NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
478361 |
2hfi   |
7227 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2hfi
save_distance_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 176
_TA_constraint_stats_list.Viol_count 156
_TA_constraint_stats_list.Viol_total 1710.43
_TA_constraint_stats_list.Viol_max 2.47
_TA_constraint_stats_list.Viol_rms 0.16
_TA_constraint_stats_list.Viol_average_all_restraints 0.02
_TA_constraint_stats_list.Viol_average_violations_only 0.55
_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 . 1 6 LEU C 1 7 LEU N 1 7 LEU CA 1 7 LEU C -77.00 -53.00 -68.06 -71.39 -72.45 0.63 20 0 "[ . 1 . 2]"
2 . 1 7 LEU N 1 7 LEU CA 1 7 LEU C 1 8 GLU N -53.00 -27.00 -45.02 -45.23 -46.44 0.54 3 0 "[ . 1 . 2]"
3 . 1 7 LEU C 1 8 GLU N 1 8 GLU CA 1 8 GLU C -75.00 -49.00 -59.73 -57.82 -59.56 0.30 8 0 "[ . 1 . 2]"
4 . 1 8 GLU N 1 8 GLU CA 1 8 GLU C 1 9 MET N -55.00 -29.00 -39.46 -50.49 -28.61 0.39 16 0 "[ . 1 . 2]"
5 . 1 8 GLU C 1 9 MET N 1 9 MET CA 1 9 MET C -77.00 -55.00 -61.60 -70.04 -56.53 . . 0 "[ . 1 . 2]"
6 . 1 9 MET N 1 9 MET CA 1 9 MET C 1 10 THR N -57.00 -21.00 -41.67 -38.51 -39.55 . . 0 "[ . 1 . 2]"
7 . 1 9 MET C 1 10 THR N 1 10 THR CA 1 10 THR C -87.00 -45.00 -67.52 -73.62 -63.49 . . 0 "[ . 1 . 2]"
8 . 1 10 THR N 1 10 THR CA 1 10 THR C 1 11 GLU N -55.00 -33.00 -46.90 -49.07 -49.39 . . 0 "[ . 1 . 2]"
9 . 1 10 THR C 1 11 GLU N 1 11 GLU CA 1 11 GLU C -75.00 -53.00 -55.46 -63.58 -52.18 0.82 8 0 "[ . 1 . 2]"
10 . 1 11 GLU N 1 11 GLU CA 1 11 GLU C 1 12 GLN N -51.00 -25.00 -43.24 -51.19 -35.60 0.19 15 0 "[ . 1 . 2]"
11 . 1 11 GLU C 1 12 GLN N 1 12 GLN CA 1 12 GLN C -83.00 -51.00 -62.49 -63.17 -63.20 . . 0 "[ . 1 . 2]"
12 . 1 12 GLN N 1 12 GLN CA 1 12 GLN C 1 13 MET N -53.00 -25.00 -45.54 -45.28 -46.17 . . 0 "[ . 1 . 2]"
13 . 1 12 GLN C 1 13 MET N 1 13 MET CA 1 13 MET C -75.00 -55.00 -62.60 -62.16 -62.68 0.32 17 0 "[ . 1 . 2]"
14 . 1 13 MET N 1 13 MET CA 1 13 MET C 1 14 ILE N -51.00 -29.00 -38.60 -44.17 -34.36 . . 0 "[ . 1 . 2]"
15 . 1 13 MET C 1 14 ILE N 1 14 ILE CA 1 14 ILE C -77.00 -55.00 -61.45 -65.66 -55.16 . . 0 "[ . 1 . 2]"
16 . 1 14 ILE N 1 14 ILE CA 1 14 ILE C 1 15 GLU N -53.00 -33.00 -47.57 -52.16 -42.55 . . 0 "[ . 1 . 2]"
17 . 1 14 ILE C 1 15 GLU N 1 15 GLU CA 1 15 GLU C -77.00 -51.00 -62.92 -61.79 -63.30 . . 0 "[ . 1 . 2]"
18 . 1 15 GLU N 1 15 GLU CA 1 15 GLU C 1 16 VAL N -53.00 -29.00 -42.35 -51.15 -34.99 . . 0 "[ . 1 . 2]"
