NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
432614 |
2jst   |
15384 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2jst
save_distance_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 184
_TA_constraint_stats_list.Viol_count 967
_TA_constraint_stats_list.Viol_total 9265.05
_TA_constraint_stats_list.Viol_max 5.65
_TA_constraint_stats_list.Viol_rms 0.38
_TA_constraint_stats_list.Viol_average_all_restraints 0.13
_TA_constraint_stats_list.Viol_average_violations_only 0.48
_TA_constraint_stats_list.Cutoff_violation_report 5.00
_TA_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * ID of the restraint list.
* 3 * Number of restraints in list.
* 4 * Number of violated restraints (each model violation is used).
* 5 * Sum of violations in degrees.
* 6 * Maximum violation of a restraint without averaging in any way.
* 7 * Rms of violations over all restraints.
* 8 * Average violation over all restraints.
* 9 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
Threshold for reporting violations (degrees) in the last columns of the next table.
* 10 * This tag.
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
* 2 * Torsion angle name where available.
* 3 * First atom's:
* 4 * Chain identifier (can be absent if none defined)
* 5 * Residue number
* 6 * Residue name
* 7 * Name of (pseudo-)atom
* 8 * Second thru fourth atom's identifiers occupy columns 7 thru 18.
* 19 * Lower bound (degrees)
* 20 * Upper bound (degrees)
* 21 * Average angle in ensemble of models
* 22 * Minimum angle in ensemble of models (counter clockwise from range)
* 23 * Maximum angle in ensemble of models (clockwise from range)
* 24 * Maximum violation (without any averaging)
* 25 * Model number with the maximum violation
* 26 * Number of models with a violation above cutoff
* 27 * List of models with a violation above cutoff. See description above.
* 28 * Administrative tag
* 29 * Administrative tag
;
loop_
_TA_constraint_stats.Restraint_ID
_TA_constraint_stats.Torsion_angle_name
_TA_constraint_stats.Entity_assembly_ID_1
_TA_constraint_stats.Comp_index_ID_1
_TA_constraint_stats.Comp_ID_1
_TA_constraint_stats.Atom_ID_1
_TA_constraint_stats.Entity_assembly_ID_2
_TA_constraint_stats.Comp_index_ID_2
_TA_constraint_stats.Comp_ID_2
_TA_constraint_stats.Atom_ID_2
_TA_constraint_stats.Entity_assembly_ID_3
_TA_constraint_stats.Comp_index_ID_3
_TA_constraint_stats.Comp_ID_3
_TA_constraint_stats.Atom_ID_3
_TA_constraint_stats.Entity_assembly_ID_4
_TA_constraint_stats.Comp_index_ID_4
_TA_constraint_stats.Comp_ID_4
_TA_constraint_stats.Atom_ID_4
_TA_constraint_stats.Angle_lower_bound_val
_TA_constraint_stats.Angle_upper_bound_val
_TA_constraint_stats.Angle_average
_TA_constraint_stats.Angle_minimum
_TA_constraint_stats.Angle_maximum
_TA_constraint_stats.Max_violation
_TA_constraint_stats.Max_violation_model_number
_TA_constraint_stats.Over_cutoff_violation_count
