NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
452012 |
2rq5   |
cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2rq5
save_distance_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 166
_TA_constraint_stats_list.Viol_count 676
_TA_constraint_stats_list.Viol_total 5156.15
_TA_constraint_stats_list.Viol_max 1.90
_TA_constraint_stats_list.Viol_rms 0.23
_TA_constraint_stats_list.Viol_average_all_restraints 0.08
_TA_constraint_stats_list.Viol_average_violations_only 0.38
_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 12 PRO C 1 13 ASN N 1 13 ASN CA 1 13 ASN C -77.00 -55.40 -65.50 -71.87 -58.61 . . 0 "[ . 1 . 2]"
2 . 1 13 ASN N 1 13 ASN CA 1 13 ASN C 1 14 VAL N -52.70 -20.90 -36.31 -34.91 -35.86 0.26 5 0 "[ . 1 . 2]"
3 . 1 13 ASN C 1 14 VAL N 1 14 VAL CA 1 14 VAL C -75.70 -53.90 -72.11 -73.30 -74.96 0.34 13 0 "[ . 1 . 2]"
4 . 1 14 VAL N 1 14 VAL CA 1 14 VAL C 1 15 GLN N -54.90 -32.10 -40.56 -45.93 -35.01 . . 0 "[ . 1 . 2]"
5 . 1 14 VAL C 1 15 GLN N 1 15 GLN CA 1 15 GLN C -72.50 -52.50 -60.89 -60.95 -62.10 . . 0 "[ . 1 . 2]"
6 . 1 15 GLN N 1 15 GLN CA 1 15 GLN C 1 16 ARG N -50.40 -30.40 -41.82 -50.39 -34.59 . . 0 "[ . 1 . 2]"
7 . 1 15 GLN C 1 16 ARG N 1 16 ARG CA 1 16 ARG C -82.30 -51.90 -64.47 -70.68 -57.06 . . 0 "[ . 1 . 2]"
8 . 1 16 ARG N 1 16 ARG CA 1 16 ARG C 1 17 LEU N -50.70 -30.70 -48.86 -50.93 -39.77 0.23 13 0 "[ . 1 . 2]"
9 . 1 16 ARG C 1 17 LEU N 1 17 LEU CA 1 17 LEU C -73.70 -53.10 -63.52 -62.54 -63.28 . . 0 "[ . 1 . 2]"
10 . 1 17 LEU N 1 17 LEU CA 1 17 LEU C 1 18 ALA N -56.60 -26.40 -32.01 -29.97 -30.74 . . 0 "[ . 1 . 2]"
11 . 1 17 LEU C 1 18 ALA N 1 18 ALA CA 1 18 ALA C -73.90 -53.90 -71.30 -70.98 -71.40 0.14 7 0 "[ . 1 . 2]"
12 . 1 18 ALA N 1 18 ALA CA 1 18 ALA C 1 19 CYS N -54.00 -18.00 -49.44 -46.87 -48.26 0.06 10 0 "[ . 1 . 2]"
13 . 1 18 ALA C 1 19 CYS N 1 19 CYS CA 1 19 CYS C -77.20 -57.20 -59.40 -70.02 -56.92 0.28 13 0 "[ . 1 . 2]"
14 . 1 19 CYS N 1 19 CYS CA 1 19 CYS C 1 20 ILE N -57.40 -26.40 -44.89 -38.85 -41.83 . . 0 "[ . 1 . 2]"
15 . 1 19 CYS C 1 20 ILE N 1 20 ILE CA 1 20 ILE C -72.60 -52.60 -64.74 -69.28 -58.92 . . 0 "[ . 1 . 2]"
16 . 1 20 ILE N 1 20 ILE CA 1 20 ILE C 1 21 LYS N -58.60 -33.00 -42.30 -54.01 -35.46 . . 0 "[ . 1 . 2]"
17 . 1 20 ILE C 1 21 LYS N 1 21 LYS CA 1 21 LYS C -69.20 -49.20 -62.81 -66.24 -59.81 . . 0 "[ . 1 . 2]"