19 . 1 15 GLU C 1 16 VAL N 1 16 VAL CA 1 16 VAL C -79.00 -53.00 -62.03 -65.37 -58.98 . . 0 "[ . 1 . 2]"
20 . 1 16 VAL N 1 16 VAL CA 1 16 VAL C 1 17 ALA N -55.00 -33.00 -42.54 -41.86 -42.19 . . 0 "[ . 1 . 2]"
21 . 1 16 VAL C 1 17 ALA N 1 17 ALA CA 1 17 ALA C -75.00 -49.00 -63.76 -74.63 -58.69 . . 0 "[ . 1 . 2]"
22 . 1 17 ALA N 1 17 ALA CA 1 17 ALA C 1 18 GLU N -55.00 -27.00 -47.87 -54.38 -40.69 . . 0 "[ . 1 . 2]"
23 . 1 17 ALA C 1 18 GLU N 1 18 GLU CA 1 18 GLU C -81.00 -51.00 -60.77 -62.63 -63.53 . . 0 "[ . 1 . 2]"
24 . 1 18 GLU N 1 18 GLU CA 1 18 GLU C 1 19 LYS N -55.00 -31.00 -45.47 -55.17 -32.94 0.17 4 0 "[ . 1 . 2]"
25 . 1 18 GLU C 1 19 LYS N 1 19 LYS CA 1 19 LYS C -79.00 -47.00 -68.20 -79.11 -58.85 0.11 10 0 "[ . 1 . 2]"
26 . 1 19 LYS N 1 19 LYS CA 1 19 LYS C 1 20 GLY N -69.00 -7.00 -34.68 -26.43 -28.75 . . 0 "[ . 1 . 2]"
27 . 1 19 LYS C 1 20 GLY N 1 20 GLY CA 1 20 GLY C -75.00 -53.00 -65.32 -69.42 -60.32 . . 0 "[ . 1 . 2]"
28 . 1 20 GLY N 1 20 GLY CA 1 20 GLY C 1 21 ALA N -63.00 -19.00 -44.34 -49.96 -36.77 . . 0 "[ . 1 . 2]"
29 . 1 20 GLY C 1 21 ALA N 1 21 ALA CA 1 21 ALA C -85.00 -49.00 -64.91 -70.72 -58.20 . . 0 "[ . 1 . 2]"
30 . 1 21 ALA N 1 21 ALA CA 1 21 ALA C 1 22 ASP N -55.00 -27.00 -41.25 -35.33 -37.74 . . 0 "[ . 1 . 2]"
31 . 1 21 ALA C 1 22 ASP N 1 22 ASP CA 1 22 ASP C -77.00 -57.00 -63.86 -61.50 -62.08 0.69 14 0 "[ . 1 . 2]"
32 . 1 22 ASP N 1 22 ASP CA 1 22 ASP C 1 23 ARG N -51.00 -29.00 -41.03 -48.24 -28.91 0.09 14 0 "[ . 1 . 2]"
33 . 1 22 ASP C 1 23 ARG N 1 23 ARG CA 1 23 ARG C -79.00 -57.00 -64.54 -70.56 -57.52 . . 0 "[ . 1 . 2]"
34 . 1 23 ARG N 1 23 ARG CA 1 23 ARG C 1 24 TYR N -49.00 -29.00 -39.40 -41.01 -43.06 . . 0 "[ . 1 . 2]"
35 . 1 23 ARG C 1 24 TYR N 1 24 TYR CA 1 24 TYR C -75.00 -49.00 -68.77 -66.73 -68.00 0.46 1 0 "[ . 1 . 2]"
36 . 1 24 TYR N 1 24 TYR CA 1 24 TYR C 1 25 GLN N -55.00 -35.00 -36.28 -41.42 -32.55 2.45 6 0 "[ . 1 . 2]"
37 . 1 24 TYR C 1 25 GLN N 1 25 GLN CA 1 25 GLN C -73.00 -51.00 -66.03 -73.18 -57.71 0.18 4 0 "[ . 1 . 2]"
38 . 1 25 GLN N 1 25 GLN CA 1 25 GLN C 1 26 GLU N -53.00 -27.00 -39.11 -46.81 -50.45 2.22 7 0 "[ . 1 . 2]"
39 . 1 25 GLN C 1 26 GLU N 1 26 GLU CA 1 26 GLU C -95.00 -47.00 -71.16 -76.39 -81.36 . . 0 "[ . 1 . 2]"
40 . 1 26 GLU N 1 26 GLU CA 1 26 GLU C 1 27 GLY N -61.00 1.00 -42.08 -61.30 -19.08 0.30 17 0 "[ . 1 . 2]"
41 . 1 42 PRO C 1 43 ALA N 1 43 ALA CA 1 43 ALA C -84.00 -56.00 -65.32 -77.98 -56.88 . . 0 "[ . 1 . 2]"