_TA_constraint_stats.Over_cutoff_violation_per_model
1 PHI 1 4 LEU C 1 5 ARG N 1 5 ARG CA 1 5 ARG C -72.00 -52.00 -69.72 -70.60 -71.32 0.84 9 0 "[ . 1 . 2]"
2 PSI 1 5 ARG N 1 5 ARG CA 1 5 ARG C 1 6 GLU N -53.00 -21.00 -35.93 -43.81 -45.46 . . 0 "[ . 1 . 2]"
3 PHI 1 5 ARG C 1 6 GLU N 1 6 GLU CA 1 6 GLU C -78.00 -54.00 -54.11 -53.44 -53.63 1.47 14 0 "[ . 1 . 2]"
4 PSI 1 6 GLU N 1 6 GLU CA 1 6 GLU C 1 7 GLU N -55.00 -27.00 -28.47 -32.67 -26.02 0.98 11 0 "[ . 1 . 2]"
5 PHI 1 6 GLU C 1 7 GLU N 1 7 GLU CA 1 7 GLU C -74.00 -54.00 -54.99 -64.27 -53.04 0.96 14 0 "[ . 1 . 2]"
6 PSI 1 7 GLU N 1 7 GLU CA 1 7 GLU C 1 8 ALA N -58.00 -18.00 -39.14 -28.65 -29.93 . . 0 "[ . 1 . 2]"
7 PHI 1 7 GLU C 1 8 ALA N 1 8 ALA CA 1 8 ALA C -76.00 -52.00 -67.71 -76.24 -52.96 0.24 14 0 "[ . 1 . 2]"
8 PSI 1 8 ALA N 1 8 ALA CA 1 8 ALA C 1 9 ALA N -51.00 -27.00 -27.52 -29.21 -26.53 0.47 7 0 "[ . 1 . 2]"
9 PHI 1 8 ALA C 1 9 ALA N 1 9 ALA CA 1 9 ALA C -74.00 -54.00 -66.68 -61.94 -63.07 1.97 7 0 "[ . 1 . 2]"
10 PSI 1 9 ALA N 1 9 ALA CA 1 9 ALA C 1 10 LYS N -51.00 -27.00 -40.56 -50.49 -26.95 0.05 7 0 "[ . 1 . 2]"
11 PHI 1 9 ALA C 1 10 LYS N 1 10 LYS CA 1 10 LYS C -76.00 -56.00 -61.74 -58.56 -62.37 0.51 18 0 "[ . 1 . 2]"
12 PSI 1 10 LYS N 1 10 LYS CA 1 10 LYS C 1 11 LEU N -53.00 -25.00 -34.85 -31.98 -32.65 1.57 7 0 "[ . 1 . 2]"
13 PHI 1 10 LYS C 1 11 LEU N 1 11 LEU CA 1 11 LEU C -76.00 -52.00 -52.21 -51.80 -51.87 0.36 6 0 "[ . 1 . 2]"
14 PSI 1 11 LEU N 1 11 LEU CA 1 11 LEU C 1 12 PHE N -62.00 -22.00 -44.32 -49.15 -40.58 . . 0 "[ . 1 . 2]"
15 PHI 1 11 LEU C 1 12 PHE N 1 12 PHE CA 1 12 PHE C -74.00 -54.00 -73.62 -74.06 -74.09 0.32 17 0 "[ . 1 . 2]"
16 PSI 1 12 PHE N 1 12 PHE CA 1 12 PHE C 1 13 GLU N -58.00 -22.00 -25.09 -29.35 -20.19 1.81 7 0 "[ . 1 . 2]"
17 PHI 1 12 PHE C 1 13 GLU N 1 13 GLU CA 1 13 GLU C -78.00 -54.00 -57.91 -56.37 -57.75 0.42 16 0 "[ . 1 . 2]"
18 PSI 1 13 GLU N 1 13 GLU CA 1 13 GLU C 1 14 GLU N -54.00 -26.00 -36.56 -33.97 -35.01 . . 0 "[ . 1 . 2]"
19 PHI 1 13 GLU C 1 14 GLU N 1 14 GLU CA 1 14 GLU C -75.00 -55.00 -73.17 -69.22 -73.29 0.51 11 0 "[ . 1 . 2]"
20 PSI 1 14 GLU N 1 14 GLU CA 1 14 GLU C 1 15 TRP N -52.00 -28.00 -32.94 -33.19 -33.85 0.43 10 0 "[ . 1 . 2]"
21 PHI 1 14 GLU C 1 15 TRP N 1 15 TRP CA 1 15 TRP C -78.00 -54.00 -59.10 -67.97 -52.22 1.78 18 0 "[ . 1 . 2]"
22 PSI 1 15 TRP N 1 15 TRP CA 1 15 TRP C 1 16 LYS N -56.00 -24.00 -49.67 -44.45 -45.96 0.11 11 0 "[ . 1 . 2]"
23 PHI 1 15 TRP C 1 16 LYS N 1 16 LYS CA 1 16 LYS C -77.00 -53.00 -74.24 -77.53 -67.87 0.53 3 0 "[ . 1 . 2]"
24 PSI 1 16 LYS N 1 16 LYS CA 1 16 LYS C 1 17 LYS N -59.00 -15.00 -27.20 -41.36 -15.18 . . 0 "[ . 1 . 2]"
25 PHI 1 16 LYS C 1 17 LYS N 1 17 LYS CA 1 17 LYS C -75.00 -55.00 -70.58 -75.23 -54.95 0.23 17 0 "[ . 1 . 2]"
26 PSI 1 17 LYS N 1 17 LYS CA 1 17 LYS C 1 18 LEU N -62.00 -14.00 -54.70 -54.62 -56.77 0.37 17 0 "[ . 1 . 2]"
