NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
564451 |
2ma1   |
19317 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2ma1
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 1063
_Distance_constraint_stats_list.Viol_count 121
_Distance_constraint_stats_list.Viol_total 8.381
_Distance_constraint_stats_list.Viol_max 0.251
_Distance_constraint_stats_list.Viol_rms 0.0303
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0079
_Distance_constraint_stats_list.Viol_average_violations_only 0.0693
_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 1 HIS 0.000 0.000 . 0 "[ ]"
1 2 ASP 0.000 0.000 . 0 "[ ]"
1 3 ALA 0.000 0.000 . 0 "[ ]"
1 4 PRO 0.014 0.014 1 0 "[ ]"
1 5 LEU 0.053 0.039 1 0 "[ ]"
1 6 PHE 0.113 0.074 1 0 "[ ]"
1 7 GLU 0.047 0.047 1 0 "[ ]"
1 8 ALA 0.047 0.047 1 0 "[ ]"
1 9 LEU 0.463 0.215 1 0 "[ ]"
1 10 ARG 0.057 0.033 1 0 "[ ]"
1 11 ALA 0.225 0.100 1 0 "[ ]"
1 12 TRP 0.136 0.061 1 0 "[ ]"
1 13 ARG 0.087 0.063 1 0 "[ ]"
1 14 LEU 0.122 0.063 1 0 "[ ]"
1 15 GLN 0.261 0.178 1 0 "[ ]"
1 16 LYS 0.246 0.178 1 0 "[ ]"
1 17 ALA 0.082 0.045 1 0 "[ ]"
1 18 LYS 0.097 0.052 1 0 "[ ]"
1 19 GLU 0.110 0.052 1 0 "[ ]"
1 20 LEU 0.077 0.052 1 0 "[ ]"
1 21 SER 0.011 0.011 1 0 "[ ]"
1 22 LEU 0.000 0.000 . 0 "[ ]"
1 23 PRO 0.000 0.000 . 0 "[ ]"
1 24 PRO 0.160 0.074 1 0 "[ ]"
1 25 TYR 0.188 0.066 1 0 "[ ]"
1 26 THR 0.260 0.117 1 0 "[ ]"
1 27 ILE 0.642 0.242 1 0 "[ ]"
1 28 PHE 0.300 0.117 1 0 "[ ]"
1 29 HIS 0.090 0.045 1 0 "[ ]"
1 30 ASP 0.065 0.045 1 0 "[ ]"
1 31 ALA 0.046 0.046 1 0 "[ ]"
1 32 THR 0.357 0.242 1 0 "[ ]"
1 33 LEU 0.346 0.213 1 0 "[ ]"
1 34 LYS 0.366 0.128 1 0 "[ ]"
1 35 THR 0.515 0.231 1 0 "[ ]"
1 36 ILE 0.494 0.238 1 0 "[ ]"
1 37 ALA 0.134 0.060 1 0 "[ ]"
1 38 GLU 0.186 0.100 1 0 "[ ]"
1 39 LEU 0.197 0.094 1 0 "[ ]"
1 40 ARG 0.088 0.064 1 0 "[ ]"
1 41 PRO 0.000 0.000 . 0 "[ ]"
1 42 GLY 0.188 0.094 1 0 "[ ]"
1 43 SER 0.197 0.093 1 0 "[ ]"
1 44 HIS 0.063 0.056 1 0 "[ ]"
1 45 ALA 0.078 0.056 1 0 "[ ]"
1 46 THR 0.453 0.251 1 0 "[ ]"
1 47 LEU 0.305 0.122 1 0 "[ ]"
1 48 GLY 0.000 0.000 . 0 "[ ]"
1 49 THR 0.257 0.096 1 0 "[ ]"
1 50 VAL 0.174 0.068 1 0 "[ ]"
1 51 SER 0.085 0.058 1 0 "[ ]"
1 52 GLY 0.108 0.058 1 0 "[ ]"
1 53 VAL 0.083 0.050 1 0 "[ ]"
1 54 GLY 0.000 0.000 . 0 "[ ]"
1 55 GLY 0.036 0.036 1 0 "[ ]"
1 56 ARG 0.233 0.202 1 0 "[ ]"
1 57 LYS 0.185 0.101 1 0 "[ ]"
1 58 LEU 0.152 0.090 1 0 "[ ]"
1 59 ALA 0.083 0.043 1 0 "[ ]"
1 60 ALA 0.170 0.082 1 0 "[ ]"
1 61 TYR 0.250 0.171 1 0 "[ ]"
1 62 GLY 0.297 0.095 1 0 "[ ]"
1 63 ASP 0.112 0.069 1 0 "[ ]"
1 64 GLU 0.153 0.054 1 0 "[ ]"
1 65 VAL 0.271 0.239 1 0 "[ ]"
1 66 LEU 0.549 0.119 1 0 "[ ]"
1 67 GLN 0.256 0.119 1 0 "[ ]"
1 68 VAL 0.405 0.204 1 0 "[ ]"
1 69 VAL 0.461 0.234 1 0 "[ ]"
1 70 ARG 0.097 0.061 1 0 "[ ]"
1 71 ASP 0.036 0.036 1 0 "[ ]"
1 72 SER 0.090 0.066 1 0 "[ ]"
1 73 SER 0.006 0.006 1 0 "[ ]"
1 74 GLY 0.000 0.000 . 0 "[ ]"
1 75 GLY 0.017 0.017 1 0 "[ ]"
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 1 HIS QB 1 2 ASP H 1.800 . 6.000 3.247 3.247 3.247 . 0 0 "[ ]" 1
2 1 2 ASP H 1 40 ARG QG 1.800 . 6.000 5.819 5.819 5.819 . 0 0 "[ ]" 1
3 1 2 ASP H 1 4 PRO QD 1.800 . 6.000 3.924 3.924 3.924 . 0 0 "[ ]" 1
4 1 1 HIS HA 1 2 ASP H 1.800 . 3.500 2.196 2.196 2.196 . 0 0 "[ ]" 1
5 1 2 ASP HA 1 3 ALA H 1.800 . 3.500 3.226 3.226 3.226 . 0 0 "[ ]" 1
6 1 2 ASP HA 1 4 PRO QD 1.800 . 6.000 2.777 2.777 2.777 . 0 0 "[ ]" 1
7 1 2 ASP QB 1 4 PRO QG 1.800 . 6.000 5.765 5.765 5.765 . 0 0 "[ ]" 1
8 1 3 ALA H 1 3 ALA MB 1.800 . 2.900 2.060 2.060 2.060 . 0 0 "[ ]" 1
9 1 2 ASP HB3 1 3 ALA H 1.800 . 6.000 4.323 4.323 4.323 . 0 0 "[ ]" 1
10 1 2 ASP HB2 1 3 ALA H 1.800 . 6.000 3.686 3.686 3.686 . 0 0 "[ ]" 1
11 1 3 ALA H 1 4 PRO QD 1.800 . 2.900 2.279 2.279 2.279 . 0 0 "[ ]" 1
12 1 3 ALA H 1 4 PRO QG 1.800 . 6.000 4.216 4.216 4.216 . 0 0 "[ ]" 1
13 1 3 ALA HA 1 4 PRO QD 1.800 . 3.500 3.489 3.489 3.489 . 0 0 "[ ]" 1
14 1 4 PRO QB 1 4 PRO QD 1.800 . 2.900 2.820 2.820 2.820 . 0 0 "[ ]" 1
15 1 4 PRO HA 1 4 PRO QG 1.800 . 3.500 2.955 2.955 2.955 . 0 0 "[ ]" 1
16 1 4 PRO HA 1 4 PRO QD 1.800 . 3.500 3.364 3.364 3.364 . 0 0 "[ ]" 1
17 1 4 PRO HA 1 5 LEU H 1.800 . 3.500 3.514 3.514 3.514 0.014 1 0 "[ ]" 1
18 1 5 LEU H 1 5 LEU QD 1.800 . 6.000 3.663 3.663 3.663 . 0 0 "[ ]" 1
19 1 5 LEU H 1 5 LEU HG 1.800 . 6.000 4.476 4.476 4.476 . 0 0 "[ ]" 1
20 1 5 LEU H 1 5 LEU HB3 1.800 . 3.500 2.604 2.604 2.604 . 0 0 "[ ]" 1
21 1 5 LEU H 1 5 LEU HB2 1.800 . 3.500 2.508 2.508 2.508 . 0 0 "[ ]" 1
22 1 5 LEU HA 1 5 LEU QD 1.800 . 3.500 2.131 2.131 2.131 . 0 0 "[ ]" 1
23 1 5 LEU HB3 1 5 LEU QD 1.800 . 3.500 2.251 2.251 2.251 . 0 0 "[ ]" 1
24 1 5 LEU HB2 1 5 LEU QD 1.800 . 3.500 2.027 2.027 2.027 . 0 0 "[ ]" 1
25 1 4 PRO QB 1 5 LEU H 1.800 . 6.000 2.885 2.885 2.885 . 0 0 "[ ]" 1
26 1 5 LEU H 1 7 GLU H 1.800 . 6.000 4.179 4.179 4.179 . 0 0 "[ ]" 1
27 1 3 ALA HA 1 5 LEU H 1.800 . 6.000 4.009 4.009 4.009 . 0 0 "[ ]" 1
28 1 4 PRO QD 1 5 LEU H 1.800 . 3.500 2.830 2.830 2.830 . 0 0 "[ ]" 1
29 1 5 LEU H 1 37 ALA HA 1.800 . 6.000 5.350 5.350 5.350 . 0 0 "[ ]" 1
30 1 5 LEU QD 1 37 ALA HA 1.800 . 6.000 4.381 4.381 4.381 . 0 0 "[ ]" 1
31 1 5 LEU QD 1 37 ALA MB 1.800 . 6.000 5.087 5.087 5.087 . 0 0 "[ ]" 1
32 1 6 PHE H 1 6 PHE QD 1.800 . 6.000 4.200 4.200 4.200 . 0 0 "[ ]" 1
33 1 6 PHE H 1 6 PHE HB3 1.800 . 3.500 2.663 2.663 2.663 . 0 0 "[ ]" 1
34 1 6 PHE H 1 6 PHE HB2 1.800 . 3.500 2.502 2.502 2.502 . 0 0 "[ ]" 1
35 1 6 PHE HB3 1 6 PHE QD 1.800 . 2.900 2.383 2.383 2.383 . 0 0 "[ ]" 1
36 1 6 PHE HB2 1 6 PHE QD 1.800 . 2.900 2.449 2.449 2.449 . 0 0 "[ ]" 1
37 1 6 PHE HA 1 6 PHE QD 1.800 . 6.000 2.764 2.764 2.764 . 0 0 "[ ]" 1
38 1 5 LEU QD 1 6 PHE H 1.800 . 6.000 4.007 4.007 4.007 . 0 0 "[ ]" 1
39 1 5 LEU HA 1 6 PHE H 1.800 . 3.500 3.539 3.539 3.539 0.039 1 0 "[ ]" 1
40 1 5 LEU QB 1 6 PHE H 1.800 . 3.500 2.634 2.634 2.634 . 0 0 "[ ]" 1
41 1 5 LEU H 1 6 PHE H 1.800 . 3.500 2.660 2.660 2.660 . 0 0 "[ ]" 1
42 1 6 PHE H 1 7 GLU H 1.800 . 3.500 2.736 2.736 2.736 . 0 0 "[ ]" 1
43 1 6 PHE H 1 8 ALA H 1.800 . 6.000 4.401 4.401 4.401 . 0 0 "[ ]" 1
44 1 6 PHE HA 1 9 LEU HB3 1.800 . 6.000 4.161 4.161 4.161 . 0 0 "[ ]" 1
45 1 6 PHE HA 1 9 LEU HB2 1.800 . 6.000 2.590 2.590 2.590 . 0 0 "[ ]" 1
46 1 6 PHE HA 1 9 LEU QD 1.800 . 6.000 2.618 2.618 2.618 . 0 0 "[ ]" 1
47 1 6 PHE HA 1 9 LEU H 1.800 . 3.500 3.057 3.057 3.057 . 0 0 "[ ]" 1
48 1 6 PHE QD 1 10 ARG HA 1.800 . 6.000 4.588 4.588 4.588 . 0 0 "[ ]" 1
49 1 6 PHE QD 1 37 ALA MB 1.800 . 6.000 3.453 3.453 3.453 . 0 0 "[ ]" 1
50 1 6 PHE QD 1 7 GLU QG 1.800 . 6.000 3.845 3.845 3.845 . 0 0 "[ ]" 1
51 1 6 PHE HZ 1 27 ILE MD 1.800 . 6.300 6.374 6.374 6.374 0.074 1 0 "[ ]" 1
52 1 6 PHE HZ 1 36 ILE MD 1.800 . 6.000 4.157 4.157 4.157 . 0 0 "[ ]" 1
53 1 6 PHE HB3 1 37 ALA MB 1.800 . 5.000 3.300 3.300 3.300 . 0 0 "[ ]" 1
54 1 6 PHE HB2 1 37 ALA MB 1.800 . 5.000 2.257 2.257 2.257 . 0 0 "[ ]" 1
55 1 7 GLU H 1 7 GLU QB 1.800 . 3.500 2.507 2.507 2.507 . 0 0 "[ ]" 1
56 1 7 GLU H 1 7 GLU QG 1.800 . 6.000 2.048 2.048 2.048 . 0 0 "[ ]" 1
57 1 7 GLU HA 1 7 GLU QG 1.800 . 3.500 2.351 2.351 2.351 . 0 0 "[ ]" 1
58 1 6 PHE HA 1 7 GLU H 1.800 . 6.000 3.530 3.530 3.530 . 0 0 "[ ]" 1
59 1 6 PHE QD 1 7 GLU H 1.800 . 6.000 3.753 3.753 3.753 . 0 0 "[ ]" 1
60 1 5 LEU HA 1 7 GLU H 1.800 . 6.000 3.993 3.993 3.993 . 0 0 "[ ]" 1
61 1 6 PHE HB3 1 7 GLU H 1.800 . 6.000 2.803 2.803 2.803 . 0 0 "[ ]" 1
62 1 6 PHE HB2 1 7 GLU H 1.800 . 6.000 3.972 3.972 3.972 . 0 0 "[ ]" 1
63 1 7 GLU H 1 9 LEU H 1.800 . 6.000 4.317 4.317 4.317 . 0 0 "[ ]" 1
64 1 7 GLU H 1 37 ALA MB 1.800 . 6.000 5.399 5.399 5.399 . 0 0 "[ ]" 1
65 1 7 GLU HA 1 10 ARG QB 1.800 . 6.000 2.429 2.429 2.429 . 0 0 "[ ]" 1
66 1 8 ALA H 1 8 ALA HA 1.800 . 2.900 2.891 2.891 2.891 . 0 0 "[ ]" 1
67 1 8 ALA H 1 8 ALA MB 1.800 . 3.500 2.267 2.267 2.267 . 0 0 "[ ]" 1
68 1 5 LEU QD 1 8 ALA H 1.800 . 6.000 4.035 4.035 4.035 . 0 0 "[ ]" 1
69 1 7 GLU HA 1 8 ALA H 1.800 . 3.500 3.547 3.547 3.547 0.047 1 0 "[ ]" 1
70 1 7 GLU QG 1 8 ALA H 1.800 . 6.000 4.046 4.046 4.046 . 0 0 "[ ]" 1
71 1 8 ALA H 1 9 LEU QD 1.800 . 6.000 4.414 4.414 4.414 . 0 0 "[ ]" 1
72 1 5 LEU HA 1 8 ALA H 1.800 . 6.000 3.543 3.543 3.543 . 0 0 "[ ]" 1
73 1 6 PHE HA 1 8 ALA H 1.800 . 6.000 4.020 4.020 4.020 . 0 0 "[ ]" 1
74 1 7 GLU QB 1 8 ALA H 1.800 . 3.500 2.613 2.613 2.613 . 0 0 "[ ]" 1
75 1 7 GLU H 1 8 ALA H 1.800 . 3.500 2.807 2.807 2.807 . 0 0 "[ ]" 1
76 1 8 ALA H 1 9 LEU H 1.800 . 3.500 2.616 2.616 2.616 . 0 0 "[ ]" 1
77 1 8 ALA H 1 10 ARG H 1.800 . 6.000 3.839 3.839 3.839 . 0 0 "[ ]" 1
78 1 8 ALA HA 1 11 ALA H 1.800 . 6.000 3.483 3.483 3.483 . 0 0 "[ ]" 1
79 1 9 LEU H 1 9 LEU HA 1.800 . 2.900 2.859 2.859 2.859 . 0 0 "[ ]" 1
80 1 9 LEU H 1 9 LEU HB3 1.800 . 3.500 3.598 3.598 3.598 0.098 1 0 "[ ]" 1
81 1 9 LEU H 1 9 LEU HB2 1.800 . 3.500 2.598 2.598 2.598 . 0 0 "[ ]" 1
82 1 9 LEU H 1 9 LEU MD1 1.800 . 6.000 3.621 3.621 3.621 . 0 0 "[ ]" 1
83 1 9 LEU H 1 9 LEU MD2 1.800 . 6.000 2.763 2.763 2.763 . 0 0 "[ ]" 1
84 1 9 LEU H 1 9 LEU HG 1.800 . 6.000 1.994 1.994 1.994 . 0 0 "[ ]" 1
85 1 9 LEU HA 1 9 LEU MD1 1.800 . 3.500 3.715 3.715 3.715 0.215 1 0 "[ ]" 1
86 1 9 LEU HA 1 9 LEU MD2 1.800 . 18.800 2.024 2.024 2.024 . 0 0 "[ ]" 1
87 1 9 LEU QB 1 9 LEU MD1 1.800 . 3.500 2.059 2.059 2.059 . 0 0 "[ ]" 1
88 1 9 LEU HB3 1 9 LEU MD2 1.800 . 3.500 2.397 2.397 2.397 . 0 0 "[ ]" 1
89 1 9 LEU HB2 1 9 LEU MD2 1.800 . 3.500 3.198 3.198 3.198 . 0 0 "[ ]" 1
90 1 7 GLU HA 1 9 LEU H 1.800 . 6.000 4.627 4.627 4.627 . 0 0 "[ ]" 1
91 1 5 LEU HA 1 9 LEU H 1.800 . 6.000 4.961 4.961 4.961 . 0 0 "[ ]" 1
92 1 9 LEU H 1 11 ALA H 1.800 . 6.000 4.140 4.140 4.140 . 0 0 "[ ]" 1
93 1 9 LEU HA 1 12 TRP HB3 1.800 . 6.000 3.177 3.177 3.177 . 0 0 "[ ]" 1
94 1 9 LEU HA 1 12 TRP HB2 1.800 . 6.000 3.620 3.620 3.620 . 0 0 "[ ]" 1
95 1 9 LEU QD 1 65 VAL HA 1.800 . 5.000 4.357 4.357 4.357 . 0 0 "[ ]" 1
96 1 9 LEU QD 1 68 VAL HA 1.800 . 6.000 5.600 5.600 5.600 . 0 0 "[ ]" 1
97 1 10 ARG H 1 10 ARG QD 1.800 . 6.000 4.424 4.424 4.424 . 0 0 "[ ]" 1
98 1 10 ARG H 1 10 ARG QB 1.800 . 2.900 2.272 2.272 2.272 . 0 0 "[ ]" 1
99 1 10 ARG H 1 10 ARG HG3 1.800 . 6.000 4.424 4.424 4.424 . 0 0 "[ ]" 1
100 1 10 ARG H 1 10 ARG HG2 1.800 . 6.000 4.496 4.496 4.496 . 0 0 "[ ]" 1
101 1 10 ARG HA 1 10 ARG QD 1.800 . 6.000 3.985 3.985 3.985 . 0 0 "[ ]" 1
102 1 10 ARG QB 1 10 ARG HD3 1.800 . 3.500 2.428 2.428 2.428 . 0 0 "[ ]" 1
103 1 10 ARG QB 1 10 ARG HD2 1.800 . 3.500 2.364 2.364 2.364 . 0 0 "[ ]" 1
104 1 6 PHE HA 1 10 ARG H 1.800 . 6.000 3.794 3.794 3.794 . 0 0 "[ ]" 1
105 1 7 GLU HA 1 10 ARG H 1.800 . 6.000 3.403 3.403 3.403 . 0 0 "[ ]" 1
106 1 8 ALA HA 1 10 ARG H 1.800 . 6.000 4.285 4.285 4.285 . 0 0 "[ ]" 1
107 1 9 LEU HA 1 10 ARG H 1.800 . 3.500 3.524 3.524 3.524 0.024 1 0 "[ ]" 1
108 1 9 LEU HB3 1 10 ARG H 1.800 . 6.000 3.810 3.810 3.810 . 0 0 "[ ]" 1
109 1 9 LEU HB2 1 10 ARG H 1.800 . 6.000 2.642 2.642 2.642 . 0 0 "[ ]" 1
110 1 9 LEU MD1 1 10 ARG H 1.800 . 6.000 4.618 4.618 4.618 . 0 0 "[ ]" 1
111 1 9 LEU MD2 1 10 ARG H 1.800 . 6.000 4.404 4.404 4.404 . 0 0 "[ ]" 1
112 1 9 LEU H 1 10 ARG H 1.800 . 3.500 2.603 2.603 2.603 . 0 0 "[ ]" 1
