NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
632867 |
6mnl   |
30373 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_6mnl
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 193
_TA_constraint_stats_list.Viol_count 83
_TA_constraint_stats_list.Viol_total 1799.56
_TA_constraint_stats_list.Viol_max 4.37
_TA_constraint_stats_list.Viol_rms 0.22
_TA_constraint_stats_list.Viol_average_all_restraints 0.02
_TA_constraint_stats_list.Viol_average_violations_only 1.08
_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 . 2 17 LYS N 2 17 LYS CA 2 17 LYS C 2 18 VAL N -64.00 6.00 -53.79 -55.49 -55.96 0.11 15 0 "[ . 1 . 2]"
2 . 2 17 LYS C 2 18 VAL N 2 18 VAL CA 2 18 VAL C -94.00 -34.00 -55.27 -58.72 -50.77 . . 0 "[ . 1 . 2]"
3 . 2 18 VAL N 2 18 VAL CA 2 18 VAL C 2 19 SER N -79.00 -19.00 -39.78 -38.17 -40.00 . . 0 "[ . 1 . 2]"
4 . 2 18 VAL C 2 19 SER N 2 19 SER CA 2 19 SER C -96.00 -36.00 -60.81 -67.71 -58.01 . . 0 "[ . 1 . 2]"
5 . 2 19 SER N 2 19 SER CA 2 19 SER C 2 20 GLU N -69.00 -9.00 -32.95 -34.57 -38.17 . . 0 "[ . 1 . 2]"
6 . 2 19 SER C 2 20 GLU N 2 20 GLU CA 2 20 GLU C -95.00 -35.00 -71.96 -79.59 -66.25 . . 0 "[ . 1 . 2]"
7 . 2 20 GLU N 2 20 GLU CA 2 20 GLU C 2 21 GLN N -71.00 -11.00 -46.00 -57.47 -28.65 . . 0 "[ . 1 . 2]"
8 . 2 20 GLU C 2 21 GLN N 2 21 GLN CA 2 21 GLN C -95.00 -35.00 -58.18 -61.59 -63.90 . . 0 "[ . 1 . 2]"
9 . 2 21 GLN N 2 21 GLN CA 2 21 GLN C 2 22 LEU N -70.00 -10.00 -45.49 -46.45 -48.12 . . 0 "[ . 1 . 2]"
10 . 2 21 GLN C 2 22 LEU N 2 22 LEU CA 2 22 LEU C -97.00 -37.00 -63.16 -69.31 -58.84 . . 0 "[ . 1 . 2]"
11 . 2 22 LEU N 2 22 LEU CA 2 22 LEU C 2 23 LYS N -65.00 -5.00 -37.76 -48.18 -31.61 . . 0 "[ . 1 . 2]"
12 . 2 22 LEU C 2 23 LYS N 2 23 LYS CA 2 23 LYS C -95.00 -35.00 -64.07 -59.24 -59.34 . . 0 "[ . 1 . 2]"
13 . 2 23 LYS N 2 23 LYS CA 2 23 LYS C 2 24 CYS N -72.00 -12.00 -30.29 -38.80 -19.29 . . 0 "[ . 1 . 2]"
14 . 2 23 LYS C 2 24 CYS N 2 24 CYS CA 2 24 CYS C -96.00 -36.00 -66.67 -63.63 -64.52 . . 0 "[ . 1 . 2]"
15 . 2 24 CYS N 2 24 CYS CA 2 24 CYS C 2 25 CYS N -74.00 -14.00 -37.86 -42.04 -32.51 . . 0 "[ . 1 . 2]"
16 . 2 24 CYS C 2 25 CYS N 2 25 CYS CA 2 25 CYS C -91.00 -31.00 -66.26 -67.08 -67.73 . . 0 "[ . 1 . 2]"
17 . 2 25 CYS N 2 25 CYS CA 2 25 CYS C 2 26 SER N -73.00 -13.00 -33.03 -35.96 -27.05 . . 0 "[ . 1 . 2]"
18 . 2 25 CYS C 2 26 SER N 2 26 SER CA 2 26 SER C -92.00 -32.00 -62.01 -62.62 -62.94 . . 0 "[ . 1 . 2]"
19 . 2 26 SER N 2 26 SER CA 2 26 SER C 2 27 GLY N -74.00 -14.00 -43.63 -41.64 -42.19 . . 0 "[ . 1 . 2]"
20 . 2 26 SER C 2 27 GLY N 2 27 GLY CA 2 27 GLY C -94.00 -34.00 -55.79 -61.33 -53.14 . . 0 "[ . 1 . 2]"