27 PHI 1 17 LYS C 1 18 LEU N 1 18 LEU CA 1 18 LEU C -75.00 -55.00 -55.65 -59.99 -54.59 0.41 18 0 "[ . 1 . 2]"
28 PSI 1 18 LEU N 1 18 LEU CA 1 18 LEU C 1 19 ALA N -61.00 -25.00 -31.55 -29.96 -32.68 1.04 14 0 "[ . 1 . 2]"
29 PHI 1 18 LEU C 1 19 ALA N 1 19 ALA CA 1 19 ALA C -73.00 -53.00 -67.68 -73.35 -57.47 0.35 6 0 "[ . 1 . 2]"
30 PSI 1 19 ALA N 1 19 ALA CA 1 19 ALA C 1 20 GLU N -63.00 -11.00 -26.77 -24.13 -24.82 0.95 14 0 "[ . 1 . 2]"
31 PHI 1 19 ALA C 1 20 GLU N 1 20 GLU CA 1 20 GLU C -73.00 -53.00 -69.62 -73.70 -56.30 0.70 18 0 "[ . 1 . 2]"
32 PSI 1 20 GLU N 1 20 GLU CA 1 20 GLU C 1 21 GLU N -49.00 -29.00 -49.47 -49.51 -49.54 1.02 6 0 "[ . 1 . 2]"
33 PHI 1 20 GLU C 1 21 GLU N 1 21 GLU CA 1 21 GLU C -74.00 -54.00 -69.20 -74.14 -74.23 0.48 14 0 "[ . 1 . 2]"
34 PSI 1 21 GLU N 1 21 GLU CA 1 21 GLU C 1 22 ALA N -51.00 -31.00 -47.34 -51.53 -32.14 0.53 2 0 "[ . 1 . 2]"
35 PHI 1 21 GLU C 1 22 ALA N 1 22 ALA CA 1 22 ALA C -76.00 -52.00 -59.65 -55.70 -56.10 1.42 14 0 "[ . 1 . 2]"
36 PSI 1 22 ALA N 1 22 ALA CA 1 22 ALA C 1 23 ALA N -55.00 -23.00 -30.03 -33.10 -22.42 0.58 1 0 "[ . 1 . 2]"
37 PHI 1 22 ALA C 1 23 ALA N 1 23 ALA CA 1 23 ALA C -76.00 -52.00 -71.77 -72.10 -75.67 0.06 7 0 "[ . 1 . 2]"
38 PSI 1 23 ALA N 1 23 ALA CA 1 23 ALA C 1 24 LYS N -54.00 -26.00 -52.86 -54.09 -54.22 0.86 1 0 "[ . 1 . 2]"
39 PHI 1 23 ALA C 1 24 LYS N 1 24 LYS CA 1 24 LYS C -76.00 -56.00 -64.27 -64.86 -65.87 . . 0 "[ . 1 . 2]"
40 PSI 1 24 LYS N 1 24 LYS CA 1 24 LYS C 1 25 LEU N -59.00 -15.00 -34.41 -37.54 -29.99 . . 0 "[ . 1 . 2]"
41 PHI 1 24 LYS C 1 25 LEU N 1 25 LEU CA 1 25 LEU C -76.00 -52.00 -76.82 -76.89 -77.64 1.86 18 0 "[ . 1 . 2]"
42 PSI 1 25 LEU N 1 25 LEU CA 1 25 LEU C 1 26 LEU N -68.00 -16.00 -39.55 -42.21 -36.71 . . 0 "[ . 1 . 2]"
43 PHI 1 25 LEU C 1 26 LEU N 1 26 LEU CA 1 26 LEU C -79.00 -51.00 -50.53 -50.81 -50.09 0.91 5 0 "[ . 1 . 2]"
44 PSI 1 26 LEU N 1 26 LEU CA 1 26 LEU C 1 27 GLU N -60.00 -16.00 -48.94 -48.16 -49.22 . . 0 "[ . 1 . 2]"
45 PHI 1 26 LEU C 1 27 GLU N 1 27 GLU CA 1 27 GLU C -102.00 -50.00 -90.88 -101.61 -78.99 . . 0 "[ . 1 . 2]"
46 PSI 1 27 GLU N 1 27 GLU CA 1 27 GLU C 1 28 GLY N -65.00 11.00 5.38 12.38 12.29 2.19 15 0 "[ . 1 . 2]"
47 PHI 1 35 GLY C 1 36 GLU N 1 36 GLU CA 1 36 GLU C -76.00 -52.00 -62.83 -57.78 -60.84 1.35 18 0 "[ . 1 . 2]"
48 PSI 1 36 GLU N 1 36 GLU CA 1 36 GLU C 1 37 LEU N -63.00 -11.00 -30.37 -36.31 -37.05 0.34 13 0 "[ . 1 . 2]"
49 PHI 1 36 GLU C 1 37 LEU N 1 37 LEU CA 1 37 LEU C -79.00 -51.00 -56.10 -77.22 -50.18 0.82 18 0 "[ . 1 . 2]"
50 PSI 1 37 LEU N 1 37 LEU CA 1 37 LEU C 1 38 MET N -59.00 -23.00 -47.85 -39.34 -47.67 0.04 11 0 "[ . 1 . 2]"
51 PHI 1 37 LEU C 1 38 MET N 1 38 MET CA 1 38 MET C -73.00 -53.00 -67.20 -73.13 -53.00 0.13 12 0 "[ . 1 . 2]"
52 PSI 1 38 MET N 1 38 MET CA 1 38 MET C 1 39 LYS N -53.00 -25.00 -33.32 -25.67 -26.82 . . 0 "[ . 1 . 2]"
53 PHI 1 38 MET C 1 39 LYS N 1 39 LYS CA 1 39 LYS C -74.00 -54.00 -57.41 -69.36 -53.81 0.19 7 0 "[ . 1 . 2]"