113 1 10 ARG HA 1 13 ARG HB3 1.800 . 6.000 2.459 2.459 2.459 . 0 0 "[ ]" 1
114 1 10 ARG HA 1 13 ARG HB2 1.800 . 6.000 2.594 2.594 2.594 . 0 0 "[ ]" 1
115 1 9 LEU MD1 1 10 ARG HA 1.800 . 6.000 5.808 5.808 5.808 . 0 0 "[ ]" 1
116 1 9 LEU MD2 1 10 ARG HA 1.800 . 6.000 5.834 5.834 5.834 . 0 0 "[ ]" 1
117 1 11 ALA H 1 11 ALA HA 1.800 . 2.900 2.859 2.859 2.859 . 0 0 "[ ]" 1
118 1 11 ALA H 1 11 ALA MB 1.800 . 2.900 2.247 2.247 2.247 . 0 0 "[ ]" 1
119 1 7 GLU HA 1 11 ALA H 1.800 . 6.000 4.458 4.458 4.458 . 0 0 "[ ]" 1
120 1 9 LEU MD1 1 11 ALA H 1.800 . 6.300 6.400 6.400 6.400 0.100 1 0 "[ ]" 1
121 1 9 LEU MD2 1 11 ALA H 1.800 . 6.300 5.212 5.212 5.212 . 0 0 "[ ]" 1
122 1 10 ARG HG3 1 11 ALA H 1.800 . 6.000 4.862 4.862 4.862 . 0 0 "[ ]" 1
123 1 10 ARG HG2 1 11 ALA H 1.800 . 6.000 3.933 3.933 3.933 . 0 0 "[ ]" 1
124 1 11 ALA H 1 12 TRP QB 1.800 . 6.000 4.513 4.513 4.513 . 0 0 "[ ]" 1
125 1 11 ALA H 1 12 TRP H 1.800 . 6.000 2.715 2.715 2.715 . 0 0 "[ ]" 1
126 1 9 LEU HA 1 11 ALA H 1.800 . 6.000 4.052 4.052 4.052 . 0 0 "[ ]" 1
127 1 10 ARG HA 1 11 ALA H 1.800 . 3.500 3.533 3.533 3.533 0.033 1 0 "[ ]" 1
128 1 10 ARG QB 1 11 ALA H 1.800 . 3.500 2.655 2.655 2.655 . 0 0 "[ ]" 1
129 1 10 ARG H 1 11 ALA H 1.800 . 3.500 2.711 2.711 2.711 . 0 0 "[ ]" 1
130 1 12 TRP H 1 12 TRP HD1 1.800 . 6.000 5.122 5.122 5.122 . 0 0 "[ ]" 1
131 1 12 TRP H 1 12 TRP HA 1.800 . 2.900 2.878 2.878 2.878 . 0 0 "[ ]" 1
132 1 12 TRP H 1 12 TRP HB3 1.800 . 3.500 2.639 2.639 2.639 . 0 0 "[ ]" 1
133 1 12 TRP H 1 12 TRP HB2 1.800 . 3.500 2.517 2.517 2.517 . 0 0 "[ ]" 1
134 1 12 TRP HA 1 12 TRP HD1 1.800 . 6.000 4.452 4.452 4.452 . 0 0 "[ ]" 1
135 1 12 TRP H 1 13 ARG H 1.800 . 2.900 2.571 2.571 2.571 . 0 0 "[ ]" 1
136 1 11 ALA MB 1 12 TRP H 1.800 . 2.900 2.355 2.355 2.355 . 0 0 "[ ]" 1
137 1 12 TRP HA 1 15 GLN QB 1.800 . 6.000 2.793 2.793 2.793 . 0 0 "[ ]" 1
138 1 9 LEU HA 1 12 TRP H 1.800 . 6.000 3.279 3.279 3.279 . 0 0 "[ ]" 1
139 1 11 ALA HA 1 12 TRP H 1.800 . 3.500 3.561 3.561 3.561 0.061 1 0 "[ ]" 1
140 1 12 TRP H 1 14 LEU H 1.800 . 6.000 4.296 4.296 4.296 . 0 0 "[ ]" 1
141 1 12 TRP HD1 1 13 ARG QB 1.800 . 7.000 5.010 5.010 5.010 . 0 0 "[ ]" 1
142 1 12 TRP HB3 1 14 LEU H 1.800 . 6.000 5.146 5.146 5.146 . 0 0 "[ ]" 1
143 1 12 TRP HB2 1 14 LEU H 1.800 . 6.000 5.872 5.872 5.872 . 0 0 "[ ]" 1
144 1 12 TRP HA 1 15 GLN QG 1.800 . 6.000 3.414 3.414 3.414 . 0 0 "[ ]" 1
145 1 9 LEU QD 1 12 TRP HD1 1.800 . 6.000 4.736 4.736 4.736 . 0 0 "[ ]" 1
146 1 13 ARG H 1 13 ARG HE 1.800 . 6.300 4.722 4.722 4.722 . 0 0 "[ ]" 1
147 1 13 ARG H 1 13 ARG HB3 1.800 . 3.500 2.661 2.661 2.661 . 0 0 "[ ]" 1
148 1 13 ARG H 1 13 ARG HB2 1.800 . 3.500 2.430 2.430 2.430 . 0 0 "[ ]" 1
149 1 13 ARG H 1 13 ARG HG3 1.800 . 6.000 4.382 4.382 4.382 . 0 0 "[ ]" 1
150 1 13 ARG H 1 13 ARG HG2 1.800 . 6.000 4.514 4.514 4.514 . 0 0 "[ ]" 1
151 1 13 ARG HA 1 13 ARG QG 1.800 . 3.500 2.340 2.340 2.340 . 0 0 "[ ]" 1
152 1 13 ARG HA 1 13 ARG HD3 1.800 . 6.000 4.296 4.296 4.296 . 0 0 "[ ]" 1
153 1 13 ARG HA 1 13 ARG HD2 1.800 . 6.000 4.717 4.717 4.717 . 0 0 "[ ]" 1
154 1 13 ARG HA 1 13 ARG QH 1.800 . 6.000 5.613 5.613 5.613 . 0 0 "[ ]" 1
155 1 13 ARG HB3 1 13 ARG QD 1.800 . 5.000 2.843 2.843 2.843 . 0 0 "[ ]" 1
156 1 13 ARG HB2 1 13 ARG QD 1.800 . 5.000 2.396 2.396 2.396 . 0 0 "[ ]" 1
157 1 9 LEU HA 1 13 ARG H 1.800 . 6.000 4.169 4.169 4.169 . 0 0 "[ ]" 1
158 1 10 ARG HA 1 13 ARG H 1.800 . 6.000 3.201 3.201 3.201 . 0 0 "[ ]" 1
159 1 11 ALA HA 1 13 ARG H 1.800 . 6.000 4.338 4.338 4.338 . 0 0 "[ ]" 1
160 1 11 ALA H 1 13 ARG H 1.800 . 6.000 3.899 3.899 3.899 . 0 0 "[ ]" 1
161 1 12 TRP HA 1 13 ARG H 1.800 . 3.500 3.524 3.524 3.524 0.024 1 0 "[ ]" 1
162 1 12 TRP HB3 1 13 ARG H 1.800 . 6.000 2.666 2.666 2.666 . 0 0 "[ ]" 1
163 1 12 TRP HB2 1 13 ARG H 1.800 . 6.000 3.852 3.852 3.852 . 0 0 "[ ]" 1
164 1 13 ARG H 1 15 GLN H 1.800 . 6.000 4.311 4.311 4.311 . 0 0 "[ ]" 1
165 1 13 ARG HA 1 16 LYS HB3 1.800 . 6.000 2.482 2.482 2.482 . 0 0 "[ ]" 1
166 1 13 ARG HA 1 16 LYS HB2 1.800 . 6.000 3.152 3.152 3.152 . 0 0 "[ ]" 1
167 1 13 ARG HA 1 15 GLN H 1.800 . 6.000 4.502 4.502 4.502 . 0 0 "[ ]" 1
168 1 13 ARG HA 1 17 ALA H 1.800 . 6.000 3.998 3.998 3.998 . 0 0 "[ ]" 1
169 1 13 ARG HA 1 27 ILE MG 1.800 . 6.000 4.285 4.285 4.285 . 0 0 "[ ]" 1
170 1 13 ARG HA 1 27 ILE MD 1.800 . 3.500 3.209 3.209 3.209 . 0 0 "[ ]" 1
171 1 13 ARG HD3 1 27 ILE QG 1.800 . 6.000 5.890 5.890 5.890 . 0 0 "[ ]" 1
172 1 13 ARG HD2 1 27 ILE QG 1.800 . 6.000 4.587 4.587 4.587 . 0 0 "[ ]" 1
173 1 13 ARG HD3 1 25 TYR H 1.800 . 7.000 6.051 6.051 6.051 . 0 0 "[ ]" 1
174 1 13 ARG HD2 1 25 TYR H 1.800 . 6.300 4.451 4.451 4.451 . 0 0 "[ ]" 1
175 1 13 ARG HD3 1 28 PHE QD 1.800 . 3.500 2.728 2.728 2.728 . 0 0 "[ ]" 1
176 1 13 ARG HD2 1 28 PHE QD 1.800 . 3.500 2.572 2.572 2.572 . 0 0 "[ ]" 1
177 1 13 ARG HD3 1 28 PHE HB2 1.800 . 5.000 4.573 4.573 4.573 . 0 0 "[ ]" 1
178 1 13 ARG HD2 1 28 PHE HB2 1.800 . 5.000 4.118 4.118 4.118 . 0 0 "[ ]" 1
179 1 13 ARG HD3 1 28 PHE HB3 1.800 . 6.000 5.920 5.920 5.920 . 0 0 "[ ]" 1
180 1 13 ARG HD2 1 28 PHE HB3 1.800 . 6.000 5.742 5.742 5.742 . 0 0 "[ ]" 1
181 1 14 LEU H 1 14 LEU QB 1.800 . 2.900 2.506 2.506 2.506 . 0 0 "[ ]" 1
182 1 14 LEU H 1 14 LEU HG 1.800 . 2.900 2.078 2.078 2.078 . 0 0 "[ ]" 1
183 1 14 LEU H 1 14 LEU QD 1.800 . 3.500 2.940 2.940 2.940 . 0 0 "[ ]" 1
184 1 14 LEU HA 1 14 LEU QD 1.800 . 3.500 2.041 2.041 2.041 . 0 0 "[ ]" 1
185 1 14 LEU QB 1 14 LEU QD 1.800 . 3.500 1.928 1.928 1.928 . 0 0 "[ ]" 1
186 1 13 ARG H 1 14 LEU H 1.800 . 2.900 2.822 2.822 2.822 . 0 0 "[ ]" 1
187 1 10 ARG HA 1 14 LEU H 1.800 . 6.000 4.231 4.231 4.231 . 0 0 "[ ]" 1
188 1 11 ALA HA 1 14 LEU H 1.800 . 6.000 3.615 3.615 3.615 . 0 0 "[ ]" 1
189 1 12 TRP HA 1 14 LEU H 1.800 . 6.000 4.270 4.270 4.270 . 0 0 "[ ]" 1
190 1 13 ARG HA 1 14 LEU H 1.800 . 3.500 3.563 3.563 3.563 0.063 1 0 "[ ]" 1
191 1 13 ARG QB 1 14 LEU H 1.800 . 3.500 2.515 2.515 2.515 . 0 0 "[ ]" 1
192 1 14 LEU HA 1 17 ALA MB 1.800 . 6.000 2.598 2.598 2.598 . 0 0 "[ ]" 1
193 1 14 LEU QB 1 15 GLN H 1.800 . 3.500 2.499 2.499 2.499 . 0 0 "[ ]" 1
194 1 10 ARG QD 1 14 LEU QD 1.800 . 6.000 3.881 3.881 3.881 . 0 0 "[ ]" 1
195 1 11 ALA HA 1 14 LEU QB 1.800 . 6.000 3.500 3.500 3.500 . 0 0 "[ ]" 1
196 1 15 GLN H 1 15 GLN HA 1.800 . 2.900 2.881 2.881 2.881 . 0 0 "[ ]" 1
197 1 15 GLN H 1 15 GLN QB 1.800 . 2.900 2.431 2.431 2.431 . 0 0 "[ ]" 1
198 1 15 GLN H 1 15 GLN QG 1.800 . 6.000 2.194 2.194 2.194 . 0 0 "[ ]" 1
199 1 15 GLN HA 1 15 GLN QG 1.800 . 3.500 2.370 2.370 2.370 . 0 0 "[ ]" 1
200 1 11 ALA HA 1 15 GLN H 1.800 . 6.000 4.775 4.775 4.775 . 0 0 "[ ]" 1
201 1 12 TRP HA 1 15 GLN H 1.800 . 6.000 3.332 3.332 3.332 . 0 0 "[ ]" 1
202 1 15 GLN H 1 16 LYS QG 1.800 . 6.000 6.178 6.178 6.178 0.178 1 0 "[ ]" 1
203 1 14 LEU HG 1 15 GLN H 1.800 . 6.000 4.174 4.174 4.174 . 0 0 "[ ]" 1
204 1 14 LEU H 1 15 GLN H 1.800 . 2.900 2.710 2.710 2.710 . 0 0 "[ ]" 1
205 1 14 LEU HA 1 15 GLN H 1.800 . 3.500 3.559 3.559 3.559 0.059 1 0 "[ ]" 1
206 1 14 LEU QD 1 15 GLN H 1.800 . 6.000 4.036 4.036 4.036 . 0 0 "[ ]" 1
207 1 14 LEU QD 1 15 GLN HA 1.800 . 6.000 5.149 5.149 5.149 . 0 0 "[ ]" 1
208 1 15 GLN QB 1 16 LYS H 1.800 . 3.500 2.535 2.535 2.535 . 0 0 "[ ]" 1
209 1 16 LYS H 1 16 LYS QE 1.800 . 6.000 5.896 5.896 5.896 . 0 0 "[ ]" 1
210 1 16 LYS H 1 16 LYS HA 1.800 . 2.900 2.847 2.847 2.847 . 0 0 "[ ]" 1
211 1 16 LYS H 1 16 LYS HB3 1.800 . 3.500 2.602 2.602 2.602 . 0 0 "[ ]" 1
212 1 16 LYS H 1 16 LYS HB2 1.800 . 3.500 2.473 2.473 2.473 . 0 0 "[ ]" 1
213 1 16 LYS H 1 16 LYS QG 1.800 . 5.000 3.953 3.953 3.953 . 0 0 "[ ]" 1
214 1 16 LYS HB2 1 16 LYS QE 1.800 . 5.000 3.923 3.923 3.923 . 0 0 "[ ]" 1
215 1 16 LYS HB3 1 16 LYS QE 1.800 . 5.000 4.008 4.008 4.008 . 0 0 "[ ]" 1
216 1 16 LYS HA 1 16 LYS QE 1.800 . 6.000 4.500 4.500 4.500 . 0 0 "[ ]" 1
217 1 16 LYS HA 1 16 LYS QG 1.800 . 5.000 2.347 2.347 2.347 . 0 0 "[ ]" 1
218 1 13 ARG HA 1 16 LYS H 1.800 . 6.000 3.410 3.410 3.410 . 0 0 "[ ]" 1
219 1 15 GLN QG 1 16 LYS H 1.800 . 6.000 4.000 4.000 4.000 . 0 0 "[ ]" 1
220 1 15 GLN HA 1 16 LYS H 1.800 . 3.500 3.525 3.525 3.525 0.025 1 0 "[ ]" 1
221 1 15 GLN H 1 16 LYS H 1.800 . 2.900 2.550 2.550 2.550 . 0 0 "[ ]" 1
222 1 14 LEU HA 1 16 LYS H 1.800 . 6.000 4.428 4.428 4.428 . 0 0 "[ ]" 1
223 1 14 LEU H 1 16 LYS H 1.800 . 6.000 4.025 4.025 4.025 . 0 0 "[ ]" 1
224 1 16 LYS H 1 17 ALA MB 1.800 . 6.000 4.261 4.261 4.261 . 0 0 "[ ]" 1
225 1 16 LYS H 1 18 LYS H 1.800 . 6.000 4.199 4.199 4.199 . 0 0 "[ ]" 1
226 1 16 LYS H 1 27 ILE MD 1.800 . 6.000 4.294 4.294 4.294 . 0 0 "[ ]" 1
227 1 16 LYS HA 1 17 ALA H 1.800 . 3.500 3.538 3.538 3.538 0.038 1 0 "[ ]" 1
228 1 16 LYS HA 1 18 LYS H 1.800 . 6.000 4.280 4.280 4.280 . 0 0 "[ ]" 1
229 1 16 LYS HA 1 19 GLU QB 1.800 . 6.000 3.133 3.133 3.133 . 0 0 "[ ]" 1
230 1 16 LYS HA 1 19 GLU H 1.800 . 3.500 3.506 3.506 3.506 0.006 1 0 "[ ]" 1
231 1 16 LYS HA 1 20 LEU H 1.800 . 6.000 4.378 4.378 4.378 . 0 0 "[ ]" 1
232 1 16 LYS HB3 1 17 ALA H 1.800 . 6.000 2.613 2.613 2.613 . 0 0 "[ ]" 1
233 1 16 LYS HB2 1 17 ALA H 1.800 . 6.000 3.849 3.849 3.849 . 0 0 "[ ]" 1
234 1 16 LYS QB 1 18 LYS H 1.800 . 6.000 4.732 4.732 4.732 . 0 0 "[ ]" 1
235 1 17 ALA H 1 17 ALA MB 1.800 . 2.900 2.043 2.043 2.043 . 0 0 "[ ]" 1
236 1 14 LEU HA 1 17 ALA H 1.800 . 3.500 3.439 3.439 3.439 . 0 0 "[ ]" 1
237 1 15 GLN H 1 17 ALA H 1.800 . 6.000 4.049 4.049 4.049 . 0 0 "[ ]" 1
238 1 15 GLN HA 1 17 ALA H 1.800 . 6.000 4.293 4.293 4.293 . 0 0 "[ ]" 1
239 1 16 LYS HG3 1 17 ALA H 1.800 . 6.000 4.812 4.812 4.812 . 0 0 "[ ]" 1
240 1 16 LYS HG2 1 17 ALA H 1.800 . 6.000 3.867 3.867 3.867 . 0 0 "[ ]" 1
241 1 16 LYS H 1 17 ALA H 1.800 . 2.900 2.679 2.679 2.679 . 0 0 "[ ]" 1
242 1 16 LYS QB 1 17 ALA H 1.800 . 3.500 2.572 2.572 2.572 . 0 0 "[ ]" 1
243 1 17 ALA H 1 19 GLU H 1.800 . 6.000 4.324 4.324 4.324 . 0 0 "[ ]" 1
244 1 17 ALA H 1 27 ILE MD 1.800 . 6.000 2.759 2.759 2.759 . 0 0 "[ ]" 1
245 1 17 ALA H 1 27 ILE MG 1.800 . 6.000 5.063 5.063 5.063 . 0 0 "[ ]" 1
246 1 17 ALA HA 1 19 GLU H 1.800 . 6.000 4.358 4.358 4.358 . 0 0 "[ ]" 1
247 1 17 ALA HA 1 20 LEU HB3 1.800 . 6.000 4.273 4.273 4.273 . 0 0 "[ ]" 1
248 1 17 ALA HA 1 20 LEU HB2 1.800 . 6.000 2.588 2.588 2.588 . 0 0 "[ ]" 1
249 1 17 ALA HA 1 20 LEU H 1.800 . 6.000 3.298 3.298 3.298 . 0 0 "[ ]" 1
250 1 17 ALA HA 1 27 ILE MG 1.800 . 6.000 4.482 4.482 4.482 . 0 0 "[ ]" 1
251 1 16 LYS HB3 1 17 ALA HA 1.800 . 6.000 4.197 4.197 4.197 . 0 0 "[ ]" 1
252 1 16 LYS HB2 1 17 ALA HA 1.800 . 6.000 5.621 5.621 5.621 . 0 0 "[ ]" 1
253 1 18 LYS H 1 18 LYS HA 1.800 . 2.900 2.838 2.838 2.838 . 0 0 "[ ]" 1
254 1 18 LYS H 1 18 LYS QB 1.800 . 2.900 2.275 2.275 2.275 . 0 0 "[ ]" 1
255 1 18 LYS H 1 18 LYS QD 1.800 . 6.000 4.427 4.427 4.427 . 0 0 "[ ]" 1
256 1 18 LYS H 1 18 LYS QG 1.800 . 6.000 3.977 3.977 3.977 . 0 0 "[ ]" 1
257 1 18 LYS HA 1 18 LYS QG 1.800 . 3.500 2.358 2.358 2.358 . 0 0 "[ ]" 1
258 1 18 LYS QB 1 18 LYS QE 1.800 . 6.000 3.544 3.544 3.544 . 0 0 "[ ]" 1
259 1 18 LYS HA 1 18 LYS QD 1.800 . 6.000 3.985 3.985 3.985 . 0 0 "[ ]" 1
