0 "[ . 1 . 2]" 1
19 1 13 LEU H 1 16 TRP H . . 5.000 4.633 4.561 4.731 . 0 0 "[ . 1 . 2]" 1
20 1 14 ASP H 1 17 GLU H . . 5.000 4.837 4.640 4.951 . 0 0 "[ . 1 . 2]" 1
21 1 9 SER H 1 13 LEU H . . 5.000 3.293 3.172 3.463 . 0 0 "[ . 1 . 2]" 1
22 1 9 SER HA 1 10 GLY H . . 2.700 2.693 2.689 2.697 . 0 0 "[ . 1 . 2]" 1
23 1 10 GLY HA3 1 11 GLY H . . 2.700 2.679 2.672 2.684 . 0 0 "[ . 1 . 2]" 1
24 1 11 GLY QA 1 12 GLU H . . 4.100 2.784 2.775 2.796 . 0 0 "[ . 1 . 2]" 1
25 1 12 GLU HA 1 13 LEU H . . 3.600 3.592 3.571 3.606 0.006 8 0 "[ . 1 . 2]" 1
26 1 14 ASP HA 1 15 LYS H . . 3.600 3.574 3.568 3.596 . 0 0 "[ . 1 . 2]" 1
27 1 15 LYS HA 1 16 TRP H . . 3.600 3.610 3.601 3.614 0.014 15 0 "[ . 1 . 2]" 1
28 1 16 TRP HA 1 17 GLU H . . 5.000 3.637 3.595 3.647 . 0 0 "[ . 1 . 2]" 1
29 1 17 GLU HA 1 18 LYS H . . 3.600 3.507 3.433 3.581 . 0 0 "[ . 1 . 2]" 1
30 1 18 LYS HA 1 19 ILE H . . 3.600 3.032 2.714 3.635 0.035 12 0 "[ . 1 . 2]" 1
31 1 9 SER HA 1 11 GLY H . . 5.000 5.015 5.006 5.026 0.026 6 0 "[ . 1 . 2]" 1
32 1 10 GLY HA3 1 12 GLU H . . 5.000 4.637 4.612 4.659 . 0 0 "[ . 1 . 2]" 1
33 1 17 GLU HA 1 19 ILE H . . 5.000 3.650 3.223 4.560 . 0 0 "[ . 1 . 2]" 1
34 1 10 GLY HA2 1 13 LEU H . . 5.000 4.027 3.939 4.083 . 0 0 "[ . 1 . 2]" 1
35 1 11 GLY QA 1 14 ASP H . . 5.800 3.174 3.077 3.237 . 0 0 "[ . 1 . 2]" 1
36 1 12 GLU HA 1 15 LYS H . . 5.000 3.424 3.373 3.497 . 0 0 "[ . 1 . 2]" 1
37 1 13 LEU HA 1 16 TRP H . . 5.000 3.016 2.925 3.136 . 0 0 "[ . 1 . 2]" 1
38 1 14 ASP HA 1 17 GLU H . . 5.000 3.778 3.497 3.958 . 0 0 "[ . 1 . 2]" 1
39 1 15 LYS HA 1 18 LYS H . . 5.000 3.220 3.030 3.440 . 0 0 "[ . 1 . 2]" 1
40 1 12 GLU HA 1 16 TRP H . . 5.000 4.367 4.132 4.571 . 0 0 "[ . 1 . 2]" 1
41 1 14 ASP HA 1 18 LYS H . . 5.000 4.329 3.952 4.537 . 0 0 "[ . 1 . 2]" 1
42 1 10 GLY HA2 1 13 LEU HB3 . . 5.000 3.369 3.228 3.497 . 0 0 "[ . 1 . 2]" 1
43 1 12 GLU HA 1 15 LYS QB . . 4.100 2.761 2.633 2.955 . 0 0 "[ . 1 . 2]" 1
44 1 13 LEU HA 1 16 TRP HB3 . . 3.300 2.300 2.134 2.423 . 0 0 "[ . 1 . 2]" 1
45 1 13 LEU HA 1 16 TRP HB2 . . 5.000 3.396 3.206 3.619 . 0 0 "[ . 1 . 2]" 1
46 1 14 ASP HA 1 17 GLU QB . . 5.800 3.074 2.670 3.864 . 0 0 "[ . 1 . 2]" 1
47 1 15 LYS HA 1 18 LYS QB . . 5.800 2.095 1.968 2.467 . 0 0 "[ . 1 . 2]" 1
48 1 19 ILE HA 1 20 ARG H . . 2.700 2.250 2.177 2.298 . 0 0 "[ . 1 . 2]" 1
49 1 20 ARG HA 1 21 LEU H . . 2.700 2.387 2.237 2.566 . 0 0 "[ . 1 . 2]" 1
50 1 21 LEU HA 1 22 ARG H . . 3.300 3.121 2.834 3.330 0.030 11 0 "[ . 1 . 2]" 1
51 1 23 PRO HA 1 24 GLY H . . 2.700 2.156 2.150 2.172 . 0 0 "[ . 1 . 2]" 1
52 1 24 GLY HA3 1 25 GLY H . . 3.300 3.365 3.340 3.444 0.144 16 0 "[ . 1 . 2]" 1
53 1 24 GLY HA2 1 25 GLY H . . 3.300 3.344 3.252 3.371 0.071 14 0 "[ . 1 . 2]" 1
54 1 25 GLY QA 1 26 LYS H . . 3.500 2.382 2.170 2.942 . 0 0 "[ . 1 . 2]" 1
55 1 27 LYS HA 1 28 GLN H . . 3.300 3.017 2.274 3.371 0.071 19 0 "[ . 1 . 2]" 1
56 1 28 GLN HA 1 29 TYR H . . 2.700 2.405 2.306 2.655 . 0 0 "[ . 1 . 2]" 1
57 1 29 TYR HA 1 30 LYS H . . 2.700 2.318 2.262 2.377 . 0 0 "[ . 1 . 2]" 1
58 1 20 ARG HA 1 28 GLN HA . . 2.700 2.334 2.015 2.721 0.021 11 0 "[ . 1 . 2]" 1
59 1 20 ARG HA 1 29 TYR H . . 5.000 3.738 2.962 4.361 . 0 0 "[ . 1 . 2]" 1
60 1 21 LEU H 1 28 GLN HA . . 3.300 3.010 2.497 3.325 0.025 5 0 "[ . 1 . 2]" 1
61 1 23 PRO HA 1 25 GLY H . . 5.000 3.249 3.179 3.320 . 0 0 "[ . 1 . 2]" 1
62 1 25 GLY QA 1 27 LYS H . . 5.800 3.651 2.937 4.897 . 0 0 "[ . 1 . 2]" 1
63 1 19 ILE H 1 29 TYR H . . 5.000 3.841 3.030 5.017 0.017 12 0 "[ . 1 . 2]" 1
64 1 21 LEU H 1 28 GLN H . . 5.000 4.375 3.472 4.872 . 0 0 "[ . 1 . 2]" 1
65 1 22 ARG H 1 25 GLY H . . 5.000 4.357 3.576 5.020 0.020 2 0 "[ . 1 . 2]" 1
66 1 22 ARG H 1 27 LYS H . . 5.000 4.094 2.863 5.067 0.067 14 0 "[ . 1 . 2]" 1
67 1 25 GLY H 1 27 LYS H . . 5.000 4.671 3.842 5.113 0.113 14 0 "[ . 1 . 2]" 1
68 1 26 LYS H 1 27 LYS H . . 2.700 2.536 1.976 2.731 0.031 11 0 "[ . 1 . 2]" 1
69 1 22 ARG HA 1 23 PRO QD . . 4.100 3.052 2.005 3.469 . 0 0 "[ . 1 . 2]" 1
70 1 31 LEU H 1 32 LYS H . . 2.900 2.615 2.593 2.627 . 0 0 "[ . 1 . 2]" 1
71 1 32 LYS H 1 33 HIS H . . 2.900 2.685 2.650 2.700 . 0 0 "[ . 1 . 2]" 1
72 1 33 HIS H 1 34 ILE H . . 2.900 2.613 2.568 2.632 . 0 0 "[ . 1 . 2]" 1
73 1 34 ILE H 1 35 VAL H . . 2.900 2.711 2.688 2.739 . 0 0 "[ . 1 . 2]" 1
74 1 35 VAL H 1 36 TRP H . . 2.900 2.819 2.755 2.847 . 0 0 "[ . 1 . 2]" 1
75 1 36 TRP H 1 37 ALA H . . 2.900 2.608 2.595 2.629 . 0 0 "[ . 1 . 2]" 1
76 1 37 ALA H 1 38 SER H . . 2.900 2.790 2.766 2.807 . 0 0 "[ . 1 . 2]" 1
77 1 38 SER H 1 39 ARG H . . 2.900 2.658 2.624 2.704 . 0 0 "[ . 1 . 2]" 1
78 1 39 ARG H 1 40 GLU H . . 2.900 2.697 2.674 2.703 . 0 0 "[ . 1 . 2]" 1
79 1 40 GLU H 1 41 LEU H . . 2.900 2.607 2.514 2.650 . 0 0 "[ . 1 . 2]" 1
80 1 41 LEU H 1 42 GLU H . . 2.900 2.712 2.491 2.795 . 0 0 "[ . 1 . 2]" 1
81 1 42 GLU H 1 43 ARG H . . 2.900 2.710 2.560 2.757 . 0 0 "[ . 1 . 2]" 1
82 1 43 ARG H 1 44 PHE H . . 2.900 2.615 2.437 2.725 . 0 0 "[ . 1 . 2]" 1
83 1 44 PHE H 1 45 ALA H . . 2.900 2.577 2.309 2.683 . 0 0 "[ . 1 . 2]" 1
84 1 45 ALA H 1 46 VAL H . . 2.700 2.522 2.385 2.667 . 0 0 "[ . 1 . 2]" 1
85 1 31 LEU H 1 33 HIS H . . 5.000 4.374 4.265 4.420 . 0 0 "[ . 1 . 2]" 1
86 1 32 LYS H 1 34 ILE H . . 5.000 3.946 3.920 3.988 . 0 0 "[ . 1 . 2]" 1
87 1 33 HIS H 1 35 VAL H . . 5.000 4.321 4.275 4.341 . 0 0 "[ . 1 . 2]" 1
88 1 34 ILE H 1 36 TRP H . . 5.000 4.077 4.041 4.095 . 0 0 "[ . 1 . 2]" 1
89 1 35 VAL H 1 37 ALA H . . 5.000 4.080 3.997 4.146 . 0 0 "[ . 1 . 2]" 1
90 1 36 TRP H 1 38 SER H . . 5.000 4.303 4.246 4.378 . 0 0 "[ . 1 . 2]" 1
91 1 37 ALA H 1 39 ARG H . . 5.000 3.893 3.860 3.936 . 0 0 "[ . 1 . 2]" 1
92 1 38 SER H 1 40 GLU H . . 5.000 4.247 4.154 4.286 . 0 0 "[ . 1 . 2]" 1
93 1 39 ARG H 1 41 LEU H . . 5.000 4.050 4.031 4.097 . 0 0 "[ . 1 . 2]" 1
94 1 40 GLU H 1 42 GLU H . . 5.000 4.286 3.988 4.391 . 0 0 "[ . 1 . 2]" 1
95 1 41 LEU H 1 43 ARG H . . 5.000 4.054 3.864 4.216 . 0 0 "[ . 1 . 2]" 1
96 1 42 GLU H 1 44 PHE H . . 5.000 4.055 3.640 4.251 . 0 0 "[ . 1 . 2]" 1
97 1 43 ARG H 1 45 ALA H . . 5.000 3.954 3.828 4.116 . 0 0 "[ . 1 . 2]" 1
98 1 44 PHE H 1 46 VAL H . . 5.000 3.679 3.131 3.937 . 0 0 "[ . 1 . 2]" 1
99 1 30 LYS H 1 33 HIS H . . 3.300 3.070 2.959 3.236 . 0 0 "[ . 1 . 2]" 1
100 1 32 LYS H 1 35 VAL H . . 5.000 4.748 4.705 4.781 . 0 0 "[ . 1 . 2]" 1
101 1 35 VAL H 1 38 SER H . . 5.000 4.722 4.694 4.850 . 0 0 "[ . 1 . 2]" 1
102 1 30 LYS HA 1 31 LEU H . . 2.700 2.551 2.462 2.600 . 0 0 "[ . 1 . 2]" 1
103 1 33 HIS HA 1 34 ILE H . . 5.000 3.575 3.572 3.583 . 0 0 "[ . 1 . 2]" 1
104 1 34 ILE HA 1 35 VAL H . . 5.000 3.624 3.622 3.626 . 0 0 "[ . 1 . 2]" 1
105 1 35 VAL HA 1 36 TRP H . . 5.000 3.608 3.601 3.613 . 0 0 "[ . 1 . 2]" 1
106 1 36 TRP HA 1 37 ALA H . . 5.000 3.603 3.591 3.611 . 0 0 "[ . 1 . 2]" 1
107 1 37 ALA HA 1 38 SER H . . 5.000 3.633 3.629 3.636 . 0 0 "[ . 1 . 2]" 1
108 1 38 SER HA 1 39 ARG H . . 5.000 3.575 3.573 3.584 . 0 0 "[ . 1 . 2]" 1
109 1 40 GLU HA 1 41 LEU H . . 5.000 3.571 3.568 3.583 . 0 0 "[ . 1 . 2]" 1
110 1 44 PHE HA 1 45 ALA H . . 5.000 3.335 3.214 3.423 . 0 0 "[ . 1 . 2]" 1
111 1 44 PHE H 1 45 ALA HA . . 5.000 4.755 4.491 4.819 . 0 0 "[ . 1 . 2]" 1
112 1 34 ILE HA 1 36 TRP H . . 5.000 4.300 4.206 4.460 . 0 0 "[ . 1 . 2]" 1
113 1 35 VAL HA 1 37 ALA H . . 5.000 4.301 4.180 4.349 . 0 0 "[ . 1 . 2]" 1
114 1 32 LYS HA 1 35 VAL H . . 5.000 3.414 3.394 3.454 . 0 0 "[ . 1 . 2]" 1
115 1 33 HIS HA 1 36 TRP H . . 5.000 3.390 3.352 3.431 . 0 0 "[ . 1 . 2]" 1
116 1 34 ILE HA 1 37 ALA H . . 5.000 3.095 3.052 3.218 . 0 0 "[ . 1 . 2]" 1
117 1 35 VAL HA 1 38 SER H . . 5.000 3.362 3.330 3.389 . 0 0 "[ . 1 . 2]" 1
118 1 36 TRP HA 1 39 ARG H . . 5.000 3.268 3.229 3.307 . 0 0 "[ . 1 . 2]" 1
119 1 38 SER HA 1 41 LEU H . . 5.000 3.206 3.116 3.255 . 0 0 "[ . 1 . 2]" 1
120 1 40 GLU HA 1 43 ARG H . . 5.000 3.244 3.129 3.390 . 0 0 "[ . 1 . 2]" 1
121 1 42 GLU HA 1 45 ALA H . . 5.000 3.534 3.263 3.877 . 0 0 "[ . 1 . 2]" 1
122 1 32 LYS HA 1 36 TRP H . . 5.000 4.382 4.114 4.507 . 0 0 "[ . 1 . 2]" 1
123 1 33 HIS HA 1 37 ALA H . . 5.000 4.300 3.964 4.526 . 0 0 "[ . 1 . 2]" 1
124 1 30 LYS HA 1 33 HIS QB . . 5.800 4.683 4.585 4.812 . 0 0 "[ . 1 . 2]" 1
125 1 31 LEU HA 1 34 ILE HB . . 5.000 2.364 2.279 2.446 . 0 0 "[ . 1 . 2]" 1
126 1 32 LYS HA 1 35 VAL HB . . 2.700 2.703 2.661 2.739 0.039 14 0 "[ . 1 . 2]" 1
127 1 33 HIS HA 1 36 TRP QB . . 4.100 2.621 2.464 2.704 . 0 0 "[ . 1 . 2]" 1
128 1 34 ILE HA 1 37 ALA MB . . 3.200 2.235 2.108 2.365 . 0 0 "[ . 1 . 2]" 1
129 1 35 VAL HA 1 38 SER QB . . 4.100 2.991 2.653 3.416 . 0 0 "[ . 1 . 2]" 1
130 1 36 TRP HA 1 39 ARG QB . . 4.100 2.216 2.066 2.469 . 0 0 "[ . 1 . 2]" 1
131 1 37 ALA HA 1 40 GLU HB2 . . 5.000 3.125 2.875 3.560 . 0 0 "[ . 1 . 2]" 1
132 1 37 ALA HA 1 40 GLU HB3 . . 5.000 3.968 3.294 4.660 . 0 0 "[ . 1 . 2]" 1
133 1 40 GLU HA 1 43 ARG QB . . 4.100 2.608 2.147 3.518 . 0 0 "[ . 1 . 2]" 1
134 1 41 LEU HA 1 44 PHE HB2 . . 5.000 2.970 2.056 3.691 . 0 0 "[ . 1 . 2]" 1
135 1 46 VAL H 1 47 ASN H . . 5.000 4.467 4.461 4.510 . 0 0 "[ . 1 . 2]" 1
136 1 46 VAL HA 1 47 ASN H . . 2.700 2.332 2.311 2.337 . 0 0 "[ . 1 . 2]" 1
137 1 46 VAL HB 1 47 ASN H . . 5.000 4.144 4.099 4.218 . 0 0 "[ . 1 . 2]" 1
138 1 46 VAL MG2 1 47 ASN H . . 3.200 2.136 1.929 2.298 . 0 0 "[ . 1 . 2]" 1
139 1 47 ASN HA 1 48 PRO HD3 . . 3.300 1.973 1.969 1.985 . 0 0 "[ . 1 . 2]" 1
140 1 47 ASN HA 1 48 PRO HD2 . . 3.300 2.454 2.384 2.533 . 0 0 "[ . 1 . 2]" 1
141 1 49 GLY H 1 50 LEU H . . 2.700 2.649 2.618 2.684 . 0 0 "[ . 1 . 2]" 1
142 1 50 LEU H 1 51 LEU H . . 2.700 2.464 2.408 2.511 . 0 0 "[ . 1 . 2]" 1
143 1 51 LEU H 1 52 GLU H . . 2.700 2.463 2.322 2.596 . 0 0 "[ . 1 . 2]" 1
144 1 52 GLU H 1 53 THR H . . 2.700 2.387 2.200 2.538 . 0 0 "[ . 1 . 2]" 1
145 1 49 GLY H 1 51 LEU H . . 5.000 4.385 4.220 4.525 . 0 0 "[ . 1 . 2]" 1
146 1 50 LEU H 1 52 GLU H . . 5.000 3.761 3.675 3.965 . 0 0 "[ . 1 . 2]" 1
147 1 51 LEU H 1 53 THR H . . 5.000 4.122 4.010 4.231 . 0 0 "[ . 1 . 2]" 1
148 1 48 PRO HA 1 49 GLY H . . 3.300 3.398 3.396 3.399 0.099 13 0 "[ . 1 . 2]" 1
149 1 49 GLY QA 1 50 LEU H . . 4.100 2.971 2.961 2.980 . 0 0 "[ . 1 . 2]" 1
150 1 51 LEU HA 1 52 GLU H . . 5.000 3.419 3.326 3.485 . 0 0 "[ . 1 . 2]" 1
151 1 52 GLU HA 1 53 THR H . . 3.300 3.492 3.488 3.493 0.193 3 0 "[ . 1 . 2]" 1
152 1 48 PRO HA 1 50 LEU H . . 3.300 3.307 3.295 3.316 0.016 11 0 "[ . 1 . 2]" 1
153 1 50 LEU HA 1 52 GLU H . . 5.000 3.634 3.434 3.824 . 0 0 "[ . 1 . 2]" 1
154 1 51 LEU HA 1 53 THR H . . 5.000 3.735 3.640 3.883 . 0 0 "[ . 1 . 2]" 1
155 1 49 GLY QA 1 52 GLU H . . 5.800 3.157 2.987 3.328 . 0 0 "[ . 1 . 2]" 1
156 1 50 LEU HA 1 53 THR H . . 5.000 3.457 3.287 3.582 . 0 0 "[ . 1 . 2]" 1
157 1 53 THR H 1 54 SER H . . 5.000 4.477 4.457 4.483 . 0 0 "[ . 1 . 2]" 1
158 1 54 SER H 1 55 GLU H . . 2.900 2.543 2.514 2.664 . 0 0 "[ . 1 . 2]" 1
159 1 55 GLU H 1 56 GLY H . . 2.900 2.684 2.533 2.754 . 0 0 "[ . 1 . 2]" 1
160 1 56 GLY H 1 57 CYS H . . 2.900 2.614 2.505 2.712 . 0 0 "[ . 1 . 2]" 1
161 1 57 CYS H 1 58 ARG H . . 2.900 2.590 2.517 2.623 . 0 0 "[ . 1 . 2]" 1
162 1 58 ARG H 1 59 GLN H . . 2.900 2.702 2.554 2.749 . 0 0 "[ . 1 . 2]" 1
163 1 59 GLN H 1 60 ILE H . . 2.900 2.632 2.525 2.730 . 0 0 "[ . 1 . 2]" 1
164 1 60 ILE H 1 61 LEU H . . 2.900 2.908 2.895 2.921 0.021 9 0 "[ . 1 . 2]" 1
165 1 61 LEU H 1 62 GLY H . . 2.900 2.881 2.745 2.924 0.024 11 0 "[ . 1 . 2]" 1
166 1 62 GLY H 1 63 GLN H . . 2.900 2.754 2.618 2.808 . 0 0 "[ . 1 . 2]" 1
167 1 63 GLN H 1 64 LEU H . . 2.900 2.706 2.672 2.743 . 0 0 "[ . 1 . 2]" 1
168 1 64 LEU H 1 65 GLN H . . 2.900 1.915 1.875 1.997 . 0 0 "[ . 1 . 2]" 1
169 1 53 THR H 1 55 GLU H . . 5.000 5.006 4.992 5.020 0.020 8 0 "[ . 1 . 2]" 1
170 1 54 SER H 1 56 GLY H . . 5.000 4.334 4.098 4.464 . 0 0 "[ . 1 . 2]" 1
171 1 55 GLU H 1 57 CYS H . . 5.000 3.983 3.875 4.107 . 0 0 "[ . 1 . 2]" 1
172 1 57 CYS H 1 59 GLN H . . 5.000 4.080 3.815 4.247 . 0 0 "[ . 1 . 2]" 1
173 1 58 ARG H 1 60 ILE H . . 5.000 4.100 3.929 4.327 . 0 0 "[ . 1 . 2]" 1
174 1 59 GLN H 1 61 LEU H . . 5.000 4.840 4.700 4.958 . 0 0 "[ . 1 . 2]" 1
175 1 63 GLN H 1 65 GLN H . . 5.000 4.413 4.302 4.479 . 0 0 "[ . 1 . 2]" 1
176 1 53 THR H 1 56 GLY H . . 5.000 3.878 3.664 4.121 . 0 0 "[ . 1 . 2]" 1
177 1 53 THR H 1 57 CYS H . . 5.000 4.073 3.806 4.349 . 0 0 "[ . 1 . 2]" 1
178 1 53 THR HA 1 54 SER H . . 2.700 2.333 2.262 2.403 . 0 0 "[ . 1 . 2]" 1
179 1 54 SER HA 1 55 GLU H . . 5.000 3.550 3.526 3.566 . 0 0 "[ . 1 . 2]" 1
180 1 55 GLU HA 1 56 GLY H . . 5.000 3.616 3.579 3.629 . 0 0 "[ . 1 . 2]" 1
181 1 56 GLY HA3 1 57 CYS H . . 5.000 2.927 2.861 2.967 . 0 0 "[ . 1 . 2]" 1
182 1 58 ARG HA 1 59 GLN H . . 5.000 3.598 3.560 3.622 . 0 0 "[ . 1 . 2]" 1
183 1 60 ILE HA 1 61 LEU H . . 5.000 3.631 3.626 3.639 . 0 0 "[ . 1 . 2]" 1
184 1 61 LEU HA 1 62 GLY H . . 5.000 3.571 3.529 3.590 . 0 0 "[ . 1 . 2]" 1
185 1 62 GLY QA 1 63 GLN H . . 4.100 2.705 2.702 2.709 . 0 0 "[ . 1 . 2]" 1
186 1 63 GLN HA 1 64 LEU H . . 5.000 3.070 3.043 3.127 . 0 0 "[ . 1 . 2]" 1
187 1 53 THR HB 1 55 GLU H . . 3.300 2.986 2.932 3.038 . 0 0 "[ . 1 . 2]" 1
188 1 57 CYS HA 1 59 GLN H . . 5.000 4.292 4.158 4.472 . 0 0 "[ . 1 . 2]" 1
189 1 53 THR HB 1 56 GLY H . . 5.000 3.694 3.480 3.840 . 0 0 "[ . 1 . 2]" 1
190 1 53 THR MG 1 56 GLY H . . 5.800 3.974 3.889 4.062 . 0 0 "[ . 1 . 2]" 1
191 1 54 SER HA 1 57 CYS H . . 5.000 3.297 3.198 3.400 . 0 0 "[ . 1 . 2]" 1
192 1 55 GLU HA 1 58 ARG H . . 5.000 3.474 3.367 3.602 . 0 0 "[ . 1 . 2]" 1
193 1 56 GLY HA2 1 59 GLN H . . 5.000 3.315 3.187 3.453 . 0 0 "[ . 1 . 2]" 1
194 1 57 CYS HA 1 60 ILE H . . 5.000 3.287 3.140 3.599 . 0 0 "[ . 1 . 2]" 1
195 1 58 ARG HA 1 61 LEU H . . 5.000 3.981 3.686 4.241 . 0 0 "[ . 1 . 2]" 1
196 1 59 GLN HA 1 62 GLY H . . 5.000 3.785 3.463 3.921 . 0 0 "[ . 1 . 2]" 1
197 1 60 ILE HA 1 63 GLN H . . 5.000 3.296 3.206 3.392 . 0 0 "[ . 1 . 2]" 1
198 1 61 LEU HA 1 64 LEU H . . 5.000 3.436 3.349 3.548 . 0 0 "[ . 1 . 2]" 1
199 1 62 GLY QA 1 65 GLN H . . 5.800 3.947 3.705 4.101 . 0 0 "[ . 1 . 2]" 1
200 1 58 ARG HA 1 62 GLY H . . 5.000 3.724 3.478 4.086 . 0 0 "[ . 1 . 2]" 1
201 1 55 GLU HA 1 58 ARG QB . . 4.100 2.811 2.491 3.752 . 0 0 "[ . 1 . 2]" 1
202 1 57 CYS HA 1 60 ILE HB . . 5.000 2.589 2.295 3.211 . 0 0 "[ . 1 . 2]" 1
203 1 58 ARG HA 1 61 LEU HB3 . . 5.000 3.151 2.848 3.374 . 0 0 "[ . 1 . 2]" 1
204 1 60 ILE HA 1 63 GLN QB . . 4.100 3.427 3.253 3.693 . 0 0 "[ . 1 . 2]" 1
205 1 62 GLY QA 1 65 GLN HB2 . . 5.800 3.953 3.519 4.191 . 0 0 "[ . 1 . 2]" 1
206 1 67 SER H 1 68 LEU H . . 2.700 2.591 2.584 2.605 . 0 0 "[ . 1 . 2]" 1
207 1 68 LEU H 1 69 GLN H . . 2.700 2.549 2.539 2.596 . 0 0 "[ . 1 . 2]" 1
208 1 69 GLN H 1 70 THR H . . 2.700 2.560 2.542 2.568 . 0 0 "[ . 1 . 2]" 1
209 1 70 THR H 1 71 GLY H . . 2.700 1.906 1.889 1.954 . 0 0 "[ . 1 . 2]" 1
210 1 71 GLY H 1 72 SER H . . 3.300 3.319 3.305 3.348 0.048 8 0 "[ . 1 . 2]" 1
211 1 67 SER H 1 69 GLN H . . 5.000 4.535 4.513 4.613 . 0 0 "[ . 1 . 2]" 1
212 1 68 LEU H 1 70 THR H . . 5.000 3.630 3.600 3.648 . 0 0 "[ . 1 . 2]" 1
213 1 69 GLN H 1 71 GLY H . . 5.000 3.884 3.873 3.915 . 0 0 "[ . 1 . 2]" 1
214 1 70 THR H 1 72 SER H . . 5.000 5.129 5.111 5.163 0.163 8 0 "[ . 1 . 2]" 1
215 1 66 PRO HD2 1 67 SER H . . 3.300 2.266 2.260 2.269 . 0 0 "[ . 1 . 2]" 1
216 1 66 PRO QG 1 67 SER H . . 4.100 2.698 2.686 2.731 . 0 0 "[ . 1 . 2]" 1
217 1 66 PRO HA 1 67 SER H . . 5.000 3.506 3.501 3.508 . 0 0 "[ . 1 . 2]" 1
218 1 67 SER HA 1 68 LEU H . . 3.300 3.419 3.413 3.424 0.124 11 0 "[ . 1 . 2]" 1
219 1 68 LEU HA 1 69 GLN H . . 5.000 3.607 3.605 3.615 . 0 0 "[ . 1 . 2]" 1
220 1 69 GLN HA 1 70 THR H . . 3.300 3.370 3.364 3.373 0.073 18 0 "[ . 1 . 2]" 1
221 1 70 THR HA 1 71 GLY H . . 5.000 3.356 3.346 3.377 . 0 0 "[ . 1 . 2]" 1
222 1 71 GLY HA3 1 72 SER H . . 3.300 2.270 2.259 2.280 . 0 0 "[ . 1 . 2]" 1
223 1 71 GLY HA2 1 72 SER H . . 3.300 3.504 3.490 3.513 0.213 13 0 "[ . 1 . 2]" 1
224 1 65 GLN HA 1 67 SER H . . 5.000 4.648 4.608 4.661 . 0 0 "[ . 1 . 2]" 1
225 1 66 PRO HA 1 68 LEU H . . 5.000 3.549 3.518 3.565 . 0 0 "[ . 1 . 2]" 1
226 1 67 SER HA 1 69 GLN H . . 5.000 4.231 4.203 4.259 . 0 0 "[ . 1 . 2]" 1
227 1 68 LEU HA 1 70 THR H . . 5.000 3.645 3.625 3.693 . 0 0 "[ . 1 . 2]" 1
228 1 69 GLN HA 1 71 GLY H . . 5.000 3.974 3.932 3.992 . 0 0 "[ . 1 . 2]" 1
229 1 64 LEU HA 1 67 SER H . . 5.000 2.971 2.929 2.989 . 0 0 "[ . 1 . 2]" 1
230 1 65 GLN HA 1 68 LEU H . . 5.000 3.702 3.690 3.723 . 0 0 "[ . 1 . 2]" 1
231 1 67 SER HA 1 70 THR H . . 5.000 3.214 3.142 3.236 . 0 0 "[ . 1 . 2]" 1
232 1 68 LEU HA 1 71 GLY H . . 5.000 3.066 3.022 3.173 . 0 0 "[ . 1 . 2]" 1
233 1 66 PRO HA 1 69 GLN QB . . 5.800 3.712 3.640 4.044 . 0 0 "[ . 1 . 2]" 1
234 1 72 SER H 1 73 GLU H . . 5.000 4.358 4.355 4.362 . 0 0 "[ . 1 . 2]" 1
235 1 73 GLU H 1 74 GLU H . . 2.900 2.706 2.676 2.733 . 0 0 "[ . 1 . 2]" 1
236 1 74 GLU H 1 75 LEU H . . 2.900 2.586 2.516 2.598 . 0 0 "[ . 1 . 2]" 1
237 1 75 LEU H 1 76 ARG H . . 2.900 2.645 2.569 2.680 . 0 0 "[ . 1 . 2]" 1
238 1 76 ARG H 1 77 SER H . . 2.900 2.722 2.683 2.762 . 0 0 "[ . 1 . 2]" 1
239 1 77 SER H 1 78 LEU H . . 2.900 2.687 2.584 2.756 . 0 0 "[ . 1 . 2]" 1
240 1 78 LEU H 1 79 TYR H . . 2.900 2.676 2.606 2.743 . 0 0 "[ . 1 . 2]" 1
241 1 79 TYR H 1 80 ASN H . . 2.900 2.711 2.617 2.841 . 0 0 "[ . 1 . 2]" 1
242 1 80 ASN H 1 81 THR H . . 2.900 2.643 2.488 2.717 . 0 0 "[ . 1 . 2]" 1
243 1 81 THR H 1 82 ILE H . . 2.900 2.637 2.577 2.760 . 0 0 "[ . 1 . 2]" 1
244 1 82 ILE H 1 83 ALA H . . 2.900 2.574 2.477 2.639 . 0 0 "[ . 1 . 2]" 1
245 1 83 ALA H 1 84 VAL H . . 2.900 2.892 2.798 2.940 0.040 20 0 "[ . 1 . 2]" 1
246 1 84 VAL H 1 85 LEU H . . 3.300 2.717 2.695 2.734 . 0 0 "[ . 1 . 2]" 1
247 1 85 LEU H 1 86 TYR H . . 2.900 2.725 2.694 2.777 . 0 0 "[ . 1 . 2]" 1
248 1 86 TYR H 1 87 CYS H . . 2.900 2.754 2.683 2.848 . 0 0 "[ . 1 . 2]" 1
249 1 87 CYS H 1 88 VAL H . . 2.900 2.571 2.444 2.655 . 0 0 "[ . 1 . 2]" 1
250 1 88 VAL H 1 89 HIS H . . 2.900 2.624 2.556 2.714 . 0 0 "[ . 1 . 2]" 1
251 1 89 HIS H 1 90 GLN H . . 2.900 2.651 2.372 2.746 . 0 0 "[ . 1 . 2]" 1
252 1 90 GLN H 1 91 ARG H . . 2.900 2.317 2.277 2.518 . 0 0 "[ . 1 . 2]" 1
253 1 91 ARG H 1 92 ILE H . . 2.900 2.557 2.324 2.924 0.024 17 0 "[ . 1 . 2]" 1
254 1 92 ILE H 1 93 ASP H . . 5.000 4.620 4.585 4.629 . 0 0 "[ . 1 . 2]" 1
255 1 73 GLU H 1 75 LEU H . . 5.000 4.200 3.995 4.233 . 0 0 "[ . 1 . 2]" 1
256 1 74 GLU H 1 76 ARG H . . 5.000 3.840 3.813 3.905 . 0 0 "[ . 1 . 2]" 1
257 1 75 LEU H 1 77 SER H . . 5.000 4.331 4.229 4.418 . 0 0 "[ . 1 . 2]" 1