21 . 2 27 GLY N 2 27 GLY CA 2 27 GLY C 2 28 ILE N -72.00 -12.00 -35.82 -39.47 -27.24 . . 0 "[ . 1 . 2]"
22 . 2 27 GLY C 2 28 ILE N 2 28 ILE CA 2 28 ILE C -96.00 -36.00 -67.30 -72.86 -65.28 . . 0 "[ . 1 . 2]"
23 . 2 28 ILE N 2 28 ILE CA 2 28 ILE C 2 29 LEU N -71.00 -11.00 -49.60 -51.35 -54.79 . . 0 "[ . 1 . 2]"
24 . 2 28 ILE C 2 29 LEU N 2 29 LEU CA 2 29 LEU C -95.00 -35.00 -66.72 -70.11 -60.98 . . 0 "[ . 1 . 2]"
25 . 2 29 LEU N 2 29 LEU CA 2 29 LEU C 2 30 LYS N -73.00 -13.00 -36.21 -39.27 -30.55 . . 0 "[ . 1 . 2]"
26 . 2 29 LEU C 2 30 LYS N 2 30 LYS CA 2 30 LYS C -93.00 -33.00 -58.13 -56.08 -57.20 . . 0 "[ . 1 . 2]"
27 . 2 30 LYS N 2 30 LYS CA 2 30 LYS C 2 31 GLU N -71.00 -11.00 -37.46 -38.45 -39.53 . . 0 "[ . 1 . 2]"
28 . 2 30 LYS C 2 31 GLU N 2 31 GLU CA 2 31 GLU C -97.00 -37.00 -72.18 -82.70 -61.96 . . 0 "[ . 1 . 2]"
29 . 2 31 GLU N 2 31 GLU CA 2 31 GLU C 2 32 MET N -69.00 -9.00 -45.56 -35.16 -38.18 . . 0 "[ . 1 . 2]"
30 . 2 31 GLU C 2 32 MET N 2 32 MET CA 2 32 MET C -93.00 -33.00 -70.41 -75.83 -62.95 . . 0 "[ . 1 . 2]"
31 . 2 32 MET N 2 32 MET CA 2 32 MET C 2 33 PHE N -73.00 -13.00 -15.28 -23.01 -10.95 2.05 12 0 "[ . 1 . 2]"
32 . 2 32 MET C 2 33 PHE N 2 33 PHE CA 2 33 PHE C -112.00 -52.00 -92.45 -97.35 -89.02 . . 0 "[ . 1 . 2]"
33 . 2 33 PHE N 2 33 PHE CA 2 33 PHE C 2 34 ALA N -54.00 6.00 -7.35 -0.87 -3.04 . . 0 "[ . 1 . 2]"
34 . 2 33 PHE C 2 34 ALA N 2 34 ALA CA 2 34 ALA C -170.00 -30.00 -61.76 -65.19 -66.38 . . 0 "[ . 1 . 2]"
35 . 2 34 ALA N 2 34 ALA CA 2 34 ALA C 2 35 LYS N 71.00 167.00 143.99 151.51 149.98 . . 0 "[ . 1 . 2]"
36 . 2 34 ALA C 2 35 LYS N 2 35 LYS CA 2 35 LYS C -87.00 -27.00 -57.76 -57.37 -57.84 . . 0 "[ . 1 . 2]"
37 . 2 35 LYS N 2 35 LYS CA 2 35 LYS C 2 36 LYS N -82.00 6.00 -23.76 -31.40 -16.36 . . 0 "[ . 1 . 2]"
38 . 2 35 LYS C 2 36 LYS N 2 36 LYS CA 2 36 LYS C -103.00 -43.00 -67.72 -71.44 -64.11 . . 0 "[ . 1 . 2]"
39 . 2 36 LYS N 2 36 LYS CA 2 36 LYS C 2 37 HIS N -47.00 23.00 -26.96 -28.23 -28.83 . . 0 "[ . 1 . 2]"
40 . 2 36 LYS C 2 37 HIS N 2 37 HIS CA 2 37 HIS C -141.00 -53.00 -97.68 -96.69 -97.10 . . 0 "[ . 1 . 2]"
41 . 2 37 HIS N 2 37 HIS CA 2 37 HIS C 2 38 ALA N -55.00 33.00 -6.48 -6.35 -6.67 . . 0 "[ . 1 . 2]"
42 . 2 37 HIS C 2 38 ALA N 2 38 ALA CA 2 38 ALA C -92.00 -22.00 -78.30 -81.79 -73.28 . . 0 "[ . 1 . 2]"
43 . 2 38 ALA N 2 38 ALA CA 2 38 ALA C 2 39 ALA N -81.00 -1.00 -6.85 -5.60 -6.32 0.61 8 0 "[ . 1 . 2]"
44 . 2 38 ALA C 2 39 ALA N 2 39 ALA CA 2 39 ALA C -104.00 -44.00 -66.77 -74.69 -61.59 . . 0 "[ . 1 . 2]"
45 . 2 39 ALA N 2 39 ALA CA 2 39 ALA C 2 40 TYR N -58.00 2.00 -33.96 -38.38 -29.63 . . 0 "[ . 1 . 2]"