42 . 1 43 ALA N 1 43 ALA CA 1 43 ALA C 1 44 VAL N -59.00 -11.00 -37.61 -35.93 -37.27 . . 0 "[ . 1 . 2]"
43 . 1 43 ALA C 1 44 VAL N 1 44 VAL CA 1 44 VAL C -71.00 -51.00 -62.23 -63.52 -63.61 . . 0 "[ . 1 . 2]"
44 . 1 44 VAL N 1 44 VAL CA 1 44 VAL C 1 45 GLU N -57.00 -35.00 -46.58 -38.89 -40.27 . . 0 "[ . 1 . 2]"
45 . 1 44 VAL C 1 45 GLU N 1 45 GLU CA 1 45 GLU C -75.00 -49.00 -62.08 -71.32 -54.99 . . 0 "[ . 1 . 2]"
46 . 1 45 GLU N 1 45 GLU CA 1 45 GLU C 1 46 GLU N -51.00 -31.00 -45.32 -50.93 -38.12 . . 0 "[ . 1 . 2]"
47 . 1 45 GLU C 1 46 GLU N 1 46 GLU CA 1 46 GLU C -75.00 -55.00 -60.19 -54.86 -55.62 0.54 19 0 "[ . 1 . 2]"
48 . 1 46 GLU N 1 46 GLU CA 1 46 GLU C 1 47 ASN N -59.00 -31.00 -54.29 -61.34 -46.64 2.34 7 0 "[ . 1 . 2]"
49 . 1 46 GLU C 1 47 ASN N 1 47 ASN CA 1 47 ASN C -85.00 -53.00 -64.65 -59.92 -61.53 . . 0 "[ . 1 . 2]"
50 . 1 47 ASN N 1 47 ASN CA 1 47 ASN C 1 48 ASP N -51.00 -25.00 -34.28 -36.73 -37.94 0.17 18 0 "[ . 1 . 2]"
51 . 1 47 ASN C 1 48 ASP N 1 48 ASP CA 1 48 ASP C -75.00 -53.00 -61.24 -66.55 -54.67 . . 0 "[ . 1 . 2]"
52 . 1 48 ASP N 1 48 ASP CA 1 48 ASP C 1 49 GLU N -57.00 -31.00 -51.68 -57.28 -44.40 0.28 4 0 "[ . 1 . 2]"
53 . 1 48 ASP C 1 49 GLU N 1 49 GLU CA 1 49 GLU C -81.00 -51.00 -65.25 -63.79 -66.49 . . 0 "[ . 1 . 2]"
54 . 1 49 GLU N 1 49 GLU CA 1 49 GLU C 1 50 LEU N -63.00 -17.00 -38.99 -39.16 -39.83 . . 0 "[ . 1 . 2]"
55 . 1 49 GLU C 1 50 LEU N 1 50 LEU CA 1 50 LEU C -71.00 -51.00 -59.27 -64.39 -55.20 . . 0 "[ . 1 . 2]"
56 . 1 50 LEU N 1 50 LEU CA 1 50 LEU C 1 51 ALA N -53.00 -33.00 -52.26 -53.26 -53.59 0.78 1 0 "[ . 1 . 2]"
57 . 1 50 LEU C 1 51 ALA N 1 51 ALA CA 1 51 ALA C -77.00 -55.00 -63.76 -72.39 -58.71 . . 0 "[ . 1 . 2]"
58 . 1 51 ALA N 1 51 ALA CA 1 51 ALA C 1 52 ALA N -67.00 -5.00 -37.88 -38.75 -40.09 . . 0 "[ . 1 . 2]"
59 . 1 51 ALA C 1 52 ALA N 1 52 ALA CA 1 52 ALA C -75.00 -51.00 -64.35 -61.39 -62.22 . . 0 "[ . 1 . 2]"
60 . 1 52 ALA N 1 52 ALA CA 1 52 ALA C 1 53 ARG N -57.00 -31.00 -49.92 -57.38 -40.82 0.38 17 0 "[ . 1 . 2]"
61 . 1 52 ALA C 1 53 ARG N 1 53 ARG CA 1 53 ARG C -75.00 -55.00 -67.22 -69.21 -70.58 . . 0 "[ . 1 . 2]"
62 . 1 53 ARG N 1 53 ARG CA 1 53 ARG C 1 54 TRP N -51.00 -31.00 -37.01 -36.36 -37.38 0.41 7 0 "[ . 1 . 2]"
63 . 1 53 ARG C 1 54 TRP N 1 54 TRP CA 1 54 TRP C -75.00 -53.00 -63.98 -62.12 -62.19 . . 0 "[ . 1 . 2]"
64 . 1 54 TRP N 1 54 TRP CA 1 54 TRP C 1 55 ALA N -57.00 -33.00 -46.78 -52.60 -42.85 . . 0 "[ . 1 . 2]"