258 1 76 ARG H 1 78 LEU H . . 5.000 3.990 3.953 4.051 . 0 0 "[ . 1 . 2]" 1
259 1 77 SER H 1 79 TYR H . . 5.000 4.350 4.224 4.380 . 0 0 "[ . 1 . 2]" 1
260 1 78 LEU H 1 80 ASN H . . 5.000 4.072 3.939 4.156 . 0 0 "[ . 1 . 2]" 1
261 1 79 TYR H 1 81 THR H . . 5.000 4.007 3.901 4.122 . 0 0 "[ . 1 . 2]" 1
262 1 80 ASN H 1 82 ILE H . . 5.000 4.345 4.217 4.445 . 0 0 "[ . 1 . 2]" 1
263 1 81 THR H 1 83 ALA H . . 5.000 3.875 3.711 3.970 . 0 0 "[ . 1 . 2]" 1
264 1 84 VAL H 1 86 TYR H . . 5.000 4.127 4.006 4.259 . 0 0 "[ . 1 . 2]" 1
265 1 85 LEU H 1 87 CYS H . . 5.000 4.316 4.017 4.540 . 0 0 "[ . 1 . 2]" 1
266 1 86 TYR H 1 88 VAL H . . 5.000 3.952 3.788 4.155 . 0 0 "[ . 1 . 2]" 1
267 1 87 CYS H 1 89 HIS H . . 5.000 4.057 3.841 4.330 . 0 0 "[ . 1 . 2]" 1
268 1 88 VAL H 1 90 GLN H . . 5.000 4.078 3.614 4.191 . 0 0 "[ . 1 . 2]" 1
269 1 89 HIS H 1 91 ARG H . . 5.000 3.710 3.602 3.903 . 0 0 "[ . 1 . 2]" 1
270 1 90 GLN H 1 92 ILE H . . 5.000 3.782 3.493 4.033 . 0 0 "[ . 1 . 2]" 1
271 1 72 SER H 1 75 LEU H . . 5.000 3.560 3.471 3.626 . 0 0 "[ . 1 . 2]" 1
272 1 73 GLU H 1 76 ARG H . . 5.000 4.577 4.526 4.609 . 0 0 "[ . 1 . 2]" 1
273 1 75 LEU H 1 78 LEU H . . 5.000 4.885 4.839 4.958 . 0 0 "[ . 1 . 2]" 1
274 1 76 ARG H 1 79 TYR H . . 5.000 4.888 4.848 4.933 . 0 0 "[ . 1 . 2]" 1
275 1 77 SER H 1 80 ASN H . . 5.000 4.796 4.633 5.017 0.017 10 0 "[ . 1 . 2]" 1
276 1 72 SER HA 1 73 GLU H . . 2.700 2.743 2.727 2.785 0.085 13 0 "[ . 1 . 2]" 1
277 1 72 SER HB2 1 73 GLU H . . 3.300 1.983 1.906 2.014 . 0 0 "[ . 1 . 2]" 1
278 1 72 SER HB3 1 73 GLU H . . 5.000 3.471 3.408 3.508 . 0 0 "[ . 1 . 2]" 1
279 1 74 GLU HA 1 75 LEU H . . 5.000 3.617 3.589 3.622 . 0 0 "[ . 1 . 2]" 1
280 1 76 ARG HA 1 77 SER H . . 5.000 3.619 3.601 3.631 . 0 0 "[ . 1 . 2]" 1
281 1 79 TYR HA 1 80 ASN H . . 5.000 3.608 3.577 3.617 . 0 0 "[ . 1 . 2]" 1
282 1 80 ASN HA 1 81 THR H . . 5.000 3.570 3.539 3.598 . 0 0 "[ . 1 . 2]" 1
283 1 81 THR HA 1 82 ILE H . . 5.000 3.612 3.602 3.618 . 0 0 "[ . 1 . 2]" 1
284 1 82 ILE HA 1 83 ALA H . . 5.000 3.584 3.555 3.608 . 0 0 "[ . 1 . 2]" 1
285 1 83 ALA HA 1 84 VAL H . . 5.000 3.638 3.631 3.642 . 0 0 "[ . 1 . 2]" 1
286 1 84 VAL HA 1 85 LEU H . . 5.000 3.604 3.593 3.614 . 0 0 "[ . 1 . 2]" 1
287 1 85 LEU HA 1 86 TYR H . . 5.000 3.591 3.569 3.616 . 0 0 "[ . 1 . 2]" 1
288 1 86 TYR HA 1 87 CYS H . . 5.000 3.616 3.570 3.638 . 0 0 "[ . 1 . 2]" 1
289 1 87 CYS HA 1 88 VAL H . . 5.000 3.586 3.564 3.609 . 0 0 "[ . 1 . 2]" 1
290 1 88 VAL HA 1 89 HIS H . . 5.000 3.588 3.561 3.619 . 0 0 "[ . 1 . 2]" 1
291 1 89 HIS HA 1 90 GLN H . . 5.000 3.581 3.469 3.596 . 0 0 "[ . 1 . 2]" 1
292 1 90 GLN HA 1 91 ARG H . . 5.000 3.434 3.176 3.483 . 0 0 "[ . 1 . 2]" 1
293 1 91 ARG HA 1 92 ILE H . . 3.300 2.842 2.737 3.190 . 0 0 "[ . 1 . 2]" 1
294 1 72 SER HB2 1 74 GLU H . . 3.300 2.961 2.913 3.022 . 0 0 "[ . 1 . 2]" 1
295 1 72 SER HB3 1 74 GLU H . . 5.000 4.460 4.440 4.512 . 0 0 "[ . 1 . 2]" 1
296 1 72 SER HA 1 74 GLU H . . 5.000 4.631 4.609 4.715 . 0 0 "[ . 1 . 2]" 1
297 1 72 SER HB3 1 75 LEU H . . 5.000 4.382 4.364 4.411 . 0 0 "[ . 1 . 2]" 1
298 1 72 SER HB2 1 75 LEU H . . 5.000 3.770 3.661 3.852 . 0 0 "[ . 1 . 2]" 1
299 1 72 SER HA 1 75 LEU H . . 5.000 4.632 4.518 4.677 . 0 0 "[ . 1 . 2]" 1
300 1 74 GLU HA 1 77 SER H . . 5.000 3.346 3.286 3.398 . 0 0 "[ . 1 . 2]" 1
301 1 75 LEU HA 1 78 LEU H . . 5.000 3.276 3.176 3.335 . 0 0 "[ . 1 . 2]" 1
302 1 76 ARG HA 1 79 TYR H . . 5.000 3.324 3.284 3.374 . 0 0 "[ . 1 . 2]" 1
303 1 77 SER HA 1 80 ASN H . . 5.000 3.296 3.181 3.436 . 0 0 "[ . 1 . 2]" 1
304 1 78 LEU HA 1 81 THR H . . 5.000 3.405 3.183 3.547 . 0 0 "[ . 1 . 2]" 1
305 1 80 ASN HA 1 83 ALA H . . 5.000 3.402 3.222 3.516 . 0 0 "[ . 1 . 2]" 1
306 1 81 THR HA 1 84 VAL H . . 5.000 3.675 3.502 3.839 . 0 0 "[ . 1 . 2]" 1
307 1 83 ALA HA 1 86 TYR H . . 5.000 3.419 3.357 3.492 . 0 0 "[ . 1 . 2]" 1
308 1 84 VAL HA 1 87 CYS H . . 5.000 3.272 3.198 3.374 . 0 0 "[ . 1 . 2]" 1
309 1 85 LEU HA 1 88 VAL H . . 5.000 3.275 3.156 3.464 . 0 0 "[ . 1 . 2]" 1
310 1 86 TYR HA 1 89 HIS H . . 5.000 3.284 3.213 3.375 . 0 0 "[ . 1 . 2]" 1
311 1 87 CYS HA 1 90 GLN H . . 5.000 3.270 3.061 3.407 . 0 0 "[ . 1 . 2]" 1
312 1 88 VAL HA 1 91 ARG H . . 5.000 3.012 2.871 3.458 . 0 0 "[ . 1 . 2]" 1
313 1 75 LEU HA 1 79 TYR H . . 5.000 4.551 4.489 4.687 . 0 0 "[ . 1 . 2]" 1
314 1 76 ARG HA 1 80 ASN H . . 5.000 4.383 4.180 4.665 . 0 0 "[ . 1 . 2]" 1
315 1 80 ASN HA 1 84 VAL H . . 5.000 4.066 3.878 4.279 . 0 0 "[ . 1 . 2]" 1
316 1 82 ILE HA 1 86 TYR H . . 5.000 4.025 3.802 4.155 . 0 0 "[ . 1 . 2]" 1
317 1 85 LEU HA 1 89 HIS H . . 5.000 4.248 3.928 4.532 . 0 0 "[ . 1 . 2]" 1
318 1 86 TYR HA 1 90 GLN H . . 5.000 4.558 4.189 4.713 . 0 0 "[ . 1 . 2]" 1
319 1 73 GLU HA 1 76 ARG QB . . 3.500 2.650 2.497 2.734 . 0 0 "[ . 1 . 2]" 1
320 1 74 GLU HA 1 77 SER HB2 . . 5.000 3.095 2.713 3.812 . 0 0 "[ . 1 . 2]" 1
321 1 75 LEU HA 1 78 LEU HB2 . . 5.000 3.455 3.365 3.655 . 0 0 "[ . 1 . 2]" 1
322 1 75 LEU HA 1 78 LEU HB3 . . 5.000 2.609 2.479 2.784 . 0 0 "[ . 1 . 2]" 1
323 1 76 ARG HA 1 79 TYR HB3 . . 3.300 2.861 2.790 3.010 . 0 0 "[ . 1 . 2]" 1
324 1 77 SER HA 1 80 ASN HB3 . . 3.300 3.057 2.553 3.392 0.092 3 0 "[ . 1 . 2]" 1
325 1 78 LEU HA 1 81 THR HB . . 3.300 2.852 2.549 3.071 . 0 0 "[ . 1 . 2]" 1
326 1 79 TYR HA 1 82 ILE HB . . 5.000 2.916 2.572 4.498 . 0 0 "[ . 1 . 2]" 1
327 1 80 ASN HA 1 83 ALA MB . . 3.800 2.192 1.970 2.415 . 0 0 "[ . 1 . 2]" 1
328 1 81 THR HA 1 84 VAL HB . . 5.000 3.096 2.821 3.347 . 0 0 "[ . 1 . 2]" 1
329 1 82 ILE HA 1 85 LEU HB2 . . 5.000 2.182 2.063 2.453 . 0 0 "[ . 1 . 2]" 1
330 1 83 ALA HA 1 86 TYR HB2 . . 5.000 2.982 2.646 3.360 . 0 0 "[ . 1 . 2]" 1
331 1 84 VAL HA 1 87 CYS QB . . 4.100 2.752 2.373 3.351 . 0 0 "[ . 1 . 2]" 1
332 1 87 CYS HA 1 90 GLN HB2 . . 5.000 2.993 2.609 3.325 . 0 0 "[ . 1 . 2]" 1
333 1 92 ILE HA 1 93 ASP H . . 2.700 2.263 2.260 2.268 . 0 0 "[ . 1 . 2]" 1
334 1 92 ILE MG 1 93 ASP H . . 3.200 2.294 2.060 2.458 . 0 0 "[ . 1 . 2]" 1
335 1 93 ASP HA 1 94 VAL H . . 2.700 2.304 2.264 2.515 . 0 0 "[ . 1 . 2]" 1
336 1 94 VAL HA 1 95 LYS H . . 2.700 2.547 2.355 2.589 . 0 0 "[ . 1 . 2]" 1
337 1 94 VAL HB 1 95 LYS H . . 2.700 2.334 2.235 2.757 0.057 3 0 "[ . 1 . 2]" 1
338 1 95 LYS H 1 96 ASP H . . 2.700 2.059 1.835 2.599 . 0 0 "[ . 1 . 2]" 1
339 1 19 ILE HA 1 95 LYS HA . . 5.000 3.322 1.995 3.813 . 0 0 "[ . 1 . 2]" 1
340 1 20 ARG HA 1 96 ASP HA . . 5.000 4.402 4.122 4.740 . 0 0 "[ . 1 . 2]" 1
341 1 94 VAL HA 1 96 ASP H . . 5.000 4.406 3.736 5.017 0.017 20 0 "[ . 1 . 2]" 1
342 1 95 LYS HA 1 96 ASP H . . 5.000 3.547 3.040 3.640 . 0 0 "[ . 1 . 2]" 1
343 1 96 ASP HA 1 97 THR H . . 2.700 2.584 2.395 2.618 . 0 0 "[ . 1 . 2]" 1
344 1 20 ARG H 1 96 ASP HA . . 2.700 2.129 1.933 2.652 . 0 0 "[ . 1 . 2]" 1
345 1 21 LEU HA 1 97 THR H . . 5.000 3.616 2.921 4.091 . 0 0 "[ . 1 . 2]" 1
346 1 20 ARG H 1 97 THR H . . 5.000 4.240 3.990 4.786 . 0 0 "[ . 1 . 2]" 1
347 1 20 ARG H 1 96 ASP H . . 5.000 4.322 3.353 4.821 . 0 0 "[ . 1 . 2]" 1
348 1 19 ILE MG 1 96 ASP HA . . 3.200 2.472 2.293 2.634 . 0 0 "[ . 1 . 2]" 1
349 1 19 ILE MG 1 96 ASP H . . 5.500 3.779 2.688 4.261 . 0 0 "[ . 1 . 2]" 1
350 1 97 THR H 1 98 LYS H . . 3.300 2.730 2.673 2.786 . 0 0 "[ . 1 . 2]" 1
351 1 98 LYS H 1 99 GLU H . . 2.900 2.638 2.511 2.718 . 0 0 "[ . 1 . 2]" 1
352 1 99 GLU H 1 100 ALA H . . 2.900 2.601 2.555 2.705 . 0 0 "[ . 1 . 2]" 1
353 1 100 ALA H 1 101 LEU H . . 2.900 2.544 2.508 2.611 . 0 0 "[ . 1 . 2]" 1
354 1 101 LEU H 1 102 ASP H . . 2.900 2.774 2.717 2.830 . 0 0 "[ . 1 . 2]" 1
355 1 102 ASP H 1 103 LYS H . . 2.900 2.507 2.479 2.543 . 0 0 "[ . 1 . 2]" 1
356 1 103 LYS H 1 104 ILE H . . 2.900 2.842 2.762 2.896 . 0 0 "[ . 1 . 2]" 1
357 1 104 ILE H 1 105 GLU H . . 2.900 2.695 2.684 2.709 . 0 0 "[ . 1 . 2]" 1
358 1 105 GLU H 1 106 GLU H . . 2.900 2.821 2.693 2.876 . 0 0 "[ . 1 . 2]" 1
359 1 106 GLU H 1 107 GLU H . . 2.900 2.795 2.730 2.855 . 0 0 "[ . 1 . 2]" 1
360 1 107 GLU H 1 108 GLN H . . 2.900 2.900 2.882 2.902 0.002 14 0 "[ . 1 . 2]" 1
361 1 108 GLN H 1 109 ASN H . . 2.900 2.878 2.871 2.900 . 0 0 "[ . 1 . 2]" 1
362 1 109 ASN H 1 110 LYS H . . 2.900 2.792 2.730 2.803 . 0 0 "[ . 1 . 2]" 1
363 1 110 LYS H 1 111 SER H . . 2.900 2.809 2.604 2.900 0.000 13 0 "[ . 1 . 2]" 1
364 1 111 SER H 1 112 LYS H . . 2.900 2.906 2.723 2.926 0.026 1 0 "[ . 1 . 2]" 1
365 1 112 LYS H 1 113 LYS H . . 2.900 2.898 2.849 2.915 0.015 19 0 "[ . 1 . 2]" 1
366 1 113 LYS H 1 114 LYS H . . 2.900 2.890 2.674 2.918 0.018 13 0 "[ . 1 . 2]" 1
367 1 114 LYS H 1 115 ALA H . . 2.900 2.826 2.627 2.911 0.011 13 0 "[ . 1 . 2]" 1
368 1 115 ALA H 1 116 GLN H . . 2.900 2.883 2.648 2.939 0.039 18 0 "[ . 1 . 2]" 1
369 1 116 GLN H 1 117 GLN H . . 2.900 2.878 2.691 2.935 0.035 4 0 "[ . 1 . 2]" 1
370 1 117 GLN H 1 118 ALA H . . 2.900 2.875 2.548 2.914 0.014 18 0 "[ . 1 . 2]" 1
371 1 118 ALA H 1 119 ALA H . . 2.900 2.851 2.631 2.915 0.015 11 0 "[ . 1 . 2]" 1
372 1 96 ASP H 1 98 LYS H . . 5.000 5.007 4.935 5.073 0.073 15 0 "[ . 1 . 2]" 1
373 1 97 THR H 1 99 GLU H . . 5.000 3.971 3.909 4.043 . 0 0 "[ . 1 . 2]" 1
374 1 98 LYS H 1 100 ALA H . . 5.000 4.169 4.080 4.273 . 0 0 "[ . 1 . 2]" 1
375 1 99 GLU H 1 101 LEU H . . 5.000 4.072 3.938 4.277 . 0 0 "[ . 1 . 2]" 1
376 1 100 ALA H 1 102 ASP H . . 5.000 4.162 3.912 4.295 . 0 0 "[ . 1 . 2]" 1
377 1 101 LEU H 1 103 LYS H . . 5.000 4.023 3.950 4.239 . 0 0 "[ . 1 . 2]" 1
378 1 102 ASP H 1 104 ILE H . . 5.000 4.394 4.195 4.454 . 0 0 "[ . 1 . 2]" 1
379 1 103 LYS H 1 105 GLU H . . 5.000 3.654 3.605 3.729 . 0 0 "[ . 1 . 2]" 1
380 1 104 ILE H 1 106 GLU H . . 5.000 4.652 4.552 4.703 . 0 0 "[ . 1 . 2]" 1
381 1 105 GLU H 1 107 GLU H . . 5.000 4.212 4.156 4.273 . 0 0 "[ . 1 . 2]" 1
382 1 108 GLN H 1 110 LYS H . . 5.000 4.120 3.874 4.157 . 0 0 "[ . 1 . 2]" 1
383 1 109 ASN H 1 111 SER H . . 5.000 4.474 4.216 4.620 . 0 0 "[ . 1 . 2]" 1
384 1 111 SER H 1 113 LYS H . . 5.000 4.411 3.917 4.969 . 0 0 "[ . 1 . 2]" 1
385 1 112 LYS H 1 114 LYS H . . 5.000 4.336 3.626 4.728 . 0 0 "[ . 1 . 2]" 1
386 1 113 LYS H 1 115 ALA H . . 5.000 4.221 3.780 4.489 . 0 0 "[ . 1 . 2]" 1
387 1 114 LYS H 1 116 GLN H . . 5.000 4.495 4.278 4.851 . 0 0 "[ . 1 . 2]" 1
388 1 115 ALA H 1 117 GLN H . . 5.000 4.175 3.619 4.513 . 0 0 "[ . 1 . 2]" 1
389 1 116 GLN H 1 118 ALA H . . 5.000 4.466 4.130 4.683 . 0 0 "[ . 1 . 2]" 1
390 1 117 GLN H 1 119 ALA H . . 5.000 4.336 4.048 4.553 . 0 0 "[ . 1 . 2]" 1
391 1 120 ALA H 1 122 THR H . . 5.000 4.305 3.661 4.672 . 0 0 "[ . 1 . 2]" 1
392 1 96 ASP H 1 99 GLU H . . 5.000 3.328 3.233 3.766 . 0 0 "[ . 1 . 2]" 1
393 1 98 LYS H 1 101 LEU H . . 5.000 4.799 4.656 4.968 . 0 0 "[ . 1 . 2]" 1
394 1 99 GLU H 1 102 ASP H . . 5.000 4.880 4.707 4.994 . 0 0 "[ . 1 . 2]" 1
395 1 100 ALA H 1 103 LYS H . . 5.000 4.439 4.377 4.502 . 0 0 "[ . 1 . 2]" 1
396 1 102 ASP H 1 105 GLU H . . 5.000 4.381 4.314 4.437 . 0 0 "[ . 1 . 2]" 1
397 1 103 LYS H 1 106 GLU H . . 5.000 4.881 4.624 5.011 0.011 15 0 "[ . 1 . 2]" 1
398 1 95 LYS H 1 99 GLU H . . 5.000 4.492 4.303 4.710 . 0 0 "[ . 1 . 2]" 1
399 1 96 ASP H 1 100 ALA H . . 5.000 4.379 4.076 4.731 . 0 0 "[ . 1 . 2]" 1
400 1 97 THR HA 1 98 LYS H . . 5.000 3.601 3.567 3.616 . 0 0 "[ . 1 . 2]" 1
401 1 98 LYS HA 1 99 GLU H . . 5.000 3.555 3.550 3.573 . 0 0 "[ . 1 . 2]" 1
402 1 99 GLU HA 1 100 ALA H . . 5.000 3.576 3.554 3.605 . 0 0 "[ . 1 . 2]" 1
403 1 100 ALA HA 1 101 LEU H . . 5.000 3.598 3.584 3.621 . 0 0 "[ . 1 . 2]" 1
404 1 101 LEU HA 1 102 ASP H . . 5.000 3.613 3.582 3.629 . 0 0 "[ . 1 . 2]" 1
405 1 103 LYS HA 1 104 ILE H . . 5.000 3.639 3.637 3.641 . 0 0 "[ . 1 . 2]" 1
406 1 104 ILE HA 1 105 GLU H . . 5.000 3.533 3.529 3.546 . 0 0 "[ . 1 . 2]" 1
407 1 105 GLU HA 1 106 GLU H . . 5.000 3.636 3.635 3.637 . 0 0 "[ . 1 . 2]" 1
408 1 109 ASN HA 1 110 LYS H . . 5.000 3.616 3.550 3.623 . 0 0 "[ . 1 . 2]" 1
409 1 110 LYS HA 1 111 SER H . . 5.000 3.633 3.605 3.639 . 0 0 "[ . 1 . 2]" 1
410 1 111 SER HA 1 112 LYS H . . 5.000 3.627 3.498 3.649 . 0 0 "[ . 1 . 2]" 1
411 1 112 LYS HA 1 113 LYS H . . 5.000 3.627 3.582 3.640 . 0 0 "[ . 1 . 2]" 1
412 1 114 LYS HA 1 115 ALA H . . 5.000 3.609 3.464 3.632 . 0 0 "[ . 1 . 2]" 1
413 1 116 GLN HA 1 117 GLN H . . 5.000 3.616 3.543 3.645 . 0 0 "[ . 1 . 2]" 1
414 1 117 GLN HA 1 118 ALA H . . 5.000 3.632 3.584 3.642 . 0 0 "[ . 1 . 2]" 1
415 1 120 ALA HA 1 121 ASP H . . 5.000 3.491 3.227 3.642 . 0 0 "[ . 1 . 2]" 1
416 1 121 ASP HA 1 122 THR H . . 5.000 3.466 2.898 3.656 . 0 0 "[ . 1 . 2]" 1
417 1 97 THR HA 1 99 GLU H . . 5.000 4.022 3.926 4.158 . 0 0 "[ . 1 . 2]" 1
418 1 98 LYS HA 1 100 ALA H . . 5.000 4.166 4.011 4.369 . 0 0 "[ . 1 . 2]" 1
419 1 99 GLU HA 1 101 LEU H . . 5.000 4.377 4.260 4.596 . 0 0 "[ . 1 . 2]" 1
420 1 104 ILE HA 1 106 GLU H . . 5.000 4.579 4.500 4.767 . 0 0 "[ . 1 . 2]" 1
421 1 109 ASN HA 1 111 SER H . . 5.000 4.801 4.473 5.000 . 0 0 "[ . 1 . 2]" 1
422 1 111 SER HA 1 113 LYS H . . 5.000 4.637 4.106 5.011 0.011 16 0 "[ . 1 . 2]" 1
423 1 115 ALA HA 1 117 GLN H . . 5.000 4.538 4.159 4.955 . 0 0 "[ . 1 . 2]" 1
424 1 117 GLN HA 1 119 ALA H . . 5.000 4.687 4.249 5.008 0.008 6 0 "[ . 1 . 2]" 1
425 1 120 ALA HA 1 122 THR H . . 5.000 4.393 3.417 5.052 0.052 4 0 "[ . 1 . 2]" 1
426 1 97 THR HA 1 100 ALA H . . 5.000 3.198 3.054 3.379 . 0 0 "[ . 1 . 2]" 1
427 1 98 LYS HA 1 101 LEU H . . 5.000 3.215 3.112 3.323 . 0 0 "[ . 1 . 2]" 1
428 1 99 GLU HA 1 102 ASP H . . 5.000 3.477 3.362 3.597 . 0 0 "[ . 1 . 2]" 1
429 1 100 ALA HA 1 103 LYS H . . 5.000 3.138 3.081 3.212 . 0 0 "[ . 1 . 2]" 1
430 1 101 LEU HA 1 104 ILE H . . 5.000 3.969 3.882 4.042 . 0 0 "[ . 1 . 2]" 1
431 1 103 LYS HA 1 106 GLU H . . 5.000 3.550 3.358 3.623 . 0 0 "[ . 1 . 2]" 1
432 1 104 ILE HA 1 107 GLU H . . 5.000 3.403 3.249 3.682 . 0 0 "[ . 1 . 2]" 1
433 1 109 ASN HA 1 112 LYS H . . 5.000 3.627 3.436 3.949 . 0 0 "[ . 1 . 2]" 1
434 1 111 SER HA 1 114 LYS H . . 5.000 3.469 3.370 3.576 . 0 0 "[ . 1 . 2]" 1
435 1 98 LYS HA 1 102 ASP H . . 5.000 4.319 4.003 4.580 . 0 0 "[ . 1 . 2]" 1
436 1 101 LEU HA 1 105 GLU H . . 5.000 3.923 3.770 4.099 . 0 0 "[ . 1 . 2]" 1
437 1 97 THR HA 1 100 ALA MB . . 3.800 2.639 2.467 3.001 . 0 0 "[ . 1 . 2]" 1
438 1 98 LYS HA 1 101 LEU HB2 . . 5.000 2.406 2.143 2.664 . 0 0 "[ . 1 . 2]" 1
439 1 98 LYS HA 1 101 LEU HB3 . . 5.000 3.812 3.352 4.157 . 0 0 "[ . 1 . 2]" 1
440 1 99 GLU HA 1 102 ASP HB2 . . 5.000 3.938 3.219 4.378 . 0 0 "[ . 1 . 2]" 1
441 1 99 GLU HA 1 102 ASP HB3 . . 3.300 3.075 2.789 3.262 . 0 0 "[ . 1 . 2]" 1
442 1 100 ALA HA 1 103 LYS HB2 . . 5.000 2.213 1.969 3.150 . 0 0 "[ . 1 . 2]" 1
443 1 100 ALA HA 1 103 LYS HB3 . . 3.300 3.125 1.985 3.332 0.032 14 0 "[ . 1 . 2]" 1
444 1 101 LEU HA 1 104 ILE HB . . 5.000 4.986 4.673 5.063 0.063 15 0 "[ . 1 . 2]" 1
445 1 102 ASP HA 1 105 GLU QB . . 4.100 2.115 2.031 2.307 . 0 0 "[ . 1 . 2]" 1
446 1 103 LYS HA 1 106 GLU QB . . 4.100 3.289 2.801 3.531 . 0 0 "[ . 1 . 2]" 1
447 1 104 ILE HA 1 107 GLU QB . . 4.100 2.460 2.127 2.773 . 0 0 "[ . 1 . 2]" 1
448 1 105 GLU HA 1 108 GLN QB . . 4.100 2.884 2.682 3.066 . 0 0 "[ . 1 . 2]" 1
449 1 106 GLU HA 1 109 ASN QB . . 4.100 2.617 2.478 2.751 . 0 0 "[ . 1 . 2]" 1
450 1 108 GLN HA 1 111 SER QB . . 4.100 2.663 2.345 2.833 . 0 0 "[ . 1 . 2]" 1
451 1 109 ASN HA 1 112 LYS QB . . 4.100 2.815 2.297 3.663 . 0 0 "[ . 1 . 2]" 1
452 1 111 SER HA 1 114 LYS QB . . 4.100 2.613 2.126 2.930 . 0 0 "[ . 1 . 2]" 1
453 1 112 LYS HA 1 115 ALA MB . . 3.800 2.463 1.975 2.819 . 0 0 "[ . 1 . 2]" 1
454 1 116 GLN HA 1 119 ALA MB . . 3.800 2.504 2.240 2.881 . 0 0 "[ . 1 . 2]" 1
455 1 117 GLN HA 1 120 ALA MB . . 3.800 2.611 1.988 2.918 . 0 0 "[ . 1 . 2]" 1
456 1 118 ALA HA 1 121 ASP QB . . 5.800 2.538 1.912 3.883 . 0 0 "[ . 1 . 2]" 1
457 1 119 ALA HA 1 122 THR MG . . 5.500 3.181 1.989 4.545 . 0 0 "[ . 1 . 2]" 1
458 1 6 SER H 1 8 LEU H . . 5.000 4.934 3.886 5.007 0.007 9 0 "[ . 1 . 2]" 1
459 1 6 SER HA 1 7 VAL H . . 2.700 2.512 2.251 2.708 0.008 9 0 "[ . 1 . 2]" 1
460 1 6 SER HA 1 8 LEU H . . 5.000 4.649 4.444 5.000 . 0 0 "[ . 1 . 2]" 1
461 1 7 VAL H 1 8 LEU H . . 2.700 2.498 2.293 2.709 0.009 9 0 "[ . 1 . 2]" 1
462 1 7 VAL QG 1 8 LEU H . . 4.200 2.756 2.515 2.987 . 0 0 "[ . 1 . 2]" 1
463 1 7 VAL HB 1 8 LEU H . . 3.300 2.459 2.266 2.712 . 0 0 "[ . 1 . 2]" 1
464 1 7 VAL QG 1 8 LEU HG . . 6.500 2.226 2.116 2.333 . 0 0 "[ . 1 . 2]" 1
465 1 7 VAL QG 1 34 ILE MG . . 5.300 1.664 1.619 1.706 . 0 0 "[ . 1 . 2]" 1
466 1 7 VAL QG 1 34 ILE MD . . 4.700 2.034 1.916 2.147 . 0 0 "[ . 1 . 2]" 1
467 1 7 VAL HA 1 52 GLU HA . . 3.300 3.306 3.296 3.311 0.011 9 0 "[ . 1 . 2]" 1
468 1 7 VAL HA 1 52 GLU QG . . 4.100 2.672 2.110 3.221 . 0 0 "[ . 1 . 2]" 1
469 1 7 VAL QG 1 52 GLU QG . . 5.600 3.114 2.433 3.616 . 0 0 "[ . 1 . 2]" 1
470 1 8 LEU H 1 8 LEU HG . . 3.300 3.276 3.196 3.324 0.024 9 0 "[ . 1 . 2]" 1
471 1 8 LEU HA 1 8 LEU MD2 . . 3.200 1.887 1.869 1.906 . 0 0 "[ . 1 . 2]" 1
472 1 8 LEU HA 1 9 SER H . . 2.700 2.365 2.304 2.431 . 0 0 "[ . 1 . 2]" 1
473 1 8 LEU HB2 1 9 SER H . . 5.000 4.055 3.937 4.166 . 0 0 "[ . 1 . 2]" 1
474 1 8 LEU HB3 1 9 SER H . . 5.000 2.775 2.601 2.947 . 0 0 "[ . 1 . 2]" 1
475 1 8 LEU MD2 1 9 SER H . . 3.800 2.817 2.732 2.918 . 0 0 "[ . 1 . 2]" 1
476 1 8 LEU MD1 1 9 SER H . . 5.500 4.262 4.130 4.420 . 0 0 "[ . 1 . 2]" 1
477 1 8 LEU MD2 1 12 GLU HB2 . . 5.500 3.754 3.627 3.817 . 0 0 "[ . 1 . 2]" 1
478 1 8 LEU MD2 1 13 LEU H . . 5.500 4.364 4.338 4.401 . 0 0 "[ . 1 . 2]" 1
479 1 8 LEU MD1 1 13 LEU H . . 5.500 3.972 3.905 4.132 . 0 0 "[ . 1 . 2]" 1
480 1 8 LEU MD1 1 13 LEU HA . . 3.800 1.930 1.908 1.983 . 0 0 "[ . 1 . 2]" 1
481 1 8 LEU MD1 1 13 LEU MD1 . . 3.700 1.868 1.851 1.909 . 0 0 "[ . 1 . 2]" 1
482 1 8 LEU MD2 1 13 LEU MD1 . . 6.000 4.040 3.996 4.086 . 0 0 "[ . 1 . 2]" 1
483 1 8 LEU MD1 1 13 LEU MD2 . . 6.000 3.745 3.706 3.875 . 0 0 "[ . 1 . 2]" 1
484 1 8 LEU MD1 1 16 TRP H . . 3.800 3.086 3.063 3.115 . 0 0 "[ . 1 . 2]" 1
485 1 8 LEU MD1 1 16 TRP HB2 . . 5.500 1.813 1.778 1.923 . 0 0 "[ . 1 . 2]" 1
486 1 8 LEU H 1 34 ILE MG . . 5.500 4.310 4.146 4.446 . 0 0 "[ . 1 . 2]" 1
487 1 8 LEU H 1 34 ILE MD . . 5.500 3.831 3.706 3.987 . 0 0 "[ . 1 . 2]" 1
488 1 8 LEU MD1 1 34 ILE MD . . 3.700 1.842 1.774 1.893 . 0 0 "[ . 1 . 2]" 1
489 1 8 LEU MD2 1 34 ILE MD . . 4.300 2.993 2.925 3.023 . 0 0 "[ . 1 . 2]" 1
490 1 8 LEU MD1 1 34 ILE MG . . 6.000 3.944 3.902 3.989 . 0 0 "[ . 1 . 2]" 1
491 1 8 LEU MD2 1 88 VAL MG1 . . 4.300 2.535 2.222 2.725 . 0 0 "[ . 1 . 2]" 1
492 1 8 LEU MD1 1 88 VAL MG1 . . 6.000 2.570 2.347 2.907 . 0 0 "[ . 1 . 2]" 1