46 . 2 41 ALA C 2 42 TRP N 2 42 TRP CA 2 42 TRP C -95.00 -27.00 -54.75 -56.26 -53.02 . . 0 "[ . 1 . 2]"
47 . 2 42 TRP N 2 42 TRP CA 2 42 TRP C 2 43 PRO N -72.00 8.00 -37.86 -37.32 -37.76 . . 0 "[ . 1 . 2]"
48 . 2 42 TRP C 2 43 PRO N 2 43 PRO CA 2 43 PRO C -88.00 -28.00 -65.23 -63.45 -64.33 . . 0 "[ . 1 . 2]"
49 . 2 43 PRO N 2 43 PRO CA 2 43 PRO C 2 44 PHE N -57.00 3.00 -23.43 -28.34 -17.44 . . 0 "[ . 1 . 2]"
50 . 2 43 PRO C 2 44 PHE N 2 44 PHE CA 2 44 PHE C -127.00 -39.00 -89.53 -89.23 -89.45 . . 0 "[ . 1 . 2]"
51 . 2 44 PHE N 2 44 PHE CA 2 44 PHE C 2 45 TYR N -45.00 23.00 -22.14 -20.74 -21.19 . . 0 "[ . 1 . 2]"
52 . 2 44 PHE C 2 45 TYR N 2 45 TYR CA 2 45 TYR C -126.00 -46.00 -58.72 -63.45 -55.12 . . 0 "[ . 1 . 2]"
53 . 2 45 TYR N 2 45 TYR CA 2 45 TYR C 2 46 LYS N -42.00 38.00 -42.97 -45.55 -32.79 3.55 5 0 "[ . 1 . 2]"
54 . 2 46 LYS C 2 47 PRO N 2 47 PRO CA 2 47 PRO C -96.00 -36.00 -47.89 -48.01 -49.27 . . 0 "[ . 1 . 2]"
55 . 2 47 PRO N 2 47 PRO CA 2 47 PRO C 2 48 VAL N 108.00 178.00 130.68 127.48 126.23 . . 0 "[ . 1 . 2]"
56 . 2 47 PRO C 2 48 VAL N 2 48 VAL CA 2 48 VAL C -166.00 -22.00 -52.82 -63.14 -36.41 . . 0 "[ . 1 . 2]"
57 . 2 48 VAL N 2 48 VAL CA 2 48 VAL C 2 49 ASP N 99.00 159.00 131.36 115.04 149.87 . . 0 "[ . 1 . 2]"
58 . 2 48 VAL C 2 49 ASP N 2 49 ASP CA 2 49 ASP C -149.00 -41.00 -79.77 -73.49 -74.21 . . 0 "[ . 1 . 2]"
59 . 2 49 ASP N 2 49 ASP CA 2 49 ASP C 2 50 VAL N 77.00 -143.00 96.45 85.94 103.91 . . 0 "[ . 1 . 2]"
60 . 2 49 ASP C 2 50 VAL N 2 50 VAL CA 2 50 VAL C -89.00 -29.00 -57.61 -52.67 -54.95 . . 0 "[ . 1 . 2]"
61 . 2 50 VAL N 2 50 VAL CA 2 50 VAL C 2 51 GLU N -67.00 -7.00 -32.62 -43.41 -26.36 . . 0 "[ . 1 . 2]"
62 . 2 50 VAL C 2 51 GLU N 2 51 GLU CA 2 51 GLU C -93.00 -33.00 -71.86 -66.39 -67.69 . . 0 "[ . 1 . 2]"
63 . 2 51 GLU N 2 51 GLU CA 2 51 GLU C 2 52 ALA N -72.00 -12.00 -23.16 -30.21 -37.35 0.25 19 0 "[ . 1 . 2]"
64 . 2 51 GLU C 2 52 ALA N 2 52 ALA CA 2 52 ALA C -96.00 -36.00 -72.72 -96.95 -55.93 0.95 17 0 "[ . 1 . 2]"
65 . 2 52 ALA N 2 52 ALA CA 2 52 ALA C 2 53 LEU N -75.00 5.00 -40.36 -44.07 -47.29 . . 0 "[ . 1 . 2]"
66 . 2 52 ALA C 2 53 LEU N 2 53 LEU CA 2 53 LEU C -126.00 -62.00 -94.99 -113.90 -72.12 . . 0 "[ . 1 . 2]"
67 . 2 53 LEU N 2 53 LEU CA 2 53 LEU C 2 54 GLY N -27.00 33.00 -20.58 -21.38 -23.52 1.87 12 0 "[ . 1 . 2]"
68 . 2 53 LEU C 2 54 GLY N 2 54 GLY CA 2 54 GLY C 31.00 91.00 80.04 67.33 88.75 . . 0 "[ . 1 . 2]"
69 . 2 54 GLY N 2 54 GLY CA 2 54 GLY C 2 55 LEU N 11.00 71.00 43.46 35.13 63.42 . . 0 "[ . 1 . 2]"
70 . 2 57 ASP C 2 58 TYR N 2 58 TYR CA 2 58 TYR C -94.00 -14.00 -87.96 -90.96 -92.31 0.36 1 0 "[ . 1 . 2]"