65 . 1 54 TRP C 1 55 ALA N 1 55 ALA CA 1 55 ALA C -75.00 -49.00 -59.16 -62.68 -55.80 . . 0 "[ . 1 . 2]"
66 . 1 55 ALA N 1 55 ALA CA 1 55 ALA C 1 56 GLU N -65.00 -27.00 -45.16 -44.92 -45.20 . . 0 "[ . 1 . 2]"
67 . 1 55 ALA C 1 56 GLU N 1 56 GLU CA 1 56 GLU C -73.00 -53.00 -59.45 -63.69 -55.73 . . 0 "[ . 1 . 2]"
68 . 1 56 GLU N 1 56 GLU CA 1 56 GLU C 1 57 GLY N -53.00 -29.00 -43.91 -43.82 -45.84 0.21 6 0 "[ . 1 . 2]"
69 . 1 57 GLY C 1 58 ALA N 1 58 ALA CA 1 58 ALA C -77.00 -53.00 -64.53 -61.22 -62.05 . . 0 "[ . 1 . 2]"
70 . 1 58 ALA N 1 58 ALA CA 1 58 ALA C 1 59 LEU N -53.00 -29.00 -42.57 -42.51 -42.99 . . 0 "[ . 1 . 2]"
71 . 1 58 ALA C 1 59 LEU N 1 59 LEU CA 1 59 LEU C -71.00 -51.00 -62.17 -66.96 -59.32 . . 0 "[ . 1 . 2]"
72 . 1 59 LEU N 1 59 LEU CA 1 59 LEU C 1 60 GLU N -51.00 -21.00 -37.03 -41.78 -33.61 . . 0 "[ . 1 . 2]"
73 . 1 59 LEU C 1 60 GLU N 1 60 GLU CA 1 60 GLU C -75.00 -49.00 -62.05 -63.79 -65.79 . . 0 "[ . 1 . 2]"
74 . 1 60 GLU N 1 60 GLU CA 1 60 GLU C 1 61 LEU N -53.00 -31.00 -46.80 -45.40 -46.85 0.96 18 0 "[ . 1 . 2]"
75 . 1 60 GLU C 1 61 LEU N 1 61 LEU CA 1 61 LEU C -75.00 -55.00 -62.78 -68.28 -57.06 . . 0 "[ . 1 . 2]"
76 . 1 61 LEU N 1 61 LEU CA 1 61 LEU C 1 62 ILE N -53.00 -31.00 -46.15 -45.64 -46.49 . . 0 "[ . 1 . 2]"
77 . 1 62 ILE C 1 63 LYS N 1 63 LYS CA 1 63 LYS C -81.00 -55.00 -81.53 -79.90 -81.13 2.47 8 0 "[ . 1 . 2]"
78 . 1 63 LYS N 1 63 LYS CA 1 63 LYS C 1 64 VAL N -49.00 -21.00 -34.27 -36.35 -39.18 1.43 9 0 "[ . 1 . 2]"
79 . 1 71 HIS C 1 72 LYS N 1 72 LYS CA 1 72 LYS C -67.00 -47.00 -60.83 -67.59 -54.78 0.59 14 0 "[ . 1 . 2]"
80 . 1 72 LYS N 1 72 LYS CA 1 72 LYS C 1 73 GLU N -57.00 -23.00 -40.01 -35.89 -38.84 0.76 5 0 "[ . 1 . 2]"
81 . 1 72 LYS C 1 73 GLU N 1 73 GLU CA 1 73 GLU C -81.00 -49.00 -58.59 -67.62 -48.69 0.31 15 0 "[ . 1 . 2]"
82 . 1 73 GLU N 1 73 GLU CA 1 73 GLU C 1 74 GLN N -57.00 -27.00 -37.46 -49.99 -27.09 . . 0 "[ . 1 . 2]"
83 . 1 73 GLU C 1 74 GLN N 1 74 GLN CA 1 74 GLN C -71.00 -51.00 -66.28 -71.60 -55.04 0.60 17 0 "[ . 1 . 2]"
84 . 1 74 GLN N 1 74 GLN CA 1 74 GLN C 1 75 ILE N -59.00 -29.00 -42.64 -53.38 -34.68 . . 0 "[ . 1 . 2]"
85 . 1 74 GLN C 1 75 ILE N 1 75 ILE CA 1 75 ILE C -87.00 -45.00 -60.34 -60.71 -61.63 . . 0 "[ . 1 . 2]"
86 . 1 75 ILE N 1 75 ILE CA 1 75 ILE C 1 76 GLU N -57.00 -27.00 -42.55 -43.02 -43.75 . . 0 "[ . 1 . 2]"
87 . 1 75 ILE C 1 76 GLU N 1 76 GLU CA 1 76 GLU C -81.00 -45.00 -69.26 -76.93 -58.19 . . 0 "[ . 1 . 2]"