260 1 18 LYS QB 1 18 LYS QD 1.800 . 3.500 2.133 2.133 2.133 . 0 0 "[ ]" 1
261 1 18 LYS QE 1 18 LYS QG 1.800 . 3.500 2.110 2.110 2.110 . 0 0 "[ ]" 1
262 1 14 LEU HA 1 18 LYS H 1.800 . 6.000 4.543 4.543 4.543 . 0 0 "[ ]" 1
263 1 15 GLN HA 1 18 LYS H 1.800 . 6.000 3.434 3.434 3.434 . 0 0 "[ ]" 1
264 1 16 LYS QG 1 18 LYS H 1.800 . 6.000 5.159 5.159 5.159 . 0 0 "[ ]" 1
265 1 17 ALA HA 1 18 LYS H 1.800 . 3.500 3.545 3.545 3.545 0.045 1 0 "[ ]" 1
266 1 17 ALA MB 1 18 LYS H 1.800 . 2.900 2.714 2.714 2.714 . 0 0 "[ ]" 1
267 1 17 ALA H 1 18 LYS H 1.800 . 2.900 2.698 2.698 2.698 . 0 0 "[ ]" 1
268 1 18 LYS H 1 19 GLU QB 1.800 . 6.000 4.549 4.549 4.549 . 0 0 "[ ]" 1
269 1 18 LYS H 1 19 GLU H 1.800 . 2.900 2.757 2.757 2.757 . 0 0 "[ ]" 1
270 1 18 LYS H 1 20 LEU H 1.800 . 6.000 4.181 4.181 4.181 . 0 0 "[ ]" 1
271 1 18 LYS HA 1 19 GLU H 1.800 . 3.500 3.552 3.552 3.552 0.052 1 0 "[ ]" 1
272 1 18 LYS HA 1 20 LEU H 1.800 . 6.000 4.533 4.533 4.533 . 0 0 "[ ]" 1
273 1 18 LYS QB 1 19 GLU H 1.800 . 3.500 2.491 2.491 2.491 . 0 0 "[ ]" 1
274 1 18 LYS QG 1 19 GLU QB 1.800 . 6.000 4.567 4.567 4.567 . 0 0 "[ ]" 1
275 1 19 GLU H 1 19 GLU HA 1.800 . 2.900 2.877 2.877 2.877 . 0 0 "[ ]" 1
276 1 19 GLU H 1 19 GLU QB 1.800 . 2.900 2.282 2.282 2.282 . 0 0 "[ ]" 1
277 1 19 GLU H 1 19 GLU QG 1.800 . 6.000 3.984 3.984 3.984 . 0 0 "[ ]" 1
278 1 19 GLU HA 1 19 GLU QG 1.800 . 2.900 2.364 2.364 2.364 . 0 0 "[ ]" 1
279 1 15 GLN HA 1 19 GLU H 1.800 . 6.000 4.767 4.767 4.767 . 0 0 "[ ]" 1
280 1 18 LYS QD 1 19 GLU H 1.800 . 6.000 4.443 4.443 4.443 . 0 0 "[ ]" 1
281 1 18 LYS QG 1 19 GLU H 1.800 . 6.000 3.657 3.657 3.657 . 0 0 "[ ]" 1
282 1 19 GLU H 1 20 LEU HG 1.800 . 7.000 4.234 4.234 4.234 . 0 0 "[ ]" 1
283 1 19 GLU H 1 20 LEU H 1.800 . 2.900 2.643 2.643 2.643 . 0 0 "[ ]" 1
284 1 19 GLU H 1 20 LEU QB 1.800 . 6.000 4.742 4.742 4.742 . 0 0 "[ ]" 1
285 1 19 GLU H 1 20 LEU QD 1.800 . 6.000 4.600 4.600 4.600 . 0 0 "[ ]" 1
286 1 19 GLU HA 1 21 SER H 1.800 . 6.000 4.303 4.303 4.303 . 0 0 "[ ]" 1
287 1 19 GLU QB 1 20 LEU H 1.800 . 2.900 2.507 2.507 2.507 . 0 0 "[ ]" 1
288 1 19 GLU QB 1 61 TYR HA 1.800 . 7.000 6.871 6.871 6.871 . 0 0 "[ ]" 1
289 1 20 LEU H 1 20 LEU QB 1.800 . 3.500 2.497 2.497 2.497 . 0 0 "[ ]" 1
290 1 20 LEU H 1 20 LEU QD 1.800 . 5.000 2.949 2.949 2.949 . 0 0 "[ ]" 1
291 1 20 LEU H 1 20 LEU HG 1.800 . 5.000 2.126 2.126 2.126 . 0 0 "[ ]" 1
292 1 20 LEU HA 1 20 LEU QD 1.800 . 3.500 2.035 2.035 2.035 . 0 0 "[ ]" 1
293 1 20 LEU HA 1 20 LEU HG 1.800 . 3.500 3.139 3.139 3.139 . 0 0 "[ ]" 1
294 1 20 LEU QB 1 20 LEU QD 1.800 . 3.500 1.908 1.908 1.908 . 0 0 "[ ]" 1
295 1 19 GLU HA 1 20 LEU H 1.800 . 3.500 3.552 3.552 3.552 0.052 1 0 "[ ]" 1
296 1 20 LEU H 1 21 SER H 1.800 . 3.500 2.509 2.509 2.509 . 0 0 "[ ]" 1
297 1 20 LEU H 1 27 ILE MD 1.800 . 6.000 4.759 4.759 4.759 . 0 0 "[ ]" 1
298 1 21 SER H 1 21 SER QB 1.800 . 3.500 3.110 3.110 3.110 . 0 0 "[ ]" 1
299 1 20 LEU HG 1 21 SER H 1.800 . 6.000 4.204 4.204 4.204 . 0 0 "[ ]" 1
300 1 21 SER H 1 22 LEU QB 1.800 . 6.000 5.109 5.109 5.109 . 0 0 "[ ]" 1
301 1 21 SER H 1 22 LEU H 1.800 . 5.000 2.441 2.441 2.441 . 0 0 "[ ]" 1
302 1 18 LYS HA 1 21 SER H 1.800 . 6.000 3.421 3.421 3.421 . 0 0 "[ ]" 1
303 1 17 ALA HA 1 21 SER H 1.800 . 6.000 3.747 3.747 3.747 . 0 0 "[ ]" 1
304 1 20 LEU HA 1 21 SER H 1.800 . 3.500 3.511 3.511 3.511 0.011 1 0 "[ ]" 1
305 1 20 LEU QB 1 21 SER H 1.800 . 3.500 2.757 2.757 2.757 . 0 0 "[ ]" 1
306 1 21 SER H 1 22 LEU HG 1.800 . 6.000 3.817 3.817 3.817 . 0 0 "[ ]" 1
307 1 22 LEU H 1 22 LEU HG 1.800 . 6.000 2.128 2.128 2.128 . 0 0 "[ ]" 1
308 1 22 LEU H 1 22 LEU QD 1.800 . 6.000 2.919 2.919 2.919 . 0 0 "[ ]" 1
309 1 22 LEU HA 1 22 LEU QD 1.800 . 3.500 2.234 2.234 2.234 . 0 0 "[ ]" 1
310 1 22 LEU HB3 1 22 LEU QD 1.800 . 3.500 2.120 2.120 2.120 . 0 0 "[ ]" 1
311 1 22 LEU HB2 1 22 LEU QD 1.800 . 3.500 2.270 2.270 2.270 . 0 0 "[ ]" 1
312 1 18 LYS HA 1 22 LEU H 1.800 . 6.000 4.968 4.968 4.968 . 0 0 "[ ]" 1
313 1 21 SER QB 1 22 LEU H 1.800 . 6.000 3.598 3.598 3.598 . 0 0 "[ ]" 1
314 1 22 LEU H 1 23 PRO QD 1.800 . 6.000 4.390 4.390 4.390 . 0 0 "[ ]" 1
315 1 22 LEU H 1 23 PRO HA 1.800 . 6.000 5.300 5.300 5.300 . 0 0 "[ ]" 1
316 1 22 LEU H 1 27 ILE MD 1.800 . 6.000 4.958 4.958 4.958 . 0 0 "[ ]" 1
317 1 22 LEU QB 1 23 PRO HA 1.800 . 6.000 4.444 4.444 4.444 . 0 0 "[ ]" 1
318 1 22 LEU HB3 1 23 PRO QD 1.800 . 6.000 2.080 2.080 2.080 . 0 0 "[ ]" 1
319 1 22 LEU HB2 1 23 PRO QD 1.800 . 6.000 2.479 2.479 2.479 . 0 0 "[ ]" 1
320 1 23 PRO HA 1 23 PRO HB3 1.800 . 2.900 2.276 2.276 2.276 . 0 0 "[ ]" 1
321 1 23 PRO HA 1 23 PRO QG 1.800 . 3.500 3.077 3.077 3.077 . 0 0 "[ ]" 1
322 1 23 PRO QB 1 27 ILE H 1.800 . 5.000 4.455 4.455 4.455 . 0 0 "[ ]" 1
323 1 23 PRO HB3 1 25 TYR QE 1.800 . 3.500 2.278 2.278 2.278 . 0 0 "[ ]" 1
324 1 23 PRO HB2 1 25 TYR QE 1.800 . 3.500 2.737 2.737 2.737 . 0 0 "[ ]" 1
325 1 22 LEU QD 1 23 PRO HD3 1.800 . 5.000 3.533 3.533 3.533 . 0 0 "[ ]" 1
326 1 22 LEU QD 1 23 PRO HD2 1.800 . 5.000 3.564 3.564 3.564 . 0 0 "[ ]" 1
327 1 22 LEU QB 1 23 PRO HD3 1.800 . 3.500 2.369 2.369 2.369 . 0 0 "[ ]" 1
328 1 22 LEU QB 1 23 PRO HD2 1.800 . 3.500 2.121 2.121 2.121 . 0 0 "[ ]" 1
329 1 24 PRO HA 1 27 ILE MD 1.800 . 6.000 2.025 2.025 2.025 . 0 0 "[ ]" 1
330 1 24 PRO HA 1 27 ILE QG 1.800 . 6.000 2.504 2.504 2.504 . 0 0 "[ ]" 1
331 1 17 ALA MB 1 24 PRO HA 1.800 . 6.000 2.423 2.423 2.423 . 0 0 "[ ]" 1
332 1 24 PRO HA 1 26 THR H 1.800 . 4.000 4.074 4.074 4.074 0.074 1 0 "[ ]" 1
333 1 25 TYR H 1 25 TYR HA 1.800 . 2.900 2.866 2.866 2.866 . 0 0 "[ ]" 1
334 1 25 TYR H 1 25 TYR QB 1.800 . 2.900 2.426 2.426 2.426 . 0 0 "[ ]" 1
335 1 25 TYR H 1 25 TYR QD 1.800 . 2.900 2.285 2.285 2.285 . 0 0 "[ ]" 1
336 1 25 TYR H 1 25 TYR QE 1.800 . 6.000 4.188 4.188 4.188 . 0 0 "[ ]" 1
337 1 25 TYR HA 1 25 TYR QD 1.800 . 6.000 3.681 3.681 3.681 . 0 0 "[ ]" 1
338 1 25 TYR H 1 26 THR HG1 1.800 . 6.000 4.329 4.329 4.329 . 0 0 "[ ]" 1
339 1 25 TYR H 1 26 THR H 1.800 . 2.900 2.586 2.586 2.586 . 0 0 "[ ]" 1
340 1 24 PRO QB 1 25 TYR H 1.800 . 2.900 2.919 2.919 2.919 0.019 1 0 "[ ]" 1
341 1 24 PRO HA 1 25 TYR H 1.800 . 3.500 3.566 3.566 3.566 0.066 1 0 "[ ]" 1
342 1 24 PRO QD 1 25 TYR H 1.800 . 3.500 2.827 2.827 2.827 . 0 0 "[ ]" 1
343 1 24 PRO QG 1 25 TYR H 1.800 . 6.000 2.295 2.295 2.295 . 0 0 "[ ]" 1
344 1 26 THR H 1 26 THR HA 1.800 . 2.900 2.880 2.880 2.880 . 0 0 "[ ]" 1
345 1 26 THR H 1 26 THR HB 1.800 . 2.900 2.579 2.579 2.579 . 0 0 "[ ]" 1
346 1 26 THR H 1 26 THR MG 1.800 . 6.000 3.772 3.772 3.772 . 0 0 "[ ]" 1
347 1 26 THR HA 1 26 THR MG 1.800 . 3.500 2.307 2.307 2.307 . 0 0 "[ ]" 1
348 1 24 PRO QB 1 26 THR H 1.800 . 6.000 4.667 4.667 4.667 . 0 0 "[ ]" 1
349 1 24 PRO QG 1 26 THR H 1.800 . 6.000 4.581 4.581 4.581 . 0 0 "[ ]" 1
350 1 24 PRO QD 1 26 THR H 1.800 . 6.000 4.135 4.135 4.135 . 0 0 "[ ]" 1
351 1 25 TYR HA 1 26 THR H 1.800 . 3.500 3.481 3.481 3.481 . 0 0 "[ ]" 1
352 1 25 TYR QB 1 26 THR H 1.800 . 6.000 3.554 3.554 3.554 . 0 0 "[ ]" 1
353 1 25 TYR QD 1 26 THR H 1.800 . 6.000 3.185 3.185 3.185 . 0 0 "[ ]" 1
354 1 26 THR H 1 27 ILE QG 1.800 . 6.000 3.718 3.718 3.718 . 0 0 "[ ]" 1
355 1 26 THR H 1 27 ILE H 1.800 . 2.900 2.559 2.559 2.559 . 0 0 "[ ]" 1
356 1 26 THR H 1 28 PHE QB 1.800 . 6.000 6.117 6.117 6.117 0.117 1 0 "[ ]" 1
357 1 25 TYR QD 1 26 THR HA 1.800 . 5.000 2.938 2.938 2.938 . 0 0 "[ ]" 1
358 1 26 THR HB 1 27 ILE HA 1.800 . 6.000 4.211 4.211 4.211 . 0 0 "[ ]" 1
359 1 26 THR HB 1 27 ILE H 1.800 . 2.900 2.795 2.795 2.795 . 0 0 "[ ]" 1
360 1 23 PRO QD 1 26 THR HB 1.800 . 6.000 2.551 2.551 2.551 . 0 0 "[ ]" 1
361 1 23 PRO QD 1 26 THR MG 1.800 . 6.000 2.747 2.747 2.747 . 0 0 "[ ]" 1
362 1 25 TYR QD 1 26 THR HG1 1.800 . 2.900 2.958 2.958 2.958 0.058 1 0 "[ ]" 1
363 1 27 ILE H 1 27 ILE HG12 1.800 . 6.000 3.209 3.209 3.209 . 0 0 "[ ]" 1
364 1 27 ILE H 1 27 ILE HG13 1.800 . 6.000 1.844 1.844 1.844 . 0 0 "[ ]" 1
365 1 27 ILE H 1 27 ILE MD 1.800 . 6.000 3.366 3.366 3.366 . 0 0 "[ ]" 1
366 1 27 ILE H 1 27 ILE MG 1.800 . 3.500 3.727 3.727 3.727 0.227 1 0 "[ ]" 1
367 1 27 ILE HA 1 27 ILE MD 1.800 . 6.000 3.850 3.850 3.850 . 0 0 "[ ]" 1
368 1 27 ILE HA 1 27 ILE MG 1.800 . 3.500 2.286 2.286 2.286 . 0 0 "[ ]" 1
369 1 27 ILE HB 1 27 ILE MD 1.800 . 2.900 2.245 2.245 2.245 . 0 0 "[ ]" 1
370 1 27 ILE MD 1 27 ILE MG 1.800 . 3.500 2.044 2.044 2.044 . 0 0 "[ ]" 1
371 1 27 ILE HG13 1 27 ILE MG 1.800 . 2.900 3.142 3.142 3.142 0.242 1 0 "[ ]" 1
372 1 27 ILE HG12 1 27 ILE MG 1.800 . 2.900 2.162 2.162 2.162 . 0 0 "[ ]" 1
373 1 24 PRO HA 1 27 ILE H 1.800 . 3.500 3.452 3.452 3.452 . 0 0 "[ ]" 1
374 1 25 TYR HA 1 27 ILE H 1.800 . 4.000 4.043 4.043 4.043 0.043 1 0 "[ ]" 1
375 1 25 TYR QB 1 27 ILE H 1.800 . 6.000 5.026 5.026 5.026 . 0 0 "[ ]" 1
376 1 25 TYR H 1 27 ILE H 1.800 . 6.000 4.178 4.178 4.178 . 0 0 "[ ]" 1
377 1 26 THR HA 1 27 ILE H 1.800 . 3.500 3.511 3.511 3.511 0.011 1 0 "[ ]" 1
378 1 27 ILE H 1 28 PHE H 1.800 . 2.900 2.755 2.755 2.755 . 0 0 "[ ]" 1
379 1 27 ILE HA 1 28 PHE QD 1.800 . 6.000 5.104 5.104 5.104 . 0 0 "[ ]" 1
380 1 27 ILE HA 1 28 PHE QE 1.800 . 6.000 5.592 5.592 5.592 . 0 0 "[ ]" 1
381 1 27 ILE HB 1 28 PHE QD 1.800 . 6.000 3.004 3.004 3.004 . 0 0 "[ ]" 1
382 1 27 ILE HB 1 28 PHE QE 1.800 . 6.000 3.587 3.587 3.587 . 0 0 "[ ]" 1
383 1 27 ILE HB 1 28 PHE H 1.800 . 6.000 2.556 2.556 2.556 . 0 0 "[ ]" 1
384 1 27 ILE MG 1 28 PHE QE 1.800 . 6.000 2.724 2.724 2.724 . 0 0 "[ ]" 1
385 1 27 ILE MG 1 28 PHE H 1.800 . 6.000 3.589 3.589 3.589 . 0 0 "[ ]" 1
386 1 27 ILE MD 1 28 PHE QD 1.800 . 6.000 3.965 3.965 3.965 . 0 0 "[ ]" 1
387 1 27 ILE MD 1 28 PHE QE 1.800 . 6.000 3.549 3.549 3.549 . 0 0 "[ ]" 1
388 1 17 ALA MB 1 27 ILE MD 1.800 . 3.500 2.119 2.119 2.119 . 0 0 "[ ]" 1
389 1 22 LEU HG 1 27 ILE MD 1.800 . 6.000 5.590 5.590 5.590 . 0 0 "[ ]" 1
390 1 22 LEU QB 1 27 ILE MD 1.800 . 6.000 4.815 4.815 4.815 . 0 0 "[ ]" 1
391 1 16 LYS QB 1 27 ILE MD 1.800 . 3.500 2.395 2.395 2.395 . 0 0 "[ ]" 1
392 1 13 ARG QD 1 27 ILE MD 1.800 . 3.500 3.171 3.171 3.171 . 0 0 "[ ]" 1
393 1 16 LYS QE 1 27 ILE MD 1.800 . 5.000 3.570 3.570 3.570 . 0 0 "[ ]" 1
394 1 13 ARG QB 1 27 ILE MD 1.800 . 5.000 3.840 3.840 3.840 . 0 0 "[ ]" 1
395 1 20 LEU QB 1 27 ILE QG 1.800 . 3.500 3.410 3.410 3.410 . 0 0 "[ ]" 1
396 1 27 ILE MG 1 28 PHE HZ 1.800 . 5.000 2.997 2.997 2.997 . 0 0 "[ ]" 1
397 1 13 ARG QG 1 27 ILE MG 1.800 . 5.000 3.272 3.272 3.272 . 0 0 "[ ]" 1
398 1 16 LYS QD 1 27 ILE MG 1.800 . 3.500 2.044 2.044 2.044 . 0 0 "[ ]" 1
399 1 27 ILE MG 1 53 VAL QG 1.800 . 5.000 2.998 2.998 2.998 . 0 0 "[ ]" 1
400 1 28 PHE HA 1 28 PHE QD 1.800 . 5.000 2.409 2.409 2.409 . 0 0 "[ ]" 1
401 1 28 PHE H 1 28 PHE QD 1.800 . 6.000 3.180 3.180 3.180 . 0 0 "[ ]" 1
402 1 24 PRO HA 1 28 PHE H 1.800 . 6.000 5.240 5.240 5.240 . 0 0 "[ ]" 1
403 1 25 TYR HA 1 28 PHE H 1.800 . 6.000 3.536 3.536 3.536 . 0 0 "[ ]" 1
404 1 25 TYR QB 1 28 PHE H 1.800 . 6.000 4.896 4.896 4.896 . 0 0 "[ ]" 1
405 1 26 THR HA 1 28 PHE H 1.800 . 6.000 4.160 4.160 4.160 . 0 0 "[ ]" 1
406 1 26 THR H 1 28 PHE H 1.800 . 6.000 4.306 4.306 4.306 . 0 0 "[ ]" 1