71 . 2 58 TYR N 2 58 TYR CA 2 58 TYR C 2 59 CYS N -67.00 -7.00 -47.38 -61.80 -35.79 . . 0 "[ . 1 . 2]"
72 . 2 58 TYR C 2 59 CYS N 2 59 CYS CA 2 59 CYS C -92.00 -32.00 -76.06 -78.34 -80.00 . . 0 "[ . 1 . 2]"
73 . 2 59 CYS N 2 59 CYS CA 2 59 CYS C 2 60 ASP N -58.00 2.00 -19.15 -26.83 -12.47 . . 0 "[ . 1 . 2]"
74 . 2 59 CYS C 2 60 ASP N 2 60 ASP CA 2 60 ASP C -109.00 -29.00 -69.35 -69.04 -70.26 . . 0 "[ . 1 . 2]"
75 . 2 60 ASP N 2 60 ASP CA 2 60 ASP C 2 61 ILE N -70.00 -10.00 -38.97 -47.14 -23.02 . . 0 "[ . 1 . 2]"
76 . 2 60 ASP C 2 61 ILE N 2 61 ILE CA 2 61 ILE C -112.00 -52.00 -99.16 -108.00 -110.84 0.21 17 0 "[ . 1 . 2]"
77 . 2 61 ILE N 2 61 ILE CA 2 61 ILE C 2 62 ILE N -66.00 6.00 -51.21 -59.69 -43.83 . . 0 "[ . 1 . 2]"
78 . 2 61 ILE C 2 62 ILE N 2 62 ILE CA 2 62 ILE C -139.00 -59.00 -79.99 -86.42 -72.69 . . 0 "[ . 1 . 2]"
79 . 2 62 ILE N 2 62 ILE CA 2 62 ILE C 2 63 LYS N 40.00 160.00 94.45 87.27 102.56 . . 0 "[ . 1 . 2]"
80 . 2 62 ILE C 2 63 LYS N 2 63 LYS CA 2 63 LYS C -120.00 -40.00 -90.09 -81.01 -83.11 . . 0 "[ . 1 . 2]"
81 . 2 63 LYS N 2 63 LYS CA 2 63 LYS C 2 64 HIS N -56.00 8.00 -24.06 -35.84 -15.16 . . 0 "[ . 1 . 2]"
82 . 2 63 LYS C 2 64 HIS N 2 64 HIS CA 2 64 HIS C -171.00 -75.00 -125.51 -122.63 -124.22 . . 0 "[ . 1 . 2]"
83 . 2 64 HIS N 2 64 HIS CA 2 64 HIS C 2 65 PRO N 48.00 -160.00 72.57 71.01 70.46 . . 0 "[ . 1 . 2]"
84 . 2 64 HIS C 2 65 PRO N 2 65 PRO CA 2 65 PRO C -95.00 -35.00 -71.01 -75.73 -67.47 . . 0 "[ . 1 . 2]"
85 . 2 65 PRO N 2 65 PRO CA 2 65 PRO C 2 66 MET N 121.00 -179.00 139.55 147.97 145.76 1.34 20 0 "[ . 1 . 2]"
86 . 2 65 PRO C 2 66 MET N 2 66 MET CA 2 66 MET C -142.00 -62.00 -138.43 -143.62 -118.52 1.62 9 0 "[ . 1 . 2]"
87 . 2 66 MET N 2 66 MET CA 2 66 MET C 2 67 ASP N 79.00 -177.00 157.71 154.80 153.18 . . 0 "[ . 1 . 2]"
88 . 2 66 MET C 2 67 ASP N 2 67 ASP CA 2 67 ASP C -151.00 -31.00 -147.61 -151.81 -141.03 0.81 11 0 "[ . 1 . 2]"
89 . 2 67 ASP N 2 67 ASP CA 2 67 ASP C 2 68 MET N 131.00 -169.00 153.28 152.35 152.02 . . 0 "[ . 1 . 2]"
90 . 2 67 ASP C 2 68 MET N 2 68 MET CA 2 68 MET C -103.00 -31.00 -68.74 -76.59 -61.55 . . 0 "[ . 1 . 2]"
91 . 2 68 MET N 2 68 MET CA 2 68 MET C 2 69 SER N -73.00 -9.00 -23.84 -29.40 -18.00 . . 0 "[ . 1 . 2]"
92 . 2 68 MET C 2 69 SER N 2 69 SER CA 2 69 SER C -96.00 -36.00 -70.58 -69.69 -70.04 . . 0 "[ . 1 . 2]"
93 . 2 69 SER N 2 69 SER CA 2 69 SER C 2 70 THR N -66.00 -6.00 -53.85 -54.80 -55.63 . . 0 "[ . 1 . 2]"
94 . 2 69 SER C 2 70 THR N 2 70 THR CA 2 70 THR C -96.00 -36.00 -61.28 -67.56 -58.02 . . 0 "[ . 1 . 2]"
95 . 2 70 THR N 2 70 THR CA 2 70 THR C 2 71 ILE N -69.00 -9.00 -44.24 -43.38 -43.96 . . 0 "[ . 1 . 2]"