493 1 9 SER H 1 12 GLU HB2 . . 3.300 2.276 2.162 2.347 . 0 0 "[ . 1 . 2]" 1
494 1 9 SER H 1 12 GLU HB3 . . 5.000 2.325 2.174 2.464 . 0 0 "[ . 1 . 2]" 1
495 1 9 SER HB2 1 11 GLY H . . 5.000 4.464 4.449 4.482 . 0 0 "[ . 1 . 2]" 1
496 1 9 SER HB2 1 10 GLY H . . 3.300 2.871 2.853 2.884 . 0 0 "[ . 1 . 2]" 1
497 1 9 SER HB3 1 12 GLU H . . 3.300 3.312 3.305 3.329 0.029 15 0 "[ . 1 . 2]" 1
498 1 12 GLU H 1 12 GLU HB3 . . 3.300 3.333 3.315 3.393 0.093 15 0 "[ . 1 . 2]" 1
499 1 12 GLU H 1 12 GLU QG . . 3.500 3.112 2.956 3.169 . 0 0 "[ . 1 . 2]" 1
500 1 12 GLU HA 1 88 VAL MG1 . . 3.800 2.667 2.345 2.993 . 0 0 "[ . 1 . 2]" 1
501 1 13 LEU H 1 13 LEU HB2 . . 3.300 2.546 2.519 2.603 . 0 0 "[ . 1 . 2]" 1
502 1 13 LEU H 1 13 LEU HB3 . . 2.700 2.362 2.321 2.385 . 0 0 "[ . 1 . 2]" 1
503 1 13 LEU HA 1 13 LEU MD1 . . 3.200 1.961 1.927 2.092 . 0 0 "[ . 1 . 2]" 1
504 1 13 LEU HB3 1 14 ASP H . . 3.300 2.771 2.689 2.922 . 0 0 "[ . 1 . 2]" 1
505 1 13 LEU MD1 1 16 TRP HD1 . . 3.800 2.114 1.871 2.409 . 0 0 "[ . 1 . 2]" 1
506 1 13 LEU MD1 1 17 GLU H . . 3.800 2.709 2.452 2.883 . 0 0 "[ . 1 . 2]" 1
507 1 15 LYS H 1 88 VAL MG1 . . 5.500 3.820 3.476 4.077 . 0 0 "[ . 1 . 2]" 1
508 1 16 TRP HB3 1 17 GLU H . . 3.300 2.521 2.356 2.827 . 0 0 "[ . 1 . 2]" 1
509 1 16 TRP HB2 1 17 GLU H . . 5.000 3.917 3.812 4.085 . 0 0 "[ . 1 . 2]" 1
510 1 16 TRP HA 1 19 ILE MD . . 3.800 2.572 1.873 3.233 . 0 0 "[ . 1 . 2]" 1
511 1 16 TRP HE3 1 19 ILE MD . . 5.500 3.344 2.708 4.174 . 0 0 "[ . 1 . 2]" 1
512 1 16 TRP HE1 1 30 LYS H . . 3.300 2.850 2.584 3.210 . 0 0 "[ . 1 . 2]" 1
513 1 16 TRP HE1 1 30 LYS HA . . 5.000 3.255 3.090 3.446 . 0 0 "[ . 1 . 2]" 1
514 1 16 TRP HD1 1 30 LYS HA . . 5.000 3.644 3.468 3.760 . 0 0 "[ . 1 . 2]" 1
515 1 16 TRP HE1 1 31 LEU H . . 5.000 4.050 3.929 4.161 . 0 0 "[ . 1 . 2]" 1
516 1 16 TRP HE1 1 31 LEU HA . . 3.300 3.250 3.154 3.319 0.019 1 0 "[ . 1 . 2]" 1
517 1 16 TRP HE1 1 31 LEU MD1 . . 5.500 3.538 3.304 3.669 . 0 0 "[ . 1 . 2]" 1
518 1 16 TRP HD1 1 31 LEU MD1 . . 5.500 2.791 2.428 3.240 . 0 0 "[ . 1 . 2]" 1
519 1 16 TRP HE1 1 32 LYS H . . 5.000 4.917 4.813 5.003 0.003 10 0 "[ . 1 . 2]" 1
520 1 16 TRP HZ2 1 34 ILE H . . 5.000 3.705 3.412 3.882 . 0 0 "[ . 1 . 2]" 1
521 1 16 TRP HE1 1 34 ILE MD . . 3.800 3.013 2.961 3.075 . 0 0 "[ . 1 . 2]" 1
522 1 16 TRP HZ2 1 34 ILE MD . . 5.500 4.065 3.984 4.194 . 0 0 "[ . 1 . 2]" 1
523 1 16 TRP HE1 1 34 ILE HG13 . . 5.000 1.955 1.940 1.982 . 0 0 "[ . 1 . 2]" 1
524 1 16 TRP HE1 1 34 ILE HG12 . . 3.300 3.340 3.324 3.364 0.064 18 0 "[ . 1 . 2]" 1
525 1 16 TRP HE1 1 34 ILE H . . 5.000 3.357 3.274 3.419 . 0 0 "[ . 1 . 2]" 1
526 1 16 TRP HH2 1 84 VAL MG1 . . 5.500 3.759 3.662 3.922 . 0 0 "[ . 1 . 2]" 1
527 1 16 TRP HE3 1 84 VAL MG1 . . 5.500 1.901 1.828 1.953 . 0 0 "[ . 1 . 2]" 1
528 1 16 TRP HE3 1 85 LEU HA . . 5.000 3.082 2.849 3.301 . 0 0 "[ . 1 . 2]" 1
529 1 16 TRP H 1 88 VAL MG2 . . 3.800 2.827 2.750 3.004 . 0 0 "[ . 1 . 2]" 1
530 1 16 TRP H 1 88 VAL MG1 . . 3.800 2.860 2.630 3.020 . 0 0 "[ . 1 . 2]" 1
531 1 16 TRP HA 1 88 VAL MG2 . . 3.800 2.194 2.014 2.413 . 0 0 "[ . 1 . 2]" 1
532 1 16 TRP HE3 1 88 VAL MG2 . . 3.200 2.383 2.235 2.569 . 0 0 "[ . 1 . 2]" 1
533 1 16 TRP HE3 1 88 VAL MG1 . . 5.500 4.059 3.839 4.319 . 0 0 "[ . 1 . 2]" 1
534 1 19 ILE MG 1 29 TYR QE . . 6.100 2.670 1.768 3.481 . 0 0 "[ . 1 . 2]" 1
535 1 19 ILE MG 1 29 TYR H . . 5.500 4.219 3.718 4.480 . 0 0 "[ . 1 . 2]" 1
536 1 19 ILE MG 1 84 VAL MG1 . . 3.700 2.042 1.899 2.241 . 0 0 "[ . 1 . 2]" 1
537 1 19 ILE MG 1 84 VAL MG2 . . 4.300 2.221 1.910 2.524 . 0 0 "[ . 1 . 2]" 1
538 1 19 ILE MD 1 84 VAL MG1 . . 3.700 1.829 1.613 2.071 . 0 0 "[ . 1 . 2]" 1
539 1 19 ILE MD 1 84 VAL MG2 . . 6.000 3.124 2.750 3.690 . 0 0 "[ . 1 . 2]" 1
540 1 19 ILE MG 1 97 THR H . . 3.800 3.160 2.968 3.266 . 0 0 "[ . 1 . 2]" 1
541 1 19 ILE MD 1 94 VAL QG . . 7.000 1.919 1.667 2.452 . 0 0 "[ . 1 . 2]" 1
542 1 21 LEU H 1 21 LEU HG . . 2.700 2.365 1.933 2.704 0.004 14 0 "[ . 1 . 2]" 1
543 1 21 LEU MD1 1 22 ARG H . . 5.500 3.647 2.469 3.848 . 0 0 "[ . 1 . 2]" 1
544 1 21 LEU MD2 1 22 ARG H . . 5.500 4.165 3.500 4.513 . 0 0 "[ . 1 . 2]" 1
545 1 21 LEU HB2 1 22 ARG H . . 3.300 2.011 1.857 2.721 . 0 0 "[ . 1 . 2]" 1
546 1 21 LEU MD2 1 27 LYS H . . 5.500 4.473 2.491 4.671 . 0 0 "[ . 1 . 2]" 1
547 1 21 LEU MD2 1 28 GLN HA . . 5.500 2.635 1.982 3.832 . 0 0 "[ . 1 . 2]" 1
548 1 21 LEU MD2 1 28 GLN H . . 5.500 4.053 2.720 4.541 . 0 0 "[ . 1 . 2]" 1
549 1 21 LEU MD1 1 28 GLN H . . 5.500 3.573 1.954 4.549 . 0 0 "[ . 1 . 2]" 1
550 1 21 LEU MD2 1 29 TYR HA . . 5.500 2.430 1.960 3.615 . 0 0 "[ . 1 . 2]" 1
551 1 21 LEU MD1 1 29 TYR HA . . 3.800 2.729 2.095 2.995 . 0 0 "[ . 1 . 2]" 1
552 1 21 LEU MD2 1 29 TYR H . . 5.500 2.538 2.177 3.637 . 0 0 "[ . 1 . 2]" 1
553 1 21 LEU MD1 1 29 TYR H . . 5.500 4.065 3.276 4.353 . 0 0 "[ . 1 . 2]" 1
554 1 21 LEU MD1 1 30 LYS H . . 5.500 4.321 4.072 4.454 . 0 0 "[ . 1 . 2]" 1
555 1 21 LEU MD2 1 33 HIS HE1 . . 5.500 4.328 3.989 4.477 . 0 0 "[ . 1 . 2]" 1
556 1 21 LEU MD1 1 33 HIS HE1 . . 5.500 2.388 2.056 2.688 . 0 0 "[ . 1 . 2]" 1
557 1 29 TYR H 1 29 TYR HD2 . . 5.000 3.731 3.273 4.079 . 0 0 "[ . 1 . 2]" 1
558 1 29 TYR HA 1 33 HIS HE1 . . 5.000 4.352 3.369 4.995 . 0 0 "[ . 1 . 2]" 1
559 1 29 TYR QE 1 81 THR HA . . 7.300 3.290 2.831 3.762 . 0 0 "[ . 1 . 2]" 1
560 1 29 TYR QE 1 81 THR MG . . 6.100 2.985 2.336 4.331 . 0 0 "[ . 1 . 2]" 1
561 1 29 TYR QE 1 84 VAL MG1 . . 7.800 2.748 1.969 3.721 . 0 0 "[ . 1 . 2]" 1
562 1 29 TYR QE 1 84 VAL MG2 . . 6.100 2.314 1.956 2.932 . 0 0 "[ . 1 . 2]" 1
563 1 31 LEU H 1 31 LEU MD1 . . 3.800 2.917 2.801 3.058 . 0 0 "[ . 1 . 2]" 1
564 1 31 LEU HA 1 31 LEU MD1 . . 3.800 1.952 1.907 2.020 . 0 0 "[ . 1 . 2]" 1
565 1 31 LEU H 1 31 LEU QB . . 3.500 2.117 1.964 2.374 . 0 0 "[ . 1 . 2]" 1
566 1 31 LEU HA 1 34 ILE MD . . 3.800 2.993 2.940 3.024 . 0 0 "[ . 1 . 2]" 1
567 1 31 LEU MD1 1 34 ILE MD . . 3.700 2.146 1.990 2.346 . 0 0 "[ . 1 . 2]" 1
568 1 31 LEU MD1 1 34 ILE QG . . 6.300 3.195 3.079 3.320 . 0 0 "[ . 1 . 2]" 1
569 1 34 ILE H 1 34 ILE HB . . 2.700 2.265 2.235 2.294 . 0 0 "[ . 1 . 2]" 1
570 1 34 ILE HB 1 35 VAL H . . 3.300 2.622 2.586 2.657 . 0 0 "[ . 1 . 2]" 1
571 1 34 ILE MG 1 35 VAL H . . 3.800 3.168 3.039 3.236 . 0 0 "[ . 1 . 2]" 1
572 1 34 ILE MG 1 35 VAL MG2 . . 6.000 3.465 3.335 3.615 . 0 0 "[ . 1 . 2]" 1
573 1 34 ILE MG 1 35 VAL HA . . 5.500 3.278 3.098 3.377 . 0 0 "[ . 1 . 2]" 1
574 1 34 ILE HA 1 81 THR MG . . 5.500 2.927 2.698 3.224 . 0 0 "[ . 1 . 2]" 1
575 1 34 ILE H 1 81 THR MG . . 5.500 4.482 4.271 4.640 . 0 0 "[ . 1 . 2]" 1
576 1 34 ILE MD 1 85 LEU MD2 . . 4.300 2.395 2.146 2.559 . 0 0 "[ . 1 . 2]" 1
577 1 34 ILE MD 1 85 LEU MD1 . . 4.300 2.121 1.875 2.658 . 0 0 "[ . 1 . 2]" 1
578 1 35 VAL HA 1 35 VAL MG2 . . 3.200 2.127 2.026 2.258 . 0 0 "[ . 1 . 2]" 1
579 1 35 VAL H 1 35 VAL MG2 . . 3.200 2.554 2.440 2.633 . 0 0 "[ . 1 . 2]" 1
580 1 35 VAL H 1 35 VAL HB . . 2.700 2.160 2.147 2.169 . 0 0 "[ . 1 . 2]" 1
581 1 35 VAL MG1 1 36 TRP H . . 3.800 2.991 2.929 3.066 . 0 0 "[ . 1 . 2]" 1
582 1 36 TRP HZ2 1 74 GLU QG . . 5.800 3.104 1.933 4.262 . 0 0 "[ . 1 . 2]" 1
583 1 36 TRP HH2 1 78 LEU MD2 . . 5.500 4.176 3.869 4.424 . 0 0 "[ . 1 . 2]" 1
584 1 36 TRP HH2 1 78 LEU HA . . 5.000 3.058 2.702 4.517 . 0 0 "[ . 1 . 2]" 1
585 1 37 ALA MB 1 38 SER H . . 3.200 2.451 2.363 2.546 . 0 0 "[ . 1 . 2]" 1
586 1 37 ALA MB 1 78 LEU MD2 . . 3.700 2.337 2.214 2.449 . 0 0 "[ . 1 . 2]" 1
587 1 37 ALA HA 1 78 LEU MD2 . . 3.200 2.000 1.781 2.210 . 0 0 "[ . 1 . 2]" 1
588 1 37 ALA MB 1 81 THR MG . . 4.300 1.852 1.654 2.132 . 0 0 "[ . 1 . 2]" 1
589 1 37 ALA MB 1 81 THR HB . . 5.500 2.761 2.427 3.434 . 0 0 "[ . 1 . 2]" 1
590 1 38 SER H 1 51 LEU MD2 . . 3.800 2.766 2.388 3.007 . 0 0 "[ . 1 . 2]" 1
591 1 38 SER H 1 51 LEU MD1 . . 5.500 4.413 4.281 4.550 . 0 0 "[ . 1 . 2]" 1
592 1 38 SER HA 1 51 LEU MD2 . . 3.800 2.392 1.907 2.744 . 0 0 "[ . 1 . 2]" 1
593 1 38 SER H 1 78 LEU MD2 . . 5.500 4.563 4.521 4.621 . 0 0 "[ . 1 . 2]" 1
594 1 40 GLU QB 1 78 LEU MD2 . . 6.300 2.305 2.129 2.557 . 0 0 "[ . 1 . 2]" 1
595 1 41 LEU HA 1 41 LEU MD2 . . 3.200 2.127 1.895 2.457 . 0 0 "[ . 1 . 2]" 1
596 1 41 LEU H 1 41 LEU HG . . 3.300 2.251 2.137 2.503 . 0 0 "[ . 1 . 2]" 1
597 1 41 LEU HA 1 46 VAL HB . . 5.000 4.608 4.403 4.849 . 0 0 "[ . 1 . 2]" 1
598 1 41 LEU MD2 1 46 VAL HB . . 5.500 4.324 4.277 4.409 . 0 0 "[ . 1 . 2]" 1
599 1 41 LEU HA 1 46 VAL MG1 . . 5.500 2.297 2.076 2.599 . 0 0 "[ . 1 . 2]" 1
600 1 41 LEU MD1 1 48 PRO HA . . 3.800 2.834 2.683 2.984 . 0 0 "[ . 1 . 2]" 1
601 1 41 LEU MD1 1 48 PRO HB3 . . 5.500 4.024 3.755 4.345 . 0 0 "[ . 1 . 2]" 1
602 1 41 LEU MD2 1 60 ILE HA . . 5.500 4.361 4.049 4.577 . 0 0 "[ . 1 . 2]" 1
603 1 41 LEU H 1 78 LEU MD2 . . 5.500 3.824 3.647 4.089 . 0 0 "[ . 1 . 2]" 1
604 1 44 PHE H 1 44 PHE HB2 . . 2.700 2.200 1.941 2.659 . 0 0 "[ . 1 . 2]" 1
605 1 44 PHE HB3 1 46 VAL MG1 . . 3.800 2.235 1.976 2.700 . 0 0 "[ . 1 . 2]" 1
606 1 44 PHE HB2 1 46 VAL MG1 . . 5.500 3.245 1.988 3.835 . 0 0 "[ . 1 . 2]" 1
607 1 46 VAL HA 1 46 VAL MG2 . . 3.200 2.223 2.125 2.365 . 0 0 "[ . 1 . 2]" 1
608 1 46 VAL H 1 46 VAL MG1 . . 3.200 2.308 2.148 2.424 . 0 0 "[ . 1 . 2]" 1
609 1 46 VAL H 1 46 VAL HB . . 3.300 2.931 2.788 3.012 . 0 0 "[ . 1 . 2]" 1
610 1 46 VAL MG2 1 60 ILE MD . . 4.300 2.479 2.219 2.598 . 0 0 "[ . 1 . 2]" 1
611 1 47 ASN HA 1 49 GLY H . . 5.000 3.725 3.650 3.802 . 0 0 "[ . 1 . 2]" 1
612 1 47 ASN QB 1 49 GLY H . . 5.800 2.649 2.435 3.384 . 0 0 "[ . 1 . 2]" 1
613 1 47 ASN QB 1 50 LEU MD1 . . 6.300 2.676 2.449 2.913 . 0 0 "[ . 1 . 2]" 1
614 1 47 ASN H 1 50 LEU MD1 . . 3.800 2.879 2.720 3.008 . 0 0 "[ . 1 . 2]" 1
615 1 47 ASN QB 1 50 LEU H . . 5.800 3.034 2.888 3.345 . 0 0 "[ . 1 . 2]" 1
616 1 48 PRO HG2 1 49 GLY H . . 3.300 3.320 3.317 3.323 0.023 14 0 "[ . 1 . 2]" 1
617 1 48 PRO HD2 1 49 GLY H . . 3.300 2.357 2.356 2.359 . 0 0 "[ . 1 . 2]" 1
618 1 50 LEU HA 1 50 LEU MD2 . . 3.200 2.041 1.950 2.187 . 0 0 "[ . 1 . 2]" 1
619 1 50 LEU H 1 50 LEU HB2 . . 3.300 2.503 2.444 2.574 . 0 0 "[ . 1 . 2]" 1
620 1 50 LEU H 1 50 LEU HG . . 3.300 2.255 2.148 2.350 . 0 0 "[ . 1 . 2]" 1
621 1 50 LEU MD2 1 51 LEU H . . 5.500 4.516 4.481 4.549 . 0 0 "[ . 1 . 2]" 1
622 1 50 LEU HA 1 56 GLY HA3 . . 5.000 2.073 2.000 2.252 . 0 0 "[ . 1 . 2]" 1
623 1 50 LEU HA 1 56 GLY HA2 . . 5.000 3.551 3.374 3.929 . 0 0 "[ . 1 . 2]" 1
624 1 50 LEU MD2 1 56 GLY HA3 . . 3.800 2.499 1.972 2.769 . 0 0 "[ . 1 . 2]" 1
625 1 50 LEU MD2 1 56 GLY HA2 . . 3.800 2.733 2.509 2.832 . 0 0 "[ . 1 . 2]" 1
626 1 51 LEU H 1 51 LEU HB3 . . 3.300 2.380 2.116 2.943 . 0 0 "[ . 1 . 2]" 1
627 1 51 LEU HA 1 51 LEU MD1 . . 3.200 2.454 1.837 2.565 . 0 0 "[ . 1 . 2]" 1
628 1 51 LEU HB3 1 52 GLU H . . 5.000 3.432 3.218 3.717 . 0 0 "[ . 1 . 2]" 1
629 1 51 LEU HA 1 60 ILE MD . . 5.500 4.114 3.838 4.466 . 0 0 "[ . 1 . 2]" 1
630 1 51 LEU MD1 1 85 LEU MD2 . . 4.300 1.890 1.658 2.703 . 0 0 "[ . 1 . 2]" 1
631 1 51 LEU MD1 1 85 LEU MD1 . . 6.000 3.602 3.215 4.037 . 0 0 "[ . 1 . 2]" 1
632 1 51 LEU MD2 1 85 LEU MD2 . . 6.000 2.915 2.392 3.792 . 0 0 "[ . 1 . 2]" 1
633 1 52 GLU QB 1 53 THR MG . . 4.600 2.383 2.259 2.496 . 0 0 "[ . 1 . 2]" 1
634 1 53 THR H 1 53 THR MG . . 3.200 2.447 2.364 2.578 . 0 0 "[ . 1 . 2]" 1
635 1 53 THR HA 1 53 THR MG . . 3.200 2.615 2.567 2.644 . 0 0 "[ . 1 . 2]" 1
636 1 53 THR HB 1 54 SER H . . 3.300 2.896 2.742 3.072 . 0 0 "[ . 1 . 2]" 1
637 1 54 SER HA 1 86 TYR QD . . 5.000 4.076 3.743 4.581 . 0 0 "[ . 1 . 2]" 1
638 1 54 SER HA 1 86 TYR QE . . 5.000 4.890 4.604 4.981 . 0 0 "[ . 1 . 2]" 1
639 1 54 SER QB 1 86 TYR QD . . 5.800 4.275 3.610 5.045 . 0 0 "[ . 1 . 2]" 1
640 1 54 SER QB 1 86 TYR QE . . 5.800 4.350 3.637 4.963 . 0 0 "[ . 1 . 2]" 1
641 1 54 SER H 1 89 HIS QB . . 5.800 4.146 3.557 4.567 . 0 0 "[ . 1 . 2]" 1
642 1 54 SER HA 1 89 HIS QB . . 5.800 3.479 3.217 3.850 . 0 0 "[ . 1 . 2]" 1
643 1 57 CYS HB2 1 86 TYR QD . . 5.000 3.825 2.479 4.830 . 0 0 "[ . 1 . 2]" 1
644 1 57 CYS HB3 1 86 TYR QD . . 5.000 3.034 2.142 4.983 . 0 0 "[ . 1 . 2]" 1
645 1 57 CYS HA 1 60 ILE MD . . 3.800 2.485 2.078 2.801 . 0 0 "[ . 1 . 2]" 1
646 1 58 ARG H 1 86 TYR QD . . 5.000 3.738 3.356 4.052 . 0 0 "[ . 1 . 2]" 1
647 1 59 GLN H 1 60 ILE MD . . 5.500 3.782 3.649 3.908 . 0 0 "[ . 1 . 2]" 1
648 1 60 ILE H 1 60 ILE MD . . 3.800 2.374 2.133 2.533 . 0 0 "[ . 1 . 2]" 1
649 1 60 ILE HA 1 60 ILE MD . . 3.800 3.067 2.855 3.137 . 0 0 "[ . 1 . 2]" 1
650 1 60 ILE H 1 60 ILE HB . . 3.300 2.119 2.060 2.155 . 0 0 "[ . 1 . 2]" 1
651 1 60 ILE MG 1 61 LEU H . . 3.800 2.148 1.957 2.381 . 0 0 "[ . 1 . 2]" 1
652 1 60 ILE HB 1 61 LEU H . . 3.800 2.432 2.358 2.559 . 0 0 "[ . 1 . 2]" 1
653 1 61 LEU HA 1 61 LEU MD1 . . 3.200 2.317 2.226 2.440 . 0 0 "[ . 1 . 2]" 1
654 1 61 LEU HB3 1 62 GLY H . . 3.300 2.879 2.789 3.076 . 0 0 "[ . 1 . 2]" 1
655 1 61 LEU HA 1 64 LEU MD2 . . 5.500 2.727 2.634 2.852 . 0 0 "[ . 1 . 2]" 1
656 1 61 LEU HA 1 79 TYR HE2 . . 5.000 3.733 3.323 4.238 . 0 0 "[ . 1 . 2]" 1
657 1 61 LEU MD1 1 79 TYR HE2 . . 3.800 2.932 2.754 3.033 . 0 0 "[ . 1 . 2]" 1
658 1 61 LEU MD1 1 79 TYR HD2 . . 5.500 2.831 2.694 2.943 . 0 0 "[ . 1 . 2]" 1
659 1 61 LEU MD1 1 79 TYR HA . . 3.800 2.982 2.788 3.118 . 0 0 "[ . 1 . 2]" 1
660 1 61 LEU MD1 1 82 ILE HB . . 3.800 2.416 2.208 2.782 . 0 0 "[ . 1 . 2]" 1
661 1 61 LEU MD1 1 83 ALA HA . . 5.500 2.613 2.445 2.728 . 0 0 "[ . 1 . 2]" 1
662 1 61 LEU MD2 1 83 ALA HA . . 3.800 2.051 1.955 2.226 . 0 0 "[ . 1 . 2]" 1
663 1 61 LEU MD1 1 83 ALA H . . 3.200 2.550 2.459 2.624 . 0 0 "[ . 1 . 2]" 1
664 1 61 LEU MD2 1 83 ALA H . . 5.500 3.883 3.749 4.073 . 0 0 "[ . 1 . 2]" 1
665 1 61 LEU MD2 1 83 ALA MB . . 4.300 2.478 2.281 2.652 . 0 0 "[ . 1 . 2]" 1
666 1 61 LEU MD1 1 83 ALA MB . . 3.700 2.082 1.955 2.262 . 0 0 "[ . 1 . 2]" 1
667 1 61 LEU MD2 1 86 TYR H . . 5.500 4.350 4.205 4.465 . 0 0 "[ . 1 . 2]" 1
668 1 61 LEU MD2 1 86 TYR HB2 . . 5.500 2.969 2.824 3.125 . 0 0 "[ . 1 . 2]" 1
669 1 61 LEU MD2 1 86 TYR HB3 . . 5.500 3.421 3.028 3.698 . 0 0 "[ . 1 . 2]" 1
670 1 61 LEU MD1 1 86 TYR HB2 . . 5.500 4.380 4.259 4.463 . 0 0 "[ . 1 . 2]" 1
671 1 64 LEU HA 1 64 LEU MD1 . . 3.200 2.157 1.984 2.374 . 0 0 "[ . 1 . 2]" 1
672 1 64 LEU HA 1 75 LEU QD . . 6.500 4.279 4.188 4.465 . 0 0 "[ . 1 . 2]" 1
673 1 64 LEU MD1 1 75 LEU QD . . 5.300 2.351 2.126 2.971 . 0 0 "[ . 1 . 2]" 1
674 1 64 LEU MD1 1 78 LEU MD1 . . 3.700 2.298 2.209 2.443 . 0 0 "[ . 1 . 2]" 1
675 1 64 LEU MD2 1 79 TYR H . . 3.800 2.926 2.895 2.950 . 0 0 "[ . 1 . 2]" 1
676 1 64 LEU MD2 1 79 TYR HD2 . . 5.500 1.956 1.949 1.963 . 0 0 "[ . 1 . 2]" 1
677 1 64 LEU MD1 1 79 TYR HD2 . . 5.500 3.829 3.634 4.316 . 0 0 "[ . 1 . 2]" 1
678 1 64 LEU MD2 1 79 TYR HA . . 3.800 1.894 1.836 2.104 . 0 0 "[ . 1 . 2]" 1
679 1 64 LEU MD2 1 82 ILE MD . . 3.800 2.080 1.697 2.351 . 0 0 "[ . 1 . 2]" 1
680 1 64 LEU MD1 1 82 ILE MD . . 5.500 3.455 3.073 3.703 . 0 0 "[ . 1 . 2]" 1
681 1 65 GLN H 1 65 GLN HB2 . . 3.300 2.212 2.183 2.234 . 0 0 "[ . 1 . 2]" 1
682 1 65 GLN H 1 65 GLN HB3 . . 2.700 2.773 2.741 2.810 0.110 4 0 "[ . 1 . 2]" 1
683 1 65 GLN H 1 65 GLN HA . . 2.700 2.722 2.709 2.730 0.030 20 0 "[ . 1 . 2]" 1
684 1 65 GLN H 1 66 PRO HD2 . . 3.300 2.317 2.297 2.351 . 0 0 "[ . 1 . 2]" 1
685 1 65 GLN H 1 66 PRO HD3 . . 5.000 2.460 2.434 2.503 . 0 0 "[ . 1 . 2]" 1
686 1 65 GLN HG2 1 79 TYR HE2 . . 3.300 3.289 3.150 3.323 0.023 15 0 "[ . 1 . 2]" 1
687 1 65 GLN HB3 1 79 TYR HE2 . . 5.000 4.388 4.257 4.569 . 0 0 "[ . 1 . 2]" 1
688 1 65 GLN H 1 79 TYR HE2 . . 3.300 3.041 2.764 3.325 0.025 10 0 "[ . 1 . 2]" 1
689 1 65 GLN H 1 79 TYR HD2 . . 5.000 4.035 3.984 4.096 . 0 0 "[ . 1 . 2]" 1
690 1 65 GLN HA 1 79 TYR HE2 . . 3.300 2.448 2.278 2.646 . 0 0 "[ . 1 . 2]" 1
691 1 67 SER H 1 68 LEU HG . . 5.000 4.771 4.641 4.815 . 0 0 "[ . 1 . 2]" 1
692 1 67 SER H 1 68 LEU HB2 . . 5.000 4.431 4.409 4.477 . 0 0 "[ . 1 . 2]" 1
693 1 67 SER QB 1 75 LEU QD . . 5.300 2.651 2.407 3.111 . 0 0 "[ . 1 . 2]" 1
694 1 68 LEU H 1 68 LEU HG . . 3.300 3.085 2.978 3.125 . 0 0 "[ . 1 . 2]" 1
695 1 68 LEU HB2 1 69 GLN H . . 3.300 2.902 2.850 2.931 . 0 0 "[ . 1 . 2]" 1
696 1 68 LEU H 1 68 LEU HB2 . . 3.300 2.093 2.081 2.129 . 0 0 "[ . 1 . 2]" 1
697 1 68 LEU H 1 68 LEU HB3 . . 3.300 3.401 3.389 3.434 0.134 11 0 "[ . 1 . 2]" 1
698 1 68 LEU MD2 1 69 GLN H . . 5.500 4.598 4.580 4.614 . 0 0 "[ . 1 . 2]" 1
699 1 68 LEU HA 1 75 LEU QD . . 4.800 2.373 1.901 2.846 . 0 0 "[ . 1 . 2]" 1
700 1 68 LEU H 1 75 LEU QD . . 6.500 4.017 3.794 4.352 . 0 0 "[ . 1 . 2]" 1
701 1 68 LEU MD2 1 75 LEU QD . . 4.700 1.823 1.658 1.992 . 0 0 "[ . 1 . 2]" 1
702 1 68 LEU MD2 1 76 ARG HA . . 3.200 1.770 1.751 1.808 . 0 0 "[ . 1 . 2]" 1
703 1 68 LEU MD2 1 76 ARG QB . . 4.600 3.035 2.960 3.376 . 0 0 "[ . 1 . 2]" 1
704 1 68 LEU MD2 1 79 TYR H . . 3.800 3.011 2.987 3.160 . 0 0 "[ . 1 . 2]" 1
705 1 68 LEU MD1 1 79 TYR HD2 . . 3.800 2.561 2.439 2.793 . 0 0 "[ . 1 . 2]" 1
706 1 68 LEU MD1 1 79 TYR HE2 . . 3.800 2.791 2.701 2.828 . 0 0 "[ . 1 . 2]" 1
707 1 68 LEU MD2 1 79 TYR HD2 . . 3.800 3.093 3.021 3.118 . 0 0 "[ . 1 . 2]" 1
708 1 68 LEU MD2 1 79 TYR HB3 . . 3.800 1.989 1.919 2.177 . 0 0 "[ . 1 . 2]" 1
709 1 68 LEU MD2 1 79 TYR HB2 . . 3.800 1.960 1.889 2.111 . 0 0 "[ . 1 . 2]" 1
710 1 68 LEU MD1 1 79 TYR HB2 . . 5.500 2.833 2.665 3.217 . 0 0 "[ . 1 . 2]" 1
711 1 70 THR H 1 70 THR MG . . 3.200 2.424 2.398 2.523 . 0 0 "[ . 1 . 2]" 1
712 1 70 THR MG 1 71 GLY H . . 3.800 2.836 2.821 2.861 . 0 0 "[ . 1 . 2]" 1
713 1 70 THR H 1 75 LEU QD . . 6.500 4.236 4.065 4.509 . 0 0 "[ . 1 . 2]" 1
714 1 71 GLY HA3 1 75 LEU QD . . 6.500 1.976 1.831 2.099 . 0 0 "[ . 1 . 2]" 1
715 1 71 GLY HA2 1 75 LEU QD . . 6.500 2.134 1.850 3.231 . 0 0 "[ . 1 . 2]" 1
716 1 71 GLY H 1 75 LEU QD . . 4.800 3.240 2.966 3.508 . 0 0 "[ . 1 . 2]" 1
717 1 72 SER H 1 75 LEU QD . . 4.800 2.819 1.921 3.157 . 0 0 "[ . 1 . 2]" 1
718 1 72 SER H 1 75 LEU QB . . 4.100 2.046 1.932 2.130 . 0 0 "[ . 1 . 2]" 1
719 1 75 LEU HA 1 75 LEU QD . . 4.200 2.889 2.004 3.029 . 0 0 "[ . 1 . 2]" 1
720 1 77 SER HB3 1 78 LEU H . . 3.300 3.067 2.756 3.299 . 0 0 "[ . 1 . 2]" 1
721 1 78 LEU HA 1 78 LEU MD2 . . 3.200 2.129 1.965 2.279 . 0 0 "[ . 1 . 2]" 1
722 1 78 LEU HB3 1 79 TYR H . . 3.300 2.760 2.680 2.879 . 0 0 "[ . 1 . 2]" 1
723 1 79 TYR HE1 1 83 ALA MB . . 5.500 2.629 2.486 2.979 . 0 0 "[ . 1 . 2]" 1
724 1 79 TYR HD1 1 83 ALA MB . . 6.600 3.026 2.913 3.254 . 0 0 "[ . 1 . 2]" 1
725 1 79 TYR HE1 1 101 LEU MD1 . . 3.200 2.020 1.778 2.298 . 0 0 "[ . 1 . 2]" 1