18 . 1 21 LYS N 1 21 LYS CA 1 21 LYS C 1 22 LYS N -52.70 -32.70 -42.78 -40.48 -43.87 0.29 12 0 "[ . 1 . 2]"
19 . 1 21 LYS C 1 22 LYS N 1 22 LYS CA 1 22 LYS C -73.10 -53.10 -62.60 -67.35 -56.58 . . 0 "[ . 1 . 2]"
20 . 1 22 LYS N 1 22 LYS CA 1 22 LYS C 1 23 HIS N -54.10 -34.10 -42.78 -50.96 -38.17 . . 0 "[ . 1 . 2]"
21 . 1 22 LYS C 1 23 HIS N 1 23 HIS CA 1 23 HIS C -74.70 -53.30 -69.41 -71.67 -72.78 . . 0 "[ . 1 . 2]"
22 . 1 23 HIS N 1 23 HIS CA 1 23 HIS C 1 24 LEU N -65.50 -25.30 -41.82 -39.84 -40.89 . . 0 "[ . 1 . 2]"
23 . 1 23 HIS C 1 24 LEU N 1 24 LEU CA 1 24 LEU C -76.00 -56.00 -56.79 -58.33 -55.73 0.27 5 0 "[ . 1 . 2]"
24 . 1 24 LEU N 1 24 LEU CA 1 24 LEU C 1 25 ARG N -49.80 -29.80 -49.42 -49.82 -49.84 0.40 20 0 "[ . 1 . 2]"
25 . 1 24 LEU C 1 25 ARG N 1 25 ARG CA 1 25 ARG C -78.20 -51.00 -64.18 -67.01 -68.34 . . 0 "[ . 1 . 2]"
26 . 1 25 ARG N 1 25 ARG CA 1 25 ARG C 1 26 SER N -53.30 -17.30 -41.22 -44.12 -38.77 . . 0 "[ . 1 . 2]"
27 . 1 25 ARG C 1 26 SER N 1 26 SER CA 1 26 SER C -73.60 -53.60 -73.62 -73.89 -72.58 0.29 10 0 "[ . 1 . 2]"
28 . 1 26 SER N 1 26 SER CA 1 26 SER C 1 27 GLN N -44.80 -11.60 -14.77 -20.38 -11.50 0.10 20 0 "[ . 1 . 2]"
29 . 1 28 GLY C 1 29 ILE N 1 29 ILE CA 1 29 ILE C -152.60 -62.80 -105.32 -108.16 -108.44 . . 0 "[ . 1 . 2]"
30 . 1 29 ILE N 1 29 ILE CA 1 29 ILE C 1 30 THR N 104.90 154.70 105.45 104.75 104.71 0.31 19 0 "[ . 1 . 2]"
31 . 1 35 PRO C 1 36 LEU N 1 36 LEU CA 1 36 LEU C -144.00 -60.60 -131.97 -131.31 -133.75 0.39 13 0 "[ . 1 . 2]"
32 . 1 36 LEU N 1 36 LEU CA 1 36 LEU C 1 37 ILE N 121.80 166.40 151.86 149.52 154.96 . . 0 "[ . 1 . 2]"
33 . 1 36 LEU C 1 37 ILE N 1 37 ILE CA 1 37 ILE C -149.50 -56.30 -149.20 -149.68 -149.74 0.44 17 0 "[ . 1 . 2]"
34 . 1 37 ILE N 1 37 ILE CA 1 37 ILE C 1 38 GLY N 94.80 172.40 133.19 130.15 134.20 . . 0 "[ . 1 . 2]"
35 . 1 39 GLY C 1 40 CYS N 1 40 CYS CA 1 40 CYS C -146.40 -67.20 -132.17 -134.38 -129.58 . . 0 "[ . 1 . 2]"
36 . 1 40 CYS N 1 40 CYS CA 1 40 CYS C 1 41 GLU N 111.70 164.30 162.95 163.76 163.30 0.08 2 0 "[ . 1 . 2]"
37 . 1 40 CYS C 1 41 GLU N 1 41 GLU CA 1 41 GLU C -107.80 -48.60 -79.42 -77.69 -77.77 . . 0 "[ . 1 . 2]"
38 . 1 41 GLU N 1 41 GLU CA 1 41 GLU C 1 42 LEU N 102.30 148.50 144.19 145.52 145.21 . . 0 "[ . 1 . 2]"