96 . 2 70 THR C 2 71 ILE N 2 71 ILE CA 2 71 ILE C -95.00 -35.00 -57.96 -60.36 -55.85 . . 0 "[ . 1 . 2]"
97 . 2 71 ILE N 2 71 ILE CA 2 71 ILE C 2 72 LYS N -71.00 -11.00 -41.13 -41.69 -42.21 . . 0 "[ . 1 . 2]"
98 . 2 71 ILE C 2 72 LYS N 2 72 LYS CA 2 72 LYS C -93.00 -33.00 -66.44 -70.49 -62.26 . . 0 "[ . 1 . 2]"
99 . 2 72 LYS N 2 72 LYS CA 2 72 LYS C 2 73 SER N -72.00 -12.00 -39.52 -40.76 -37.89 . . 0 "[ . 1 . 2]"
100 . 2 72 LYS C 2 73 SER N 2 73 SER CA 2 73 SER C -94.00 -34.00 -53.37 -52.47 -53.00 . . 0 "[ . 1 . 2]"
101 . 2 73 SER N 2 73 SER CA 2 73 SER C 2 74 LYS N -70.00 -10.00 -51.01 -53.38 -46.24 . . 0 "[ . 1 . 2]"
102 . 2 73 SER C 2 74 LYS N 2 74 LYS CA 2 74 LYS C -93.00 -33.00 -64.33 -70.13 -61.33 . . 0 "[ . 1 . 2]"
103 . 2 74 LYS N 2 74 LYS CA 2 74 LYS C 2 75 LEU N -72.00 -12.00 -34.74 -33.12 -33.60 . . 0 "[ . 1 . 2]"
104 . 2 74 LYS C 2 75 LEU N 2 75 LEU CA 2 75 LEU C -95.00 -35.00 -65.70 -68.33 -60.08 . . 0 "[ . 1 . 2]"
105 . 2 75 LEU N 2 75 LEU CA 2 75 LEU C 2 76 GLU N -69.00 -9.00 -43.45 -46.86 -41.92 . . 0 "[ . 1 . 2]"
106 . 2 75 LEU C 2 76 GLU N 2 76 GLU CA 2 76 GLU C -94.00 -34.00 -66.33 -72.48 -60.84 . . 0 "[ . 1 . 2]"
107 . 2 76 GLU N 2 76 GLU CA 2 76 GLU C 2 77 ALA N -56.00 4.00 -27.00 -33.50 -19.23 . . 0 "[ . 1 . 2]"
108 . 2 76 GLU C 2 77 ALA N 2 77 ALA CA 2 77 ALA C -115.00 -55.00 -81.72 -79.83 -80.13 . . 0 "[ . 1 . 2]"
109 . 2 77 ALA N 2 77 ALA CA 2 77 ALA C 2 78 ARG N -29.00 31.00 -15.10 -10.22 -13.79 . . 0 "[ . 1 . 2]"
110 . 2 77 ALA C 2 78 ARG N 2 78 ARG CA 2 78 ARG C 29.00 89.00 65.84 62.13 69.78 . . 0 "[ . 1 . 2]"
111 . 2 78 ARG N 2 78 ARG CA 2 78 ARG C 2 79 GLU N 5.00 65.00 36.11 28.71 41.06 . . 0 "[ . 1 . 2]"
112 . 2 78 ARG C 2 79 GLU N 2 79 GLU CA 2 79 GLU C -127.00 -55.00 -81.19 -74.99 -77.82 . . 0 "[ . 1 . 2]"
113 . 2 79 GLU N 2 79 GLU CA 2 79 GLU C 2 80 TYR N -65.00 31.00 -6.43 -12.74 5.96 . . 0 "[ . 1 . 2]"
114 . 2 80 TYR C 2 81 ARG N 2 81 ARG CA 2 81 ARG C -97.00 -37.00 -90.02 -97.17 -79.46 0.17 12 0 "[ . 1 . 2]"
115 . 2 81 ARG N 2 81 ARG CA 2 81 ARG C 2 82 ASP N -64.00 -4.00 -24.99 -36.89 -15.66 . . 0 "[ . 1 . 2]"
116 . 2 82 ASP C 2 83 ALA N 2 83 ALA CA 2 83 ALA C -129.00 -25.00 -69.04 -73.59 -62.94 . . 0 "[ . 1 . 2]"
117 . 2 83 ALA N 2 83 ALA CA 2 83 ALA C 2 84 GLN N -66.00 -6.00 -32.95 -30.49 -32.80 . . 0 "[ . 1 . 2]"
118 . 2 83 ALA C 2 84 GLN N 2 84 GLN CA 2 84 GLN C -95.00 -35.00 -60.82 -65.72 -53.91 . . 0 "[ . 1 . 2]"
119 . 2 84 GLN N 2 84 GLN CA 2 84 GLN C 2 85 GLU N -68.00 -8.00 -37.79 -42.46 -26.48 . . 0 "[ . 1 . 2]"
120 . 2 84 GLN C 2 85 GLU N 2 85 GLU CA 2 85 GLU C -95.00 -35.00 -61.85 -62.68 -64.27 . . 0 "[ . 1 . 2]"