54 PSI 1 39 LYS N 1 39 LYS CA 1 39 LYS C 1 40 LEU N -48.00 -28.00 -28.76 -29.21 -29.65 0.33 18 0 "[ . 1 . 2]"
55 PHI 1 39 LYS C 1 40 LEU N 1 40 LEU CA 1 40 LEU C -74.00 -54.00 -65.24 -61.64 -61.94 0.37 11 0 "[ . 1 . 2]"
56 PSI 1 40 LEU N 1 40 LEU CA 1 40 LEU C 1 41 CYS N -61.00 -21.00 -44.25 -61.14 -28.44 0.14 10 0 "[ . 1 . 2]"
57 PHI 1 40 LEU C 1 41 CYS N 1 41 CYS CA 1 41 CYS C -75.00 -55.00 -70.57 -69.84 -71.88 0.34 18 0 "[ . 1 . 2]"
58 PSI 1 41 CYS N 1 41 CYS CA 1 41 CYS C 1 42 GLU N -56.00 -24.00 -34.42 -41.19 -45.42 . . 0 "[ . 1 . 2]"
59 PHI 1 41 CYS C 1 42 GLU N 1 42 GLU CA 1 42 GLU C -73.00 -53.00 -60.46 -63.71 -65.80 . . 0 "[ . 1 . 2]"
60 PSI 1 42 GLU N 1 42 GLU CA 1 42 GLU C 1 43 GLU N -54.00 -26.00 -25.89 -25.66 -25.83 1.17 17 0 "[ . 1 . 2]"
61 PHI 1 42 GLU C 1 43 GLU N 1 43 GLU CA 1 43 GLU C -75.00 -55.00 -55.62 -54.71 -54.83 0.72 9 0 "[ . 1 . 2]"
62 PSI 1 43 GLU N 1 43 GLU CA 1 43 GLU C 1 44 ALA N -60.00 -16.00 -30.63 -40.88 -18.13 . . 0 "[ . 1 . 2]"
63 PHI 1 43 GLU C 1 44 ALA N 1 44 ALA CA 1 44 ALA C -76.00 -52.00 -51.79 -51.82 -51.87 1.11 18 0 "[ . 1 . 2]"
64 PSI 1 44 ALA N 1 44 ALA CA 1 44 ALA C 1 45 ALA N -50.00 -26.00 -43.83 -42.54 -43.07 0.20 18 0 "[ . 1 . 2]"
65 PHI 1 44 ALA C 1 45 ALA N 1 45 ALA CA 1 45 ALA C -75.00 -51.00 -74.78 -75.55 -69.31 0.55 16 0 "[ . 1 . 2]"
66 PSI 1 45 ALA N 1 45 ALA CA 1 45 ALA C 1 46 LYS N -59.00 -23.00 -23.21 -23.12 -23.67 0.35 14 0 "[ . 1 . 2]"
67 PHI 1 45 ALA C 1 46 LYS N 1 46 LYS CA 1 46 LYS C -78.00 -54.00 -74.85 -77.92 -67.86 . . 0 "[ . 1 . 2]"
68 PSI 1 46 LYS N 1 46 LYS CA 1 46 LYS C 1 47 LYS N -60.00 -16.00 -48.93 -53.11 -46.06 . . 0 "[ . 1 . 2]"
69 PHI 1 46 LYS C 1 47 LYS N 1 47 LYS CA 1 47 LYS C -74.00 -54.00 -65.37 -57.26 -59.82 0.13 6 0 "[ . 1 . 2]"
70 PSI 1 47 LYS N 1 47 LYS CA 1 47 LYS C 1 48 ALA N -61.00 -25.00 -48.65 -55.28 -56.53 0.53 18 0 "[ . 1 . 2]"
71 PHI 1 47 LYS C 1 48 ALA N 1 48 ALA CA 1 48 ALA C -72.00 -52.00 -55.66 -52.89 -54.45 0.18 7 0 "[ . 1 . 2]"
72 PSI 1 48 ALA N 1 48 ALA CA 1 48 ALA C 1 49 GLU N -50.00 -26.00 -39.52 -50.81 -27.25 0.81 18 0 "[ . 1 . 2]"
73 PHI 1 48 ALA C 1 49 GLU N 1 49 GLU CA 1 49 GLU C -77.00 -53.00 -69.70 -65.13 -66.65 0.27 17 0 "[ . 1 . 2]"
74 PSI 1 49 GLU N 1 49 GLU CA 1 49 GLU C 1 50 GLU N -56.00 -28.00 -36.97 -48.10 -27.82 0.18 18 0 "[ . 1 . 2]"
75 PHI 1 49 GLU C 1 50 GLU N 1 50 GLU CA 1 50 GLU C -74.00 -54.00 -69.19 -74.78 -54.19 0.78 12 0 "[ . 1 . 2]"
76 PSI 1 50 GLU N 1 50 GLU CA 1 50 GLU C 1 51 LEU N -51.00 -19.00 -43.28 -35.13 -40.92 1.78 12 0 "[ . 1 . 2]"
77 PHI 1 50 GLU C 1 51 LEU N 1 51 LEU CA 1 51 LEU C -73.00 -53.00 -70.99 -73.35 -61.69 0.35 18 0 "[ . 1 . 2]"
78 PSI 1 51 LEU N 1 51 LEU CA 1 51 LEU C 1 52 PHE N -60.00 -24.00 -39.18 -57.49 -19.54 4.46 12 0 "[ . 1 . 2]"
79 PHI 1 51 LEU C 1 52 PHE N 1 52 PHE CA 1 52 PHE C -74.00 -54.00 -57.94 -57.00 -60.49 1.65 12 0 "[ . 1 . 2]"