407 1 27 ILE HA 1 28 PHE H 1.800 . 3.500 3.545 3.545 3.545 0.045 1 0 "[ ]" 1
408 1 27 ILE HG13 1 28 PHE H 1.800 . 6.000 4.073 4.073 4.073 . 0 0 "[ ]" 1
409 1 27 ILE HG12 1 28 PHE H 1.800 . 6.000 4.930 4.930 4.930 . 0 0 "[ ]" 1
410 1 27 ILE MD 1 28 PHE H 1.800 . 6.000 4.339 4.339 4.339 . 0 0 "[ ]" 1
411 1 28 PHE H 1 29 HIS H 1.800 . 6.000 4.523 4.523 4.523 . 0 0 "[ ]" 1
412 1 27 ILE H 1 28 PHE HA 1.800 . 6.000 5.380 5.380 5.380 . 0 0 "[ ]" 1
413 1 28 PHE HA 1 29 HIS H 1.800 . 3.500 2.357 2.357 2.357 . 0 0 "[ ]" 1
414 1 27 ILE QG 1 28 PHE QB 1.800 . 6.000 5.563 5.563 5.563 . 0 0 "[ ]" 1
415 1 27 ILE H 1 28 PHE QB 1.800 . 6.000 5.014 5.014 5.014 . 0 0 "[ ]" 1
416 1 28 PHE HB3 1 32 THR HB 1.800 . 6.000 3.324 3.324 3.324 . 0 0 "[ ]" 1
417 1 28 PHE HB2 1 32 THR HB 1.800 . 6.000 4.816 4.816 4.816 . 0 0 "[ ]" 1
418 1 27 ILE QG 1 28 PHE QD 1.800 . 6.000 4.877 4.877 4.877 . 0 0 "[ ]" 1
419 1 27 ILE MG 1 28 PHE QD 1.800 . 6.000 3.270 3.270 3.270 . 0 0 "[ ]" 1
420 1 28 PHE QD 1 29 HIS H 1.800 . 6.000 3.774 3.774 3.774 . 0 0 "[ ]" 1
421 1 28 PHE QD 1 32 THR HG1 1.800 . 6.000 3.444 3.444 3.444 . 0 0 "[ ]" 1
422 1 12 TRP QB 1 28 PHE HZ 1.800 . 6.000 6.052 6.052 6.052 0.052 1 0 "[ ]" 1
423 1 16 LYS QG 1 28 PHE HZ 1.800 . 6.000 5.222 5.222 5.222 . 0 0 "[ ]" 1
424 1 28 PHE HZ 1 53 VAL QG 1.800 . 6.000 4.122 4.122 4.122 . 0 0 "[ ]" 1
425 1 28 PHE HZ 1 61 TYR QB 1.800 . 6.000 6.018 6.018 6.018 0.018 1 0 "[ ]" 1
426 1 29 HIS H 1 29 HIS HB3 1.800 . 3.500 2.547 2.547 2.547 . 0 0 "[ ]" 1
427 1 28 PHE QB 1 29 HIS H 1.800 . 5.000 2.677 2.677 2.677 . 0 0 "[ ]" 1
428 1 28 PHE QE 1 29 HIS H 1.800 . 6.000 6.024 6.024 6.024 0.024 1 0 "[ ]" 1
429 1 29 HIS H 1 32 THR MG 1.800 . 6.000 3.313 3.313 3.313 . 0 0 "[ ]" 1
430 1 29 HIS H 1 32 THR HB 1.800 . 3.500 2.289 2.289 2.289 . 0 0 "[ ]" 1
431 1 30 ASP H 1 30 ASP QB 1.800 . 3.500 2.439 2.439 2.439 . 0 0 "[ ]" 1
432 1 29 HIS HB3 1 30 ASP H 1.800 . 6.000 3.811 3.811 3.811 . 0 0 "[ ]" 1
433 1 29 HIS HB2 1 30 ASP H 1.800 . 6.000 4.020 4.020 4.020 . 0 0 "[ ]" 1
434 1 30 ASP H 1 31 ALA H 1.800 . 6.000 2.863 2.863 2.863 . 0 0 "[ ]" 1
435 1 29 HIS HA 1 30 ASP H 1.800 . 3.500 2.334 2.334 2.334 . 0 0 "[ ]" 1
436 1 30 ASP HA 1 32 THR H 1.800 . 6.000 4.671 4.671 4.671 . 0 0 "[ ]" 1
437 1 30 ASP HA 1 33 LEU HB3 1.800 . 6.000 3.118 3.118 3.118 . 0 0 "[ ]" 1
438 1 30 ASP HA 1 33 LEU HB2 1.800 . 6.000 3.491 3.491 3.491 . 0 0 "[ ]" 1
439 1 29 HIS HD2 1 30 ASP HA 1.800 . 6.000 6.045 6.045 6.045 0.045 1 0 "[ ]" 1
440 1 29 HIS HE1 1 30 ASP HA 1.800 . 6.000 5.881 5.881 5.881 . 0 0 "[ ]" 1
441 1 29 HIS HD2 1 30 ASP QB 1.800 . 6.000 4.714 4.714 4.714 . 0 0 "[ ]" 1
442 1 29 HIS HE1 1 30 ASP QB 1.800 . 3.500 3.520 3.520 3.520 0.020 1 0 "[ ]" 1
443 1 31 ALA H 1 31 ALA HA 1.800 . 2.900 2.891 2.891 2.891 . 0 0 "[ ]" 1
444 1 31 ALA H 1 31 ALA MB 1.800 . 2.900 2.107 2.107 2.107 . 0 0 "[ ]" 1
445 1 29 HIS HA 1 31 ALA H 1.800 . 6.000 4.445 4.445 4.445 . 0 0 "[ ]" 1
446 1 30 ASP HA 1 31 ALA H 1.800 . 6.000 3.582 3.582 3.582 . 0 0 "[ ]" 1
447 1 31 ALA H 1 33 LEU H 1.800 . 6.000 4.085 4.085 4.085 . 0 0 "[ ]" 1
448 1 30 ASP QB 1 31 ALA H 1.800 . 2.900 2.481 2.481 2.481 . 0 0 "[ ]" 1
449 1 29 HIS HB3 1 31 ALA H 1.800 . 6.000 3.651 3.651 3.651 . 0 0 "[ ]" 1
450 1 29 HIS HB2 1 31 ALA H 1.800 . 6.000 4.763 4.763 4.763 . 0 0 "[ ]" 1
451 1 31 ALA H 1 32 THR H 1.800 . 3.500 2.598 2.598 2.598 . 0 0 "[ ]" 1
452 1 31 ALA HA 1 34 LYS HB3 1.800 . 5.000 4.796 4.796 4.796 . 0 0 "[ ]" 1
453 1 31 ALA HA 1 34 LYS HB2 1.800 . 5.000 3.288 3.288 3.288 . 0 0 "[ ]" 1
454 1 31 ALA HA 1 32 THR H 1.800 . 3.500 3.546 3.546 3.546 0.046 1 0 "[ ]" 1
455 1 31 ALA HA 1 33 LEU H 1.800 . 6.000 4.382 4.382 4.382 . 0 0 "[ ]" 1
456 1 31 ALA HA 1 34 LYS H 1.800 . 6.000 3.549 3.549 3.549 . 0 0 "[ ]" 1
457 1 32 THR H 1 32 THR HA 1.800 . 2.900 2.840 2.840 2.840 . 0 0 "[ ]" 1
458 1 32 THR H 1 32 THR HB 1.800 . 2.900 2.567 2.567 2.567 . 0 0 "[ ]" 1
459 1 32 THR H 1 32 THR MG 1.800 . 3.500 3.742 3.742 3.742 0.242 1 0 "[ ]" 1
460 1 32 THR HA 1 32 THR MG 1.800 . 2.900 2.299 2.299 2.299 . 0 0 "[ ]" 1
461 1 32 THR H 1 33 LEU QB 1.800 . 6.000 4.447 4.447 4.447 . 0 0 "[ ]" 1
462 1 32 THR H 1 33 LEU QD 1.800 . 6.000 5.564 5.564 5.564 . 0 0 "[ ]" 1
463 1 32 THR H 1 34 LYS H 1.800 . 6.000 4.281 4.281 4.281 . 0 0 "[ ]" 1
464 1 32 THR H 1 33 LEU H 1.800 . 2.900 2.708 2.708 2.708 . 0 0 "[ ]" 1
465 1 31 ALA MB 1 32 THR H 1.800 . 2.900 2.621 2.621 2.621 . 0 0 "[ ]" 1
466 1 29 HIS HB3 1 32 THR H 1.800 . 6.000 2.277 2.277 2.277 . 0 0 "[ ]" 1
467 1 29 HIS HB2 1 32 THR H 1.800 . 6.000 4.000 4.000 4.000 . 0 0 "[ ]" 1
468 1 32 THR HA 1 33 LEU H 1.800 . 3.500 3.546 3.546 3.546 0.046 1 0 "[ ]" 1
469 1 32 THR HA 1 35 THR HB 1.800 . 3.500 2.805 2.805 2.805 . 0 0 "[ ]" 1
470 1 28 PHE QB 1 32 THR HA 1.800 . 6.000 5.599 5.599 5.599 . 0 0 "[ ]" 1
471 1 28 PHE QB 1 32 THR HB 1.800 . 3.500 3.267 3.267 3.267 . 0 0 "[ ]" 1
472 1 32 THR HB 1 33 LEU QB 1.800 . 6.000 4.094 4.094 4.094 . 0 0 "[ ]" 1
473 1 32 THR HB 1 33 LEU H 1.800 . 2.900 2.590 2.590 2.590 . 0 0 "[ ]" 1
474 1 31 ALA MB 1 32 THR HB 1.800 . 6.000 4.724 4.724 4.724 . 0 0 "[ ]" 1
475 1 32 THR HB 1 33 LEU QD 1.800 . 6.000 5.223 5.223 5.223 . 0 0 "[ ]" 1
476 1 32 THR HB 1 33 LEU HG 1.800 . 7.000 6.188 6.188 6.188 . 0 0 "[ ]" 1
477 1 33 LEU H 1 33 LEU HB3 1.800 . 3.500 2.624 2.624 2.624 . 0 0 "[ ]" 1
478 1 33 LEU H 1 33 LEU HB2 1.800 . 3.500 2.436 2.436 2.436 . 0 0 "[ ]" 1
479 1 33 LEU H 1 33 LEU QD 1.800 . 3.500 3.713 3.713 3.713 0.213 1 0 "[ ]" 1
480 1 33 LEU H 1 33 LEU HG 1.800 . 5.000 4.373 4.373 4.373 . 0 0 "[ ]" 1
481 1 33 LEU HB3 1 33 LEU QD 1.800 . 3.500 2.055 2.055 2.055 . 0 0 "[ ]" 1
482 1 33 LEU HB2 1 33 LEU QD 1.800 . 3.500 2.098 2.098 2.098 . 0 0 "[ ]" 1
483 1 33 LEU HA 1 33 LEU QD 1.800 . 3.500 3.013 3.013 3.013 . 0 0 "[ ]" 1
484 1 6 PHE QE 1 33 LEU H 1.800 . 7.000 6.162 6.162 6.162 . 0 0 "[ ]" 1
485 1 33 LEU H 1 34 LYS H 1.800 . 2.900 2.772 2.772 2.772 . 0 0 "[ ]" 1
486 1 30 ASP HA 1 33 LEU H 1.800 . 6.000 3.707 3.707 3.707 . 0 0 "[ ]" 1
487 1 32 THR MG 1 33 LEU H 1.800 . 3.500 3.524 3.524 3.524 0.024 1 0 "[ ]" 1
488 1 33 LEU H 1 35 THR H 1.800 . 6.000 4.179 4.179 4.179 . 0 0 "[ ]" 1
489 1 28 PHE HB3 1 33 LEU H 1.800 . 5.000 3.692 3.692 3.692 . 0 0 "[ ]" 1
490 1 28 PHE HB2 1 33 LEU H 1.800 . 5.000 4.550 4.550 4.550 . 0 0 "[ ]" 1
491 1 33 LEU HA 1 34 LYS H 1.800 . 3.500 3.550 3.550 3.550 0.050 1 0 "[ ]" 1
492 1 33 LEU HA 1 35 THR H 1.800 . 6.000 4.339 4.339 4.339 . 0 0 "[ ]" 1
493 1 33 LEU HA 1 36 ILE HB 1.800 . 6.000 3.165 3.165 3.165 . 0 0 "[ ]" 1
494 1 33 LEU HA 1 36 ILE MD 1.800 . 2.900 2.333 2.333 2.333 . 0 0 "[ ]" 1
495 1 33 LEU QD 1 34 LYS HA 1.800 . 2.900 2.779 2.779 2.779 . 0 0 "[ ]" 1
496 1 30 ASP HA 1 33 LEU QD 1.800 . 5.000 3.576 3.576 3.576 . 0 0 "[ ]" 1
497 1 28 PHE QD 1 33 LEU HB3 1.800 . 6.000 6.014 6.014 6.014 0.014 1 0 "[ ]" 1
498 1 28 PHE QD 1 33 LEU HB2 1.800 . 5.000 4.557 4.557 4.557 . 0 0 "[ ]" 1
499 1 34 LYS H 1 34 LYS HA 1.800 . 2.900 2.863 2.863 2.863 . 0 0 "[ ]" 1
500 1 34 LYS H 1 34 LYS HB3 1.800 . 3.500 3.603 3.603 3.603 0.103 1 0 "[ ]" 1
501 1 34 LYS H 1 34 LYS HB2 1.800 . 3.500 2.506 2.506 2.506 . 0 0 "[ ]" 1
502 1 34 LYS H 1 34 LYS QD 1.800 . 6.000 3.821 3.821 3.821 . 0 0 "[ ]" 1
503 1 34 LYS H 1 34 LYS QG 1.800 . 6.000 2.063 2.063 2.063 . 0 0 "[ ]" 1
504 1 34 LYS HA 1 34 LYS QD 1.800 . 6.000 3.924 3.924 3.924 . 0 0 "[ ]" 1
505 1 34 LYS HA 1 34 LYS QG 1.800 . 3.500 2.350 2.350 2.350 . 0 0 "[ ]" 1
506 1 34 LYS HA 1 34 LYS QE 1.800 . 6.000 4.576 4.576 4.576 . 0 0 "[ ]" 1
507 1 34 LYS QB 1 34 LYS QD 1.800 . 3.500 2.135 2.135 2.135 . 0 0 "[ ]" 1
508 1 30 ASP HA 1 34 LYS H 1.800 . 6.000 4.586 4.586 4.586 . 0 0 "[ ]" 1
509 1 32 THR HA 1 34 LYS H 1.800 . 6.000 4.304 4.304 4.304 . 0 0 "[ ]" 1
510 1 33 LEU HB3 1 34 LYS H 1.800 . 6.000 2.588 2.588 2.588 . 0 0 "[ ]" 1
511 1 33 LEU HB2 1 34 LYS H 1.800 . 6.000 3.840 3.840 3.840 . 0 0 "[ ]" 1
512 1 33 LEU QD 1 34 LYS H 1.800 . 6.000 3.035 3.035 3.035 . 0 0 "[ ]" 1
513 1 34 LYS H 1 35 THR H 1.800 . 3.500 2.629 2.629 2.629 . 0 0 "[ ]" 1
514 1 34 LYS H 1 36 ILE H 1.800 . 6.000 4.148 4.148 4.148 . 0 0 "[ ]" 1
515 1 34 LYS HA 1 36 ILE H 1.800 . 6.000 4.254 4.254 4.254 . 0 0 "[ ]" 1
516 1 34 LYS HA 1 37 ALA H 1.800 . 3.500 3.479 3.479 3.479 . 0 0 "[ ]" 1
517 1 34 LYS HA 1 37 ALA MB 1.800 . 3.500 2.885 2.885 2.885 . 0 0 "[ ]" 1
518 1 6 PHE QD 1 34 LYS HA 1.800 . 6.000 5.722 5.722 5.722 . 0 0 "[ ]" 1
519 1 35 THR H 1 35 THR HA 1.800 . 2.900 2.834 2.834 2.834 . 0 0 "[ ]" 1
520 1 35 THR H 1 35 THR HB 1.800 . 2.900 2.490 2.490 2.490 . 0 0 "[ ]" 1
521 1 35 THR H 1 35 THR MG 1.800 . 3.500 3.731 3.731 3.731 0.231 1 0 "[ ]" 1
522 1 35 THR HA 1 35 THR MG 1.800 . 2.900 2.339 2.339 2.339 . 0 0 "[ ]" 1
523 1 31 ALA HA 1 35 THR H 1.800 . 6.000 4.626 4.626 4.626 . 0 0 "[ ]" 1
524 1 32 THR HA 1 35 THR H 1.800 . 6.000 3.325 3.325 3.325 . 0 0 "[ ]" 1
525 1 34 LYS HB3 1 35 THR H 1.800 . 6.000 3.683 3.683 3.683 . 0 0 "[ ]" 1
526 1 34 LYS HB2 1 35 THR H 1.800 . 6.000 2.597 2.597 2.597 . 0 0 "[ ]" 1
527 1 34 LYS QD 1 35 THR H 1.800 . 5.000 4.721 4.721 4.721 . 0 0 "[ ]" 1
528 1 34 LYS HA 1 35 THR H 1.800 . 3.500 3.532 3.532 3.532 0.032 1 0 "[ ]" 1
529 1 34 LYS QG 1 35 THR H 1.800 . 6.000 3.944 3.944 3.944 . 0 0 "[ ]" 1
530 1 35 THR H 1 36 ILE H 1.800 . 3.500 2.699 2.699 2.699 . 0 0 "[ ]" 1
531 1 35 THR H 1 37 ALA H 1.800 . 6.000 4.318 4.318 4.318 . 0 0 "[ ]" 1
532 1 35 THR HA 1 38 GLU HB3 1.800 . 6.000 4.397 4.397 4.397 . 0 0 "[ ]" 1
533 1 35 THR HA 1 38 GLU HB2 1.800 . 6.000 2.780 2.780 2.780 . 0 0 "[ ]" 1
534 1 35 THR HA 1 38 GLU H 1.800 . 5.000 3.440 3.440 3.440 . 0 0 "[ ]" 1
535 1 34 LYS HA 1 35 THR HA 1.800 . 6.000 4.836 4.836 4.836 . 0 0 "[ ]" 1
536 1 34 LYS QG 1 35 THR HA 1.800 . 6.000 5.754 5.754 5.754 . 0 0 "[ ]" 1
537 1 35 THR HA 1 36 ILE H 1.800 . 3.500 3.537 3.537 3.537 0.037 1 0 "[ ]" 1
538 1 35 THR HA 1 37 ALA H 1.800 . 6.000 4.387 4.387 4.387 . 0 0 "[ ]" 1
539 1 35 THR HA 1 38 GLU QG 1.800 . 6.000 3.382 3.382 3.382 . 0 0 "[ ]" 1
540 1 34 LYS QG 1 35 THR HB 1.800 . 6.000 6.128 6.128 6.128 0.128 1 0 "[ ]" 1
541 1 35 THR HB 1 36 ILE H 1.800 . 2.900 2.645 2.645 2.645 . 0 0 "[ ]" 1
542 1 35 THR MG 1 36 ILE H 1.800 . 3.500 3.492 3.492 3.492 . 0 0 "[ ]" 1
543 1 36 ILE H 1 36 ILE HB 1.800 . 3.500 2.521 2.521 2.521 . 0 0 "[ ]" 1
544 1 36 ILE H 1 36 ILE QG 1.800 . 3.500 1.990 1.990 1.990 . 0 0 "[ ]" 1
545 1 36 ILE HA 1 36 ILE MD 1.800 . 6.000 3.818 3.818 3.818 . 0 0 "[ ]" 1
546 1 36 ILE HA 1 36 ILE HG13 1.800 . 3.500 2.994 2.994 2.994 . 0 0 "[ ]" 1
547 1 36 ILE HA 1 36 ILE MG 1.800 . 2.900 2.282 2.282 2.282 . 0 0 "[ ]" 1
548 1 36 ILE HB 1 36 ILE MD 1.800 . 6.000 2.223 2.223 2.223 . 0 0 "[ ]" 1
549 1 36 ILE MD 1 36 ILE MG 1.800 . 3.500 2.055 2.055 2.055 . 0 0 "[ ]" 1
550 1 36 ILE H 1 36 ILE MD 1.800 . 3.500 3.487 3.487 3.487 . 0 0 "[ ]" 1
551 1 36 ILE HG13 1 36 ILE MG 1.800 . 3.500 3.169 3.169 3.169 . 0 0 "[ ]" 1
552 1 36 ILE HG12 1 36 ILE MG 1.800 . 3.500 2.279 2.279 2.279 . 0 0 "[ ]" 1
553 1 36 ILE H 1 36 ILE MG 1.800 . 3.500 3.738 3.738 3.738 0.238 1 0 "[ ]" 1