39 . 1 41 GLU C 1 42 LEU N 1 42 LEU CA 1 42 LEU C -136.80 -70.40 -134.96 -135.00 -135.11 . . 0 "[ . 1 . 2]"
40 . 1 42 LEU N 1 42 LEU CA 1 42 LEU C 1 43 ASP N 102.80 144.00 145.05 144.72 145.40 1.40 13 0 "[ . 1 . 2]"
41 . 1 43 ASP C 1 44 LEU N 1 44 LEU CA 1 44 LEU C -72.80 -52.20 -53.59 -52.23 -52.37 0.23 4 0 "[ . 1 . 2]"
42 . 1 44 LEU N 1 44 LEU CA 1 44 LEU C 1 45 ALA N -54.90 2.70 -37.75 -36.07 -37.77 . . 0 "[ . 1 . 2]"
43 . 1 44 LEU C 1 45 ALA N 1 45 ALA CA 1 45 ALA C -79.30 -53.30 -64.89 -71.69 -59.19 . . 0 "[ . 1 . 2]"
44 . 1 45 ALA N 1 45 ALA CA 1 45 ALA C 1 46 CYS N -47.10 -27.10 -44.96 -47.57 -43.16 0.47 16 0 "[ . 1 . 2]"
45 . 1 45 ALA C 1 46 CYS N 1 46 CYS CA 1 46 CYS C -76.80 -56.20 -69.15 -68.55 -68.90 . . 0 "[ . 1 . 2]"
46 . 1 46 CYS N 1 46 CYS CA 1 46 CYS C 1 47 PHE N -45.60 -15.00 -36.18 -37.58 -38.22 . . 0 "[ . 1 . 2]"
47 . 1 46 CYS C 1 47 PHE N 1 47 PHE CA 1 47 PHE C -119.20 -43.80 -69.54 -68.54 -68.70 . . 0 "[ . 1 . 2]"
48 . 1 47 PHE N 1 47 PHE CA 1 47 PHE C 1 48 PHE N -70.20 33.60 -45.47 -45.16 -45.85 . . 0 "[ . 1 . 2]"
49 . 1 47 PHE C 1 48 PHE N 1 48 PHE CA 1 48 PHE C -73.40 -52.40 -59.11 -61.39 -56.52 . . 0 "[ . 1 . 2]"
50 . 1 48 PHE N 1 48 PHE CA 1 48 PHE C 1 49 ARG N -52.70 -28.90 -49.17 -48.73 -48.79 0.11 8 0 "[ . 1 . 2]"
51 . 1 48 PHE C 1 49 ARG N 1 49 ARG CA 1 49 ARG C -75.30 -49.30 -60.36 -60.20 -60.66 . . 0 "[ . 1 . 2]"
52 . 1 49 ARG N 1 49 ARG CA 1 49 ARG C 1 50 LEU N -51.20 -30.20 -42.80 -45.52 -40.14 . . 0 "[ . 1 . 2]"
53 . 1 49 ARG C 1 50 LEU N 1 50 LEU CA 1 50 LEU C -75.60 -52.00 -57.46 -57.16 -57.44 . . 0 "[ . 1 . 2]"
54 . 1 50 LEU N 1 50 LEU CA 1 50 LEU C 1 51 ILE N -62.50 -25.10 -48.30 -50.45 -51.00 . . 0 "[ . 1 . 2]"
55 . 1 50 LEU C 1 51 ILE N 1 51 ILE CA 1 51 ILE C -76.90 -56.90 -59.23 -69.01 -56.71 0.19 8 0 "[ . 1 . 2]"
56 . 1 51 ILE N 1 51 ILE CA 1 51 ILE C 1 52 ASN N -52.60 -32.60 -44.98 -44.71 -45.09 . . 0 "[ . 1 . 2]"
57 . 1 51 ILE C 1 52 ASN N 1 52 ASN CA 1 52 ASN C -70.70 -50.50 -63.37 -66.88 -59.79 . . 0 "[ . 1 . 2]"
58 . 1 52 ASN N 1 52 ASN CA 1 52 ASN C 1 53 GLU N -54.70 -21.10 -43.91 -47.52 -38.08 . . 0 "[ . 1 . 2]"
59 . 1 52 ASN C 1 53 GLU N 1 53 GLU CA 1 53 GLU C -75.50 -55.50 -64.90 -56.32 -61.15 0.37 7 0 "[ . 1 . 2]"
60 . 1 53 GLU N 1 53 GLU CA 1 53 GLU C 1 54 MET N -48.40 -9.60 -18.05 -40.71 -9.54 0.06 16 0 "[ . 1 . 2]"