88 . 1 76 GLU N 1 76 GLU CA 1 76 GLU C 1 77 ALA N -49.00 -25.00 -35.62 -33.92 -34.74 . . 0 "[ . 1 . 2]"
89 . 1 77 ALA C 1 78 VAL N 1 78 VAL CA 1 78 VAL C -79.00 -49.00 -60.01 -68.58 -54.46 . . 0 "[ . 1 . 2]"
90 . 1 78 VAL N 1 78 VAL CA 1 78 VAL C 1 79 LYS N -57.00 -35.00 -39.60 -36.32 -37.87 . . 0 "[ . 1 . 2]"
91 . 1 78 VAL C 1 79 LYS N 1 79 LYS CA 1 79 LYS C -71.00 -51.00 -55.40 -58.52 -51.36 . . 0 "[ . 1 . 2]"
92 . 1 79 LYS N 1 79 LYS CA 1 79 LYS C 1 80 ASP N -53.00 -29.00 -48.82 -47.56 -48.96 1.27 9 0 "[ . 1 . 2]"
93 . 1 79 LYS C 1 80 ASP N 1 80 ASP CA 1 80 ASP C -77.00 -51.00 -73.50 -67.52 -71.69 1.21 15 0 "[ . 1 . 2]"
94 . 1 80 ASP N 1 80 ASP CA 1 80 ASP C 1 81 ASN N -53.00 -27.00 -43.82 -43.88 -45.10 . . 0 "[ . 1 . 2]"
95 . 1 80 ASP C 1 81 ASN N 1 81 ASN CA 1 81 ASN C -81.00 -53.00 -63.43 -62.99 -63.90 . . 0 "[ . 1 . 2]"
96 . 1 81 ASN N 1 81 ASN CA 1 81 ASN C 1 82 PHE N -49.00 -25.00 -34.52 -44.01 -25.60 . . 0 "[ . 1 . 2]"
97 . 1 81 ASN C 1 82 PHE N 1 82 PHE CA 1 82 PHE C -77.00 -53.00 -64.64 -69.41 -59.54 . . 0 "[ . 1 . 2]"
98 . 1 82 PHE N 1 82 PHE CA 1 82 PHE C 1 83 LEU N -55.00 -33.00 -45.53 -54.35 -36.30 . . 0 "[ . 1 . 2]"
99 . 1 82 PHE C 1 83 LEU N 1 83 LEU CA 1 83 LEU C -73.00 -51.00 -64.29 -63.89 -64.78 . . 0 "[ . 1 . 2]"
100 . 1 83 LEU N 1 83 LEU CA 1 83 LEU C 1 84 GLU N -49.00 -27.00 -41.24 -39.60 -41.48 . . 0 "[ . 1 . 2]"
101 . 1 83 LEU C 1 84 GLU N 1 84 GLU CA 1 84 GLU C -77.00 -57.00 -63.48 -63.77 -66.51 0.10 18 0 "[ . 1 . 2]"
102 . 1 84 GLU N 1 84 GLU CA 1 84 GLU C 1 85 LEU N -55.00 -31.00 -42.62 -51.44 -30.48 0.52 1 0 "[ . 1 . 2]"
103 . 1 84 GLU C 1 85 LEU N 1 85 LEU CA 1 85 LEU C -77.00 -53.00 -55.88 -59.10 -59.94 0.49 12 0 "[ . 1 . 2]"
104 . 1 85 LEU N 1 85 LEU CA 1 85 LEU C 1 86 VAL N -53.00 -29.00 -50.07 -46.14 -48.53 1.15 7 0 "[ . 1 . 2]"
105 . 1 85 LEU C 1 86 VAL N 1 86 VAL CA 1 86 VAL C -73.00 -53.00 -59.83 -57.97 -58.42 . . 0 "[ . 1 . 2]"
106 . 1 86 VAL N 1 86 VAL CA 1 86 VAL C 1 87 LEU N -57.00 -35.00 -45.83 -50.09 -40.83 . . 0 "[ . 1 . 2]"
107 . 1 86 VAL C 1 87 LEU N 1 87 LEU CA 1 87 LEU C -69.00 -47.00 -63.40 -69.09 -58.54 0.09 18 0 "[ . 1 . 2]"
108 . 1 87 LEU N 1 87 LEU CA 1 87 LEU C 1 88 GLN N -61.00 -23.00 -49.69 -46.62 -47.73 . . 0 "[ . 1 . 2]"
109 . 1 88 GLN C 1 89 SER N 1 89 SER CA 1 89 SER C -79.00 -47.00 -67.08 -72.73 -55.93 . . 0 "[ . 1 . 2]"
110 . 1 89 SER N 1 89 SER CA 1 89 SER C 1 90 TYR N -59.00 -13.00 -34.19 -34.16 -38.45 . . 0 "[ . 1 . 2]"