554 1 36 ILE H 1 37 ALA H 1.800 . 2.900 2.739 2.739 2.739 . 0 0 "[ ]" 1
555 1 32 THR HA 1 36 ILE H 1.800 . 6.000 4.468 4.468 4.468 . 0 0 "[ ]" 1
556 1 33 LEU HA 1 36 ILE H 1.800 . 6.000 3.426 3.426 3.426 . 0 0 "[ ]" 1
557 1 36 ILE H 1 38 GLU H 1.800 . 6.000 4.235 4.235 4.235 . 0 0 "[ ]" 1
558 1 36 ILE HA 1 37 ALA MB 1.800 . 6.000 5.037 5.037 5.037 . 0 0 "[ ]" 1
559 1 36 ILE HA 1 37 ALA H 1.800 . 3.500 3.560 3.560 3.560 0.060 1 0 "[ ]" 1
560 1 35 THR MG 1 36 ILE HA 1.800 . 3.500 3.505 3.505 3.505 0.005 1 0 "[ ]" 1
561 1 35 THR HB 1 36 ILE HA 1.800 . 6.000 4.277 4.277 4.277 . 0 0 "[ ]" 1
562 1 36 ILE HA 1 38 GLU H 1.800 . 6.000 4.491 4.491 4.491 . 0 0 "[ ]" 1
563 1 36 ILE HB 1 37 ALA H 1.800 . 5.000 2.555 2.555 2.555 . 0 0 "[ ]" 1
564 1 9 LEU QD 1 36 ILE HB 1.800 . 5.000 4.113 4.113 4.113 . 0 0 "[ ]" 1
565 1 35 THR HA 1 36 ILE MG 1.800 . 6.000 6.083 6.083 6.083 0.083 1 0 "[ ]" 1
566 1 35 THR MG 1 36 ILE MG 1.800 . 6.000 4.972 4.972 4.972 . 0 0 "[ ]" 1
567 1 34 LYS QG 1 36 ILE QG 1.800 . 6.300 6.329 6.329 6.329 0.029 1 0 "[ ]" 1
568 1 9 LEU QB 1 36 ILE QG 1.800 . 6.000 5.884 5.884 5.884 . 0 0 "[ ]" 1
569 1 34 LYS HA 1 36 ILE MG 1.800 . 6.000 6.024 6.024 6.024 0.024 1 0 "[ ]" 1
570 1 36 ILE QG 1 47 LEU MD1 1.800 . 5.000 3.107 3.107 3.107 . 0 0 "[ ]" 1
571 1 37 ALA H 1 37 ALA HA 1.800 . 2.900 2.862 2.862 2.862 . 0 0 "[ ]" 1
572 1 37 ALA H 1 37 ALA MB 1.800 . 2.900 2.118 2.118 2.118 . 0 0 "[ ]" 1
573 1 36 ILE MD 1 37 ALA H 1.800 . 6.000 4.427 4.427 4.427 . 0 0 "[ ]" 1
574 1 36 ILE QG 1 37 ALA H 1.800 . 6.000 3.980 3.980 3.980 . 0 0 "[ ]" 1
575 1 37 ALA H 1 38 GLU H 1.800 . 2.900 2.687 2.687 2.687 . 0 0 "[ ]" 1
576 1 36 ILE MG 1 37 ALA H 1.800 . 6.000 3.485 3.485 3.485 . 0 0 "[ ]" 1
577 1 37 ALA H 1 39 LEU QD 1.800 . 6.000 5.772 5.772 5.772 . 0 0 "[ ]" 1
578 1 5 LEU HG 1 37 ALA HA 1.800 . 6.000 5.482 5.482 5.482 . 0 0 "[ ]" 1
579 1 9 LEU MD1 1 37 ALA HA 1.800 . 6.000 4.276 4.276 4.276 . 0 0 "[ ]" 1
580 1 9 LEU HG 1 37 ALA HA 1.800 . 6.000 6.026 6.026 6.026 0.026 1 0 "[ ]" 1
581 1 37 ALA HA 1 38 GLU H 1.800 . 3.500 3.548 3.548 3.548 0.048 1 0 "[ ]" 1
582 1 34 LYS HA 1 37 ALA HA 1.800 . 6.000 5.689 5.689 5.689 . 0 0 "[ ]" 1
583 1 37 ALA MB 1 38 GLU H 1.800 . 2.900 2.619 2.619 2.619 . 0 0 "[ ]" 1
584 1 37 ALA MB 1 39 LEU QD 1.800 . 6.000 5.778 5.778 5.778 . 0 0 "[ ]" 1
585 1 1 HIS QB 1 37 ALA MB 1.800 . 6.000 5.568 5.568 5.568 . 0 0 "[ ]" 1
586 1 6 PHE QB 1 37 ALA MB 1.800 . 6.000 2.221 2.221 2.221 . 0 0 "[ ]" 1
587 1 38 GLU H 1 38 GLU HA 1.800 . 2.900 2.863 2.863 2.863 . 0 0 "[ ]" 1
588 1 38 GLU HA 1 38 GLU HG3 1.800 . 3.500 3.031 3.031 3.031 . 0 0 "[ ]" 1
589 1 38 GLU HA 1 38 GLU HG2 1.800 . 3.500 2.432 2.432 2.432 . 0 0 "[ ]" 1
590 1 38 GLU H 1 38 GLU HG2 1.800 . 6.000 3.390 3.390 3.390 . 0 0 "[ ]" 1
591 1 38 GLU H 1 38 GLU HG3 1.800 . 6.000 2.192 2.192 2.192 . 0 0 "[ ]" 1
592 1 38 GLU H 1 38 GLU HB3 1.800 . 3.500 3.600 3.600 3.600 0.100 1 0 "[ ]" 1
593 1 38 GLU H 1 38 GLU HB2 1.800 . 3.500 2.455 2.455 2.455 . 0 0 "[ ]" 1
594 1 38 GLU H 1 39 LEU H 1.800 . 2.900 2.645 2.645 2.645 . 0 0 "[ ]" 1
595 1 39 LEU H 1 39 LEU HA 1.800 . 2.900 2.965 2.965 2.965 0.065 1 0 "[ ]" 1
596 1 39 LEU H 1 39 LEU MD1 1.800 . 6.000 3.789 3.789 3.789 . 0 0 "[ ]" 1
597 1 39 LEU H 1 39 LEU MD2 1.800 . 6.000 3.331 3.331 3.331 . 0 0 "[ ]" 1
598 1 39 LEU HA 1 39 LEU MD1 1.800 . 6.000 3.776 3.776 3.776 . 0 0 "[ ]" 1
599 1 39 LEU HA 1 39 LEU MD2 1.800 . 6.000 2.042 2.042 2.042 . 0 0 "[ ]" 1
600 1 39 LEU HB3 1 39 LEU MD1 1.800 . 3.500 2.267 2.267 2.267 . 0 0 "[ ]" 1
601 1 39 LEU HB3 1 39 LEU MD2 1.800 . 3.500 2.303 2.303 2.303 . 0 0 "[ ]" 1
602 1 39 LEU HB2 1 39 LEU MD1 1.800 . 3.500 2.441 2.441 2.441 . 0 0 "[ ]" 1
603 1 39 LEU HB2 1 39 LEU MD2 1.800 . 3.500 3.189 3.189 3.189 . 0 0 "[ ]" 1
604 1 36 ILE MG 1 39 LEU H 1.800 . 6.000 4.550 4.550 4.550 . 0 0 "[ ]" 1
605 1 39 LEU H 1 40 ARG H 1.800 . 6.000 4.576 4.576 4.576 . 0 0 "[ ]" 1
606 1 38 GLU HA 1 39 LEU H 1.800 . 3.500 3.538 3.538 3.538 0.038 1 0 "[ ]" 1
607 1 36 ILE HA 1 39 LEU H 1.800 . 6.000 3.491 3.491 3.491 . 0 0 "[ ]" 1
608 1 38 GLU HB3 1 39 LEU H 1.800 . 6.000 3.664 3.664 3.664 . 0 0 "[ ]" 1
609 1 38 GLU HB2 1 39 LEU H 1.800 . 6.000 2.654 2.654 2.654 . 0 0 "[ ]" 1
610 1 39 LEU H 1 40 ARG QG 1.800 . 7.000 5.323 5.323 5.323 . 0 0 "[ ]" 1
611 1 39 LEU HB3 1 40 ARG HA 1.800 . 6.000 4.537 4.537 4.537 . 0 0 "[ ]" 1
612 1 39 LEU HB2 1 40 ARG HA 1.800 . 6.000 4.579 4.579 4.579 . 0 0 "[ ]" 1
613 1 39 LEU QD 1 41 PRO QD 1.800 . 5.000 3.110 3.110 3.110 . 0 0 "[ ]" 1
614 1 39 LEU QD 1 47 LEU QB 1.800 . 6.000 4.190 4.190 4.190 . 0 0 "[ ]" 1
615 1 40 ARG H 1 40 ARG HA 1.800 . 2.900 2.964 2.964 2.964 0.064 1 0 "[ ]" 1
616 1 40 ARG H 1 40 ARG HG3 1.800 . 6.000 2.435 2.435 2.435 . 0 0 "[ ]" 1
617 1 40 ARG H 1 40 ARG HG2 1.800 . 6.000 2.718 2.718 2.718 . 0 0 "[ ]" 1
618 1 40 ARG H 1 40 ARG QD 1.800 . 6.000 4.303 4.303 4.303 . 0 0 "[ ]" 1
619 1 40 ARG HA 1 40 ARG QD 1.800 . 6.000 4.363 4.363 4.363 . 0 0 "[ ]" 1
620 1 40 ARG QB 1 40 ARG QD 1.800 . 3.500 2.133 2.133 2.133 . 0 0 "[ ]" 1
621 1 40 ARG H 1 42 GLY QA 1.800 . 7.000 6.290 6.290 6.290 . 0 0 "[ ]" 1
622 1 39 LEU HA 1 40 ARG H 1.800 . 3.500 2.259 2.259 2.259 . 0 0 "[ ]" 1
623 1 39 LEU MD1 1 40 ARG H 1.800 . 6.000 4.862 4.862 4.862 . 0 0 "[ ]" 1
624 1 39 LEU MD2 1 40 ARG H 1.800 . 6.000 3.510 3.510 3.510 . 0 0 "[ ]" 1
625 1 39 LEU QD 1 40 ARG HA 1.800 . 6.000 5.137 5.137 5.137 . 0 0 "[ ]" 1
626 1 40 ARG HA 1 69 VAL MG1 1.800 . 5.000 4.720 4.720 4.720 . 0 0 "[ ]" 1
627 1 42 GLY H 1 42 GLY HA3 1.800 . 2.900 2.969 2.969 2.969 0.069 1 0 "[ ]" 1
628 1 42 GLY H 1 42 GLY HA2 1.800 . 2.900 2.424 2.424 2.424 . 0 0 "[ ]" 1
629 1 42 GLY H 1 43 SER QB 1.800 . 6.000 4.924 4.924 4.924 . 0 0 "[ ]" 1
630 1 42 GLY H 1 46 THR HB 1.800 . 6.000 4.961 4.961 4.961 . 0 0 "[ ]" 1
631 1 41 PRO QB 1 42 GLY H 1.800 . 6.000 3.227 3.227 3.227 . 0 0 "[ ]" 1
632 1 41 PRO HA 1 42 GLY H 1.800 . 3.500 3.498 3.498 3.498 . 0 0 "[ ]" 1
633 1 42 GLY H 1 43 SER H 1.800 . 5.000 2.871 2.871 2.871 . 0 0 "[ ]" 1
634 1 42 GLY H 1 46 THR MG 1.800 . 6.000 5.164 5.164 5.164 . 0 0 "[ ]" 1
635 1 39 LEU QD 1 42 GLY H 1.800 . 6.000 6.094 6.094 6.094 0.094 1 0 "[ ]" 1
636 1 40 ARG QG 1 42 GLY H 1.800 . 6.000 4.933 4.933 4.933 . 0 0 "[ ]" 1
637 1 42 GLY H 1 66 LEU QD 1.800 . 6.000 5.211 5.211 5.211 . 0 0 "[ ]" 1
638 1 43 SER H 1 43 SER HA 1.800 . 2.900 2.979 2.979 2.979 0.079 1 0 "[ ]" 1
639 1 43 SER H 1 43 SER QB 1.800 . 2.900 2.422 2.422 2.422 . 0 0 "[ ]" 1
640 1 41 PRO QG 1 43 SER H 1.800 . 6.000 3.202 3.202 3.202 . 0 0 "[ ]" 1
641 1 42 GLY HA3 1 43 SER H 1.800 . 3.500 2.964 2.964 2.964 . 0 0 "[ ]" 1
642 1 42 GLY HA2 1 43 SER H 1.800 . 3.500 3.525 3.525 3.525 0.025 1 0 "[ ]" 1
643 1 43 SER H 1 45 ALA H 1.800 . 6.000 5.650 5.650 5.650 . 0 0 "[ ]" 1
644 1 43 SER H 1 46 THR MG 1.800 . 6.000 3.999 3.999 3.999 . 0 0 "[ ]" 1
645 1 43 SER H 1 66 LEU QB 1.800 . 6.000 6.093 6.093 6.093 0.093 1 0 "[ ]" 1
646 1 43 SER H 1 66 LEU MD1 1.800 . 6.000 5.670 5.670 5.670 . 0 0 "[ ]" 1
647 1 43 SER H 1 66 LEU MD2 1.800 . 6.000 4.033 4.033 4.033 . 0 0 "[ ]" 1
648 1 43 SER H 1 69 VAL MG1 1.800 . 6.000 5.236 5.236 5.236 . 0 0 "[ ]" 1
649 1 43 SER H 1 69 VAL MG2 1.800 . 6.000 5.413 5.413 5.413 . 0 0 "[ ]" 1
650 1 44 HIS HA 1 47 LEU HB3 1.800 . 6.000 3.186 3.186 3.186 . 0 0 "[ ]" 1
651 1 44 HIS HA 1 47 LEU HB2 1.800 . 6.000 2.602 2.602 2.602 . 0 0 "[ ]" 1
652 1 44 HIS HA 1 66 LEU QD 1.800 . 6.000 4.828 4.828 4.828 . 0 0 "[ ]" 1
653 1 44 HIS HE1 1 68 VAL HB 1.800 . 7.000 6.950 6.950 6.950 . 0 0 "[ ]" 1
654 1 44 HIS HD2 1 61 TYR QE 1.800 . 6.000 5.402 5.402 5.402 . 0 0 "[ ]" 1
655 1 44 HIS HD2 1 66 LEU QD 1.800 . 6.000 4.110 4.110 4.110 . 0 0 "[ ]" 1
656 1 44 HIS HE1 1 65 VAL QG 1.800 . 6.000 2.019 2.019 2.019 . 0 0 "[ ]" 1
657 1 44 HIS HA 1 50 VAL QG 1.800 . 6.000 3.323 3.323 3.323 . 0 0 "[ ]" 1
658 1 44 HIS QB 1 50 VAL QG 1.800 . 6.000 2.126 2.126 2.126 . 0 0 "[ ]" 1
659 1 45 ALA H 1 45 ALA MB 1.800 . 2.900 2.180 2.180 2.180 . 0 0 "[ ]" 1
660 1 43 SER HA 1 45 ALA H 1.800 . 6.000 4.112 4.112 4.112 . 0 0 "[ ]" 1
661 1 44 HIS HA 1 45 ALA H 1.800 . 3.500 3.556 3.556 3.556 0.056 1 0 "[ ]" 1
662 1 44 HIS QB 1 45 ALA H 1.800 . 3.500 2.568 2.568 2.568 . 0 0 "[ ]" 1
663 1 45 ALA H 1 46 THR MG 1.800 . 6.000 5.900 5.900 5.900 . 0 0 "[ ]" 1
664 1 45 ALA H 1 47 LEU H 1.800 . 6.000 3.948 3.948 3.948 . 0 0 "[ ]" 1
665 1 46 THR H 1 46 THR HA 1.800 . 2.900 2.880 2.880 2.880 . 0 0 "[ ]" 1
666 1 46 THR H 1 46 THR HB 1.800 . 3.500 2.526 2.526 2.526 . 0 0 "[ ]" 1
667 1 46 THR H 1 46 THR MG 1.800 . 3.500 3.751 3.751 3.751 0.251 1 0 "[ ]" 1
668 1 46 THR HA 1 46 THR MG 1.800 . 2.900 2.300 2.300 2.300 . 0 0 "[ ]" 1
669 1 44 HIS HA 1 46 THR H 1.800 . 6.000 4.247 4.247 4.247 . 0 0 "[ ]" 1
670 1 45 ALA HA 1 46 THR H 1.800 . 3.500 3.522 3.522 3.522 0.022 1 0 "[ ]" 1
671 1 45 ALA MB 1 46 THR H 1.800 . 2.900 2.661 2.661 2.661 . 0 0 "[ ]" 1
672 1 45 ALA H 1 46 THR H 1.800 . 3.500 2.642 2.642 2.642 . 0 0 "[ ]" 1
673 1 46 THR H 1 47 LEU H 1.800 . 2.900 2.479 2.479 2.479 . 0 0 "[ ]" 1
674 1 46 THR H 1 48 GLY H 1.800 . 6.000 4.166 4.166 4.166 . 0 0 "[ ]" 1
675 1 46 THR HA 1 49 THR H 1.800 . 6.000 6.078 6.078 6.078 0.078 1 0 "[ ]" 1
676 1 46 THR HA 1 47 LEU H 1.800 . 3.500 3.488 3.488 3.488 . 0 0 "[ ]" 1
677 1 43 SER H 1 46 THR HB 1.800 . 5.000 3.007 3.007 3.007 . 0 0 "[ ]" 1
678 1 46 THR HB 1 47 LEU H 1.800 . 5.000 2.840 2.840 2.840 . 0 0 "[ ]" 1
679 1 41 PRO QG 1 46 THR HB 1.800 . 5.000 3.022 3.022 3.022 . 0 0 "[ ]" 1
680 1 41 PRO QD 1 46 THR HB 1.800 . 5.000 4.962 4.962 4.962 . 0 0 "[ ]" 1
681 1 41 PRO QG 1 46 THR MG 1.800 . 3.500 2.712 2.712 2.712 . 0 0 "[ ]" 1
682 1 46 THR H 1 49 THR H 1.800 . 6.000 6.096 6.096 6.096 0.096 1 0 "[ ]" 1
683 1 46 THR H 1 50 VAL QG 1.800 . 5.000 4.417 4.417 4.417 . 0 0 "[ ]" 1
684 1 44 HIS HD2 1 46 THR H 1.800 . 6.000 6.007 6.007 6.007 0.007 1 0 "[ ]" 1
685 1 47 LEU H 1 47 LEU HA 1.800 . 2.900 2.795 2.795 2.795 . 0 0 "[ ]" 1
686 1 47 LEU H 1 47 LEU HB3 1.800 . 3.500 2.657 2.657 2.657 . 0 0 "[ ]" 1
687 1 47 LEU H 1 47 LEU HB2 1.800 . 3.500 2.448 2.448 2.448 . 0 0 "[ ]" 1
688 1 47 LEU HA 1 47 LEU MD1 1.800 . 6.000 2.109 2.109 2.109 . 0 0 "[ ]" 1
689 1 47 LEU HA 1 47 LEU MD2 1.800 . 6.000 3.821 3.821 3.821 . 0 0 "[ ]" 1
690 1 47 LEU HB3 1 47 LEU MD1 1.800 . 3.500 3.182 3.182 3.182 . 0 0 "[ ]" 1
691 1 47 LEU HB3 1 47 LEU MD2 1.800 . 3.500 2.260 2.260 2.260 . 0 0 "[ ]" 1
692 1 47 LEU HB2 1 47 LEU MD1 1.800 . 3.500 2.219 2.219 2.219 . 0 0 "[ ]" 1
693 1 47 LEU HB2 1 47 LEU MD2 1.800 . 3.500 2.434 2.434 2.434 . 0 0 "[ ]" 1
694 1 47 LEU H 1 47 LEU MD1 1.800 . 5.000 3.896 3.896 3.896 . 0 0 "[ ]" 1
695 1 47 LEU H 1 47 LEU MD2 1.800 . 5.000 4.294 4.294 4.294 . 0 0 "[ ]" 1
696 1 47 LEU QD 1 47 LEU HG 1.800 . 3.500 1.907 1.907 1.907 . 0 0 "[ ]" 1
697 1 47 LEU HB3 1 47 LEU HG 1.800 . 2.900 2.490 2.490 2.490 . 0 0 "[ ]" 1
698 1 47 LEU HB2 1 47 LEU HG 1.800 . 2.900 3.022 3.022 3.022 0.122 1 0 "[ ]" 1
699 1 44 HIS HA 1 47 LEU H 1.800 . 6.000 3.227 3.227 3.227 . 0 0 "[ ]" 1
700 1 47 LEU H 1 49 THR H 1.800 . 6.000 4.264 4.264 4.264 . 0 0 "[ ]" 1