61 . 1 53 GLU C 1 54 MET N 1 54 MET CA 1 54 MET C -111.90 -63.50 -91.17 -90.20 -91.86 . . 0 "[ . 1 . 2]"
62 . 1 54 MET N 1 54 MET CA 1 54 MET C 1 55 GLY N -27.10 36.50 25.88 -27.22 36.67 0.17 12 0 "[ . 1 . 2]"
63 . 1 56 GLY C 1 57 MET N 1 57 MET CA 1 57 MET C -73.00 -39.80 -70.66 -73.13 -63.83 0.13 19 0 "[ . 1 . 2]"
64 . 1 57 MET N 1 57 MET CA 1 57 MET C 1 58 GLN N -60.70 -20.90 -32.96 -36.69 -37.47 . . 0 "[ . 1 . 2]"
65 . 1 57 MET C 1 58 GLN N 1 58 GLN CA 1 58 GLN C -74.30 -50.70 -55.05 -59.10 -50.37 0.33 3 0 "[ . 1 . 2]"
66 . 1 58 GLN N 1 58 GLN CA 1 58 GLN C 1 59 GLN N -49.50 -29.50 -45.99 -42.78 -43.64 . . 0 "[ . 1 . 2]"
67 . 1 58 GLN C 1 59 GLN N 1 59 GLN CA 1 59 GLN C -81.20 -57.40 -64.37 -65.23 -65.85 . . 0 "[ . 1 . 2]"
68 . 1 59 GLN N 1 59 GLN CA 1 59 GLN C 1 60 VAL N -52.60 -24.20 -50.89 -45.14 -50.63 0.21 6 0 "[ . 1 . 2]"
69 . 1 59 GLN C 1 60 VAL N 1 60 VAL CA 1 60 VAL C -76.80 -49.40 -51.26 -61.81 -49.02 0.38 17 0 "[ . 1 . 2]"
70 . 1 60 VAL N 1 60 VAL CA 1 60 VAL C 1 61 THR N -55.60 -33.60 -55.18 -55.89 -52.66 0.29 15 0 "[ . 1 . 2]"
71 . 1 60 VAL C 1 61 THR N 1 61 THR CA 1 61 THR C -75.30 -55.50 -76.15 -76.09 -76.15 1.14 6 0 "[ . 1 . 2]"
72 . 1 61 THR N 1 61 THR CA 1 61 THR C 1 62 ASP N -54.10 -24.70 -51.32 -54.30 -47.30 0.20 11 0 "[ . 1 . 2]"
73 . 1 61 THR C 1 62 ASP N 1 62 ASP CA 1 62 ASP C -76.80 -54.20 -61.11 -57.32 -58.56 . . 0 "[ . 1 . 2]"
74 . 1 62 ASP N 1 62 ASP CA 1 62 ASP C 1 63 LEU N -50.90 -9.50 -51.15 -51.11 -51.14 0.51 20 0 "[ . 1 . 2]"
75 . 1 62 ASP C 1 63 LEU N 1 63 LEU CA 1 63 LEU C -113.60 -73.00 -77.74 -75.00 -75.96 . . 0 "[ . 1 . 2]"
76 . 1 63 LEU N 1 63 LEU CA 1 63 LEU C 1 64 LYS N -12.70 33.50 2.50 -1.81 10.87 . . 0 "[ . 1 . 2]"
77 . 1 65 LYS C 1 66 TRP N 1 66 TRP CA 1 66 TRP C -69.50 -49.50 -59.59 -65.05 -55.75 . . 0 "[ . 1 . 2]"
78 . 1 66 TRP N 1 66 TRP CA 1 66 TRP C 1 67 ASN N -60.00 -23.00 -28.66 -29.80 -29.85 0.27 16 0 "[ . 1 . 2]"
79 . 1 66 TRP C 1 67 ASN N 1 67 ASN CA 1 67 ASN C -71.20 -50.20 -56.47 -59.16 -54.56 . . 0 "[ . 1 . 2]"
80 . 1 67 ASN N 1 67 ASN CA 1 67 ASN C 1 68 LYS N -53.10 -26.70 -43.53 -41.59 -41.70 . . 0 "[ . 1 . 2]"
81 . 1 67 ASN C 1 68 LYS N 1 68 LYS CA 1 68 LYS C -80.40 -54.20 -76.92 -77.52 -77.69 . . 0 "[ . 1 . 2]"
82 . 1 68 LYS N 1 68 LYS CA 1 68 LYS C 1 69 LEU N -50.90 -30.90 -51.42 -51.75 -51.76 1.05 11 0 "[ . 1 . 2]"