80 PSI 1 52 PHE N 1 52 PHE CA 1 52 PHE C 1 53 LYS N -52.00 -24.00 -27.26 -36.71 -23.58 0.42 12 0 "[ . 1 . 2]"
81 PHI 1 52 PHE C 1 53 LYS N 1 53 LYS CA 1 53 LYS C -76.00 -52.00 -59.67 -59.44 -61.54 0.28 18 0 "[ . 1 . 2]"
82 PSI 1 53 LYS N 1 53 LYS CA 1 53 LYS C 1 54 LEU N -59.00 -27.00 -52.63 -60.74 -35.80 1.74 18 0 "[ . 1 . 2]"
83 PHI 1 53 LYS C 1 54 LEU N 1 54 LEU CA 1 54 LEU C -75.00 -55.00 -70.16 -77.45 -54.97 2.45 18 0 "[ . 1 . 2]"
84 PSI 1 54 LEU N 1 54 LEU CA 1 54 LEU C 1 55 ALA N -59.00 -23.00 -28.56 -24.41 -25.07 1.25 20 0 "[ . 1 . 2]"
85 PHI 1 54 LEU C 1 55 ALA N 1 55 ALA CA 1 55 ALA C -73.00 -53.00 -57.42 -55.39 -55.74 0.22 10 0 "[ . 1 . 2]"
86 PSI 1 55 ALA N 1 55 ALA CA 1 55 ALA C 1 56 GLU N -49.00 -25.00 -30.39 -41.08 -24.64 0.36 12 0 "[ . 1 . 2]"
87 PHI 1 55 ALA C 1 56 GLU N 1 56 GLU CA 1 56 GLU C -77.00 -53.00 -65.72 -67.31 -76.43 0.66 11 0 "[ . 1 . 2]"
88 PSI 1 56 GLU N 1 56 GLU CA 1 56 GLU C 1 57 GLU N -54.00 -26.00 -30.01 -52.96 -22.67 3.33 19 0 "[ . 1 . 2]"
89 PHI 1 56 GLU C 1 57 GLU N 1 57 GLU CA 1 57 GLU C -75.00 -55.00 -65.35 -76.57 -54.49 1.57 14 0 "[ . 1 . 2]"
90 PSI 1 57 GLU N 1 57 GLU CA 1 57 GLU C 1 58 ARG N -54.00 -26.00 -48.48 -47.83 -48.78 1.40 14 0 "[ . 1 . 2]"
91 PHI 1 57 GLU C 1 58 ARG N 1 58 ARG CA 1 58 ARG C -77.00 -57.00 -78.08 -77.95 -78.00 5.65 20 1 "[ . 1 . +]"
92 PSI 1 58 ARG N 1 58 ARG CA 1 58 ARG C 1 59 LEU N -62.00 -14.00 -20.75 -15.33 -18.90 3.05 14 0 "[ . 1 . 2]"
93 PHI 2 4 LEU C 2 5 ARG N 2 5 ARG CA 2 5 ARG C -72.00 -52.00 -69.23 -70.86 -71.31 1.11 9 0 "[ . 1 . 2]"
94 PSI 2 5 ARG N 2 5 ARG CA 2 5 ARG C 2 6 GLU N -53.00 -21.00 -35.92 -43.64 -45.51 . . 0 "[ . 1 . 2]"
95 PHI 2 5 ARG C 2 6 GLU N 2 6 GLU CA 2 6 GLU C -78.00 -54.00 -54.01 -53.66 -53.77 2.20 11 0 "[ . 1 . 2]"
96 PSI 2 6 GLU N 2 6 GLU CA 2 6 GLU C 2 7 GLU N -55.00 -27.00 -28.54 -33.05 -26.43 0.57 14 0 "[ . 1 . 2]"
97 PHI 2 6 GLU C 2 7 GLU N 2 7 GLU CA 2 7 GLU C -74.00 -54.00 -54.84 -63.46 -52.94 1.06 14 0 "[ . 1 . 2]"
98 PSI 2 7 GLU N 2 7 GLU CA 2 7 GLU C 2 8 ALA N -58.00 -18.00 -38.98 -28.65 -29.98 . . 0 "[ . 1 . 2]"
99 PHI 2 7 GLU C 2 8 ALA N 2 8 ALA CA 2 8 ALA C -76.00 -52.00 -67.90 -76.70 -52.51 0.70 11 0 "[ . 1 . 2]"
100 PSI 2 8 ALA N 2 8 ALA CA 2 8 ALA C 2 9 ALA N -51.00 -27.00 -27.32 -30.76 -26.62 0.38 7 0 "[ . 1 . 2]"
101 PHI 2 8 ALA C 2 9 ALA N 2 9 ALA CA 2 9 ALA C -74.00 -54.00 -66.43 -63.06 -64.18 3.22 7 0 "[ . 1 . 2]"
102 PSI 2 9 ALA N 2 9 ALA CA 2 9 ALA C 2 10 LYS N -51.00 -27.00 -40.39 -50.07 -26.02 0.98 7 0 "[ . 1 . 2]"
103 PHI 2 9 ALA C 2 10 LYS N 2 10 LYS CA 2 10 LYS C -76.00 -56.00 -61.69 -60.30 -62.48 0.36 11 0 "[ . 1 . 2]"
104 PSI 2 10 LYS N 2 10 LYS CA 2 10 LYS C 2 11 LEU N -53.00 -25.00 -34.81 -34.33 -34.97 1.09 7 0 "[ . 1 . 2]"
105 PHI 2 10 LYS C 2 11 LEU N 2 11 LEU CA 2 11 LEU C -76.00 -52.00 -52.12 -51.82 -51.86 0.42 17 0 "[ . 1 . 2]"
106 PSI 2 11 LEU N 2 11 LEU CA 2 11 LEU C 2 12 PHE N -62.00 -22.00 -44.17 -47.50 -40.60 . . 0 "[ . 1 . 2]"