701 1 36 ILE QG 1 47 LEU QD 1.800 . 6.000 2.079 2.079 2.079 . 0 0 "[ ]" 1
702 1 47 LEU QD 1 50 VAL HB 1.800 . 6.000 5.465 5.465 5.465 . 0 0 "[ ]" 1
703 1 47 LEU QD 1 48 GLY QA 1.800 . 6.000 4.434 4.434 4.434 . 0 0 "[ ]" 1
704 1 36 ILE MD 1 47 LEU QD 1.800 . 6.000 3.161 3.161 3.161 . 0 0 "[ ]" 1
705 1 36 ILE QG 1 47 LEU HB3 1.800 . 7.000 5.301 5.301 5.301 . 0 0 "[ ]" 1
706 1 36 ILE QG 1 47 LEU HB2 1.800 . 7.000 4.984 4.984 4.984 . 0 0 "[ ]" 1
707 1 47 LEU HB3 1 50 VAL QG 1.800 . 6.000 2.792 2.792 2.792 . 0 0 "[ ]" 1
708 1 47 LEU HB2 1 50 VAL QG 1.800 . 6.000 3.902 3.902 3.902 . 0 0 "[ ]" 1
709 1 47 LEU QD 1 50 VAL QG 1.800 . 6.000 2.963 2.963 2.963 . 0 0 "[ ]" 1
710 1 47 LEU QB 1 48 GLY H 1.800 . 3.500 2.697 2.697 2.697 . 0 0 "[ ]" 1
711 1 47 LEU H 1 48 GLY H 1.800 . 3.500 2.744 2.744 2.744 . 0 0 "[ ]" 1
712 1 48 GLY H 1 49 THR MG 1.800 . 6.000 5.875 5.875 5.875 . 0 0 "[ ]" 1
713 1 48 GLY H 1 49 THR H 1.800 . 2.900 2.390 2.390 2.390 . 0 0 "[ ]" 1
714 1 48 GLY H 1 50 VAL MG1 1.800 . 6.000 5.916 5.916 5.916 . 0 0 "[ ]" 1
715 1 48 GLY H 1 50 VAL QG 1.800 . 6.000 3.253 3.253 3.253 . 0 0 "[ ]" 1
716 1 48 GLY QA 1 50 VAL QG 1.800 . 6.000 4.000 4.000 4.000 . 0 0 "[ ]" 1
717 1 48 GLY QA 1 49 THR H 1.800 . 2.900 2.855 2.855 2.855 . 0 0 "[ ]" 1
718 1 47 LEU QD 1 48 GLY H 1.800 . 5.000 4.034 4.034 4.034 . 0 0 "[ ]" 1
719 1 49 THR H 1 49 THR HA 1.800 . 2.900 2.983 2.983 2.983 0.083 1 0 "[ ]" 1
720 1 49 THR H 1 49 THR MG 1.800 . 6.000 3.984 3.984 3.984 . 0 0 "[ ]" 1
721 1 49 THR H 1 50 VAL HA 1.800 . 6.000 4.446 4.446 4.446 . 0 0 "[ ]" 1
722 1 49 THR H 1 50 VAL H 1.800 . 3.500 2.547 2.547 2.547 . 0 0 "[ ]" 1
723 1 49 THR H 1 50 VAL QG 1.800 . 6.000 2.846 2.846 2.846 . 0 0 "[ ]" 1
724 1 49 THR HA 1 50 VAL H 1.800 . 3.500 2.883 2.883 2.883 . 0 0 "[ ]" 1
725 1 49 THR HB 1 50 VAL HA 1.800 . 6.000 4.453 4.453 4.453 . 0 0 "[ ]" 1
726 1 48 GLY HA3 1 49 THR HB 1.800 . 6.000 5.597 5.597 5.597 . 0 0 "[ ]" 1
727 1 48 GLY HA2 1 49 THR HB 1.800 . 6.000 5.800 5.800 5.800 . 0 0 "[ ]" 1
728 1 50 VAL H 1 50 VAL HA 1.800 . 2.900 2.968 2.968 2.968 0.068 1 0 "[ ]" 1
729 1 50 VAL H 1 50 VAL MG1 1.800 . 6.000 3.827 3.827 3.827 . 0 0 "[ ]" 1
730 1 50 VAL H 1 50 VAL MG2 1.800 . 6.000 2.456 2.456 2.456 . 0 0 "[ ]" 1
731 1 50 VAL HA 1 50 VAL QG 1.800 . 3.500 2.097 2.097 2.097 . 0 0 "[ ]" 1
732 1 47 LEU H 1 50 VAL H 1.800 . 6.000 6.050 6.050 6.050 0.050 1 0 "[ ]" 1
733 1 48 GLY H 1 50 VAL H 1.800 . 6.000 4.087 4.087 4.087 . 0 0 "[ ]" 1
734 1 48 GLY QA 1 50 VAL H 1.800 . 6.000 3.756 3.756 3.756 . 0 0 "[ ]" 1
735 1 49 THR MG 1 50 VAL H 1.800 . 6.000 4.224 4.224 4.224 . 0 0 "[ ]" 1
736 1 50 VAL H 1 51 SER H 1.800 . 6.000 4.476 4.476 4.476 . 0 0 "[ ]" 1
737 1 50 VAL HA 1 51 SER H 1.800 . 3.500 2.203 2.203 2.203 . 0 0 "[ ]" 1
738 1 49 THR MG 1 50 VAL HA 1.800 . 6.000 4.347 4.347 4.347 . 0 0 "[ ]" 1
739 1 47 LEU QB 1 50 VAL HA 1.800 . 6.000 4.871 4.871 4.871 . 0 0 "[ ]" 1
740 1 47 LEU HG 1 50 VAL HA 1.800 . 6.000 6.038 6.038 6.038 0.038 1 0 "[ ]" 1
741 1 47 LEU MD2 1 50 VAL HA 1.800 . 6.000 4.079 4.079 4.079 . 0 0 "[ ]" 1
742 1 50 VAL HA 1 61 TYR QE 1.800 . 7.000 6.566 6.566 6.566 . 0 0 "[ ]" 1
743 1 36 ILE HA 1 50 VAL QG 1.800 . 7.000 7.018 7.018 7.018 0.018 1 0 "[ ]" 1
744 1 51 SER H 1 51 SER HA 1.800 . 2.900 2.923 2.923 2.923 0.023 1 0 "[ ]" 1
745 1 51 SER H 1 51 SER QB 1.800 . 2.900 2.829 2.829 2.829 . 0 0 "[ ]" 1
746 1 50 VAL HB 1 51 SER H 1.800 . 6.000 4.168 4.168 4.168 . 0 0 "[ ]" 1
747 1 50 VAL QG 1 51 SER H 1.800 . 3.500 2.659 2.659 2.659 . 0 0 "[ ]" 1
748 1 51 SER H 1 58 LEU QD 1.800 . 6.000 5.453 5.453 5.453 . 0 0 "[ ]" 1
749 1 52 GLY H 1 52 GLY HA3 1.800 . 2.900 2.886 2.886 2.886 . 0 0 "[ ]" 1
750 1 51 SER QB 1 52 GLY H 1.800 . 3.500 3.558 3.558 3.558 0.058 1 0 "[ ]" 1
751 1 51 SER HA 1 52 GLY H 1.800 . 3.500 2.271 2.271 2.271 . 0 0 "[ ]" 1
752 1 52 GLY H 1 53 VAL HA 1.800 . 6.000 5.558 5.558 5.558 . 0 0 "[ ]" 1
753 1 53 VAL H 1 53 VAL HA 1.800 . 2.900 2.896 2.896 2.896 . 0 0 "[ ]" 1
754 1 53 VAL H 1 53 VAL MG1 1.800 . 6.000 2.127 2.127 2.127 . 0 0 "[ ]" 1
755 1 53 VAL H 1 53 VAL MG2 1.800 . 6.000 1.935 1.935 1.935 . 0 0 "[ ]" 1
756 1 53 VAL HA 1 53 VAL MG1 1.800 . 3.500 2.438 2.438 2.438 . 0 0 "[ ]" 1
757 1 53 VAL HA 1 53 VAL MG2 1.800 . 3.500 3.193 3.193 3.193 . 0 0 "[ ]" 1
758 1 53 VAL HB 1 53 VAL QG 1.800 . 3.500 1.900 1.900 1.900 . 0 0 "[ ]" 1
759 1 28 PHE QE 1 53 VAL H 1.800 . 6.000 6.009 6.009 6.009 0.009 1 0 "[ ]" 1
760 1 52 GLY HA3 1 53 VAL H 1.800 . 3.500 2.837 2.837 2.837 . 0 0 "[ ]" 1
761 1 52 GLY HA2 1 53 VAL H 1.800 . 3.500 3.550 3.550 3.550 0.050 1 0 "[ ]" 1
762 1 52 GLY H 1 53 VAL H 1.800 . 3.500 3.300 3.300 3.300 . 0 0 "[ ]" 1
763 1 53 VAL H 1 54 GLY H 1.800 . 6.000 2.501 2.501 2.501 . 0 0 "[ ]" 1
764 1 53 VAL H 1 54 GLY QA 1.800 . 6.000 4.425 4.425 4.425 . 0 0 "[ ]" 1
765 1 28 PHE QE 1 53 VAL HA 1.800 . 6.000 6.021 6.021 6.021 0.021 1 0 "[ ]" 1
766 1 51 SER QB 1 53 VAL HB 1.800 . 7.000 7.004 7.004 7.004 0.004 1 0 "[ ]" 1
767 1 53 VAL HB 1 54 GLY QA 1.800 . 6.000 4.467 4.467 4.467 . 0 0 "[ ]" 1
768 1 52 GLY QA 1 53 VAL QG 1.800 . 6.000 3.381 3.381 3.381 . 0 0 "[ ]" 1
769 1 53 VAL QG 1 54 GLY QA 1.800 . 3.500 3.008 3.008 3.008 . 0 0 "[ ]" 1
770 1 50 VAL HB 1 53 VAL MG2 1.800 . 6.000 4.028 4.028 4.028 . 0 0 "[ ]" 1
771 1 53 VAL MG1 1 61 TYR QD 1.800 . 6.000 5.243 5.243 5.243 . 0 0 "[ ]" 1
772 1 53 VAL MG2 1 61 TYR QD 1.800 . 7.000 5.111 5.111 5.111 . 0 0 "[ ]" 1
773 1 28 PHE QE 1 53 VAL MG1 1.800 . 6.000 2.735 2.735 2.735 . 0 0 "[ ]" 1
774 1 28 PHE QE 1 53 VAL MG2 1.800 . 6.000 3.705 3.705 3.705 . 0 0 "[ ]" 1
775 1 53 VAL MG2 1 58 LEU HB3 1.800 . 6.000 5.555 5.555 5.555 . 0 0 "[ ]" 1
776 1 53 VAL MG2 1 58 LEU HB2 1.800 . 6.000 4.154 4.154 4.154 . 0 0 "[ ]" 1
777 1 53 VAL MG2 1 58 LEU QB 1.800 . 6.000 4.044 4.044 4.044 . 0 0 "[ ]" 1
778 1 36 ILE MD 1 53 VAL MG2 1.800 . 6.000 5.818 5.818 5.818 . 0 0 "[ ]" 1
779 1 52 GLY QA 1 53 VAL MG2 1.800 . 5.000 4.153 4.153 4.153 . 0 0 "[ ]" 1
780 1 54 GLY H 1 55 GLY H 1.800 . 5.000 4.633 4.633 4.633 . 0 0 "[ ]" 1
781 1 53 VAL HA 1 54 GLY H 1.800 . 3.500 3.471 3.471 3.471 . 0 0 "[ ]" 1
782 1 53 VAL HB 1 54 GLY H 1.800 . 5.000 4.041 4.041 4.041 . 0 0 "[ ]" 1
783 1 53 VAL MG1 1 54 GLY H 1.800 . 6.000 3.921 3.921 3.921 . 0 0 "[ ]" 1
784 1 53 VAL MG2 1 54 GLY H 1.800 . 6.000 2.286 2.286 2.286 . 0 0 "[ ]" 1
785 1 54 GLY H 1 55 GLY QA 1.800 . 6.000 5.105 5.105 5.105 . 0 0 "[ ]" 1
786 1 54 GLY QA 1 55 GLY H 1.800 . 3.500 2.179 2.179 2.179 . 0 0 "[ ]" 1
787 1 55 GLY H 1 55 GLY HA3 1.800 . 2.900 2.936 2.936 2.936 0.036 1 0 "[ ]" 1
788 1 55 GLY H 1 55 GLY HA2 1.800 . 2.900 2.718 2.718 2.718 . 0 0 "[ ]" 1
789 1 56 ARG HA 1 56 ARG QD 1.800 . 2.900 2.204 2.204 2.204 . 0 0 "[ ]" 1
790 1 56 ARG HA 1 56 ARG HG3 1.800 . 3.500 2.665 2.665 2.665 . 0 0 "[ ]" 1
791 1 56 ARG HA 1 56 ARG HG2 1.800 . 3.500 3.702 3.702 3.702 0.202 1 0 "[ ]" 1
792 1 56 ARG HA 1 59 ALA MB 1.800 . 6.000 3.048 3.048 3.048 . 0 0 "[ ]" 1
793 1 56 ARG HA 1 57 LYS H 1.800 . 3.500 3.532 3.532 3.532 0.032 1 0 "[ ]" 1
794 1 56 ARG HA 1 59 ALA H 1.800 . 6.000 3.427 3.427 3.427 . 0 0 "[ ]" 1
795 1 57 LYS H 1 57 LYS QE 1.800 . 6.000 4.198 4.198 4.198 . 0 0 "[ ]" 1
796 1 57 LYS H 1 57 LYS HB3 1.800 . 3.500 3.601 3.601 3.601 0.101 1 0 "[ ]" 1
797 1 57 LYS H 1 57 LYS HB2 1.800 . 3.500 2.490 2.490 2.490 . 0 0 "[ ]" 1
798 1 57 LYS HA 1 57 LYS QD 1.800 . 6.000 3.918 3.918 3.918 . 0 0 "[ ]" 1
799 1 57 LYS HA 1 57 LYS QE 1.800 . 6.000 4.562 4.562 4.562 . 0 0 "[ ]" 1
800 1 57 LYS HA 1 57 LYS QG 1.800 . 3.500 2.332 2.332 2.332 . 0 0 "[ ]" 1
801 1 57 LYS H 1 57 LYS HA 1.800 . 2.900 2.839 2.839 2.839 . 0 0 "[ ]" 1
802 1 57 LYS HB3 1 57 LYS QD 1.800 . 3.500 2.371 2.371 2.371 . 0 0 "[ ]" 1
803 1 57 LYS HB2 1 57 LYS QD 1.800 . 3.500 2.421 2.421 2.421 . 0 0 "[ ]" 1
804 1 57 LYS QE 1 57 LYS QG 1.800 . 2.900 2.099 2.099 2.099 . 0 0 "[ ]" 1
805 1 57 LYS H 1 57 LYS QG 1.800 . 5.000 2.108 2.108 2.108 . 0 0 "[ ]" 1
806 1 55 GLY QA 1 57 LYS H 1.800 . 6.000 3.327 3.327 3.327 . 0 0 "[ ]" 1
807 1 56 ARG H 1 57 LYS H 1.800 . 3.500 2.726 2.726 2.726 . 0 0 "[ ]" 1
808 1 57 LYS H 1 58 LEU QD 1.800 . 6.000 5.500 5.500 5.500 . 0 0 "[ ]" 1
809 1 57 LYS H 1 59 ALA H 1.800 . 6.000 4.303 4.303 4.303 . 0 0 "[ ]" 1
810 1 57 LYS HA 1 60 ALA MB 1.800 . 6.000 2.540 2.540 2.540 . 0 0 "[ ]" 1
811 1 57 LYS HA 1 61 TYR QD 1.800 . 6.000 4.304 4.304 4.304 . 0 0 "[ ]" 1
812 1 57 LYS QB 1 61 TYR QD 1.800 . 6.000 2.925 2.925 2.925 . 0 0 "[ ]" 1
813 1 57 LYS QG 1 61 TYR QD 1.800 . 6.000 4.985 4.985 4.985 . 0 0 "[ ]" 1
814 1 57 LYS QG 1 61 TYR QE 1.800 . 6.000 6.016 6.016 6.016 0.016 1 0 "[ ]" 1
815 1 20 LEU HA 1 57 LYS QB 1.800 . 6.000 6.014 6.014 6.014 0.014 1 0 "[ ]" 1
816 1 58 LEU H 1 58 LEU HA 1.800 . 2.900 2.827 2.827 2.827 . 0 0 "[ ]" 1
817 1 58 LEU H 1 58 LEU HB3 1.800 . 3.500 2.645 2.645 2.645 . 0 0 "[ ]" 1
818 1 58 LEU H 1 58 LEU HB2 1.800 . 3.500 2.456 2.456 2.456 . 0 0 "[ ]" 1
819 1 58 LEU H 1 58 LEU HG 1.800 . 5.000 4.483 4.483 4.483 . 0 0 "[ ]" 1
820 1 58 LEU HA 1 58 LEU QD 1.800 . 3.500 2.134 2.134 2.134 . 0 0 "[ ]" 1
821 1 58 LEU HA 1 58 LEU HG 1.800 . 3.500 2.861 2.861 2.861 . 0 0 "[ ]" 1
822 1 58 LEU H 1 58 LEU QD 1.800 . 3.500 3.590 3.590 3.590 0.090 1 0 "[ ]" 1
823 1 58 LEU H 1 59 ALA H 1.800 . 2.900 2.739 2.739 2.739 . 0 0 "[ ]" 1
824 1 57 LYS QB 1 58 LEU H 1.800 . 3.500 2.711 2.711 2.711 . 0 0 "[ ]" 1
825 1 57 LYS H 1 58 LEU H 1.800 . 2.900 2.667 2.667 2.667 . 0 0 "[ ]" 1
826 1 57 LYS HA 1 58 LEU H 1.800 . 3.500 3.522 3.522 3.522 0.022 1 0 "[ ]" 1
827 1 57 LYS QD 1 58 LEU H 1.800 . 6.000 4.887 4.887 4.887 . 0 0 "[ ]" 1
828 1 58 LEU H 1 59 ALA MB 1.800 . 6.000 4.327 4.327 4.327 . 0 0 "[ ]" 1
829 1 58 LEU HA 1 59 ALA H 1.800 . 3.500 3.539 3.539 3.539 0.039 1 0 "[ ]" 1
830 1 58 LEU HA 1 60 ALA H 1.800 . 6.000 4.340 4.340 4.340 . 0 0 "[ ]" 1
831 1 58 LEU HA 1 61 TYR QB 1.800 . 6.000 4.072 4.072 4.072 . 0 0 "[ ]" 1
832 1 58 LEU HA 1 61 TYR H 1.800 . 6.000 3.307 3.307 3.307 . 0 0 "[ ]" 1
833 1 58 LEU HB3 1 59 ALA H 1.800 . 6.000 2.614 2.614 2.614 . 0 0 "[ ]" 1
834 1 58 LEU HB2 1 59 ALA H 1.800 . 6.000 3.846 3.846 3.846 . 0 0 "[ ]" 1
835 1 58 LEU QB 1 59 ALA HA 1.800 . 6.000 4.096 4.096 4.096 . 0 0 "[ ]" 1
836 1 59 ALA H 1 59 ALA HA 1.800 . 2.900 2.866 2.866 2.866 . 0 0 "[ ]" 1
837 1 59 ALA H 1 59 ALA MB 1.800 . 2.900 2.054 2.054 2.054 . 0 0 "[ ]" 1
838 1 57 LYS HA 1 59 ALA H 1.800 . 6.000 4.113 4.113 4.113 . 0 0 "[ ]" 1
839 1 58 LEU HG 1 59 ALA H 1.800 . 6.000 3.904 3.904 3.904 . 0 0 "[ ]" 1
840 1 59 ALA H 1 60 ALA MB 1.800 . 6.000 4.314 4.314 4.314 . 0 0 "[ ]" 1
841 1 59 ALA H 1 61 TYR H 1.800 . 6.000 4.055 4.055 4.055 . 0 0 "[ ]" 1
842 1 59 ALA HA 1 61 TYR H 1.800 . 6.000 4.556 4.556 4.556 . 0 0 "[ ]" 1
843 1 60 ALA H 1 60 ALA HA 1.800 . 2.900 2.898 2.898 2.898 . 0 0 "[ ]" 1
844 1 60 ALA H 1 60 ALA MB 1.800 . 2.900 2.192 2.192 2.192 . 0 0 "[ ]" 1
845 1 57 LYS HA 1 60 ALA H 1.800 . 6.000 3.162 3.162 3.162 . 0 0 "[ ]" 1
846 1 59 ALA MB 1 60 ALA H 1.800 . 2.900 2.675 2.675 2.675 . 0 0 "[ ]" 1
847 1 59 ALA HA 1 60 ALA H 1.800 . 3.500 3.543 3.543 3.543 0.043 1 0 "[ ]" 1