111 . 1 89 SER C 1 90 TYR N 1 90 TYR CA 1 90 TYR C -110.00 -58.00 -88.28 -110.48 -65.42 0.48 15 0 "[ . 1 . 2]"
112 . 1 90 TYR N 1 90 TYR CA 1 90 TYR C 1 91 VAL N -57.00 -13.00 -48.77 -57.91 -33.94 0.91 6 0 "[ . 1 . 2]"
113 . 1 96 LYS C 1 97 LYS N 1 97 LYS CA 1 97 LYS C -72.00 -52.00 -60.53 -61.77 -64.35 0.66 10 0 "[ . 1 . 2]"
114 . 1 97 LYS N 1 97 LYS CA 1 97 LYS C 1 98 ARG N -57.00 -29.00 -43.08 -57.48 -28.86 0.48 13 0 "[ . 1 . 2]"
115 . 1 97 LYS C 1 98 ARG N 1 98 ARG CA 1 98 ARG C -79.00 -53.00 -66.77 -79.53 -53.02 0.53 13 0 "[ . 1 . 2]"
116 . 1 98 ARG N 1 98 ARG CA 1 98 ARG C 1 99 PHE N -55.00 -23.00 -34.79 -49.83 -22.81 0.19 7 0 "[ . 1 . 2]"
117 . 1 98 ARG C 1 99 PHE N 1 99 PHE CA 1 99 PHE C -75.00 -47.00 -63.10 -62.43 -63.40 . . 0 "[ . 1 . 2]"
118 . 1 99 PHE N 1 99 PHE CA 1 99 PHE C 1 100 LYS N -55.00 -33.00 -44.44 -53.71 -34.04 . . 0 "[ . 1 . 2]"
119 . 1 99 PHE C 1 100 LYS N 1 100 LYS CA 1 100 LYS C -73.00 -53.00 -65.24 -69.10 -71.50 0.20 1 0 "[ . 1 . 2]"
120 . 1 100 LYS N 1 100 LYS CA 1 100 LYS C 1 101 ASP N -65.00 -13.00 -43.19 -53.41 -29.01 . . 0 "[ . 1 . 2]"
121 . 1 100 LYS C 1 101 ASP N 1 101 ASP CA 1 101 ASP C -79.00 -57.00 -61.50 -68.71 -56.55 0.45 3 0 "[ . 1 . 2]"
122 . 1 101 ASP N 1 101 ASP CA 1 101 ASP C 1 102 ILE N -57.00 -15.00 -46.72 -47.49 -48.94 . . 0 "[ . 1 . 2]"
123 . 1 101 ASP C 1 102 ILE N 1 102 ILE CA 1 102 ILE C -75.00 -53.00 -59.88 -63.76 -57.13 . . 0 "[ . 1 . 2]"
124 . 1 102 ILE N 1 102 ILE CA 1 102 ILE C 1 103 THR N -53.00 -33.00 -47.53 -44.99 -45.87 . . 0 "[ . 1 . 2]"
125 . 1 102 ILE C 1 103 THR N 1 103 THR CA 1 103 THR C -77.00 -55.00 -58.66 -57.66 -57.97 . . 0 "[ . 1 . 2]"
126 . 1 103 THR N 1 103 THR CA 1 103 THR C 1 104 GLU N -51.00 -31.00 -45.81 -50.44 -42.09 . . 0 "[ . 1 . 2]"
127 . 1 103 THR C 1 104 GLU N 1 104 GLU CA 1 104 GLU C -73.00 -49.00 -61.56 -56.19 -58.29 . . 0 "[ . 1 . 2]"
128 . 1 104 GLU N 1 104 GLU CA 1 104 GLU C 1 105 SER N -55.00 -29.00 -46.27 -51.71 -37.27 . . 0 "[ . 1 . 2]"
129 . 1 104 GLU C 1 105 SER N 1 105 SER CA 1 105 SER C -75.00 -55.00 -60.02 -61.10 -62.30 . . 0 "[ . 1 . 2]"
130 . 1 105 SER N 1 105 SER CA 1 105 SER C 1 106 VAL N -49.00 -29.00 -41.49 -47.53 -37.13 . . 0 "[ . 1 . 2]"
131 . 1 105 SER C 1 106 VAL N 1 106 VAL CA 1 106 VAL C -75.00 -51.00 -67.07 -72.20 -59.61 . . 0 "[ . 1 . 2]"
132 . 1 106 VAL N 1 106 VAL CA 1 106 VAL C 1 107 LEU N -57.00 -35.00 -51.84 -51.39 -52.02 . . 0 "[ . 1 . 2]"