83 . 1 68 LYS C 1 69 LEU N 1 69 LEU CA 1 69 LEU C -74.30 -52.90 -56.07 -57.48 -58.06 . . 0 "[ . 1 . 2]"
84 . 1 69 LEU N 1 69 LEU CA 1 69 LEU C 1 70 ALA N -55.50 -31.10 -40.87 -40.07 -40.29 . . 0 "[ . 1 . 2]"
85 . 1 69 LEU C 1 70 ALA N 1 70 ALA CA 1 70 ALA C -71.50 -51.50 -71.58 -71.94 -70.27 0.44 18 0 "[ . 1 . 2]"
86 . 1 70 ALA N 1 70 ALA CA 1 70 ALA C 1 71 ASP N -50.90 -30.30 -34.10 -35.06 -35.64 0.29 17 0 "[ . 1 . 2]"
87 . 1 70 ALA C 1 71 ASP N 1 71 ASP CA 1 71 ASP C -73.90 -53.30 -53.50 -55.44 -52.87 0.43 16 0 "[ . 1 . 2]"
88 . 1 71 ASP N 1 71 ASP CA 1 71 ASP C 1 72 MET N -51.80 -25.20 -48.60 -47.78 -48.08 . . 0 "[ . 1 . 2]"
89 . 1 71 ASP C 1 72 MET N 1 72 MET CA 1 72 MET C -73.90 -53.90 -64.05 -66.30 -60.53 . . 0 "[ . 1 . 2]"
90 . 1 72 MET N 1 72 MET CA 1 72 MET C 1 73 LEU N -53.80 -5.40 -21.77 -21.57 -22.21 . . 0 "[ . 1 . 2]"
91 . 1 72 MET C 1 73 LEU N 1 73 LEU CA 1 73 LEU C -108.40 -78.40 -79.71 -84.71 -78.15 0.25 8 0 "[ . 1 . 2]"
92 . 1 73 LEU N 1 73 LEU CA 1 73 LEU C 1 74 ARG N -7.40 28.40 -2.11 -2.85 -2.99 . . 0 "[ . 1 . 2]"
93 . 1 73 LEU C 1 74 ARG N 1 74 ARG CA 1 74 ARG C 41.80 80.80 70.88 70.86 70.63 . . 0 "[ . 1 . 2]"
94 . 1 74 ARG N 1 74 ARG CA 1 74 ARG C 1 75 ILE N -0.40 71.60 71.82 71.76 71.74 0.43 12 0 "[ . 1 . 2]"
95 . 1 74 ARG C 1 75 ILE N 1 75 ILE CA 1 75 ILE C -143.10 -49.10 -125.29 -134.24 -118.78 . . 0 "[ . 1 . 2]"
96 . 1 75 ILE N 1 75 ILE CA 1 75 ILE C 1 76 PRO N 76.80 -174.80 138.52 135.57 142.43 . . 0 "[ . 1 . 2]"
97 . 1 76 PRO C 1 77 LYS N 1 77 LYS CA 1 77 LYS C -69.60 -49.60 -69.70 -69.87 -69.91 0.94 11 0 "[ . 1 . 2]"
98 . 1 77 LYS N 1 77 LYS CA 1 77 LYS C 1 78 THR N -57.00 -0.40 -20.00 -20.47 -21.59 . . 0 "[ . 1 . 2]"
99 . 1 77 LYS C 1 78 THR N 1 78 THR CA 1 78 THR C -135.50 -65.50 -65.50 -65.42 -65.46 0.27 16 0 "[ . 1 . 2]"
100 . 1 78 THR N 1 78 THR CA 1 78 THR C 1 79 ALA N -23.70 23.10 -22.55 -24.00 -18.52 0.30 2 0 "[ . 1 . 2]"
101 . 1 78 THR C 1 79 ALA N 1 79 ALA CA 1 79 ALA C -101.70 -45.50 -76.45 -88.46 -64.64 . . 0 "[ . 1 . 2]"
102 . 1 79 ALA N 1 79 ALA CA 1 79 ALA C 1 80 GLN N 76.20 177.60 110.31 100.16 117.65 . . 0 "[ . 1 . 2]"
103 . 1 79 ALA C 1 80 GLN N 1 80 GLN CA 1 80 GLN C -82.90 -48.10 -75.75 -76.18 -83.06 0.54 1 0 "[ . 1 . 2]"