848 1 60 ALA MB 1 61 TYR QD 1.800 . 6.000 4.222 4.222 4.222 . 0 0 "[ ]" 1
849 1 60 ALA MB 1 61 TYR H 1.800 . 2.900 2.549 2.549 2.549 . 0 0 "[ ]" 1
850 1 61 TYR H 1 61 TYR QD 1.800 . 3.500 2.917 2.917 2.917 . 0 0 "[ ]" 1
851 1 61 TYR H 1 61 TYR QE 1.800 . 6.000 4.938 4.938 4.938 . 0 0 "[ ]" 1
852 1 61 TYR H 1 61 TYR HB3 1.800 . 3.500 2.445 2.445 2.445 . 0 0 "[ ]" 1
853 1 61 TYR H 1 61 TYR HB2 1.800 . 3.500 3.671 3.671 3.671 0.171 1 0 "[ ]" 1
854 1 61 TYR HA 1 61 TYR QD 1.800 . 6.000 3.363 3.363 3.363 . 0 0 "[ ]" 1
855 1 61 TYR HB3 1 61 TYR QD 1.800 . 3.500 2.363 2.363 2.363 . 0 0 "[ ]" 1
856 1 61 TYR HB2 1 61 TYR QD 1.800 . 3.500 2.468 2.468 2.468 . 0 0 "[ ]" 1
857 1 57 LYS HA 1 61 TYR H 1.800 . 6.000 3.949 3.949 3.949 . 0 0 "[ ]" 1
858 1 60 ALA H 1 61 TYR H 1.800 . 2.900 2.541 2.541 2.541 . 0 0 "[ ]" 1
859 1 60 ALA HA 1 61 TYR H 1.800 . 3.500 3.545 3.545 3.545 0.045 1 0 "[ ]" 1
860 1 61 TYR HA 1 64 GLU QB 1.800 . 6.000 3.576 3.576 3.576 . 0 0 "[ ]" 1
861 1 58 LEU QB 1 61 TYR QD 1.800 . 6.000 4.159 4.159 4.159 . 0 0 "[ ]" 1
862 1 60 ALA MB 1 61 TYR QE 1.800 . 7.000 6.078 6.078 6.078 . 0 0 "[ ]" 1
863 1 12 TRP HE1 1 61 TYR HB3 1.800 . 6.000 3.899 3.899 3.899 . 0 0 "[ ]" 1
864 1 12 TRP HE1 1 61 TYR HB2 1.800 . 6.000 2.146 2.146 2.146 . 0 0 "[ ]" 1
865 1 61 TYR HB3 1 65 VAL MG2 1.800 . 6.000 5.098 5.098 5.098 . 0 0 "[ ]" 1
866 1 61 TYR HB2 1 65 VAL MG2 1.800 . 6.000 3.847 3.847 3.847 . 0 0 "[ ]" 1
867 1 58 LEU HA 1 61 TYR QD 1.800 . 6.000 2.369 2.369 2.369 . 0 0 "[ ]" 1
868 1 58 LEU HG 1 61 TYR QD 1.800 . 7.000 4.997 4.997 4.997 . 0 0 "[ ]" 1
869 1 62 GLY H 1 62 GLY HA3 1.800 . 2.900 2.951 2.951 2.951 0.051 1 0 "[ ]" 1
870 1 62 GLY H 1 62 GLY HA2 1.800 . 2.900 2.684 2.684 2.684 . 0 0 "[ ]" 1
871 1 60 ALA HA 1 62 GLY H 1.800 . 6.000 5.853 5.853 5.853 . 0 0 "[ ]" 1
872 1 60 ALA H 1 62 GLY H 1.800 . 6.300 6.382 6.382 6.382 0.082 1 0 "[ ]" 1
873 1 61 TYR HA 1 62 GLY H 1.800 . 3.500 2.183 2.183 2.183 . 0 0 "[ ]" 1
874 1 61 TYR HB3 1 62 GLY H 1.800 . 6.000 4.551 4.551 4.551 . 0 0 "[ ]" 1
875 1 61 TYR HB2 1 62 GLY H 1.800 . 6.000 3.738 3.738 3.738 . 0 0 "[ ]" 1
876 1 62 GLY H 1 64 GLU H 1.800 . 6.000 2.864 2.864 2.864 . 0 0 "[ ]" 1
877 1 62 GLY H 1 65 VAL H 1.800 . 6.000 2.664 2.664 2.664 . 0 0 "[ ]" 1
878 1 62 GLY HA3 1 65 VAL HB 1.800 . 6.000 4.412 4.412 4.412 . 0 0 "[ ]" 1
879 1 62 GLY HA2 1 65 VAL HB 1.800 . 6.000 2.891 2.891 2.891 . 0 0 "[ ]" 1
880 1 50 VAL QG 1 62 GLY HA3 1.800 . 6.000 5.851 5.851 5.851 . 0 0 "[ ]" 1
881 1 50 VAL QG 1 62 GLY HA2 1.800 . 6.000 5.840 5.840 5.840 . 0 0 "[ ]" 1
882 1 47 LEU QD 1 62 GLY QA 1.800 . 7.000 7.095 7.095 7.095 0.095 1 0 "[ ]" 1
883 1 63 ASP H 1 63 ASP HA 1.800 . 2.900 2.831 2.831 2.831 . 0 0 "[ ]" 1
884 1 63 ASP H 1 63 ASP QB 1.800 . 2.900 2.260 2.260 2.260 . 0 0 "[ ]" 1
885 1 59 ALA HA 1 63 ASP H 1.800 . 6.000 4.489 4.489 4.489 . 0 0 "[ ]" 1
886 1 63 ASP H 1 64 GLU QB 1.800 . 6.000 4.755 4.755 4.755 . 0 0 "[ ]" 1
887 1 63 ASP H 1 64 GLU H 1.800 . 2.900 2.749 2.749 2.749 . 0 0 "[ ]" 1
888 1 60 ALA HA 1 63 ASP H 1.800 . 6.000 5.997 5.997 5.997 . 0 0 "[ ]" 1
889 1 62 GLY HA2 1 63 ASP H 1.800 . 3.500 3.569 3.569 3.569 0.069 1 0 "[ ]" 1
890 1 62 GLY HA3 1 63 ASP H 1.800 . 3.500 2.451 2.451 2.451 . 0 0 "[ ]" 1
891 1 63 ASP H 1 65 VAL H 1.800 . 6.000 4.107 4.107 4.107 . 0 0 "[ ]" 1
892 1 62 GLY H 1 63 ASP H 1.800 . 3.500 3.208 3.208 3.208 . 0 0 "[ ]" 1
893 1 63 ASP QB 1 64 GLU H 1.800 . 2.900 2.532 2.532 2.532 . 0 0 "[ ]" 1
894 1 64 GLU H 1 64 GLU QB 1.800 . 2.900 2.433 2.433 2.433 . 0 0 "[ ]" 1
895 1 64 GLU H 1 64 GLU HA 1.800 . 2.900 2.865 2.865 2.865 . 0 0 "[ ]" 1
896 1 64 GLU HA 1 64 GLU HG3 1.800 . 3.500 3.033 3.033 3.033 . 0 0 "[ ]" 1
897 1 64 GLU HA 1 64 GLU HG2 1.800 . 3.500 2.438 2.438 2.438 . 0 0 "[ ]" 1
898 1 64 GLU H 1 64 GLU HG2 1.800 . 3.500 3.391 3.391 3.391 . 0 0 "[ ]" 1
899 1 64 GLU H 1 64 GLU HG3 1.800 . 3.500 2.192 2.192 2.192 . 0 0 "[ ]" 1
900 1 60 ALA HA 1 64 GLU H 1.800 . 6.000 5.951 5.951 5.951 . 0 0 "[ ]" 1
901 1 61 TYR HA 1 64 GLU H 1.800 . 6.000 4.201 4.201 4.201 . 0 0 "[ ]" 1
902 1 63 ASP HA 1 64 GLU H 1.800 . 3.500 3.544 3.544 3.544 0.044 1 0 "[ ]" 1
903 1 64 GLU H 1 66 LEU H 1.800 . 6.000 4.197 4.197 4.197 . 0 0 "[ ]" 1
904 1 64 GLU H 1 65 VAL H 1.800 . 2.900 2.622 2.622 2.622 . 0 0 "[ ]" 1
905 1 64 GLU HA 1 65 VAL H 1.800 . 3.500 3.532 3.532 3.532 0.032 1 0 "[ ]" 1
906 1 64 GLU HA 1 67 GLN QB 1.800 . 6.000 2.938 2.938 2.938 . 0 0 "[ ]" 1
907 1 64 GLU H 1 65 VAL MG2 1.800 . 5.000 4.208 4.208 4.208 . 0 0 "[ ]" 1
908 1 64 GLU H 1 67 GLN H 1.800 . 5.000 5.054 5.054 5.054 0.054 1 0 "[ ]" 1
909 1 65 VAL H 1 65 VAL HA 1.800 . 2.900 2.845 2.845 2.845 . 0 0 "[ ]" 1
910 1 65 VAL H 1 65 VAL HB 1.800 . 2.900 2.445 2.445 2.445 . 0 0 "[ ]" 1
911 1 65 VAL H 1 65 VAL MG2 1.800 . 3.500 2.383 2.383 2.383 . 0 0 "[ ]" 1
912 1 65 VAL H 1 65 VAL MG1 1.800 . 3.500 3.739 3.739 3.739 0.239 1 0 "[ ]" 1
913 1 65 VAL HA 1 65 VAL MG1 1.800 . 2.900 2.337 2.337 2.337 . 0 0 "[ ]" 1
914 1 65 VAL HA 1 65 VAL MG2 1.800 . 2.900 2.216 2.216 2.216 . 0 0 "[ ]" 1
915 1 65 VAL MG1 1 65 VAL MG2 1.800 . 2.900 1.859 1.859 1.859 . 0 0 "[ ]" 1
916 1 62 GLY HA3 1 65 VAL H 1.800 . 6.000 4.451 4.451 4.451 . 0 0 "[ ]" 1
917 1 62 GLY HA2 1 65 VAL H 1.800 . 6.000 3.588 3.588 3.588 . 0 0 "[ ]" 1
918 1 65 VAL H 1 66 LEU H 1.800 . 2.900 2.670 2.670 2.670 . 0 0 "[ ]" 1
919 1 64 GLU QB 1 65 VAL H 1.800 . 3.500 2.691 2.691 2.691 . 0 0 "[ ]" 1
920 1 65 VAL H 1 67 GLN H 1.800 . 6.000 4.223 4.223 4.223 . 0 0 "[ ]" 1
921 1 65 VAL HA 1 67 GLN H 1.800 . 6.000 4.311 4.311 4.311 . 0 0 "[ ]" 1
922 1 65 VAL HA 1 68 VAL HB 1.800 . 3.500 2.285 2.285 2.285 . 0 0 "[ ]" 1
923 1 65 VAL HA 1 69 VAL H 1.800 . 6.000 3.994 3.994 3.994 . 0 0 "[ ]" 1
924 1 64 GLU QB 1 65 VAL HA 1.800 . 6.000 3.932 3.932 3.932 . 0 0 "[ ]" 1
925 1 65 VAL HA 1 68 VAL H 1.800 . 6.000 3.109 3.109 3.109 . 0 0 "[ ]" 1
926 1 65 VAL HB 1 66 LEU H 1.800 . 3.500 2.651 2.651 2.651 . 0 0 "[ ]" 1
927 1 64 GLU QB 1 65 VAL MG2 1.800 . 6.000 3.400 3.400 3.400 . 0 0 "[ ]" 1
928 1 64 GLU QB 1 65 VAL MG1 1.800 . 6.000 5.174 5.174 5.174 . 0 0 "[ ]" 1
929 1 65 VAL HB 1 69 VAL MG2 1.800 . 6.000 4.237 4.237 4.237 . 0 0 "[ ]" 1
930 1 65 VAL MG1 1 68 VAL QG 1.800 . 6.000 3.257 3.257 3.257 . 0 0 "[ ]" 1
931 1 65 VAL MG2 1 68 VAL QG 1.800 . 6.000 3.602 3.602 3.602 . 0 0 "[ ]" 1
932 1 61 TYR QD 1 65 VAL MG2 1.800 . 6.000 2.438 2.438 2.438 . 0 0 "[ ]" 1
933 1 9 LEU QB 1 65 VAL MG1 1.800 . 5.000 3.992 3.992 3.992 . 0 0 "[ ]" 1
934 1 12 TRP HD1 1 65 VAL MG1 1.800 . 5.000 3.712 3.712 3.712 . 0 0 "[ ]" 1
935 1 65 VAL MG1 1 69 VAL H 1.800 . 3.500 3.453 3.453 3.453 . 0 0 "[ ]" 1
936 1 65 VAL MG1 1 70 ARG H 1.800 . 6.000 5.655 5.655 5.655 . 0 0 "[ ]" 1
937 1 9 LEU QB 1 65 VAL MG2 1.800 . 5.000 4.892 4.892 4.892 . 0 0 "[ ]" 1
938 1 12 TRP QB 1 65 VAL MG2 1.800 . 3.500 3.214 3.214 3.214 . 0 0 "[ ]" 1
939 1 61 TYR QE 1 65 VAL MG2 1.800 . 5.000 3.479 3.479 3.479 . 0 0 "[ ]" 1
940 1 61 TYR QB 1 65 VAL MG2 1.800 . 5.000 3.740 3.740 3.740 . 0 0 "[ ]" 1
941 1 66 LEU H 1 66 LEU HA 1.800 . 2.900 2.833 2.833 2.833 . 0 0 "[ ]" 1
942 1 66 LEU H 1 66 LEU HB3 1.800 . 3.500 3.590 3.590 3.590 0.090 1 0 "[ ]" 1
943 1 66 LEU H 1 66 LEU HB2 1.800 . 3.500 2.834 2.834 2.834 . 0 0 "[ ]" 1
944 1 66 LEU H 1 66 LEU MD1 1.800 . 5.000 3.483 3.483 3.483 . 0 0 "[ ]" 1
945 1 66 LEU H 1 66 LEU MD2 1.800 . 5.000 2.511 2.511 2.511 . 0 0 "[ ]" 1
946 1 66 LEU H 1 66 LEU HG 1.800 . 3.500 1.721 1.721 1.721 0.079 1 0 "[ ]" 1
947 1 66 LEU HA 1 66 LEU MD1 1.800 . 6.000 3.852 3.852 3.852 . 0 0 "[ ]" 1
948 1 66 LEU HA 1 66 LEU MD2 1.800 . 6.000 2.161 2.161 2.161 . 0 0 "[ ]" 1
949 1 66 LEU HA 1 66 LEU HG 1.800 . 3.500 3.328 3.328 3.328 . 0 0 "[ ]" 1
950 1 66 LEU HB3 1 66 LEU MD1 1.800 . 3.500 2.305 2.305 2.305 . 0 0 "[ ]" 1
951 1 66 LEU HB3 1 66 LEU MD2 1.800 . 3.500 2.339 2.339 2.339 . 0 0 "[ ]" 1
952 1 66 LEU HB2 1 66 LEU MD2 1.800 . 3.500 3.191 3.191 3.191 . 0 0 "[ ]" 1
953 1 66 LEU HB2 1 66 LEU MD1 1.800 . 3.500 2.411 2.411 2.411 . 0 0 "[ ]" 1
954 1 62 GLY HA3 1 66 LEU H 1.800 . 6.000 5.460 5.460 5.460 . 0 0 "[ ]" 1
955 1 62 GLY HA2 1 66 LEU H 1.800 . 6.000 4.606 4.606 4.606 . 0 0 "[ ]" 1
956 1 63 ASP HA 1 66 LEU H 1.800 . 5.000 3.489 3.489 3.489 . 0 0 "[ ]" 1
957 1 64 GLU HA 1 66 LEU H 1.800 . 6.000 4.208 4.208 4.208 . 0 0 "[ ]" 1
958 1 64 GLU QB 1 66 LEU H 1.800 . 6.000 4.717 4.717 4.717 . 0 0 "[ ]" 1
959 1 65 VAL HA 1 66 LEU H 1.800 . 6.000 3.542 3.542 3.542 . 0 0 "[ ]" 1
960 1 66 LEU H 1 68 VAL MG1 1.800 . 6.000 6.078 6.078 6.078 0.078 1 0 "[ ]" 1
961 1 66 LEU H 1 67 GLN H 1.800 . 2.900 2.711 2.711 2.711 . 0 0 "[ ]" 1
962 1 43 SER H 1 66 LEU QD 1.800 . 6.000 3.952 3.952 3.952 . 0 0 "[ ]" 1
963 1 63 ASP HA 1 66 LEU MD1 1.800 . 5.000 2.162 2.162 2.162 . 0 0 "[ ]" 1
964 1 63 ASP HA 1 66 LEU MD2 1.800 . 5.000 3.584 3.584 3.584 . 0 0 "[ ]" 1
965 1 64 GLU HA 1 66 LEU MD1 1.800 . 6.000 5.400 5.400 5.400 . 0 0 "[ ]" 1
966 1 64 GLU HA 1 66 LEU MD2 1.800 . 6.000 6.023 6.023 6.023 0.023 1 0 "[ ]" 1
967 1 64 GLU QB 1 66 LEU QD 1.800 . 6.000 5.487 5.487 5.487 . 0 0 "[ ]" 1
968 1 65 VAL H 1 66 LEU QD 1.800 . 6.000 4.139 4.139 4.139 . 0 0 "[ ]" 1
969 1 64 GLU QB 1 66 LEU HG 1.800 . 6.000 5.626 5.626 5.626 . 0 0 "[ ]" 1
970 1 66 LEU HA 1 67 GLN H 1.800 . 3.500 3.545 3.545 3.545 0.045 1 0 "[ ]" 1
971 1 66 LEU HA 1 69 VAL HB 1.800 . 6.000 2.676 2.676 2.676 . 0 0 "[ ]" 1
972 1 66 LEU HA 1 69 VAL H 1.800 . 6.000 3.355 3.355 3.355 . 0 0 "[ ]" 1
973 1 66 LEU HA 1 70 ARG H 1.800 . 6.000 4.152 4.152 4.152 . 0 0 "[ ]" 1
974 1 63 ASP HA 1 66 LEU HB3 1.800 . 6.000 4.737 4.737 4.737 . 0 0 "[ ]" 1
975 1 63 ASP HA 1 66 LEU HB2 1.800 . 6.000 3.762 3.762 3.762 . 0 0 "[ ]" 1
976 1 66 LEU HA 1 69 VAL MG1 1.800 . 6.000 4.042 4.042 4.042 . 0 0 "[ ]" 1
977 1 66 LEU HA 1 69 VAL MG2 1.800 . 6.000 2.728 2.728 2.728 . 0 0 "[ ]" 1
978 1 67 GLN H 1 67 GLN HA 1.800 . 2.900 2.864 2.864 2.864 . 0 0 "[ ]" 1
979 1 67 GLN H 1 67 GLN QB 1.800 . 2.900 2.276 2.276 2.276 . 0 0 "[ ]" 1
980 1 67 GLN H 1 67 GLN QG 1.800 . 6.000 3.982 3.982 3.982 . 0 0 "[ ]" 1
981 1 67 GLN HA 1 67 GLN QG 1.800 . 3.500 2.326 2.326 2.326 . 0 0 "[ ]" 1
982 1 63 ASP HA 1 67 GLN H 1.800 . 6.000 4.841 4.841 4.841 . 0 0 "[ ]" 1
983 1 66 LEU MD1 1 67 GLN H 1.800 . 6.000 4.258 4.258 4.258 . 0 0 "[ ]" 1
984 1 66 LEU MD2 1 67 GLN H 1.800 . 6.000 4.312 4.312 4.312 . 0 0 "[ ]" 1
985 1 67 GLN H 1 68 VAL H 1.800 . 2.900 2.654 2.654 2.654 . 0 0 "[ ]" 1
986 1 66 LEU HB3 1 67 GLN H 1.800 . 6.000 3.768 3.768 3.768 . 0 0 "[ ]" 1
987 1 66 LEU HB2 1 67 GLN H 1.800 . 6.000 2.427 2.427 2.427 . 0 0 "[ ]" 1
988 1 64 GLU HA 1 67 GLN H 1.800 . 3.500 3.342 3.342 3.342 . 0 0 "[ ]" 1
989 1 66 LEU HG 1 67 GLN H 1.800 . 3.500 3.619 3.619 3.619 0.119 1 0 "[ ]" 1
990 1 67 GLN H 1 68 VAL MG1 1.800 . 6.000 5.807 5.807 5.807 . 0 0 "[ ]" 1
991 1 67 GLN H 1 69 VAL H 1.800 . 6.000 4.141 4.141 4.141 . 0 0 "[ ]" 1
992 1 67 GLN HA 1 68 VAL QG 1.800 . 6.000 4.854 4.854 4.854 . 0 0 "[ ]" 1
993 1 67 GLN HA 1 68 VAL H 1.800 . 3.500 3.538 3.538 3.538 0.038 1 0 "[ ]" 1