121 . 2 85 GLU N 2 85 GLU CA 2 85 GLU C 2 86 PHE N -75.00 -15.00 -49.57 -52.88 -43.24 . . 0 "[ . 1 . 2]"
122 . 2 85 GLU C 2 86 PHE N 2 86 PHE CA 2 86 PHE C -91.00 -31.00 -52.53 -52.13 -52.56 . . 0 "[ . 1 . 2]"
123 . 2 86 PHE N 2 86 PHE CA 2 86 PHE C 2 87 GLY N -70.00 -10.00 -51.77 -58.23 -45.20 . . 0 "[ . 1 . 2]"
124 . 2 86 PHE C 2 87 GLY N 2 87 GLY CA 2 87 GLY C -92.00 -32.00 -60.67 -62.16 -63.91 . . 0 "[ . 1 . 2]"
125 . 2 87 GLY N 2 87 GLY CA 2 87 GLY C 2 88 ALA N -80.00 12.00 -32.21 -28.95 -30.31 . . 0 "[ . 1 . 2]"
126 . 2 87 GLY C 2 88 ALA N 2 88 ALA CA 2 88 ALA C -94.00 -34.00 -63.92 -69.90 -58.42 . . 0 "[ . 1 . 2]"
127 . 2 88 ALA N 2 88 ALA CA 2 88 ALA C 2 89 ASP N -67.00 -7.00 -53.73 -61.29 -44.41 . . 0 "[ . 1 . 2]"
128 . 2 88 ALA C 2 89 ASP N 2 89 ASP CA 2 89 ASP C -94.00 -34.00 -66.90 -62.31 -63.87 . . 0 "[ . 1 . 2]"
129 . 2 89 ASP N 2 89 ASP CA 2 89 ASP C 2 90 VAL N -74.00 -14.00 -29.74 -28.20 -28.20 . . 0 "[ . 1 . 2]"
130 . 2 89 ASP C 2 90 VAL N 2 90 VAL CA 2 90 VAL C -95.00 -35.00 -65.11 -64.86 -65.53 . . 0 "[ . 1 . 2]"
131 . 2 90 VAL N 2 90 VAL CA 2 90 VAL C 2 91 ARG N -77.00 -17.00 -38.81 -41.44 -35.22 . . 0 "[ . 1 . 2]"
132 . 2 90 VAL C 2 91 ARG N 2 91 ARG CA 2 91 ARG C -93.00 -33.00 -75.68 -80.87 -72.73 . . 0 "[ . 1 . 2]"
133 . 2 91 ARG N 2 91 ARG CA 2 91 ARG C 2 92 LEU N -71.00 -11.00 -21.04 -26.67 -15.62 . . 0 "[ . 1 . 2]"
134 . 2 91 ARG C 2 92 LEU N 2 92 LEU CA 2 92 LEU C -97.00 -37.00 -59.00 -67.40 -51.72 . . 0 "[ . 1 . 2]"
135 . 2 92 LEU N 2 92 LEU CA 2 92 LEU C 2 93 MET N -72.00 -12.00 -60.10 -58.49 -59.47 . . 0 "[ . 1 . 2]"
136 . 2 92 LEU C 2 93 MET N 2 93 MET CA 2 93 MET C -90.00 -30.00 -67.41 -77.50 -60.17 . . 0 "[ . 1 . 2]"
137 . 2 93 MET N 2 93 MET CA 2 93 MET C 2 94 PHE N -75.00 -15.00 -33.56 -38.35 -21.89 . . 0 "[ . 1 . 2]"
138 . 2 93 MET C 2 94 PHE N 2 94 PHE CA 2 94 PHE C -93.00 -33.00 -65.10 -63.23 -63.84 . . 0 "[ . 1 . 2]"
139 . 2 94 PHE N 2 94 PHE CA 2 94 PHE C 2 95 SER N -70.00 -10.00 -35.99 -39.18 -40.38 . . 0 "[ . 1 . 2]"
140 . 2 94 PHE C 2 95 SER N 2 95 SER CA 2 95 SER C -95.00 -35.00 -78.64 -85.77 -70.36 . . 0 "[ . 1 . 2]"
141 . 2 95 SER N 2 95 SER CA 2 95 SER C 2 96 ASN N -68.00 -8.00 -19.47 -14.68 -15.27 . . 0 "[ . 1 . 2]"
142 . 2 95 SER C 2 96 ASN N 2 96 ASN CA 2 96 ASN C -95.00 -35.00 -59.51 -66.42 -53.44 . . 0 "[ . 1 . 2]"
143 . 2 96 ASN N 2 96 ASN CA 2 96 ASN C 2 97 CYS N -70.00 -10.00 -50.81 -57.81 -47.02 . . 0 "[ . 1 . 2]"
144 . 2 96 ASN C 2 97 CYS N 2 97 CYS CA 2 97 CYS C -94.00 -34.00 -67.87 -64.27 -66.70 . . 0 "[ . 1 . 2]"
145 . 2 97 CYS N 2 97 CYS CA 2 97 CYS C 2 98 TYR N -75.00 -15.00 -31.94 -28.76 -28.97 . . 0 "[ . 1 . 2]"