726 1 79 TYR HD1 1 101 LEU MD1 . . 3.800 2.773 2.388 3.047 . 0 0 "[ . 1 . 2]" 1
727 1 80 ASN HB3 1 97 THR MG . . 3.800 2.450 1.876 3.208 . 0 0 "[ . 1 . 2]" 1
728 1 80 ASN HB2 1 97 THR MG . . 3.800 2.577 1.795 3.205 . 0 0 "[ . 1 . 2]" 1
729 1 80 ASN HA 1 97 THR MG . . 3.800 3.180 2.883 3.293 . 0 0 "[ . 1 . 2]" 1
730 1 80 ASN HA 1 101 LEU MD2 . . 5.500 3.745 2.114 4.258 . 0 0 "[ . 1 . 2]" 1
731 1 80 ASN HA 1 101 LEU MD1 . . 3.800 2.516 2.078 3.020 . 0 0 "[ . 1 . 2]" 1
732 1 81 THR HB 1 82 ILE H . . 3.300 2.614 2.537 2.721 . 0 0 "[ . 1 . 2]" 1
733 1 81 THR HB 1 83 ALA H . . 5.000 4.907 4.770 5.017 0.017 3 0 "[ . 1 . 2]" 1
734 1 82 ILE HB 1 83 ALA H . . 3.300 2.874 2.726 3.352 0.052 20 0 "[ . 1 . 2]" 1
735 1 82 ILE MD 1 83 ALA H . . 5.500 4.328 3.544 4.490 . 0 0 "[ . 1 . 2]" 1
736 1 82 ILE MG 1 83 ALA H . . 5.500 3.557 3.400 4.222 . 0 0 "[ . 1 . 2]" 1
737 1 83 ALA MB 1 100 ALA MB . . 6.000 2.700 2.565 2.815 . 0 0 "[ . 1 . 2]" 1
738 1 83 ALA MB 1 101 LEU HA . . 5.500 3.273 3.136 3.396 . 0 0 "[ . 1 . 2]" 1
739 1 83 ALA MB 1 101 LEU MD1 . . 3.700 2.131 2.012 2.461 . 0 0 "[ . 1 . 2]" 1
740 1 83 ALA MB 1 101 LEU MD2 . . 6.000 3.896 1.698 4.222 . 0 0 "[ . 1 . 2]" 1
741 1 83 ALA HA 1 104 ILE MD . . 3.800 2.316 2.016 2.674 . 0 0 "[ . 1 . 2]" 1
742 1 83 ALA MB 1 104 ILE MD . . 3.700 1.645 1.595 1.680 . 0 0 "[ . 1 . 2]" 1
743 1 83 ALA HA 1 104 ILE MG . . 5.500 3.435 3.099 3.711 . 0 0 "[ . 1 . 2]" 1
744 1 83 ALA MB 1 104 ILE MG . . 6.000 2.865 2.691 3.030 . 0 0 "[ . 1 . 2]" 1
745 1 84 VAL H 1 84 VAL MG2 . . 3.200 2.470 2.366 2.544 . 0 0 "[ . 1 . 2]" 1
746 1 84 VAL HA 1 84 VAL MG2 . . 3.200 2.233 2.137 2.293 . 0 0 "[ . 1 . 2]" 1
747 1 84 VAL H 1 84 VAL HB . . 2.700 2.163 2.131 2.234 . 0 0 "[ . 1 . 2]" 1
748 1 84 VAL MG1 1 85 LEU H . . 3.800 3.054 3.013 3.253 . 0 0 "[ . 1 . 2]" 1
749 1 84 VAL MG1 1 88 VAL MG2 . . 4.300 2.319 1.955 2.611 . 0 0 "[ . 1 . 2]" 1
750 1 84 VAL MG2 1 97 THR HA . . 3.200 1.810 1.777 1.839 . 0 0 "[ . 1 . 2]" 1
751 1 84 VAL MG2 1 100 ALA MB . . 4.300 1.680 1.633 1.795 . 0 0 "[ . 1 . 2]" 1
752 1 84 VAL H 1 100 ALA MB . . 3.800 3.242 3.192 3.318 . 0 0 "[ . 1 . 2]" 1
753 1 84 VAL HA 1 100 ALA MB . . 3.200 1.944 1.789 2.202 . 0 0 "[ . 1 . 2]" 1
754 1 85 LEU HA 1 85 LEU MD1 . . 3.200 2.414 1.895 2.607 . 0 0 "[ . 1 . 2]" 1
755 1 85 LEU H 1 85 LEU HB2 . . 2.700 1.987 1.978 2.076 . 0 0 "[ . 1 . 2]" 1
756 1 85 LEU HB2 1 86 TYR H . . 3.300 3.285 3.113 3.329 0.029 5 0 "[ . 1 . 2]" 1
757 1 86 TYR HB3 1 87 CYS H . . 3.300 2.360 2.116 2.672 . 0 0 "[ . 1 . 2]" 1
758 1 86 TYR QD 1 87 CYS H . . 5.000 3.696 2.964 4.045 . 0 0 "[ . 1 . 2]" 1
759 1 86 TYR QE 1 92 ILE MD . . 5.500 4.474 4.283 4.544 . 0 0 "[ . 1 . 2]" 1
760 1 86 TYR QD 1 104 ILE MG . . 5.500 2.658 2.337 3.122 . 0 0 "[ . 1 . 2]" 1
761 1 86 TYR QD 1 104 ILE MD . . 5.500 3.923 3.145 4.337 . 0 0 "[ . 1 . 2]" 1
762 1 87 CYS HB2 1 92 ILE HB . . 5.000 3.316 1.962 3.895 . 0 0 "[ . 1 . 2]" 1
763 1 87 CYS HA 1 92 ILE HB . . 5.000 3.054 2.448 3.774 . 0 0 "[ . 1 . 2]" 1
764 1 87 CYS HB2 1 92 ILE H . . 5.000 4.534 3.361 5.035 0.035 17 0 "[ . 1 . 2]" 1
765 1 87 CYS HB3 1 92 ILE H . . 5.000 4.094 3.223 5.055 0.055 20 0 "[ . 1 . 2]" 1
766 1 87 CYS HA 1 92 ILE H . . 5.000 3.529 3.252 3.789 . 0 0 "[ . 1 . 2]" 1
767 1 87 CYS HA 1 92 ILE MD . . 3.800 1.958 1.766 3.248 . 0 0 "[ . 1 . 2]" 1
768 1 87 CYS HA 1 92 ILE MG . . 5.500 4.249 3.617 4.579 . 0 0 "[ . 1 . 2]" 1
769 1 87 CYS HB2 1 92 ILE MG . . 5.500 3.957 1.920 4.483 . 0 0 "[ . 1 . 2]" 1
770 1 87 CYS HB2 1 100 ALA MB . . 5.500 3.074 2.507 4.144 . 0 0 "[ . 1 . 2]" 1
771 1 87 CYS H 1 104 ILE MD . . 5.500 4.363 4.293 4.468 . 0 0 "[ . 1 . 2]" 1
772 1 88 VAL H 1 88 VAL MG2 . . 3.200 2.521 2.238 2.628 . 0 0 "[ . 1 . 2]" 1
773 1 88 VAL HB 1 89 HIS H . . 3.300 2.851 2.715 2.988 . 0 0 "[ . 1 . 2]" 1
774 1 90 GLN HB3 1 92 ILE MD . . 3.800 1.873 1.758 1.946 . 0 0 "[ . 1 . 2]" 1
775 1 91 ARG H 1 92 ILE MD . . 5.500 3.324 3.071 3.779 . 0 0 "[ . 1 . 2]" 1
776 1 91 ARG H 1 92 ILE HB . . 5.000 4.634 4.198 5.031 0.031 17 0 "[ . 1 . 2]" 1
777 1 92 ILE HA 1 92 ILE HG12 . . 3.300 3.216 3.109 3.432 0.132 16 0 "[ . 1 . 2]" 1
778 1 92 ILE H 1 92 ILE MD . . 3.200 2.334 2.244 2.574 . 0 0 "[ . 1 . 2]" 1
779 1 92 ILE H 1 92 ILE HB . . 2.700 2.295 2.106 2.625 . 0 0 "[ . 1 . 2]" 1
780 1 92 ILE MG 1 94 VAL QG . . 5.300 2.161 1.714 2.596 . 0 0 "[ . 1 . 2]" 1
781 1 93 ASP H 1 94 VAL QG . . 6.500 3.887 3.659 4.094 . 0 0 "[ . 1 . 2]" 1
782 1 94 VAL H 1 94 VAL QG . . 4.200 2.069 1.870 2.320 . 0 0 "[ . 1 . 2]" 1
783 1 94 VAL HB 1 96 ASP H . . 5.000 3.722 2.699 4.555 . 0 0 "[ . 1 . 2]" 1
784 1 94 VAL HB 1 100 ALA MB . . 5.500 3.386 3.163 3.555 . 0 0 "[ . 1 . 2]" 1
785 1 94 VAL HB 1 100 ALA H . . 5.000 3.923 3.434 4.384 . 0 0 "[ . 1 . 2]" 1
786 1 94 VAL QG 1 100 ALA HA . . 4.800 2.319 1.900 2.817 . 0 0 "[ . 1 . 2]" 1
787 1 94 VAL QG 1 100 ALA MB . . 5.300 2.528 2.290 2.759 . 0 0 "[ . 1 . 2]" 1
788 1 100 ALA MB 1 104 ILE MD . . 6.000 2.888 2.261 3.377 . 0 0 "[ . 1 . 2]" 1
789 1 100 ALA MB 1 104 ILE MG . . 3.700 2.254 2.139 2.442 . 0 0 "[ . 1 . 2]" 1
790 1 100 ALA HA 1 104 ILE MG . . 5.500 2.826 2.747 2.893 . 0 0 "[ . 1 . 2]" 1
791 1 101 LEU HA 1 101 LEU MD1 . . 3.200 2.097 1.891 2.371 . 0 0 "[ . 1 . 2]" 1
792 1 101 LEU MD1 1 104 ILE MD . . 4.300 2.042 1.869 2.434 . 0 0 "[ . 1 . 2]" 1
793 1 104 ILE HA 1 104 ILE MG . . 3.200 2.475 2.403 2.492 . 0 0 "[ . 1 . 2]" 1
794 1 9 SER OG 1 12 GLU H . . 2.400 2.229 2.216 2.249 . 0 0 "[ . 1 . 2]" 1
795 1 9 SER OG 1 12 GLU N . 2.700 3.200 3.212 3.199 3.232 0.032 15 0 "[ . 1 . 2]" 1
796 1 9 SER O 1 13 LEU H . . 2.400 1.780 1.759 1.800 0.041 16 0 "[ . 1 . 2]" 1
797 1 9 SER O 1 13 LEU N . 2.700 3.200 2.663 2.629 2.678 0.071 18 0 "[ . 1 . 2]" 1
798 1 10 GLY O 1 14 ASP H . . 2.400 2.351 2.319 2.405 0.005 3 0 "[ . 1 . 2]" 1
799 1 10 GLY O 1 14 ASP N . 2.700 3.200 3.249 3.230 3.264 0.064 18 0 "[ . 1 . 2]" 1
800 1 11 GLY O 1 15 LYS H . . 2.400 2.231 2.018 2.437 0.037 15 0 "[ . 1 . 2]" 1
801 1 11 GLY O 1 15 LYS N . 2.700 3.200 3.041 2.852 3.220 0.020 15 0 "[ . 1 . 2]" 1
802 1 12 GLU O 1 16 TRP H . . 2.400 2.048 1.910 2.250 . 0 0 "[ . 1 . 2]" 1
803 1 12 GLU O 1 16 TRP N . 2.700 3.200 2.985 2.875 3.200 . 15 0 "[ . 1 . 2]" 1
804 1 13 LEU O 1 17 GLU H . . 2.400 1.766 1.725 1.806 0.075 4 0 "[ . 1 . 2]" 1
805 1 13 LEU O 1 17 GLU N . 2.700 3.200 2.733 2.675 2.755 0.025 15 0 "[ . 1 . 2]" 1
806 1 14 ASP O 1 18 LYS H . . 2.400 2.402 2.186 2.459 0.059 7 0 "[ . 1 . 2]" 1
807 1 14 ASP O 1 18 LYS N . 2.700 3.200 3.034 2.912 3.164 . 0 0 "[ . 1 . 2]" 1
808 1 19 ILE O 1 29 TYR H . . 2.400 2.334 2.228 2.425 0.025 19 0 "[ . 1 . 2]" 1
809 1 19 ILE O 1 29 TYR N . 2.700 3.200 3.232 3.199 3.280 0.080 19 0 "[ . 1 . 2]" 1
810 1 21 LEU H 1 27 LYS O . . 2.400 2.008 1.787 2.460 0.060 14 0 "[ . 1 . 2]" 1
811 1 21 LEU N 1 27 LYS O . 2.700 3.200 2.946 2.734 3.307 0.107 14 0 "[ . 1 . 2]" 1
812 1 22 ARG O 1 25 GLY H . . 2.400 2.391 2.311 2.493 0.093 11 0 "[ . 1 . 2]" 1
813 1 22 ARG O 1 25 GLY N . 2.700 3.500 3.329 3.257 3.417 . 0 0 "[ . 1 . 2]" 1
814 1 30 LYS O 1 34 ILE H . . 2.400 2.307 2.265 2.357 . 0 0 "[ . 1 . 2]" 1
815 1 30 LYS O 1 34 ILE N . 2.700 3.200 3.202 3.165 3.250 0.050 15 0 "[ . 1 . 2]" 1
816 1 31 LEU O 1 35 VAL H . . 2.400 1.900 1.818 1.958 . 0 0 "[ . 1 . 2]" 1
817 1 31 LEU O 1 35 VAL N . 2.700 3.200 2.868 2.794 2.924 . 0 0 "[ . 1 . 2]" 1
818 1 32 LYS O 1 36 TRP H . . 2.400 2.194 1.941 2.289 . 0 0 "[ . 1 . 2]" 1
819 1 32 LYS O 1 36 TRP N . 2.700 3.200 3.130 2.909 3.208 0.008 19 0 "[ . 1 . 2]" 1
820 1 33 HIS O 1 37 ALA H . . 2.400 2.032 1.815 2.220 . 0 0 "[ . 1 . 2]" 1
821 1 33 HIS O 1 37 ALA N . 2.700 3.200 2.909 2.693 3.053 0.007 1 0 "[ . 1 . 2]" 1
822 1 34 ILE O 1 38 SER H . . 2.400 1.809 1.787 2.020 0.013 20 0 "[ . 1 . 2]" 1
823 1 34 ILE O 1 38 SER N . 2.700 3.200 2.755 2.733 2.931 . 0 0 "[ . 1 . 2]" 1
824 1 35 VAL O 1 39 ARG H . . 2.400 1.862 1.807 2.043 . 0 0 "[ . 1 . 2]" 1
825 1 35 VAL O 1 39 ARG N . 2.700 3.200 2.743 2.693 2.908 0.007 1 0 "[ . 1 . 2]" 1
826 1 36 TRP O 1 40 GLU H . . 2.400 2.070 1.994 2.227 . 0 0 "[ . 1 . 2]" 1
827 1 36 TRP O 1 40 GLU N . 2.700 3.200 2.941 2.879 3.086 . 0 0 "[ . 1 . 2]" 1
828 1 37 ALA O 1 41 LEU H . . 2.400 2.331 2.286 2.374 . 0 0 "[ . 1 . 2]" 1
829 1 37 ALA O 1 41 LEU N . 2.700 3.200 3.196 3.154 3.225 0.025 19 0 "[ . 1 . 2]" 1
830 1 38 SER O 1 42 GLU H . . 2.400 2.219 2.044 2.399 . 0 0 "[ . 1 . 2]" 1
831 1 38 SER O 1 42 GLU N . 2.700 3.200 3.137 2.960 3.213 0.013 10 0 "[ . 1 . 2]" 1
832 1 39 ARG O 1 43 ARG H . . 2.400 2.291 1.986 2.376 . 0 0 "[ . 1 . 2]" 1
833 1 39 ARG O 1 43 ARG N . 2.700 3.200 3.186 2.921 3.210 0.010 18 0 "[ . 1 . 2]" 1
834 1 40 GLU O 1 44 PHE H . . 2.400 2.231 2.060 2.404 0.004 18 0 "[ . 1 . 2]" 1
835 1 40 GLU O 1 44 PHE N . 2.700 3.200 3.012 2.827 3.200 . 0 0 "[ . 1 . 2]" 1
836 1 48 PRO O 1 51 LEU H . . 2.400 2.148 1.884 2.384 . 0 0 "[ . 1 . 2]" 1
837 1 48 PRO O 1 51 LEU N . 2.700 3.200 3.025 2.831 3.194 . 0 0 "[ . 1 . 2]" 1
838 1 49 GLY O 1 52 GLU H . . 2.400 2.328 2.038 2.401 0.001 9 0 "[ . 1 . 2]" 1
839 1 49 GLY O 1 52 GLU N . 2.700 3.200 3.182 2.981 3.211 0.011 11 0 "[ . 1 . 2]" 1
840 1 53 THR OG1 1 56 GLY H . . 2.400 2.152 2.018 2.245 . 0 0 "[ . 1 . 2]" 1
841 1 53 THR OG1 1 56 GLY N . 2.700 3.200 3.115 2.922 3.226 0.026 13 0 "[ . 1 . 2]" 1
842 1 53 THR O 1 57 CYS H . . 2.400 2.112 1.873 2.309 . 0 0 "[ . 1 . 2]" 1
843 1 53 THR O 1 57 CYS N . 2.700 3.200 3.041 2.803 3.204 0.004 9 0 "[ . 1 . 2]" 1
844 1 54 SER O 1 58 ARG H . . 2.400 1.952 1.815 2.179 . 0 0 "[ . 1 . 2]" 1
845 1 54 SER O 1 58 ARG N . 2.700 3.200 2.854 2.738 3.070 . 0 0 "[ . 1 . 2]" 1
846 1 55 GLU O 1 59 GLN H . . 2.400 2.258 1.992 2.377 . 0 0 "[ . 1 . 2]" 1
847 1 55 GLU O 1 59 GLN N . 2.700 3.200 3.133 2.898 3.222 0.022 13 0 "[ . 1 . 2]" 1
848 1 56 GLY O 1 60 ILE H . . 2.400 2.222 2.054 2.410 0.010 6 0 "[ . 1 . 2]" 1
849 1 56 GLY O 1 60 ILE N . 2.700 3.200 3.087 2.935 3.208 0.008 3 0 "[ . 1 . 2]" 1
850 1 57 CYS O 1 61 LEU H . . 2.400 1.991 1.881 2.205 . 0 0 "[ . 1 . 2]" 1
851 1 57 CYS O 1 61 LEU N . 2.700 3.200 2.853 2.698 3.119 0.002 9 0 "[ . 1 . 2]" 1
852 1 58 ARG O 1 62 GLY H . . 2.400 1.997 1.873 2.155 . 0 0 "[ . 1 . 2]" 1
853 1 58 ARG O 1 62 GLY N . 2.700 3.200 2.824 2.725 2.994 . 0 0 "[ . 1 . 2]" 1
854 1 59 GLN O 1 63 GLN H . . 2.400 2.162 1.805 2.282 . 0 0 "[ . 1 . 2]" 1
855 1 59 GLN O 1 63 GLN N . 2.700 3.200 3.069 2.734 3.185 . 0 0 "[ . 1 . 2]" 1
856 1 60 ILE O 1 64 LEU H . . 2.400 2.404 2.360 2.417 0.017 19 0 "[ . 1 . 2]" 1
857 1 60 ILE O 1 64 LEU N . 2.700 3.200 2.668 2.654 2.688 0.046 14 0 "[ . 1 . 2]" 1
858 1 61 LEU O 1 65 GLN H . . 2.400 2.427 2.403 2.437 0.037 14 0 "[ . 1 . 2]" 1
859 1 61 LEU O 1 65 GLN N . 2.700 3.200 3.190 3.123 3.221 0.021 10 0 "[ . 1 . 2]" 1
860 1 66 PRO O 1 69 GLN H . . 2.400 2.450 2.433 2.473 0.073 15 0 "[ . 1 . 2]" 1
861 1 66 PRO O 1 69 GLN N . 2.700 3.200 3.183 3.158 3.204 0.004 15 0 "[ . 1 . 2]" 1
862 1 67 SER O 1 70 THR H . . 2.400 2.387 2.373 2.394 . 0 0 "[ . 1 . 2]" 1
863 1 67 SER O 1 70 THR N . 2.700 3.200 3.234 3.200 3.242 0.042 14 0 "[ . 1 . 2]" 1
864 1 68 LEU O 1 71 GLY H . . 2.400 2.334 2.320 2.367 . 0 0 "[ . 1 . 2]" 1
865 1 68 LEU O 1 71 GLY N . 2.700 3.200 3.227 3.213 3.255 0.055 11 0 "[ . 1 . 2]" 1
866 1 72 SER OG 1 75 LEU H . . 2.400 2.498 2.457 2.540 0.140 13 0 "[ . 1 . 2]" 1
867 1 72 SER OG 1 75 LEU N . 2.700 3.500 3.479 3.440 3.515 0.015 8 0 "[ . 1 . 2]" 1
868 1 72 SER O 1 76 ARG H . . 2.400 1.818 1.801 1.847 . 0 0 "[ . 1 . 2]" 1
869 1 72 SER O 1 76 ARG N . 2.700 3.200 2.691 2.674 2.721 0.026 12 0 "[ . 1 . 2]" 1
870 1 73 GLU O 1 77 SER H . . 2.400 2.370 2.322 2.417 0.017 12 0 "[ . 1 . 2]" 1
871 1 73 GLU O 1 77 SER N . 2.700 3.200 3.276 3.243 3.310 0.110 8 0 "[ . 1 . 2]" 1
872 1 74 GLU O 1 78 LEU H . . 2.400 2.377 2.331 2.418 0.018 11 0 "[ . 1 . 2]" 1
873 1 74 GLU O 1 78 LEU N . 2.700 3.200 3.225 3.211 3.270 0.070 11 0 "[ . 1 . 2]" 1
874 1 75 LEU O 1 79 TYR H . . 2.400 2.254 2.191 2.364 . 0 0 "[ . 1 . 2]" 1
875 1 75 LEU O 1 79 TYR N . 2.700 3.200 3.166 3.110 3.275 0.075 11 0 "[ . 1 . 2]" 1
876 1 76 ARG O 1 80 ASN H . . 2.400 2.040 1.864 2.350 . 0 0 "[ . 1 . 2]" 1
877 1 76 ARG O 1 80 ASN N . 2.700 3.200 2.984 2.802 3.285 0.085 10 0 "[ . 1 . 2]" 1
878 1 77 SER O 1 81 THR H . . 2.400 2.255 2.045 2.437 0.037 9 0 "[ . 1 . 2]" 1
879 1 77 SER O 1 81 THR N . 2.700 3.200 3.054 2.890 3.189 . 0 0 "[ . 1 . 2]" 1
880 1 78 LEU O 1 82 ILE H . . 2.400 2.192 2.005 2.306 . 0 0 "[ . 1 . 2]" 1
881 1 78 LEU O 1 82 ILE N . 2.700 3.200 3.114 2.929 3.220 0.020 9 0 "[ . 1 . 2]" 1
882 1 79 TYR O 1 83 ALA H . . 2.400 1.775 1.758 1.802 0.042 9 0 "[ . 1 . 2]" 1
883 1 79 TYR O 1 83 ALA N . 2.700 3.200 2.724 2.667 2.774 0.033 12 0 "[ . 1 . 2]" 1
884 1 80 ASN O 1 84 VAL H . . 2.400 2.110 1.831 2.247 . 0 0 "[ . 1 . 2]" 1
885 1 80 ASN O 1 84 VAL N . 2.700 3.200 3.097 2.826 3.216 0.016 2 0 "[ . 1 . 2]" 1
886 1 81 THR O 1 85 LEU H . . 2.400 2.015 1.854 2.256 . 0 0 "[ . 1 . 2]" 1
887 1 81 THR O 1 85 LEU N . 2.700 3.200 2.959 2.816 3.178 . 0 0 "[ . 1 . 2]" 1
888 1 82 ILE O 1 86 TYR H . . 2.400 1.838 1.762 1.936 0.038 12 0 "[ . 1 . 2]" 1
889 1 82 ILE O 1 86 TYR N . 2.700 3.200 2.708 2.684 2.759 0.016 20 0 "[ . 1 . 2]" 1
890 1 83 ALA O 1 87 CYS H . . 2.400 2.218 1.780 2.360 0.020 16 0 "[ . 1 . 2]" 1
891 1 83 ALA O 1 87 CYS N . 2.700 3.200 3.116 2.759 3.251 0.051 6 0 "[ . 1 . 2]" 1
892 1 84 VAL O 1 88 VAL H . . 2.400 1.932 1.784 2.086 0.016 16 0 "[ . 1 . 2]" 1
893 1 84 VAL O 1 88 VAL N . 2.700 3.200 2.836 2.649 3.003 0.051 16 0 "[ . 1 . 2]" 1
894 1 85 LEU O 1 89 HIS H . . 2.400 2.012 1.790 2.265 0.010 6 0 "[ . 1 . 2]" 1
895 1 85 LEU O 1 89 HIS N . 2.700 3.200 2.866 2.692 3.161 0.008 6 0 "[ . 1 . 2]" 1
896 1 86 TYR O 1 90 GLN H . . 2.400 2.292 1.972 2.360 . 0 0 "[ . 1 . 2]" 1
897 1 86 TYR O 1 90 GLN N . 2.700 3.200 3.150 2.647 3.227 0.053 20 0 "[ . 1 . 2]" 1
898 1 20 ARG H 1 95 LYS O . . 2.400 1.893 1.789 2.301 0.011 18 0 "[ . 1 . 2]" 1
899 1 20 ARG N 1 95 LYS O . 2.700 3.200 2.807 2.681 3.253 0.053 3 0 "[ . 1 . 2]" 1
900 1 20 ARG O 1 97 THR H . . 2.400 2.418 2.363 2.465 0.065 19 0 "[ . 1 . 2]" 1
901 1 20 ARG O 1 97 THR N . 2.700 3.200 3.187 3.073 3.258 0.058 6 0 "[ . 1 . 2]" 1
902 1 96 ASP OD1 1 99 GLU H . . 2.400 3.238 2.067 4.159 1.759 2 14 "[*+**** * * * -** **]" 1
903 1 96 ASP OD1 1 99 GLU N . 2.700 3.200 3.919 2.712 5.045 1.845 2 14 "[*+**** * * * **- **]" 1
904 1 96 ASP O 1 100 ALA H . . 2.400 2.342 2.215 2.436 0.036 20 0 "[ . 1 . 2]" 1
905 1 96 ASP O 1 100 ALA N . 2.700 3.200 3.153 3.007 3.222 0.022 3 0 "[ . 1 . 2]" 1
906 1 97 THR O 1 101 LEU H . . 2.400 2.110 1.775 2.340 0.025 9 0 "[ . 1 . 2]" 1
907 1 97 THR O 1 101 LEU N . 2.700 3.200 3.031 2.731 3.223 0.023 13 0 "[ . 1 . 2]" 1
908 1 98 LYS O 1 102 ASP H . . 2.400 2.206 1.942 2.320 . 0 0 "[ . 1 . 2]" 1
909 1 98 LYS O 1 102 ASP N . 2.700 3.200 3.144 2.885 3.255 0.055 20 0 "[ . 1 . 2]" 1
910 1 99 GLU O 1 103 LYS H . . 2.400 1.780 1.759 1.811 0.041 16 0 "[ . 1 . 2]" 1
911 1 99 GLU O 1 103 LYS N . 2.700 3.200 2.713 2.670 2.755 0.030 20 0 "[ . 1 . 2]" 1
912 1 101 LEU O 1 105 GLU H . . 2.400 2.166 2.120 2.238 . 0 0 "[ . 1 . 2]" 1
913 1 101 LEU O 1 105 GLU N . 2.700 3.200 2.871 2.834 2.931 . 0 0 "[ . 1 . 2]" 1
914 1 102 ASP O 1 106 GLU H . . 2.400 2.151 1.797 2.313 0.003 9 0 "[ . 1 . 2]" 1
915 1 102 ASP O 1 106 GLU N . 2.700 3.200 3.087 2.761 3.224 0.024 19 0 "[ . 1 . 2]" 1
916 1 103 LYS O 1 107 GLU H . . 2.400 2.140 1.806 2.226 . 0 0 "[ . 1 . 2]" 1
917 1 103 LYS O 1 107 GLU N . 2.700 3.200 3.122 2.798 3.206 0.006 19 0 "[ . 1 . 2]" 1
918 1 104 ILE O 1 108 GLN H . . 2.400 1.829 1.796 2.009 0.004 8 0 "[ . 1 . 2]" 1
919 1 104 ILE O 1 108 GLN N . 2.700 3.200 2.810 2.760 2.979 . 0 0 "[ . 1 . 2]" 1
920 1 105 GLU O 1 109 ASN H . . 2.400 1.919 1.800 2.066 . 0 0 "[ . 1 . 2]" 1
921 1 105 GLU O 1 109 ASN N . 2.700 3.200 2.912 2.786 3.058 . 0 0 "[ . 1 . 2]" 1
922 1 106 GLU O 1 110 LYS H . . 2.400 1.822 1.799 2.064 0.001 18 0 "[ . 1 . 2]" 1
923 1 106 GLU O 1 110 LYS N . 2.700 3.200 2.760 2.712 2.837 . 0 0 "[ . 1 . 2]" 1
924 1 107 GLU O 1 111 SER H . . 2.400 1.809 1.800 1.896 0.000 16 0 "[ . 1 . 2]" 1
925 1 107 GLU O 1 111 SER N . 2.700 3.200 2.785 2.710 2.843 . 0 0 "[ . 1 . 2]" 1
926 1 108 GLN O 1 112 LYS H . . 2.400 1.812 1.799 1.980 0.001 18 0 "[ . 1 . 2]" 1
927 1 108 GLN O 1 112 LYS N . 2.700 3.200 2.776 2.700 2.829 0.000 6 0 "[ . 1 . 2]" 1
928 1 109 ASN O 1 113 LYS H . . 2.400 1.936 1.800 2.406 0.006 1 0 "[ . 1 . 2]" 1
929 1 109 ASN O 1 113 LYS N . 2.700 3.200 2.902 2.741 3.215 0.015 1 0 "[ . 1 . 2]" 1
930 1 110 LYS O 1 114 LYS H . . 2.400 1.870 1.798 2.292 0.002 13 0 "[ . 1 . 2]" 1
931 1 110 LYS O 1 114 LYS N . 2.700 3.200 2.841 2.762 3.213 0.013 1 0 "[ . 1 . 2]" 1
932 1 111 SER O 1 115 ALA H . . 2.400 1.851 1.799 2.180 0.001 3 0 "[ . 1 . 2]" 1
933 1 111 SER O 1 115 ALA N . 2.700 3.200 2.785 2.702 3.127 . 0 0 "[ . 1 . 2]" 1
934 1 112 LYS O 1 116 GLN H . . 2.400 1.834 1.799 2.022 0.001 3 0 "[ . 1 . 2]" 1
935 1 112 LYS O 1 116 GLN N . 2.700 3.200 2.794 2.704 2.963 . 0 0 "[ . 1 . 2]" 1
936 1 113 LYS O 1 117 GLN H . . 2.400 1.805 1.799 1.832 0.001 2 0 "[ . 1 . 2]" 1
937 1 113 LYS O 1 117 GLN N . 2.700 3.200 2.762 2.699 2.806 0.001 3 0 "[ . 1 . 2]" 1
938 1 114 LYS O 1 118 ALA H . . 2.400 1.886 1.797 2.393 0.003 18 0 "[ . 1 . 2]" 1
939 1 114 LYS O 1 118 ALA N . 2.700 3.200 2.855 2.772 3.152 . 0 0 "[ . 1 . 2]" 1
940 1 115 ALA O 1 119 ALA H . . 2.400 1.845 1.796 2.075 0.004 4 0 "[ . 1 . 2]" 1
941 1 115 ALA O 1 119 ALA N . 2.700 3.200 2.818 2.721 3.067 . 0 0 "[ . 1 . 2]" 1
942 1 116 GLN O 1 120 ALA H . . 2.400 1.994 1.798 2.373 0.002 7 0 "[ . 1 . 2]" 1
943 1 116 GLN O 1 120 ALA N . 2.700 3.200 2.866 2.691 3.203 0.009 20 0 "[ . 1 . 2]" 1
944 1 117 GLN O 1 121 ASP H . . 2.400 2.141 1.800 2.462 0.062 11 0 "[ . 1 . 2]" 1
945 1 117 GLN O 1 121 ASP N . 2.700 3.200 2.825 2.667 3.213 0.033 16 0 "[ . 1 . 2]" 1
946 1 118 ALA O 1 122 THR H . . 2.400 2.075 1.783 2.765 0.365 11 0 "[ . 1 . 2]" 1
947 1 118 ALA O 1 122 THR N . 2.700 3.200 2.757 2.580 2.980 0.120 1 0 "[ . 1 . 2]" 1
948 1 119 ALA O 1 122 THR HG1 . . 2.400 2.324 1.980 2.593 0.193 11 0 "[ . 1 . 2]" 1
949 1 119 ALA O 1 122 THR OG1 . 2.700 3.200 2.773 2.660 3.052 0.040 14 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 614
_Distance_constraint_stats_list.Viol_count 586
_Distance_constraint_stats_list.Viol_total 6569.690
_Distance_constraint_stats_list.Viol_max 7.072
_Distance_constraint_stats_list.Viol_rms 0.3289