104 . 1 80 GLN N 1 80 GLN CA 1 80 GLN C 1 81 ASP N -68.20 21.20 -44.82 -68.93 7.83 0.73 10 0 "[ . 1 . 2]"
105 . 1 81 ASP C 1 82 ARG N 1 82 ARG CA 1 82 ARG C -81.10 -42.70 -50.30 -50.32 -51.91 . . 0 "[ . 1 . 2]"
106 . 1 82 ARG N 1 82 ARG CA 1 82 ARG C 1 83 LEU N -59.70 -31.10 -36.78 -46.72 -32.07 . . 0 "[ . 1 . 2]"
107 . 1 82 ARG C 1 83 LEU N 1 83 LEU CA 1 83 LEU C -70.20 -50.20 -66.27 -60.99 -63.15 0.40 13 0 "[ . 1 . 2]"
108 . 1 83 LEU N 1 83 LEU CA 1 83 LEU C 1 84 ALA N -57.20 -27.00 -47.81 -50.39 -52.64 . . 0 "[ . 1 . 2]"
109 . 1 83 LEU C 1 84 ALA N 1 84 ALA CA 1 84 ALA C -71.90 -49.10 -71.90 -72.42 -69.36 0.52 11 0 "[ . 1 . 2]"
110 . 1 84 ALA N 1 84 ALA CA 1 84 ALA C 1 85 LYS N -52.50 -30.70 -38.17 -39.65 -36.48 . . 0 "[ . 1 . 2]"
111 . 1 84 ALA C 1 85 LYS N 1 85 LYS CA 1 85 LYS C -75.80 -55.80 -63.77 -65.67 -61.71 . . 0 "[ . 1 . 2]"
112 . 1 85 LYS N 1 85 LYS CA 1 85 LYS C 1 86 LEU N -52.30 -28.70 -40.34 -42.96 -37.36 . . 0 "[ . 1 . 2]"
113 . 1 85 LYS C 1 86 LEU N 1 86 LEU CA 1 86 LEU C -78.80 -55.60 -65.98 -72.95 -63.37 . . 0 "[ . 1 . 2]"
114 . 1 86 LEU N 1 86 LEU CA 1 86 LEU C 1 87 GLN N -52.00 -32.00 -44.33 -45.34 -47.04 . . 0 "[ . 1 . 2]"
115 . 1 86 LEU C 1 87 GLN N 1 87 GLN CA 1 87 GLN C -78.20 -55.60 -55.77 -57.85 -55.19 0.41 8 0 "[ . 1 . 2]"
116 . 1 87 GLN N 1 87 GLN CA 1 87 GLN C 1 88 GLU N -57.90 -15.70 -46.60 -48.03 -49.01 . . 0 "[ . 1 . 2]"
117 . 1 87 GLN C 1 88 GLU N 1 88 GLU CA 1 88 GLU C -77.10 -54.10 -76.87 -77.60 -74.14 0.50 16 0 "[ . 1 . 2]"
118 . 1 88 GLU N 1 88 GLU CA 1 88 GLU C 1 89 ALA N -50.60 -30.40 -29.66 -29.49 -29.61 1.03 9 0 "[ . 1 . 2]"
119 . 1 88 GLU C 1 89 ALA N 1 89 ALA CA 1 89 ALA C -77.80 -57.20 -67.47 -68.94 -66.42 . . 0 "[ . 1 . 2]"
120 . 1 89 ALA N 1 89 ALA CA 1 89 ALA C 1 90 TYR N -50.80 -23.60 -38.36 -40.68 -36.83 . . 0 "[ . 1 . 2]"
121 . 1 89 ALA C 1 90 TYR N 1 90 TYR CA 1 90 TYR C -86.40 -47.60 -85.10 -84.99 -85.38 0.20 5 0 "[ . 1 . 2]"
122 . 1 90 TYR N 1 90 TYR CA 1 90 TYR C 1 91 CYS N -56.30 -25.50 -34.46 -35.08 -36.31 . . 0 "[ . 1 . 2]"
123 . 1 90 TYR C 1 91 CYS N 1 91 CYS CA 1 91 CYS C -71.10 -51.10 -64.13 -69.45 -58.86 . . 0 "[ . 1 . 2]"
124 . 1 91 CYS N 1 91 CYS CA 1 91 CYS C 1 92 GLN N -50.70 -30.70 -30.68 -30.54 -30.57 0.46 12 0 "[ . 1 . 2]"
125 . 1 91 CYS C 1 92 GLN N 1 92 GLN CA 1 92 GLN C -100.90 -51.10 -98.07 -101.14 -93.53 0.24 9 0 "[ . 1 . 2]"