107 PHI 2 11 LEU C 2 12 PHE N 2 12 PHE CA 2 12 PHE C -74.00 -54.00 -73.61 -74.29 -67.12 0.29 17 0 "[ . 1 . 2]"
108 PSI 2 12 PHE N 2 12 PHE CA 2 12 PHE C 2 13 GLU N -58.00 -22.00 -25.43 -30.50 -20.54 1.46 7 0 "[ . 1 . 2]"
109 PHI 2 12 PHE C 2 13 GLU N 2 13 GLU CA 2 13 GLU C -78.00 -54.00 -58.15 -58.16 -58.59 0.29 14 0 "[ . 1 . 2]"
110 PSI 2 13 GLU N 2 13 GLU CA 2 13 GLU C 2 14 GLU N -54.00 -26.00 -37.20 -49.35 -26.06 . . 0 "[ . 1 . 2]"
111 PHI 2 13 GLU C 2 14 GLU N 2 14 GLU CA 2 14 GLU C -75.00 -55.00 -73.10 -75.01 -75.02 0.62 11 0 "[ . 1 . 2]"
112 PSI 2 14 GLU N 2 14 GLU CA 2 14 GLU C 2 15 TRP N -52.00 -28.00 -32.44 -28.06 -29.24 1.41 14 0 "[ . 1 . 2]"
113 PHI 2 14 GLU C 2 15 TRP N 2 15 TRP CA 2 15 TRP C -78.00 -54.00 -59.14 -67.63 -52.70 1.30 18 0 "[ . 1 . 2]"
114 PSI 2 15 TRP N 2 15 TRP CA 2 15 TRP C 2 16 LYS N -56.00 -24.00 -49.98 -47.52 -47.90 0.20 14 0 "[ . 1 . 2]"
115 PHI 2 15 TRP C 2 16 LYS N 2 16 LYS CA 2 16 LYS C -77.00 -53.00 -74.23 -78.37 -67.71 1.37 18 0 "[ . 1 . 2]"
116 PSI 2 16 LYS N 2 16 LYS CA 2 16 LYS C 2 17 LYS N -59.00 -15.00 -26.91 -39.75 -14.78 0.22 18 0 "[ . 1 . 2]"
117 PHI 2 16 LYS C 2 17 LYS N 2 17 LYS CA 2 17 LYS C -75.00 -55.00 -70.05 -67.02 -68.12 0.30 7 0 "[ . 1 . 2]"
118 PSI 2 17 LYS N 2 17 LYS CA 2 17 LYS C 2 18 LEU N -62.00 -14.00 -55.83 -52.49 -53.79 0.87 18 0 "[ . 1 . 2]"
119 PHI 2 17 LYS C 2 18 LEU N 2 18 LEU CA 2 18 LEU C -75.00 -55.00 -55.55 -57.95 -54.40 0.60 9 0 "[ . 1 . 2]"
120 PSI 2 18 LEU N 2 18 LEU CA 2 18 LEU C 2 19 ALA N -61.00 -25.00 -31.17 -29.20 -31.95 0.54 14 0 "[ . 1 . 2]"
121 PHI 2 18 LEU C 2 19 ALA N 2 19 ALA CA 2 19 ALA C -73.00 -53.00 -67.18 -73.85 -57.62 0.85 14 0 "[ . 1 . 2]"
122 PSI 2 19 ALA N 2 19 ALA CA 2 19 ALA C 2 20 GLU N -63.00 -11.00 -26.64 -21.86 -23.46 0.94 14 0 "[ . 1 . 2]"
123 PHI 2 19 ALA C 2 20 GLU N 2 20 GLU CA 2 20 GLU C -73.00 -53.00 -69.66 -73.14 -73.19 0.57 7 0 "[ . 1 . 2]"
124 PSI 2 20 GLU N 2 20 GLU CA 2 20 GLU C 2 21 GLU N -49.00 -29.00 -49.45 -49.38 -49.43 0.93 6 0 "[ . 1 . 2]"
125 PHI 2 20 GLU C 2 21 GLU N 2 21 GLU CA 2 21 GLU C -74.00 -54.00 -68.80 -74.14 -74.23 0.43 14 0 "[ . 1 . 2]"
126 PSI 2 21 GLU N 2 21 GLU CA 2 21 GLU C 2 22 ALA N -51.00 -31.00 -47.41 -51.78 -30.96 0.78 20 0 "[ . 1 . 2]"
127 PHI 2 21 GLU C 2 22 ALA N 2 22 ALA CA 2 22 ALA C -76.00 -52.00 -59.82 -56.57 -57.86 1.78 14 0 "[ . 1 . 2]"
128 PSI 2 22 ALA N 2 22 ALA CA 2 22 ALA C 2 23 ALA N -55.00 -23.00 -30.01 -33.28 -22.20 0.80 1 0 "[ . 1 . 2]"
129 PHI 2 22 ALA C 2 23 ALA N 2 23 ALA CA 2 23 ALA C -76.00 -52.00 -71.79 -71.54 -76.01 0.33 18 0 "[ . 1 . 2]"
130 PSI 2 23 ALA N 2 23 ALA CA 2 23 ALA C 2 24 LYS N -54.00 -26.00 -52.92 -54.56 -54.79 0.82 1 0 "[ . 1 . 2]"
131 PHI 2 23 ALA C 2 24 LYS N 2 24 LYS CA 2 24 LYS C -76.00 -56.00 -64.17 -65.17 -65.93 . . 0 "[ . 1 . 2]"
132 PSI 2 24 LYS N 2 24 LYS CA 2 24 LYS C 2 25 LEU N -59.00 -15.00 -34.48 -37.69 -29.92 . . 0 "[ . 1 . 2]"