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0267
_Distance_constraint_stats_list.Viol_average_violations_only 0.5606
_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
1 144 HIS 23.266 2.748 5 14 "[ *-+*********. * *2]"
1 145 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 146 ALA 0.136 0.080 14 0 "[ . 1 . 2]"
1 147 ILE 0.136 0.080 14 0 "[ . 1 . 2]"
1 148 SER 1.136 0.091 14 0 "[ . 1 . 2]"
1 149 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 150 ARG 0.064 0.034 6 0 "[ . 1 . 2]"
1 151 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 152 LEU 0.543 0.041 13 0 "[ . 1 . 2]"
1 153 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 154 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 155 TRP 0.441 0.116 19 0 "[ . 1 . 2]"
1 156 VAL 0.933 0.116 19 0 "[ . 1 . 2]"
1 157 LYS 0.492 0.080 13 0 "[ . 1 . 2]"
1 158 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 159 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 160 GLU 0.173 0.046 3 0 "[ . 1 . 2]"
1 161 GLU 0.008 0.005 13 0 "[ . 1 . 2]"
1 162 LYS 0.035 0.014 20 0 "[ . 1 . 2]"
1 163 ALA 0.744 0.060 11 0 "[ . 1 . 2]"
1 164 PHE 0.544 0.060 11 0 "[ . 1 . 2]"
1 165 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 166 PRO 0.440 0.080 8 0 "[ . 1 . 2]"
1 167 GLU 0.516 0.080 8 0 "[ . 1 . 2]"
1 168 VAL 0.051 0.051 6 0 "[ . 1 . 2]"
1 169 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 170 PRO 0.508 0.067 20 0 "[ . 1 . 2]"
1 171 MET 0.432 0.067 20 0 "[ . 1 . 2]"
1 172 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 173 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 174 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 175 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 176 SER 0.011 0.011 4 0 "[ . 1 . 2]"
1 179 ALA 0.157 0.029 8 0 "[ . 1 . 2]"
1 180 THR 0.655 0.160 15 0 "[ . 1 . 2]"
1 182 GLN 0.498 0.160 15 0 "[ . 1 . 2]"
1 183 ASP 0.047 0.029 8 0 "[ . 1 . 2]"
1 184 LEU 0.047 0.029 8 0 "[ . 1 . 2]"
1 185 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 186 THR 0.009 0.009 7 0 "[ . 1 . 2]"
1 187 MET 0.009 0.009 7 0 "[ . 1 . 2]"
1 188 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 189 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 190 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 191 VAL 0.744 0.193 17 0 "[ . 1 . 2]"
1 192 GLY 0.682 0.193 17 0 "[ . 1 . 2]"
1 193 GLY 0.070 0.031 12 0 "[ . 1 . 2]"
1 194 HIS 0.065 0.031 12 0 "[ . 1 . 2]"
1 195 GLN 0.176 0.032 12 0 "[ . 1 . 2]"
1 196 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 197 ALA 0.017 0.014 16 0 "[ . 1 . 2]"
1 198 MET 0.176 0.032 12 0 "[ . 1 . 2]"
1 199 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 200 MET 0.017 0.014 16 0 "[ . 1 . 2]"
1 201 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 202 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 203 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 204 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 205 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 206 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 207 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 208 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 209 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 210 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 211 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 212 TRP 0.126 0.066 16 0 "[ . 1 . 2]"
1 213 ASP 0.101 0.066 16 0 "[ . 1 . 2]"
1 214 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 215 LEU 0.355 0.049 12 0 "[ . 1 . 2]"
1 216 HIS 0.355 0.049 12 0 "[ . 1 . 2]"
1 217 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 218 VAL 0.095 0.047 14 0 "[ . 1 . 2]"
1 219 HIS 59.712 6.058 19 18 "[****** *** *-*****+*]"
1 220 ALA 0.080 0.038 14 0 "[ . 1 . 2]"
1 221 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 222 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 223 ILE 0.036 0.023 10 0 "[ . 1 . 2]"
1 224 ALA 0.043 0.023 10 0 "[ . 1 . 2]"
1 225 PRO 0.089 0.011 5 0 "[ . 1 . 2]"
1 226 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 227 GLN 0.095 0.011 5 0 "[ . 1 . 2]"
1 228 MET 0.327 0.136 16 0 "[ . 1 . 2]"
1 229 ARG 59.558 5.683 2 17 "[*+*-*****1** ***** *]"
1 230 GLU 59.805 6.058 19 18 "[****** *** *-*****+*]"
1 231 PRO 0.124 0.031 10 0 "[ . 1 . 2]"
1 232 ARG 0.032 0.025 16 0 "[ . 1 . 2]"
1 233 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 234 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 235 ASP 0.157 0.018 14 0 "[ . 1 . 2]"
1 236 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 237 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 238 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 239 THR 0.070 0.019 10 0 "[ . 1 . 2]"
1 240 THR 50.922 5.683 2 16 "[*+**.****1** ***** -]"
1 241 SER 172.599 7.072 3 18 "[ *+***** ****-******]"
1 242 THR 0.321 0.067 8 0 "[ . 1 . 2]"
1 243 LEU 0.043 0.037 19 0 "[ . 1 . 2]"
1 244 GLN 0.909 0.086 16 0 "[ . 1 . 2]"
1 245 GLU 0.365 0.086 16 0 "[ . 1 . 2]"
1 246 GLN 0.956 0.109 12 0 "[ . 1 . 2]"
1 247 ILE 24.108 2.748 5 14 "[ *-+*********. * *2]"
1 248 GLY 0.416 0.094 19 0 "[ . 1 . 2]"
1 249 TRP 181.286 7.072 3 19 "[**+-**** ***********]"
1 250 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 251 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 252 HIS 0.885 0.075 17 0 "[ . 1 . 2]"
1 253 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 254 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 255 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 256 ILE 0.840 0.075 17 0 "[ . 1 . 2]"
1 257 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 258 VAL 0.064 0.021 10 0 "[ . 1 . 2]"
1 259 GLY 0.064 0.021 10 0 "[ . 1 . 2]"
1 260 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 261 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 262 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 263 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 264 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 265 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 266 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 267 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 268 LEU 0.014 0.014 17 0 "[ . 1 . 2]"
1 269 GLY 0.014 0.014 17 0 "[ . 1 . 2]"
1 270 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 271 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 272 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 273 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 274 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 275 ARG 3.130 0.158 11 0 "[ . 1 . 2]"
1 276 MET 3.130 0.158 11 0 "[ . 1 . 2]"
1 277 TYR 0.010 0.010 18 0 "[ . 1 . 2]"
1 278 SER 0.010 0.010 18 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 1 148 SER HA 1 149 PRO QD . . 3.500 2.049 1.988 2.115 . 0 0 "[ . 1 . 2]" 2
2 1 148 SER H 1 151 THR H . . 5.000 4.100 3.856 4.270 . 0 0 "[ . 1 . 2]" 2
3 1 148 SER H 1 151 THR HB . . 5.000 3.487 3.050 4.425 . 0 0 "[ . 1 . 2]" 2
4 1 148 SER H 1 151 THR MG . . 5.500 3.007 1.921 3.362 . 0 0 "[ . 1 . 2]" 2
5 1 150 ARG H 1 151 THR H . . 2.900 2.623 2.500 2.723 . 0 0 "[ . 1 . 2]" 2
6 1 151 THR H 1 152 LEU H . . 2.900 2.553 2.453 2.624 . 0 0 "[ . 1 . 2]" 2
7 1 152 LEU H 1 153 ASN H . . 2.900 2.625 2.518 2.771 . 0 0 "[ . 1 . 2]" 2
8 1 153 ASN H 1 154 ALA H . . 2.900 2.573 2.489 2.618 . 0 0 "[ . 1 . 2]" 2
9 1 154 ALA H 1 155 TRP H . . 2.900 2.729 2.622 2.787 . 0 0 "[ . 1 . 2]" 2
10 1 155 TRP H 1 156 VAL H . . 2.900 2.662 2.599 2.698 . 0 0 "[ . 1 . 2]" 2
11 1 156 VAL H 1 157 LYS H . . 2.900 2.889 2.827 2.912 0.012 20 0 "[ . 1 . 2]" 2
12 1 157 LYS H 1 158 VAL H . . 2.900 2.578 2.493 2.661 . 0 0 "[ . 1 . 2]" 2
13 1 158 VAL H 1 159 VAL H . . 2.900 2.598 2.447 2.670 . 0 0 "[ . 1 . 2]" 2
14 1 159 VAL H 1 160 GLU H . . 2.900 2.663 2.386 2.821 . 0 0 "[ . 1 . 2]" 2
15 1 160 GLU H 1 161 GLU H . . 2.900 2.544 2.406 2.701 . 0 0 "[ . 1 . 2]" 2
16 1 161 GLU H 1 162 LYS H . . 2.900 2.615 2.294 2.905 0.005 13 0 "[ . 1 . 2]" 2
17 1 162 LYS H 1 163 ALA H . . 2.900 2.595 2.026 2.914 0.014 20 0 "[ . 1 . 2]" 2
18 1 148 SER H 1 150 ARG H . . 5.000 4.994 4.903 5.034 0.034 6 0 "[ . 1 . 2]" 2
19 1 150 ARG H 1 152 LEU H . . 5.000 4.026 3.925 4.178 . 0 0 "[ . 1 . 2]" 2
20 1 151 THR H 1 153 ASN H . . 5.000 4.086 3.883 4.197 . 0 0 "[ . 1 . 2]" 2
21 1 152 LEU H 1 154 ALA H . . 5.000 4.020 3.738 4.252 . 0 0 "[ . 1 . 2]" 2
22 1 153 ASN H 1 155 TRP H . . 5.000 4.188 4.068 4.328 . 0 0 "[ . 1 . 2]" 2
23 1 154 ALA H 1 156 VAL H . . 5.000 4.054 3.947 4.137 . 0 0 "[ . 1 . 2]" 2
24 1 155 TRP H 1 157 LYS H . . 5.000 4.137 4.079 4.209 . 0 0 "[ . 1 . 2]" 2
25 1 157 LYS H 1 159 VAL H . . 5.000 4.118 4.011 4.206 . 0 0 "[ . 1 . 2]" 2
26 1 158 VAL H 1 160 GLU H . . 5.000 4.042 3.775 4.209 . 0 0 "[ . 1 . 2]" 2
27 1 159 VAL H 1 161 GLU H . . 5.000 3.888 3.660 4.135 . 0 0 "[ . 1 . 2]" 2
28 1 160 GLU H 1 162 LYS H . . 5.000 4.375 3.758 4.989 . 0 0 "[ . 1 . 2]" 2
29 1 161 GLU H 1 163 ALA H . . 5.000 4.331 3.883 4.816 . 0 0 "[ . 1 . 2]" 2
30 1 150 ARG H 1 153 ASN H . . 5.000 4.769 4.605 4.919 . 0 0 "[ . 1 . 2]" 2
31 1 160 GLU H 1 163 ALA H . . 5.000 4.950 4.651 5.046 0.046 3 0 "[ . 1 . 2]" 2
32 1 149 PRO HA 1 152 LEU H . . 5.000 3.123 2.987 3.323 . 0 0 "[ . 1 . 2]" 2
33 1 151 THR HA 1 154 ALA H . . 5.000 3.196 3.028 3.322 . 0 0 "[ . 1 . 2]" 2
34 1 152 LEU HA 1 155 TRP H . . 5.000 3.478 3.262 3.591 . 0 0 "[ . 1 . 2]" 2
35 1 153 ASN HA 1 156 VAL H . . 5.000 3.390 3.314 3.491 . 0 0 "[ . 1 . 2]" 2
36 1 154 ALA HA 1 157 LYS H . . 5.000 3.514 3.439 3.652 . 0 0 "[ . 1 . 2]" 2
37 1 155 TRP HA 1 158 VAL H . . 5.000 2.980 2.878 3.137 . 0 0 "[ . 1 . 2]" 2
38 1 153 ASN HA 1 157 LYS H . . 5.000 4.284 4.018 4.486 . 0 0 "[ . 1 . 2]" 2
39 1 158 VAL HA 1 162 LYS H . . 5.000 3.945 2.971 4.559 . 0 0 "[ . 1 . 2]" 2
40 1 149 PRO HA 1 152 LEU QB . . 3.500 2.470 2.207 2.675 . 0 0 "[ . 1 . 2]" 2
41 1 150 ARG HA 1 153 ASN QB . . 3.500 2.802 2.602 3.131 . 0 0 "[ . 1 . 2]" 2
42 1 151 THR HA 1 154 ALA MB . . 3.800 2.361 2.111 2.713 . 0 0 "[ . 1 . 2]" 2
43 1 153 ASN HA 1 156 VAL HB . . 3.300 2.298 2.100 2.474 . 0 0 "[ . 1 . 2]" 2
44 1 154 ALA HA 1 157 LYS QB . . 4.100 2.918 2.724 3.172 . 0 0 "[ . 1 . 2]" 2
45 1 155 TRP HA 1 158 VAL HB . . 3.300 2.382 1.995 2.670 . 0 0 "[ . 1 . 2]" 2
46 1 156 VAL HA 1 159 VAL HB . . 3.300 2.691 2.264 3.050 . 0 0 "[ . 1 . 2]" 2
47 1 157 LYS HA 1 160 GLU QB . . 4.100 2.636 1.975 3.209 . 0 0 "[ . 1 . 2]" 2
48 1 158 VAL HA 1 161 GLU QB . . 4.100 2.358 1.960 3.116 . 0 0 "[ . 1 . 2]" 2
49 1 165 SER HA 1 166 PRO QD . . 3.500 2.139 2.054 2.179 . 0 0 "[ . 1 . 2]" 2
50 1 167 GLU H 1 168 VAL H . . 2.900 2.373 2.223 2.578 . 0 0 "[ . 1 . 2]" 2
51 1 168 VAL H 1 169 ILE H . . 2.900 2.003 1.907 2.108 . 0 0 "[ . 1 . 2]" 2
52 1 171 MET H 1 172 PHE H . . 2.900 2.690 2.652 2.784 . 0 0 "[ . 1 . 2]" 2
53 1 172 PHE H 1 173 SER H . . 2.900 2.663 2.518 2.787 . 0 0 "[ . 1 . 2]" 2
54 1 173 SER H 1 174 ALA H . . 2.900 2.610 2.447 2.721 . 0 0 "[ . 1 . 2]" 2
55 1 174 ALA H 1 175 LEU H . . 2.900 2.658 2.551 2.721 . 0 0 "[ . 1 . 2]" 2
56 1 175 LEU H 1 176 SER H . . 2.900 2.444 2.388 2.535 . 0 0 "[ . 1 . 2]" 2
57 1 167 GLU H 1 169 ILE H . . 5.000 4.041 3.734 4.297 . 0 0 "[ . 1 . 2]" 2
58 1 171 MET H 1 173 SER H . . 5.000 4.237 4.017 4.376 . 0 0 "[ . 1 . 2]" 2
59 1 165 SER H 1 168 VAL H . . 5.000 3.732 3.501 3.963 . 0 0 "[ . 1 . 2]" 2
60 1 171 MET H 1 174 ALA H . . 5.000 4.797 4.532 4.955 . 0 0 "[ . 1 . 2]" 2
61 1 170 PRO HA 1 173 SER H . . 5.000 3.324 3.155 3.436 . 0 0 "[ . 1 . 2]" 2
62 1 171 MET HA 1 174 ALA H . . 5.000 3.373 3.116 3.553 . 0 0 "[ . 1 . 2]" 2
63 1 167 GLU HA 1 170 PRO HB2 . . 5.000 4.844 4.598 5.056 0.056 6 0 "[ . 1 . 2]" 2
64 1 171 MET HA 1 174 ALA MB . . 3.800 2.531 2.095 2.770 . 0 0 "[ . 1 . 2]" 2
65 1 180 THR H 1 184 LEU H . . 5.000 3.419 3.173 3.696 . 0 0 "[ . 1 . 2]" 2
66 1 182 GLN H 1 183 ASP H . . 2.900 2.647 2.531 2.862 . 0 0 "[ . 1 . 2]" 2
67 1 183 ASP H 1 184 LEU H . . 2.900 2.686 2.427 2.929 0.029 8 0 "[ . 1 . 2]" 2
68 1 184 LEU H 1 185 ASN H . . 2.900 2.628 2.525 2.738 . 0 0 "[ . 1 . 2]" 2
69 1 185 ASN H 1 186 THR H . . 2.900 2.671 2.478 2.761 . 0 0 "[ . 1 . 2]" 2
70 1 186 THR H 1 187 MET H . . 2.900 2.682 2.503 2.755 . 0 0 "[ . 1 . 2]" 2
71 1 187 MET H 1 188 LEU H . . 2.900 2.679 2.555 2.741 . 0 0 "[ . 1 . 2]" 2
72 1 188 LEU H 1 189 ASN H . . 2.900 2.536 2.283 2.680 . 0 0 "[ . 1 . 2]" 2
73 1 189 ASN H 1 190 THR H . . 2.900 2.417 2.147 2.788 . 0 0 "[ . 1 . 2]" 2
74 1 180 THR H 1 182 GLN H . . 5.000 4.997 4.855 5.160 0.160 15 0 "[ . 1 . 2]" 2
75 1 182 GLN H 1 184 LEU H . . 5.000 4.076 3.832 4.197 . 0 0 "[ . 1 . 2]" 2
76 1 183 ASP H 1 185 ASN H . . 5.000 3.949 3.619 4.395 . 0 0 "[ . 1 . 2]" 2
77 1 185 ASN H 1 187 MET H . . 5.000 4.260 4.014 4.401 . 0 0 "[ . 1 . 2]" 2
78 1 187 MET H 1 189 ASN H . . 5.000 3.744 3.620 3.948 . 0 0 "[ . 1 . 2]" 2
79 1 188 LEU H 1 190 THR H . . 5.000 4.320 3.884 4.587 . 0 0 "[ . 1 . 2]" 2
80 1 189 ASN H 1 191 VAL H . . 5.000 3.565 3.095 4.377 . 0 0 "[ . 1 . 2]" 2
81 1 180 THR H 1 183 ASP H . . 5.000 3.624 3.352 3.988 . 0 0 "[ . 1 . 2]" 2
82 1 183 ASP H 1 186 THR H . . 5.000 4.628 4.405 4.815 . 0 0 "[ . 1 . 2]" 2
83 1 182 GLN HA 1 185 ASN H . . 5.000 3.380 3.054 3.713 . 0 0 "[ . 1 . 2]" 2
84 1 183 ASP HA 1 186 THR H . . 5.000 3.433 3.225 3.588 . 0 0 "[ . 1 . 2]" 2
85 1 184 LEU HA 1 186 THR H . . 5.000 4.129 3.921 4.374 . 0 0 "[ . 1 . 2]" 2
86 1 184 LEU HA 1 187 MET H . . 5.000 3.222 2.960 3.392 . 0 0 "[ . 1 . 2]" 2
87 1 186 THR HA 1 189 ASN H . . 5.000 3.395 3.079 3.572 . 0 0 "[ . 1 . 2]" 2
88 1 188 LEU HA 1 191 VAL H . . 5.000 3.303 2.958 3.799 . 0 0 "[ . 1 . 2]" 2
89 1 183 ASP HA 1 187 MET H . . 5.000 4.587 4.194 4.770 . 0 0 "[ . 1 . 2]" 2
90 1 185 ASN HA 1 189 ASN H . . 5.000 4.337 3.875 4.620 . 0 0 "[ . 1 . 2]" 2
91 1 186 THR HA 1 190 THR H . . 5.000 4.303 3.961 4.617 . 0 0 "[ . 1 . 2]" 2
92 1 183 ASP HA 1 186 THR HB . . 3.300 2.632 2.320 2.986 . 0 0 "[ . 1 . 2]" 2
93 1 184 LEU HA 1 187 MET QB . . 4.100 2.725 2.016 3.455 . 0 0 "[ . 1 . 2]" 2
94 1 186 THR HA 1 189 ASN QB . . 3.800 2.253 1.904 2.657 . 0 0 "[ . 1 . 2]" 2
95 1 195 GLN H 1 196 ALA H . . 2.900 2.689 2.539 2.768 . 0 0 "[ . 1 . 2]" 2
96 1 196 ALA H 1 197 ALA H . . 2.900 2.790 2.777 2.800 . 0 0 "[ . 1 . 2]" 2
97 1 197 ALA H 1 198 MET H . . 2.900 2.759 2.729 2.772 . 0 0 "[ . 1 . 2]" 2
98 1 198 MET H 1 199 GLN H . . 2.900 2.726 2.695 2.745 . 0 0 "[ . 1 . 2]" 2
99 1 199 GLN H 1 200 MET H . . 2.900 2.764 2.662 2.857 . 0 0 "[ . 1 . 2]" 2
100 1 200 MET H 1 201 LEU H . . 2.900 2.705 2.563 2.783 . 0 0 "[ . 1 . 2]" 2
101 1 201 LEU H 1 202 LYS H . . 2.900 2.625 2.483 2.729 . 0 0 "[ . 1 . 2]" 2
102 1 202 LYS H 1 203 GLU H . . 2.900 2.591 2.516 2.738 . 0 0 "[ . 1 . 2]" 2
103 1 203 GLU H 1 204 THR H . . 2.900 2.633 2.593 2.656 . 0 0 "[ . 1 . 2]" 2
104 1 204 THR H 1 205 ILE H . . 2.900 2.609 2.517 2.694 . 0 0 "[ . 1 . 2]" 2
105 1 205 ILE H 1 206 ASN H . . 2.900 2.781 2.672 2.838 . 0 0 "[ . 1 . 2]" 2
106 1 206 ASN H 1 207 GLU H . . 2.900 2.700 2.671 2.726 . 0 0 "[ . 1 . 2]" 2
107 1 207 GLU H 1 208 GLU H . . 2.900 2.577 2.480 2.604 . 0 0 "[ . 1 . 2]" 2
108 1 208 GLU H 1 209 ALA H . . 2.900 2.621 2.529 2.702 . 0 0 "[ . 1 . 2]" 2
109 1 209 ALA H 1 210 ALA H . . 2.900 2.628 2.545 2.753 . 0 0 "[ . 1 . 2]" 2
110 1 210 ALA H 1 211 GLU H . . 2.900 2.792 2.714 2.809 . 0 0 "[ . 1 . 2]" 2
111 1 211 GLU H 1 212 TRP H . . 2.900 2.613 2.548 2.680 . 0 0 "[ . 1 . 2]" 2
112 1 212 TRP H 1 213 ASP H . . 2.900 2.865 2.723 2.966 0.066 16 0 "[ . 1 . 2]" 2
113 1 213 ASP H 1 214 ARG H . . 2.900 2.696 2.656 2.706 . 0 0 "[ . 1 . 2]" 2
114 1 214 ARG H 1 215 LEU H . . 2.900 2.696 2.643 2.729 . 0 0 "[ . 1 . 2]" 2
115 1 195 GLN H 1 197 ALA H . . 5.000 4.353 4.268 4.421 . 0 0 "[ . 1 . 2]" 2
116 1 196 ALA H 1 198 MET H . . 5.000 4.219 4.189 4.254 . 0 0 "[ . 1 . 2]" 2
117 1 197 ALA H 1 199 GLN H . . 5.000 3.983 3.953 4.058 . 0 0 "[ . 1 . 2]" 2
118 1 198 MET H 1 200 MET H . . 5.000 4.556 4.436 4.605 . 0 0 "[ . 1 . 2]" 2
119 1 199 GLN H 1 201 LEU H . . 5.000 3.941 3.754 4.177 . 0 0 "[ . 1 . 2]" 2
120 1 200 MET H 1 202 LYS H . . 5.000 4.169 3.966 4.372 . 0 0 "[ . 1 . 2]" 2
121 1 201 LEU H 1 203 GLU H . . 5.000 3.982 3.812 4.207 . 0 0 "[ . 1 . 2]" 2
122 1 202 LYS H 1 204 THR H . . 5.000 4.211 3.994 4.371 . 0 0 "[ . 1 . 2]" 2
123 1 203 GLU H 1 205 ILE H . . 5.000 4.094 3.960 4.194 . 0 0 "[ . 1 . 2]" 2
124 1 204 THR H 1 206 ASN H . . 5.000 4.270 4.204 4.356 . 0 0 "[ . 1 . 2]" 2
125 1 205 ILE H 1 207 GLU H . . 5.000 3.892 3.794 3.976 . 0 0 "[ . 1 . 2]" 2
126 1 206 ASN H 1 208 GLU H . . 5.000 3.984 3.906 4.080 . 0 0 "[ . 1 . 2]" 2
127 1 207 GLU H 1 209 ALA H . . 5.000 4.208 3.957 4.365 . 0 0 "[ . 1 . 2]" 2
128 1 208 GLU H 1 210 ALA H . . 5.000 4.251 4.112 4.383 . 0 0 "[ . 1 . 2]" 2
129 1 209 ALA H 1 211 GLU H . . 5.000 4.073 3.965 4.166 . 0 0 "[ . 1 . 2]" 2
130 1 210 ALA H 1 212 TRP H . . 5.000 3.987 3.926 4.079 . 0 0 "[ . 1 . 2]" 2
131 1 211 GLU H 1 213 ASP H . . 5.000 4.556 4.293 4.815 . 0 0 "[ . 1 . 2]" 2
132 1 213 ASP H 1 215 LEU H . . 5.000 4.247 4.134 4.337 . 0 0 "[ . 1 . 2]" 2
133 1 214 ARG H 1 216 HIS H . . 5.000 3.636 3.596 3.704 . 0 0 "[ . 1 . 2]" 2
134 1 197 ALA H 1 200 MET H . . 5.000 4.918 4.760 5.014 0.014 16 0 "[ . 1 . 2]" 2
135 1 195 GLN HA 1 198 MET H . . 3.300 3.301 3.244 3.332 0.032 12 0 "[ . 1 . 2]" 2
136 1 197 ALA HA 1 200 MET H . . 5.000 3.523 3.426 3.591 . 0 0 "[ . 1 . 2]" 2
137 1 201 LEU HA 1 204 THR H . . 5.000 3.272 3.023 3.418 . 0 0 "[ . 1 . 2]" 2
138 1 202 LYS HA 1 205 ILE H . . 5.000 3.438 3.276 3.544 . 0 0 "[ . 1 . 2]" 2
139 1 203 GLU HA 1 206 ASN H . . 5.000 3.810 3.594 3.997 . 0 0 "[ . 1 . 2]" 2
140 1 204 THR HA 1 207 GLU H . . 5.000 3.434 3.357 3.605 . 0 0 "[ . 1 . 2]" 2
141 1 206 ASN HA 1 209 ALA H . . 5.000 3.444 3.313 3.553 . 0 0 "[ . 1 . 2]" 2
142 1 207 GLU HA 1 210 ALA H . . 5.000 3.303 3.206 3.428 . 0 0 "[ . 1 . 2]" 2
143 1 208 GLU HA 1 211 GLU H . . 5.000 3.549 3.433 3.650 . 0 0 "[ . 1 . 2]" 2
144 1 209 ALA HA 1 212 TRP H . . 5.000 3.247 3.164 3.431 . 0 0 "[ . 1 . 2]" 2
145 1 210 ALA HA 1 213 ASP H . . 5.000 3.755 3.584 3.935 . 0 0 "[ . 1 . 2]" 2
146 1 213 ASP HA 1 216 HIS H . . 5.000 2.970 2.817 3.247 . 0 0 "[ . 1 . 2]" 2
147 1 195 GLN HA 1 199 GLN H . . 5.000 4.053 3.990 4.094 . 0 0 "[ . 1 . 2]" 2
148 1 196 ALA HA 1 200 MET H . . 5.000 4.239 3.954 4.502 . 0 0 "[ . 1 . 2]" 2
149 1 198 MET HA 1 202 LYS H . . 5.000 4.140 3.664 4.542 . 0 0 "[ . 1 . 2]" 2