133 . 1 106 VAL C 1 107 LEU N 1 107 LEU CA 1 107 LEU C -71.00 -51.00 -59.52 -63.18 -56.83 . . 0 "[ . 1 . 2]"
134 . 1 107 LEU N 1 107 LEU CA 1 107 LEU C 1 108 TYR N -49.00 -27.00 -41.39 -43.92 -43.94 . . 0 "[ . 1 . 2]"
135 . 1 107 LEU C 1 108 TYR N 1 108 TYR CA 1 108 TYR C -83.00 -51.00 -57.48 -53.68 -54.46 . . 0 "[ . 1 . 2]"
136 . 1 108 TYR N 1 108 TYR CA 1 108 TYR C 1 109 THR N -59.00 -21.00 -47.32 -52.34 -54.32 . . 0 "[ . 1 . 2]"
137 . 1 108 TYR C 1 109 THR N 1 109 THR CA 1 109 THR C -87.00 -51.00 -66.19 -74.36 -60.80 . . 0 "[ . 1 . 2]"
138 . 1 109 THR N 1 109 THR CA 1 109 THR C 1 110 LEU N -49.00 -29.00 -41.77 -44.15 -44.85 . . 0 "[ . 1 . 2]"
139 . 1 109 THR C 1 110 LEU N 1 110 LEU CA 1 110 LEU C -71.00 -51.00 -60.78 -63.49 -56.38 . . 0 "[ . 1 . 2]"
140 . 1 110 LEU N 1 110 LEU CA 1 110 LEU C 1 111 HIS N -53.00 -33.00 -41.49 -38.04 -38.59 . . 0 "[ . 1 . 2]"
141 . 1 110 LEU C 1 111 HIS N 1 111 HIS CA 1 111 HIS C -71.00 -51.00 -64.54 -64.77 -64.80 . . 0 "[ . 1 . 2]"
142 . 1 111 HIS N 1 111 HIS CA 1 111 HIS C 1 112 ALA N -55.00 -29.00 -36.42 -44.79 -28.14 0.86 11 0 "[ . 1 . 2]"
143 . 1 111 HIS C 1 112 ALA N 1 112 ALA CA 1 112 ALA C -73.00 -53.00 -66.04 -68.03 -69.43 . . 0 "[ . 1 . 2]"
144 . 1 112 ALA N 1 112 ALA CA 1 112 ALA C 1 113 VAL N -49.00 -29.00 -45.18 -39.57 -40.69 1.69 16 0 "[ . 1 . 2]"
145 . 1 112 ALA C 1 113 VAL N 1 113 VAL CA 1 113 VAL C -77.00 -53.00 -69.20 -77.48 -61.81 0.48 19 0 "[ . 1 . 2]"
146 . 1 113 VAL N 1 113 VAL CA 1 113 VAL C 1 114 LYS N -53.00 -33.00 -42.25 -50.35 -32.76 0.24 10 0 "[ . 1 . 2]"
147 . 1 113 VAL C 1 114 LYS N 1 114 LYS CA 1 114 LYS C -73.00 -51.00 -57.00 -61.13 -54.31 . . 0 "[ . 1 . 2]"
148 . 1 114 LYS N 1 114 LYS CA 1 114 LYS C 1 115 ASP N -55.00 -29.00 -43.08 -49.03 -37.67 . . 0 "[ . 1 . 2]"
149 . 1 114 LYS C 1 115 ASP N 1 115 ASP CA 1 115 ASP C -75.00 -53.00 -65.59 -72.93 -60.01 . . 0 "[ . 1 . 2]"
150 . 1 115 ASP N 1 115 ASP CA 1 115 ASP C 1 116 GLU N -51.00 -31.00 -45.21 -43.30 -45.68 1.87 8 0 "[ . 1 . 2]"
151 . 1 115 ASP C 1 116 GLU N 1 116 GLU CA 1 116 GLU C -81.00 -55.00 -63.04 -64.33 -66.86 0.51 4 0 "[ . 1 . 2]"
152 . 1 116 GLU N 1 116 GLU CA 1 116 GLU C 1 117 ILE N -53.00 -27.00 -40.65 -53.40 -25.99 1.01 9 0 "[ . 1 . 2]"
153 . 1 116 GLU C 1 117 ILE N 1 117 ILE CA 1 117 ILE C -91.00 -47.00 -60.63 -60.49 -61.23 . . 0 "[ . 1 . 2]"
154 . 1 117 ILE N 1 117 ILE CA 1 117 ILE C 1 118 ALA N -53.00 -31.00 -47.09 -53.06 -39.80 0.06 9 0 "[ . 1 . 2]"