994 1 67 GLN HA 1 70 ARG H 1.800 . 6.000 3.545 3.545 3.545 . 0 0 "[ ]" 1
995 1 67 GLN HA 1 69 VAL H 1.800 . 6.000 4.444 4.444 4.444 . 0 0 "[ ]" 1
996 1 67 GLN HA 1 71 ASP H 1.800 . 6.000 4.364 4.364 4.364 . 0 0 "[ ]" 1
997 1 68 VAL H 1 68 VAL HA 1.800 . 2.900 2.862 2.862 2.862 . 0 0 "[ ]" 1
998 1 68 VAL H 1 68 VAL HB 1.800 . 3.500 2.322 2.322 2.322 . 0 0 "[ ]" 1
999 1 68 VAL H 1 68 VAL MG1 1.800 . 3.500 3.704 3.704 3.704 0.204 1 0 "[ ]" 1
1000 1 68 VAL H 1 68 VAL MG2 1.800 . 3.500 2.365 2.365 2.365 . 0 0 "[ ]" 1
1001 1 68 VAL HA 1 68 VAL MG1 1.800 . 2.900 2.413 2.413 2.413 . 0 0 "[ ]" 1
1002 1 68 VAL HA 1 68 VAL MG2 1.800 . 2.900 2.229 2.229 2.229 . 0 0 "[ ]" 1
1003 1 64 GLU HA 1 68 VAL H 1.800 . 6.000 4.450 4.450 4.450 . 0 0 "[ ]" 1
1004 1 65 VAL MG1 1 68 VAL H 1.800 . 6.000 4.148 4.148 4.148 . 0 0 "[ ]" 1
1005 1 68 VAL H 1 69 VAL H 1.800 . 2.900 2.647 2.647 2.647 . 0 0 "[ ]" 1
1006 1 66 LEU HA 1 68 VAL H 1.800 . 6.000 4.344 4.344 4.344 . 0 0 "[ ]" 1
1007 1 67 GLN QG 1 68 VAL H 1.800 . 6.000 3.755 3.755 3.755 . 0 0 "[ ]" 1
1008 1 68 VAL HA 1 71 ASP QB 1.800 . 3.500 2.743 2.743 2.743 . 0 0 "[ ]" 1
1009 1 67 GLN QB 1 68 VAL H 1.800 . 3.500 2.552 2.552 2.552 . 0 0 "[ ]" 1
1010 1 68 VAL H 1 70 ARG H 1.800 . 6.000 4.203 4.203 4.203 . 0 0 "[ ]" 1
1011 1 9 LEU HA 1 68 VAL QG 1.800 . 3.500 3.391 3.391 3.391 . 0 0 "[ ]" 1
1012 1 67 GLN QB 1 68 VAL QG 1.800 . 3.500 3.205 3.205 3.205 . 0 0 "[ ]" 1
1013 1 11 ALA MB 1 68 VAL QG 1.800 . 3.500 3.531 3.531 3.531 0.031 1 0 "[ ]" 1
1014 1 65 VAL HA 1 68 VAL QG 1.800 . 3.500 2.743 2.743 2.743 . 0 0 "[ ]" 1
1015 1 69 VAL H 1 69 VAL HA 1.800 . 2.900 2.847 2.847 2.847 . 0 0 "[ ]" 1
1016 1 69 VAL H 1 69 VAL HB 1.800 . 3.500 2.417 2.417 2.417 . 0 0 "[ ]" 1
1017 1 69 VAL H 1 69 VAL MG1 1.800 . 3.500 3.734 3.734 3.734 0.234 1 0 "[ ]" 1
1018 1 69 VAL H 1 69 VAL MG2 1.800 . 3.500 2.395 2.395 2.395 . 0 0 "[ ]" 1
1019 1 69 VAL HA 1 69 VAL MG1 1.800 . 2.900 2.348 2.348 2.348 . 0 0 "[ ]" 1
1020 1 69 VAL HA 1 69 VAL MG2 1.800 . 2.900 2.215 2.215 2.215 . 0 0 "[ ]" 1
1021 1 69 VAL H 1 71 ASP H 1.800 . 6.000 4.083 4.083 4.083 . 0 0 "[ ]" 1
1022 1 68 VAL HA 1 69 VAL H 1.800 . 3.500 3.554 3.554 3.554 0.054 1 0 "[ ]" 1
1023 1 68 VAL HB 1 69 VAL H 1.800 . 6.000 2.644 2.644 2.644 . 0 0 "[ ]" 1
1024 1 5 LEU QD 1 69 VAL HA 1.800 . 6.000 3.630 3.630 3.630 . 0 0 "[ ]" 1
1025 1 66 LEU HG 1 69 VAL QG 1.800 . 5.000 5.022 5.022 5.022 0.022 1 0 "[ ]" 1
1026 1 40 ARG QB 1 69 VAL QG 1.800 . 5.000 3.912 3.912 3.912 . 0 0 "[ ]" 1
1027 1 66 LEU QB 1 69 VAL QG 1.800 . 5.000 4.175 4.175 4.175 . 0 0 "[ ]" 1
1028 1 40 ARG QD 1 69 VAL QG 1.800 . 5.000 5.024 5.024 5.024 0.024 1 0 "[ ]" 1
1029 1 66 LEU H 1 69 VAL QG 1.800 . 5.000 4.226 4.226 4.226 . 0 0 "[ ]" 1
1030 1 70 ARG H 1 70 ARG QD 1.800 . 6.000 4.182 4.182 4.182 . 0 0 "[ ]" 1
1031 1 70 ARG H 1 70 ARG HA 1.800 . 2.900 2.855 2.855 2.855 . 0 0 "[ ]" 1
1032 1 70 ARG H 1 70 ARG QB 1.800 . 2.900 2.449 2.449 2.449 . 0 0 "[ ]" 1
1033 1 69 VAL HB 1 70 ARG H 1.800 . 3.500 2.574 2.574 2.574 . 0 0 "[ ]" 1
1034 1 69 VAL H 1 70 ARG H 1.800 . 3.500 2.715 2.715 2.715 . 0 0 "[ ]" 1
1035 1 68 VAL HA 1 70 ARG H 1.800 . 6.000 4.480 4.480 4.480 . 0 0 "[ ]" 1
1036 1 69 VAL HA 1 70 ARG H 1.800 . 3.500 3.561 3.561 3.561 0.061 1 0 "[ ]" 1
1037 1 69 VAL MG1 1 70 ARG H 1.800 . 6.000 3.330 3.330 3.330 . 0 0 "[ ]" 1
1038 1 69 VAL MG2 1 70 ARG H 1.800 . 6.000 3.914 3.914 3.914 . 0 0 "[ ]" 1
1039 1 70 ARG H 1 71 ASP H 1.800 . 3.500 2.660 2.660 2.660 . 0 0 "[ ]" 1
1040 1 71 ASP H 1 71 ASP QB 1.800 . 2.900 2.264 2.264 2.264 . 0 0 "[ ]" 1
1041 1 71 ASP H 1 71 ASP HA 1.800 . 2.900 2.849 2.849 2.849 . 0 0 "[ ]" 1
1042 1 69 VAL HA 1 71 ASP H 1.800 . 6.000 4.275 4.275 4.275 . 0 0 "[ ]" 1
1043 1 70 ARG QB 1 71 ASP H 1.800 . 2.900 2.616 2.616 2.616 . 0 0 "[ ]" 1
1044 1 71 ASP QB 1 72 SER H 1.800 . 2.900 2.605 2.605 2.605 . 0 0 "[ ]" 1
1045 1 68 VAL HA 1 71 ASP H 1.800 . 3.500 3.437 3.437 3.437 . 0 0 "[ ]" 1
1046 1 70 ARG HA 1 71 ASP H 1.800 . 3.500 3.536 3.536 3.536 0.036 1 0 "[ ]" 1
1047 1 71 ASP H 1 72 SER H 1.800 . 3.500 2.694 2.694 2.694 . 0 0 "[ ]" 1
1048 1 72 SER H 1 72 SER HA 1.800 . 2.900 2.861 2.861 2.861 . 0 0 "[ ]" 1
1049 1 72 SER H 1 72 SER QB 1.800 . 2.900 2.438 2.438 2.438 . 0 0 "[ ]" 1
1050 1 72 SER H 1 73 SER H 1.800 . 3.500 2.637 2.637 2.637 . 0 0 "[ ]" 1
1051 1 69 VAL HA 1 72 SER H 1.800 . 5.000 3.350 3.350 3.350 . 0 0 "[ ]" 1
1052 1 69 VAL MG2 1 72 SER H 1.800 . 5.000 5.066 5.066 5.066 0.066 1 0 "[ ]" 1
1053 1 70 ARG HA 1 72 SER H 1.800 . 5.000 4.204 4.204 4.204 . 0 0 "[ ]" 1
1054 1 70 ARG QB 1 72 SER H 1.800 . 5.000 4.675 4.675 4.675 . 0 0 "[ ]" 1
1055 1 73 SER H 1 73 SER QB 1.800 . 2.900 2.419 2.419 2.419 . 0 0 "[ ]" 1
1056 1 73 SER H 1 74 GLY HA3 1.800 . 6.000 5.293 5.293 5.293 . 0 0 "[ ]" 1
1057 1 73 SER H 1 74 GLY HA2 1.800 . 6.000 4.988 4.988 4.988 . 0 0 "[ ]" 1
1058 1 72 SER HA 1 73 SER H 1.800 . 3.500 3.506 3.506 3.506 0.006 1 0 "[ ]" 1
1059 1 73 SER H 1 74 GLY H 1.800 . 3.500 2.618 2.618 2.618 . 0 0 "[ ]" 1
1060 1 74 GLY H 1 75 GLY H 1.800 . 3.500 2.282 2.282 2.282 . 0 0 "[ ]" 1
1061 1 74 GLY HA3 1 75 GLY H 1.800 . 6.000 3.347 3.347 3.347 . 0 0 "[ ]" 1
1062 1 74 GLY HA2 1 75 GLY H 1.800 . 6.000 3.229 3.229 3.229 . 0 0 "[ ]" 1
1063 1 72 SER HA 1 75 GLY H 1.800 . 6.000 6.017 6.017 6.017 0.017 1 0 "[ ]" 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 52
_Distance_constraint_stats_list.Viol_count 9
_Distance_constraint_stats_list.Viol_total 0.364
_Distance_constraint_stats_list.Viol_max 0.081
_Distance_constraint_stats_list.Viol_rms 0.0184
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0070
_Distance_constraint_stats_list.Viol_average_violations_only 0.0405
_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 5 LEU 0.023 0.023 1 0 "[ ]"
1 6 PHE 0.000 0.000 . 0 "[ ]"
1 7 GLU 0.000 0.000 . 0 "[ ]"
1 8 ALA 0.089 0.081 1 0 "[ ]"
1 9 LEU 0.023 0.023 1 0 "[ ]"
1 10 ARG 0.000 0.000 . 0 "[ ]"
1 11 ALA 0.019 0.019 1 0 "[ ]"
1 12 TRP 0.089 0.081 1 0 "[ ]"
1 13 ARG 0.000 0.000 . 0 "[ ]"
1 14 LEU 0.000 0.000 . 0 "[ ]"
1 15 GLN 0.037 0.019 1 0 "[ ]"
1 16 LYS 0.000 0.000 . 0 "[ ]"
1 17 ALA 0.000 0.000 . 0 "[ ]"
1 18 LYS 0.000 0.000 . 0 "[ ]"
1 19 GLU 0.017 0.017 1 0 "[ ]"
1 20 LEU 0.000 0.000 . 0 "[ ]"
1 23 PRO 0.049 0.049 1 0 "[ ]"
1 24 PRO 0.000 0.000 . 0 "[ ]"
1 26 THR 0.049 0.049 1 0 "[ ]"
1 27 ILE 0.000 0.000 . 0 "[ ]"
1 30 ASP 0.048 0.048 1 0 "[ ]"
1 31 ALA 0.000 0.000 . 0 "[ ]"
1 32 THR 0.000 0.000 . 0 "[ ]"
1 33 LEU 0.000 0.000 . 0 "[ ]"
1 34 LYS 0.048 0.048 1 0 "[ ]"
1 35 THR 0.000 0.000 . 0 "[ ]"
1 36 ILE 0.000 0.000 . 0 "[ ]"
1 37 ALA 0.000 0.000 . 0 "[ ]"
1 38 GLU 0.000 0.000 . 0 "[ ]"
1 43 SER 0.000 0.000 . 0 "[ ]"
1 47 LEU 0.000 0.000 . 0 "[ ]"
1 56 ARG 0.055 0.055 1 0 "[ ]"
1 60 ALA 0.055 0.055 1 0 "[ ]"
1 63 ASP 0.065 0.065 1 0 "[ ]"
1 64 GLU 0.000 0.000 . 0 "[ ]"
1 65 VAL 0.000 0.000 . 0 "[ ]"
1 66 LEU 0.000 0.000 . 0 "[ ]"
1 67 GLN 0.065 0.065 1 0 "[ ]"
1 68 VAL 0.000 0.000 . 0 "[ ]"
1 69 VAL 0.000 0.000 . 0 "[ ]"
1 70 ARG 0.000 0.000 . 0 "[ ]"
1 71 ASP 0.000 0.000 . 0 "[ ]"
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 5 LEU O 1 9 LEU H 2.000 . 2.500 2.523 2.523 2.523 0.023 1 0 "[ ]" 2
2 1 5 LEU O 1 9 LEU N 3.000 2.200 3.500 3.470 3.470 3.470 . 0 0 "[ ]" 2
3 1 6 PHE O 1 10 ARG H 2.000 . 2.500 1.613 1.613 1.613 . 0 0 "[ ]" 2
4 1 6 PHE O 1 10 ARG N 3.000 2.200 3.500 2.547 2.547 2.547 . 0 0 "[ ]" 2
5 1 7 GLU O 1 11 ALA H 2.000 . 2.500 2.443 2.443 2.443 . 0 0 "[ ]" 2
6 1 7 GLU O 1 11 ALA N 3.000 2.200 3.500 3.265 3.265 3.265 . 0 0 "[ ]" 2
7 1 8 ALA O 1 12 TRP H 2.000 . 2.500 2.581 2.581 2.581 0.081 1 0 "[ ]" 2
8 1 8 ALA O 1 12 TRP N 3.000 2.200 3.500 3.507 3.507 3.507 0.007 1 0 "[ ]" 2
9 1 9 LEU O 1 13 ARG H 2.000 . 2.500 1.859 1.859 1.859 . 0 0 "[ ]" 2
10 1 9 LEU O 1 13 ARG N 3.000 2.200 3.500 2.789 2.789 2.789 . 0 0 "[ ]" 2
11 1 10 ARG O 1 14 LEU H 2.000 . 2.500 2.183 2.183 2.183 . 0 0 "[ ]" 2
12 1 10 ARG O 1 14 LEU N 3.000 2.200 3.500 3.085 3.085 3.085 . 0 0 "[ ]" 2
13 1 11 ALA O 1 15 GLN H 2.000 . 2.500 2.519 2.519 2.519 0.019 1 0 "[ ]" 2
14 1 11 ALA O 1 15 GLN N 3.000 2.200 3.500 3.463 3.463 3.463 . 0 0 "[ ]" 2
15 1 12 TRP O 1 16 LYS H 2.000 . 2.500 1.769 1.769 1.769 . 0 0 "[ ]" 2
16 1 12 TRP O 1 16 LYS N 3.000 2.200 3.500 2.718 2.718 2.718 . 0 0 "[ ]" 2
17 1 13 ARG O 1 17 ALA H 2.000 . 2.500 1.940 1.940 1.940 . 0 0 "[ ]" 2
18 1 13 ARG O 1 17 ALA N 3.000 2.200 3.500 2.837 2.837 2.837 . 0 0 "[ ]" 2
19 1 14 LEU O 1 18 LYS H 2.000 . 2.500 2.413 2.413 2.413 . 0 0 "[ ]" 2
20 1 14 LEU O 1 18 LYS N 3.000 2.200 3.500 3.304 3.304 3.304 . 0 0 "[ ]" 2
21 1 15 GLN O 1 19 GLU H 2.000 . 2.500 2.517 2.517 2.517 0.017 1 0 "[ ]" 2
22 1 15 GLN O 1 19 GLU N 3.000 2.200 3.500 3.441 3.441 3.441 . 0 0 "[ ]" 2
23 1 16 LYS O 1 20 LEU H 2.000 . 2.500 2.127 2.127 2.127 . 0 0 "[ ]" 2
24 1 16 LYS O 1 20 LEU N 3.000 2.200 3.500 3.079 3.079 3.079 . 0 0 "[ ]" 2
25 1 23 PRO O 1 26 THR H 2.000 . 2.500 2.549 2.549 2.549 0.049 1 0 "[ ]" 2
26 1 23 PRO O 1 26 THR N 3.000 2.200 3.500 3.229 3.229 3.229 . 0 0 "[ ]" 2
27 1 24 PRO O 1 27 ILE H 2.000 . 2.500 2.282 2.282 2.282 . 0 0 "[ ]" 2
28 1 24 PRO O 1 27 ILE N 3.000 2.200 3.500 3.027 3.027 3.027 . 0 0 "[ ]" 2
29 1 30 ASP O 1 34 LYS H 2.000 . 2.500 2.548 2.548 2.548 0.048 1 0 "[ ]" 2
30 1 30 ASP O 1 34 LYS N 3.000 2.200 3.500 3.454 3.454 3.454 . 0 0 "[ ]" 2
31 1 31 ALA O 1 35 THR H 2.000 . 2.500 2.357 2.357 2.357 . 0 0 "[ ]" 2
32 1 31 ALA O 1 35 THR N 3.000 2.200 3.500 3.272 3.272 3.272 . 0 0 "[ ]" 2
33 1 32 THR O 1 36 ILE H 2.000 . 2.500 2.225 2.225 2.225 . 0 0 "[ ]" 2
34 1 32 THR O 1 36 ILE N 3.000 2.200 3.500 3.114 3.114 3.114 . 0 0 "[ ]" 2
35 1 33 LEU O 1 37 ALA H 2.000 . 2.500 2.497 2.497 2.497 . 0 0 "[ ]" 2
36 1 33 LEU O 1 37 ALA N 3.000 2.200 3.500 3.417 3.417 3.417 . 0 0 "[ ]" 2
37 1 34 LYS O 1 38 GLU H 2.000 . 2.500 2.261 2.261 2.261 . 0 0 "[ ]" 2
38 1 34 LYS O 1 38 GLU N 3.000 2.200 3.500 3.210 3.210 3.210 . 0 0 "[ ]" 2
39 1 43 SER O 1 47 LEU H 2.000 . 2.500 2.201 2.201 2.201 . 0 0 "[ ]" 2
40 1 43 SER O 1 47 LEU N 3.000 2.200 3.500 3.003 3.003 3.003 . 0 0 "[ ]" 2
41 1 56 ARG O 1 60 ALA H 2.000 . 2.500 2.555 2.555 2.555 0.055 1 0 "[ ]" 2
42 1 56 ARG O 1 60 ALA N 3.000 2.200 3.500 3.466 3.466 3.466 . 0 0 "[ ]" 2
43 1 63 ASP O 1 67 GLN H 2.000 . 2.500 2.565 2.565 2.565 0.065 1 0 "[ ]" 2
44 1 63 ASP O 1 67 GLN N 3.000 2.200 3.500 3.496 3.496 3.496 . 0 0 "[ ]" 2
45 1 64 GLU O 1 68 VAL H 2.000 . 2.500 2.126 2.126 2.126 . 0 0 "[ ]" 2
46 1 64 GLU O 1 68 VAL N 3.000 2.200 3.500 3.033 3.033 3.033 . 0 0 "[ ]" 2
47 1 65 VAL O 1 69 VAL H 2.000 . 2.500 1.783 1.783 1.783 . 0 0 "[ ]" 2
48 1 65 VAL O 1 69 VAL N 3.000 2.200 3.500 2.716 2.716 2.716 . 0 0 "[ ]" 2
49 1 66 LEU O 1 70 ARG H 2.000 . 2.500 2.052 2.052 2.052 . 0 0 "[ ]" 2
50 1 66 LEU O 1 70 ARG N 3.000 2.200 3.500 3.004 3.004 3.004 . 0 0 "[ ]" 2
51 1 67 GLN O 1 71 ASP H 2.000 . 2.500 2.243 2.243 2.243 . 0 0 "[ ]" 2
52 1 67 GLN O 1 71 ASP N 3.000 2.200 3.500 3.145 3.145 3.145 . 0 0 "[ ]" 2
stop_
save_
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