150 1 200 MET HA 1 204 THR H . . 5.000 4.352 4.075 4.722 . 0 0 "[ . 1 . 2]" 2
151 1 201 LEU HA 1 205 ILE H . . 5.000 3.842 3.684 4.046 . 0 0 "[ . 1 . 2]" 2
152 1 202 LYS HA 1 206 ASN H . . 5.000 3.370 3.035 3.722 . 0 0 "[ . 1 . 2]" 2
153 1 204 THR HA 1 208 GLU H . . 5.000 4.087 3.830 4.265 . 0 0 "[ . 1 . 2]" 2
154 1 205 ILE HA 1 209 ALA H . . 5.000 4.643 4.372 4.783 . 0 0 "[ . 1 . 2]" 2
155 1 206 ASN HA 1 210 ALA H . . 5.000 4.512 4.165 4.628 . 0 0 "[ . 1 . 2]" 2
156 1 195 GLN HA 1 198 MET QB . . 4.100 2.316 2.213 2.456 . 0 0 "[ . 1 . 2]" 2
157 1 196 ALA HA 1 199 GLN QB . . 4.100 2.518 2.354 2.673 . 0 0 "[ . 1 . 2]" 2
158 1 198 MET HA 1 201 LEU QB . . 4.100 2.375 2.077 2.705 . 0 0 "[ . 1 . 2]" 2
159 1 199 GLN HA 1 202 LYS QB . . 4.100 2.823 2.388 3.188 . 0 0 "[ . 1 . 2]" 2
160 1 200 MET HA 1 203 GLU QB . . 4.100 2.474 2.134 3.046 . 0 0 "[ . 1 . 2]" 2
161 1 203 GLU HA 1 206 ASN QB . . 4.100 2.822 2.620 2.941 . 0 0 "[ . 1 . 2]" 2
162 1 204 THR HA 1 207 GLU HB2 . . 5.000 2.944 2.141 3.806 . 0 0 "[ . 1 . 2]" 2
163 1 204 THR HA 1 207 GLU HB3 . . 5.000 2.906 2.158 3.881 . 0 0 "[ . 1 . 2]" 2
164 1 207 GLU HA 1 210 ALA MB . . 3.800 2.550 2.314 3.031 . 0 0 "[ . 1 . 2]" 2
165 1 208 GLU HA 1 211 GLU QB . . 4.100 2.836 2.540 3.702 . 0 0 "[ . 1 . 2]" 2
166 1 211 GLU HA 1 214 ARG QB . . 4.100 2.099 1.918 2.367 . 0 0 "[ . 1 . 2]" 2
167 1 216 HIS HA 1 217 PRO HD2 . . 2.700 2.191 2.183 2.282 . 0 0 "[ . 1 . 2]" 2
168 1 216 HIS HA 1 217 PRO HD3 . . 2.700 2.165 1.962 2.247 . 0 0 "[ . 1 . 2]" 2
169 1 217 PRO HA 1 218 VAL H . . 2.700 2.345 2.149 2.651 . 0 0 "[ . 1 . 2]" 2
170 1 218 VAL HA 1 219 HIS H . . 2.700 2.355 2.183 2.747 0.047 14 0 "[ . 1 . 2]" 2
171 1 219 HIS HA 1 220 ALA H . . 2.700 2.427 2.186 2.738 0.038 14 0 "[ . 1 . 2]" 2
172 1 220 ALA HA 1 221 GLY H . . 2.700 2.445 2.187 2.653 . 0 0 "[ . 1 . 2]" 2
173 1 221 GLY H 1 222 PRO QD . . 4.100 3.581 2.844 3.701 . 0 0 "[ . 1 . 2]" 2
174 1 221 GLY HA3 1 222 PRO QD . . 3.500 2.305 1.873 3.218 . 0 0 "[ . 1 . 2]" 2
175 1 221 GLY HA2 1 222 PRO QD . . 3.500 2.463 1.854 3.023 . 0 0 "[ . 1 . 2]" 2
176 1 222 PRO HA 1 223 ILE H . . 2.700 2.298 2.149 2.634 . 0 0 "[ . 1 . 2]" 2
177 1 223 ILE HA 1 224 ALA H . . 2.700 2.446 2.176 2.723 0.023 10 0 "[ . 1 . 2]" 2
178 1 224 ALA HA 1 225 PRO HD2 . . 3.300 2.754 2.639 2.862 . 0 0 "[ . 1 . 2]" 2
179 1 224 ALA HA 1 225 PRO HD3 . . 3.300 2.021 1.963 2.086 . 0 0 "[ . 1 . 2]" 2
180 1 224 ALA MB 1 225 PRO HD2 . . 3.800 2.296 1.999 2.501 . 0 0 "[ . 1 . 2]" 2
181 1 224 ALA MB 1 225 PRO HD3 . . 3.800 2.983 2.783 3.155 . 0 0 "[ . 1 . 2]" 2
182 1 224 ALA H 1 227 GLN H . . 5.000 4.508 4.025 5.007 0.007 6 0 "[ . 1 . 2]" 2
183 1 224 ALA MB 1 227 GLN H . . 3.800 2.905 2.773 3.019 . 0 0 "[ . 1 . 2]" 2
184 1 225 PRO HA 1 226 GLY H . . 2.700 2.180 2.157 2.232 . 0 0 "[ . 1 . 2]" 2
185 1 225 PRO HA 1 227 GLN H . . 3.600 3.596 3.426 3.611 0.011 5 0 "[ . 1 . 2]" 2
186 1 226 GLY H 1 227 GLN H . . 2.900 2.606 2.169 2.865 . 0 0 "[ . 1 . 2]" 2
187 1 228 MET HA 1 229 ARG H . . 2.700 2.465 2.204 2.836 0.136 16 0 "[ . 1 . 2]" 2
188 1 229 ARG HA 1 230 GLU H . . 2.700 2.592 2.243 2.748 0.048 6 0 "[ . 1 . 2]" 2
189 1 230 GLU HA 1 231 PRO HD2 . . 2.700 2.339 2.197 2.722 0.022 5 0 "[ . 1 . 2]" 2
190 1 230 GLU HA 1 231 PRO HD3 . . 2.700 2.122 1.930 2.627 . 0 0 "[ . 1 . 2]" 2
191 1 232 ARG H 1 235 ASP H . . 5.000 3.262 2.918 3.916 . 0 0 "[ . 1 . 2]" 2
192 1 234 SER H 1 235 ASP H . . 2.900 2.677 2.570 2.786 . 0 0 "[ . 1 . 2]" 2
193 1 235 ASP H 1 236 ILE H . . 2.900 2.634 2.447 2.740 . 0 0 "[ . 1 . 2]" 2
194 1 236 ILE H 1 237 ALA H . . 2.900 2.634 2.617 2.650 . 0 0 "[ . 1 . 2]" 2
195 1 237 ALA H 1 238 GLY H . . 2.900 2.437 2.281 2.570 . 0 0 "[ . 1 . 2]" 2
196 1 234 SER H 1 236 ILE H . . 5.000 4.057 3.886 4.251 . 0 0 "[ . 1 . 2]" 2
197 1 235 ASP H 1 237 ALA H . . 5.000 3.876 3.601 4.104 . 0 0 "[ . 1 . 2]" 2
198 1 236 ILE H 1 238 GLY H . . 5.000 3.981 3.861 4.127 . 0 0 "[ . 1 . 2]" 2
199 1 235 ASP HA 1 237 ALA H . . 5.000 3.869 3.619 4.042 . 0 0 "[ . 1 . 2]" 2
200 1 234 SER HA 1 237 ALA H . . 5.000 3.382 3.227 3.655 . 0 0 "[ . 1 . 2]" 2
201 1 234 SER HA 1 237 ALA MB . . 3.800 2.599 2.245 2.948 . 0 0 "[ . 1 . 2]" 2
202 1 242 THR H 1 245 GLU H . . 5.000 3.831 3.539 4.229 . 0 0 "[ . 1 . 2]" 2
203 1 242 THR H 1 246 GLN H . . 5.000 4.551 4.007 5.014 0.014 7 0 "[ . 1 . 2]" 2
204 1 243 LEU H 1 244 GLN H . . 2.900 2.766 2.521 2.937 0.037 19 0 "[ . 1 . 2]" 2
205 1 244 GLN H 1 245 GLU H . . 2.900 2.855 2.499 2.986 0.086 16 0 "[ . 1 . 2]" 2
206 1 245 GLU H 1 246 GLN H . . 2.900 2.639 2.552 2.680 . 0 0 "[ . 1 . 2]" 2
207 1 246 GLN H 1 247 ILE H . . 2.900 2.786 2.542 2.950 0.050 13 0 "[ . 1 . 2]" 2
208 1 247 ILE H 1 248 GLY H . . 2.900 2.881 2.691 2.994 0.094 19 0 "[ . 1 . 2]" 2
209 1 248 GLY H 1 249 TRP H . . 2.900 2.765 2.625 2.813 . 0 0 "[ . 1 . 2]" 2
210 1 249 TRP H 1 250 MET H . . 2.900 2.587 2.500 2.659 . 0 0 "[ . 1 . 2]" 2
211 1 250 MET H 1 251 THR H . . 3.300 2.615 2.395 2.738 . 0 0 "[ . 1 . 2]" 2
212 1 251 THR H 1 252 HIS H . . 2.700 2.473 2.404 2.665 . 0 0 "[ . 1 . 2]" 2
213 1 243 LEU H 1 245 GLU H . . 5.000 4.006 3.650 4.323 . 0 0 "[ . 1 . 2]" 2
214 1 244 GLN H 1 246 GLN H . . 5.000 4.236 3.919 4.637 . 0 0 "[ . 1 . 2]" 2
215 1 245 GLU H 1 247 ILE H . . 5.000 4.478 3.810 4.985 . 0 0 "[ . 1 . 2]" 2
216 1 246 GLN H 1 248 GLY H . . 5.000 4.039 3.681 4.554 . 0 0 "[ . 1 . 2]" 2
217 1 247 ILE H 1 249 TRP H . . 5.000 4.362 3.901 4.621 . 0 0 "[ . 1 . 2]" 2
218 1 248 GLY H 1 250 MET H . . 5.000 3.893 3.778 4.164 . 0 0 "[ . 1 . 2]" 2
219 1 249 TRP H 1 251 THR H . . 5.000 4.064 3.580 4.270 . 0 0 "[ . 1 . 2]" 2
220 1 250 MET H 1 252 HIS H . . 5.000 3.974 3.851 4.218 . 0 0 "[ . 1 . 2]" 2
221 1 243 LEU H 1 246 GLN H . . 5.000 4.648 4.358 4.933 . 0 0 "[ . 1 . 2]" 2
222 1 244 GLN H 1 247 ILE H . . 5.000 4.909 4.689 5.041 0.041 11 0 "[ . 1 . 2]" 2
223 1 245 GLU H 1 248 GLY H . . 5.000 4.787 4.426 4.920 . 0 0 "[ . 1 . 2]" 2
224 1 249 TRP H 1 252 HIS H . . 5.000 4.921 4.760 5.014 0.014 3 0 "[ . 1 . 2]" 2
225 1 242 THR HA 1 244 GLN H . . 5.000 4.822 4.235 5.004 0.004 10 0 "[ . 1 . 2]" 2
226 1 244 GLN HA 1 247 ILE H . . 5.000 3.678 3.324 3.986 . 0 0 "[ . 1 . 2]" 2
227 1 245 GLU HA 1 248 GLY H . . 5.000 3.723 3.475 3.948 . 0 0 "[ . 1 . 2]" 2
228 1 246 GLN HA 1 249 TRP H . . 5.000 3.316 3.146 3.562 . 0 0 "[ . 1 . 2]" 2
229 1 247 ILE HA 1 250 MET H . . 5.000 3.348 3.183 3.529 . 0 0 "[ . 1 . 2]" 2
230 1 248 GLY QA 1 251 THR H . . 5.800 3.214 2.851 3.441 . 0 0 "[ . 1 . 2]" 2
231 1 243 LEU HA 1 247 ILE H . . 5.000 3.905 3.662 4.302 . 0 0 "[ . 1 . 2]" 2
232 1 247 ILE HA 1 251 THR H . . 5.000 4.540 4.153 4.738 . 0 0 "[ . 1 . 2]" 2
233 1 244 GLN HA 1 247 ILE HB . . 3.300 2.845 2.243 3.337 0.037 14 0 "[ . 1 . 2]" 2
234 1 251 THR HA 1 252 HIS H . . 3.300 3.053 3.045 3.058 . 0 0 "[ . 1 . 2]" 2
235 1 252 HIS HA 1 253 ASN H . . 2.700 2.567 2.520 2.628 . 0 0 "[ . 1 . 2]" 2
236 1 253 ASN HA 1 254 PRO HA . . 2.700 1.718 1.713 1.736 . 0 0 "[ . 1 . 2]" 2
237 1 254 PRO HA 1 255 PRO QD . . 3.500 1.979 1.946 1.985 . 0 0 "[ . 1 . 2]" 2
238 1 253 ASN HA 1 255 PRO HD2 . . 5.000 3.879 3.764 3.901 . 0 0 "[ . 1 . 2]" 2
239 1 253 ASN HA 1 255 PRO HD3 . . 3.300 2.558 2.412 2.583 . 0 0 "[ . 1 . 2]" 2
240 1 255 PRO HA 1 256 ILE H . . 2.700 2.150 2.148 2.162 . 0 0 "[ . 1 . 2]" 2
241 1 256 ILE HA 1 257 PRO QD . . 3.500 1.852 1.838 1.883 . 0 0 "[ . 1 . 2]" 2
242 1 257 PRO HA 1 258 VAL H . . 2.700 2.615 2.566 2.643 . 0 0 "[ . 1 . 2]" 2
243 1 258 VAL H 1 259 GLY H . . 2.900 2.784 2.610 2.921 0.021 10 0 "[ . 1 . 2]" 2
244 1 259 GLY H 1 260 GLU H . . 2.900 2.685 2.579 2.725 . 0 0 "[ . 1 . 2]" 2
245 1 260 GLU H 1 261 ILE H . . 2.900 2.568 2.528 2.683 . 0 0 "[ . 1 . 2]" 2
246 1 261 ILE H 1 262 TYR H . . 2.900 2.616 2.494 2.673 . 0 0 "[ . 1 . 2]" 2
247 1 262 TYR H 1 263 LYS H . . 2.900 2.665 2.506 2.791 . 0 0 "[ . 1 . 2]" 2
248 1 263 LYS H 1 264 ARG H . . 2.900 2.716 2.682 2.766 . 0 0 "[ . 1 . 2]" 2
249 1 264 ARG H 1 265 TRP H . . 2.900 2.628 2.556 2.752 . 0 0 "[ . 1 . 2]" 2
250 1 265 TRP H 1 266 ILE H . . 2.900 2.653 2.572 2.677 . 0 0 "[ . 1 . 2]" 2
251 1 266 ILE H 1 267 ILE H . . 2.900 2.764 2.744 2.778 . 0 0 "[ . 1 . 2]" 2
252 1 267 ILE H 1 268 LEU H . . 2.900 2.644 2.629 2.662 . 0 0 "[ . 1 . 2]" 2
253 1 268 LEU H 1 269 GLY H . . 2.900 2.830 2.761 2.895 . 0 0 "[ . 1 . 2]" 2
254 1 269 GLY H 1 270 LEU H . . 2.900 2.857 2.821 2.895 . 0 0 "[ . 1 . 2]" 2
255 1 270 LEU H 1 271 ASN H . . 2.900 2.858 2.809 2.891 . 0 0 "[ . 1 . 2]" 2
256 1 271 ASN H 1 272 LYS H . . 2.900 2.660 2.584 2.685 . 0 0 "[ . 1 . 2]" 2
257 1 272 LYS H 1 273 ILE H . . 2.900 2.555 2.527 2.640 . 0 0 "[ . 1 . 2]" 2
258 1 273 ILE H 1 274 VAL H . . 2.900 2.673 2.467 2.736 . 0 0 "[ . 1 . 2]" 2
259 1 274 VAL H 1 275 ARG H . . 2.900 2.592 2.468 2.696 . 0 0 "[ . 1 . 2]" 2
260 1 275 ARG H 1 276 MET H . . 2.900 2.635 2.511 2.711 . 0 0 "[ . 1 . 2]" 2
261 1 276 MET H 1 277 TYR H . . 2.900 2.240 2.158 2.478 . 0 0 "[ . 1 . 2]" 2
262 1 277 TYR H 1 278 SER H . . 2.900 2.577 2.403 2.669 . 0 0 "[ . 1 . 2]" 2
263 1 258 VAL H 1 260 GLU H . . 5.000 3.960 3.631 4.216 . 0 0 "[ . 1 . 2]" 2
264 1 259 GLY H 1 261 ILE H . . 5.000 4.035 3.922 4.166 . 0 0 "[ . 1 . 2]" 2
265 1 260 GLU H 1 262 TYR H . . 5.000 4.206 4.062 4.319 . 0 0 "[ . 1 . 2]" 2
266 1 261 ILE H 1 263 LYS H . . 5.000 4.089 3.911 4.233 . 0 0 "[ . 1 . 2]" 2
267 1 268 LEU H 1 270 LEU H . . 5.000 4.387 4.281 4.468 . 0 0 "[ . 1 . 2]" 2
268 1 269 GLY H 1 271 ASN H . . 5.000 3.933 3.864 3.992 . 0 0 "[ . 1 . 2]" 2
269 1 270 LEU H 1 272 LYS H . . 5.000 4.403 4.269 4.483 . 0 0 "[ . 1 . 2]" 2
270 1 271 ASN H 1 273 ILE H . . 5.000 3.900 3.816 3.996 . 0 0 "[ . 1 . 2]" 2
271 1 272 LYS H 1 274 VAL H . . 5.000 4.117 3.913 4.213 . 0 0 "[ . 1 . 2]" 2
272 1 273 ILE H 1 275 ARG H . . 5.000 4.062 3.872 4.204 . 0 0 "[ . 1 . 2]" 2
273 1 274 VAL H 1 276 MET H . . 5.000 3.753 3.596 3.824 . 0 0 "[ . 1 . 2]" 2
274 1 275 ARG H 1 277 TYR H . . 5.000 4.245 4.149 4.379 . 0 0 "[ . 1 . 2]" 2
275 1 276 MET H 1 278 SER H . . 5.000 3.609 3.465 3.711 . 0 0 "[ . 1 . 2]" 2
276 1 269 GLY H 1 272 LYS H . . 5.000 4.795 4.735 4.842 . 0 0 "[ . 1 . 2]" 2
277 1 258 VAL HA 1 261 ILE H . . 5.000 3.431 3.225 3.627 . 0 0 "[ . 1 . 2]" 2
278 1 264 ARG HA 1 267 ILE H . . 5.000 3.252 3.197 3.330 . 0 0 "[ . 1 . 2]" 2
279 1 265 TRP HA 1 268 LEU H . . 5.000 3.246 3.209 3.281 . 0 0 "[ . 1 . 2]" 2
280 1 267 ILE HA 1 270 LEU H . . 5.000 3.661 3.544 3.784 . 0 0 "[ . 1 . 2]" 2
281 1 268 LEU HA 1 271 ASN H . . 5.000 3.761 3.655 3.823 . 0 0 "[ . 1 . 2]" 2
282 1 270 LEU HA 1 273 ILE H . . 5.000 3.182 3.111 3.361 . 0 0 "[ . 1 . 2]" 2
283 1 271 ASN HA 1 274 VAL H . . 5.000 3.500 3.268 3.588 . 0 0 "[ . 1 . 2]" 2
284 1 272 LYS HA 1 275 ARG H . . 5.000 3.238 3.144 3.405 . 0 0 "[ . 1 . 2]" 2
285 1 273 ILE HA 1 276 MET H . . 5.000 3.466 3.231 3.678 . 0 0 "[ . 1 . 2]" 2
286 1 274 VAL HA 1 277 TYR H . . 5.000 3.074 2.855 3.406 . 0 0 "[ . 1 . 2]" 2
287 1 275 ARG HA 1 278 SER H . . 5.000 3.711 3.209 3.916 . 0 0 "[ . 1 . 2]" 2
288 1 276 MET HA 1 278 SER H . . 5.000 3.727 3.636 4.004 . 0 0 "[ . 1 . 2]" 2
289 1 264 ARG HA 1 268 LEU H . . 5.000 4.300 4.090 4.464 . 0 0 "[ . 1 . 2]" 2
290 1 272 LYS HA 1 276 MET H . . 5.000 4.332 4.135 4.536 . 0 0 "[ . 1 . 2]" 2
291 1 273 ILE HA 1 277 TYR H . . 5.000 4.272 3.843 4.728 . 0 0 "[ . 1 . 2]" 2
292 1 274 VAL HA 1 278 SER H . . 5.000 4.469 4.295 4.690 . 0 0 "[ . 1 . 2]" 2
293 1 260 GLU HA 1 263 LYS QB . . 4.100 2.725 2.152 3.825 . 0 0 "[ . 1 . 2]" 2
294 1 261 ILE HA 1 264 ARG QB . . 4.100 2.711 2.352 3.122 . 0 0 "[ . 1 . 2]" 2
295 1 263 LYS HA 1 266 ILE HB . . 5.000 2.987 2.660 3.147 . 0 0 "[ . 1 . 2]" 2
296 1 264 ARG HA 1 267 ILE HB . . 3.300 2.453 2.330 2.620 . 0 0 "[ . 1 . 2]" 2
297 1 265 TRP HA 1 268 LEU QB . . 4.100 2.242 2.157 2.319 . 0 0 "[ . 1 . 2]" 2
298 1 268 LEU HA 1 271 ASN HB2 . . 5.000 2.882 2.591 3.258 . 0 0 "[ . 1 . 2]" 2
299 1 268 LEU HA 1 271 ASN HB3 . . 5.000 3.716 3.224 4.134 . 0 0 "[ . 1 . 2]" 2
300 1 270 LEU HA 1 273 ILE HB . . 3.300 2.287 2.099 2.479 . 0 0 "[ . 1 . 2]" 2
301 1 271 ASN HA 1 274 VAL HB . . 3.300 2.874 2.374 3.054 . 0 0 "[ . 1 . 2]" 2
302 1 275 ARG HA 1 278 SER QB . . 5.000 3.128 2.102 3.530 . 0 0 "[ . 1 . 2]" 2
303 1 144 HIS HA 1 145 GLN H . . 2.700 2.267 2.187 2.288 . 0 0 "[ . 1 . 2]" 2
304 1 144 HIS QB 1 247 ILE MD . . 4.600 2.772 1.806 3.425 . 0 0 "[ . 1 . 2]" 2
305 1 144 HIS H 1 247 ILE MD . . 5.500 4.482 4.331 4.629 . 0 0 "[ . 1 . 2]" 2
306 1 144 HIS HD2 1 247 ILE MD . . 3.800 4.734 1.982 6.548 2.748 5 14 "[ *-+*********. * *2]" 2
307 1 145 GLN HA 1 146 ALA H . . 2.700 2.314 2.204 2.350 . 0 0 "[ . 1 . 2]" 2
308 1 146 ALA HA 1 147 ILE H . . 2.700 2.655 2.496 2.780 0.080 14 0 "[ . 1 . 2]" 2
309 1 146 ALA MB 1 147 ILE H . . 3.200 2.271 2.083 2.530 . 0 0 "[ . 1 . 2]" 2
310 1 147 ILE H 1 147 ILE MG . . 3.200 2.499 2.446 2.593 . 0 0 "[ . 1 . 2]" 2
311 1 147 ILE H 1 147 ILE MD . . 5.500 4.313 4.091 4.404 . 0 0 "[ . 1 . 2]" 2
312 1 147 ILE HA 1 148 SER H . . 2.700 2.274 2.224 2.283 . 0 0 "[ . 1 . 2]" 2
313 1 147 ILE MG 1 148 SER H . . 5.500 3.360 3.287 3.617 . 0 0 "[ . 1 . 2]" 2
314 1 147 ILE MD 1 148 SER H . . 5.500 4.052 3.912 4.421 . 0 0 "[ . 1 . 2]" 2
315 1 147 ILE MD 1 151 THR MG . . 3.700 1.870 1.749 2.526 . 0 0 "[ . 1 . 2]" 2
316 1 147 ILE MG 1 151 THR MG . . 4.300 2.770 2.572 3.008 . 0 0 "[ . 1 . 2]" 2
317 1 147 ILE MD 1 179 ALA MB . . 6.000 3.953 3.468 4.023 . 0 0 "[ . 1 . 2]" 2
318 1 147 ILE MG 1 183 ASP HA . . 3.800 2.945 2.810 3.064 . 0 0 "[ . 1 . 2]" 2
319 1 147 ILE MD 1 183 ASP HA . . 5.500 3.547 2.979 4.186 . 0 0 "[ . 1 . 2]" 2
320 1 147 ILE MD 1 186 THR MG . . 4.300 2.601 2.417 2.756 . 0 0 "[ . 1 . 2]" 2
321 1 147 ILE MG 1 186 THR MG . . 3.700 1.823 1.661 2.005 . 0 0 "[ . 1 . 2]" 2
322 1 147 ILE MG 1 186 THR HB . . 3.800 2.847 2.316 3.132 . 0 0 "[ . 1 . 2]" 2
323 1 147 ILE MD 1 187 MET H . . 5.500 3.663 3.011 4.138 . 0 0 "[ . 1 . 2]" 2
324 1 148 SER H 1 148 SER HB3 . . 2.700 2.120 2.116 2.131 . 0 0 "[ . 1 . 2]" 2
325 1 148 SER H 1 148 SER HB2 . . 3.300 3.354 3.340 3.391 0.091 14 0 "[ . 1 . 2]" 2
326 1 148 SER HB2 1 149 PRO HD2 . . 3.300 2.557 2.434 2.615 . 0 0 "[ . 1 . 2]" 2
327 1 148 SER HB2 1 149 PRO HD3 . . 3.300 3.097 2.978 3.219 . 0 0 "[ . 1 . 2]" 2
328 1 148 SER HB2 1 150 ARG H . . 5.000 3.662 3.521 3.784 . 0 0 "[ . 1 . 2]" 2
329 1 148 SER HB3 1 150 ARG H . . 5.000 4.019 3.989 4.069 . 0 0 "[ . 1 . 2]" 2
330 1 148 SER HB2 1 151 THR H . . 5.000 4.562 4.287 4.665 . 0 0 "[ . 1 . 2]" 2
331 1 148 SER HB3 1 151 THR H . . 5.000 3.797 3.423 4.029 . 0 0 "[ . 1 . 2]" 2
332 1 149 PRO HD2 1 150 ARG H . . 5.000 2.309 2.272 2.384 . 0 0 "[ . 1 . 2]" 2
333 1 149 PRO HA 1 150 ARG H . . 5.000 3.426 3.384 3.455 . 0 0 "[ . 1 . 2]" 2
334 1 151 THR H 1 151 THR HB . . 2.700 2.131 1.981 2.612 . 0 0 "[ . 1 . 2]" 2
335 1 151 THR HA 1 152 LEU H . . 5.000 3.574 3.553 3.604 . 0 0 "[ . 1 . 2]" 2
336 1 151 THR MG 1 152 LEU H . . 5.500 2.312 1.965 2.545 . 0 0 "[ . 1 . 2]" 2
337 1 151 THR HB 1 152 LEU H . . 5.000 3.681 3.360 4.140 . 0 0 "[ . 1 . 2]" 2
338 1 151 THR MG 1 175 LEU MD2 . . 3.700 2.453 2.254 2.574 . 0 0 "[ . 1 . 2]" 2
339 1 151 THR HA 1 175 LEU MD2 . . 3.800 2.943 2.851 3.107 . 0 0 "[ . 1 . 2]" 2
340 1 152 LEU QD 1 187 MET H . . 4.800 3.112 2.987 3.321 . 0 0 "[ . 1 . 2]" 2
341 1 152 LEU QD 1 186 THR MG . . 4.700 1.523 1.494 1.563 . 0 0 "[ . 1 . 2]" 2
342 1 152 LEU HA 1 152 LEU HG . . 2.700 2.719 2.702 2.741 0.041 13 0 "[ . 1 . 2]" 2
343 1 152 LEU H 1 152 LEU HG . . 2.700 2.683 2.409 2.735 0.035 6 0 "[ . 1 . 2]" 2
344 1 152 LEU QB 1 153 ASN H . . 3.500 2.745 2.623 2.907 . 0 0 "[ . 1 . 2]" 2
345 1 154 ALA MB 1 155 TRP H . . 3.200 2.482 2.408 2.604 . 0 0 "[ . 1 . 2]" 2
346 1 155 TRP HE1 1 191 VAL MG2 . . 5.500 2.416 1.847 3.471 . 0 0 "[ . 1 . 2]" 2
347 1 155 TRP HB3 1 156 VAL H . . 2.700 2.714 2.554 2.816 0.116 19 0 "[ . 1 . 2]" 2
348 1 156 VAL HA 1 190 THR MG . . 5.500 3.717 2.998 4.561 . 0 0 "[ . 1 . 2]" 2
349 1 156 VAL MG2 1 190 THR MG . . 3.700 2.090 1.721 2.627 . 0 0 "[ . 1 . 2]" 2
350 1 156 VAL H 1 156 VAL MG2 . . 3.200 2.265 2.122 2.461 . 0 0 "[ . 1 . 2]" 2
351 1 156 VAL H 1 156 VAL HB . . 2.700 2.333 2.218 2.408 . 0 0 "[ . 1 . 2]" 2
352 1 156 VAL HA 1 156 VAL MG1 . . 3.200 2.526 2.440 2.640 . 0 0 "[ . 1 . 2]" 2
353 1 156 VAL HA 1 156 VAL MG2 . . 3.200 2.261 2.191 2.336 . 0 0 "[ . 1 . 2]" 2
354 1 156 VAL HB 1 157 LYS H . . 2.700 2.721 2.687 2.780 0.080 13 0 "[ . 1 . 2]" 2
355 1 158 VAL H 1 158 VAL MG2 . . 3.200 2.218 2.029 2.582 . 0 0 "[ . 1 . 2]" 2
356 1 158 VAL HB 1 159 VAL H . . 3.300 2.696 2.600 2.894 . 0 0 "[ . 1 . 2]" 2
357 1 158 VAL MG1 1 171 MET ME . . 4.300 2.377 1.820 2.689 . 0 0 "[ . 1 . 2]" 2
358 1 158 VAL MG2 1 171 MET ME . . 3.700 1.945 1.690 2.333 . 0 0 "[ . 1 . 2]" 2
359 1 155 TRP HE1 1 159 VAL MG1 . . 5.500 4.298 3.804 4.493 . 0 0 "[ . 1 . 2]" 2
360 1 159 VAL H 1 159 VAL MG2 . . 3.200 2.250 1.923 2.493 . 0 0 "[ . 1 . 2]" 2
361 1 159 VAL HB 1 160 GLU H . . 3.300 2.743 2.570 3.008 . 0 0 "[ . 1 . 2]" 2
362 1 159 VAL HA 1 163 ALA H . . 5.000 2.672 2.042 3.605 . 0 0 "[ . 1 . 2]" 2
363 1 159 VAL MG1 1 163 ALA HA . . 3.800 2.653 1.967 3.040 . 0 0 "[ . 1 . 2]" 2
364 1 159 VAL MG1 1 191 VAL MG2 . . 4.300 2.469 2.003 2.641 . 0 0 "[ . 1 . 2]" 2
365 1 159 VAL MG2 1 191 VAL MG2 . . 6.000 1.914 1.805 2.044 . 0 0 "[ . 1 . 2]" 2
366 1 159 VAL MG2 1 191 VAL MG1 . . 6.000 4.052 3.957 4.098 . 0 0 "[ . 1 . 2]" 2
367 1 159 VAL MG1 1 191 VAL MG1 . . 6.000 3.718 3.355 3.951 . 0 0 "[ . 1 . 2]" 2
368 1 159 VAL MG1 1 192 GLY H . . 5.500 2.000 1.867 2.426 . 0 0 "[ . 1 . 2]" 2
369 1 162 LYS H 1 168 VAL QG . . 6.500 3.612 2.671 4.376 . 0 0 "[ . 1 . 2]" 2
370 1 163 ALA H 1 164 PHE H . . 3.300 3.222 2.981 3.360 0.060 11 0 "[ . 1 . 2]" 2
371 1 163 ALA MB 1 164 PHE H . . 3.200 2.509 2.410 2.599 . 0 0 "[ . 1 . 2]" 2
372 1 163 ALA H 1 168 VAL QG . . 6.500 3.130 2.254 4.198 . 0 0 "[ . 1 . 2]" 2
373 1 164 PHE HA 1 165 SER H . . 2.700 2.287 2.195 2.601 . 0 0 "[ . 1 . 2]" 2
374 1 164 PHE H 1 168 VAL QG . . 4.800 3.478 3.317 3.669 . 0 0 "[ . 1 . 2]" 2
375 1 165 SER H 1 168 VAL QG . . 4.200 2.080 1.767 3.016 . 0 0 "[ . 1 . 2]" 2
376 1 165 SER HB2 1 167 GLU H . . 5.000 3.278 2.795 3.603 . 0 0 "[ . 1 . 2]" 2
377 1 165 SER HA 1 165 SER HB2 . . 2.700 2.302 2.256 2.399 . 0 0 "[ . 1 . 2]" 2
378 1 165 SER HB2 1 166 PRO HD2 . . 3.300 2.037 1.843 2.376 . 0 0 "[ . 1 . 2]" 2
379 1 166 PRO HG2 1 167 GLU H . . 3.300 3.299 2.844 3.380 0.080 8 0 "[ . 1 . 2]" 2