133 PHI 2 24 LYS C 2 25 LEU N 2 25 LEU CA 2 25 LEU C -76.00 -52.00 -76.80 -76.82 -77.69 1.88 18 0 "[ . 1 . 2]"
134 PSI 2 25 LEU N 2 25 LEU CA 2 25 LEU C 2 26 LEU N -68.00 -16.00 -39.44 -41.21 -41.64 . . 0 "[ . 1 . 2]"
135 PHI 2 25 LEU C 2 26 LEU N 2 26 LEU CA 2 26 LEU C -79.00 -51.00 -50.54 -50.88 -50.14 0.86 5 0 "[ . 1 . 2]"
136 PSI 2 26 LEU N 2 26 LEU CA 2 26 LEU C 2 27 GLU N -60.00 -16.00 -49.00 -49.07 -49.81 . . 0 "[ . 1 . 2]"
137 PHI 2 26 LEU C 2 27 GLU N 2 27 GLU CA 2 27 GLU C -102.00 -50.00 -90.97 -100.01 -78.94 . . 0 "[ . 1 . 2]"
138 PSI 2 27 GLU N 2 27 GLU CA 2 27 GLU C 2 28 GLY N -65.00 11.00 5.14 12.54 12.44 2.09 15 0 "[ . 1 . 2]"
139 PHI 2 35 GLY C 2 36 GLU N 2 36 GLU CA 2 36 GLU C -76.00 -52.00 -62.37 -54.86 -57.66 0.39 16 0 "[ . 1 . 2]"
140 PSI 2 36 GLU N 2 36 GLU CA 2 36 GLU C 2 37 LEU N -63.00 -11.00 -30.70 -34.74 -35.87 . . 0 "[ . 1 . 2]"
141 PHI 2 36 GLU C 2 37 LEU N 2 37 LEU CA 2 37 LEU C -79.00 -51.00 -56.59 -71.45 -51.38 . . 0 "[ . 1 . 2]"
142 PSI 2 37 LEU N 2 37 LEU CA 2 37 LEU C 2 38 MET N -59.00 -23.00 -47.21 -39.30 -47.99 0.20 16 0 "[ . 1 . 2]"
143 PHI 2 37 LEU C 2 38 MET N 2 38 MET CA 2 38 MET C -73.00 -53.00 -66.64 -73.07 -54.97 0.07 12 0 "[ . 1 . 2]"
144 PSI 2 38 MET N 2 38 MET CA 2 38 MET C 2 39 LYS N -53.00 -25.00 -30.82 -26.92 -26.96 2.44 18 0 "[ . 1 . 2]"
145 PHI 2 38 MET C 2 39 LYS N 2 39 LYS CA 2 39 LYS C -74.00 -54.00 -55.62 -64.29 -52.02 1.98 18 0 "[ . 1 . 2]"
146 PSI 2 39 LYS N 2 39 LYS CA 2 39 LYS C 2 40 LEU N -48.00 -28.00 -29.04 -28.22 -28.81 1.69 18 0 "[ . 1 . 2]"
147 PHI 2 39 LYS C 2 40 LEU N 2 40 LEU CA 2 40 LEU C -74.00 -54.00 -64.67 -59.87 -61.84 2.23 18 0 "[ . 1 . 2]"
148 PSI 2 40 LEU N 2 40 LEU CA 2 40 LEU C 2 41 CYS N -61.00 -21.00 -44.00 -61.13 -26.76 0.13 7 0 "[ . 1 . 2]"
149 PHI 2 40 LEU C 2 41 CYS N 2 41 CYS CA 2 41 CYS C -75.00 -55.00 -71.68 -70.24 -71.66 0.54 18 0 "[ . 1 . 2]"
150 PSI 2 41 CYS N 2 41 CYS CA 2 41 CYS C 2 42 GLU N -56.00 -24.00 -33.08 -34.55 -36.99 0.26 2 0 "[ . 1 . 2]"
151 PHI 2 41 CYS C 2 42 GLU N 2 42 GLU CA 2 42 GLU C -73.00 -53.00 -60.08 -57.22 -59.54 0.27 18 0 "[ . 1 . 2]"
152 PSI 2 42 GLU N 2 42 GLU CA 2 42 GLU C 2 43 GLU N -54.00 -26.00 -25.62 -25.56 -25.71 1.94 18 0 "[ . 1 . 2]"
153 PHI 2 42 GLU C 2 43 GLU N 2 43 GLU CA 2 43 GLU C -75.00 -55.00 -55.11 -54.12 -54.38 0.94 16 0 "[ . 1 . 2]"
154 PSI 2 43 GLU N 2 43 GLU CA 2 43 GLU C 2 44 ALA N -60.00 -16.00 -30.52 -44.57 -21.17 . . 0 "[ . 1 . 2]"
155 PHI 2 43 GLU C 2 44 ALA N 2 44 ALA CA 2 44 ALA C -76.00 -52.00 -51.77 -51.75 -51.85 1.39 18 0 "[ . 1 . 2]"
156 PSI 2 44 ALA N 2 44 ALA CA 2 44 ALA C 2 45 ALA N -50.00 -26.00 -43.91 -42.00 -42.52 . . 0 "[ . 1 . 2]"
157 PHI 2 44 ALA C 2 45 ALA N 2 45 ALA CA 2 45 ALA C -75.00 -51.00 -74.77 -75.73 -71.85 0.73 14 0 "[ . 1 . 2]"
158 PSI 2 45 ALA N 2 45 ALA CA 2 45 ALA C 2 46 LYS N -59.00 -23.00 -23.15 -23.45 -23.74 0.54 14 0 "[ . 1 . 2]"