146 . 2 97 CYS C 2 98 TYR N 2 98 TYR CA 2 98 TYR C -95.00 -35.00 -64.37 -64.08 -64.78 . . 0 "[ . 1 . 2]"
147 . 2 98 TYR N 2 98 TYR CA 2 98 TYR C 2 99 LYS N -68.00 4.00 -41.35 -52.22 -34.41 . . 0 "[ . 1 . 2]"
148 . 2 98 TYR C 2 99 LYS N 2 99 LYS CA 2 99 LYS C -99.00 -39.00 -88.29 -80.57 -81.81 . . 0 "[ . 1 . 2]"
149 . 2 99 LYS N 2 99 LYS CA 2 99 LYS C 2 100 TYR N -66.00 -6.00 -24.46 -24.58 -29.09 . . 0 "[ . 1 . 2]"
150 . 2 99 LYS C 2 100 TYR N 2 100 TYR CA 2 100 TYR C -104.00 -40.00 -97.63 -104.45 -83.65 0.45 17 0 "[ . 1 . 2]"
151 . 2 100 TYR N 2 100 TYR CA 2 100 TYR C 2 101 ASN N -63.00 -3.00 -13.57 -4.67 -9.17 0.51 10 0 "[ . 1 . 2]"
152 . 2 101 ASN C 2 102 PRO N 2 102 PRO CA 2 102 PRO C -111.00 -27.00 -65.77 -75.79 -54.03 . . 0 "[ . 1 . 2]"
153 . 2 102 PRO N 2 102 PRO CA 2 102 PRO C 2 103 PRO N 80.00 -168.00 146.54 138.86 160.75 . . 0 "[ . 1 . 2]"
154 . 2 102 PRO C 2 103 PRO N 2 103 PRO CA 2 103 PRO C -87.00 -27.00 -64.96 -63.48 -63.66 . . 0 "[ . 1 . 2]"
155 . 2 103 PRO N 2 103 PRO CA 2 103 PRO C 2 104 ASP N -56.00 4.00 -6.62 -6.65 -7.44 . . 0 "[ . 1 . 2]"
156 . 2 103 PRO C 2 104 ASP N 2 104 ASP CA 2 104 ASP C -119.00 -59.00 -99.91 -98.22 -98.90 . . 0 "[ . 1 . 2]"
157 . 2 104 ASP N 2 104 ASP CA 2 104 ASP C 2 105 HIS N -33.00 27.00 6.30 3.69 3.22 . . 0 "[ . 1 . 2]"
158 . 2 106 GLU C 2 107 VAL N 2 107 VAL CA 2 107 VAL C -96.00 -36.00 -56.99 -60.09 -54.06 . . 0 "[ . 1 . 2]"
159 . 2 107 VAL N 2 107 VAL CA 2 107 VAL C 2 108 VAL N -72.00 -12.00 -37.52 -37.58 -37.98 . . 0 "[ . 1 . 2]"
160 . 2 107 VAL C 2 108 VAL N 2 108 VAL CA 2 108 VAL C -92.00 -32.00 -72.12 -73.11 -73.44 . . 0 "[ . 1 . 2]"
161 . 2 108 VAL N 2 108 VAL CA 2 108 VAL C 2 109 ALA N -72.00 -12.00 -30.85 -33.72 -25.96 . . 0 "[ . 1 . 2]"
162 . 2 108 VAL C 2 109 ALA N 2 109 ALA CA 2 109 ALA C -91.00 -31.00 -71.90 -70.96 -71.97 . . 0 "[ . 1 . 2]"
163 . 2 109 ALA N 2 109 ALA CA 2 109 ALA C 2 110 MET N -70.00 -10.00 -39.19 -43.25 -35.32 . . 0 "[ . 1 . 2]"
164 . 2 109 ALA C 2 110 MET N 2 110 MET CA 2 110 MET C -93.00 -33.00 -70.01 -69.41 -70.09 . . 0 "[ . 1 . 2]"
165 . 2 110 MET N 2 110 MET CA 2 110 MET C 2 111 ALA N -75.00 -15.00 -33.23 -37.28 -40.39 . . 0 "[ . 1 . 2]"
166 . 2 110 MET C 2 111 ALA N 2 111 ALA CA 2 111 ALA C -92.00 -32.00 -70.82 -77.22 -65.64 . . 0 "[ . 1 . 2]"
167 . 2 111 ALA N 2 111 ALA CA 2 111 ALA C 2 112 ARG N -73.00 -13.00 -28.33 -29.54 -30.39 . . 0 "[ . 1 . 2]"
168 . 2 111 ALA C 2 112 ARG N 2 112 ARG CA 2 112 ARG C -92.00 -32.00 -56.86 -63.09 -52.69 . . 0 "[ . 1 . 2]"
169 . 2 112 ARG N 2 112 ARG CA 2 112 ARG C 2 113 LYS N -74.00 -14.00 -47.75 -57.41 -42.26 . . 0 "[ . 1 . 2]"
170 . 2 112 ARG C 2 113 LYS N 2 113 LYS CA 2 113 LYS C -95.00 -35.00 -77.66 -76.74 -78.01 . . 0 "[ . 1 . 2]"