126 . 1 92 GLN N 1 92 GLN CA 1 92 GLN C 1 93 TYR N -66.50 3.30 -3.31 -3.49 -4.57 . . 0 "[ . 1 . 2]"
127 . 1 94 LEU C 1 95 LEU N 1 95 LEU CA 1 95 LEU C -83.50 -47.50 -52.76 -58.23 -61.64 0.06 14 0 "[ . 1 . 2]"
128 . 1 95 LEU N 1 95 LEU CA 1 95 LEU C 1 96 SER N -56.60 -14.60 -48.98 -55.34 -56.03 0.34 10 0 "[ . 1 . 2]"
129 . 1 95 LEU C 1 96 SER N 1 96 SER CA 1 96 SER C -74.70 -54.70 -56.65 -54.60 -54.63 0.42 14 0 "[ . 1 . 2]"
130 . 1 96 SER N 1 96 SER CA 1 96 SER C 1 97 TYR N -54.80 -13.80 -52.95 -55.00 -55.19 1.07 12 0 "[ . 1 . 2]"
131 . 1 96 SER C 1 97 TYR N 1 97 TYR CA 1 97 TYR C -88.70 -47.30 -58.80 -58.40 -59.59 0.49 4 0 "[ . 1 . 2]"
132 . 1 97 TYR N 1 97 TYR CA 1 97 TYR C 1 98 ASP N -53.10 -29.50 -35.96 -50.32 -51.11 0.63 7 0 "[ . 1 . 2]"
133 . 1 97 TYR C 1 98 ASP N 1 98 ASP CA 1 98 ASP C -96.80 -49.20 -85.79 -58.78 -58.80 0.19 7 0 "[ . 1 . 2]"
134 . 1 98 ASP N 1 98 ASP CA 1 98 ASP C 1 99 SER N -59.70 3.10 -9.66 -27.12 1.61 . . 0 "[ . 1 . 2]"
135 . 1 102 PRO C 1 103 GLU N 1 103 GLU CA 1 103 GLU C -77.60 -49.00 -61.00 -75.98 -48.86 0.14 7 0 "[ . 1 . 2]"
136 . 1 103 GLU N 1 103 GLU CA 1 103 GLU C 1 104 GLU N -56.50 -30.30 -52.94 -53.60 -53.97 0.28 6 0 "[ . 1 . 2]"
137 . 1 103 GLU C 1 104 GLU N 1 104 GLU CA 1 104 GLU C -76.70 -56.70 -60.72 -59.34 -59.71 . . 0 "[ . 1 . 2]"
138 . 1 104 GLU N 1 104 GLU CA 1 104 GLU C 1 105 HIS N -52.30 -26.50 -26.51 -26.06 -26.17 1.09 6 0 "[ . 1 . 2]"
139 . 1 104 GLU C 1 105 HIS N 1 105 HIS CA 1 105 HIS C -75.40 -55.40 -75.33 -76.14 -70.03 0.74 19 0 "[ . 1 . 2]"
140 . 1 105 HIS N 1 105 HIS CA 1 105 HIS C 1 106 ARG N -53.00 -33.00 -54.19 -54.79 -53.62 1.79 6 0 "[ . 1 . 2]"
141 . 1 105 HIS C 1 106 ARG N 1 106 ARG CA 1 106 ARG C -79.40 -57.00 -62.52 -66.22 -59.53 . . 0 "[ . 1 . 2]"
142 . 1 106 ARG N 1 106 ARG CA 1 106 ARG C 1 107 ARG N -49.70 -29.70 -40.62 -38.04 -40.31 . . 0 "[ . 1 . 2]"
143 . 1 106 ARG C 1 107 ARG N 1 107 ARG CA 1 107 ARG C -78.30 -58.30 -67.11 -77.15 -64.06 . . 0 "[ . 1 . 2]"
144 . 1 107 ARG N 1 107 ARG CA 1 107 ARG C 1 108 LEU N -53.70 -28.90 -54.00 -54.36 -51.57 0.66 15 0 "[ . 1 . 2]"
145 . 1 107 ARG C 1 108 LEU N 1 108 LEU CA 1 108 LEU C -70.60 -50.60 -63.33 -63.13 -63.64 . . 0 "[ . 1 . 2]"
146 . 1 108 LEU N 1 108 LEU CA 1 108 LEU C 1 109 GLU N -51.70 -31.70 -40.16 -40.29 -40.62 . . 0 "[ . 1 . 2]"