380 1 166 PRO HA 1 169 ILE MD . . 5.500 4.256 2.609 4.662 . 0 0 "[ . 1 . 2]" 2
381 1 166 PRO HA 1 274 VAL MG1 . . 3.800 2.854 2.754 3.017 . 0 0 "[ . 1 . 2]" 2
382 1 166 PRO HA 1 274 VAL MG2 . . 5.500 3.518 2.900 3.708 . 0 0 "[ . 1 . 2]" 2
383 1 168 VAL QG 1 270 LEU MD1 . . 7.000 3.853 3.480 4.182 . 0 0 "[ . 1 . 2]" 2
384 1 168 VAL H 1 168 VAL HB . . 2.700 2.420 2.224 2.751 0.051 6 0 "[ . 1 . 2]" 2
385 1 169 ILE H 1 170 PRO QD . . 5.800 2.088 1.996 2.188 . 0 0 "[ . 1 . 2]" 2
386 1 169 ILE MG 1 270 LEU MD1 . . 6.000 3.663 3.294 3.941 . 0 0 "[ . 1 . 2]" 2
387 1 169 ILE MD 1 270 LEU MD1 . . 6.000 2.887 2.303 3.917 . 0 0 "[ . 1 . 2]" 2
388 1 169 ILE MD 1 270 LEU H . . 5.500 3.987 3.740 4.457 . 0 0 "[ . 1 . 2]" 2
389 1 169 ILE MD 1 274 VAL H . . 5.500 3.691 3.262 4.192 . 0 0 "[ . 1 . 2]" 2
390 1 169 ILE MD 1 271 ASN H . . 3.800 2.860 2.505 3.083 . 0 0 "[ . 1 . 2]" 2
391 1 169 ILE MD 1 274 VAL MG2 . . 4.300 2.114 1.800 2.610 . 0 0 "[ . 1 . 2]" 2
392 1 169 ILE MD 1 271 ASN HA . . 3.800 2.334 1.801 2.814 . 0 0 "[ . 1 . 2]" 2
393 1 170 PRO QD 1 171 MET H . . 5.800 2.235 2.233 2.238 . 0 0 "[ . 1 . 2]" 2
394 1 170 PRO HB2 1 171 MET H . . 3.300 3.316 3.271 3.367 0.067 20 0 "[ . 1 . 2]" 2
395 1 170 PRO QG 1 171 MET H . . 5.800 2.802 2.756 2.855 . 0 0 "[ . 1 . 2]" 2
396 1 171 MET ME 1 175 LEU MD1 . . 4.300 2.328 1.756 2.874 . 0 0 "[ . 1 . 2]" 2
397 1 172 PHE HA 1 187 MET ME . . 3.800 2.787 2.372 3.237 . 0 0 "[ . 1 . 2]" 2
398 1 173 SER H 1 267 ILE MD . . 5.500 3.133 2.561 3.655 . 0 0 "[ . 1 . 2]" 2
399 1 173 SER HA 1 267 ILE MD . . 3.800 2.912 2.399 3.196 . 0 0 "[ . 1 . 2]" 2
400 1 174 ALA H 1 174 ALA MB . . 3.200 2.017 1.933 2.151 . 0 0 "[ . 1 . 2]" 2
401 1 175 LEU H 1 175 LEU MD2 . . 5.500 4.442 4.424 4.456 . 0 0 "[ . 1 . 2]" 2
402 1 176 SER HA 1 187 MET ME . . 5.500 3.841 3.137 4.406 . 0 0 "[ . 1 . 2]" 2
403 1 176 SER HA 1 179 ALA MB . . 3.800 2.491 2.152 2.687 . 0 0 "[ . 1 . 2]" 2
404 1 176 SER H 1 176 SER HB3 . . 2.700 2.439 2.186 2.711 0.011 4 0 "[ . 1 . 2]" 2
405 1 179 ALA HA 1 180 THR H . . 2.700 2.690 2.544 2.729 0.029 8 0 "[ . 1 . 2]" 2
406 1 179 ALA MB 1 183 ASP QB . . 6.300 2.636 2.282 3.696 . 0 0 "[ . 1 . 2]" 2
407 1 179 ALA MB 1 184 LEU MD1 . . 4.300 2.517 1.950 2.737 . 0 0 "[ . 1 . 2]" 2
408 1 179 ALA MB 1 184 LEU MD2 . . 3.700 2.132 1.868 2.298 . 0 0 "[ . 1 . 2]" 2
409 1 179 ALA H 1 179 ALA MB . . 3.200 2.260 2.180 2.329 . 0 0 "[ . 1 . 2]" 2
410 1 179 ALA MB 1 180 THR H . . 3.200 2.109 1.993 2.336 . 0 0 "[ . 1 . 2]" 2
411 1 180 THR MG 1 182 GLN H . . 5.500 4.317 4.239 4.484 . 0 0 "[ . 1 . 2]" 2
412 1 180 THR MG 1 183 ASP H . . 5.500 3.504 3.268 3.705 . 0 0 "[ . 1 . 2]" 2
413 1 180 THR MG 1 183 ASP QB . . 4.000 2.529 2.322 2.770 . 0 0 "[ . 1 . 2]" 2
414 1 180 THR MG 1 243 LEU MD2 . . 4.300 2.446 1.930 2.769 . 0 0 "[ . 1 . 2]" 2
415 1 180 THR MG 1 243 LEU MD1 . . 6.000 3.329 2.506 3.854 . 0 0 "[ . 1 . 2]" 2
416 1 180 THR MG 1 247 ILE MD . . 3.700 1.779 1.625 1.921 . 0 0 "[ . 1 . 2]" 2
417 1 180 THR MG 1 247 ILE HA . . 5.500 3.770 3.597 3.924 . 0 0 "[ . 1 . 2]" 2
418 1 180 THR MG 1 247 ILE H . . 5.500 4.467 4.401 4.521 . 0 0 "[ . 1 . 2]" 2
419 1 180 THR MG 1 247 ILE HG13 . . 5.500 2.688 2.136 3.818 . 0 0 "[ . 1 . 2]" 2
420 1 180 THR MG 1 247 ILE MG . . 6.000 4.041 3.991 4.085 . 0 0 "[ . 1 . 2]" 2
421 1 180 THR MG 1 250 MET ME . . 3.700 2.044 1.767 2.305 . 0 0 "[ . 1 . 2]" 2
422 1 180 THR H 1 250 MET ME . . 5.500 3.944 3.714 4.162 . 0 0 "[ . 1 . 2]" 2
423 1 180 THR HA 1 250 MET ME . . 3.800 2.188 1.852 2.999 . 0 0 "[ . 1 . 2]" 2
424 1 180 THR H 1 180 THR MG . . 3.800 1.911 1.859 2.033 . 0 0 "[ . 1 . 2]" 2
425 1 182 GLN QG 1 243 LEU MD2 . . 6.300 3.720 2.718 4.473 . 0 0 "[ . 1 . 2]" 2
426 1 184 LEU HA 1 184 LEU MD2 . . 3.800 2.113 1.955 2.426 . 0 0 "[ . 1 . 2]" 2
427 1 184 LEU MD1 1 263 LYS H . . 3.800 2.982 2.369 3.273 . 0 0 "[ . 1 . 2]" 2
428 1 184 LEU MD1 1 263 LYS HA . . 5.500 2.582 2.210 3.101 . 0 0 "[ . 1 . 2]" 2
429 1 184 LEU MD2 1 266 ILE MD . . 4.300 2.475 1.873 2.867 . 0 0 "[ . 1 . 2]" 2
430 1 184 LEU MD1 1 266 ILE MD . . 4.300 2.461 2.007 2.785 . 0 0 "[ . 1 . 2]" 2
431 1 186 THR MG 1 187 MET H . . 3.800 2.690 2.284 3.066 . 0 0 "[ . 1 . 2]" 2
432 1 186 THR HB 1 187 MET H . . 3.300 3.073 2.810 3.309 0.009 7 0 "[ . 1 . 2]" 2
433 1 186 THR H 1 186 THR HB . . 2.700 1.985 1.946 2.083 . 0 0 "[ . 1 . 2]" 2
434 1 187 MET HA 1 190 THR MG . . 5.500 2.386 1.967 3.486 . 0 0 "[ . 1 . 2]" 2
435 1 188 LEU MD2 1 198 MET ME . . 4.300 2.112 1.750 2.695 . 0 0 "[ . 1 . 2]" 2
436 1 188 LEU MD1 1 198 MET ME . . 4.300 2.825 2.618 3.009 . 0 0 "[ . 1 . 2]" 2
437 1 188 LEU MD2 1 266 ILE MG . . 4.300 2.295 1.926 2.661 . 0 0 "[ . 1 . 2]" 2
438 1 188 LEU MD2 1 266 ILE MD . . 6.000 2.910 2.131 3.613 . 0 0 "[ . 1 . 2]" 2
439 1 188 LEU MD1 1 266 ILE MG . . 4.300 1.941 1.758 2.482 . 0 0 "[ . 1 . 2]" 2
440 1 188 LEU MD1 1 266 ILE MD . . 3.700 1.958 1.872 2.080 . 0 0 "[ . 1 . 2]" 2
441 1 188 LEU MD2 1 201 LEU MD2 . . 4.300 2.514 1.780 2.919 . 0 0 "[ . 1 . 2]" 2
442 1 190 THR H 1 190 THR MG . . 3.200 2.343 1.878 2.556 . 0 0 "[ . 1 . 2]" 2
443 1 190 THR HA 1 191 VAL H . . 5.000 3.385 3.178 3.632 . 0 0 "[ . 1 . 2]" 2
444 1 191 VAL H 1 191 VAL HB . . 2.700 2.147 2.050 2.741 0.041 15 0 "[ . 1 . 2]" 2
445 1 191 VAL HA 1 192 GLY H . . 2.700 2.727 2.656 2.893 0.193 17 0 "[ . 1 . 2]" 2
446 1 191 VAL HA 1 191 VAL MG2 . . 3.200 2.042 1.997 2.080 . 0 0 "[ . 1 . 2]" 2
447 1 191 VAL H 1 198 MET ME . . 5.500 4.422 4.322 4.510 . 0 0 "[ . 1 . 2]" 2
448 1 191 VAL HB 1 198 MET ME . . 3.800 2.886 2.018 3.183 . 0 0 "[ . 1 . 2]" 2
449 1 191 VAL MG1 1 198 MET ME . . 4.300 1.898 1.703 2.609 . 0 0 "[ . 1 . 2]" 2
450 1 191 VAL MG2 1 198 MET ME . . 4.300 2.317 1.707 2.717 . 0 0 "[ . 1 . 2]" 2
451 1 191 VAL MG1 1 192 GLY H . . 3.200 2.348 1.890 2.571 . 0 0 "[ . 1 . 2]" 2
452 1 191 VAL MG2 1 192 GLY H . . 3.200 1.963 1.859 2.079 . 0 0 "[ . 1 . 2]" 2
453 1 191 VAL MG1 1 193 GLY H . . 5.500 2.376 1.718 3.556 . 0 0 "[ . 1 . 2]" 2
454 1 191 VAL MG2 1 193 GLY H . . 5.500 3.289 2.756 4.154 . 0 0 "[ . 1 . 2]" 2
455 1 191 VAL MG1 1 194 HIS H . . 5.500 3.948 1.944 4.451 . 0 0 "[ . 1 . 2]" 2
456 1 192 GLY H 1 193 GLY H . . 3.300 2.671 1.879 3.304 0.004 13 0 "[ . 1 . 2]" 2
457 1 192 GLY HA2 1 193 GLY H . . 3.300 2.686 2.276 3.112 . 0 0 "[ . 1 . 2]" 2
458 1 192 GLY H 1 198 MET ME . . 5.500 4.330 4.055 4.491 . 0 0 "[ . 1 . 2]" 2
459 1 193 GLY H 1 194 HIS H . . 2.700 2.547 1.985 2.731 0.031 12 0 "[ . 1 . 2]" 2
460 1 193 GLY QA 1 194 HIS H . . 3.500 2.802 2.476 2.918 . 0 0 "[ . 1 . 2]" 2
461 1 194 HIS HA 1 195 GLN H . . 2.700 2.265 2.186 2.433 . 0 0 "[ . 1 . 2]" 2
462 1 194 HIS H 1 197 ALA MB . . 5.500 4.135 3.329 4.480 . 0 0 "[ . 1 . 2]" 2
463 1 196 ALA H 1 196 ALA MB . . 3.200 2.054 1.932 2.161 . 0 0 "[ . 1 . 2]" 2
464 1 196 ALA MB 1 197 ALA H . . 3.200 2.494 2.413 2.624 . 0 0 "[ . 1 . 2]" 2
465 1 197 ALA HA 1 200 MET ME . . 5.500 2.653 1.808 3.420 . 0 0 "[ . 1 . 2]" 2
466 1 197 ALA MB 1 200 MET ME . . 6.000 3.515 2.573 3.901 . 0 0 "[ . 1 . 2]" 2
467 1 197 ALA MB 1 273 ILE MD . . 4.300 2.382 2.043 2.627 . 0 0 "[ . 1 . 2]" 2
468 1 197 ALA MB 1 273 ILE MG . . 4.300 2.074 1.668 2.574 . 0 0 "[ . 1 . 2]" 2
469 1 197 ALA H 1 197 ALA MB . . 3.200 2.065 1.947 2.158 . 0 0 "[ . 1 . 2]" 2
470 1 197 ALA MB 1 198 MET H . . 3.200 2.486 2.405 2.616 . 0 0 "[ . 1 . 2]" 2
471 1 198 MET ME 1 201 LEU MD2 . . 4.300 2.190 1.775 2.724 . 0 0 "[ . 1 . 2]" 2
472 1 198 MET ME 1 273 ILE MD . . 6.000 4.079 3.964 4.148 . 0 0 "[ . 1 . 2]" 2
473 1 200 MET ME 1 273 ILE HA . . 3.800 3.060 2.624 3.247 . 0 0 "[ . 1 . 2]" 2
474 1 200 MET ME 1 273 ILE MG . . 6.000 3.439 2.515 3.780 . 0 0 "[ . 1 . 2]" 2
475 1 201 LEU MD2 1 205 ILE MD . . 4.300 2.600 2.389 2.707 . 0 0 "[ . 1 . 2]" 2
476 1 201 LEU HG 1 205 ILE QG . . 4.100 2.725 2.412 2.936 . 0 0 "[ . 1 . 2]" 2
477 1 201 LEU MD2 1 273 ILE MD . . 4.300 2.813 2.531 2.973 . 0 0 "[ . 1 . 2]" 2
478 1 201 LEU MD1 1 270 LEU H . . 5.500 2.139 1.883 2.496 . 0 0 "[ . 1 . 2]" 2
479 1 201 LEU MD2 1 270 LEU H . . 5.500 3.593 2.826 4.046 . 0 0 "[ . 1 . 2]" 2
480 1 201 LEU H 1 273 ILE MD . . 5.500 3.478 2.862 4.385 . 0 0 "[ . 1 . 2]" 2
481 1 204 THR MG 1 269 GLY H . . 3.200 2.569 2.449 2.673 . 0 0 "[ . 1 . 2]" 2
482 1 204 THR MG 1 268 LEU HB3 . . 3.800 2.101 1.925 2.285 . 0 0 "[ . 1 . 2]" 2
483 1 204 THR MG 1 268 LEU HB2 . . 5.500 3.338 3.138 3.534 . 0 0 "[ . 1 . 2]" 2
484 1 204 THR MG 1 268 LEU MD2 . . 3.700 2.175 1.989 2.322 . 0 0 "[ . 1 . 2]" 2
485 1 204 THR MG 1 269 GLY HA2 . . 5.500 2.403 2.034 2.703 . 0 0 "[ . 1 . 2]" 2
486 1 204 THR H 1 204 THR HB . . 2.700 1.996 1.968 2.032 . 0 0 "[ . 1 . 2]" 2
487 1 204 THR MG 1 205 ILE H . . 3.800 2.693 2.281 2.982 . 0 0 "[ . 1 . 2]" 2
488 1 205 ILE MD 1 266 ILE H . . 3.800 2.816 2.758 2.860 . 0 0 "[ . 1 . 2]" 2
489 1 205 ILE MD 1 262 TYR HE1 . . 3.800 2.777 2.277 3.040 . 0 0 "[ . 1 . 2]" 2
490 1 205 ILE MG 1 262 TYR HE1 . . 3.200 2.195 1.876 2.591 . 0 0 "[ . 1 . 2]" 2
491 1 205 ILE MG 1 265 TRP HE3 . . 3.800 2.003 1.773 2.524 . 0 0 "[ . 1 . 2]" 2
492 1 205 ILE H 1 205 ILE HB . . 2.700 2.288 2.249 2.319 . 0 0 "[ . 1 . 2]" 2
493 1 205 ILE MG 1 206 ASN H . . 3.800 3.100 2.971 3.178 . 0 0 "[ . 1 . 2]" 2
494 1 209 ALA MB 1 233 GLY HA3 . . 3.800 1.998 1.739 2.185 . 0 0 "[ . 1 . 2]" 2
495 1 209 ALA MB 1 233 GLY HA2 . . 3.800 2.891 2.678 3.095 . 0 0 "[ . 1 . 2]" 2
496 1 209 ALA MB 1 234 SER H . . 3.800 2.912 2.808 3.068 . 0 0 "[ . 1 . 2]" 2
497 1 209 ALA H 1 209 ALA MB . . 3.200 2.035 1.957 2.183 . 0 0 "[ . 1 . 2]" 2
498 1 209 ALA MB 1 210 ALA H . . 3.200 2.550 2.409 2.602 . 0 0 "[ . 1 . 2]" 2
499 1 210 ALA H 1 210 ALA MB . . 3.200 2.008 1.932 2.114 . 0 0 "[ . 1 . 2]" 2
500 1 210 ALA MB 1 211 GLU H . . 3.200 2.558 2.443 2.630 . 0 0 "[ . 1 . 2]" 2
501 1 212 TRP HE1 1 232 ARG HA . . 5.000 4.024 2.863 5.025 0.025 16 0 "[ . 1 . 2]" 2
502 1 212 TRP HE1 1 236 ILE MD . . 3.800 2.933 1.983 3.251 . 0 0 "[ . 1 . 2]" 2
503 1 215 LEU H 1 215 LEU HG . . 2.700 2.139 1.951 2.699 . 0 0 "[ . 1 . 2]" 2
504 1 215 LEU H 1 215 LEU MD1 . . 3.800 3.030 2.919 3.115 . 0 0 "[ . 1 . 2]" 2
505 1 215 LEU HA 1 216 HIS H . . 3.300 3.316 3.270 3.349 0.049 12 0 "[ . 1 . 2]" 2
506 1 218 VAL QG 1 232 ARG HA . . 6.500 4.134 3.391 4.790 . 0 0 "[ . 1 . 2]" 2
507 1 219 HIS HD2 1 230 GLU QG . . 5.800 8.726 4.942 11.858 6.058 19 18 "[****** *** *-*****+*]" 2
508 1 223 ILE MD 1 227 GLN H . . 5.500 3.857 3.002 4.411 . 0 0 "[ . 1 . 2]" 2
509 1 223 ILE MD 1 229 ARG H . . 3.800 2.470 1.836 3.213 . 0 0 "[ . 1 . 2]" 2
510 1 223 ILE MG 1 229 ARG H . . 5.500 4.218 2.482 4.584 . 0 0 "[ . 1 . 2]" 2
511 1 224 ALA H 1 227 GLN QB . . 4.100 2.904 2.465 3.619 . 0 0 "[ . 1 . 2]" 2
512 1 224 ALA MB 1 227 GLN QG . . 4.000 2.257 1.726 2.956 . 0 0 "[ . 1 . 2]" 2
513 1 228 MET ME 1 245 GLU HA . . 3.800 2.845 2.242 3.261 . 0 0 "[ . 1 . 2]" 2
514 1 228 MET ME 1 248 GLY QA . . 6.300 4.178 3.278 4.557 . 0 0 "[ . 1 . 2]" 2
515 1 228 MET ME 1 249 TRP HE1 . . 5.500 3.718 3.136 4.298 . 0 0 "[ . 1 . 2]" 2
516 1 228 MET QG 1 249 TRP HE1 . . 4.100 2.915 1.995 3.763 . 0 0 "[ . 1 . 2]" 2
517 1 228 MET QB 1 249 TRP HE1 . . 4.100 2.913 1.871 3.476 . 0 0 "[ . 1 . 2]" 2
518 1 228 MET ME 1 249 TRP H . . 3.800 3.160 2.765 3.297 . 0 0 "[ . 1 . 2]" 2
519 1 228 MET ME 1 249 TRP HD1 . . 5.500 3.319 1.881 4.139 . 0 0 "[ . 1 . 2]" 2
520 1 229 ARG H 1 249 TRP HE1 . . 5.000 4.851 4.061 5.067 0.067 16 0 "[ . 1 . 2]" 2
521 1 229 ARG QG 1 249 TRP HE1 . . 5.800 5.908 4.411 7.480 1.680 17 6 "[* -* 1* .*+ 2]" 2
522 1 229 ARG HE 1 240 THR MG . . 5.500 7.626 1.867 11.183 5.683 2 16 "[*+**.****1** ***** -]" 2
523 1 230 GLU HA 1 249 TRP HE1 . . 5.000 4.133 3.268 4.944 . 0 0 "[ . 1 . 2]" 2
524 1 230 GLU HA 1 256 ILE MD . . 5.500 4.325 3.862 4.537 . 0 0 "[ . 1 . 2]" 2
525 1 231 PRO HA 1 232 ARG H . . 2.700 2.296 2.150 2.707 0.007 4 0 "[ . 1 . 2]" 2
526 1 231 PRO HD2 1 249 TRP HE1 . . 5.000 4.474 3.642 5.031 0.031 10 0 "[ . 1 . 2]" 2
527 1 231 PRO HD3 1 249 TRP HE1 . . 5.000 3.081 2.200 3.851 . 0 0 "[ . 1 . 2]" 2
528 1 235 ASP HA 1 241 SER H . . 3.300 3.248 2.670 3.318 0.018 14 0 "[ . 1 . 2]" 2
529 1 236 ILE MD 1 258 VAL MG2 . . 4.300 2.676 2.026 2.954 . 0 0 "[ . 1 . 2]" 2
530 1 236 ILE MG 1 258 VAL MG2 . . 6.000 2.840 1.894 3.838 . 0 0 "[ . 1 . 2]" 2
531 1 236 ILE MD 1 261 ILE MD . . 4.300 2.100 1.769 2.577 . 0 0 "[ . 1 . 2]" 2
532 1 236 ILE MD 1 261 ILE MG . . 3.700 1.967 1.721 2.201 . 0 0 "[ . 1 . 2]" 2
533 1 236 ILE MG 1 261 ILE MG . . 3.700 1.992 1.913 2.150 . 0 0 "[ . 1 . 2]" 2
534 1 236 ILE MG 1 261 ILE MD . . 6.000 3.261 2.769 3.600 . 0 0 "[ . 1 . 2]" 2
535 1 236 ILE MG 1 262 TYR H . . 3.200 2.754 2.673 2.814 . 0 0 "[ . 1 . 2]" 2
536 1 236 ILE MG 1 262 TYR HA . . 3.800 3.071 2.759 3.201 . 0 0 "[ . 1 . 2]" 2
537 1 237 ALA MB 1 239 THR H . . 3.800 2.853 2.732 3.020 . 0 0 "[ . 1 . 2]" 2
538 1 238 GLY H 1 239 THR H . . 2.700 2.291 2.120 2.610 . 0 0 "[ . 1 . 2]" 2
539 1 238 GLY H 1 240 THR H . . 5.000 3.720 3.489 4.118 . 0 0 "[ . 1 . 2]" 2
540 1 238 GLY H 1 241 SER H . . 5.000 3.915 3.575 4.207 . 0 0 "[ . 1 . 2]" 2
541 1 238 GLY QA 1 241 SER H . . 5.800 2.874 2.665 2.980 . 0 0 "[ . 1 . 2]" 2
542 1 239 THR H 1 240 THR H . . 2.700 2.301 2.234 2.465 . 0 0 "[ . 1 . 2]" 2
543 1 239 THR H 1 241 SER H . . 3.300 3.278 3.179 3.319 0.019 10 0 "[ . 1 . 2]" 2
544 1 239 THR MG 1 240 THR H . . 3.800 2.574 1.920 3.037 . 0 0 "[ . 1 . 2]" 2
545 1 240 THR H 1 241 SER H . . 2.700 2.130 1.893 2.242 . 0 0 "[ . 1 . 2]" 2
546 1 240 THR HA 1 241 SER H . . 3.300 3.308 3.237 3.335 0.035 10 0 "[ . 1 . 2]" 2
547 1 241 SER HA 1 242 THR H . . 2.700 2.347 2.261 2.446 . 0 0 "[ . 1 . 2]" 2
548 1 241 SER HA 1 249 TRP HZ3 . . 5.000 9.100 3.505 11.316 6.316 3 18 "[ *+***** ****-******]" 2
549 1 241 SER HA 1 249 TRP HH2 . . 5.000 9.341 4.390 12.072 7.072 3 18 "[ *+***** ****-******]" 2
550 1 242 THR H 1 242 THR MG . . 3.800 2.933 2.446 3.384 . 0 0 "[ . 1 . 2]" 2
551 1 242 THR HA 1 243 LEU H . . 2.700 2.556 2.388 2.665 . 0 0 "[ . 1 . 2]" 2
552 1 242 THR HB 1 243 LEU H . . 5.000 3.933 3.313 4.199 . 0 0 "[ . 1 . 2]" 2
553 1 242 THR MG 1 243 LEU H . . 3.200 2.166 1.860 2.500 . 0 0 "[ . 1 . 2]" 2
554 1 242 THR HB 1 244 GLN H . . 5.000 4.734 2.939 5.067 0.067 8 0 "[ . 1 . 2]" 2
555 1 242 THR MG 1 244 GLN H . . 3.800 1.991 1.746 2.973 . 0 0 "[ . 1 . 2]" 2
556 1 243 LEU HA 1 243 LEU MD2 . . 3.800 1.988 1.913 2.213 . 0 0 "[ . 1 . 2]" 2
557 1 243 LEU HB3 1 244 GLN H . . 3.300 2.412 2.278 2.877 . 0 0 "[ . 1 . 2]" 2
558 1 243 LEU HG 1 244 GLN H . . 5.000 4.692 4.309 4.961 . 0 0 "[ . 1 . 2]" 2
559 1 243 LEU MD1 1 244 GLN H . . 3.800 2.867 2.438 3.008 . 0 0 "[ . 1 . 2]" 2
560 1 243 LEU MD2 1 244 GLN H . . 5.500 4.205 3.900 4.335 . 0 0 "[ . 1 . 2]" 2
561 1 243 LEU MD2 1 246 GLN H . . 5.500 3.960 3.675 4.352 . 0 0 "[ . 1 . 2]" 2
562 1 243 LEU MD2 1 246 GLN QB . . 6.300 2.636 2.103 3.152 . 0 0 "[ . 1 . 2]" 2
563 1 243 LEU MD2 1 247 ILE MD . . 4.300 1.901 1.597 2.638 . 0 0 "[ . 1 . 2]" 2
564 1 243 LEU MD1 1 247 ILE MD . . 3.700 1.856 1.674 2.185 . 0 0 "[ . 1 . 2]" 2
565 1 246 GLN HA 1 249 TRP HE3 . . 5.000 4.704 1.985 5.109 0.109 12 0 "[ . 1 . 2]" 2
566 1 247 ILE H 1 247 ILE HB . . 3.300 2.222 2.101 2.439 . 0 0 "[ . 1 . 2]" 2
567 1 247 ILE H 1 247 ILE MD . . 3.800 2.608 2.112 3.132 . 0 0 "[ . 1 . 2]" 2
568 1 247 ILE MG 1 248 GLY H . . 3.800 3.014 2.906 3.191 . 0 0 "[ . 1 . 2]" 2
569 1 247 ILE HB 1 248 GLY H . . 3.300 2.831 2.327 3.179 . 0 0 "[ . 1 . 2]" 2
570 1 247 ILE HG12 1 248 GLY H . . 5.800 5.059 4.210 5.425 . 0 0 "[ . 1 . 2]" 2
571 1 247 ILE MG 1 251 THR H . . 5.500 4.259 3.876 4.455 . 0 0 "[ . 1 . 2]" 2
572 1 247 ILE MD 1 250 MET ME . . 4.300 2.612 1.917 3.081 . 0 0 "[ . 1 . 2]" 2
573 1 247 ILE MG 1 250 MET ME . . 6.000 3.835 3.535 4.014 . 0 0 "[ . 1 . 2]" 2
574 1 247 ILE HA 1 250 MET ME . . 3.800 2.148 1.900 2.672 . 0 0 "[ . 1 . 2]" 2
575 1 248 GLY QA 1 249 TRP H . . 4.100 2.721 2.675 2.826 . 0 0 "[ . 1 . 2]" 2
576 1 249 TRP HB2 1 250 MET H . . 5.000 3.260 3.086 3.753 . 0 0 "[ . 1 . 2]" 2
577 1 249 TRP HA 1 256 ILE MD . . 5.500 3.392 2.842 3.873 . 0 0 "[ . 1 . 2]" 2
578 1 249 TRP HD1 1 256 ILE MD . . 5.500 2.316 1.882 3.893 . 0 0 "[ . 1 . 2]" 2
579 1 249 TRP HE1 1 256 ILE MD . . 3.800 3.092 2.146 3.285 . 0 0 "[ . 1 . 2]" 2
580 1 250 MET HA 1 250 MET ME . . 5.500 4.263 3.760 4.539 . 0 0 "[ . 1 . 2]" 2
581 1 250 MET HA 1 257 PRO HA . . 5.000 4.096 3.611 4.516 . 0 0 "[ . 1 . 2]" 2
582 1 250 MET ME 1 258 VAL MG1 . . 6.000 2.669 2.121 3.335 . 0 0 "[ . 1 . 2]" 2
583 1 250 MET HA 1 258 VAL MG1 . . 5.500 4.304 3.811 4.558 . 0 0 "[ . 1 . 2]" 2
584 1 250 MET ME 1 259 GLY H . . 3.800 3.038 2.833 3.187 . 0 0 "[ . 1 . 2]" 2
585 1 252 HIS H 1 256 ILE H . . 3.300 3.342 3.318 3.375 0.075 17 0 "[ . 1 . 2]" 2
586 1 252 HIS H 1 255 PRO HA . . 5.000 2.761 2.621 2.862 . 0 0 "[ . 1 . 2]" 2
587 1 256 ILE MG 1 261 ILE MD . . 4.300 2.836 2.503 2.997 . 0 0 "[ . 1 . 2]" 2
588 1 256 ILE MG 1 258 VAL MG2 . . 4.300 2.455 1.986 2.912 . 0 0 "[ . 1 . 2]" 2
589 1 256 ILE H 1 256 ILE MD . . 3.800 3.030 2.884 3.121 . 0 0 "[ . 1 . 2]" 2
590 1 257 PRO HA 1 260 GLU H . . 5.000 3.216 3.098 3.365 . 0 0 "[ . 1 . 2]" 2
591 1 258 VAL HA 1 261 ILE MD . . 5.500 2.255 1.778 2.823 . 0 0 "[ . 1 . 2]" 2
592 1 258 VAL MG1 1 259 GLY H . . 3.200 2.177 1.861 2.490 . 0 0 "[ . 1 . 2]" 2
593 1 261 ILE MG 1 265 TRP HE1 . . 3.200 2.309 2.105 2.528 . 0 0 "[ . 1 . 2]" 2
594 1 263 LYS HA 1 266 ILE MD . . 3.800 2.258 1.970 2.912 . 0 0 "[ . 1 . 2]" 2
595 1 265 TRP H 1 268 LEU MD1 . . 5.500 4.386 4.174 4.468 . 0 0 "[ . 1 . 2]" 2
596 1 265 TRP HA 1 268 LEU MD1 . . 3.800 2.445 2.121 2.676 . 0 0 "[ . 1 . 2]" 2
597 1 265 TRP HE1 1 268 LEU MD1 . . 5.500 4.555 4.431 4.622 . 0 0 "[ . 1 . 2]" 2
598 1 266 ILE MG 1 267 ILE MD . . 6.000 3.449 3.037 3.885 . 0 0 "[ . 1 . 2]" 2
599 1 266 ILE HB 1 267 ILE MD . . 5.500 3.246 2.866 3.754 . 0 0 "[ . 1 . 2]" 2
600 1 266 ILE MG 1 270 LEU MD1 . . 4.300 1.679 1.611 1.761 . 0 0 "[ . 1 . 2]" 2
601 1 266 ILE MG 1 270 LEU MD2 . . 4.300 2.837 2.795 2.900 . 0 0 "[ . 1 . 2]" 2
602 1 266 ILE MG 1 270 LEU H . . 5.500 3.525 3.429 3.609 . 0 0 "[ . 1 . 2]" 2
603 1 266 ILE MG 1 267 ILE H . . 5.500 3.474 3.361 3.548 . 0 0 "[ . 1 . 2]" 2
604 1 267 ILE MG 1 268 LEU H . . 3.800 2.955 2.887 3.017 . 0 0 "[ . 1 . 2]" 2
605 1 268 LEU HB3 1 269 GLY H . . 2.700 2.600 2.464 2.714 0.014 17 0 "[ . 1 . 2]" 2
606 1 270 LEU H 1 270 LEU MD1 . . 3.800 3.195 3.181 3.223 . 0 0 "[ . 1 . 2]" 2
607 1 270 LEU H 1 270 LEU MD2 . . 3.800 3.269 3.221 3.318 . 0 0 "[ . 1 . 2]" 2