155 . 1 119 ARG C 1 120 GLU N 1 120 GLU CA 1 120 GLU C -108.00 -52.00 -72.59 -74.44 -80.58 . . 0 "[ . 1 . 2]"
156 . 1 120 GLU N 1 120 GLU CA 1 120 GLU C 1 121 ASP N -64.00 24.00 -45.85 -38.06 -41.72 0.47 19 0 "[ . 1 . 2]"
157 . 1 26 GLU C 1 27 GLY N 1 27 GLY CA 1 27 GLY C 45.00 -45.00 87.27 48.41 -44.87 0.13 1 0 "[ . 1 . 2]"
158 . 1 56 GLU C 1 57 GLY N 1 57 GLY CA 1 57 GLY C 45.00 -45.00 -68.08 -69.36 -69.72 . . 0 "[ . 1 . 2]"
159 . 1 57 GLY N 1 57 GLY CA 1 57 GLY C 1 58 ALA N -115.00 115.00 -42.75 -42.66 -43.23 . . 0 "[ . 1 . 2]"
160 . 1 61 LEU C 1 62 ILE N 1 62 ILE CA 1 62 ILE C 45.00 -45.00 -72.92 -81.63 -67.61 . . 0 "[ . 1 . 2]"
161 . 1 61 LEU C 1 62 ILE N 1 62 ILE CA 1 62 ILE C -155.00 75.00 -72.92 -81.63 -67.61 . . 0 "[ . 1 . 2]"
162 . 1 62 ILE N 1 62 ILE CA 1 62 ILE C 1 63 LYS N -85.00 105.00 -18.76 -35.39 -2.14 . . 0 "[ . 1 . 2]"
163 . 1 63 LYS C 1 64 VAL N 1 64 VAL CA 1 64 VAL C -145.00 -45.00 -78.98 -95.99 -61.00 . . 0 "[ . 1 . 2]"
164 . 1 64 VAL N 1 64 VAL CA 1 64 VAL C 1 65 ARG N -85.00 5.00 -48.38 -50.54 -51.92 . . 0 "[ . 1 . 2]"
165 . 1 76 GLU C 1 77 ALA N 1 77 ALA CA 1 77 ALA C 45.00 -45.00 -71.05 -79.59 -63.06 . . 0 "[ . 1 . 2]"
166 . 1 76 GLU C 1 77 ALA N 1 77 ALA CA 1 77 ALA C 175.00 75.00 -71.05 -79.59 -63.06 . . 0 "[ . 1 . 2]"
167 . 1 77 ALA N 1 77 ALA CA 1 77 ALA C 1 78 VAL N -85.00 85.00 -43.87 -44.42 -45.15 . . 0 "[ . 1 . 2]"
168 . 1 87 LEU C 1 88 GLN N 1 88 GLN CA 1 88 GLN C 45.00 -45.00 -70.16 -92.00 -52.06 . . 0 "[ . 1 . 2]"
169 . 1 87 LEU C 1 88 GLN N 1 88 GLN CA 1 88 GLN C 175.00 75.00 -70.16 -92.00 -52.06 . . 0 "[ . 1 . 2]"
170 . 1 88 GLN N 1 88 GLN CA 1 88 GLN C 1 89 SER N -85.00 145.00 -19.09 -24.38 -26.54 . . 0 "[ . 1 . 2]"
171 . 1 117 ILE C 1 118 ALA N 1 118 ALA CA 1 118 ALA C 45.00 -45.00 -73.62 -69.89 -71.75 . . 0 "[ . 1 . 2]"
172 . 1 117 ILE C 1 118 ALA N 1 118 ALA CA 1 118 ALA C 175.00 75.00 -73.62 -69.89 -71.75 . . 0 "[ . 1 . 2]"
173 . 1 118 ALA N 1 118 ALA CA 1 118 ALA C 1 119 ARG N -85.00 95.00 -20.69 -31.38 -6.64 . . 0 "[ . 1 . 2]"
174 . 1 118 ALA C 1 119 ARG N 1 119 ARG CA 1 119 ARG C 45.00 -45.00 -78.82 -68.73 -70.30 . . 0 "[ . 1 . 2]"
175 . 1 118 ALA C 1 119 ARG N 1 119 ARG CA 1 119 ARG C 175.00 65.00 -78.82 -68.73 -70.30 . . 0 "[ . 1 . 2]"
176 . 1 119 ARG N 1 119 ARG CA 1 119 ARG C 1 120 GLU N -85.00 -165.00 -34.94 -55.32 5.22 . . 0 "[ . 1 . 2]"
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