159 PHI 2 45 ALA C 2 46 LYS N 2 46 LYS CA 2 46 LYS C -78.00 -54.00 -74.28 -78.13 -66.35 0.13 20 0 "[ . 1 . 2]"
160 PSI 2 46 LYS N 2 46 LYS CA 2 46 LYS C 2 47 LYS N -60.00 -16.00 -48.58 -52.75 -43.28 . . 0 "[ . 1 . 2]"
161 PHI 2 46 LYS C 2 47 LYS N 2 47 LYS CA 2 47 LYS C -74.00 -54.00 -65.12 -62.44 -63.79 0.15 18 0 "[ . 1 . 2]"
162 PSI 2 47 LYS N 2 47 LYS CA 2 47 LYS C 2 48 ALA N -61.00 -25.00 -49.12 -55.09 -56.32 0.17 15 0 "[ . 1 . 2]"
163 PHI 2 47 LYS C 2 48 ALA N 2 48 ALA CA 2 48 ALA C -72.00 -52.00 -56.00 -53.09 -54.39 0.14 20 0 "[ . 1 . 2]"
164 PSI 2 48 ALA N 2 48 ALA CA 2 48 ALA C 2 49 GLU N -50.00 -26.00 -39.13 -49.60 -27.07 . . 0 "[ . 1 . 2]"
165 PHI 2 48 ALA C 2 49 GLU N 2 49 GLU CA 2 49 GLU C -77.00 -53.00 -69.86 -64.00 -66.83 0.23 7 0 "[ . 1 . 2]"
166 PSI 2 49 GLU N 2 49 GLU CA 2 49 GLU C 2 50 GLU N -56.00 -28.00 -36.51 -48.17 -27.93 0.07 17 0 "[ . 1 . 2]"
167 PHI 2 49 GLU C 2 50 GLU N 2 50 GLU CA 2 50 GLU C -74.00 -54.00 -69.00 -74.74 -53.96 0.74 12 0 "[ . 1 . 2]"
168 PSI 2 50 GLU N 2 50 GLU CA 2 50 GLU C 2 51 LEU N -51.00 -19.00 -43.14 -28.96 -32.23 1.85 12 0 "[ . 1 . 2]"
169 PHI 2 50 GLU C 2 51 LEU N 2 51 LEU CA 2 51 LEU C -73.00 -53.00 -71.06 -72.68 -72.86 0.54 17 0 "[ . 1 . 2]"
170 PSI 2 51 LEU N 2 51 LEU CA 2 51 LEU C 2 52 PHE N -60.00 -24.00 -38.58 -53.23 -19.62 4.38 12 0 "[ . 1 . 2]"
171 PHI 2 51 LEU C 2 52 PHE N 2 52 PHE CA 2 52 PHE C -74.00 -54.00 -58.17 -57.12 -58.99 1.77 12 0 "[ . 1 . 2]"
172 PSI 2 52 PHE N 2 52 PHE CA 2 52 PHE C 2 53 LYS N -52.00 -24.00 -27.29 -36.66 -23.63 0.37 12 0 "[ . 1 . 2]"
173 PHI 2 52 PHE C 2 53 LYS N 2 53 LYS CA 2 53 LYS C -76.00 -52.00 -60.26 -64.24 -66.43 0.34 11 0 "[ . 1 . 2]"
174 PSI 2 53 LYS N 2 53 LYS CA 2 53 LYS C 2 54 LEU N -59.00 -27.00 -52.70 -59.68 -33.00 0.68 16 0 "[ . 1 . 2]"
175 PHI 2 53 LYS C 2 54 LEU N 2 54 LEU CA 2 54 LEU C -75.00 -55.00 -70.29 -75.70 -54.60 0.70 19 0 "[ . 1 . 2]"
176 PSI 2 54 LEU N 2 54 LEU CA 2 54 LEU C 2 55 ALA N -59.00 -23.00 -27.80 -25.00 -25.35 1.05 20 0 "[ . 1 . 2]"
177 PHI 2 54 LEU C 2 55 ALA N 2 55 ALA CA 2 55 ALA C -73.00 -53.00 -57.52 -54.87 -55.35 0.13 9 0 "[ . 1 . 2]"
178 PSI 2 55 ALA N 2 55 ALA CA 2 55 ALA C 2 56 GLU N -49.00 -25.00 -30.37 -38.93 -24.71 0.29 12 0 "[ . 1 . 2]"
179 PHI 2 55 ALA C 2 56 GLU N 2 56 GLU CA 2 56 GLU C -77.00 -53.00 -66.09 -68.81 -75.81 1.00 17 0 "[ . 1 . 2]"
180 PSI 2 56 GLU N 2 56 GLU CA 2 56 GLU C 2 57 GLU N -54.00 -26.00 -29.94 -45.95 -24.45 1.55 6 0 "[ . 1 . 2]"
181 PHI 2 56 GLU C 2 57 GLU N 2 57 GLU CA 2 57 GLU C -75.00 -55.00 -64.54 -76.36 -50.36 4.64 19 0 "[ . 1 . 2]"
182 PSI 2 57 GLU N 2 57 GLU CA 2 57 GLU C 2 58 ARG N -54.00 -26.00 -48.52 -48.45 -49.27 2.07 19 0 "[ . 1 . 2]"
183 PHI 2 57 GLU C 2 58 ARG N 2 58 ARG CA 2 58 ARG C -77.00 -57.00 -78.23 -77.88 -77.98 5.64 20 1 "[ . 1 . +]"
184 PSI 2 58 ARG N 2 58 ARG CA 2 58 ARG C 2 59 LEU N -62.00 -14.00 -21.01 -19.16 -21.83 2.94 14 0 "[ . 1 . 2]"
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