171 . 2 113 LYS N 2 113 LYS CA 2 113 LYS C 2 114 LEU N -65.00 -5.00 -29.52 -37.13 -18.67 . . 0 "[ . 1 . 2]"
172 . 2 113 LYS C 2 114 LEU N 2 114 LEU CA 2 114 LEU C -94.00 -34.00 -64.87 -72.17 -60.15 . . 0 "[ . 1 . 2]"
173 . 2 114 LEU N 2 114 LEU CA 2 114 LEU C 2 115 GLN N -72.00 -12.00 -44.76 -48.48 -39.59 . . 0 "[ . 1 . 2]"
174 . 2 114 LEU C 2 115 GLN N 2 115 GLN CA 2 115 GLN C -93.00 -33.00 -58.10 -63.14 -50.92 . . 0 "[ . 1 . 2]"
175 . 2 115 GLN N 2 115 GLN CA 2 115 GLN C 2 116 ASP N -70.00 -10.00 -31.02 -32.32 -33.26 . . 0 "[ . 1 . 2]"
176 . 2 115 GLN C 2 116 ASP N 2 116 ASP CA 2 116 ASP C -95.00 -35.00 -67.65 -75.66 -59.90 . . 0 "[ . 1 . 2]"
177 . 2 116 ASP N 2 116 ASP CA 2 116 ASP C 2 117 VAL N -71.00 -11.00 -59.45 -60.28 -61.28 . . 0 "[ . 1 . 2]"
178 . 2 116 ASP C 2 117 VAL N 2 117 VAL CA 2 117 VAL C -94.00 -34.00 -59.09 -60.97 -55.91 . . 0 "[ . 1 . 2]"
179 . 2 117 VAL N 2 117 VAL CA 2 117 VAL C 2 118 PHE N -75.00 -15.00 -42.76 -45.64 -40.00 . . 0 "[ . 1 . 2]"
180 . 2 117 VAL C 2 118 PHE N 2 118 PHE CA 2 118 PHE C -90.00 -30.00 -58.41 -56.82 -58.03 . . 0 "[ . 1 . 2]"
181 . 2 118 PHE N 2 118 PHE CA 2 118 PHE C 2 119 GLU N -73.00 -13.00 -42.10 -43.78 -46.95 . . 0 "[ . 1 . 2]"
182 . 2 118 PHE C 2 119 GLU N 2 119 GLU CA 2 119 GLU C -95.00 -35.00 -57.08 -58.80 -59.07 . . 0 "[ . 1 . 2]"
183 . 2 119 GLU N 2 119 GLU CA 2 119 GLU C 2 120 MET N -72.00 -12.00 -52.32 -60.60 -43.36 . . 0 "[ . 1 . 2]"
184 . 2 119 GLU C 2 120 MET N 2 120 MET CA 2 120 MET C -93.00 -33.00 -66.74 -68.17 -68.93 . . 0 "[ . 1 . 2]"
185 . 2 120 MET N 2 120 MET CA 2 120 MET C 2 121 ARG N -68.00 -8.00 -36.29 -40.69 -41.34 . . 0 "[ . 1 . 2]"
186 . 2 120 MET C 2 121 ARG N 2 121 ARG CA 2 121 ARG C -100.00 -40.00 -64.03 -73.37 -55.96 . . 0 "[ . 1 . 2]"
187 . 2 121 ARG N 2 121 ARG CA 2 121 ARG C 2 122 PHE N -68.00 -8.00 -38.47 -36.80 -37.23 . . 0 "[ . 1 . 2]"
188 . 2 121 ARG C 2 122 PHE N 2 122 PHE CA 2 122 PHE C -92.00 -32.00 -85.96 -93.03 -77.87 1.03 9 0 "[ . 1 . 2]"
189 . 2 122 PHE N 2 122 PHE CA 2 122 PHE C 2 123 ALA N -68.00 -8.00 -21.03 -28.58 -14.81 . . 0 "[ . 1 . 2]"
190 . 2 122 PHE C 2 123 ALA N 2 123 ALA CA 2 123 ALA C -115.00 -55.00 -65.68 -69.95 -72.09 . . 0 "[ . 1 . 2]"
191 . 2 123 ALA N 2 123 ALA CA 2 123 ALA C 2 124 LYS N -31.00 29.00 -24.87 -34.27 -11.20 3.27 9 0 "[ . 1 . 2]"
192 . 2 123 ALA C 2 124 LYS N 2 124 LYS CA 2 124 LYS C -157.00 27.00 -74.37 -81.47 -83.97 . . 0 "[ . 1 . 2]"
193 . 2 124 LYS N 2 124 LYS CA 2 124 LYS C 2 125 MET N -90.00 38.00 -36.93 41.03 40.75 4.37 13 0 "[ . 1 . 2]"
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