608 1 270 LEU MD2 1 273 ILE MD . . 4.300 2.283 2.081 2.729 . 0 0 "[ . 1 . 2]" 2
609 1 273 ILE MG 1 277 TYR HD2 . . 5.500 3.573 2.138 4.572 . 0 0 "[ . 1 . 2]" 2
610 1 274 VAL H 1 274 VAL HB . . 3.300 2.307 2.200 2.430 . 0 0 "[ . 1 . 2]" 2
611 1 274 VAL H 1 274 VAL MG2 . . 3.200 2.293 2.144 2.502 . 0 0 "[ . 1 . 2]" 2
612 1 274 VAL HB 1 275 ARG H . . 3.300 2.667 2.582 2.832 . 0 0 "[ . 1 . 2]" 2
613 1 275 ARG HA 1 276 MET H . . 3.300 3.457 3.455 3.458 0.158 11 0 "[ . 1 . 2]" 2
614 1 277 TYR HA 1 278 SER H . . 3.300 3.164 3.129 3.310 0.010 18 0 "[ . 1 . 2]" 2
stop_
save_
save_distance_constraint_statistics_3
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 3
_Distance_constraint_stats_list.Constraint_count 143
_Distance_constraint_stats_list.Viol_count 747
_Distance_constraint_stats_list.Viol_total 2002.244
_Distance_constraint_stats_list.Viol_max 4.670
_Distance_constraint_stats_list.Viol_rms 0.2984
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0350
_Distance_constraint_stats_list.Viol_average_violations_only 0.1340
_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
1 148 SER 0.798 0.068 20 0 "[ . 1 . 2]"
1 149 PRO 0.009 0.008 20 0 "[ . 1 . 2]"
1 150 ARG 0.052 0.033 14 0 "[ . 1 . 2]"
1 151 THR 0.902 0.068 20 0 "[ . 1 . 2]"
1 152 LEU 0.492 0.072 11 0 "[ . 1 . 2]"
1 153 ASN 0.015 0.008 20 0 "[ . 1 . 2]"
1 154 ALA 0.137 0.033 14 0 "[ . 1 . 2]"
1 155 TRP 0.760 0.064 20 0 "[ . 1 . 2]"
1 156 VAL 0.546 0.072 11 0 "[ . 1 . 2]"
1 157 LYS 0.068 0.024 14 0 "[ . 1 . 2]"
1 158 VAL 0.258 0.050 19 0 "[ . 1 . 2]"
1 159 VAL 0.657 0.064 20 0 "[ . 1 . 2]"
1 160 GLU 0.054 0.014 14 0 "[ . 1 . 2]"
1 161 GLU 0.061 0.024 14 0 "[ . 1 . 2]"
1 162 LYS 0.173 0.050 19 0 "[ . 1 . 2]"
1 165 SER 0.691 0.087 10 0 "[ . 1 . 2]"
1 168 VAL 0.410 0.063 18 0 "[ . 1 . 2]"
1 169 ILE 0.612 0.087 10 0 "[ . 1 . 2]"
1 170 PRO 0.021 0.016 15 0 "[ . 1 . 2]"
1 171 MET 0.281 0.062 18 0 "[ . 1 . 2]"
1 172 PHE 0.378 0.063 18 0 "[ . 1 . 2]"
1 174 ALA 0.021 0.016 15 0 "[ . 1 . 2]"
1 175 LEU 0.281 0.062 18 0 "[ . 1 . 2]"
1 176 SER 0.047 0.018 8 0 "[ . 1 . 2]"
1 180 THR 0.064 0.021 14 0 "[ . 1 . 2]"
1 181 PRO 0.408 0.075 17 0 "[ . 1 . 2]"
1 182 GLN 0.098 0.019 3 0 "[ . 1 . 2]"
1 183 ASP 0.330 0.095 11 0 "[ . 1 . 2]"
1 184 LEU 0.158 0.021 14 0 "[ . 1 . 2]"
1 185 ASN 0.755 0.075 17 0 "[ . 1 . 2]"
1 186 THR 0.238 0.070 17 0 "[ . 1 . 2]"
1 187 MET 0.847 0.110 19 0 "[ . 1 . 2]"
1 188 LEU 0.095 0.021 20 0 "[ . 1 . 2]"
1 189 ASN 0.347 0.065 11 0 "[ . 1 . 2]"
1 190 THR 0.140 0.070 17 0 "[ . 1 . 2]"
1 191 VAL 0.518 0.110 19 0 "[ . 1 . 2]"
1 194 HIS 0.075 0.042 14 0 "[ . 1 . 2]"
1 195 GLN 0.247 0.029 20 0 "[ . 1 . 2]"
1 196 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 197 ALA 0.059 0.035 14 0 "[ . 1 . 2]"
1 198 MET 0.123 0.042 14 0 "[ . 1 . 2]"
1 199 GLN 0.412 0.029 20 0 "[ . 1 . 2]"
1 200 MET 0.015 0.011 20 0 "[ . 1 . 2]"
1 201 LEU 0.668 0.070 12 0 "[ . 1 . 2]"
1 202 LYS 0.675 0.039 17 0 "[ . 1 . 2]"
1 203 GLU 0.181 0.026 5 0 "[ . 1 . 2]"
1 204 THR 0.151 0.028 5 0 "[ . 1 . 2]"
1 205 ILE 0.938 0.076 16 0 "[ . 1 . 2]"
1 206 ASN 0.744 0.039 17 0 "[ . 1 . 2]"
1 207 GLU 0.132 0.044 11 0 "[ . 1 . 2]"
1 208 GLU 0.240 0.028 5 0 "[ . 1 . 2]"
1 209 ALA 0.455 0.076 16 0 "[ . 1 . 2]"
1 210 ALA 0.117 0.022 5 0 "[ . 1 . 2]"
1 211 GLU 0.116 0.044 11 0 "[ . 1 . 2]"
1 212 TRP 0.104 0.022 5 0 "[ . 1 . 2]"
1 213 ASP 0.125 0.024 14 0 "[ . 1 . 2]"
1 214 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 215 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 216 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 224 ALA 3.696 0.306 3 0 "[ . 1 . 2]"
1 227 GLN 3.696 0.306 3 0 "[ . 1 . 2]"
1 229 ARG 84.318 4.670 17 18 "[-* *************+* *]"
1 232 ARG 0.177 0.061 16 0 "[ . 1 . 2]"
1 233 GLY 0.262 0.062 17 0 "[ . 1 . 2]"
1 236 ILE 0.177 0.061 16 0 "[ . 1 . 2]"
1 237 ALA 0.262 0.062 17 0 "[ . 1 . 2]"
1 242 THR 0.124 0.057 12 0 "[ . 1 . 2]"
1 243 LEU 0.197 0.064 12 0 "[ . 1 . 2]"
1 244 GLN 0.142 0.054 19 0 "[ . 1 . 2]"
1 245 GLU 0.004 0.003 3 0 "[ . 1 . 2]"
1 246 GLN 0.598 0.094 8 0 "[ . 1 . 2]"
1 247 ILE 0.224 0.064 12 0 "[ . 1 . 2]"
1 248 GLY 0.142 0.054 19 0 "[ . 1 . 2]"
1 249 TRP 84.322 4.670 17 18 "[-* *************+* *]"
1 250 MET 0.474 0.094 8 0 "[ . 1 . 2]"
1 251 THR 0.026 0.010 20 0 "[ . 1 . 2]"
1 258 VAL 0.051 0.024 14 0 "[ . 1 . 2]"
1 259 GLY 0.059 0.035 4 0 "[ . 1 . 2]"
1 260 GLU 0.006 0.006 4 0 "[ . 1 . 2]"
1 261 ILE 0.056 0.016 15 0 "[ . 1 . 2]"
1 262 TYR 0.057 0.024 14 0 "[ . 1 . 2]"
1 263 LYS 0.076 0.035 4 0 "[ . 1 . 2]"
1 264 ARG 0.006 0.006 4 0 "[ . 1 . 2]"
1 265 TRP 0.063 0.016 15 0 "[ . 1 . 2]"
1 266 ILE 0.007 0.004 16 0 "[ . 1 . 2]"
1 267 ILE 0.016 0.016 9 0 "[ . 1 . 2]"
1 268 LEU 0.744 0.067 17 0 "[ . 1 . 2]"
1 269 GLY 0.617 0.083 20 0 "[ . 1 . 2]"
1 270 LEU 0.152 0.029 6 0 "[ . 1 . 2]"
1 271 ASN 0.122 0.015 3 0 "[ . 1 . 2]"
1 272 LYS 0.766 0.067 17 0 "[ . 1 . 2]"
1 273 ILE 0.622 0.083 20 0 "[ . 1 . 2]"
1 274 VAL 0.275 0.029 6 0 "[ . 1 . 2]"
1 275 ARG 0.179 0.015 3 0 "[ . 1 . 2]"
1 276 MET 0.021 0.007 4 0 "[ . 1 . 2]"
1 277 TYR 0.012 0.004 11 0 "[ . 1 . 2]"
1 278 SER 0.180 0.012 18 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 1 148 SER OG 1 151 THR H . . 2.700 2.646 2.408 2.710 0.010 20 0 "[ . 1 . 2]" 3
2 1 149 PRO O 1 153 ASN H . . 2.400 2.092 1.792 2.289 0.008 20 0 "[ . 1 . 2]" 3
3 1 150 ARG O 1 154 ALA H . . 2.400 2.046 1.795 2.368 0.005 3 0 "[ . 1 . 2]" 3
4 1 151 THR O 1 155 TRP H . . 2.400 1.847 1.775 2.163 0.025 17 0 "[ . 1 . 2]" 3
5 1 152 LEU O 1 156 VAL H . . 2.400 1.784 1.728 1.905 0.072 11 0 "[ . 1 . 2]" 3
6 1 153 ASN O 1 157 LYS H . . 2.400 2.113 1.917 2.335 . 0 0 "[ . 1 . 2]" 3
7 1 154 ALA O 1 158 VAL H . . 2.400 2.280 2.121 2.408 0.008 13 0 "[ . 1 . 2]" 3
8 1 155 TRP O 1 159 VAL H . . 2.400 1.779 1.743 1.806 0.057 7 0 "[ . 1 . 2]" 3
9 1 156 VAL O 1 160 GLU H . . 2.400 2.034 1.786 2.408 0.014 14 0 "[ . 1 . 2]" 3
10 1 157 LYS O 1 161 GLU H . . 2.400 2.094 1.808 2.402 0.002 20 0 "[ . 1 . 2]" 3
11 1 158 VAL O 1 162 LYS H . . 2.400 1.998 1.792 2.411 0.011 19 0 "[ . 1 . 2]" 3
12 1 148 SER OG 1 151 THR N . 2.700 3.500 3.532 3.343 3.568 0.068 20 0 "[ . 1 . 2]" 3
13 1 149 PRO O 1 153 ASN N . 2.700 3.200 3.005 2.755 3.201 0.001 5 0 "[ . 1 . 2]" 3
14 1 150 ARG O 1 154 ALA N . 2.700 3.200 2.958 2.690 3.233 0.033 14 0 "[ . 1 . 2]" 3
15 1 151 THR O 1 155 TRP N . 2.700 3.200 2.821 2.737 3.122 . 0 0 "[ . 1 . 2]" 3
16 1 152 LEU O 1 156 VAL N . 2.700 3.200 2.743 2.675 2.833 0.025 11 0 "[ . 1 . 2]" 3
17 1 153 ASN O 1 157 LYS N . 2.700 3.200 3.000 2.824 3.207 0.007 20 0 "[ . 1 . 2]" 3
18 1 154 ALA O 1 158 VAL N . 2.700 3.200 3.113 2.917 3.228 0.028 11 0 "[ . 1 . 2]" 3
19 1 155 TRP O 1 159 VAL N . 2.700 3.200 2.690 2.636 2.716 0.064 20 0 "[ . 1 . 2]" 3
20 1 156 VAL O 1 160 GLU N . 2.700 3.200 2.954 2.697 3.207 0.007 10 0 "[ . 1 . 2]" 3
21 1 157 LYS O 1 161 GLU N . 2.700 3.200 2.843 2.676 3.088 0.024 14 0 "[ . 1 . 2]" 3
22 1 158 VAL O 1 162 LYS N . 2.700 3.200 2.806 2.650 3.097 0.050 19 0 "[ . 1 . 2]" 3
23 1 165 SER O 1 169 ILE H . . 2.400 2.336 1.862 2.424 0.024 18 0 "[ . 1 . 2]" 3
24 1 168 VAL O 1 172 PHE H . . 2.400 1.800 1.737 1.892 0.063 18 0 "[ . 1 . 2]" 3
25 1 170 PRO O 1 174 ALA H . . 2.400 2.218 1.964 2.390 . 0 0 "[ . 1 . 2]" 3
26 1 171 MET O 1 175 LEU H . . 2.400 2.268 1.886 2.366 . 0 0 "[ . 1 . 2]" 3
27 1 172 PHE O 1 176 SER H . . 2.400 2.110 1.803 2.418 0.018 8 0 "[ . 1 . 2]" 3
28 1 165 SER OG 1 168 VAL N . 2.700 3.200 3.164 2.896 3.222 0.022 5 0 "[ . 1 . 2]" 3
29 1 165 SER O 1 169 ILE N . 2.700 3.200 3.207 2.778 3.287 0.087 10 0 "[ . 1 . 2]" 3
30 1 168 VAL O 1 172 PHE N . 2.700 3.200 2.719 2.652 2.823 0.048 6 0 "[ . 1 . 2]" 3
31 1 170 PRO O 1 174 ALA N . 2.700 3.200 3.061 2.723 3.216 0.016 15 0 "[ . 1 . 2]" 3
32 1 171 MET O 1 175 LEU N . 2.700 3.200 3.190 2.845 3.262 0.062 18 0 "[ . 1 . 2]" 3
33 1 172 PHE O 1 176 SER N . 2.700 3.200 2.772 2.688 2.963 0.012 11 0 "[ . 1 . 2]" 3
34 1 180 THR O 1 184 LEU H . . 2.400 2.026 1.782 2.391 0.018 1 0 "[ . 1 . 2]" 3
35 1 181 PRO O 1 185 ASN H . . 2.400 1.844 1.772 2.060 0.028 18 0 "[ . 1 . 2]" 3
36 1 182 GLN O 1 186 THR H . . 2.400 2.129 1.834 2.412 0.012 4 0 "[ . 1 . 2]" 3
37 1 183 ASP O 1 187 MET H . . 2.400 2.232 1.929 2.397 . 0 0 "[ . 1 . 2]" 3
38 1 184 LEU O 1 188 LEU H . . 2.400 1.878 1.779 2.096 0.021 20 0 "[ . 1 . 2]" 3
39 1 185 ASN O 1 189 ASN H . . 2.400 2.233 1.909 2.430 0.030 19 0 "[ . 1 . 2]" 3
40 1 186 THR O 1 190 THR H . . 2.400 2.172 1.961 2.374 . 0 0 "[ . 1 . 2]" 3
41 1 187 MET O 1 191 VAL H . . 2.400 2.386 2.136 2.510 0.110 19 0 "[ . 1 . 2]" 3
42 1 180 THR O 1 184 LEU N . 2.700 3.200 2.950 2.739 3.221 0.021 14 0 "[ . 1 . 2]" 3
43 1 181 PRO O 1 185 ASN N . 2.700 3.200 2.715 2.625 2.940 0.075 17 0 "[ . 1 . 2]" 3
44 1 182 GLN O 1 186 THR N . 2.700 3.200 2.967 2.730 3.219 0.019 3 0 "[ . 1 . 2]" 3
45 1 183 ASP O 1 187 MET N . 2.700 3.200 3.142 2.829 3.295 0.095 11 0 "[ . 1 . 2]" 3
46 1 184 LEU O 1 188 LEU N . 2.700 3.200 2.847 2.751 3.075 . 0 0 "[ . 1 . 2]" 3
47 1 185 ASN O 1 189 ASN N . 2.700 3.200 2.790 2.635 3.136 0.065 11 0 "[ . 1 . 2]" 3
48 1 186 THR O 1 190 THR N . 2.700 3.200 3.039 2.899 3.270 0.070 17 0 "[ . 1 . 2]" 3
49 1 187 MET O 1 191 VAL N . 2.700 3.200 2.976 2.818 3.205 0.005 20 0 "[ . 1 . 2]" 3
50 1 194 HIS O 1 198 MET H . . 2.400 1.976 1.758 2.231 0.042 14 0 "[ . 1 . 2]" 3
51 1 195 GLN O 1 199 GLN H . . 2.400 1.838 1.796 1.857 0.004 2 0 "[ . 1 . 2]" 3
52 1 196 ALA O 1 200 MET H . . 2.400 2.051 1.800 2.258 . 0 0 "[ . 1 . 2]" 3
53 1 197 ALA O 1 201 LEU H . . 2.400 1.948 1.765 2.164 0.035 14 0 "[ . 1 . 2]" 3
54 1 198 MET O 1 202 LYS H . . 2.400 2.081 1.794 2.383 0.006 11 0 "[ . 1 . 2]" 3
55 1 199 GLN O 1 203 GLU H . . 2.400 2.254 1.968 2.415 0.015 9 0 "[ . 1 . 2]" 3
56 1 200 MET O 1 204 THR H . . 2.400 2.081 1.812 2.352 . 0 0 "[ . 1 . 2]" 3
57 1 201 LEU O 1 205 ILE H . . 2.400 1.774 1.730 1.818 0.070 12 0 "[ . 1 . 2]" 3
58 1 202 LYS O 1 206 ASN H . . 2.400 1.774 1.761 1.789 0.039 17 0 "[ . 1 . 2]" 3
59 1 203 GLU O 1 207 GLU H . . 2.400 1.907 1.797 2.057 0.003 15 0 "[ . 1 . 2]" 3
60 1 204 THR O 1 208 GLU H . . 2.400 1.980 1.932 2.076 . 0 0 "[ . 1 . 2]" 3
61 1 205 ILE O 1 209 ALA H . . 2.400 2.347 2.104 2.433 0.033 11 0 "[ . 1 . 2]" 3
62 1 206 ASN O 1 210 ALA H . . 2.400 2.187 1.893 2.260 . 0 0 "[ . 1 . 2]" 3
63 1 207 GLU O 1 211 GLU H . . 2.400 1.867 1.756 2.104 0.044 11 0 "[ . 1 . 2]" 3
64 1 208 GLU O 1 212 TRP H . . 2.400 1.898 1.799 2.277 0.001 9 0 "[ . 1 . 2]" 3
65 1 209 ALA O 1 213 ASP H . . 2.400 1.850 1.776 2.221 0.024 14 0 "[ . 1 . 2]" 3
66 1 210 ALA O 1 214 ARG H . . 2.400 1.988 1.828 2.335 . 0 0 "[ . 1 . 2]" 3
67 1 211 GLU O 1 215 LEU H . . 2.400 2.120 1.914 2.307 . 0 0 "[ . 1 . 2]" 3
68 1 213 ASP O 1 216 HIS H . . 2.400 2.106 1.934 2.220 . 0 0 "[ . 1 . 2]" 3
69 1 194 HIS O 1 198 MET N . 2.700 3.200 2.959 2.745 3.208 0.008 17 0 "[ . 1 . 2]" 3
70 1 195 GLN O 1 199 GLN N . 2.700 3.200 2.688 2.671 2.694 0.029 20 0 "[ . 1 . 2]" 3
71 1 196 ALA O 1 200 MET N . 2.700 3.200 3.016 2.791 3.183 . 0 0 "[ . 1 . 2]" 3
72 1 197 ALA O 1 201 LEU N . 2.700 3.200 2.871 2.681 3.041 0.019 12 0 "[ . 1 . 2]" 3
73 1 198 MET O 1 202 LYS N . 2.700 3.200 2.944 2.679 3.198 0.021 14 0 "[ . 1 . 2]" 3
74 1 199 GLN O 1 203 GLU N . 2.700 3.200 3.096 2.840 3.226 0.026 5 0 "[ . 1 . 2]" 3
75 1 200 MET O 1 204 THR N . 2.700 3.200 3.002 2.722 3.211 0.011 20 0 "[ . 1 . 2]" 3
76 1 201 LEU O 1 205 ILE N . 2.700 3.200 2.744 2.676 2.812 0.024 14 0 "[ . 1 . 2]" 3
77 1 202 LYS O 1 206 ASN N . 2.700 3.200 2.726 2.665 2.781 0.035 17 0 "[ . 1 . 2]" 3
78 1 203 GLU O 1 207 GLU N . 2.700 3.200 2.758 2.697 2.841 0.003 3 0 "[ . 1 . 2]" 3
79 1 204 THR O 1 208 GLU N . 2.700 3.200 2.714 2.672 2.810 0.028 5 0 "[ . 1 . 2]" 3
80 1 205 ILE O 1 209 ALA N . 2.700 3.200 3.182 2.869 3.276 0.076 16 0 "[ . 1 . 2]" 3
81 1 206 ASN O 1 210 ALA N . 2.700 3.200 3.166 2.885 3.222 0.022 5 0 "[ . 1 . 2]" 3
82 1 207 GLU O 1 211 GLU N . 2.700 3.200 2.844 2.743 3.084 . 0 0 "[ . 1 . 2]" 3
83 1 208 GLU O 1 212 TRP N . 2.700 3.200 2.735 2.678 3.072 0.022 5 0 "[ . 1 . 2]" 3
84 1 209 ALA O 1 213 ASP N . 2.700 3.200 2.820 2.734 3.132 . 0 0 "[ . 1 . 2]" 3
85 1 210 ALA O 1 214 ARG N . 2.700 3.200 2.832 2.701 3.154 . 0 0 "[ . 1 . 2]" 3
86 1 211 GLU O 1 215 LEU N . 2.700 3.200 2.910 2.777 3.144 . 0 0 "[ . 1 . 2]" 3
87 1 213 ASP O 1 216 HIS N . 2.700 3.200 2.926 2.799 2.981 . 0 0 "[ . 1 . 2]" 3
88 1 224 ALA O 1 227 GLN H . . 2.400 2.465 2.166 2.706 0.306 3 0 "[ . 1 . 2]" 3
89 1 224 ALA O 1 227 GLN N . 2.700 3.200 3.284 3.133 3.404 0.204 3 0 "[ . 1 . 2]" 3
90 1 229 ARG O 1 249 TRP HE1 . . 2.000 4.173 2.345 6.670 4.670 17 18 "[-* *************+* *]" 3
91 1 229 ARG O 1 249 TRP NE1 . 2.700 3.000 5.043 3.096 7.587 4.587 17 17 "[ * -************+* *]" 3
92 1 232 ARG O 1 236 ILE H . . 2.400 1.990 1.739 2.377 0.061 16 0 "[ . 1 . 2]" 3
93 1 233 GLY O 1 237 ALA H . . 2.400 2.357 1.936 2.425 0.025 6 0 "[ . 1 . 2]" 3
94 1 232 ARG O 1 236 ILE N . 2.700 3.200 2.910 2.697 3.233 0.033 3 0 "[ . 1 . 2]" 3
95 1 233 GLY O 1 237 ALA N . 2.700 3.200 3.048 2.638 3.213 0.062 17 0 "[ . 1 . 2]" 3
96 1 242 THR O 1 246 GLN H . . 2.400 2.148 1.873 2.372 . 0 0 "[ . 1 . 2]" 3
97 1 243 LEU O 1 247 ILE H . . 2.400 1.891 1.736 2.232 0.064 12 0 "[ . 1 . 2]" 3
98 1 244 GLN O 1 248 GLY H . . 2.400 2.091 1.787 2.261 0.013 3 0 "[ . 1 . 2]" 3
99 1 245 GLU O 1 249 TRP H . . 2.400 2.052 1.797 2.293 0.003 3 0 "[ . 1 . 2]" 3
100 1 246 GLN O 1 250 MET H . . 2.400 1.844 1.774 2.051 0.026 15 0 "[ . 1 . 2]" 3
101 1 247 ILE O 1 251 THR H . . 2.400 2.284 1.867 2.405 0.005 10 0 "[ . 1 . 2]" 3
102 1 242 THR O 1 246 GLN N . 2.700 3.200 2.984 2.685 3.257 0.057 12 0 "[ . 1 . 2]" 3
103 1 243 LEU O 1 247 ILE N . 2.700 3.200 2.828 2.723 3.229 0.029 7 0 "[ . 1 . 2]" 3
104 1 244 GLN O 1 248 GLY N . 2.700 3.200 3.032 2.728 3.254 0.054 19 0 "[ . 1 . 2]" 3
105 1 245 GLU O 1 249 TRP N . 2.700 3.200 2.981 2.747 3.185 . 0 0 "[ . 1 . 2]" 3
106 1 246 GLN O 1 250 MET N . 2.700 3.200 2.721 2.606 2.969 0.094 8 0 "[ . 1 . 2]" 3
107 1 247 ILE O 1 251 THR N . 2.700 3.200 3.005 2.690 3.173 0.010 20 0 "[ . 1 . 2]" 3
108 1 258 VAL O 1 262 TYR H . . 2.400 2.094 1.794 2.311 0.006 19 0 "[ . 1 . 2]" 3
109 1 259 GLY O 1 263 LYS H . . 2.400 1.926 1.765 2.259 0.035 4 0 "[ . 1 . 2]" 3
110 1 260 GLU O 1 264 ARG H . . 2.400 2.072 1.794 2.380 0.006 4 0 "[ . 1 . 2]" 3
111 1 261 ILE O 1 265 TRP H . . 2.400 2.318 2.058 2.416 0.016 15 0 "[ . 1 . 2]" 3
112 1 262 TYR O 1 266 ILE H . . 2.400 2.155 1.819 2.312 . 0 0 "[ . 1 . 2]" 3
113 1 263 LYS O 1 267 ILE H . . 2.400 2.111 1.849 2.272 . 0 0 "[ . 1 . 2]" 3
114 1 264 ARG O 1 268 LEU H . . 2.400 2.060 1.878 2.191 . 0 0 "[ . 1 . 2]" 3
115 1 265 TRP O 1 269 GLY H . . 2.400 2.173 1.963 2.291 . 0 0 "[ . 1 . 2]" 3
116 1 266 ILE O 1 270 LEU H . . 2.400 1.876 1.819 1.949 . 0 0 "[ . 1 . 2]" 3
117 1 267 ILE O 1 271 ASN H . . 2.400 2.070 1.956 2.220 . 0 0 "[ . 1 . 2]" 3
118 1 268 LEU O 1 272 LYS H . . 2.400 2.368 2.297 2.406 0.006 2 0 "[ . 1 . 2]" 3
119 1 269 GLY O 1 273 ILE H . . 2.400 1.784 1.717 1.920 0.083 20 0 "[ . 1 . 2]" 3
120 1 270 LEU O 1 274 VAL H . . 2.400 1.839 1.771 1.939 0.029 6 0 "[ . 1 . 2]" 3
121 1 271 ASN O 1 275 ARG H . . 2.400 1.840 1.785 2.097 0.015 3 0 "[ . 1 . 2]" 3
122 1 272 LYS O 1 276 MET H . . 2.400 2.282 2.120 2.407 0.007 4 0 "[ . 1 . 2]" 3
123 1 273 ILE O 1 277 TYR H . . 2.400 2.021 1.807 2.404 0.004 11 0 "[ . 1 . 2]" 3
124 1 274 VAL O 1 278 SER H . . 2.400 2.402 2.379 2.408 0.008 18 0 "[ . 1 . 2]" 3
125 1 275 ARG O 1 278 SER HG . . 2.400 2.192 1.967 2.405 0.005 10 0 "[ . 1 . 2]" 3
126 1 258 VAL O 1 262 TYR N . 2.700 3.200 3.030 2.768 3.224 0.024 14 0 "[ . 1 . 2]" 3
127 1 259 GLY O 1 263 LYS N . 2.700 3.200 2.889 2.700 3.205 0.005 17 0 "[ . 1 . 2]" 3
128 1 260 GLU O 1 264 ARG N . 2.700 3.200 2.972 2.751 3.200 . 0 0 "[ . 1 . 2]" 3
129 1 261 ILE O 1 265 TRP N . 2.700 3.200 3.130 2.949 3.211 0.011 4 0 "[ . 1 . 2]" 3
130 1 262 TYR O 1 266 ILE N . 2.700 3.200 3.075 2.783 3.204 0.004 16 0 "[ . 1 . 2]" 3
131 1 263 LYS O 1 267 ILE N . 2.700 3.200 3.062 2.810 3.216 0.016 9 0 "[ . 1 . 2]" 3
132 1 264 ARG O 1 268 LEU N . 2.700 3.200 2.860 2.724 2.967 . 0 0 "[ . 1 . 2]" 3
133 1 265 TRP O 1 269 GLY N . 2.700 3.200 3.101 2.918 3.205 0.005 13 0 "[ . 1 . 2]" 3
134 1 266 ILE O 1 270 LEU N . 2.700 3.200 2.838 2.761 2.906 . 0 0 "[ . 1 . 2]" 3
135 1 267 ILE O 1 271 ASN N . 2.700 3.200 2.877 2.789 2.995 . 0 0 "[ . 1 . 2]" 3
136 1 268 LEU O 1 272 LYS N . 2.700 3.200 3.236 3.177 3.267 0.067 17 0 "[ . 1 . 2]" 3
137 1 269 GLY O 1 273 ILE N . 2.700 3.200 2.725 2.683 2.828 0.017 20 0 "[ . 1 . 2]" 3
138 1 270 LEU O 1 274 VAL N . 2.700 3.200 2.766 2.673 2.890 0.027 18 0 "[ . 1 . 2]" 3
139 1 271 ASN O 1 275 ARG N . 2.700 3.200 2.792 2.689 3.036 0.011 15 0 "[ . 1 . 2]" 3
140 1 272 LYS O 1 276 MET N . 2.700 3.200 2.853 2.697 2.977 0.003 17 0 "[ . 1 . 2]" 3
141 1 273 ILE O 1 277 TYR N . 2.700 3.200 2.886 2.698 3.203 0.003 20 0 "[ . 1 . 2]" 3
142 1 274 VAL O 1 278 SER N . 2.700 3.200 2.711 2.693 2.860 0.007 10 0 "[ . 1 . 2]" 3
143 1 275 ARG O 1 278 SER OG . 2.700 3.200 2.741 2.688 2.927 0.012 18 0 "[ . 1 . 2]" 3
stop_
save_
save_distance_constraint_statistics_4
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 4
_Distance_constraint_stats_list.Constraint_count 4
_Distance_constraint_stats_list.Viol_count 0
_Distance_constraint_stats_list.Viol_total 0.000
_Distance_constraint_stats_list.Viol_max 0.000
_Distance_constraint_stats_list.Viol_rms 0.0000
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0000
_Distance_constraint_stats_list.Viol_average_violations_only 0.0000
_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 19 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 148 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 152 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 167 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 169 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 171 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 173 SER 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 19 ILE N 1 29 TYR O . 2.700 . 5.981 5.598 6.541 . 0 0 "[ . 1 . 2]" 4
2 1 148 SER O 1 152 LEU N . 2.700 . 3.527 3.322 3.692 . 0 0 "[ . 1 . 2]" 4
3 1 167 GLU O 1 171 MET N . 2.700 . 3.838 3.673 4.066 . 0 0 "[ . 1 . 2]" 4
4 1 169 ILE O 1 173 SER N . 2.700 . 3.467 3.185 3.715 . 0 0 "[ . 1 . 2]" 4
stop_
save_
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