147 . 1 108 LEU C 1 109 GLU N 1 109 GLU CA 1 109 GLU C -73.50 -53.50 -67.70 -65.95 -66.82 . . 0 "[ . 1 . 2]"
148 . 1 109 GLU N 1 109 GLU CA 1 109 GLU C 1 110 LYS N -53.30 -32.70 -54.14 -54.59 -53.78 1.29 2 0 "[ . 1 . 2]"
149 . 1 109 GLU C 1 110 LYS N 1 110 LYS CA 1 110 LYS C -70.80 -50.80 -51.55 -51.26 -51.80 0.65 9 0 "[ . 1 . 2]"
150 . 1 110 LYS N 1 110 LYS CA 1 110 LYS C 1 111 GLU N -56.30 -30.90 -33.88 -36.76 -30.91 . . 0 "[ . 1 . 2]"
151 . 1 110 LYS C 1 111 GLU N 1 111 GLU CA 1 111 GLU C -75.60 -55.60 -69.55 -67.36 -67.51 . . 0 "[ . 1 . 2]"
152 . 1 111 GLU N 1 111 GLU CA 1 111 GLU C 1 112 VAL N -54.00 -30.20 -55.61 -55.85 -55.90 1.90 1 0 "[ . 1 . 2]"
153 . 1 111 GLU C 1 112 VAL N 1 112 VAL CA 1 112 VAL C -75.80 -55.80 -62.81 -63.44 -63.63 . . 0 "[ . 1 . 2]"
154 . 1 112 VAL N 1 112 VAL CA 1 112 VAL C 1 113 LEU N -54.80 -27.80 -53.85 -55.17 -50.75 0.37 14 0 "[ . 1 . 2]"
155 . 1 112 VAL C 1 113 LEU N 1 113 LEU CA 1 113 LEU C -71.70 -49.10 -51.81 -48.95 -49.00 0.41 3 0 "[ . 1 . 2]"
156 . 1 113 LEU N 1 113 LEU CA 1 113 LEU C 1 114 MET N -53.50 -28.70 -42.41 -46.43 -37.97 . . 0 "[ . 1 . 2]"
157 . 1 113 LEU C 1 114 MET N 1 114 MET CA 1 114 MET C -80.90 -50.10 -72.65 -75.38 -68.66 . . 0 "[ . 1 . 2]"
158 . 1 114 MET N 1 114 MET CA 1 114 MET C 1 115 GLU N -55.40 -24.20 -40.24 -42.00 -38.75 . . 0 "[ . 1 . 2]"
159 . 1 114 MET C 1 115 GLU N 1 115 GLU CA 1 115 GLU C -85.40 -51.20 -55.44 -60.52 -50.76 0.44 18 0 "[ . 1 . 2]"
160 . 1 115 GLU N 1 115 GLU CA 1 115 GLU C 1 116 LYS N -61.20 -20.60 -35.14 -33.64 -34.84 . . 0 "[ . 1 . 2]"
161 . 1 115 GLU C 1 116 LYS N 1 116 LYS CA 1 116 LYS C -86.00 -43.40 -85.59 -86.19 -79.12 0.19 17 0 "[ . 1 . 2]"
162 . 1 116 LYS N 1 116 LYS CA 1 116 LYS C 1 117 GLU N -59.00 -18.20 -39.46 -38.88 -39.83 . . 0 "[ . 1 . 2]"
163 . 1 116 LYS C 1 117 GLU N 1 117 GLU CA 1 117 GLU C -106.20 -38.20 -66.95 -73.50 -59.51 . . 0 "[ . 1 . 2]"
164 . 1 117 GLU N 1 117 GLU CA 1 117 GLU C 1 118 ILE N -62.40 -10.40 -52.06 -57.28 -47.55 . . 0 "[ . 1 . 2]"
165 . 1 117 GLU C 1 118 ILE N 1 118 ILE CA 1 118 ILE C -89.90 -43.50 -88.28 -89.82 -86.94 . . 0 "[ . 1 . 2]"
166 . 1 118 ILE N 1 118 ILE CA 1 118 ILE C 1 119 LEU N -78.90 11.50 11.61 11.62 11.61 0.26 10 0 "[ . 1 . 2]"
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